REMARK SOURCE hebe.pdb HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 08-MAY-06 2GX8 COMPND NIF3-RELATED PROTEIN; COMPND 3 CHAIN: A, B, C; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CEREUS; SOURCE 3 ORGANISM_TAXID: 226900; SOURCE 4 STRAIN: ATCC 14579; SOURCE 5 GENE: AAP11199; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21-DE3; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PMCSG7 AUTHOR G.MINASOV,J.S.BRUNZELLE,L.SHUVALOVA,I.I.VORONTSOV,F.R.COLLART, AUTHOR 2 A.JOACHIMIAK,W.F.ANDERSON,MIDWEST CENTER FOR STRUCTURAL GENOMICS AUTHOR 3 (MCSG) HET ZN A 374 1 HET ZN A 375 1 HET EPE A 376 15 HET EPE A 377 15 HET TRS A 378 8 HET ZN B 374 1 HET ZN B 375 1 HET EPE B 376 15 HET ZN C 374 1 HET ZN C 375 1 HET EPE C 376 15 HET EPE C 377 15 SITE 1 AC1 7 HIS A 69 HIS A 103 HIS A 333 GLU A 336 SITE 1 AC2 5 HIS A 68 ASP A 107 GLU A 336 ZN A 374 SITE 1 AC3 6 ASN A 74 LYS A 83 TYR A 85 ASP A 320 SITE 1 AC4 7 PHE A 143 GLU A 201 HOH A 550 LYS B 139 SITE 1 AC5 4 ASN A 238 LYS A 239 GLN C 213 TYR C 231 SITE 1 AC6 5 HIS B 69 HIS B 333 GLU B 336 ZN B 375 SITE 1 AC7 4 HIS B 68 ASP B 107 GLU B 336 ZN B 374 SITE 1 AC8 8 ASN B 74 HOH B 394 HOH B 521 HOH B 551 SITE 1 AC9 5 HIS C 69 HIS C 333 GLU C 336 ZN C 375 SITE 1 BC1 4 HIS C 68 ASP C 107 GLU C 336 ZN C 374 SITE 1 BC2 7 ASP B 320 ASN C 74 LYS C 83 TYR C 85 SITE 1 BC3 12 LYS A 139 CYS A 170 THR A 171 GLU A 205 >ILE.A 4 36.88 12.20 0.59 37.53 13.45 0.63 37.21 12.82 0.61 3 0 31.90 -999 ? ZN ZN A 375 >PRO.A 5 36.17 7.76 3.87 34.85 9.04 2.59 35.51 8.40 3.23 3 0 27.66 -999 ? ZN ZN A 375 >ASN~A 6 30.24 8.98 5.52 28.99 10.31 4.54 29.62 9.65 5.03 2 0 28.48 -999 ? ZN ZN A 375 >GLY~A 7 31.92 8.80 9.28 31.38 8.48 8.65 31.65 8.64 8.97 1 0 22.99 -999 ? ZN ZN A 375 >HIS~A 8 26.75 7.68 8.85 25.49 8.72 10.18 26.12 8.20 9.51 3 0 24.55 -999 ? ZN ZN A 375 >GLU~A 9 31.54 5.84 4.26 31.09 6.26 2.19 31.31 6.05 3.23 2 0 28.50 -999 ? ZN ZN A 375 >ILE~A 10 34.90 5.31 8.90 36.10 6.07 8.92 35.50 5.69 8.91 3 0 21.40 -999 ? ZN ZN A 375 >ILE~A 11 31.14 4.35 12.43 31.07 5.00 13.48 31.11 4.68 12.95 3 0 18.28 -999 ? ZN ZN A 375 >SER~A 12 29.97 0.68 9.55 29.00 -0.35 7.61 29.48 0.16 8.58 2 0 22.68 -999 ? ZN ZN A 375 >LEU~A 13 34.43 -0.50 8.07 34.57 -0.43 5.89 34.50 -0.46 6.98 3 0 21.91 -999 ? ZN ZN A 375 >PHE~A 14 34.51 0.34 14.77 34.92 -0.05 17.51 34.72 0.15 16.14 3 0 13.00 -999 ? ZN ZN A 375 >GLU~A 15 29.50 -0.46 14.62 27.65 0.59 14.66 28.57 0.07 14.64 2 0 17.23 -999 ? ZN ZN A 375 >SER~A 16 31.20 -5.28 11.30 32.92 -4.97 9.64 32.06 -5.13 10.47 2 0 19.64 -999 ? ZN ZN A 375 >MET~A 17 34.23 -6.11 13.54 37.82 -4.55 12.22 36.02 -5.33 12.88 2 0 16.55 -999 ? ZN ZN A 375 >TYR~A 18 34.99 -4.02 17.62 37.68 -4.71 17.89 36.33 -4.37 17.76 3 0 11.08 -999 ? ZN ZN A 375 >PRO~A 19 29.44 -7.44 15.80 29.61 -5.36 16.66 29.52 -6.40 16.23 3 0 15.14 -999 ? ZN ZN A 375 >LYS~A 20 26.66 -3.22 19.04 24.73 2.41 18.30 25.69 -0.40 18.67 2 0 16.95 -999 ? ZN ZN A 375 >HIS~A 21 24.93 -8.05 18.54 26.13 -9.04 17.11 25.53 -8.54 17.82 3 0 17.08 -999 ? ZN ZN A 375 >LEU~A 22 29.35 -7.69 21.29 29.92 -9.34 19.97 29.64 -8.51 20.63 3 0 12.61 -999 ? ZN ZN A 375 >ALA~A 23 27.83 -4.85 24.60 27.58 -3.36 24.26 27.71 -4.11 24.43 2 0 10.67 -999 ? ZN ZN A 375 >MET.A 24 26.57 -5.51 28.15 29.00 -7.95 29.25 27.78 -6.73 28.70 2 0 9.96 -999 ? ZN ZN A 375 >GLU.A 25 21.52 -4.56 31.66 21.12 -5.25 33.61 21.32 -4.91 32.64 2 0 17.13 -999 ? ZN ZN A 375 >GLY.A 26 23.61 -0.70 30.49 24.31 -1.07 30.25 23.96 -0.89 30.37 1 0 13.89 -999 ? ZN ZN A 375 >ASP.A 27 27.49 -0.90 27.62 29.53 -0.28 27.44 28.51 -0.59 27.53 2 0 8.12 -999 ? ZN ZN A 375 >LYS.A 28 26.87 3.56 26.76 22.81 3.70 30.35 24.84 3.63 28.56 2 0 12.48 -999 ? C7 EPE A 376 >ILE.A 29 28.23 1.63 22.78 28.01 0.24 22.95 28.12 0.93 22.87 3 0 11.32 -999 ? ZN ZN A 375 >GLY^A 30 27.68 4.60 19.76 28.15 4.96 20.33 27.92 4.78 20.04 1 0 14.83 -999 ? ZN ZN A 375 >LEU^A 31 27.19 8.78 17.42 27.74 10.60 16.34 27.47 9.69 16.88 3 0 18.61 -999 ? C3 EPE A 376 >GLN^A 32 28.50 8.80 23.61 29.48 8.19 25.39 28.99 8.49 24.50 2 0 10.38 -999 ? C3 EPE A 376 >ILE^A 33 30.07 14.56 21.17 30.58 15.56 22.09 30.32 15.06 21.63 3 0 13.57 -999 ? C2 EPE A 376 >GLY.A 34 28.75 15.24 16.90 28.17 14.75 17.10 28.46 15.00 17.00 1 0 18.52 -999 ? C3 EPE A 376 >ALA.A 35 27.53 14.02 13.52 27.01 15.14 12.68 27.27 14.58 13.10 2 0 22.94 -999 ? C3 EPE A 376 >LEU.A 36 28.56 9.85 11.56 29.67 8.82 13.07 29.11 9.33 12.31 3 0 21.70 -999 ? ZN ZN A 375 >ASN.A 37 25.93 12.74 7.54 24.88 14.13 8.79 25.40 13.44 8.17 2 0 27.11 -999 ? C3 EPE A 376 >LYS.A 38 30.55 14.65 7.31 33.02 15.96 12.69 31.79 15.31 10.00 2 0 22.26 -999 ? C2 EPE A 376 >PRO.A 39 32.83 15.79 3.80 32.98 14.24 5.39 32.90 15.01 4.60 3 0 30.01 -999 ? ZN ZN A 375 >VAL.A 40 36.27 12.20 7.20 35.72 11.24 9.08 35.99 11.72 8.14 3 0 24.93 -999 ? ZN ZN A 375 >ARG.A 41 42.11 12.31 4.12 44.66 13.27 2.71 43.39 12.79 3.41 2 0 31.19 -999 ? ZN ZN A 375 >HIS^A 42 43.48 12.60 9.22 44.86 13.19 7.76 44.17 12.89 8.49 3 0 26.23 -999 ? ZN ZN A 375 >VAL^A 43 40.37 8.91 12.63 38.72 7.45 12.36 39.54 8.18 12.49 3 0 19.44 -999 ? ZN ZN A 375 >LEU^A 44 42.07 10.13 16.85 43.67 10.58 18.27 42.87 10.36 17.56 3 0 17.64 -999 ? ZN ZN A 374 >ILE^A 45 42.02 4.24 17.97 40.78 3.59 17.51 41.40 3.92 17.74 3 0 13.26 -999 ? ZN ZN A 375 >ALA^A 46 41.72 6.36 22.02 41.31 7.82 22.33 41.51 7.09 22.18 2 0 12.15 -999 ? ZN ZN A 374 >LEU.A 47 42.30 4.26 26.28 42.13 2.67 27.73 42.22 3.47 27.01 3 0 6.92 -999 ? ZN ZN A 374 >ASP.A 48 40.70 8.14 28.73 41.06 6.40 29.84 40.88 7.27 29.29 2 0 7.40 -999 ? ZN ZN A 374 >VAL.A 49 39.00 11.09 25.70 37.42 11.42 24.19 38.21 11.26 24.95 3 0 11.06 -999 ? C3 EPE A 376 >THR~A 50 41.05 13.52 27.79 42.84 12.41 28.27 41.95 12.97 28.03 2 0 11.68 -999 ? C2 EPE A 376 >GLU~A 51 41.17 19.74 26.83 40.87 21.56 28.00 41.02 20.65 27.41 2 0 11.89 -999 ? O2S EPE A 376 >GLU~A 52 46.63 16.37 27.65 45.50 16.12 29.45 46.07 16.24 28.55 2 0 13.77 -999 ? C2 EPE A 376 >VAL~A 53 43.61 13.48 23.36 42.93 11.40 23.59 43.27 12.44 23.47 3 0 15.17 -999 ? C2 EPE A 376 >VAL~A 54 41.18 16.00 21.86 39.21 16.72 22.41 40.20 16.36 22.14 3 0 14.82 -999 ? C2 EPE A 376 >ASP~A 55 45.10 18.98 22.18 44.20 20.57 23.21 44.65 19.78 22.69 2 0 17.36 -999 ? O2S EPE A 376 >GLU~A 56 47.24 13.21 19.42 47.19 11.28 20.29 47.21 12.25 19.86 2 0 18.18 -999 ? ZN ZN A 374 >ALA~A 57 42.98 14.90 17.25 41.58 14.60 17.74 42.28 14.75 17.49 2 0 19.05 -999 ? C2 EPE A 376 >ILE~A 58 42.70 19.78 17.31 42.05 20.88 17.88 42.38 20.33 17.60 3 0 20.76 -999 ? O2S EPE A 376 >GLN~A 59 48.94 18.99 16.54 48.85 20.92 17.49 48.89 19.96 17.01 2 0 24.61 -999 ? C2 EPE A 376 >LEU~A 60 45.69 14.02 13.98 46.89 12.37 14.74 46.29 13.19 14.36 3 0 22.83 -999 ? ZN ZN A 374 >GLY~A 61 43.13 16.86 11.60 43.11 16.14 12.09 43.12 16.50 11.85 1 0 25.49 -999 ? C2 EPE A 376 >ALA.A 62 41.03 13.97 12.85 41.56 12.98 13.85 41.30 13.47 13.35 2 0 21.75 -999 ? ZN ZN A 374 >ASN.A 63 36.61 15.52 12.09 36.23 14.54 10.24 36.42 15.03 11.16 2 0 24.76 -999 ? C2 EPE A 376 >VAL^A 64 36.29 11.32 14.67 34.97 9.92 13.64 35.63 10.62 14.15 3 0 19.56 -999 ? ZN ZN A 375 >ILE^A 65 37.88 10.64 19.11 38.92 11.23 20.01 38.40 10.94 19.56 3 0 15.75 -999 ? ZN ZN A 374 >ILE^A 66 36.87 5.10 17.60 36.37 4.05 16.75 36.62 4.58 17.17 3 0 13.44 -999 ? ZN ZN A 375 >ALA^A 67 37.22 5.65 22.28 37.04 6.85 23.17 37.13 6.25 22.72 2 0 10.32 -999 ? ZN ZN A 374 >HIS.A 68 37.80 0.44 25.56 37.02 -1.29 26.44 37.41 -0.43 26.00 3 0 -3.31 -999 ? ZN ZN A 375s >HIS.A 69 37.42 3.90 29.26 38.47 2.36 30.22 37.94 3.13 29.74 3 0 -3.40 -999 ? ZN ZN A 374s >PRO.A 70 31.53 4.52 27.72 33.08 5.98 27.10 32.31 5.25 27.41 3 0 8.28 -999 ? ZN ZN A 374 >LEU.A 71 33.41 11.27 26.19 34.36 13.17 26.70 33.88 12.22 26.44 3 0 8.24 -999 ? C3 EPE A 376 >ILE.A 72 28.43 11.16 27.54 27.37 12.33 27.31 27.90 11.75 27.43 3 0 8.69 -999 ? C3 EPE A 376 >PHE.A 73 29.46 5.70 32.24 28.53 3.17 33.10 29.00 4.44 32.67 3 0 6.87 -999 ? C7 EPE A 376 >ASN.A 74 26.98 10.15 34.57 28.23 8.78 35.68 27.60 9.47 35.13 2 0 -4.28 -999 ? C7 EPE A 376s >PRO.A 75 22.26 10.21 32.30 24.27 11.02 31.70 23.27 10.62 32.00 3 0 9.95 -999 ? C3 EPE A 376 >LEU.A 76 25.42 15.99 30.19 27.44 15.46 29.53 26.43 15.72 29.86 3 0 8.17 -999 ? C10 EPE A 376 >LYS.A 77 22.49 17.50 33.52 21.76 14.55 38.95 22.13 16.02 36.23 2 0 10.13 -999 ? O1S EPE A 376 >ALA.A 78 24.61 20.40 32.35 24.83 21.26 33.60 24.72 20.83 32.97 2 0 8.04 -999 ? O2S EPE A 376 >ILE.A 79 27.55 21.35 28.88 27.51 20.81 27.61 27.53 21.08 28.24 3 0 9.03 -999 ? O2S EPE A 376 >HIS.A 80 28.52 23.28 34.79 26.69 23.10 35.81 27.60 23.19 35.30 3 0 6.41 -999 ? O2S EPE A 376 >THR.A 81 32.45 25.22 30.56 31.45 26.31 28.96 31.95 25.77 29.76 2 0 10.12 -999 ? O2S EPE A 376 >ASP.A 82 34.38 27.71 34.24 32.73 27.59 35.53 33.56 27.65 34.89 2 0 8.88 -999 ? O2S EPE A 376 >LYS~A 83 35.02 22.85 34.66 32.09 22.94 39.08 33.56 22.89 36.87 2 0 -5.13 -999 ? O1S EPE A 376s >ALA~A 84 37.62 20.48 33.19 38.69 19.72 33.98 38.15 20.10 33.58 2 0 6.56 -999 ? O3S EPE A 376 >TYR~A 85 33.18 16.26 32.13 31.71 14.36 30.75 32.44 15.31 31.44 3 0 -4.05 -999 ? C2 EPE A 376s >GLY~A 86 32.79 20.63 30.29 33.61 20.50 30.22 33.20 20.57 30.26 1 0 5.69 -999 ? O2S EPE A 376 >LYS~A 87 35.91 21.93 28.51 38.15 26.57 30.75 37.03 24.25 29.63 2 0 10.99 -999 ? O2S EPE A 376 >ILE~A 88 36.65 17.14 27.57 37.35 15.91 27.94 37.00 16.52 27.76 3 0 8.69 -999 ? C2 EPE A 376 >ILE~A 89 31.76 18.45 26.55 30.57 17.75 26.92 31.17 18.10 26.73 3 0 8.96 -999 ? O2S EPE A 376 >GLU~A 90 33.69 24.77 24.85 34.29 26.39 26.04 33.99 25.58 25.44 2 0 12.44 -999 ? O2S EPE A 376 >LYS~A 91 36.23 21.81 22.32 41.86 22.67 23.70 39.05 22.24 23.01 2 0 15.85 -999 ? O2S EPE A 376 >CYH~A 92 34.89 18.67 20.72 35.44 16.35 22.18 35.17 17.51 21.45 2 0 13.19 -999 ? C2 EPE A 376 >ILE~A 93 30.85 21.40 20.79 29.56 20.89 20.34 30.21 21.15 20.57 3 0 15.37 -999 ? O2S EPE A 376 >LYS~A 94 33.79 23.90 18.72 34.24 28.62 22.89 34.01 26.26 20.81 2 0 16.25 -999 ? O2S EPE A 376 >ASN~A 95 37.50 21.37 17.07 38.56 22.79 18.19 38.03 22.08 17.63 2 0 18.99 -999 ? O2S EPE A 376 >ASP.A 96 33.23 19.97 13.69 32.21 21.81 13.47 32.72 20.89 13.58 2 0 22.36 -999 ? O2S EPE A 376 >ILE.A 97 36.26 16.40 17.50 37.63 16.06 17.79 36.95 16.23 17.64 3 0 17.81 -999 ? C2 EPE A 376 >ALA^A 98 32.69 13.47 16.67 32.07 12.82 15.47 32.38 13.15 16.07 2 0 19.17 -999 ? C3 EPE A 376 >ILE^A 99 33.10 11.71 21.10 34.55 11.81 21.59 33.83 11.76 21.35 3 0 13.29 -999 ? C3 EPE A 376 >TYR^A 100 31.64 5.60 17.48 30.43 3.13 17.07 31.04 4.36 17.28 3 0 14.62 -999 ? ZN ZN A 375 >ALA^A 101 32.09 5.17 22.05 31.25 5.48 23.29 31.67 5.32 22.67 2 0 11.28 -999 ? ZN ZN A 375 >ALA.A 102 33.09 1.52 21.68 34.14 1.27 20.64 33.62 1.40 21.16 2 0 9.34 -999 ? ZN ZN A 375 >HIS~A 103 32.91 0.46 27.63 33.66 0.11 29.56 33.29 0.28 28.60 3 0 -4.82 -999 ? ZN ZN A 375s >THR~A 104 32.17 -3.62 26.15 30.67 -3.61 27.70 31.42 -3.61 26.93 2 0 6.76 -999 ? ZN ZN A 375 >ASN~A 105 30.92 -4.10 21.33 31.10 -1.93 21.21 31.01 -3.02 21.27 2 0 9.65 -999 ? ZN ZN A 375 >VAL~A 106 35.49 -4.13 22.21 36.61 -2.42 21.36 36.05 -3.28 21.79 3 0 7.00 -999 ? ZN ZN A 375 >ASP~A 107 35.27 -5.88 26.81 35.94 -4.18 27.85 35.61 -5.03 27.33 2 0 -2.33 -999 ? ZN ZN A 375s >VAL~A 108 34.04 -9.04 23.95 31.94 -9.50 24.38 32.99 -9.27 24.17 3 0 9.21 -999 ? ZN ZN A 375 >ALA~A 109 34.68 -9.30 20.20 34.40 -8.19 19.19 34.54 -8.74 19.70 2 0 11.42 -999 ? ZN ZN A 375 >LYS.A 110 37.52 -11.39 18.62 36.00 -16.08 14.56 36.76 -13.73 16.59 2 0 16.46 -999 ? O3 TRS A 378 >GLY.A 111 40.78 -9.44 18.50 40.17 -9.34 19.07 40.48 -9.39 18.78 1 0 12.81 -999 ? ZN ZN A 375 >GLY~A 112 39.28 -7.29 21.25 39.96 -7.72 21.33 39.62 -7.50 21.29 1 0 9.06 -999 ? ZN ZN A 375 >VAL~A 113 40.86 -5.95 24.42 40.35 -4.20 25.70 40.61 -5.07 25.06 3 0 5.55 -999 ? ZN ZN A 375 >ASN~A 114 39.96 -10.05 26.73 39.22 -8.78 28.27 39.59 -9.42 27.50 2 0 6.65 -999 ? ZN ZN A 375 >ASP~A 115 41.88 -11.27 21.52 40.65 -12.98 21.39 41.27 -12.13 21.46 2 0 13.24 -999 ? ZN ZN A 375 >LEU~A 116 44.83 -6.96 22.51 44.39 -5.97 20.61 44.61 -6.47 21.56 3 0 10.96 -999 ? ZN ZN A 375 >LEU~A 117 45.32 -8.50 27.69 44.90 -6.57 28.65 45.11 -7.53 28.17 3 0 9.37 -999 ? ZN ZN A 375 >ALA~A 118 46.25 -12.61 26.18 45.07 -13.50 25.76 45.66 -13.05 25.97 2 0 13.84 -999 ? ZN ZN A 375 >GLU~A 119 47.50 -11.03 21.23 45.94 -11.22 19.71 46.72 -11.12 20.47 2 0 15.23 -999 ? ZN ZN A 375 >ALA~A 120 50.64 -9.84 24.82 50.10 -8.49 25.27 50.37 -9.16 25.04 2 0 14.58 -999 ? ZN ZN A 375 >LEU~A 121 50.00 -12.35 28.89 49.39 -10.93 30.41 49.70 -11.64 29.65 3 0 15.51 -999 ? ZN ZN A 375 >GLY.A 122 51.97 -15.01 25.49 51.32 -15.01 26.00 51.64 -15.01 25.74 1 0 19.60 -999 ? ZN ZN A 375 >LEU.A 123 47.76 -16.66 27.23 47.59 -15.75 29.17 47.68 -16.20 28.20 3 0 17.27 -999 ? ZN ZN A 375 >GLN^A 124 50.96 -21.19 24.69 51.48 -20.44 22.75 51.22 -20.81 23.72 2 0 23.69 -999 ? ZN ZN A 375 >ASN^A 125 45.28 -23.75 24.72 46.53 -25.05 23.61 45.90 -24.40 24.17 2 0 21.73 -999 ? O3 TRS A 378 >THR^A 126 42.90 -19.47 25.31 43.76 -17.58 24.63 43.33 -18.52 24.97 2 0 16.96 -999 ? ZN ZN A 375 >GLU^A 127 39.39 -22.49 26.46 38.47 -23.38 24.73 38.93 -22.94 25.59 2 0 14.05 -999 ? O3 TRS A 378 >VAL^A 128 36.57 -17.31 27.04 34.80 -16.49 26.01 35.69 -16.90 26.52 3 0 14.60 -999 ? O3 TRS A 378 >LEU^A 129 37.22 -15.46 31.45 37.93 -15.32 33.50 37.58 -15.39 32.48 3 0 13.52 -999 ? ZN ZN A 375 >ALA^A 130 32.90 -15.33 31.26 32.77 -14.21 32.26 32.83 -14.77 31.76 2 0 13.12 -999 ? ZN ZN A 375 >PRO^A 131 30.79 -18.33 29.08 30.83 -16.12 29.03 30.81 -17.23 29.05 3 0 12.44 -999 ? O3 TRS A 378 >THR^A 132 28.09 -13.23 27.42 29.51 -11.55 27.63 28.80 -12.39 27.52 2 0 12.01 -999 ? ZN ZN A 375 >TYR^A 133 26.66 -12.84 21.54 25.55 -13.01 18.92 26.10 -12.92 20.23 3 0 12.87 -999 ? O3 TRS A 378 >ALA^A 134 26.32 -16.99 21.58 26.04 -18.24 22.34 26.18 -17.61 21.96 2 0 7.47 -999 ? O3 TRS A 378 >GLU^A 135 24.60 -15.96 15.66 25.54 -15.70 13.79 25.07 -15.83 14.73 2 0 12.87 -999 ? C3 TRS A 378 >GLU^A 136 19.87 -16.93 18.72 17.94 -16.19 18.72 18.90 -16.56 18.72 2 0 12.15 -999 ? O3 TRS A 378 >MET^A 137 21.20 -20.99 14.90 24.40 -21.15 14.55 22.80 -21.07 14.72 2 0 8.23 -999 ? C3 TRS A 378 >LYS^A 138 18.11 -21.79 12.78 16.12 -17.81 15.44 17.11 -19.80 14.11 2 0 13.11 -999 ? N TRS A 378 >LYS^A 139 17.05 -24.82 10.77 19.64 -29.66 10.35 18.34 -27.24 10.56 2 0 -2.64 -999 ? O3S EPE C 377s >VAL^A 140 15.83 -24.08 7.28 16.34 -22.37 5.99 16.09 -23.22 6.63 3 0 8.90 -999 ? O1S EPE C 377 >VAL^A 141 13.55 -26.62 5.63 12.80 -28.23 6.80 13.17 -27.43 6.22 3 0 8.54 -999 ? O2S EPE A 377 >VAL^A 142 12.52 -26.27 1.96 13.69 -25.47 0.25 13.11 -25.87 1.10 3 0 8.16 -999 ? C2 EPE A 377 >PHE^A 143 8.68 -28.97 1.51 8.47 -29.44 4.22 8.57 -29.20 2.86 3 0 -3.89 -999 ? C10 EPE A 377s >VAL^A 144 11.59 -29.15 -3.80 13.61 -28.22 -3.98 12.60 -28.68 -3.89 3 0 7.55 -999 ? C3 EPE A 377 >PRO~A 145 10.63 -29.46 -8.15 10.79 -30.79 -6.34 10.71 -30.12 -7.25 3 0 6.66 -999 ? C8 EPE A 377 >VAL~A 146 13.35 -34.07 -7.27 13.17 -36.24 -7.21 13.26 -35.16 -7.24 3 0 10.97 -999 ? C8 EPE A 377 >THR~A 147 14.45 -32.60 -10.61 12.69 -32.38 -11.80 13.57 -32.49 -11.21 2 0 11.14 -999 ? C8 EPE A 377 >HIS~A 148 14.41 -28.00 -10.43 13.63 -27.83 -12.37 14.02 -27.92 -11.40 3 0 11.43 -999 ? C8 EPE A 377 >ALA~A 149 16.74 -30.68 -5.41 16.48 -32.10 -4.88 16.61 -31.39 -5.15 2 0 12.22 -999 ? C7 EPE A 377 >GLU~A 150 22.60 -31.63 -7.22 23.33 -32.82 -5.63 22.96 -32.22 -6.43 2 0 12.50 -999 ? C5 EPE C 377 >GLU~A 151 19.56 -26.98 -10.07 18.53 -25.78 -11.47 19.05 -26.38 -10.77 2 0 15.60 -999 ? C7 EPE A 377 >VAL~A 152 18.66 -25.92 -4.44 16.56 -25.68 -3.83 17.61 -25.80 -4.14 3 0 12.53 -999 ? C3 EPE A 377 >ARG~A 153 20.83 -31.38 -1.20 19.50 -33.43 -3.04 20.17 -32.41 -2.12 2 0 11.00 -999 ? C6 EPE C 377 >LYS~A 154 24.03 -26.17 -4.04 26.99 -24.22 -8.52 25.51 -25.20 -6.28 2 0 18.09 -999 ? O1S EPE C 377 >ALA~A 155 22.46 -22.68 -3.71 21.06 -22.28 -4.12 21.76 -22.48 -3.92 2 0 14.27 -999 ? O1S EPE C 377 >LEU~A 156 21.27 -24.43 0.63 19.23 -24.51 1.36 20.25 -24.47 1.00 3 0 8.97 -999 ? O1S EPE C 377 >GLY~A 157 25.68 -24.30 0.57 25.46 -23.69 0.10 25.57 -23.99 0.34 1 0 9.65 -999 ? O1S EPE C 377 >ASP~A 158 27.01 -21.53 -3.21 27.96 -22.95 -4.50 27.49 -22.24 -3.86 2 0 15.23 -999 ? O1S EPE C 377 >ALA~A 159 25.41 -19.15 0.31 23.88 -18.99 0.22 24.65 -19.07 0.27 2 0 13.04 -999 ? O1S EPE C 377 >GLY.A 160 26.87 -20.51 3.59 26.23 -20.86 3.40 26.55 -20.69 3.49 1 0 10.75 -999 ? O1S EPE C 377 >ALA.A 161 24.22 -22.86 5.01 22.88 -23.16 4.38 23.55 -23.01 4.70 2 0 7.16 -999 ? O1S EPE C 377 >GLY.A 162 25.38 -26.08 6.68 25.80 -25.42 6.56 25.59 -25.75 6.62 1 0 4.48 -999 ? O1S EPE C 377 >HIS.A 163 30.88 -23.32 6.66 32.97 -23.36 6.49 31.92 -23.34 6.58 3 0 11.18 -999 ? O1S EPE C 377 >ILE.A 164 28.39 -27.14 11.25 27.87 -26.31 12.41 28.13 -26.73 11.83 3 0 7.03 -999 ? O2S EPE C 377 >GLY.A 165 32.95 -27.51 12.11 32.77 -27.17 11.33 32.86 -27.34 11.72 1 0 10.53 -999 ? O2 TRS A 378 >ASN.A 166 36.29 -29.92 9.78 37.81 -29.21 11.04 37.05 -29.57 10.41 2 0 13.31 -999 ? C3 EPE C 377 >TYR^A 167 32.29 -31.90 7.76 33.83 -34.20 8.34 33.06 -33.05 8.05 3 0 7.08 -999 ? C7 EPE C 377 >SER^A 168 30.58 -27.33 4.57 31.12 -25.87 2.65 30.85 -26.60 3.61 2 0 10.80 -999 ? O1S EPE C 377 >HIS^A 169 28.51 -27.02 0.13 29.35 -25.45 -0.99 28.93 -26.23 -0.43 3 0 11.22 -999 ? O1S EPE C 377 >CYH^A 170 25.74 -30.01 4.94 27.86 -30.22 6.82 26.80 -30.11 5.88 2 0 -4.87 -999 ? C10 EPE C 377s >THR^A 171 22.07 -30.68 4.19 22.03 -30.09 2.08 22.05 -30.39 3.14 2 0 -6.32 -999 ? O1S EPE C 377s >PHE^A 172 18.79 -35.53 6.28 17.39 -37.92 6.30 18.09 -36.73 6.29 3 0 6.53 -999 ? C9 EPE C 377 >SER^A 173 17.10 -34.58 2.20 18.37 -33.49 0.48 17.74 -34.04 1.34 2 0 8.70 -999 ? C6 EPE C 377 >SER^A 174 14.12 -36.94 2.65 13.97 -36.44 5.09 14.05 -36.69 3.87 2 0 9.43 -999 ? O3S EPE C 377 >GLU^A 175 12.76 -38.43 -2.33 12.71 -39.82 -3.96 12.73 -39.12 -3.14 2 0 13.72 -999 ? C8 EPE A 377 >GLY^A 176 7.94 -37.98 0.68 8.08 -37.55 -0.03 8.01 -37.76 0.33 1 0 9.59 -999 ? C9 EPE A 377 >THR^A 177 4.52 -36.86 -0.44 3.03 -38.32 -1.01 3.77 -37.59 -0.73 2 0 8.80 -999 ? C6 EPE A 377 >GLY^A 178 3.25 -33.31 -0.46 2.85 -33.92 -0.95 3.05 -33.61 -0.71 1 0 3.80 -999 ? C6 EPE A 377 >THR^A 179 -0.48 -32.60 -0.86 -1.48 -33.77 0.69 -0.98 -33.19 -0.08 2 0 6.64 -999 ? C6 EPE A 377 >PHE^A 180 -0.71 -29.06 -4.30 -0.06 -29.96 -6.91 -0.39 -29.51 -5.61 3 0 4.05 -999 ? O8 EPE A 377 >VAL^A 181 -5.53 -28.06 -3.45 -7.50 -28.73 -2.70 -6.52 -28.39 -3.08 3 0 10.03 -999 ? C5 EPE A 377 >PRO^A 182 -4.76 -27.22 -7.53 -4.88 -25.91 -5.70 -4.82 -26.57 -6.61 3 0 8.47 -999 ? O8 EPE A 377 >GLN.A 183 -6.86 -21.61 -3.42 -8.75 -22.47 -2.89 -7.80 -22.04 -3.16 2 0 13.75 -999 ? O8 EPE A 377 >GLN.A 195 -11.31 -33.29 -6.93 -11.68 -35.38 -6.61 -11.50 -34.33 -6.77 2 0 16.76 -999 ? O8 EPE A 377 >LEU.A 196 -6.04 -33.42 -1.77 -6.41 -35.46 -0.94 -6.23 -34.44 -1.35 3 0 10.82 -999 ? C6 EPE A 377 >GLU^A 197 -4.05 -31.37 -7.20 -4.83 -32.55 -8.76 -4.44 -31.96 -7.98 2 0 9.85 -999 ? O8 EPE A 377 >ARG^A 198 -1.05 -38.83 -3.85 -3.04 -38.62 -1.48 -2.05 -38.73 -2.67 2 0 11.16 -999 ? C6 EPE A 377 >VAL^A 199 3.33 -34.98 -5.58 3.36 -32.85 -6.21 3.35 -33.92 -5.90 3 0 5.28 -999 ? C8 EPE A 377 >GLU^A 200 6.52 -39.28 -5.41 6.61 -40.27 -3.48 6.56 -39.78 -4.45 2 0 11.53 -999 ? C6 EPE A 377 >GLU^A 201 7.01 -32.51 -2.93 6.57 -30.84 -1.85 6.79 -31.68 -2.39 2 0 -3.12 -999 ? C2 EPE A 377s >VAL^A 202 12.15 -33.71 -1.42 14.04 -34.10 -2.36 13.09 -33.90 -1.89 3 0 9.55 -999 ? C2 EPE A 377 >ARG^A 203 10.96 -32.82 5.66 12.34 -31.74 8.19 11.65 -32.28 6.92 2 0 8.58 -999 ? O3S EPE C 377 >ILE^A 204 16.31 -29.71 1.22 17.13 -29.48 0.10 16.72 -29.60 0.66 3 0 8.93 -999 ? O3S EPE C 377 >GLU^A 205 16.97 -31.31 7.38 16.25 -32.10 9.22 16.61 -31.70 8.30 2 0 -4.84 -999 ? O3S EPE C 377s >THR^A 206 19.99 -27.38 6.69 21.08 -26.14 5.25 20.54 -26.76 5.97 2 0 -4.52 -999 ? O1S EPE C 377s >ILE^A 207 22.07 -26.01 10.74 23.10 -26.05 11.78 22.58 -26.03 11.26 3 0 -4.28 -999 ? O1S EPE C 377s >ILE^A 208 21.33 -20.76 8.47 20.15 -20.38 7.77 20.74 -20.57 8.12 3 0 8.75 -999 ? O1S EPE C 377 >PRO^A 209 25.33 -18.66 10.39 23.40 -19.41 11.23 24.37 -19.03 10.81 3 0 10.57 -999 ? O1S EPE C 377 >ALA.A 210 20.67 -16.34 12.32 20.26 -15.76 13.68 20.47 -16.05 13.00 2 0 13.63 -999 ? C3 TRS A 378 >SER.A 211 22.77 -13.70 10.58 25.20 -14.10 10.82 23.98 -13.90 10.70 2 0 15.47 -999 ? O1S EPE C 377 >LEU~A 212 23.81 -16.90 6.96 25.90 -16.84 6.35 24.86 -16.87 6.66 3 0 12.59 -999 ? O1S EPE C 377 >GLN~A 213 16.78 -16.27 7.73 15.34 -16.06 9.27 16.06 -16.17 8.50 2 0 14.95 -999 ? O1S EPE C 377 >ARG~A 214 17.59 -9.46 5.35 20.56 -9.02 6.23 19.07 -9.24 5.79 2 0 20.32 -999 ? O1S EPE C 377 >LYS~A 215 21.25 -14.20 2.18 27.53 -14.97 1.13 24.39 -14.59 1.65 2 0 16.65 -999 ? O1S EPE C 377 >VAL~A 216 20.56 -17.95 2.37 21.08 -19.60 3.74 20.82 -18.78 3.05 3 0 11.74 -999 ? O1S EPE C 377 >ILE~A 217 15.72 -16.98 2.77 14.88 -18.16 3.10 15.30 -17.57 2.93 3 0 14.44 -999 ? O1S EPE A 377 >LYS~A 218 17.38 -15.22 -1.06 17.49 -9.91 -3.23 17.43 -12.57 -2.14 2 0 21.49 -999 ? C3 EPE A 377 >ALA~A 219 19.72 -17.73 -2.78 21.10 -18.09 -2.28 20.41 -17.91 -2.53 2 0 15.37 -999 ? O1S EPE C 377 >MET~A 220 17.48 -20.70 -2.10 15.36 -22.19 1.11 16.42 -21.44 -0.49 2 0 11.61 -999 ? C3 EPE A 377 >VAL~A 221 14.44 -18.94 -3.55 12.92 -17.63 -2.74 13.68 -18.28 -3.15 3 0 12.55 -999 ? C3 EPE A 377 >THR~A 222 16.28 -17.85 -6.75 17.66 -16.26 -7.18 16.97 -17.05 -6.96 2 0 17.51 -999 ? C7 EPE A 377 >ALA~A 223 17.38 -21.44 -7.38 18.48 -22.07 -6.57 17.93 -21.76 -6.98 2 0 14.91 -999 ? C7 EPE A 377 >HIS~A 224 12.08 -23.60 -5.02 10.59 -24.98 -4.54 11.34 -24.29 -4.78 3 0 7.33 -999 ? C7 EPE A 377 >PRO.A 225 11.78 -26.17 -8.68 12.39 -24.06 -9.10 12.09 -25.12 -8.89 3 0 9.06 -999 ? C7 EPE A 377 >TYR.A 226 7.72 -24.64 -8.18 7.45 -27.31 -8.97 7.59 -25.98 -8.57 3 0 5.45 -999 ? C8 EPE A 377 >GLU.A 227 5.87 -17.01 -8.12 5.06 -15.73 -9.55 5.46 -16.37 -8.83 2 0 13.15 -999 ? O8 EPE A 377 >GLU.A 228 3.91 -21.00 -3.12 3.67 -19.15 -2.10 3.79 -20.08 -2.61 2 0 8.71 -999 ? C3 EPE A 377 >VAL.A 229 8.44 -21.56 -2.47 10.58 -21.25 -2.78 9.51 -21.40 -2.62 3 0 7.51 -999 ? C3 EPE A 377 >ALA.A 230 7.28 -23.47 0.64 6.30 -24.70 0.61 6.79 -24.09 0.63 2 0 3.77 -999 ? C3 EPE A 377 >TYR^A 231 11.27 -20.99 3.01 11.22 -18.21 3.38 11.24 -19.60 3.20 3 0 10.06 -999 ? O1S EPE A 377 >ASP^A 232 9.54 -24.20 7.87 7.70 -24.91 7.05 8.62 -24.55 7.46 2 0 4.68 -999 ? O1S EPE A 377 >VAL^A 233 12.65 -21.47 9.47 13.76 -19.72 8.97 13.21 -20.59 9.22 3 0 11.84 -999 ? O1S EPE A 377 >TYR^A 234 12.00 -25.53 12.31 10.15 -27.11 10.97 11.07 -26.32 11.64 3 0 9.43 -999 ? O2S EPE A 377 >PRO^A 235 12.30 -21.62 16.89 14.01 -21.92 15.48 13.16 -21.77 16.18 3 0 12.26 -999 ? N TRS A 378 >LEU^A 236 18.21 -24.75 16.42 18.16 -26.24 14.91 18.18 -25.49 15.67 3 0 7.58 -999 ? N TRS A 378 >ASP^A 237 18.36 -25.38 21.90 16.49 -24.92 22.81 17.42 -25.15 22.35 2 0 6.80 -999 ? N TRS A 378 >ASN^A 238 22.25 -25.65 17.52 21.37 -27.55 17.01 21.81 -26.60 17.27 2 0 -4.13 -999 ? C2 TRS A 378s >LYS^A 239 24.38 -22.19 19.59 20.35 -19.68 21.34 22.36 -20.94 20.47 2 0 -7.47 -999 ? O3 TRS A 378s >GLY^A 240 27.04 -20.59 17.45 27.05 -20.66 18.34 27.05 -20.62 17.89 1 0 7.12 -999 ? C3 TRS A 378 >GLU^A 241 32.85 -18.83 18.59 34.29 -17.80 17.42 33.57 -18.31 18.00 2 0 13.09 -999 ? O3 TRS A 378 >THR^A 242 30.60 -18.28 22.38 30.36 -19.25 24.36 30.48 -18.77 23.37 2 0 8.72 -999 ? O3 TRS A 378 >LEU^A 243 31.75 -13.70 22.02 32.50 -13.55 19.95 32.12 -13.62 20.99 3 0 14.05 -999 ? O3 TRS A 378 >GLY^A 244 32.51 -13.15 26.46 33.13 -12.90 26.03 32.82 -13.03 26.24 1 0 11.92 -999 ? ZN ZN A 375 >LEU^A 245 34.09 -10.56 30.10 33.11 -8.69 29.93 33.60 -9.62 30.02 3 0 8.19 -999 ? ZN ZN A 375 >GLY^A 246 38.31 -12.10 29.42 37.83 -12.45 28.86 38.07 -12.28 29.14 1 0 9.76 -999 ? ZN ZN A 375 >LYS^A 247 40.34 -15.07 28.39 38.70 -15.53 23.22 39.52 -15.30 25.80 2 0 14.25 -999 ? ZN ZN A 375 >ILE^A 248 40.92 -18.65 31.37 40.47 -19.69 32.14 40.70 -19.17 31.76 3 0 17.37 -999 ? ZN ZN A 375 >GLY^A 249 44.87 -19.78 28.98 45.04 -19.55 29.74 44.95 -19.67 29.36 1 0 18.94 -999 ? ZN ZN A 375 >TYR^A 250 47.39 -23.45 29.84 45.28 -25.08 30.70 46.33 -24.27 30.27 3 0 23.04 -999 ? O3 TRS A 378 >LEU^A 251 52.57 -19.38 31.15 52.41 -17.39 31.96 52.49 -18.39 31.55 3 0 22.24 -999 ? ZN ZN A 375 >GLN^A 252 54.82 -21.16 25.26 56.01 -19.83 24.05 55.42 -20.50 24.65 2 0 25.98 -999 ? ZN ZN A 375 >GLU^A 253 58.61 -23.45 31.31 60.40 -23.73 30.22 59.50 -23.59 30.76 2 0 31.48 -999 ? ZN ZN A 375 >GLU^A 254 55.35 -23.67 37.01 55.67 -25.35 38.24 55.51 -24.51 37.62 2 0 30.93 -999 ? ZN ZN A 375 >MET^A 255 56.87 -19.61 36.60 56.16 -16.34 34.12 56.51 -17.97 35.36 2 0 24.09 -999 ? ZN ZN A 375 >THR^A 256 56.69 -18.34 40.21 58.60 -17.57 40.86 57.65 -17.96 40.53 2 0 28.88 -999 ? ZN ZN A 375 >LEU~A 257 53.11 -15.70 42.27 51.31 -14.45 42.42 52.21 -15.07 42.35 3 0 23.88 -999 ? ZN ZN A 374 >GLY~A 258 56.88 -13.16 41.55 56.67 -13.61 40.87 56.78 -13.38 41.21 1 0 25.62 -999 ? ZN ZN A 374 >GLN~A 259 58.90 -16.16 37.51 60.42 -17.61 36.90 59.66 -16.88 37.20 2 0 28.90 -999 ? ZN ZN A 375 >PHE~A 260 52.43 -14.27 35.94 50.19 -13.42 34.56 51.31 -13.84 35.25 3 0 19.27 -999 ? ZN ZN A 375 >ALA~A 261 54.29 -10.44 37.93 54.37 -10.19 39.44 54.33 -10.32 38.69 2 0 21.36 -999 ? ZN ZN A 374 >GLU~A 262 59.50 -9.24 37.85 59.47 -7.16 38.33 59.49 -8.20 38.09 2 0 24.15 -999 ? ZN ZN A 374 >HIS~A 263 55.65 -12.70 31.62 54.70 -13.41 29.88 55.18 -13.06 30.75 3 0 20.93 -999 ? ZN ZN A 375 >VAL~A 264 53.11 -8.79 33.29 51.21 -9.10 34.32 52.16 -8.94 33.81 3 0 17.06 -999 ? ZN ZN A 375 >LYS~A 265 54.99 -5.46 33.76 58.41 -3.92 38.21 56.70 -4.69 35.98 2 0 22.38 -999 ? ZN ZN A 374 >GLN~A 266 59.53 -7.13 31.68 60.94 -5.69 30.89 60.24 -6.41 31.28 2 0 23.95 -999 ? ZN ZN A 374 >SER~A 267 54.41 -7.54 28.59 54.43 -9.91 28.92 54.42 -8.73 28.76 2 0 18.73 -999 ? ZN ZN A 375 >LEU~A 268 50.77 -5.10 30.22 49.37 -6.88 29.87 50.07 -5.99 30.04 3 0 13.36 -999 ? ZN ZN A 375 >ASP.A 269 54.82 -1.21 28.36 56.43 0.27 28.67 55.62 -0.47 28.51 2 0 18.90 -999 ? ZN ZN A 374 >VAL.A 270 53.65 -0.86 33.12 51.87 -2.05 33.62 52.76 -1.45 33.37 3 0 15.39 -999 ? ZN ZN A 374 >LYS.A 271 56.12 0.48 35.73 59.67 4.01 35.99 57.90 2.24 35.86 2 0 23.00 -999 ? ZN ZN A 374 >GLY.A 272 54.23 -1.17 38.61 53.76 -1.27 37.97 53.99 -1.22 38.29 1 0 18.36 -999 ? ZN ZN A 374 >ALA.A 273 51.72 -3.77 39.72 51.92 -5.01 38.86 51.82 -4.39 39.29 2 0 17.12 -999 ? ZN ZN A 374 >ARG^A 274 47.87 -1.95 44.32 44.79 -1.96 44.32 46.33 -1.95 44.32 2 0 15.42 -999 ? ZN ZN A 374 >VAL^A 275 50.08 -8.59 43.71 51.74 -9.86 43.03 50.91 -9.23 43.37 3 0 20.43 -999 ? ZN ZN A 374 >VAL^A 276 47.74 -10.69 45.84 45.65 -10.33 46.28 46.69 -10.51 46.06 3 0 20.58 -999 ? ZN ZN A 374 >GLY.A 277 49.23 -14.07 46.91 49.73 -13.44 47.06 49.48 -13.76 46.98 1 0 24.28 -999 ? ZN ZN A 374 >LYS.A 278 52.59 -15.70 47.74 53.19 -20.67 51.64 52.89 -18.18 49.69 2 0 33.16 -999 ? ZN ZN A 374 >LEU.A 279 56.39 -13.42 45.75 56.01 -11.28 45.87 56.20 -12.35 45.81 3 0 26.84 -999 ? ZN ZN A 374 >ASP.A 280 57.62 -18.45 47.11 59.50 -17.52 47.44 58.56 -17.99 47.27 2 0 32.54 -999 ? ZN ZN A 374 >ASP.A 281 52.87 -20.75 45.53 51.52 -19.24 45.99 52.20 -20.00 45.76 2 0 28.06 -999 ? ZN ZN A 375 >LYS^A 282 53.78 -21.68 41.24 59.13 -25.09 41.65 56.45 -23.39 41.45 2 0 34.08 -999 ? ZN ZN A 375 >VAL^A 283 51.81 -20.25 38.35 51.17 -18.13 38.40 51.49 -19.19 38.37 3 0 24.05 -999 ? ZN ZN A 375 >ARG^A 284 52.06 -24.03 32.92 53.49 -25.85 30.90 52.78 -24.94 31.91 2 0 28.58 -999 ? ZN ZN A 375 >LYS^A 285 47.09 -21.09 34.01 41.69 -24.22 32.75 44.39 -22.66 33.38 2 0 20.00 -999 ? O3 TRS A 378 >VAL^A 286 46.33 -17.37 33.74 47.98 -15.99 33.42 47.15 -16.68 33.58 3 0 18.04 -999 ? ZN ZN A 375 >ALA^A 287 43.01 -15.52 33.51 41.87 -15.70 34.47 42.44 -15.61 33.99 2 0 15.21 -999 ? ZN ZN A 375 >VAL^A 288 43.05 -11.94 32.21 44.10 -11.19 30.38 43.58 -11.57 31.30 3 0 11.42 -999 ? ZN ZN A 375 >LEU^A 289 39.10 -9.73 32.85 36.96 -9.23 32.27 38.03 -9.48 32.56 3 0 8.10 -999 ? ZN ZN A 375 >GLY^A 290 41.03 -5.77 31.09 40.29 -6.09 31.40 40.66 -5.93 31.24 1 0 5.60 -999 ? ZN ZN A 375 >GLY^A 291 39.29 -3.03 33.06 39.67 -3.69 33.42 39.48 -3.36 33.24 1 0 4.06 -999 ? ZN ZN A 374 >ASP^A 292 36.33 -2.54 36.72 35.44 -2.95 38.63 35.88 -2.75 37.67 2 0 8.63 -999 ? ZN ZN A 374 >GLY.A 293 37.16 -7.31 36.80 37.28 -6.91 37.48 37.22 -7.11 37.14 1 0 9.40 -999 ? ZN ZN A 374 >ASN.A 294 35.77 -6.31 41.36 37.34 -5.07 42.10 36.56 -5.69 41.73 2 0 12.36 -999 ? ZN ZN A 374 >LYS.A 295 32.96 -9.31 39.54 28.55 -6.00 37.21 30.75 -7.65 38.38 2 0 12.61 -999 ? ZN ZN A 374 >TYR~A 296 34.09 -11.35 35.81 31.97 -10.07 34.54 33.03 -10.71 35.17 3 0 11.37 -999 ? ZN ZN A 375 >ILE~A 297 37.67 -13.06 42.03 37.68 -12.21 43.11 37.68 -12.64 42.57 3 0 17.21 -999 ? ZN ZN A 374 >ASN~A 298 33.43 -16.52 41.59 33.28 -16.25 43.67 33.35 -16.39 42.63 2 0 20.81 -999 ? ZN ZN A 375 >GLN~A 299 33.95 -17.11 35.05 32.58 -18.75 34.74 33.27 -17.93 34.89 2 0 16.37 -999 ? O3 TRS A 378 >ALA~A 300 38.46 -17.14 37.26 39.29 -15.90 37.59 38.88 -16.52 37.43 2 0 16.31 -999 ? ZN ZN A 375 >LYS~A 301 39.11 -19.59 40.11 42.80 -21.77 43.38 40.96 -20.68 41.74 2 0 24.94 -999 ? ZN ZN A 375 >PHE~A 302 34.13 -22.97 38.46 32.71 -25.28 37.80 33.42 -24.13 38.13 3 0 17.86 -999 ? O1 TRS A 378 >LYS~A 303 37.93 -22.13 35.45 34.81 -22.43 31.07 36.37 -22.28 33.26 2 0 13.81 -999 ? O3 TRS A 378 >GLY.A 304 41.24 -23.22 37.09 41.16 -22.48 36.89 41.20 -22.85 36.99 1 0 22.37 -999 ? O3 TRS A 378 >ALA.A 305 43.26 -20.00 36.94 42.76 -18.58 36.69 43.01 -19.29 36.81 2 0 18.87 -999 ? ZN ZN A 375 >ASP.A 306 47.82 -20.71 38.37 47.81 -22.84 38.27 47.82 -21.77 38.32 2 0 24.91 -999 ? ZN ZN A 375 >VAL^A 307 46.44 -16.28 38.69 48.29 -15.22 38.04 47.36 -15.75 38.37 3 0 19.34 -999 ? ZN ZN A 375 >TYR^A 308 41.62 -12.73 37.70 39.41 -11.19 36.83 40.51 -11.96 37.27 3 0 13.26 -999 ? ZN ZN A 375 >VAL^A 309 45.28 -10.30 35.78 47.06 -9.94 34.57 46.17 -10.12 35.18 3 0 13.46 -999 ? ZN ZN A 375 >THR^A 310 42.72 -7.43 36.10 40.77 -7.66 37.11 41.74 -7.55 36.60 2 0 10.34 -999 ? ZN ZN A 374 >GLY^A 311 42.54 -3.74 37.15 41.89 -4.18 37.32 42.22 -3.96 37.24 1 0 8.82 -999 ? ZN ZN A 374 >ASP.A 312 39.49 -1.24 39.18 39.76 0.49 37.96 39.62 -0.38 38.57 2 0 7.50 -999 ? ZN ZN A 374 >MET.A 313 41.01 -4.53 42.47 40.91 -7.82 42.53 40.96 -6.18 42.50 2 0 14.44 -999 ? ZN ZN A 374 >TYR~A 314 36.88 -2.62 44.67 35.35 -1.67 42.53 36.12 -2.15 43.60 3 0 12.17 -999 ? O8 EPE A 376 >TYR~A 315 41.01 -3.77 51.66 42.24 -4.43 54.10 41.62 -4.10 52.88 3 0 21.30 -999 ? O8 EPE A 376 >HIS~A 316 36.36 -5.20 52.06 36.55 -4.24 53.92 36.46 -4.72 52.99 3 0 20.33 -999 ? O8 EPE A 376 >VAL~A 317 37.54 -8.27 46.94 36.31 -7.93 45.13 36.92 -8.10 46.04 3 0 17.24 -999 ? ZN ZN A 374 >ALA~A 318 41.32 -8.99 47.30 42.41 -8.00 47.53 41.87 -8.49 47.42 2 0 19.12 -999 ? ZN ZN A 374 >HIS~A 319 41.01 -9.30 52.79 42.52 -8.54 54.04 41.76 -8.92 53.41 3 0 24.64 -999 ? ZN ZN A 374 >ASP~A 320 36.60 -12.13 48.17 35.17 -11.15 49.43 35.88 -11.64 48.80 2 0 -21.81 -999 ? ZN ZN A 374s >ALA~A 321 40.35 -13.63 46.22 41.15 -12.61 45.43 40.75 -13.12 45.82 2 0 19.58 -999 ? ZN ZN A 374 >MET~A 322 42.74 -14.71 48.99 44.93 -11.90 51.14 43.84 -13.30 50.06 2 0 24.63 -999 ? ZN ZN A 374 >MET~A 323 40.04 -16.78 50.64 37.55 -15.19 53.60 38.80 -15.98 52.12 2 0 24.46 -999 ? O3S EPE C 376 >LEU~A 324 38.83 -17.83 45.97 36.79 -17.52 45.31 37.81 -17.68 45.64 3 0 22.85 -999 ? ZN ZN A 375 >GLY~A 325 43.05 -19.34 46.86 42.56 -18.83 46.33 42.80 -19.09 46.60 1 0 25.53 -999 ? ZN ZN A 375 >LEU.A 326 41.91 -16.58 43.18 41.53 -16.00 41.11 41.72 -16.29 42.15 3 0 19.87 -999 ? ZN ZN A 375 >ASN^A 327 47.65 -15.59 42.64 48.42 -17.07 43.94 48.04 -16.33 43.29 2 0 23.94 -999 ? ZN ZN A 375 >ILE^A 328 45.06 -10.60 42.14 43.79 -10.64 41.43 44.43 -10.62 41.78 3 0 16.66 -999 ? ZN ZN A 374 >VAL^A 329 48.33 -9.29 39.53 50.17 -9.83 38.53 49.25 -9.56 39.03 3 0 17.09 -999 ? ZN ZN A 374 >ASP^A 330 45.96 -5.26 40.35 44.85 -3.42 39.89 45.40 -4.34 40.12 2 0 12.08 -999 ? ZN ZN A 374 >PRO.A 331 47.59 -5.26 34.99 48.29 -4.22 36.88 47.94 -4.74 35.93 3 0 12.41 -999 ? ZN ZN A 374 >GLY~A 332 46.00 -1.11 36.47 45.93 -1.81 36.02 45.96 -1.46 36.24 1 0 10.15 -999 ? ZN ZN A 374 >HIS~A 333 40.60 0.33 34.12 38.69 0.39 33.24 39.64 0.36 33.68 3 0 -3.55 -999 ? ZN ZN A 374s >ASN~A 334 45.98 2.64 32.26 46.53 3.77 30.56 46.25 3.20 31.41 2 0 9.69 -999 ? ZN ZN A 374 >VAL~A 335 46.65 -1.70 30.63 46.83 -3.74 31.34 46.74 -2.72 30.98 3 0 9.46 -999 ? ZN ZN A 374 >GLU~A 336 41.61 -2.34 29.43 39.56 -1.83 29.49 40.58 -2.08 29.46 2 0 2.52 -999 ? ZN ZN A 375s >LYS~A 337 45.66 0.76 26.15 51.53 0.58 28.90 48.60 0.67 27.52 2 0 14.02 -999 ? ZN ZN A 374 >VAL~A 338 46.51 -2.21 23.86 46.85 -4.02 25.09 46.68 -3.12 24.47 3 0 10.31 -999 ? ZN ZN A 375 >MET~A 339 43.12 -1.71 22.29 41.25 0.94 22.96 42.19 -0.38 22.62 2 0 7.71 -999 ? ZN ZN A 375 >LYS~A 340 44.47 1.55 20.70 47.30 5.10 24.27 45.89 3.33 22.49 2 0 12.75 -999 ? ZN ZN A 374 >GLN~A 341 49.31 1.05 19.01 51.39 0.92 18.69 50.35 0.98 18.85 2 0 17.59 -999 ? ZN ZN A 375 >GLY~A 342 44.89 -3.04 18.23 44.73 -2.27 17.91 44.81 -2.65 18.07 1 0 12.90 -999 ? ZN ZN A 375 >VAL~A 343 41.83 -1.38 16.72 39.88 -0.62 17.58 40.85 -1.00 17.15 3 0 12.11 -999 ? ZN ZN A 375 >GLN~A 344 45.67 2.52 13.85 47.64 2.01 13.33 46.66 2.27 13.59 2 0 19.01 -999 ? ZN ZN A 375 >LYS~A 345 45.56 -1.99 12.81 45.09 -7.18 12.35 45.33 -4.59 12.58 2 0 18.67 -999 ? ZN ZN A 375 >GLN~A 346 42.03 -5.48 14.40 41.20 -5.67 16.38 41.61 -5.57 15.39 2 0 13.26 -999 ? ZN ZN A 375 >LEU~A 347 39.84 0.41 12.10 38.14 1.65 11.48 38.99 1.03 11.79 3 0 17.28 -999 ? ZN ZN A 375 >GLN~A 348 45.30 1.40 7.97 44.85 3.48 7.99 45.08 2.44 7.98 2 0 22.76 -999 ? ZN ZN A 375 >GLU~A 349 44.64 -4.62 8.34 45.23 -6.64 8.63 44.94 -5.63 8.48 2 0 21.94 -999 ? ZN ZN A 375 >LYS~A 350 39.19 -2.77 6.68 35.27 -5.97 7.17 37.23 -4.37 6.93 2 0 21.83 -999 ? ZN ZN A 375 >VAL~A 351 39.36 0.74 5.25 40.03 2.74 5.98 39.69 1.74 5.61 3 0 23.51 -999 ? ZN ZN A 375 >ASP~A 352 43.66 -0.56 3.32 44.78 0.99 4.29 44.22 0.22 3.80 2 0 25.70 -999 ? ZN ZN A 375 >ALA~A 353 40.40 -3.18 1.57 39.94 -4.34 2.42 40.17 -3.76 2.00 2 0 26.41 -999 ? ZN ZN A 375 >LYS~A 354 37.47 -0.90 0.73 32.51 -2.58 1.13 34.99 -1.74 0.93 2 0 27.90 -999 ? ZN ZN A 375 >LYS.A 355 39.94 1.41 -1.05 41.91 -2.04 -4.52 40.92 -0.31 -2.78 2 0 33.47 -999 ? ZN ZN A 375 >LEU.A 356 38.06 4.19 2.32 35.93 3.79 2.19 36.99 3.99 2.26 3 0 27.14 -999 ? ZN ZN A 375 >ASN.A 357 41.74 8.14 0.39 43.66 9.05 0.34 42.70 8.59 0.37 2 0 31.19 -999 ? ZN ZN A 375 >VAL.A 358 41.47 7.59 5.38 39.46 7.40 6.22 40.47 7.49 5.80 3 0 25.09 -999 ? ZN ZN A 375 >HIS^A 359 45.80 8.64 6.53 46.53 8.87 4.58 46.17 8.75 5.56 3 0 27.14 -999 ? ZN ZN A 375 >ILE^A 360 43.03 4.23 11.48 41.61 4.40 11.52 42.32 4.32 11.50 3 0 19.09 -999 ? ZN ZN A 375 >HIS^A 361 46.25 9.10 12.92 46.66 10.09 11.12 46.46 9.60 12.02 3 0 22.47 -999 ? ZN ZN A 375 >ALA^A 362 46.25 5.46 17.59 47.00 4.15 17.82 46.63 4.81 17.71 2 0 15.97 -999 ? ZN ZN A 375 >SER.A 363 46.51 8.06 20.34 45.84 9.37 22.25 46.17 8.71 21.29 2 0 15.15 -999 ? ZN ZN A 374 >GLN.A 364 51.39 8.85 19.52 52.22 6.89 19.00 51.81 7.87 19.26 2 0 19.99 -999 ? ZN ZN A 374 >LEU.A 365 48.19 10.99 25.08 48.48 12.81 23.89 48.33 11.90 24.48 3 0 17.26 -999 ? ZN ZN A 374 >HIS.A 366 51.10 6.85 29.91 51.20 5.36 31.38 51.15 6.11 30.65 3 0 14.86 -999 ? ZN ZN A 374 >THR.A 367 46.41 8.27 30.19 44.93 8.03 28.58 45.67 8.15 29.38 2 0 11.13 -999 ? ZN ZN A 374 >ASP.A 368 48.24 5.16 33.58 47.82 3.96 35.30 48.03 4.56 34.44 2 0 11.85 -999 ? ZN ZN A 374 >PRO.A 369 44.09 7.82 35.96 46.32 7.99 35.77 45.21 7.91 35.86 3 0 11.61 -999 ? C8 EPE A 376 >PHE.A 370 46.70 4.90 39.59 44.12 4.72 40.65 45.41 4.81 40.12 3 0 12.81 -999 ? O8 EPE A 376 >ILE.A 371 52.95 8.03 39.08 54.05 8.96 38.52 53.50 8.49 38.80 3 0 19.73 -999 ? ZN ZN A 374 >PHE.A 372 52.79 1.59 40.88 50.60 -0.15 40.87 51.70 0.72 40.88 3 0 17.32 -999 ? ZN ZN A 374 >VAL.A 373 56.03 5.05 44.14 55.30 7.06 44.71 55.66 6.05 44.43 3 0 23.42 -999 ? ZN ZN A 374 >SER.B 2 -34.38 -16.15 16.72 -34.75 -14.25 15.20 -34.57 -15.20 15.96 2 0 32.79 -999 ? ZN ZN B 375 >LYS.B 3 -34.16 -15.88 20.56 -37.36 -15.32 22.01 -35.76 -15.60 21.29 2 0 34.82 -999 ? ZN ZN B 375 >ILE.B 4 -33.92 -12.79 24.30 -34.73 -11.93 24.77 -34.33 -12.36 24.53 3 0 30.76 -999 ? ZN ZN B 375 >PRO.B 5 -29.08 -11.85 22.72 -29.96 -13.64 23.73 -29.52 -12.75 23.23 3 0 27.02 -999 ? ZN ZN B 375 >ASN~B 6 -27.54 -14.58 28.45 -25.88 -15.90 28.21 -26.71 -15.24 28.33 2 0 27.30 -999 ? ZN ZN B 375 >GLY~B 7 -24.83 -11.10 27.95 -24.79 -11.89 27.82 -24.81 -11.49 27.88 1 0 23.15 -999 ? ZN ZN B 375 >HIS~B 8 -21.73 -14.76 29.99 -21.14 -14.36 31.97 -21.44 -14.56 30.98 3 0 24.51 -999 ? ZN ZN B 375 >GLU~B 9 -25.03 -16.61 24.42 -27.11 -17.15 24.13 -26.07 -16.88 24.27 2 0 28.41 -999 ? ZN ZN B 375 >ILE~B 10 -23.95 -10.07 23.54 -24.90 -9.11 23.48 -24.43 -9.59 23.51 3 0 21.12 -999 ? ZN ZN B 375 >ILE~B 11 -19.58 -10.51 26.10 -18.98 -9.18 26.15 -19.28 -9.85 26.13 3 0 18.20 -999 ? ZN ZN B 375 >SER~B 12 -18.37 -13.85 22.96 -18.51 -16.07 23.80 -18.44 -14.96 23.38 2 0 22.72 -999 ? ZN ZN B 375 >LEU~B 13 -20.65 -12.23 18.98 -21.90 -13.76 18.06 -21.27 -12.99 18.52 3 0 21.73 -999 ? ZN ZN B 375 >PHE~B 14 -17.27 -6.95 21.62 -15.57 -4.76 21.74 -16.42 -5.86 21.68 3 0 12.83 -999 ? ZN ZN B 375 >GLU~B 15 -14.60 -10.45 24.17 -14.29 -11.30 26.10 -14.44 -10.87 25.14 2 0 17.09 -999 ? ZN ZN B 375 >SER~B 16 -14.13 -12.84 18.48 -16.27 -12.81 17.28 -15.20 -12.83 17.88 2 0 19.34 -999 ? ZN ZN B 375 >MET~B 17 -13.48 -9.52 16.64 -17.15 -8.03 15.19 -15.31 -8.78 15.92 2 0 16.48 -999 ? ZN ZN B 375 >TYR~B 18 -12.77 -5.58 18.92 -13.52 -3.89 16.83 -13.15 -4.73 17.87 3 0 10.93 -999 ? ZN ZN B 375 >PRO~B 19 -8.98 -11.22 19.12 -9.96 -10.08 20.78 -9.47 -10.65 19.95 3 0 15.10 -999 ? ZN ZN B 375 >LYS~B 20 -8.72 -9.62 24.89 -11.95 -11.12 29.74 -10.33 -10.37 27.31 2 0 17.56 -999 ? ZN ZN B 375 >HIS~B 21 -4.82 -12.30 22.40 -5.26 -12.74 20.40 -5.04 -12.52 21.40 3 0 17.19 -999 ? ZN ZN B 375 >LEU~B 22 -5.60 -7.41 20.91 -5.31 -8.17 18.89 -5.45 -7.79 19.90 3 0 12.66 -999 ? ZN ZN B 375 >ALA~B 23 -4.97 -5.23 25.00 -5.92 -5.35 26.16 -5.45 -5.29 25.58 2 0 10.82 -999 ? ZN ZN B 375 >MET.B 24 -1.79 -3.46 26.26 -0.86 -1.70 23.68 -1.33 -2.58 24.97 2 0 9.91 -999 ? ZN ZN B 375 >GLU.B 25 1.46 -5.92 31.01 3.44 -6.69 31.23 2.45 -6.31 31.12 2 0 18.70 -999 ? ZN ZN B 375 >GLY.B 26 -1.82 -2.93 32.32 -2.26 -3.11 31.69 -2.04 -3.02 32.01 1 0 14.28 -999 ? ZN ZN B 375 >ASP.B 27 -5.26 -2.13 28.94 -6.77 -0.82 28.14 -6.01 -1.48 28.54 2 0 8.17 -999 ? ZN ZN B 375 >LYS.B 28 -8.34 -2.26 32.25 -5.11 -1.56 35.94 -6.72 -1.91 34.10 2 0 11.75 -999 ? C7 EPE B 376 >ILE.B 29 -10.13 -4.74 28.72 -9.18 -5.11 27.79 -9.66 -4.92 28.26 3 0 11.17 -999 ? ZN ZN B 375 >GLY^B 30 -13.71 -6.55 30.41 -13.82 -5.76 30.60 -13.76 -6.15 30.51 1 0 14.63 -999 ? ZN ZN B 375 >LEU^B 31 -17.47 -7.86 33.12 -19.57 -7.93 33.73 -18.52 -7.90 33.42 3 0 18.32 -999 ? C3 EPE B 376 >GLN^B 32 -14.90 -2.46 33.71 -13.74 -0.70 33.74 -14.32 -1.58 33.72 2 0 10.25 -999 ? C3 EPE B 376 >ILE^B 33 -20.39 -2.06 36.64 -20.73 -0.83 37.25 -20.56 -1.45 36.94 3 0 13.37 -999 ? C3 EPE B 376 >GLY.B 34 -22.85 -5.92 36.81 -22.11 -6.23 36.83 -22.48 -6.07 36.82 1 0 18.31 -999 ? C3 EPE B 376 >ALA.B 35 -23.34 -9.45 35.51 -24.16 -10.31 36.41 -23.75 -9.88 35.96 2 0 22.69 -999 ? C3 EPE B 376 >LEU.B 36 -22.36 -11.01 31.26 -21.18 -9.40 30.25 -21.77 -10.21 30.76 3 0 21.45 -999 ? ZN ZN B 375 >ASN.B 37 -25.23 -15.05 33.87 -25.13 -14.38 35.90 -25.18 -14.72 34.88 2 0 26.70 -999 ? C3 EPE B 376 >LYS.B 38 -28.97 -12.32 32.11 -27.27 -6.31 33.15 -28.12 -9.31 32.63 2 0 21.80 -999 ? C3 EPE B 376 >PRO.B 39 -32.92 -12.87 30.34 -30.99 -11.94 29.73 -31.95 -12.40 30.04 3 0 29.82 -999 ? ZN ZN B 375 >VAL.B 40 -30.18 -8.81 26.90 -28.09 -8.07 27.08 -29.14 -8.44 26.99 3 0 24.68 -999 ? ZN ZN B 375 >ARG.B 41 -35.98 -7.63 26.12 -37.66 -10.05 26.93 -36.82 -8.84 26.52 2 0 32.79 -999 ? ZN ZN B 375 >HIS^B 42 -32.72 -2.76 23.44 -34.69 -2.87 22.69 -33.70 -2.81 23.07 3 0 26.13 -999 ? ZN ZN B 375 >VAL^B 43 -26.87 -3.18 23.92 -25.28 -4.67 23.63 -26.07 -3.93 23.77 3 0 19.41 -999 ? ZN ZN B 375 >LEU^B 44 -25.93 1.38 24.86 -26.10 3.53 24.59 -26.02 2.46 24.72 3 0 17.53 -999 ? ZN ZN B 374 >ILE^B 45 -21.63 0.89 20.85 -20.94 -0.39 20.98 -21.29 0.25 20.92 3 0 13.38 -999 ? ZN ZN B 375 >ALA^B 46 -20.28 4.12 23.98 -20.70 4.20 25.49 -20.49 4.16 24.73 2 0 12.02 -999 ? ZN ZN B 374 >LEU.B 47 -16.64 7.19 23.14 -14.64 7.83 22.57 -15.64 7.51 22.86 3 0 6.75 -999 ? ZN ZN B 374 >ASP.B 48 -17.03 8.88 27.62 -15.41 9.62 26.60 -16.22 9.25 27.11 2 0 7.36 -999 ? ZN ZN B 374 >VAL.B 49 -19.66 6.27 30.07 -20.03 4.22 30.76 -19.85 5.25 30.42 3 0 10.73 -999 ? C3 EPE B 376 >THR~B 50 -20.93 9.59 31.40 -20.95 10.91 29.74 -20.94 10.25 30.57 2 0 11.38 -999 ? C2 EPE B 376 >GLU~B 51 -25.55 10.19 35.45 -25.80 11.09 37.35 -25.67 10.64 36.40 2 0 11.61 -999 ? O3S EPE B 376 >GLU~B 52 -26.20 13.19 30.44 -25.34 14.95 29.81 -25.77 14.07 30.13 2 0 15.59 -999 ? C2 EPE B 376 >VAL~B 53 -24.92 7.78 28.47 -23.09 7.12 27.42 -24.00 7.45 27.94 3 0 14.93 -999 ? C2 EPE B 376 >VAL~B 54 -26.33 5.79 31.41 -25.28 5.09 33.22 -25.81 5.44 32.32 3 0 14.54 -999 ? C2 EPE B 376 >ASP~B 55 -29.80 9.25 31.21 -29.50 10.07 33.15 -29.65 9.66 32.18 2 0 16.89 -999 ? O3S EPE B 376 >GLU~B 56 -28.81 7.12 24.95 -27.13 7.39 23.64 -27.97 7.26 24.29 2 0 18.10 -999 ? ZN ZN B 374 >ALA~B 57 -29.17 3.22 27.98 -28.03 2.53 28.68 -28.60 2.87 28.33 2 0 18.97 -999 ? C2 EPE B 376 >ILE~B 58 -31.90 4.20 31.89 -32.05 4.42 33.42 -31.98 4.31 32.66 3 0 20.36 -999 ? C2 EPE B 376 >GLN~B 59 -34.97 6.81 26.56 -34.24 8.19 25.10 -34.60 7.50 25.83 2 0 24.78 -999 ? C2 EPE B 376 >LEU~B 60 -32.08 2.39 24.63 -31.26 3.48 22.97 -31.67 2.93 23.80 3 0 22.96 -999 ? ZN ZN B 374 >GLY~B 61 -33.79 -0.43 27.77 -33.06 -0.20 27.38 -33.42 -0.31 27.57 1 0 25.18 -999 ? C2 EPE B 376 >ALA.B 62 -30.17 -1.37 27.22 -29.17 -0.49 26.46 -29.67 -0.93 26.84 2 0 21.54 -999 ? ZN ZN B 374 >ASN.B 63 -29.72 -4.44 30.85 -30.01 -6.28 29.82 -29.87 -5.36 30.33 2 0 24.52 -999 ? C3 EPE B 376 >VAL^B 64 -25.30 -3.75 28.70 -24.30 -5.66 28.18 -24.80 -4.71 28.44 3 0 19.63 -999 ? ZN ZN B 375 >ILE^B 65 -22.91 0.41 28.48 -23.27 1.78 28.71 -23.09 1.09 28.60 3 0 15.80 -999 ? ZN ZN B 374 >ILE^B 66 -19.81 -2.59 24.51 -19.43 -3.87 23.81 -19.62 -3.23 24.16 3 0 13.53 -999 ? ZN ZN B 375 >ALA^B 67 -17.51 1.20 26.23 -17.65 1.96 27.53 -17.58 1.58 26.88 2 0 10.44 -999 ? ZN ZN B 374 >HIS.B 68 -12.57 2.98 23.02 -10.64 2.83 22.25 -11.60 2.90 22.63 3 0 -3.38 -999 ? ZN ZN B 375s >HIS.B 69 -12.32 6.27 26.70 -11.45 7.45 25.21 -11.89 6.86 25.96 3 0 -3.36 -999 ? ZN ZN B 374s >PRO.B 70 -10.70 1.54 30.29 -12.78 2.44 30.33 -11.74 1.99 30.31 3 0 8.27 -999 ? ZN ZN B 374 >LEU.B 71 -16.85 3.04 33.82 -18.31 4.35 34.89 -17.58 3.69 34.36 3 0 7.97 -999 ? C3 EPE B 376 >ILE.B 72 -13.43 0.94 37.02 -13.85 0.31 38.24 -13.64 0.63 37.63 3 0 8.46 -999 ? C3 EPE B 376 >PHE.B 73 -7.83 3.89 33.63 -5.47 3.39 32.20 -6.65 3.64 32.91 3 0 6.98 -999 ? C7 EPE B 376 >ASN.B 74 -8.12 5.35 39.22 -7.06 6.68 37.98 -7.59 6.02 38.60 2 0 -4.36 -999 ? C8 EPE B 376s >PRO.B 75 -6.97 0.75 41.44 -8.88 1.63 40.61 -7.92 1.19 41.03 3 0 9.51 -999 ? C5 EPE B 376 >LEU.B 76 -13.50 2.06 43.26 -14.66 2.49 41.49 -14.08 2.28 42.38 3 0 8.52 -999 ? N1 EPE B 376 >LYS.B 77 -11.11 3.17 47.04 -5.49 6.11 47.22 -8.30 4.64 47.13 2 0 10.81 -999 ? C10 EPE B 376 >ALA.B 78 -14.76 4.18 47.71 -14.60 5.45 48.54 -14.68 4.81 48.12 2 0 7.78 -999 ? O2S EPE B 376 >ILE.B 79 -19.01 3.53 45.69 -19.33 2.53 44.64 -19.17 3.03 45.16 3 0 9.21 -999 ? O2S EPE B 376 >HIS.B 80 -17.26 9.01 48.35 -15.80 8.65 49.80 -16.53 8.83 49.07 3 0 6.72 -999 ? O2S EPE B 376 >THR.B 81 -22.85 8.49 45.84 -23.89 7.07 47.06 -23.37 7.78 46.45 2 0 10.70 -999 ? O2S EPE B 376 >ASP.B 82 -22.38 12.66 48.09 -22.95 14.65 48.48 -22.66 13.65 48.29 2 0 10.62 -999 ? O3S EPE B 376 >LYS~B 83 -20.11 12.86 43.96 -14.92 12.31 47.32 -17.52 12.59 45.64 2 0 4.34 -999 ? O1S EPE B 376 >ALA~B 84 -20.72 12.80 40.22 -20.43 13.90 39.21 -20.57 13.35 39.72 2 0 5.93 -999 ? O3S EPE B 376 >TYR~B 85 -16.40 8.45 39.29 -15.27 6.03 38.43 -15.84 7.24 38.86 3 0 3.87 -999 ? C2 EPE B 376 >GLY~B 86 -20.10 7.74 42.37 -20.48 8.20 41.79 -20.29 7.97 42.08 1 0 6.17 -999 ? O2S EPE B 376 >LYS~B 87 -23.51 8.76 41.04 -24.49 13.82 43.31 -24.00 11.29 42.18 2 0 9.60 -999 ? O3S EPE B 376 >ILE~B 88 -21.46 7.42 36.75 -20.79 7.94 35.59 -21.12 7.68 36.17 3 0 8.50 -999 ? C2 EPE B 376 >ILE~B 89 -20.50 3.71 40.39 -19.35 3.27 40.76 -19.92 3.49 40.57 3 0 9.23 -999 ? O2S EPE B 376 >GLU~B 90 -26.35 5.03 43.39 -26.95 6.71 44.51 -26.65 5.87 43.95 2 0 12.95 -999 ? O2S EPE B 376 >LYS~B 91 -26.96 4.56 38.63 -29.49 9.20 36.26 -28.23 6.88 37.45 2 0 15.73 -999 ? O3S EPE B 376 >CYH~B 92 -25.52 1.51 36.84 -23.55 2.45 35.15 -24.53 1.98 36.00 2 0 13.05 -999 ? C2 EPE B 376 >ILE~B 93 -25.22 -0.49 41.32 -24.50 -1.78 41.64 -24.86 -1.13 41.48 3 0 15.68 -999 ? O2S EPE B 376 >LYS~B 94 -29.53 0.46 40.71 -30.43 3.58 45.55 -29.98 2.02 43.13 2 0 17.44 -999 ? O2S EPE B 376 >ASN~B 95 -30.82 1.14 36.18 -31.61 2.89 37.07 -31.22 2.01 36.63 2 0 19.50 -999 ? O2S EPE B 376 >ASP.B 96 -29.98 -4.37 36.65 -30.49 -4.93 38.64 -30.24 -4.65 37.65 2 0 22.64 -999 ? O2S EPE B 376 >ILE.B 97 -26.66 -0.42 33.33 -27.54 -0.09 32.23 -27.10 -0.26 32.78 3 0 17.95 -999 ? C2 EPE B 376 >ALA^B 98 -23.64 -3.90 33.07 -23.65 -5.30 32.62 -23.64 -4.60 32.84 2 0 18.79 -999 ? C3 EPE B 376 >ILE^B 99 -20.12 -0.82 32.82 -20.63 0.35 32.19 -20.38 -0.24 32.51 3 0 13.08 -999 ? C3 EPE B 376 >TYR^B 100 -17.63 -5.70 28.19 -15.74 -7.29 26.85 -16.69 -6.49 27.52 3 0 14.57 -999 ? ZN ZN B 375 >ALA^B 101 -14.73 -2.17 28.75 -13.66 -1.71 29.80 -14.20 -1.94 29.27 2 0 11.06 -999 ? ZN ZN B 375 >ALA.B 102 -13.15 -2.66 25.34 -14.20 -2.84 24.29 -13.68 -2.75 24.82 2 0 9.36 -999 ? ZN ZN B 375 >HIS~B 103 -8.91 1.52 26.66 -7.77 3.28 26.73 -8.34 2.40 26.69 3 0 5.04 -999 ? ZN ZN B 375 >THR~B 104 -6.78 -0.91 23.63 -5.15 -0.73 25.06 -5.97 -0.82 24.35 2 0 6.79 -999 ? ZN ZN B 375 >ASN~B 105 -8.71 -5.38 22.66 -10.29 -4.82 23.98 -9.50 -5.10 23.32 2 0 9.47 -999 ? ZN ZN B 375 >VAL~B 106 -10.40 -1.85 20.05 -12.49 -1.20 20.20 -11.45 -1.53 20.12 3 0 6.75 -999 ? ZN ZN B 375 >ASP~B 107 -6.47 1.09 20.08 -7.49 2.52 21.22 -6.98 1.81 20.65 2 0 -2.23 -999 ? ZN ZN B 375s >VAL~B 108 -5.25 -2.64 18.06 -3.55 -3.49 19.20 -4.40 -3.06 18.63 3 0 9.11 -999 ? ZN ZN B 375 >ALA~B 109 -7.64 -4.92 16.15 -8.93 -5.45 16.76 -8.29 -5.19 16.46 2 0 11.08 -999 ? ZN ZN B 375 >LYS.B 110 -8.36 -4.86 12.39 -7.58 -9.04 11.62 -7.97 -6.95 12.00 2 0 16.94 -999 ? ZN ZN B 375 >GLY.B 111 -11.60 -2.92 11.75 -11.04 -2.69 12.33 -11.32 -2.80 12.04 1 0 12.91 -999 ? ZN ZN B 375 >GLY~B 112 -10.98 -0.97 15.01 -10.85 -0.63 14.30 -10.92 -0.80 14.65 1 0 9.09 -999 ? ZN ZN B 375 >VAL~B 113 -10.54 2.71 15.93 -10.40 3.87 17.78 -10.47 3.29 16.86 3 0 5.59 -999 ? ZN ZN B 375 >ASN~B 114 -6.09 3.05 14.26 -5.63 4.05 16.11 -5.86 3.55 15.18 2 0 6.61 -999 ? ZN ZN B 375 >ASP~B 115 -9.21 0.02 10.54 -7.53 -1.35 10.38 -8.37 -0.66 10.46 2 0 12.98 -999 ? ZN ZN B 375 >LEU~B 116 -12.97 3.46 12.27 -14.57 2.06 12.63 -13.77 2.76 12.45 3 0 11.00 -999 ? ZN ZN B 375 >LEU~B 117 -9.22 7.32 12.53 -9.80 8.32 14.31 -9.51 7.82 13.42 3 0 9.34 -999 ? ZN ZN B 375 >ALA~B 118 -7.92 6.00 8.46 -6.87 4.90 8.37 -7.39 5.45 8.42 2 0 13.77 -999 ? ZN ZN B 375 >GLU~B 119 -11.67 2.61 5.82 -11.38 1.03 7.26 -11.52 1.82 6.54 2 0 15.38 -999 ? ZN ZN B 375 >ALA~B 120 -12.64 8.39 7.33 -13.08 8.77 8.73 -12.86 8.58 8.03 2 0 14.73 -999 ? ZN ZN B 375 >LEU~B 121 -8.19 10.48 7.06 -7.92 11.73 8.82 -8.06 11.11 7.94 3 0 15.66 -999 ? ZN ZN B 375 >GLY~B 122 -9.36 8.56 2.89 -8.77 8.49 3.46 -9.06 8.52 3.18 1 0 19.62 -999 ? ZN ZN B 375 >LEU.B 123 -5.20 6.91 4.85 -4.58 8.66 5.96 -4.89 7.79 5.40 3 0 17.38 -999 ? ZN ZN B 375 >GLN^B 124 -4.90 6.08 -1.05 -6.82 5.52 -1.70 -5.86 5.80 -1.38 2 0 23.82 -999 ? ZN ZN B 375 >ASN^B 125 -0.95 2.05 0.48 -1.46 1.54 -1.51 -1.21 1.79 -0.52 2 0 24.74 -999 ? ZN ZN B 375 >THR^B 126 -2.13 1.87 5.25 -4.16 2.03 5.84 -3.14 1.95 5.55 2 0 16.92 -999 ? ZN ZN B 375 >GLU^B 127 2.11 -0.28 5.62 1.83 -2.30 4.96 1.97 -1.29 5.29 2 0 21.05 -999 ? ZN ZN B 375 >VAL^B 128 0.39 -0.46 11.26 0.17 -2.24 12.58 0.28 -1.35 11.92 3 0 14.57 -999 ? ZN ZN B 375 >LEU^B 129 1.43 3.82 13.29 2.28 5.79 13.44 1.86 4.80 13.36 3 0 13.57 -999 ? ZN ZN B 375 >ALA^B 130 3.26 0.96 16.13 3.04 1.82 17.39 3.15 1.39 16.76 2 0 12.75 -999 ? ZN ZN B 375 >PRO^B 131 5.18 -2.46 14.29 3.66 -2.13 15.89 4.42 -2.29 15.09 3 0 16.14 -999 ? ZN ZN B 375 >THR^B 132 2.33 -4.54 19.20 0.63 -3.26 19.73 1.48 -3.90 19.47 2 0 12.12 -999 ? ZN ZN B 375 >TYR^B 133 -0.70 -9.54 18.25 -1.85 -12.04 17.66 -1.28 -10.79 17.95 3 0 17.24 -999 ? ZN ZN B 375 >ALA^B 134 2.44 -10.57 15.47 3.90 -10.65 15.03 3.17 -10.61 15.25 2 0 19.13 -999 ? O1S EPE A 377 >GLU^B 135 -1.29 -15.58 14.93 -2.99 -16.30 13.82 -2.14 -15.94 14.37 2 0 15.63 -999 ? O1S EPE A 377 >GLU^B 136 3.06 -17.26 18.13 4.41 -17.23 19.78 3.73 -17.24 18.95 2 0 17.92 -999 ? O1S EPE A 377 >MET^B 137 3.03 -19.66 13.17 1.49 -18.13 10.61 2.26 -18.90 11.89 2 0 10.79 -999 ? O1S EPE A 377 >LYS^B 138 3.52 -23.27 14.19 3.97 -21.31 18.72 3.75 -22.29 16.45 2 0 15.17 -999 ? O1S EPE A 377 >LYS^B 139 4.48 -26.42 12.36 5.89 -27.34 7.19 5.18 -26.88 9.77 2 0 -2.84 -999 ? O2S EPE A 377s >VAL^B 140 2.40 -29.34 13.57 0.33 -29.29 14.30 1.36 -29.32 13.94 3 0 9.56 -999 ? O2S EPE A 377 >VAL^B 141 3.87 -32.83 13.18 5.98 -33.09 12.78 4.92 -32.96 12.98 3 0 8.94 -999 ? O2S EPE A 377 >VAL^B 142 1.69 -35.93 13.75 -0.47 -36.17 13.24 0.61 -36.05 13.50 3 0 11.88 -999 ? O2S EPE A 377 >PHE^B 143 4.74 -39.41 14.59 7.03 -37.80 14.65 5.88 -38.60 14.62 3 0 13.71 -999 ? O2S EPE A 377 >VAL^B 144 -0.31 -41.74 12.04 -1.99 -40.63 11.18 -1.15 -41.19 11.61 3 0 15.20 -999 ? O2S EPE A 377 >PRO^B 145 -1.47 -45.89 13.06 -0.37 -44.80 11.41 -0.92 -45.34 12.24 3 0 18.88 -999 ? O2S EPE A 377 >VAL.B 146 -0.12 -45.90 7.27 1.37 -46.90 6.00 0.63 -46.40 6.63 3 0 18.11 -999 ? O2S EPE A 377 >THR.B 147 -3.81 -47.06 7.27 -3.98 -48.68 8.71 -3.89 -47.87 7.99 2 0 21.84 -999 ? O3S EPE A 377 >HIS~B 148 -6.64 -44.75 10.12 -7.62 -46.49 10.77 -7.13 -45.62 10.44 3 0 20.83 -999 ? O3S EPE A 377 >ALA~B 149 -2.60 -41.23 7.10 -1.27 -41.62 6.49 -1.93 -41.42 6.80 2 0 14.00 -999 ? O3S EPE A 377 >GLU~B 150 -6.18 -40.46 2.00 -5.62 -38.68 0.95 -5.90 -39.57 1.47 2 0 12.97 -999 ? C6 EPE A 377 >GLU~B 151 -9.61 -39.78 7.97 -10.79 -41.15 9.06 -10.20 -40.47 8.51 2 0 19.22 -999 ? O3S EPE A 377 >VAL~B 152 -5.73 -37.45 8.95 -4.57 -37.92 10.75 -5.15 -37.68 9.85 3 0 13.46 -999 ? O3S EPE A 377 >ARG~B 153 -1.46 -36.52 4.12 -1.19 -38.78 2.09 -1.33 -37.65 3.11 2 0 10.73 -999 ? C6 EPE A 377 >LYS~B 154 -7.89 -34.48 4.91 -13.85 -35.95 3.01 -10.87 -35.22 3.96 2 0 18.23 -999 ? O3S EPE A 377 >ALA~B 155 -8.89 -33.90 8.54 -8.69 -34.90 9.66 -8.79 -34.40 9.10 2 0 14.26 -999 ? O3S EPE A 377 >LEU~B 156 -4.58 -31.69 9.17 -3.25 -32.44 10.76 -3.91 -32.06 9.96 3 0 9.59 -999 ? O3S EPE A 377 >GLY~B 157 -6.61 -29.59 5.82 -7.19 -29.80 6.34 -6.90 -29.69 6.08 1 0 9.55 -999 ? O3S EPE A 377 >ASP~B 158 -11.33 -30.60 6.63 -11.83 -31.70 4.85 -11.58 -31.15 5.74 2 0 14.93 -999 ? O3S EPE A 377 >ALA~B 159 -9.80 -27.22 9.41 -9.47 -27.83 10.78 -9.64 -27.53 10.09 2 0 13.92 -999 ? O3S EPE A 377 >GLY.B 160 -7.67 -24.84 7.30 -7.31 -25.39 7.61 -7.49 -25.11 7.45 1 0 11.45 -999 ? O3S EPE A 377 >ALA.B 161 -4.10 -26.00 8.07 -3.75 -27.17 8.94 -3.93 -26.58 8.51 2 0 8.19 -999 ? O3S EPE A 377 >GLY.B 162 -1.71 -25.67 5.15 -2.30 -25.15 5.24 -2.00 -25.41 5.19 1 0 5.31 -999 ? O3S EPE A 377 >HIS.B 163 -4.89 -20.97 2.80 -5.63 -19.63 1.37 -5.26 -20.30 2.08 3 0 11.54 -999 ? O3S EPE A 377 >ILE.B 164 1.33 -22.12 1.59 2.61 -22.59 2.06 1.97 -22.36 1.83 3 0 -5.50 -999 ? O1S EPE A 377s >GLY.B 165 -0.63 -18.46 -0.95 -1.10 -19.11 -0.69 -0.87 -18.78 -0.82 1 0 10.94 -999 ? O1S EPE A 377 >ASN.B 166 -2.65 -19.38 -5.26 -2.77 -17.28 -5.58 -2.71 -18.33 -5.42 2 0 12.55 -999 ? O8 EPE A 377 >TYR^B 167 -0.72 -24.00 -3.91 0.54 -23.91 -6.42 -0.09 -23.95 -5.17 3 0 5.54 -999 ? O8 EPE A 377 >SER^B 168 -4.73 -25.07 0.35 -6.94 -24.95 1.40 -5.83 -25.01 0.88 2 0 10.59 -999 ? O3S EPE A 377 >HIS^B 169 -6.90 -28.98 1.72 -8.94 -28.69 2.07 -7.92 -28.83 1.89 3 0 10.86 -999 ? O3S EPE A 377 >CYH^B 170 -0.70 -28.36 2.22 -0.22 -26.07 0.51 -0.46 -27.22 1.37 2 0 -5.04 -999 ? N1 EPE A 377s >THR^B 171 0.89 -31.19 4.26 -0.81 -32.58 4.42 0.04 -31.88 4.34 2 0 -5.46 -999 ? O3S EPE A 377s >PHE^B 172 6.52 -33.24 3.28 8.59 -34.82 2.34 7.56 -34.03 2.81 3 0 6.04 -999 ? C9 EPE A 377 >SER^B 173 4.35 -36.83 4.64 1.88 -36.99 4.49 3.12 -36.91 4.57 2 0 8.63 -999 ? C9 EPE A 377 >SER^B 174 7.43 -39.02 5.18 8.88 -37.11 5.67 8.16 -38.06 5.42 2 0 9.21 -999 ? O2S EPE A 377 >GLU^B 175 6.08 -43.60 3.61 5.68 -45.21 2.31 5.88 -44.41 2.96 2 0 16.09 -999 ? C9 EPE A 377 >GLY^B 176 9.40 -43.99 8.52 8.65 -44.36 8.52 9.03 -44.18 8.52 1 0 16.19 -999 ? O2S EPE A 377 >THR^B 177 9.43 -46.41 11.44 10.68 -47.97 10.55 10.05 -47.19 10.99 2 0 19.16 -999 ? C2 EPE C 377 >GLY^B 178 8.41 -45.68 15.01 8.59 -46.49 14.79 8.50 -46.09 14.90 1 0 19.88 -999 ? O2S EPE A 377 >THR^B 179 9.45 -47.49 18.16 11.61 -47.34 18.08 10.53 -47.42 18.12 2 0 20.09 -999 ? C2 EPE C 377 >PHE^B 180 5.49 -47.88 21.09 3.41 -49.53 20.15 4.45 -48.70 20.62 3 0 25.23 -999 ? O2S EPE A 377 >VAL^B 181 7.78 -49.90 24.77 9.59 -50.98 25.42 8.68 -50.44 25.09 3 0 27.14 -999 ? O1 TRS A 378 >PRO^B 182 3.89 -51.51 24.90 5.08 -50.25 26.36 4.49 -50.88 25.63 3 0 29.94 -999 ? N TRS A 378 >GLN.B 183 7.41 -49.44 30.49 8.75 -47.79 30.78 8.08 -48.61 30.63 2 0 25.94 -999 ? O1 TRS A 378 >GLN.B 195 7.50 -55.59 25.09 5.78 -56.84 25.13 6.64 -56.22 25.11 2 0 33.03 -999 ? C2 EPE C 377 >LEU.B 196 12.41 -55.05 20.65 12.75 -57.23 20.13 12.58 -56.14 20.39 3 0 26.88 -999 ? C2 EPE C 377 >GLU^B 197 6.54 -53.58 20.85 4.69 -53.18 21.76 5.61 -53.38 21.31 2 0 29.51 -999 ? O2S EPE A 377 >ARG^B 198 11.64 -52.94 14.57 14.19 -52.83 16.31 12.91 -52.89 15.44 2 0 21.95 -999 ? C2 EPE C 377 >VAL^B 199 5.46 -49.70 13.69 3.81 -48.69 14.79 4.64 -49.19 14.24 3 0 22.32 -999 ? O2S EPE A 377 >GLU^B 200 6.58 -49.91 8.32 6.28 -50.66 6.33 6.43 -50.29 7.33 2 0 21.89 -999 ? O2S EPE A 377 >GLU^B 201 3.89 -44.87 12.99 4.21 -43.80 14.75 4.05 -44.33 13.87 2 0 17.83 -999 ? O2S EPE A 377 >VAL^B 202 3.82 -41.64 8.59 2.58 -41.50 6.80 3.20 -41.57 7.70 3 0 13.09 -999 ? O2S EPE A 377 >ARG^B 203 8.58 -36.69 10.51 9.21 -33.68 10.79 8.90 -35.18 10.65 2 0 8.69 -999 ? O2S EPE A 377 >ILE^B 204 1.22 -35.92 8.55 0.05 -36.37 7.93 0.64 -36.15 8.24 3 0 9.00 -999 ? O2S EPE A 377 >GLU^B 205 5.77 -31.61 7.46 7.86 -31.06 7.53 6.82 -31.34 7.50 2 0 4.50 -999 ? O2S EPE A 377 >THR^B 206 1.50 -28.89 8.33 -0.67 -28.86 8.55 0.41 -28.87 8.44 2 0 5.63 -999 ? O3S EPE A 377 >ILE^B 207 2.53 -24.15 8.19 2.79 -22.88 7.58 2.66 -23.51 7.88 3 0 4.82 -999 ? O1S EPE A 377 >ILE^B 208 -1.70 -24.29 12.20 -1.92 -25.33 13.04 -1.81 -24.81 12.62 3 0 10.23 -999 ? O1S EPE A 377 >PRO^B 209 -2.80 -19.50 10.65 -1.44 -20.50 12.15 -2.12 -20.00 11.40 3 0 11.43 -999 ? O1S EPE A 377 >ALA.B 210 -1.53 -20.24 16.39 -0.69 -19.53 17.41 -1.11 -19.88 16.90 2 0 15.50 -999 ? O1S EPE A 377 >SER.B 211 -5.21 -19.23 16.51 -5.80 -18.14 14.41 -5.51 -18.69 15.46 2 0 16.40 -999 ? O1S EPE A 377 >LEU~B 212 -5.99 -22.60 13.08 -7.30 -21.84 11.49 -6.64 -22.22 12.29 3 0 13.91 -999 ? O3S EPE A 377 >GLN~B 213 -2.28 -25.33 18.62 -0.54 -24.65 19.67 -1.41 -24.99 19.14 2 0 15.99 -999 ? O1S EPE A 377 >ARG~B 214 -7.68 -23.63 22.44 -8.04 -24.96 25.17 -7.86 -24.30 23.81 2 0 23.93 -999 ? O3S EPE A 377 >LYS~B 215 -9.31 -26.31 16.29 -12.50 -24.00 11.24 -10.90 -25.16 13.77 2 0 17.38 -999 ? O3S EPE A 377 >VAL~B 216 -6.83 -28.22 14.05 -5.28 -27.59 12.58 -6.06 -27.91 13.31 3 0 12.75 -999 ? O3S EPE A 377 >ILE~B 217 -4.71 -29.77 18.11 -4.22 -29.62 19.49 -4.46 -29.70 18.80 3 0 16.43 -999 ? O3S EPE A 377 >LYS~B 218 -9.21 -31.38 17.78 -12.41 -28.97 21.74 -10.81 -30.18 19.76 2 0 23.26 -999 ? O3S EPE A 377 >ALA~B 219 -9.85 -32.42 14.17 -10.02 -31.40 13.03 -9.93 -31.91 13.60 2 0 15.85 -999 ? O3S EPE A 377 >MET~B 220 -6.53 -34.33 14.17 -2.53 -33.87 15.25 -4.53 -34.10 14.71 2 0 13.50 -999 ? O3S EPE A 377 >VAL~B 221 -6.89 -36.18 17.46 -6.27 -35.67 19.54 -6.58 -35.93 18.50 3 0 18.74 -999 ? O3S EPE A 377 >THR~B 222 -10.58 -37.08 17.00 -12.43 -36.02 17.53 -11.51 -36.55 17.27 2 0 21.64 -999 ? O3S EPE A 377 >ALA.B 223 -9.77 -38.36 13.49 -9.66 -37.46 12.27 -9.71 -37.91 12.88 2 0 17.38 -999 ? O3S EPE A 377 >HIS.B 224 -4.29 -40.29 15.37 -2.45 -41.31 15.36 -3.37 -40.80 15.36 3 0 17.79 -999 ? O2S EPE A 377 >PRO.B 225 -5.76 -44.28 13.45 -6.66 -43.49 15.32 -6.21 -43.88 14.39 3 0 20.63 -999 ? O3S EPE A 377 >TYR.B 226 -2.18 -44.73 18.44 0.01 -45.92 17.08 -1.09 -45.32 17.76 3 0 21.63 -999 ? O2S EPE A 377 >GLU.B 227 -9.17 -41.16 20.05 -10.13 -42.87 19.25 -9.65 -42.01 19.65 2 0 24.58 -999 ? O3S EPE A 377 >GLU.B 228 -2.18 -42.16 24.63 -2.03 -43.87 25.91 -2.11 -43.02 25.27 2 0 26.61 -999 ? O2S EPE A 377 >VAL.B 229 -1.81 -39.25 19.78 -2.91 -38.22 18.18 -2.36 -38.73 18.98 3 0 18.54 -999 ? O2S EPE A 377 >ALA.B 230 1.92 -38.64 19.31 2.89 -39.78 18.96 2.40 -39.21 19.13 2 0 17.80 -999 ? O2S EPE A 377 >TYR^B 231 0.21 -33.87 18.84 -0.97 -32.67 21.03 -0.38 -33.27 19.94 3 0 16.39 -999 ? O2S EPE A 377 >ASP^B 232 6.16 -32.41 17.86 6.89 -34.31 18.36 6.52 -33.36 18.11 2 0 14.54 -999 ? O2S EPE A 377 >VAL^B 233 4.19 -28.47 18.01 2.32 -27.56 18.53 3.25 -28.01 18.27 3 0 13.35 -999 ? O2S EPE A 377 >TYR^B 234 8.50 -28.26 15.53 9.64 -30.80 15.55 9.07 -29.53 15.54 3 0 11.34 -999 ? O2S EPE A 377 >PRO^B 235 8.91 -22.99 18.73 7.42 -23.38 17.08 8.17 -23.18 17.91 3 0 14.39 -999 ? O1S EPE A 377 >LEU^B 236 7.64 -21.45 12.38 7.43 -23.27 11.24 7.53 -22.36 11.81 3 0 9.09 -999 ? O1S EPE A 377 >ASP^B 237 11.84 -17.75 12.41 13.28 -17.47 14.02 12.56 -17.61 13.21 2 0 15.58 -999 ? N TRS A 378 >ASN^B 238 7.11 -18.54 9.31 8.52 -20.00 8.45 7.82 -19.27 8.88 2 0 8.84 -999 ? O1S EPE A 377 >LYS^B 239 5.23 -14.71 11.35 7.06 -15.38 16.25 6.15 -15.04 13.80 2 0 16.51 -999 ? O1S EPE A 377 >GLY^B 240 1.60 -13.95 10.45 2.15 -13.33 10.77 1.87 -13.64 10.61 1 0 14.23 -999 ? O1S EPE A 377 >GLU^B 241 -1.76 -10.13 8.02 -3.43 -8.87 7.45 -2.60 -9.50 7.74 2 0 19.53 -999 ? O1S EPE A 377 >THR^B 242 1.06 -7.67 12.24 3.05 -6.84 12.40 2.06 -7.26 12.32 2 0 18.76 -999 ? ZN ZN B 375 >LEU^B 243 -2.34 -6.48 15.24 -4.14 -7.33 14.39 -3.24 -6.90 14.82 3 0 14.34 -999 ? ZN ZN B 375 >GLY^B 244 -0.61 -2.61 16.62 -1.32 -2.49 16.19 -0.96 -2.55 16.40 1 0 11.85 -999 ? ZN ZN B 375 >LEU^B 245 -1.29 1.71 18.65 -1.87 1.75 20.66 -1.58 1.73 19.65 3 0 7.82 -999 ? ZN ZN B 375 >GLY^B 246 -2.31 3.58 14.78 -2.28 2.80 14.58 -2.30 3.19 14.68 1 0 9.61 -999 ? ZN ZN B 375 >LYS^B 247 -2.25 3.53 11.00 -3.66 -0.30 12.47 -2.96 1.61 11.73 2 0 11.69 -999 ? ZN ZN B 375 >ILE^B 248 1.53 5.19 8.85 2.92 5.26 8.57 2.23 5.23 8.71 3 0 17.17 -999 ? ZN ZN B 375 >GLY^B 249 -1.04 5.72 4.91 -0.82 6.46 5.20 -0.93 6.09 5.05 1 0 18.76 -999 ? ZN ZN B 375 >TYR^B 250 0.70 6.87 1.10 3.12 5.62 1.69 1.91 6.24 1.39 3 0 23.22 -999 ? ZN ZN B 375 >LEU^B 251 -3.28 12.31 0.94 -3.84 13.59 2.55 -3.56 12.95 1.75 3 0 22.61 -999 ? ZN ZN B 375 >GLN^B 252 -7.17 10.75 -4.34 -6.78 9.29 -5.86 -6.97 10.02 -5.10 2 0 28.38 -999 ? ZN ZN B 375 >GLU^B 253 -5.44 14.03 -5.56 -4.22 13.73 -7.31 -4.83 13.88 -6.44 2 0 31.12 -999 ? ZN ZN B 375 >GLU^B 254 1.12 17.35 -1.99 2.87 17.99 -2.99 2.00 17.67 -2.49 2 0 30.73 -999 ? ZN ZN B 375 >MET^B 255 -2.32 19.07 -0.20 -5.68 17.49 1.86 -4.00 18.28 0.83 2 0 24.27 -999 ? ZN ZN B 375 >THR^B 256 -1.04 21.83 2.11 -1.77 23.76 1.44 -1.41 22.80 1.77 2 0 29.14 -999 ? ZN ZN B 375 >LEU~B 257 0.14 21.76 6.81 0.31 20.97 8.83 0.23 21.37 7.82 3 0 23.76 -999 ? ZN ZN B 374 >GLY~B 258 -3.80 23.92 6.13 -3.78 23.26 5.65 -3.79 23.59 5.89 1 0 25.40 -999 ? ZN ZN B 374 >GLN~B 259 -5.41 23.11 1.24 -4.67 22.70 -0.73 -5.04 22.91 0.26 2 0 29.53 -999 ? ZN ZN B 375 >PHE~B 260 -4.07 16.87 6.20 -4.31 14.59 7.80 -4.19 15.73 7.00 3 0 19.39 -999 ? ZN ZN B 375 >ALA~B 261 -6.29 20.23 8.69 -5.64 21.42 9.38 -5.96 20.82 9.03 2 0 21.05 -999 ? ZN ZN B 374 >GLU~B 262 -9.48 23.81 6.41 -10.83 24.55 7.88 -10.15 24.18 7.14 2 0 24.13 -999 ? ZN ZN B 374 >HIS~B 263 -9.35 15.85 4.33 -10.07 14.01 3.63 -9.71 14.93 3.98 3 0 20.98 -999 ? ZN ZN B 375 >VAL~B 264 -9.61 16.51 9.16 -7.89 16.02 10.42 -8.75 16.27 9.79 3 0 17.12 -999 ? ZN ZN B 375 >LYS~B 265 -12.32 18.80 10.54 -12.89 23.62 10.63 -12.60 21.21 10.58 2 0 21.91 -999 ? ZN ZN B 374 >GLN~B 266 -14.31 19.60 6.00 -15.56 21.05 7.00 -14.94 20.33 6.50 2 0 23.22 -999 ? ZN ZN B 374 >SER~B 267 -13.83 13.99 7.82 -11.74 14.03 6.57 -12.78 14.01 7.19 2 0 18.54 -999 ? ZN ZN B 375 >LEU~B 268 -12.70 13.50 12.39 -11.06 12.13 11.91 -11.88 12.82 12.15 3 0 13.46 -999 ? ZN ZN B 375 >ASP.B 269 -18.05 15.19 12.20 -19.75 16.35 12.84 -18.90 15.77 12.52 2 0 18.26 -999 ? ZN ZN B 374 >VAL.B 270 -15.04 18.43 14.51 -13.13 17.45 15.02 -14.08 17.94 14.76 3 0 15.40 -999 ? ZN ZN B 374 >LYS.B 271 -15.49 22.23 14.65 -19.95 19.84 13.72 -17.72 21.03 14.19 2 0 19.93 -999 ? ZN ZN B 374 >GLY.B 272 -11.90 23.22 15.48 -12.02 22.37 15.54 -11.96 22.79 15.51 1 0 18.77 -999 ? ZN ZN B 374 >ALA.B 273 -8.43 21.62 15.62 -8.14 20.75 14.42 -8.29 21.19 15.02 2 0 17.02 -999 ? ZN ZN B 374 >ARG^B 274 -4.90 23.06 20.40 -3.60 21.04 22.31 -4.25 22.05 21.36 2 0 15.33 -999 ? ZN ZN B 374 >VAL^B 275 -2.07 22.44 14.13 -2.67 22.68 12.03 -2.37 22.56 13.08 3 0 20.37 -999 ? ZN ZN B 374 >VAL^B 276 1.67 22.27 14.69 2.71 21.36 16.39 2.19 21.81 15.54 3 0 20.62 -999 ? ZN ZN B 374 >GLY.B 277 3.65 23.16 11.55 3.12 23.75 11.78 3.39 23.45 11.66 1 0 24.23 -999 ? ZN ZN B 374 >LYS.B 278 3.65 25.62 8.65 8.47 28.09 9.23 6.06 26.86 8.94 2 0 31.34 -999 ? ZN ZN B 374 >LEU.B 279 -0.89 26.78 7.31 -2.14 26.58 9.09 -1.51 26.68 8.20 3 0 26.56 -999 ? ZN ZN B 374 >ASP.B 280 2.63 27.37 3.18 1.41 29.12 3.45 2.02 28.24 3.32 2 0 32.17 -999 ? ZN ZN B 374 >ASP.B 281 4.51 22.24 5.26 6.45 23.04 5.71 5.48 22.64 5.49 2 0 29.04 -999 ? ZN ZN B 374 >LYS^B 282 2.91 20.00 1.64 2.74 22.03 -3.14 2.83 21.02 -0.75 2 0 32.80 -999 ? ZN ZN B 375 >VAL^B 283 1.54 16.78 3.04 0.28 17.56 4.75 0.91 17.17 3.89 3 0 24.18 -999 ? ZN ZN B 375 >ARG^B 284 1.85 12.86 -2.25 0.88 12.89 -5.16 1.36 12.87 -3.70 2 0 30.04 -999 ? ZN ZN B 375 >LYS^B 285 1.97 10.60 4.02 5.48 5.38 4.89 3.72 7.99 4.45 2 0 22.19 -999 ? ZN ZN B 375 >VAL^B 286 -0.28 10.71 7.05 -2.27 11.65 6.87 -1.27 11.18 6.96 3 0 18.11 -999 ? ZN ZN B 375 >ALA^B 287 -0.09 8.91 10.38 1.12 8.85 11.22 0.51 8.88 10.80 2 0 15.22 -999 ? ZN ZN B 375 >VAL^B 288 -3.11 8.72 12.69 -5.08 8.23 11.99 -4.10 8.47 12.34 3 0 11.46 -999 ? ZN ZN B 375 >LEU^B 289 -2.28 7.12 16.77 -1.56 6.18 18.64 -1.92 6.65 17.71 3 0 8.28 -999 ? ZN ZN B 375 >GLY^B 290 -6.82 7.95 18.08 -6.13 7.62 18.39 -6.47 7.78 18.24 1 0 5.66 -999 ? ZN ZN B 375 >GLY^B 291 -6.52 8.91 21.71 -6.06 9.31 21.13 -6.29 9.11 21.42 1 0 4.09 -999 ? ZN ZN B 374 >ASP^B 292 -3.14 9.99 24.96 -1.24 10.75 25.71 -2.19 10.37 25.33 2 0 8.88 -999 ? ZN ZN B 374 >GLY.B 293 -0.50 9.63 20.82 -0.36 10.23 21.34 -0.43 9.93 21.08 1 0 9.60 -999 ? ZN ZN B 374 >ASN.B 294 2.18 12.34 23.84 0.88 14.02 24.05 1.53 13.18 23.94 2 0 12.27 -999 ? ZN ZN B 374 >LYS.B 295 4.57 8.76 22.84 2.39 5.01 24.93 3.48 6.88 23.89 2 0 11.37 -999 ? ZN ZN B 375 >TYR~B 296 3.06 5.94 19.61 2.50 3.84 21.38 2.78 4.89 20.49 3 0 11.48 -999 ? ZN ZN B 375 >ILE~B 297 5.95 12.58 17.93 6.10 13.55 18.88 6.02 13.06 18.40 3 0 17.30 -999 ? ZN ZN B 374 >ASN~B 298 10.01 8.80 17.91 11.11 10.10 19.21 10.56 9.45 18.56 2 0 20.72 -999 ? ZN ZN B 375 >GLN~B 299 6.31 4.03 15.31 7.61 2.36 15.77 6.96 3.20 15.54 2 0 17.46 -999 ? ZN ZN B 375 >ALA~B 300 5.39 8.45 13.10 4.54 9.60 13.56 4.96 9.03 13.33 2 0 16.49 -999 ? ZN ZN B 375 >LYS~B 301 8.36 10.35 11.75 10.05 14.82 9.04 9.20 12.59 10.39 2 0 25.03 -999 ? ZN ZN B 375 >PHE~B 302 11.95 5.09 12.05 13.66 2.98 11.30 12.81 4.03 11.68 3 0 23.76 -999 ? ZN ZN B 375 >LYS~B 303 7.99 5.97 9.05 6.92 1.04 11.01 7.45 3.51 10.03 2 0 19.29 -999 ? ZN ZN B 375 >GLY.B 304 8.09 9.00 6.73 7.56 8.93 7.27 7.83 8.96 7.00 1 0 23.11 -999 ? ZN ZN B 375 >ALA.B 305 4.93 10.77 7.95 4.24 10.56 9.28 4.59 10.66 8.61 2 0 19.14 -999 ? ZN ZN B 375 >ASP.B 306 3.99 14.73 5.36 5.18 14.04 3.76 4.58 14.39 4.56 2 0 24.86 -999 ? ZN ZN B 375 >VAL^B 307 1.76 14.81 9.29 -0.23 15.57 8.69 0.76 15.19 8.99 3 0 19.39 -999 ? ZN ZN B 375 >TYR^B 308 1.32 11.76 14.56 0.84 10.00 16.68 1.08 10.88 15.62 3 0 13.33 -999 ? ZN ZN B 375 >VAL^B 309 -3.15 13.12 13.51 -4.89 13.43 12.13 -4.02 13.27 12.82 3 0 13.64 -999 ? ZN ZN B 375 >THR^B 310 -3.69 12.44 17.22 -2.10 11.84 18.57 -2.90 12.14 17.90 2 0 10.23 -999 ? ZN ZN B 374 >GLY^B 311 -5.28 13.83 20.42 -4.55 13.48 20.52 -4.92 13.66 20.47 1 0 8.79 -999 ? ZN ZN B 374 >ASP.B 312 -4.08 14.12 24.69 -6.01 13.62 25.36 -5.05 13.87 25.03 2 0 7.53 -999 ? ZN ZN B 374 >MET.B 313 -1.01 16.88 22.10 1.78 16.47 20.27 0.38 16.67 21.19 2 0 15.01 -999 ? ZN ZN B 374 >TYR~B 314 2.08 17.58 27.10 3.13 18.35 29.60 2.61 17.97 28.35 3 0 14.73 -999 ? O8 EPE B 376 >TYR~B 315 4.11 23.72 25.55 5.20 26.22 24.94 4.66 24.97 25.24 3 0 21.53 -999 ? O8 EPE B 376 >HIS~B 316 7.45 20.77 27.47 7.65 22.47 28.71 7.55 21.62 28.09 3 0 20.54 -999 ? O8 EPE B 376 >VAL~B 317 5.70 17.10 22.87 4.80 15.15 23.22 5.25 16.13 23.05 3 0 17.09 -999 ? ZN ZN B 374 >ALA~B 318 4.54 19.55 20.17 3.54 20.61 20.36 4.04 20.08 20.27 2 0 19.05 -999 ? ZN ZN B 374 >HIS~B 319 8.16 23.53 21.75 7.85 25.60 21.62 8.01 24.56 21.68 3 0 24.73 -999 ? ZN ZN B 374 >ASP~B 320 9.35 16.65 21.02 10.22 16.89 22.90 9.79 16.77 21.96 2 0 -21.78 -999 ? ZN ZN B 374s >ALA~B 321 7.50 17.37 16.99 6.00 17.39 16.91 6.75 17.38 16.95 2 0 19.77 -999 ? ZN ZN B 374 >MET~B 322 8.65 20.69 15.41 6.89 24.05 17.05 7.77 22.37 16.23 2 0 24.52 -999 ? ZN ZN B 374 >MET~B 323 12.24 19.68 16.05 14.16 20.76 19.55 13.20 20.22 17.80 2 0 24.24 -999 ? O2S EPE A 376 >LEU~B 324 10.75 15.22 14.78 11.25 13.52 16.05 11.00 14.37 15.42 3 0 22.99 -999 ? ZN ZN B 375 >GLY~B 325 10.15 18.18 11.38 9.73 17.62 11.87 9.94 17.90 11.62 1 0 25.63 -999 ? ZN ZN B 375 >LEU.B 326 6.72 15.30 12.83 5.45 13.58 12.99 6.09 14.44 12.91 3 0 20.03 -999 ? ZN ZN B 375 >ASN^B 327 3.03 18.84 10.12 4.53 19.91 9.07 3.78 19.37 9.60 2 0 24.15 -999 ? ZN ZN B 374 >ILE^B 328 0.93 17.58 15.13 1.21 16.93 16.38 1.07 17.25 15.75 3 0 16.79 -999 ? ZN ZN B 374 >VAL^B 329 -3.22 18.08 13.56 -4.48 18.53 11.85 -3.85 18.30 12.70 3 0 17.03 -999 ? ZN ZN B 374 >ASP^B 330 -4.33 18.16 18.13 -5.04 17.21 19.90 -4.69 17.69 19.01 2 0 11.92 -999 ? ZN ZN B 374 >PRO.B 331 -8.20 15.16 15.23 -7.98 17.11 16.35 -8.09 16.14 15.79 3 0 12.56 -999 ? ZN ZN B 374 >GLY~B 332 -9.10 15.99 19.91 -8.87 15.45 19.32 -8.98 15.72 19.61 1 0 10.10 -999 ? ZN ZN B 374 >HIS~B 333 -8.75 11.09 23.63 -8.33 9.23 24.53 -8.54 10.16 24.08 3 0 -3.37 -999 ? ZN ZN B 374s >ASN~B 334 -13.83 13.67 21.41 -15.89 13.09 21.50 -14.86 13.38 21.46 2 0 9.65 -999 ? ZN ZN B 374 >VAL~B 335 -12.57 11.63 17.36 -10.94 12.67 16.39 -11.75 12.15 16.87 3 0 9.42 -999 ? ZN ZN B 374 >GLU~B 336 -10.29 7.50 19.92 -9.48 6.56 21.59 -9.88 7.03 20.76 2 0 2.48 -999 ? ZN ZN B 375s >LYS~B 337 -16.19 8.44 18.66 -16.77 14.07 16.03 -16.48 11.26 17.35 2 0 13.35 -999 ? ZN ZN B 374 >VAL~B 338 -16.08 6.76 15.22 -14.33 7.50 14.21 -15.21 7.13 14.71 3 0 10.27 -999 ? ZN ZN B 375 >MET~B 339 -15.74 3.47 17.20 -16.17 3.12 20.66 -15.96 3.29 18.93 2 0 7.80 -999 ? ZN ZN B 375 >LYS~B 340 -19.41 3.70 18.30 -21.14 8.87 20.36 -20.28 6.29 19.33 2 0 12.84 -999 ? ZN ZN B 374 >GLN~B 341 -22.50 4.14 12.90 -22.55 5.29 11.05 -22.53 4.72 11.97 2 0 17.79 -999 ? ZN ZN B 375 >GLY~B 342 -18.10 1.14 13.74 -18.67 1.02 14.34 -18.39 1.08 14.04 1 0 13.01 -999 ? ZN ZN B 375 >VAL~B 343 -18.57 -1.46 16.53 -17.55 -1.89 18.48 -18.06 -1.67 17.50 3 0 12.08 -999 ? ZN ZN B 375 >GLN~B 344 -24.61 -0.12 16.09 -25.84 1.53 15.46 -25.23 0.70 15.78 2 0 18.67 -999 ? ZN ZN B 375 >LYS~B 345 -22.26 -2.20 12.60 -22.46 0.95 7.82 -22.36 -0.63 10.21 2 0 20.14 -999 ? ZN ZN B 375 >GLN~B 346 -17.50 -3.97 12.92 -15.77 -3.25 13.99 -16.63 -3.61 13.45 2 0 13.15 -999 ? ZN ZN B 375 >LEU~B 347 -21.69 -5.65 17.63 -21.81 -6.90 19.46 -21.75 -6.28 18.54 3 0 17.24 -999 ? ZN ZN B 375 >GLN~B 348 -27.40 -4.91 13.95 -28.54 -5.15 15.71 -27.97 -5.03 14.83 2 0 22.96 -999 ? ZN ZN B 375 >GLU~B 349 -22.55 -8.05 9.47 -20.93 -7.23 8.30 -21.74 -7.64 8.88 2 0 21.77 -999 ? ZN ZN B 375 >LYS~B 350 -22.61 -10.64 13.95 -18.13 -13.35 13.22 -20.37 -12.00 13.58 2 0 21.91 -999 ? ZN ZN B 375 >VAL~B 351 -25.73 -10.98 16.11 -26.06 -9.19 17.33 -25.89 -10.09 16.72 3 0 23.12 -999 ? ZN ZN B 375 >ASP~B 352 -28.14 -9.98 12.04 -29.16 -8.30 12.82 -28.65 -9.14 12.43 2 0 25.82 -999 ? ZN ZN B 375 >ALA~B 353 -25.80 -13.87 11.56 -24.32 -13.83 11.25 -25.06 -13.85 11.41 2 0 26.31 -999 ? ZN ZN B 375 >LYS~B 354 -26.24 -16.01 14.73 -23.79 -17.66 13.12 -25.02 -16.84 13.92 2 0 28.15 -999 ? ZN ZN B 375 >LYS.B 355 -29.99 -15.16 14.74 -32.16 -16.11 9.38 -31.07 -15.64 12.06 2 0 33.64 -999 ? ZN ZN B 375 >LEU.B 356 -28.77 -13.23 18.96 -27.30 -14.74 19.63 -28.03 -13.99 19.30 3 0 26.83 -999 ? ZN ZN B 375 >ASN.B 357 -34.36 -10.98 18.28 -35.73 -11.88 19.64 -35.04 -11.43 18.96 2 0 31.68 -999 ? ZN ZN B 375 >VAL.B 358 -30.95 -8.13 20.25 -28.86 -8.36 20.92 -29.90 -8.24 20.58 3 0 24.77 -999 ? ZN ZN B 375 >HIS^B 359 -31.70 -2.47 18.00 -31.61 -0.90 16.60 -31.66 -1.69 17.30 3 0 24.30 -999 ? ZN ZN B 375 >ILE^B 360 -25.99 -3.41 18.42 -25.33 -4.17 19.43 -25.66 -3.79 18.93 3 0 19.15 -999 ? ZN ZN B 375 >HIS^B 361 -29.54 0.86 20.66 -31.47 0.05 20.77 -30.51 0.46 20.72 3 0 22.30 -999 ? ZN ZN B 375 >ALA^B 362 -24.59 3.58 19.16 -24.10 3.96 17.83 -24.35 3.77 18.50 2 0 16.08 -999 ? ZN ZN B 375 >SER.B 363 -24.68 6.36 21.71 -24.04 7.63 23.71 -24.36 6.99 22.71 2 0 15.02 -999 ? ZN ZN B 374 >GLN.B 364 -28.00 8.56 19.07 -26.98 8.34 17.19 -27.49 8.45 18.13 2 0 19.30 -999 ? ZN ZN B 374 >LEU.B 365 -24.55 11.48 24.42 -26.40 11.68 25.51 -25.47 11.58 24.97 3 0 17.12 -999 ? ZN ZN B 374 >HIS.B 366 -20.57 16.04 20.92 -18.78 16.88 20.21 -19.67 16.46 20.56 3 0 14.78 -999 ? ZN ZN B 374 >THR.B 367 -18.95 13.55 24.81 -19.03 11.36 25.00 -18.99 12.45 24.90 2 0 10.99 -999 ? ZN ZN B 374 >ASP.B 368 -15.86 16.57 22.39 -13.84 17.32 22.21 -14.85 16.94 22.30 2 0 11.70 -999 ? ZN ZN B 374 >PRO.B 369 -13.69 16.44 27.42 -15.35 17.48 26.27 -14.52 16.96 26.85 3 0 11.33 -999 ? O8 EPE B 376 >PHE.B 370 -11.49 20.06 25.00 -9.59 19.04 26.81 -10.54 19.55 25.90 3 0 12.32 -999 ? O8 EPE B 376 >ILE.B 371 -16.72 24.17 23.28 -18.13 24.46 23.23 -17.42 24.32 23.26 3 0 19.41 -999 ? ZN ZN B 374 >PHE.B 372 -11.64 24.23 19.14 -9.49 22.46 19.29 -10.57 23.34 19.22 3 0 17.31 -999 ? ZN ZN B 374 >VAL.B 373 -13.64 29.40 20.67 -14.32 29.62 22.79 -13.98 29.51 21.73 3 0 23.16 -999 ? O8 EPE B 376 >SER.C 2 29.11 -52.00 51.08 26.88 -52.73 51.77 27.99 -52.37 51.42 2 0 32.80 -999 ? ZN ZN C 375 >LYS.C 3 30.63 -48.52 50.80 31.26 -43.98 46.49 30.95 -46.25 48.64 2 0 28.91 -999 ? O1 TRS A 378 >ILE.C 4 30.96 -45.44 54.65 31.01 -45.43 56.14 30.99 -45.44 55.40 3 0 30.95 -999 ? ZN ZN C 375 >PRO.C 5 27.02 -43.06 51.91 29.21 -43.25 51.62 28.12 -43.15 51.77 3 0 27.17 -999 ? ZN ZN C 375 >ASN~C 6 31.13 -38.29 51.04 30.92 -37.68 49.02 31.02 -37.98 50.03 2 0 27.23 -999 ? ZN ZN C 375 >GLY~C 7 27.26 -36.33 52.02 27.65 -36.56 51.35 27.45 -36.44 51.69 1 0 23.11 -999 ? ZN ZN C 375 >HIS~C 8 29.42 -33.76 48.01 30.25 -31.91 48.55 29.84 -32.84 48.28 3 0 24.89 -999 ? ZN ZN C 375 >GLU~C 9 28.74 -39.91 47.06 29.82 -41.70 47.37 29.28 -40.80 47.21 2 0 28.11 -999 ? O1 TRS A 378 >ILE~C 10 23.57 -38.97 50.96 23.40 -39.59 52.22 23.48 -39.28 51.59 3 0 21.17 -999 ? ZN ZN C 375 >ILE~C 11 23.19 -34.23 48.88 22.19 -33.55 49.51 22.69 -33.89 49.20 3 0 18.27 -999 ? ZN ZN C 375 >SER~C 12 22.92 -36.29 44.84 24.16 -36.52 42.80 23.54 -36.41 43.82 2 0 21.06 -999 ? O1 TRS A 378 >LEU~C 13 20.87 -40.58 45.98 21.86 -42.31 45.08 21.36 -41.45 45.53 3 0 21.97 -999 ? ZN ZN C 375 >PHE~C 14 17.06 -35.49 48.83 14.82 -33.96 49.59 15.94 -34.73 49.21 3 0 12.81 -999 ? ZN ZN C 375 >GLU~C 15 19.30 -32.62 45.28 21.00 -31.37 45.17 20.15 -32.00 45.23 2 0 17.26 -999 ? ZN ZN C 375 >SER.C 16 17.18 -37.24 41.79 17.35 -39.47 42.79 17.26 -38.36 42.29 2 0 19.22 -999 ? ZN ZN C 375 >MET.C 17 13.75 -37.43 43.44 13.77 -40.60 46.20 13.76 -39.01 44.82 2 0 16.53 -999 ? ZN ZN C 375 >TYR.C 18 12.32 -34.51 46.53 10.40 -36.24 47.57 11.36 -35.37 47.05 3 0 11.04 -999 ? ZN ZN C 375 >PRO~C 19 13.85 -32.50 40.26 14.91 -32.07 42.18 14.38 -32.28 41.22 3 0 14.95 -999 ? ZN ZN C 375 >LYS~C 20 16.25 -27.94 42.71 21.97 -27.95 45.58 19.11 -27.94 44.15 2 0 17.53 -999 ? ZN ZN C 375 >HIS~C 21 14.59 -28.36 37.80 14.05 -30.33 37.30 14.32 -29.35 37.55 3 0 17.02 -999 ? O1 TRS A 378 >LEU~C 22 10.89 -28.97 41.64 10.34 -30.58 40.35 10.61 -29.77 40.99 3 0 12.70 -999 ? ZN ZN C 375 >ALA~C 23 11.77 -25.07 43.97 13.11 -24.84 44.66 12.44 -24.96 44.32 2 0 11.04 -999 ? ZN ZN C 375 >MET.C 24 9.83 -21.81 43.70 5.99 -22.24 44.97 7.91 -22.02 44.33 2 0 9.26 -999 ? ZN ZN C 375 >GLU.C 25 10.47 -15.76 42.35 12.38 -15.28 41.57 11.42 -15.52 41.96 2 0 17.70 -999 ? ZN ZN C 375 >GLY.C 26 12.94 -16.92 46.05 12.77 -17.67 45.98 12.85 -17.30 46.02 1 0 14.31 -999 ? ZN ZN C 375 >ASP.C 27 12.27 -21.58 47.53 11.82 -22.95 49.16 12.05 -22.27 48.34 2 0 8.23 -999 ? ZN ZN C 375 >LYS.C 28 15.95 -21.05 50.17 18.02 -16.90 49.10 16.99 -18.97 49.64 2 0 13.32 -999 ? C7 EPE C 376 >ILE.C 29 16.25 -25.50 48.78 15.31 -25.73 47.74 15.78 -25.62 48.26 3 0 10.95 -999 ? ZN ZN C 375 >GLY^C 30 20.37 -26.80 49.54 20.07 -26.59 50.27 20.22 -26.70 49.90 1 0 14.80 -999 ? ZN ZN C 375 >LEU^C 31 24.75 -27.44 51.66 26.21 -28.30 53.10 25.48 -27.87 52.38 3 0 18.57 -999 ? C3 EPE C 376 >GLN^C 32 20.28 -24.06 54.19 18.59 -23.03 54.91 19.44 -23.55 54.55 2 0 10.47 -999 ? C3 EPE C 376 >ILE^C 33 24.50 -25.25 58.77 24.34 -24.63 60.04 24.42 -24.94 59.40 3 0 13.33 -999 ? C3 EPE C 376 >GLY.C 34 28.32 -27.49 57.24 28.16 -27.07 56.58 28.24 -27.28 56.91 1 0 18.40 -999 ? C3 EPE C 376 >ALA.C 35 29.99 -29.58 54.51 31.46 -29.62 54.71 30.73 -29.60 54.61 2 0 22.80 -999 ? C3 EPE C 376 >LEU.C 36 28.01 -32.75 51.56 25.95 -32.14 51.67 26.98 -32.45 51.61 3 0 21.67 -999 ? ZN ZN C 375 >ASN.C 37 33.59 -33.22 51.01 34.15 -31.40 51.99 33.87 -32.31 51.50 2 0 26.80 -999 ? C3 EPE C 376 >LYS.C 38 32.75 -36.42 54.75 28.25 -34.16 56.85 30.50 -35.29 55.80 2 0 22.67 -999 ? C3 EPE C 376 >PRO.C 39 33.99 -40.47 55.96 32.07 -39.43 55.50 33.03 -39.95 55.73 3 0 30.01 -999 ? ZN ZN C 375 >VAL.C 40 27.94 -40.28 56.43 26.59 -38.66 55.75 27.26 -39.47 56.09 3 0 24.73 -999 ? ZN ZN C 375 >ARG.C 41 29.45 -44.46 60.95 32.22 -45.79 60.75 30.83 -45.12 60.85 2 0 33.06 -999 ? ZN ZN C 375 >HIS^C 42 23.45 -43.42 61.49 24.00 -45.25 62.37 23.73 -44.34 61.93 3 0 26.23 -999 ? ZN ZN C 375 >VAL^C 43 21.00 -39.31 58.10 21.24 -38.85 55.94 21.12 -39.08 57.02 3 0 19.62 -999 ? ZN ZN C 375 >LEU^C 44 18.12 -36.96 61.09 16.83 -36.96 62.86 17.48 -36.96 61.98 3 0 17.58 -999 ? ZN ZN C 374 >ILE^C 45 13.89 -37.39 57.06 14.44 -37.19 55.73 14.16 -37.29 56.39 3 0 13.35 -999 ? ZN ZN C 375 >ALA^C 46 13.15 -33.59 59.71 14.10 -32.75 60.59 13.62 -33.17 60.15 2 0 12.13 -999 ? ZN ZN C 374 >LEU.C 47 8.91 -31.30 59.57 7.16 -30.19 58.83 8.03 -30.74 59.20 3 0 6.79 -999 ? ZN ZN C 374 >ASP.C 48 10.65 -27.85 62.57 8.78 -27.40 61.73 9.72 -27.62 62.15 2 0 7.30 -999 ? ZN ZN C 374 >VAL.C 49 15.21 -28.22 62.75 17.10 -28.43 61.69 16.15 -28.32 62.22 3 0 10.82 -999 ? C3 EPE C 376 >THR~C 50 14.59 -27.36 66.40 12.75 -28.33 66.85 13.67 -27.84 66.63 2 0 11.39 -999 ? C2 EPE C 376 >GLU~C 51 19.07 -27.28 70.66 19.78 -25.91 72.07 19.43 -26.59 71.37 2 0 12.03 -999 ? O3S EPE C 376 >GLU~C 52 13.88 -30.69 72.19 13.68 -28.54 72.17 13.77 -29.62 72.18 2 0 13.90 -999 ? C2 EPE C 376 >VAL~C 53 15.80 -32.46 66.66 14.66 -32.23 64.77 15.23 -32.34 65.71 3 0 14.96 -999 ? C3 EPE C 376 >VAL~C 54 19.56 -31.70 66.67 20.73 -29.90 66.07 20.15 -30.80 66.37 3 0 14.84 -999 ? C2 EPE C 376 >ASP~C 55 19.09 -33.39 71.33 19.50 -31.61 72.40 19.30 -32.50 71.87 2 0 17.38 -999 ? O3S EPE C 376 >GLU~C 56 16.30 -37.83 67.27 14.46 -37.72 66.25 15.38 -37.77 66.76 2 0 18.45 -999 ? ZN ZN C 374 >ALA~C 57 20.74 -36.43 65.42 20.93 -35.24 64.51 20.84 -35.83 64.96 2 0 19.02 -999 ? C3 EPE C 376 >ILE~C 58 23.87 -35.42 69.00 24.68 -34.30 69.43 24.27 -34.86 69.21 3 0 20.83 -999 ? C2 EPE C 376 >GLN~C 59 20.80 -38.73 71.92 22.21 -39.43 73.41 21.51 -39.08 72.66 2 0 25.29 -999 ? C2 EPE C 376 >LEU~C 60 20.70 -41.02 65.46 18.61 -41.53 65.48 19.66 -41.28 65.47 3 0 23.23 -999 ? ZN ZN C 374 >GLY~C 61 25.22 -40.51 64.97 24.47 -40.24 64.64 24.85 -40.37 64.80 1 0 25.58 -999 ? C2 EPE C 376 >ALA.C 62 23.65 -38.52 62.14 22.14 -38.28 62.04 22.89 -38.40 62.09 2 0 21.65 -999 ? ZN ZN C 375 >ASN.C 63 27.42 -36.13 60.56 28.02 -37.46 59.02 27.72 -36.79 59.79 2 0 24.62 -999 ? C3 EPE C 376 >VAL^C 64 23.38 -34.73 58.03 23.80 -34.96 55.86 23.59 -34.85 56.94 3 0 19.64 -999 ? ZN ZN C 375 >ILE^C 65 19.44 -32.66 59.78 18.89 -32.45 61.13 19.17 -32.55 60.45 3 0 15.89 -999 ? C3 EPE C 376 >ILE^C 66 17.25 -34.28 54.52 17.36 -34.75 53.15 17.30 -34.52 53.84 3 0 13.44 -999 ? ZN ZN C 375 >ALA^C 67 14.85 -30.74 56.60 15.29 -29.68 57.59 15.07 -30.21 57.10 2 0 10.56 -999 ? ZN ZN C 374 >HIS.C 68 9.33 -29.64 54.17 7.95 -29.11 52.67 8.64 -29.38 53.42 3 0 -3.41 -999 ? ZN ZN C 375s >HIS.C 69 9.38 -25.93 57.43 7.35 -26.43 57.48 8.37 -26.18 57.46 3 0 -3.39 -999 ? ZN ZN C 374s >PRO.C 70 13.84 -23.16 54.03 14.26 -24.42 55.85 14.05 -23.79 54.94 3 0 8.46 -999 ? ZN ZN C 374 >LEU.C 71 17.95 -24.29 59.78 18.87 -24.21 61.77 18.41 -24.25 60.78 3 0 8.22 -999 ? C3 EPE C 376 >ILE.C 72 19.52 -20.00 57.09 20.84 -19.39 57.13 20.18 -19.69 57.11 3 0 8.72 -999 ? C3 EPE C 376 >PHE.C 73 12.87 -18.52 55.06 11.27 -18.17 52.78 12.07 -18.35 53.92 3 0 6.88 -999 ? C8 EPE C 376 >ASN.C 74 15.47 -13.97 57.59 13.34 -13.80 57.59 14.41 -13.88 57.59 2 0 -4.45 -999 ? C8 EPE C 376s >PRO.C 75 19.13 -13.31 53.79 19.04 -14.34 55.75 19.09 -13.82 54.77 3 0 9.89 -999 ? C5 EPE C 376 >LEU.C 76 22.57 -15.31 59.67 21.47 -17.03 60.35 22.02 -16.17 60.01 3 0 8.49 -999 ? N1 EPE C 376 >LYS.C 77 22.95 -10.74 60.05 19.36 -5.86 59.26 21.15 -8.30 59.65 2 0 10.79 -999 ? O2S EPE C 376 >ALA.C 78 24.39 -12.24 63.20 23.97 -11.24 64.29 24.18 -11.74 63.74 2 0 7.87 -999 ? O2S EPE C 376 >ILE.C 79 25.70 -16.60 64.84 25.85 -17.92 64.22 25.78 -17.26 64.53 3 0 9.17 -999 ? O3S EPE C 376 >HIS.C 80 23.09 -12.52 68.61 23.48 -10.58 67.92 23.28 -11.55 68.26 3 0 6.69 -999 ? O2S EPE C 376 >THR.C 81 24.63 -17.88 70.86 26.72 -18.03 70.54 25.68 -17.95 70.70 2 0 10.35 -999 ? O3S EPE C 376 >ASP.C 82 23.03 -14.86 74.18 22.44 -14.42 76.16 22.74 -14.64 75.17 2 0 10.22 -999 ? O3S EPE C 376 >LYS~C 83 19.52 -16.87 71.96 18.81 -11.07 69.68 19.17 -13.97 70.82 2 0 -3.65 -999 ? O2S EPE C 376s >ALA~C 84 17.50 -20.05 71.27 16.01 -20.24 71.47 16.75 -20.14 71.37 2 0 6.70 -999 ? O3S EPE C 376 >TYR~C 85 17.64 -18.79 65.22 18.00 -19.09 62.48 17.82 -18.94 63.85 3 0 -3.91 -999 ? C2 EPE C 376s >GLY~C 86 21.73 -19.07 67.60 21.30 -19.69 68.01 21.51 -19.38 67.80 1 0 5.92 -999 ? O3S EPE C 376 >LYS~C 87 22.12 -22.06 69.94 21.88 -19.84 74.70 22.00 -20.95 72.32 2 0 9.86 -999 ? O3S EPE C 376 >ILE~C 88 19.39 -24.24 66.47 18.05 -24.67 66.14 18.72 -24.46 66.30 3 0 8.70 -999 ? C2 EPE C 376 >ILE~C 89 23.32 -21.71 64.14 23.21 -20.73 63.10 23.27 -21.22 63.62 3 0 9.29 -999 ? O3S EPE C 376 >GLU~C 90 27.07 -22.98 69.65 26.90 -21.97 71.52 26.99 -22.48 70.59 2 0 12.50 -999 ? O3S EPE C 376 >LYS~C 91 24.97 -26.94 68.30 21.78 -29.04 72.70 23.38 -27.99 70.50 2 0 15.57 -999 ? O3S EPE C 376 >CYH~C 92 25.07 -27.93 64.57 22.49 -27.62 63.56 23.78 -27.78 64.06 2 0 13.12 -999 ? C2 EPE C 376 >ILE~C 93 28.76 -24.81 63.85 29.48 -23.73 63.05 29.12 -24.27 63.45 3 0 15.43 -999 ? O3S EPE C 376 >LYS~C 94 30.11 -27.61 67.14 30.55 -24.06 72.29 30.33 -25.83 69.72 2 0 16.71 -999 ? O3S EPE C 376 >ASN~C 95 27.60 -31.58 66.97 27.57 -31.41 69.09 27.59 -31.49 68.03 2 0 19.32 -999 ? O3S EPE C 376 >ASP.C 96 31.06 -32.15 62.51 32.92 -31.34 63.13 31.99 -31.74 62.82 2 0 22.89 -999 ? O3S EPE C 376 >ILE.C 97 25.06 -31.58 62.63 23.98 -32.28 63.34 24.52 -31.93 62.98 3 0 17.80 -999 ? C2 EPE C 376 >ALA^C 98 25.29 -30.67 58.07 25.77 -31.44 56.87 25.53 -31.06 57.47 2 0 19.12 -999 ? C3 EPE C 376 >ILE^C 99 21.53 -27.86 58.42 20.57 -28.40 59.37 21.05 -28.13 58.89 3 0 13.23 -999 ? C3 EPE C 376 >TYR^C 100 20.27 -30.73 51.89 19.47 -30.85 49.23 19.87 -30.79 50.56 3 0 14.49 -999 ? ZN ZN C 375 >ALA^C 101 17.04 -27.71 53.14 16.81 -26.24 53.31 16.92 -26.97 53.22 2 0 11.01 -999 ? ZN ZN C 375 >ALA.C 102 14.49 -29.28 50.81 14.45 -30.75 50.81 14.47 -30.02 50.81 2 0 9.31 -999 ? ZN ZN C 375 >HIS~C 103 10.51 -24.81 51.94 8.80 -23.79 52.62 9.66 -24.30 52.28 3 0 4.97 -999 ? ZN ZN C 375 >THR~C 104 9.25 -26.14 47.92 9.13 -24.05 47.44 9.19 -25.09 47.68 2 0 6.99 -999 ? ZN ZN C 375 >ASN~C 105 12.40 -28.97 45.42 13.67 -29.13 47.17 13.03 -29.05 46.30 2 0 9.60 -999 ? ZN ZN C 375 >VAL~C 106 9.38 -31.44 48.18 10.35 -32.52 49.88 9.86 -31.98 49.03 3 0 6.93 -999 ? ZN ZN C 375 >ASP~C 107 5.80 -28.16 48.27 6.08 -27.64 50.28 5.94 -27.90 49.28 2 0 -2.30 -999 ? ZN ZN C 375s >VAL~C 108 5.99 -29.69 44.17 6.72 -28.03 42.88 6.36 -28.86 43.52 3 0 9.16 -999 ? ZN ZN C 375 >ALA~C 109 7.53 -33.10 43.39 8.93 -33.54 43.81 8.23 -33.32 43.60 2 0 11.05 -999 ? ZN ZN C 375 >LYS.C 110 5.59 -36.33 42.73 4.93 -41.69 39.22 5.26 -39.01 40.98 2 0 19.48 -999 ? ZN ZN C 375 >GLY.C 111 5.64 -38.51 45.88 5.60 -37.66 45.90 5.62 -38.08 45.89 1 0 12.85 -999 ? ZN ZN C 375 >GLY~C 112 6.12 -35.35 47.97 5.41 -35.71 47.93 5.77 -35.53 47.95 1 0 9.08 -999 ? ZN ZN C 375 >VAL~C 113 4.21 -33.66 50.81 4.63 -31.92 52.10 4.42 -32.79 51.45 3 0 5.57 -999 ? ZN ZN C 375 >ASN~C 114 0.77 -32.01 47.92 1.06 -30.12 48.87 0.92 -31.07 48.39 2 0 6.62 -999 ? ZN ZN C 375 >ASP~C 115 1.88 -37.38 46.52 1.77 -36.70 44.54 1.83 -37.04 45.53 2 0 12.87 -999 ? ZN ZN C 375 >LEU~C 116 2.87 -37.78 51.67 4.81 -38.81 51.54 3.84 -38.30 51.61 3 0 11.00 -999 ? ZN ZN C 375 >LEU~C 117 -1.33 -34.53 52.42 -0.48 -33.25 53.96 -0.90 -33.89 53.19 3 0 9.33 -999 ? ZN ZN C 375 >ALA~C 118 -3.69 -37.06 49.43 -3.51 -36.86 47.95 -3.60 -36.96 48.69 2 0 14.03 -999 ? ZN ZN C 375 >GLU~C 119 -0.72 -41.44 48.78 1.35 -42.03 49.11 0.31 -41.74 48.94 2 0 15.59 -999 ? ZN ZN C 375 >ALA~C 120 -3.31 -40.28 53.77 -2.51 -39.27 54.59 -2.91 -39.78 54.18 2 0 14.58 -999 ? ZN ZN C 375 >LEU~C 121 -6.97 -37.40 52.60 -6.91 -35.58 53.77 -6.94 -36.49 53.18 3 0 15.67 -999 ? ZN ZN C 375 >GLY~C 122 -7.79 -41.59 50.69 -7.69 -40.80 50.48 -7.74 -41.20 50.59 1 0 19.71 -999 ? ZN ZN C 375 >LEU.C 123 -7.65 -37.78 47.66 -8.55 -36.07 48.64 -8.10 -36.93 48.15 3 0 17.43 -999 ? ZN ZN C 375 >GLN^C 124 -9.48 -42.79 45.16 -11.30 -43.67 45.70 -10.39 -43.23 45.43 2 0 24.57 -999 ? ZN ZN C 375 >ASN^C 125 -9.33 -39.33 40.03 -9.99 -41.26 39.43 -9.66 -40.29 39.73 2 0 24.77 -999 ? ZN ZN C 375 >THR^C 126 -5.70 -36.58 41.92 -4.55 -37.27 43.63 -5.12 -36.93 42.78 2 0 16.85 -999 ? ZN ZN C 375 >GLU^C 127 -6.33 -33.63 38.15 -7.56 -32.26 37.10 -6.95 -32.94 37.62 2 0 21.05 -999 ? ZN ZN C 375 >VAL^C 128 -2.00 -30.83 40.65 0.02 -30.12 40.01 -0.99 -30.48 40.33 3 0 14.35 -999 ? ZN ZN C 375 >LEU^C 129 -4.04 -27.92 43.98 -5.50 -26.76 45.05 -4.77 -27.34 44.51 3 0 13.37 -999 ? ZN ZN C 375 >ALA^C 130 -1.84 -25.01 41.51 -1.61 -23.99 42.63 -1.72 -24.50 42.07 2 0 12.95 -999 ? ZN ZN C 375 >PRO^C 131 -1.50 -25.61 37.38 0.00 -25.37 39.02 -0.75 -25.49 38.20 3 0 15.97 -999 ? ZN ZN C 375 >THR^C 132 4.01 -23.95 39.21 4.31 -24.44 41.32 4.16 -24.19 40.27 2 0 11.78 -999 ? ZN ZN C 375 >TYR^C 133 8.59 -26.93 36.99 10.82 -27.74 35.52 9.71 -27.34 36.26 3 0 16.76 -999 ? ZN ZN C 375 >ALA^C 134 6.08 -27.55 33.44 4.94 -27.08 32.58 5.51 -27.32 33.01 2 0 20.03 -999 ? ZN ZN C 375 >GLU^C 135 11.24 -30.50 31.64 12.59 -30.76 33.22 11.91 -30.63 32.43 2 0 15.12 -999 ? O1 TRS A 378 >GLU^C 136 10.97 -24.78 28.83 12.54 -23.35 28.52 11.75 -24.06 28.67 2 0 12.99 -999 ? N TRS A 378 >MET^C 137 10.38 -30.05 25.93 8.74 -32.72 27.60 9.56 -31.38 26.77 2 0 16.10 -999 ? N TRS A 378 >LYS^C 138 12.95 -30.51 23.19 15.44 -26.53 25.46 14.19 -28.52 24.33 2 0 8.30 -999 ? N TRS A 378 >LYS^C 139 13.08 -32.56 20.05 9.65 -36.55 18.68 11.37 -34.55 19.37 2 0 16.11 -999 ? N TRS A 378 >VAL^C 140 16.48 -34.14 19.50 17.98 -34.81 20.89 17.23 -34.48 20.20 3 0 8.97 -999 ? N TRS A 378 >VAL^C 141 17.12 -35.05 15.88 15.99 -34.28 14.18 16.55 -34.66 15.03 3 0 8.58 -999 ? O2S EPE C 377 >VAL^C 142 20.31 -37.06 15.27 21.29 -38.59 16.57 20.80 -37.82 15.92 3 0 8.28 -999 ? C2 EPE C 377 >PHE^C 143 21.21 -36.18 10.80 19.31 -34.15 10.67 20.26 -35.16 10.74 3 0 4.11 -999 ? C9 EPE C 377 >VAL^C 144 23.32 -41.84 12.07 23.04 -42.73 14.12 23.18 -42.29 13.09 3 0 8.51 -999 ? C2 EPE C 377 >PRO~C 145 26.54 -44.47 10.78 24.49 -43.92 10.07 25.51 -44.20 10.42 3 0 7.64 -999 ? O8 EPE C 377 >VAL~C 146 22.05 -47.47 9.33 20.56 -48.11 7.77 21.31 -47.79 8.55 3 0 11.46 -999 ? O8 EPE C 377 >THR~C 147 24.85 -49.62 10.75 26.71 -49.25 9.69 25.78 -49.44 10.22 2 0 11.53 -999 ? O8 EPE C 377 >HIS~C 148 27.13 -47.60 14.36 28.94 -48.66 14.50 28.03 -48.13 14.43 3 0 13.04 -999 ? O8 EPE C 377 >ALA~C 149 21.04 -46.59 14.02 20.14 -46.59 12.80 20.59 -46.59 13.41 2 0 12.95 -999 ? O8 EPE C 377 >GLU~C 150 18.79 -51.73 16.88 16.73 -51.34 17.24 17.76 -51.53 17.06 2 0 19.96 -999 ? C2 EPE C 377 >GLU~C 151 24.82 -49.12 19.40 26.74 -49.67 18.68 25.78 -49.39 19.04 2 0 17.15 -999 ? O8 EPE C 377 >VAL~C 152 21.74 -45.12 18.90 22.67 -43.42 17.85 22.20 -44.27 18.38 3 0 13.37 -999 ? C2 EPE C 377 >ARG~C 153 15.73 -46.74 16.59 16.35 -47.76 13.75 16.04 -47.25 15.17 2 0 15.97 -999 ? C2 EPE C 377 >LYS~C 154 18.67 -47.92 22.36 20.33 -51.69 25.99 19.50 -49.81 24.17 2 0 23.94 -999 ? C1 TRS A 378 >ALA~C 155 21.09 -45.45 23.92 22.34 -44.97 23.23 21.72 -45.21 23.58 2 0 16.73 -999 ? C1 TRS A 378 >LEU~C 156 18.00 -42.09 22.36 18.67 -40.46 21.10 18.34 -41.27 21.73 3 0 14.05 -999 ? C2 TRS A 378 >GLY~C 157 15.82 -44.70 25.16 16.57 -44.60 25.47 16.19 -44.65 25.31 1 0 18.60 -999 ? O1 TRS A 378 >ASP~C 158 19.06 -47.14 27.83 18.62 -49.09 27.08 18.84 -48.12 27.45 2 0 22.01 -999 ? O1 TRS A 378 >ALA~C 159 18.93 -42.72 28.88 19.93 -41.91 28.03 19.43 -42.32 28.45 2 0 15.13 -999 ? O1 TRS A 378 >GLY.C 160 15.27 -41.63 29.25 15.56 -41.55 28.55 15.41 -41.59 28.90 1 0 17.10 -999 ? O1 TRS A 378 >ALA.C 161 14.54 -40.01 25.90 15.56 -39.75 24.83 15.05 -39.88 25.36 2 0 14.45 -999 ? O1 TRS A 378 >GLY.C 162 11.10 -40.67 24.41 11.25 -40.70 25.20 11.17 -40.69 24.81 1 0 17.81 -999 ? N TRS A 378 >HIS.C 163 9.61 -42.49 30.12 8.57 -43.28 31.77 9.09 -42.88 30.94 3 0 22.24 -999 ? O1 TRS A 378 >ILE.C 164 5.79 -38.90 26.39 5.81 -37.57 26.90 5.80 -38.23 26.65 3 0 20.67 -999 ? N TRS A 378 >GLY.C 165 3.00 -41.27 29.42 3.80 -41.57 29.42 3.40 -41.42 29.42 1 0 25.31 -999 ? N TRS A 378 >ASN.C 166 1.70 -45.88 30.14 0.89 -45.44 32.06 1.29 -45.66 31.10 2 0 27.69 -999 ? ZN ZN C 375 >TYR^C 167 3.31 -45.81 25.21 0.69 -46.75 24.83 2.00 -46.28 25.02 3 0 26.66 -999 ? O2S EPE A 377 >SER^C 168 9.08 -45.42 26.78 10.19 -47.47 27.43 9.63 -46.44 27.10 2 0 24.11 -999 ? O1 TRS A 378 >HIS^C 169 13.13 -47.52 24.96 14.34 -48.17 26.54 13.73 -47.85 25.75 3 0 22.39 -999 ? O1 TRS A 378 >CYH^C 170 9.66 -43.43 21.72 7.18 -43.27 22.99 8.42 -43.35 22.35 2 0 22.19 -999 ? N TRS A 378 >THR^C 171 11.53 -42.54 18.55 13.17 -44.02 18.73 12.35 -43.28 18.64 2 0 17.48 -999 ? C2 EPE C 377 >PHE^C 172 9.48 -40.91 13.04 8.71 -41.08 10.37 9.10 -40.99 11.71 3 0 14.49 -999 ? O2S EPE A 377 >SER^C 173 13.37 -42.81 12.12 14.73 -44.10 13.72 14.05 -43.46 12.92 2 0 14.26 -999 ? C2 EPE C 377 >SER^C 174 13.31 -42.10 8.38 13.05 -39.69 8.34 13.18 -40.89 8.36 2 0 11.73 -999 ? O3S EPE C 377 >GLU^C 175 16.33 -45.08 6.01 16.53 -46.96 5.10 16.43 -46.02 5.56 2 0 13.76 -999 ? O8 EPE C 377 >GLY^C 176 17.46 -39.97 3.60 18.08 -40.46 3.91 17.77 -40.21 3.76 1 0 9.30 -999 ? C6 EPE C 377 >THR^C 177 20.64 -38.60 2.16 21.28 -38.84 0.08 20.96 -38.72 1.12 2 0 8.04 -999 ? C8 EPE C 377 >GLY^C 178 23.14 -36.24 3.79 23.36 -36.64 3.06 23.25 -36.44 3.42 1 0 3.71 -999 ? C6 EPE C 377 >THR^C 179 25.65 -34.16 1.85 24.40 -33.04 0.40 25.02 -33.60 1.12 2 0 -6.46 -999 ? C5 EPE C 377s >PHE^C 180 29.90 -34.68 4.21 31.04 -37.24 4.01 30.47 -35.96 4.11 3 0 -4.33 -999 ? O8 EPE C 377s >VAL^C 181 32.10 -30.99 1.69 32.13 -29.59 -0.03 32.11 -30.29 0.83 3 0 9.67 -999 ? C5 EPE C 377 >PRO^C 182 35.38 -33.62 2.53 34.53 -31.81 3.53 34.95 -32.72 3.03 3 0 9.82 -999 ? C7 EPE C 377 >GLN.C 183 35.42 -27.01 4.58 35.93 -26.02 2.76 35.67 -26.51 3.67 2 0 13.97 -999 ? C5 EPE C 377 >GLU.C 184 42.98 -26.30 5.30 43.52 -24.37 5.98 43.25 -25.34 5.64 2 0 20.48 -999 ? N4 EPE C 377 >GLY.C 185 42.18 -30.37 7.74 41.51 -30.52 7.27 41.84 -30.44 7.51 1 0 16.41 -999 ? C7 EPE C 377 >GLY.C 194 35.74 -28.58 -2.44 36.09 -29.31 -2.69 35.91 -28.95 -2.57 1 0 14.80 -999 ? C5 EPE C 377 >GLN.C 195 36.65 -33.31 -1.14 38.51 -34.46 -1.08 37.58 -33.89 -1.11 2 0 13.69 -999 ? O8 EPE C 377 >LEU.C 196 29.88 -32.25 -3.31 27.71 -32.07 -2.89 28.79 -32.16 -3.10 3 0 10.42 -999 ? C5 EPE C 377 >GLU^C 197 32.51 -36.09 0.58 33.81 -36.84 -0.90 33.16 -36.46 -0.16 2 0 9.42 -999 ? O8 EPE C 377 >ARG^C 198 24.16 -38.26 -3.08 24.91 -35.49 -4.23 24.53 -36.88 -3.65 2 0 10.55 -999 ? C8 EPE C 377 >VAL^C 199 25.84 -40.51 2.23 27.23 -40.97 3.90 26.54 -40.74 3.07 3 0 -3.61 -999 ? O8 EPE C 377s >GLU^C 200 22.01 -43.83 0.76 21.98 -45.84 -0.06 22.00 -44.84 0.35 2 0 10.81 -999 ? O8 EPE C 377 >GLU^C 201 23.53 -40.20 6.95 23.95 -38.27 7.71 23.74 -39.24 7.33 2 0 -3.18 -999 ? C8 EPE C 377s >VAL^C 202 18.93 -42.23 9.15 18.29 -44.18 9.93 18.61 -43.20 9.54 3 0 10.27 -999 ? C2 EPE C 377 >ARG^C 203 15.41 -35.90 9.66 13.77 -33.95 11.43 14.59 -34.93 10.54 2 0 8.27 -999 ? O3S EPE C 377 >ILE^C 204 17.20 -41.13 15.11 17.64 -42.39 15.69 17.42 -41.76 15.40 3 0 11.73 -999 ? C2 EPE C 377 >GLU^C 205 11.89 -37.55 15.12 10.61 -36.09 14.30 11.25 -36.82 14.71 2 0 12.89 -999 ? O3S EPE C 377 >THR^C 206 12.97 -38.24 19.88 14.05 -39.36 21.39 13.51 -38.80 20.63 2 0 14.70 -999 ? N TRS A 378 >ILE^C 207 9.85 -35.84 22.59 8.56 -35.68 23.24 9.21 -35.76 22.91 3 0 15.87 -999 ? N TRS A 378 >ILE^C 208 14.70 -34.97 25.78 15.99 -34.85 25.27 15.35 -34.91 25.53 3 0 11.16 -999 ? O1 TRS A 378 >PRO^C 209 12.60 -34.96 30.13 12.65 -33.45 28.43 12.62 -34.21 29.28 3 0 14.08 -999 ? O1 TRS A 378 >ALA.C 210 15.20 -30.13 29.07 14.89 -28.65 29.26 15.04 -29.39 29.16 2 0 10.68 -999 ? O1 TRS A 378 >SER.C 211 16.63 -31.54 32.35 15.08 -33.00 33.51 15.85 -32.27 32.93 2 0 14.21 -999 ? O1 TRS A 378 >LEU~C 212 16.61 -35.95 30.24 15.92 -37.59 31.51 16.27 -36.77 30.87 3 0 13.73 -999 ? O1 TRS A 378 >GLN~C 213 20.02 -31.25 25.96 19.87 -29.21 25.35 19.94 -30.23 25.65 2 0 -4.56 -999 ? O1 TRS A 378s >ARG~C 214 25.43 -31.91 31.60 26.96 -33.72 33.51 26.20 -32.82 32.55 2 0 11.90 -999 ? O1 TRS A 378 >LYS~C 215 22.70 -37.10 29.95 20.60 -41.87 33.53 21.65 -39.48 31.74 2 0 17.39 -999 ? O1 TRS A 378 >VAL~C 216 20.82 -37.99 26.73 18.68 -38.12 26.18 19.75 -38.05 26.45 3 0 11.24 -999 ? O1 TRS A 378 >ILE~C 217 23.52 -34.57 24.36 23.07 -34.24 23.11 23.29 -34.41 23.74 3 0 6.28 -999 ? C1 TRS A 378 >LYS~C 218 26.24 -37.78 26.13 29.59 -36.75 30.95 27.92 -37.27 28.54 2 0 12.80 -999 ? O1 TRS A 378 >ALA~C 219 24.80 -41.31 25.72 23.52 -41.79 26.39 24.16 -41.55 26.06 2 0 14.00 -999 ? C1 TRS A 378 >MET~C 220 23.85 -40.53 22.14 22.02 -37.51 20.07 22.93 -39.02 21.11 2 0 9.16 -999 ? C2 TRS A 378 >VAL~C 221 27.39 -39.31 21.28 28.50 -37.43 21.42 27.95 -38.37 21.35 3 0 10.31 -999 ? O2 TRS A 378 >THR~C 222 29.01 -42.32 22.97 29.43 -42.75 25.05 29.22 -42.54 24.01 2 0 15.34 -999 ? C1 TRS A 378 >ALA~C 223 26.89 -44.82 20.98 25.41 -45.05 21.20 26.15 -44.94 21.09 2 0 15.75 -999 ? C3 EPE C 377 >HIS~C 224 26.69 -40.96 16.23 26.39 -40.40 14.23 26.54 -40.68 15.23 3 0 8.36 -999 ? C3 EPE C 377 >PRO.C 225 28.58 -44.44 14.02 29.60 -44.01 15.96 29.09 -44.23 14.99 3 0 10.98 -999 ? C7 EPE C 377 >TYR.C 226 30.28 -40.41 12.42 29.70 -41.48 9.92 29.99 -40.94 11.17 3 0 6.49 -999 ? C7 EPE C 377 >GLU.C 227 35.69 -39.75 16.92 37.70 -40.13 16.40 36.69 -39.94 16.66 2 0 14.45 -999 ? C7 EPE C 377 >GLU.C 228 33.17 -34.88 12.75 35.01 -35.99 12.68 34.09 -35.44 12.71 2 0 9.65 -999 ? C7 EPE C 377 >VAL.C 229 28.28 -35.77 15.53 27.47 -37.37 16.83 27.87 -36.57 16.18 3 0 7.56 -999 ? C3 EPE C 377 >ALA.C 230 25.50 -33.74 13.85 25.41 -33.57 12.34 25.45 -33.65 13.09 2 0 -3.51 -999 ? C2 EPE C 377s >TYR^C 231 23.23 -33.44 18.32 24.66 -32.16 20.35 23.95 -32.80 19.33 3 0 -4.25 -999 ? C2 TRS A 378s >ASP^C 232 18.91 -30.34 15.16 19.98 -30.20 13.32 19.45 -30.27 14.24 2 0 3.77 -999 ? O2S EPE C 377 >VAL^C 233 17.83 -29.66 19.44 18.57 -29.94 21.47 18.20 -29.80 20.45 3 0 5.14 -999 ? N TRS A 378 >TYR^C 234 14.09 -28.86 16.23 14.98 -29.39 13.69 14.54 -29.13 14.96 3 0 9.10 -999 ? O2S EPE C 377 >PRO^C 235 13.26 -24.10 20.28 13.01 -26.30 20.68 13.13 -25.20 20.48 3 0 9.83 -999 ? N TRS A 378 >LEU^C 236 8.65 -28.79 21.36 9.20 -30.53 20.21 8.92 -29.66 20.78 3 0 13.92 -999 ? N TRS A 378 >ASP^C 237 4.59 -25.19 21.63 5.07 -23.28 20.96 4.83 -24.24 21.29 2 0 16.80 -999 ? O1S EPE A 377 >ASN^C 238 5.28 -30.50 23.50 4.52 -30.81 21.55 4.90 -30.65 22.53 2 0 16.63 -999 ? O2S EPE A 377 >LYS^C 239 5.15 -29.07 27.87 7.72 -24.69 27.36 6.43 -26.88 27.61 2 0 16.29 -999 ? N TRS A 378 >GLY^C 240 6.12 -31.91 30.25 5.48 -31.34 30.35 5.80 -31.62 30.30 1 0 19.25 -999 ? N TRS A 378 >GLU^C 241 4.84 -34.67 34.91 4.64 -36.58 35.93 4.74 -35.62 35.42 2 0 18.99 -999 ? ZN ZN C 375 >THR^C 242 2.56 -30.12 34.96 0.88 -28.79 34.66 1.72 -29.45 34.81 2 0 18.64 -999 ? ZN ZN C 375 >LEU^C 243 5.40 -30.33 38.72 6.46 -32.27 38.57 5.93 -31.30 38.64 3 0 14.43 -999 ? ZN ZN C 375 >GLY^C 244 2.79 -27.67 41.30 2.83 -28.37 41.63 2.81 -28.02 41.47 1 0 11.70 -999 ? ZN ZN C 375 >LEU^C 245 1.49 -25.70 45.40 3.20 -24.70 46.16 2.35 -25.20 45.78 3 0 8.02 -999 ? ZN ZN C 375 >GLY^C 246 -1.22 -29.27 46.37 -0.90 -29.41 45.67 -1.06 -29.34 46.02 1 0 9.60 -999 ? ZN ZN C 375 >LYS^C 247 -3.51 -32.04 45.03 0.24 -34.55 41.94 -1.63 -33.29 43.49 2 0 13.94 -999 ? ZN ZN C 375 >ILE^C 248 -7.82 -30.82 43.49 -8.77 -30.10 42.68 -8.30 -30.46 43.09 3 0 17.32 -999 ? ZN ZN C 375 >GLY^C 249 -9.08 -35.38 44.08 -9.51 -34.84 44.55 -9.30 -35.11 44.32 1 0 18.92 -999 ? ZN ZN C 375 >TYR^C 250 -13.28 -36.84 42.94 -13.77 -34.96 40.91 -13.52 -35.90 41.93 3 0 23.68 -999 ? ZN ZN C 375 >LEU^C 251 -14.08 -38.44 49.58 -13.43 -37.26 51.32 -13.75 -37.85 50.45 3 0 22.30 -999 ? ZN ZN C 375 >GLN^C 252 -14.38 -45.23 48.69 -13.74 -46.18 46.86 -14.06 -45.70 47.78 2 0 27.68 -999 ? ZN ZN C 375 >GLU^C 253 -18.88 -44.02 49.77 -19.94 -45.34 51.07 -19.41 -44.68 50.42 2 0 31.42 -999 ? ZN ZN C 375 >GLU^C 254 -21.46 -36.51 49.50 -23.48 -36.16 48.85 -22.47 -36.33 49.17 2 0 30.85 -999 ? ZN ZN C 375 >MET^C 255 -19.66 -36.98 53.65 -15.94 -37.97 54.97 -17.80 -37.47 54.31 2 0 24.32 -999 ? ZN ZN C 375 >THR^C 256 -20.65 -33.80 55.44 -22.00 -34.26 57.11 -21.33 -34.03 56.28 2 0 29.06 -999 ? ZN ZN C 375 >LEU~C 257 -18.18 -29.71 56.20 -16.65 -28.20 55.97 -17.41 -28.96 56.08 3 0 23.47 -999 ? ZN ZN C 374 >GLY~C 258 -18.33 -32.18 59.97 -18.10 -32.63 59.35 -18.22 -32.40 59.66 1 0 25.44 -999 ? ZN ZN C 374 >GLN~C 259 -19.24 -36.63 57.84 -20.75 -38.09 57.58 -19.99 -37.36 57.71 2 0 29.09 -999 ? ZN ZN C 375 >PHE~C 260 -13.65 -33.95 54.79 -11.16 -33.57 53.58 -12.40 -33.76 54.19 3 0 19.40 -999 ? ZN ZN C 375 >ALA~C 261 -13.17 -32.79 59.35 -13.86 -31.71 60.07 -13.51 -32.25 59.71 2 0 21.12 -999 ? ZN ZN C 374 >GLU~C 262 -15.17 -35.96 63.25 -14.01 -35.31 64.90 -14.59 -35.63 64.08 2 0 24.05 -999 ? ZN ZN C 374 >HIS~C 263 -11.47 -39.00 56.70 -10.25 -40.03 55.33 -10.86 -39.52 56.01 3 0 20.89 -999 ? ZN ZN C 375 >VAL~C 264 -8.92 -35.27 58.51 -8.62 -33.33 57.61 -8.77 -34.30 58.06 3 0 17.06 -999 ? ZN ZN C 375 >LYS~C 265 -8.06 -35.63 62.23 -11.30 -33.36 66.69 -9.68 -34.50 64.46 2 0 21.95 -999 ? ZN ZN C 374 >GLN~C 266 -8.78 -41.84 62.14 -8.45 -42.48 60.10 -8.62 -42.16 61.12 2 0 22.05 -999 ? ZN ZN C 375 >SER~C 267 -6.30 -39.53 58.90 -6.77 -39.38 56.53 -6.54 -39.45 57.72 2 0 17.79 -999 ? ZN ZN C 375 >LEU~C 268 -3.82 -35.45 58.97 -3.83 -35.02 56.84 -3.83 -35.24 57.91 3 0 13.50 -999 ? ZN ZN C 375 >ASP~C 269 -1.79 -38.40 63.28 -1.15 -38.99 65.26 -1.47 -38.69 64.27 2 0 18.04 -999 ? ZN ZN C 374 >VAL.C 270 -4.18 -34.36 64.84 -4.13 -33.01 63.12 -4.16 -33.69 63.98 3 0 15.47 -999 ? ZN ZN C 374 >LYS.C 271 -6.09 -33.65 68.04 -3.07 -37.10 68.37 -4.58 -35.38 68.21 2 0 19.51 -999 ? ZN ZN C 374 >GLY.C 272 -7.94 -30.61 66.74 -7.33 -30.77 66.23 -7.64 -30.69 66.48 1 0 18.55 -999 ? ZN ZN C 374 >ALA.C 273 -8.76 -28.60 63.60 -9.11 -29.51 62.39 -8.94 -29.06 62.99 2 0 16.96 -999 ? ZN ZN C 374 >ARG^C 274 -8.42 -22.35 63.85 -6.68 -20.58 62.11 -7.55 -21.46 62.98 2 0 15.09 -999 ? ZN ZN C 374 >VAL^C 275 -13.34 -25.57 60.06 -14.48 -27.44 59.88 -13.91 -26.50 59.97 3 0 20.28 -999 ? ZN ZN C 374 >VAL^C 276 -14.81 -22.90 57.79 -13.74 -21.16 57.03 -14.28 -22.03 57.41 3 0 20.51 -999 ? ZN ZN C 374 >GLY.C 277 -18.35 -23.56 56.48 -18.29 -23.66 57.31 -18.32 -23.61 56.89 1 0 24.27 -999 ? ZN ZN C 374 >LYS.C 278 -21.60 -25.17 57.51 -24.75 -21.09 54.19 -23.18 -23.13 55.85 2 0 30.91 -999 ? ZN ZN C 374 >LEU.C 279 -20.60 -28.88 60.53 -19.01 -28.02 61.74 -19.81 -28.45 61.14 3 0 26.42 -999 ? ZN ZN C 374 >ASP.C 280 -25.13 -30.20 58.02 -25.85 -28.27 58.51 -25.49 -29.23 58.27 2 0 31.92 -999 ? ZN ZN C 374 >ASP.C 281 -22.02 -28.08 53.32 -23.19 -26.28 53.39 -22.61 -27.18 53.35 2 0 29.07 -999 ? ZN ZN C 374 >LYS^C 282 -21.96 -32.19 51.48 -24.68 -36.28 53.46 -23.32 -34.24 52.47 2 0 31.82 -999 ? ZN ZN C 375 >VAL^C 283 -18.34 -32.67 50.40 -17.17 -32.05 52.16 -17.76 -32.36 51.28 3 0 24.17 -999 ? ZN ZN C 375 >ARG^C 284 -17.70 -37.64 45.94 -17.45 -40.51 44.86 -17.57 -39.08 45.40 2 0 27.80 -999 ? ZN ZN C 375 >LYS^C 285 -14.01 -33.36 45.98 -12.46 -31.50 40.58 -13.23 -32.43 43.28 2 0 22.29 -999 ? ZN ZN C 375 >VAL^C 286 -11.20 -32.24 48.22 -10.98 -33.34 50.12 -11.09 -32.79 49.17 3 0 18.11 -999 ? ZN ZN C 375 >ALA^C 287 -8.21 -29.95 47.66 -8.39 -28.51 47.16 -8.30 -29.23 47.41 2 0 15.31 -999 ? ZN ZN C 375 >VAL^C 288 -5.15 -30.28 49.94 -4.23 -32.15 50.68 -4.69 -31.21 50.31 3 0 11.43 -999 ? ZN ZN C 375 >LEU^C 289 -2.20 -26.86 49.50 -0.78 -25.32 48.95 -1.49 -26.09 49.22 3 0 8.24 -999 ? ZN ZN C 375 >GLY^C 290 0.35 -28.86 53.11 0.38 -28.21 52.55 0.37 -28.54 52.83 1 0 5.72 -999 ? ZN ZN C 375 >GLY^C 291 1.77 -25.71 54.72 0.95 -25.76 54.56 1.36 -25.73 54.64 1 0 4.07 -999 ? ZN ZN C 374 >ASP^C 292 1.43 -20.86 54.35 0.32 -19.00 54.12 0.87 -19.93 54.23 2 0 8.69 -999 ? ZN ZN C 374 >GLY.C 293 -2.07 -22.34 51.37 -2.27 -21.83 51.93 -2.17 -22.09 51.65 1 0 9.40 -999 ? ZN ZN C 374 >ASN.C 294 -3.30 -17.98 52.78 -3.53 -18.25 54.87 -3.42 -18.12 53.82 2 0 11.92 -999 ? ZN ZN C 374 >LYS.C 295 -2.95 -18.00 48.43 1.84 -13.91 47.77 -0.55 -15.96 48.10 2 0 14.49 -999 ? ZN ZN C 374 >TYR~C 296 -2.51 -21.77 46.19 0.10 -20.95 45.58 -1.20 -21.36 45.88 3 0 11.54 -999 ? ZN ZN C 375 >ILE~C 297 -8.93 -19.74 48.91 -8.97 -18.72 49.85 -8.95 -19.23 49.38 3 0 17.14 -999 ? ZN ZN C 374 >ASN~C 298 -8.94 -17.91 43.67 -9.93 -16.29 44.63 -9.43 -17.10 44.15 2 0 20.98 -999 ? ZN ZN C 375 >GLN~C 299 -5.59 -23.33 41.58 -5.78 -22.85 39.46 -5.69 -23.09 40.52 2 0 18.18 -999 ? ZN ZN C 375 >ALA~C 300 -9.24 -24.63 44.86 -9.08 -24.63 46.37 -9.16 -24.63 45.61 2 0 16.47 -999 ? ZN ZN C 375 >LYS~C 301 -12.73 -23.25 44.05 -17.55 -23.96 45.92 -15.14 -23.61 44.99 2 0 24.63 -999 ? ZN ZN C 375 >PHE~C 302 -10.84 -22.04 38.19 -10.68 -22.30 35.40 -10.76 -22.17 36.79 3 0 23.56 -999 ? ZN ZN C 375 >LYS~C 303 -11.06 -26.43 40.09 -5.81 -27.52 38.93 -8.44 -26.98 39.51 2 0 17.98 -999 ? ZN ZN C 375 >GLY.C 304 -14.35 -27.24 41.90 -13.76 -27.25 42.32 -14.05 -27.24 42.11 1 0 22.89 -999 ? ZN ZN C 375 >ALA.C 305 -13.32 -28.27 45.43 -12.06 -27.81 46.19 -12.69 -28.04 45.81 2 0 19.06 -999 ? ZN ZN C 375 >ASP.C 306 -16.81 -30.01 48.18 -17.96 -30.59 46.51 -17.38 -30.30 47.34 2 0 24.81 -999 ? ZN ZN C 375 >VAL^C 307 -13.56 -28.36 50.80 -13.18 -29.95 52.27 -13.37 -29.16 51.54 3 0 19.37 -999 ? ZN ZN C 375 >TYR^C 308 -8.26 -25.36 50.23 -5.59 -24.48 49.71 -6.93 -24.92 49.97 3 0 13.34 -999 ? ZN ZN C 375 >VAL^C 309 -7.46 -28.74 53.58 -7.50 -30.78 54.33 -7.48 -29.76 53.96 3 0 13.63 -999 ? ZN ZN C 375 >THR^C 310 -4.52 -26.41 54.31 -4.36 -24.52 53.23 -4.44 -25.46 53.77 2 0 10.44 -999 ? ZN ZN C 374 >GLY^C 311 -2.62 -24.75 57.19 -2.77 -24.31 56.55 -2.70 -24.53 56.87 1 0 8.68 -999 ? ZN ZN C 374 >ASP.C 312 -0.90 -20.80 57.97 0.71 -21.61 59.03 -0.09 -21.21 58.50 2 0 7.48 -999 ? ZN ZN C 374 >MET.C 313 -5.68 -20.02 57.53 -7.42 -20.42 54.94 -6.55 -20.22 56.23 2 0 14.23 -999 ? ZN ZN C 374 >TYR~C 314 -3.69 -15.10 57.54 -1.00 -15.00 58.41 -2.34 -15.05 57.97 3 0 12.22 -999 ? O8 EPE C 376 >TYR~C 315 -10.50 -13.02 60.73 -13.04 -12.15 61.66 -11.77 -12.59 61.20 3 0 21.59 -999 ? O8 EPE C 376 >HIS~C 316 -9.15 -10.09 56.84 -9.69 -8.65 58.28 -9.42 -9.37 57.56 3 0 -20.42 -999 ? O8 EPE C 376s >VAL~C 317 -8.74 -15.26 53.72 -6.88 -16.01 52.88 -7.81 -15.64 53.30 3 0 17.01 -999 ? ZN ZN C 374 >ALA~C 318 -11.35 -17.41 55.53 -11.30 -17.89 56.96 -11.33 -17.65 56.25 2 0 18.85 -999 ? ZN ZN C 374 >HIS~C 319 -14.81 -13.18 56.82 -15.91 -13.11 58.61 -15.36 -13.15 57.71 3 0 24.70 -999 ? ZN ZN C 374 >ASP~C 320 -11.50 -14.47 50.76 -10.89 -12.44 50.87 -11.20 -13.45 50.82 2 0 -21.75 -999 ? ZN ZN C 374s >ALA~C 321 -13.40 -18.49 51.25 -12.60 -19.47 52.03 -13.00 -18.98 51.64 2 0 19.69 -999 ? ZN ZN C 374 >MET~C 322 -16.94 -18.33 52.69 -17.35 -17.70 56.74 -17.14 -18.02 54.71 2 0 24.52 -999 ? ZN ZN C 374 >MET~C 323 -17.70 -15.74 49.94 -17.30 -11.60 50.59 -17.50 -13.67 50.26 2 0 23.81 -999 ? O2S EPE B 376 >LEU~C 324 -14.93 -18.61 47.10 -13.23 -17.62 46.16 -14.08 -18.12 46.63 3 0 22.87 -999 ? ZN ZN C 375 >GLY~C 325 -18.52 -20.89 48.72 -17.66 -20.90 48.73 -18.09 -20.89 48.72 1 0 25.60 -999 ? ZN ZN C 375 >LEU.C 326 -14.03 -22.47 49.19 -12.29 -23.67 48.73 -13.16 -23.07 48.96 3 0 19.90 -999 ? ZN ZN C 375 >ASN^C 327 -16.01 -26.28 53.09 -18.10 -26.10 52.88 -17.05 -26.19 52.99 2 0 24.03 -999 ? ZN ZN C 374 >ILE^C 328 -11.34 -23.92 55.01 -10.20 -23.15 54.29 -10.77 -23.54 54.65 3 0 16.72 -999 ? ZN ZN C 374 >VAL^C 329 -10.48 -27.66 57.23 -11.17 -29.63 57.69 -10.83 -28.64 57.46 3 0 17.04 -999 ? ZN ZN C 374 >ASP^C 330 -7.16 -24.94 59.28 -5.20 -24.20 59.64 -6.18 -24.57 59.46 2 0 11.91 -999 ? ZN ZN C 374 >PRO.C 331 -5.01 -30.12 58.37 -5.74 -28.81 60.07 -5.38 -29.47 59.22 3 0 12.45 -999 ? ZN ZN C 374 >GLY~C 332 -2.36 -27.10 61.01 -2.45 -27.52 60.29 -2.41 -27.31 60.65 1 0 10.07 -999 ? ZN ZN C 374 >HIS~C 333 2.70 -25.03 58.20 4.12 -24.40 56.79 3.41 -24.71 57.50 3 0 -3.37 -999 ? ZN ZN C 374s >ASN~C 334 2.44 -29.45 62.54 3.79 -30.90 63.32 3.12 -30.18 62.93 2 0 9.79 -999 ? ZN ZN C 374 >VAL~C 335 0.52 -32.05 59.08 -1.54 -31.45 58.56 -0.51 -31.75 58.82 3 0 9.47 -999 ? ZN ZN C 374 >GLU~C 336 3.38 -29.70 55.34 4.58 -28.10 54.66 3.98 -28.90 55.00 2 0 2.53 -999 ? ZN ZN C 375s >LYS~C 337 5.23 -34.02 59.10 0.53 -34.86 62.24 2.88 -34.44 60.67 2 0 12.69 -999 ? ZN ZN C 374 >VAL~C 338 4.12 -36.97 56.83 2.21 -36.49 55.96 3.17 -36.73 56.40 3 0 10.33 -999 ? ZN ZN C 375 >MET~C 339 7.06 -36.01 54.74 9.35 -33.59 55.66 8.21 -34.80 55.20 2 0 7.62 -999 ? ZN ZN C 375 >LYS~C 340 9.58 -37.42 57.24 8.41 -35.76 62.90 9.00 -36.59 60.07 2 0 12.92 -999 ? ZN ZN C 374 >GLN~C 341 7.14 -41.56 59.22 7.74 -43.32 60.24 7.44 -42.44 59.73 2 0 17.65 -999 ? ZN ZN C 375 >GLY~C 342 7.81 -40.56 53.34 8.53 -40.45 53.72 8.17 -40.50 53.53 1 0 13.18 -999 ? ZN ZN C 375 >VAL~C 343 11.23 -39.18 52.40 12.11 -37.19 52.15 11.67 -38.18 52.28 3 0 12.12 -999 ? ZN ZN C 375 >GLN~C 344 13.15 -43.20 56.87 12.11 -43.96 58.60 12.63 -43.58 57.73 2 0 18.56 -999 ? ZN ZN C 375 >LYS~C 345 11.31 -44.62 52.77 6.74 -46.86 52.89 9.03 -45.74 52.83 2 0 19.35 -999 ? ZN ZN C 375 >GLN~C 346 10.15 -41.70 48.35 9.41 -39.67 48.22 9.78 -40.69 48.29 2 0 13.37 -999 ? ZN ZN C 375 >LEU~C 347 16.14 -41.10 51.17 18.03 -40.00 50.85 17.09 -40.55 51.01 3 0 17.24 -999 ? ZN ZN C 375 >GLN~C 348 16.26 -47.44 53.87 17.87 -46.87 55.15 17.07 -47.15 54.51 2 0 22.89 -999 ? ZN ZN C 375 >GLU~C 349 13.16 -47.99 47.44 11.07 -47.60 47.14 12.11 -47.80 47.29 2 0 21.43 -999 ? ZN ZN C 375 >LYS~C 350 17.69 -45.38 46.76 16.74 -42.84 42.17 17.21 -44.11 44.46 2 0 21.45 -999 ? ZN ZN C 375 >VAL~C 351 20.68 -45.91 49.04 20.48 -44.73 50.95 20.58 -45.32 50.00 3 0 23.21 -999 ? ZN ZN C 375 >ASP~C 352 18.63 -50.25 49.90 18.47 -49.69 51.95 18.55 -49.97 50.92 2 0 25.48 -999 ? ZN ZN C 375 >ALA~C 353 19.61 -49.87 45.43 18.63 -49.07 44.55 19.12 -49.47 44.99 2 0 26.27 -999 ? ZN ZN C 375 >LYS~C 354 23.17 -48.48 45.31 22.31 -43.90 41.08 22.74 -46.19 43.19 2 0 23.72 -999 ? O1 TRS A 378 >LYS.C 355 24.80 -50.74 47.95 22.71 -54.81 46.20 23.75 -52.77 47.07 2 0 32.67 -999 ? ZN ZN C 375 >LEU.C 356 24.98 -46.32 49.97 26.09 -45.05 48.63 25.53 -45.68 49.30 3 0 26.94 -999 ? ZN ZN C 375 >ASN.C 357 27.30 -48.88 54.43 27.23 -49.76 56.37 27.26 -49.32 55.40 2 0 31.03 -999 ? ZN ZN C 375 >VAL.C 358 23.66 -45.59 55.32 23.85 -43.59 54.38 23.75 -44.59 54.85 3 0 24.80 -999 ? ZN ZN C 375 >HIS^C 359 19.80 -46.87 59.86 18.04 -47.50 60.82 18.92 -47.19 60.34 3 0 24.82 -999 ? ZN ZN C 375 >ILE^C 360 17.37 -42.84 55.78 18.14 -41.91 55.10 17.76 -42.37 55.44 3 0 19.21 -999 ? ZN ZN C 375 >HIS^C 361 17.80 -42.63 61.65 19.35 -43.97 62.12 18.57 -43.30 61.88 3 0 22.27 -999 ? ZN ZN C 375 >ALA^C 362 12.58 -40.21 60.40 11.32 -40.85 59.95 11.95 -40.53 60.17 2 0 16.16 -999 ? ZN ZN C 375 >SER.C 363 12.66 -37.79 63.35 12.77 -35.67 64.45 12.71 -36.73 63.90 2 0 15.25 -999 ? ZN ZN C 374 >GLN.C 364 11.17 -41.20 66.53 9.78 -42.57 65.67 10.48 -41.89 66.10 2 0 20.24 -999 ? ZN ZN C 374 >LEU.C 365 11.04 -34.51 67.92 12.50 -35.24 69.36 11.77 -34.88 68.64 3 0 17.28 -999 ? ZN ZN C 374 >HIS.C 366 4.16 -33.39 68.22 2.28 -32.65 67.64 3.22 -33.02 67.93 3 0 14.85 -999 ? ZN ZN C 374 >THR.C 367 7.09 -30.04 66.37 8.69 -30.35 64.94 7.89 -30.20 65.66 2 0 11.10 -999 ? ZN ZN C 374 >ASP.C 368 2.31 -29.36 66.29 0.59 -28.37 65.47 1.45 -28.87 65.88 2 0 11.74 -999 ? ZN ZN C 374 >PRO.C 369 3.99 -24.16 66.08 3.77 -25.78 67.65 3.88 -24.97 66.86 3 0 11.73 -999 ? ZN ZN C 374 >PHE.C 370 -0.57 -23.85 66.95 0.19 -21.55 65.54 -0.19 -22.70 66.24 3 0 12.75 -999 ? O8 EPE C 376 >ILE.C 371 -1.79 -27.34 72.80 -1.21 -28.00 73.95 -1.50 -27.67 73.37 3 0 19.59 -999 ? ZN ZN C 374 >PHE.C 372 -6.66 -27.35 68.48 -6.43 -26.37 65.89 -6.55 -26.86 67.18 3 0 17.18 -999 ? ZN ZN C 374 >VAL.C 373 -7.86 -26.46 74.18 -6.51 -25.13 75.26 -7.19 -25.79 74.72 3 0 23.36 -999 ? ZN ZN C 374