REMARK SOURCE hebe.pdb HEADER UNKNOWN FUNCTION 06-DEC-09 3KYG COMPND PUTATIVE UNCHARACTERIZED PROTEIN VCA0042; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: UNP RESIDUES 21-247; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: VIBRIO CHOLERAE; SOURCE 3 ORGANISM_TAXID: 666; SOURCE 4 GENE: VC_A0042; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: E. COLI BL21 (DE3); SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET15C AUTHOR K.S.RYU,J.KO,H.KIM,B.S.CHOI HET 5GP A 501 23 HET 5GP A 502 23 HET 5GP A 503 23 HET 5GP A 504 23 HET 5GP B 501 23 HET 5GP B 502 23 HET 5GP B 503 23 HET 5GP B 504 23 SITE 1 AC1 12 ARG A 136 ARG A 140 ARG A 169 ASN A 208 SITE 1 AC2 10 ARG A 99 GLY A 100 GLN A 134 ARG A 135 SITE 1 AC3 18 ARG A 140 ASP A 162 SER A 164 SER A 166 SITE 1 AC4 9 HOH A 10 GLU A 101 ARG A 135 ARG A 136 SITE 1 AC5 13 SER A 212 HIS A 214 ARG B 136 ARG B 140 SITE 1 AC6 13 ARG B 99 GLY B 100 GLN B 134 ARG B 135 SITE 1 AC7 17 HIS A 214 ARG B 140 ASP B 162 SER B 164 SITE 1 AC8 11 HIS A 214 GLU B 101 ARG B 135 ARG B 136 >SER.A 21 8.37 -23.43 3.28 9.77 -21.46 3.11 9.07 -22.44 3.20 2 0 7.01 -999 ? O4' 5GP A 504 >LYS.A 22 9.59 -25.63 0.43 14.00 -23.17 -1.43 11.80 -24.40 -0.50 2 0 7.96 -999 ? O6 5GP A 502 >THR^A 23 7.35 -28.17 -1.26 5.20 -27.99 -1.60 6.27 -28.08 -1.43 2 0 6.70 -999 ? O2P 5GP A 504 >VAL^A 24 8.94 -31.16 -2.97 9.99 -32.85 -2.08 9.47 -32.01 -2.53 3 0 11.49 -999 ? N1 5GP A 502 >SER^A 25 7.24 -33.04 -5.80 6.44 -31.23 -7.22 6.84 -32.13 -6.51 2 0 8.64 -999 ? N2 5GP A 502 >THR^A 26 7.80 -35.26 -8.82 7.85 -37.42 -8.83 7.83 -36.34 -8.82 2 0 14.12 -999 ? N2 5GP A 502 >ILE^A 27 8.52 -32.02 -12.03 7.32 -31.25 -11.87 7.92 -31.63 -11.95 3 0 8.29 -999 ? N2 5GP A 502 >ASN^A 28 7.63 -34.61 -16.91 7.25 -32.60 -17.53 7.44 -33.60 -17.22 2 0 11.40 -999 ? N2 5GP A 502 >SER~A 29 12.24 -34.04 -16.61 13.32 -36.14 -16.08 12.78 -35.09 -16.35 2 0 14.90 -999 ? N2 5GP A 502 >THR~A 30 11.45 -31.65 -19.47 10.57 -31.83 -21.41 11.01 -31.74 -20.44 2 0 13.87 -999 ? N2 5GP A 502 >ASP~A 31 8.27 -29.43 -16.53 6.75 -29.44 -17.98 7.51 -29.44 -17.26 2 0 9.43 -999 ? N2 5GP A 502 >ALA~A 32 12.22 -29.84 -14.45 12.62 -31.21 -13.88 12.42 -30.53 -14.16 2 0 9.75 -999 ? N2 5GP A 502 >LEU~A 33 15.78 -30.00 -17.75 17.22 -31.51 -17.13 16.50 -30.76 -17.44 3 0 13.30 -999 ? N2 5GP A 502 >ALA~A 34 13.44 -25.98 -18.23 11.98 -25.93 -18.83 12.71 -25.95 -18.53 2 0 9.50 -999 ? N2 5GP A 502 >MET.A 35 13.88 -24.39 -14.76 11.48 -26.07 -11.80 12.68 -25.23 -13.28 2 0 4.78 -999 ? N2 5GP A 502 >VAL.A 36 17.63 -24.83 -14.95 18.68 -26.55 -14.12 18.15 -25.69 -14.54 3 0 11.41 -999 ? N2 5GP A 502 >GLU.A 37 19.18 -19.94 -15.70 19.96 -18.12 -14.95 19.57 -19.03 -15.32 2 0 9.45 -999 ? O2' 5GP B 502 >HIS.A 38 22.57 -22.16 -21.23 23.15 -20.29 -21.99 22.86 -21.22 -21.61 3 0 14.58 -999 ? N2 5GP B 502 >SER.A 39 25.86 -23.22 -17.84 26.39 -21.91 -19.83 26.13 -22.56 -18.83 2 0 16.47 -999 ? N2 5GP B 502 >SER.A 40 24.78 -23.46 -14.17 22.60 -24.54 -14.01 23.69 -24.00 -14.09 2 0 14.71 -999 ? O4' 5GP A 502 >GLU^A 41 28.33 -26.40 -10.05 29.57 -25.59 -8.58 28.95 -25.99 -9.32 2 0 21.55 -999 ? O4' 5GP A 502 >LEU^A 42 25.34 -30.35 -12.48 23.76 -30.10 -13.93 24.55 -30.23 -13.20 3 0 18.40 -999 ? N2 5GP A 502 >THR^A 43 26.64 -31.38 -8.23 26.69 -30.65 -6.20 26.66 -31.02 -7.22 2 0 20.59 -999 ? O6 5GP A 502 >LEU^A 44 28.04 -35.47 -10.22 27.97 -34.62 -12.20 28.00 -35.05 -11.21 3 0 23.46 -999 ? N2 5GP A 502 >SER^A 45 27.17 -37.50 -6.05 26.16 -35.93 -4.58 26.67 -36.72 -5.31 2 0 23.03 -999 ? N1 5GP A 502 >ILE^A 46 29.74 -40.92 -7.78 30.32 -40.84 -8.90 30.03 -40.88 -8.34 3 0 28.50 -999 ? N2 5GP A 502 >THR^A 47 28.64 -44.14 -4.79 27.36 -44.43 -3.05 28.00 -44.29 -3.92 2 0 29.83 -999 ? N2 5GP A 502 >THR.A 48 30.73 -46.98 -6.25 32.79 -46.58 -5.76 31.76 -46.78 -6.00 2 0 34.55 -999 ? N2 5GP A 502 >PRO.A 49 30.28 -50.83 -8.30 30.07 -50.07 -6.19 30.17 -50.45 -7.25 3 0 35.36 -999 ? N2 5GP A 502 >VAL.A 50 31.96 -51.06 -2.83 34.04 -51.08 -3.46 33.00 -51.07 -3.14 3 0 38.28 -999 ? N2 5GP A 502 >GLY.A 51 30.34 -47.92 -1.43 31.02 -47.84 -1.78 30.68 -47.88 -1.60 1 0 34.68 -999 ? N2 5GP A 502 >THR.A 52 33.10 -45.39 -1.98 35.18 -45.68 -2.50 34.14 -45.53 -2.24 2 0 36.34 -999 ? N1 5GP A 502 >LYS^A 53 31.64 -41.85 -1.96 26.59 -42.91 -0.31 29.12 -42.38 -1.14 2 0 28.93 -999 ? N1 5GP A 502 >PHE^A 54 34.30 -38.76 -6.42 35.81 -36.92 -7.98 35.06 -37.84 -7.20 3 0 31.18 -999 ? N2 5GP A 502 >VAL^A 55 31.44 -35.71 -5.28 30.15 -34.59 -3.90 30.80 -35.15 -4.59 3 0 26.46 -999 ? N1 5GP A 502 >CYH^A 56 32.37 -33.43 -8.19 32.11 -35.16 -10.44 32.24 -34.30 -9.31 2 0 27.15 -999 ? N2 5GP A 502 >ARG^A 57 30.79 -28.21 -6.41 31.43 -29.85 -3.93 31.11 -29.03 -5.17 2 0 24.77 -999 ? O6 5GP A 502 >THR^A 58 30.67 -29.25 -13.30 30.80 -30.73 -14.88 30.73 -29.99 -14.09 2 0 24.64 -999 ? N2 5GP A 502 >PRO^A 59 30.61 -25.57 -15.58 29.22 -27.30 -15.27 29.92 -26.43 -15.42 3 0 21.65 -999 ? O2' 5GP B 502 >PHE^A 60 22.88 -27.91 -17.47 20.36 -28.35 -18.74 21.62 -28.13 -18.10 3 0 16.48 -999 ? N2 5GP A 502 >ILE^A 61 26.50 -28.65 -21.91 27.55 -28.88 -22.86 27.03 -28.76 -22.39 3 0 23.06 -999 ? N2 5GP B 502 >GLY^A 62 22.23 -28.69 -22.05 22.68 -29.41 -21.94 22.45 -29.05 -21.99 1 0 19.19 -999 ? N2 5GP A 502 >THR^A 63 20.12 -31.51 -23.42 18.40 -31.25 -22.15 19.26 -31.38 -22.79 2 0 17.52 -999 ? N2 5GP A 502 >HIS^A 64 20.44 -34.29 -28.92 19.74 -34.64 -30.87 20.09 -34.47 -29.90 3 0 25.36 -999 ? N2 5GP A 502 >THR.A 65 15.99 -33.59 -27.27 16.20 -34.79 -29.08 16.10 -34.19 -28.18 2 0 23.19 -999 ? N2 5GP A 502 >ASP.A 66 13.71 -36.56 -24.39 13.22 -38.06 -25.81 13.46 -37.31 -25.10 2 0 21.71 -999 ? N2 5GP A 502 >LYS.A 67 18.09 -38.38 -25.27 15.93 -37.87 -30.18 17.01 -38.12 -27.73 2 0 25.58 -999 ? N2 5GP A 502 >PHE^A 68 22.53 -38.67 -24.47 22.87 -41.23 -25.56 22.70 -39.95 -25.01 3 0 26.52 -999 ? N2 5GP A 502 >LEU^A 69 21.62 -34.85 -19.07 21.94 -33.55 -17.40 21.78 -34.20 -18.24 3 0 19.29 -999 ? N2 5GP A 502 >LEU^A 70 25.47 -32.38 -22.91 24.82 -33.03 -24.88 25.15 -32.71 -23.90 3 0 23.78 -999 ? N2 5GP A 502 >VAL^A 71 27.71 -31.73 -18.98 27.31 -33.19 -17.41 27.51 -32.46 -18.19 3 0 23.07 -999 ? N2 5GP A 502 >GLU^A 72 31.19 -27.81 -19.68 31.77 -25.86 -19.04 31.48 -26.83 -19.36 2 0 22.64 -999 ? N2 5GP B 502 >MET.A 73 33.60 -33.18 -18.32 34.39 -36.39 -18.30 33.99 -34.78 -18.31 2 0 30.68 -999 ? N2 5GP A 502 >PRO.A 74 33.75 -34.45 -14.12 34.45 -32.76 -15.37 34.10 -33.60 -14.75 3 0 28.64 -999 ? N2 5GP A 502 >LYS.A 75 38.54 -32.07 -14.23 41.56 -27.02 -16.54 40.05 -29.55 -15.39 2 0 30.24 -999 ? N2 5GP B 502 >ILE.A 76 37.86 -36.14 -11.97 36.55 -36.64 -12.36 37.21 -36.39 -12.17 3 0 32.32 -999 ? N2 5GP A 502 >SER~A 77 42.19 -37.35 -11.82 42.19 -38.66 -9.79 42.19 -38.00 -10.81 2 0 37.78 -999 ? N2 5GP A 502 >ALA~A 78 42.97 -40.52 -13.74 44.34 -40.94 -14.27 43.65 -40.73 -14.01 2 0 40.82 -999 ? N2 5GP A 502 >ASP~A 79 42.99 -42.46 -9.20 44.42 -44.06 -8.95 43.71 -43.26 -9.08 2 0 42.22 -999 ? N2 5GP A 502 >ASP~A 80 38.83 -39.06 -10.21 39.61 -38.03 -8.55 39.22 -38.54 -9.38 2 0 35.23 -999 ? N2 5GP A 502 >LEU~A 81 38.69 -41.08 -14.94 38.09 -41.03 -17.02 38.39 -41.06 -15.98 3 0 35.83 -999 ? N2 5GP A 502 >GLN~A 82 40.63 -47.07 -12.80 42.60 -47.71 -12.28 41.62 -47.39 -12.54 2 0 42.60 -999 ? N2 5GP A 502 >TYR~A 83 39.19 -46.50 -8.43 41.48 -48.13 -8.45 40.34 -47.31 -8.44 3 0 40.56 -999 ? N2 5GP A 502 >PHE~A 84 35.50 -42.06 -7.71 37.17 -42.37 -5.47 36.33 -42.22 -6.59 3 0 34.56 -999 ? N2 5GP A 502 >PHE~A 85 33.21 -39.63 -14.24 31.41 -37.77 -15.33 32.31 -38.70 -14.79 3 0 29.30 -999 ? N2 5GP A 502 >GLN.A 86 34.23 -46.88 -14.11 34.19 -48.91 -13.39 34.21 -47.90 -13.75 2 0 36.90 -999 ? N2 5GP A 502 >GLU.A 87 31.31 -44.80 -20.46 33.43 -44.95 -20.27 32.37 -44.87 -20.36 2 0 34.91 -999 ? N2 5GP A 502 >GLY.A 88 27.40 -47.36 -16.65 27.64 -46.71 -16.24 27.52 -47.04 -16.45 1 0 31.59 -999 ? N2 5GP A 502 >PHE.A 89 29.94 -45.98 -12.03 32.07 -47.54 -11.09 31.00 -46.76 -11.56 3 0 33.03 -999 ? N2 5GP A 502 >TRP^A 90 23.07 -47.30 -12.75 19.82 -45.78 -14.38 21.44 -46.54 -13.56 3 0 27.06 -999 ? N2 5GP A 502 >MET^A 91 24.55 -41.22 -9.77 27.41 -39.44 -12.27 25.98 -40.33 -11.02 2 0 25.49 -999 ? N2 5GP A 502 >ASN^A 92 22.29 -38.65 -6.51 21.31 -40.47 -6.01 21.80 -39.56 -6.26 2 0 22.36 -999 ? N2 5GP A 502 >ILE^A 93 22.58 -35.14 -10.99 23.31 -35.06 -12.26 22.94 -35.10 -11.63 3 0 19.27 -999 ? N2 5GP A 502 >ARG^A 94 21.22 -29.92 -4.66 23.81 -28.27 -4.53 22.51 -29.09 -4.60 2 0 17.10 -999 ? O6 5GP A 502 >ALA^A 95 20.75 -28.72 -10.11 20.07 -29.03 -11.44 20.41 -28.87 -10.78 2 0 13.66 -999 ? N2 5GP A 502 >ILE^A 96 20.57 -24.32 -8.26 20.40 -24.68 -6.84 20.48 -24.50 -7.55 3 0 12.58 -999 ? O6 5GP A 502 >SER^A 97 17.10 -22.79 -10.47 14.96 -22.35 -11.46 16.03 -22.57 -10.96 2 0 6.85 -999 ? N3 5GP A 502 >PRO.A 98 18.10 -18.66 -11.81 17.34 -19.73 -10.00 17.72 -19.19 -10.90 3 0 8.07 -999 ? O4' 5GP A 502 >ARG.A 99 12.23 -20.08 -13.51 11.90 -21.45 -16.23 12.07 -20.77 -14.87 2 0 -5.88 -999 ? O2' 5GP A 502s >GLY.A 100 11.78 -16.58 -7.65 12.58 -16.82 -7.68 12.18 -16.70 -7.66 1 0 -3.39 -999 ? O1P 5GP A 502s >GLU.A 101 11.20 -16.96 -2.65 11.95 -15.03 -2.24 11.58 -16.00 -2.44 2 0 -3.71 -999 ? N2 5GP A 504s >GLY.A 102 14.97 -20.41 -5.99 14.23 -20.57 -5.68 14.60 -20.49 -5.84 1 0 6.65 -999 ? N7 5GP A 502 >ALA^A 103 14.39 -24.16 -6.29 13.24 -24.47 -7.23 13.81 -24.31 -6.76 2 0 5.84 -999 ? N1 5GP A 502 >LEU^A 104 16.81 -28.00 -4.82 18.20 -27.00 -3.51 17.50 -27.50 -4.17 3 0 11.35 -999 ? O6 5GP A 502 >ILE^A 105 16.23 -29.81 -10.28 15.71 -29.18 -10.60 15.97 -29.49 -10.44 3 0 10.31 -999 ? N2 5GP A 502 >HIS^A 106 17.66 -33.13 -5.23 18.63 -32.00 -3.76 18.15 -32.56 -4.49 3 0 14.98 -999 ? N1 5GP A 502 >PHE^A 107 18.13 -35.56 -12.15 20.16 -34.26 -13.60 19.15 -34.91 -12.87 3 0 16.39 -999 ? N2 5GP A 502 >ARG^A 108 19.50 -43.37 -8.86 22.14 -44.17 -7.50 20.82 -43.77 -8.18 2 0 25.52 -999 ? N2 5GP A 502 >SER^A 109 20.90 -40.57 -13.99 22.04 -39.29 -15.72 21.47 -39.93 -14.85 2 0 21.99 -999 ? N2 5GP A 502 >GLN^A 110 23.94 -45.34 -16.44 23.24 -47.15 -17.32 23.59 -46.25 -16.88 2 0 29.14 -999 ? N2 5GP A 502 >LEU^A 111 28.00 -41.99 -16.44 29.66 -40.80 -17.15 28.83 -41.40 -16.80 3 0 28.44 -999 ? N2 5GP A 502 >MET^A 112 26.31 -43.16 -20.75 23.48 -44.35 -20.00 24.90 -43.76 -20.38 2 0 27.82 -999 ? N2 5GP A 502 >HIS^A 113 27.86 -42.38 -24.65 26.42 -43.76 -25.29 27.14 -43.07 -24.97 3 0 31.12 -999 ? N2 5GP A 502 >ILE^A 114 33.51 -40.15 -21.25 34.20 -40.22 -20.08 33.86 -40.18 -20.67 3 0 32.66 -999 ? N2 5GP A 502 >LEU^A 115 32.89 -37.17 -26.28 31.90 -38.20 -27.91 32.40 -37.69 -27.09 3 0 32.91 -999 ? N2 5GP A 502 >GLN.A 116 39.47 -36.30 -24.15 38.65 -35.96 -22.20 39.06 -36.13 -23.17 2 0 34.81 -999 ? N2 5GP B 502 >GLU.A 117 38.78 -36.03 -29.67 40.03 -34.40 -29.27 39.40 -35.21 -29.47 2 0 35.36 -999 ? N2 5GP B 502 >PRO.A 118 33.94 -31.43 -30.75 35.58 -32.68 -29.90 34.76 -32.06 -30.32 3 0 30.90 -999 ? N2 5GP B 502 >VAL.A 119 35.75 -30.92 -26.40 34.37 -29.31 -25.75 35.06 -30.11 -26.07 3 0 28.43 -999 ? N2 5GP B 502 >PRO.A 120 37.71 -31.99 -22.68 35.72 -32.39 -23.60 36.71 -32.19 -23.14 3 0 30.67 -999 ? N2 5GP B 502 >MET^A 121 31.91 -33.85 -22.44 30.26 -32.26 -25.91 31.08 -33.06 -24.17 2 0 27.93 -999 ? N2 5GP B 502 >ALA^A 122 29.98 -36.45 -20.46 30.16 -36.51 -18.95 30.07 -36.48 -19.70 2 0 27.30 -999 ? N2 5GP A 502 >PHE^A 123 27.02 -37.51 -24.04 28.02 -35.95 -26.13 27.52 -36.73 -25.09 3 0 27.89 -999 ? N2 5GP A 502 >LEU^A 124 24.03 -37.90 -17.59 25.65 -37.44 -16.22 24.84 -37.67 -16.91 3 0 23.17 -999 ? N2 5GP A 502 >SER.A 125 20.67 -40.36 -19.25 20.31 -41.89 -17.36 20.49 -41.12 -18.31 2 0 23.34 -999 ? N2 5GP A 502 >ILE.A 126 16.94 -37.39 -19.80 16.67 -36.10 -20.41 16.81 -36.75 -20.10 3 0 18.67 -999 ? N2 5GP A 502 >PRO.A 127 16.00 -38.54 -14.61 15.71 -39.58 -16.59 15.85 -39.06 -15.60 3 0 18.31 -999 ? N2 5GP A 502 >ASN.A 128 10.43 -40.86 -16.71 10.78 -42.44 -18.09 10.61 -41.65 -17.40 2 0 20.61 -999 ? N2 5GP A 502 >THR^A 129 10.95 -37.57 -13.71 9.52 -38.93 -12.75 10.24 -38.25 -13.23 2 0 15.74 -999 ? N2 5GP A 502 >MET^A 130 12.88 -35.49 -11.18 15.37 -33.49 -13.83 14.13 -34.49 -12.51 2 0 13.06 -999 ? N2 5GP A 502 >GLN^A 131 12.49 -36.48 -6.40 10.39 -36.84 -6.34 11.44 -36.66 -6.37 2 0 14.38 -999 ? N2 5GP A 502 >VAL^A 132 11.79 -30.50 -7.39 11.25 -29.39 -9.15 11.52 -29.95 -8.27 3 0 7.99 -999 ? N2 5GP A 502 >SER^A 133 11.79 -28.51 -4.15 13.20 -30.02 -2.87 12.49 -29.27 -3.51 2 0 10.69 -999 ? O6 5GP A 502 >GLN^A 134 8.34 -25.97 -6.20 7.47 -26.04 -8.14 7.91 -26.00 -7.17 2 0 -3.70 -999 ? N2 5GP A 502s >ARG.A 135 9.89 -21.08 -0.52 8.42 -18.72 0.82 9.16 -19.90 0.15 2 0 3.47 -999 ? O2' 5GP A 504s >ARG.A 136 4.60 -21.03 -8.17 4.97 -18.86 -10.34 4.79 -19.95 -9.26 2 0 -3.04 -999 ? O2P 5GP A 501s >LYS.A 137 3.01 -25.67 -3.05 -2.36 -23.98 -0.13 0.33 -24.82 -1.59 2 0 -5.41 -999 ? O2' 5GP A 503s >GLU.A 138 -1.03 -25.09 -5.67 -2.91 -25.01 -4.71 -1.97 -25.05 -5.19 2 0 5.39 -999 ? O2' 5GP A 503 >PRO.A 139 -0.12 -27.88 -10.26 0.89 -26.15 -9.28 0.38 -27.01 -9.77 3 0 8.14 -999 ? N2 5GP A 502 >ARG.A 140 1.02 -19.85 -9.68 2.28 -18.07 -7.55 1.65 -18.96 -8.62 2 0 -3.20 -999 ? O6 5GP A 501s >PHE^A 141 -3.40 -25.48 -14.23 -3.00 -27.86 -12.85 -3.20 -26.67 -13.54 3 0 8.87 -999 ? N2 5GP A 503 >GLU^A 142 0.54 -20.74 -18.09 1.55 -18.92 -18.43 1.05 -19.83 -18.26 2 0 6.92 -999 ? O1P 5GP A 501 >LEU^A 143 -6.20 -19.88 -18.72 -7.04 -19.31 -16.81 -6.62 -19.59 -17.77 3 0 9.75 -999 ? N2 5GP A 503 >ASN^A 144 -6.02 -15.76 -22.26 -3.93 -15.94 -22.46 -4.98 -15.85 -22.36 2 0 12.24 -999 ? O1P 5GP A 501 >LEU^A 145 -10.58 -16.51 -18.61 -10.89 -18.58 -19.18 -10.73 -17.54 -18.90 3 0 13.08 -999 ? N2 5GP A 503 >ALA^A 146 -11.58 -12.02 -19.69 -12.19 -11.40 -20.93 -11.89 -11.71 -20.31 2 0 17.12 -999 ? N1 5GP A 503 >GLY^A 147 -13.66 -10.87 -16.76 -13.19 -10.22 -17.01 -13.43 -10.55 -16.89 1 0 15.94 -999 ? N1 5GP A 503 >LYS^A 148 -14.30 -8.07 -14.30 -16.49 -4.54 -18.02 -15.40 -6.30 -16.16 2 0 21.55 -999 ? O6 5GP A 503 >VAL^A 149 -12.62 -7.27 -11.00 -10.79 -6.11 -10.70 -11.70 -6.69 -10.85 3 0 14.58 -999 ? O6 5GP A 503 >LEU^A 150 -16.23 -6.97 -7.87 -17.52 -5.52 -6.89 -16.87 -6.24 -7.38 3 0 19.12 -999 ? C5 5GP A 503 >PHE^A 151 -11.43 -2.95 -4.72 -10.06 -1.82 -2.54 -10.75 -2.39 -3.63 3 0 16.93 -999 ? N7 5GP A 503 >ASP.A 152 -14.38 -0.28 -3.22 -14.11 0.46 -1.27 -14.24 0.09 -2.24 2 0 21.59 -999 ? C8 5GP A 503 >GLU.A 153 -19.92 -1.15 -3.19 -20.86 0.32 -1.98 -20.39 -0.42 -2.59 2 0 26.28 -999 ? O4' 5GP A 503 >HIS^A 154 -16.57 1.54 -7.74 -17.61 3.10 -6.80 -17.09 2.32 -7.27 3 0 24.50 -999 ? N7 5GP A 503 >ARG^A 155 -19.01 -5.39 -12.02 -20.82 -5.75 -9.53 -19.91 -5.57 -10.78 2 0 22.77 -999 ? N1 5GP A 503 >GLY^A 156 -12.90 -2.87 -13.79 -13.27 -3.66 -13.72 -13.08 -3.26 -13.76 1 0 18.41 -999 ? O6 5GP A 503 >ASP^A 157 -11.46 -4.59 -18.05 -13.25 -3.94 -18.96 -12.36 -4.27 -18.51 2 0 19.93 -999 ? O6 5GP A 503 >CYH^A 158 -9.22 -7.82 -16.01 -10.60 -9.59 -14.29 -9.91 -8.71 -15.15 2 0 13.06 -999 ? O6 5GP A 503 >GLU^A 159 -6.80 -11.99 -19.73 -5.78 -11.77 -21.58 -6.29 -11.88 -20.66 2 0 13.37 -999 ? O1P 5GP A 501 >LEU^A 160 -8.20 -15.11 -15.40 -8.28 -16.24 -13.57 -8.24 -15.68 -14.49 3 0 8.77 -999 ? N2 5GP A 503 >ARG^A 161 -2.90 -13.79 -19.02 -1.80 -11.62 -20.90 -2.35 -12.71 -19.96 2 0 10.07 -999 ? O1P 5GP A 501 >ASP^A 162 -1.54 -18.53 -14.14 -0.81 -17.70 -12.34 -1.18 -18.11 -13.24 2 0 -3.18 -999 ? N1 5GP A 503s >LEU^A 163 -6.47 -20.52 -12.59 -8.41 -20.57 -11.69 -7.44 -20.55 -12.14 3 0 6.24 -999 ? N2 5GP A 503 >SER.A 164 -4.29 -22.65 -9.15 -3.25 -21.32 -7.38 -3.77 -21.98 -8.26 2 0 -3.03 -999 ? N2 5GP A 503s >ARG.A 165 -7.36 -27.90 -6.28 -9.98 -28.48 -4.76 -8.67 -28.19 -5.52 2 0 12.09 -999 ? O2' 5GP A 503 >SER.A 166 -5.42 -21.55 -4.03 -4.42 -23.17 -2.53 -4.92 -22.36 -3.28 2 0 -4.49 -999 ? O2' 5GP A 503s >GLY^A 167 -4.98 -18.44 -6.10 -5.03 -19.06 -6.64 -5.01 -18.75 -6.37 1 0 -3.57 -999 ? N3 5GP A 503s >CYH^A 168 -4.61 -16.82 -9.50 -6.95 -15.18 -9.39 -5.78 -16.00 -9.44 2 0 -6.11 -999 ? C2 5GP A 503s >ARG^A 169 0.81 -13.76 -12.98 1.95 -12.30 -10.55 1.38 -13.03 -11.76 2 0 3.25 -999 ? O4' 5GP A 501s >PHE^A 170 -6.24 -10.31 -11.65 -6.65 -8.54 -9.49 -6.45 -9.43 -10.57 3 0 8.76 -999 ? O6 5GP A 503 >ILE^A 171 -2.95 -8.43 -16.55 -2.38 -9.25 -17.66 -2.66 -8.84 -17.11 3 0 10.03 -999 ? O1P 5GP A 501 >THR.A 172 -5.82 -5.06 -15.87 -5.94 -4.49 -13.77 -5.88 -4.78 -14.82 2 0 12.99 -999 ? O6 5GP A 503 >PRO.A 173 -7.88 -2.46 -18.74 -5.85 -2.62 -17.81 -6.86 -2.54 -18.27 3 0 14.93 -999 ? N2 5GP B 501 >PRO.A 174 -1.69 -0.03 -18.87 -3.08 -0.54 -17.20 -2.39 -0.28 -18.03 3 0 10.36 -999 ? N2 5GP B 501 >LEU.A 175 -4.96 3.96 -17.81 -3.42 4.89 -19.02 -4.19 4.43 -18.42 3 0 13.26 -999 ? N2 5GP B 501 >GLY.A 176 -7.67 1.60 -14.78 -6.93 1.72 -14.43 -7.30 1.66 -14.61 1 0 15.92 -999 ? N2 5GP B 501 >LYS.A 177 -8.29 1.33 -11.04 -10.07 2.55 -5.66 -9.18 1.94 -8.35 2 0 20.38 -999 ? N7 5GP A 503 >THR.A 178 -5.27 -0.05 -9.21 -3.89 1.56 -9.36 -4.58 0.75 -9.28 2 0 14.26 -999 ? N2 5GP B 501 >TYR.A 179 -7.00 -3.62 -7.31 -9.03 -3.27 -9.19 -8.02 -3.45 -8.25 3 0 14.21 -999 ? O6 5GP A 503 >GLN.A 180 -2.20 -1.34 -0.93 -2.94 -0.08 0.65 -2.57 -0.71 -0.14 2 0 15.24 -999 ? N2 5GP A 501 >VAL.A 181 -1.49 -5.50 -1.28 0.49 -6.33 -0.79 -0.50 -5.91 -1.04 3 0 8.86 -999 ? N2 5GP A 501 >GLY.A 182 -4.13 -6.80 1.06 -4.37 -6.59 0.33 -4.25 -6.69 0.70 1 0 10.53 -999 ? O2P 5GP A 503 >ASP.A 183 -7.21 -4.60 -2.10 -6.62 -2.59 -1.84 -6.91 -3.59 -1.97 2 0 14.86 -999 ? C8 5GP A 503 >LEU^A 184 -11.03 -8.12 0.18 -12.08 -9.95 0.66 -11.56 -9.04 0.42 3 0 13.54 -999 ? O4' 5GP A 503 >VAL^A 185 -11.37 -8.25 -4.55 -9.52 -7.88 -5.69 -10.44 -8.07 -5.12 3 0 12.74 -999 ? C8 5GP A 503 >ALA^A 186 -13.67 -10.58 -6.43 -15.13 -10.51 -6.00 -14.40 -10.55 -6.22 2 0 15.50 -999 ? N3 5GP A 503 >LEU^A 187 -11.71 -12.38 -10.43 -9.77 -11.46 -10.14 -10.74 -11.92 -10.28 3 0 11.02 -999 ? N1 5GP A 503 >GLU^A 188 -17.52 -10.68 -10.73 -18.98 -9.12 -10.74 -18.25 -9.90 -10.73 2 0 19.56 -999 ? N2 5GP A 503 >ILE^A 189 -13.76 -15.40 -14.89 -12.49 -14.73 -15.26 -13.12 -15.07 -15.08 3 0 13.07 -999 ? N2 5GP A 503 >PHE^A 190 -16.93 -12.23 -19.30 -17.33 -9.47 -18.99 -17.13 -10.85 -19.15 3 0 19.78 -999 ? N2 5GP A 503 >SER^A 191 -18.28 -18.04 -18.70 -20.53 -17.65 -17.90 -19.41 -17.85 -18.30 2 0 20.38 -999 ? N2 5GP A 503 >ASP^A 192 -20.74 -17.21 -22.64 -21.47 -15.31 -22.03 -21.11 -16.26 -22.33 2 0 23.51 -999 ? N2 5GP A 503 >LEU.A 193 -17.02 -16.29 -26.49 -18.48 -17.87 -26.76 -17.75 -17.08 -26.62 3 0 23.51 -999 ? N2 5GP A 503 >ARG.A 194 -24.21 -12.74 -25.86 -24.75 -15.77 -25.77 -24.48 -14.25 -25.81 2 0 28.23 -999 ? N2 5GP A 503 >GLY^A 195 -19.44 -11.43 -21.93 -20.05 -12.09 -22.08 -19.74 -11.76 -22.00 1 0 22.80 -999 ? N2 5GP A 503 >THR^A 196 -22.86 -11.35 -20.27 -23.85 -12.12 -22.02 -23.36 -11.74 -21.15 2 0 26.14 -999 ? N2 5GP A 503 >LYS^A 197 -22.56 -14.26 -17.80 -22.15 -19.18 -19.56 -22.36 -16.72 -18.68 2 0 22.53 -999 ? N2 5GP A 503 >THR^A 198 -19.83 -15.02 -15.29 -19.83 -13.05 -14.49 -19.83 -14.04 -14.89 2 0 19.39 -999 ? N2 5GP A 503 >PHE.A 199 -16.95 -19.32 -14.76 -16.35 -20.59 -17.18 -16.65 -19.96 -15.97 3 0 16.02 -999 ? N2 5GP A 503 >PRO.A 200 -20.21 -20.06 -9.76 -19.16 -18.15 -10.24 -19.68 -19.11 -10.00 3 0 17.50 -999 ? N2 5GP A 503 >PRO.A 201 -18.44 -14.78 -6.78 -17.31 -15.65 -8.47 -17.87 -15.21 -7.62 3 0 16.20 -999 ? N2 5GP A 503 >LEU^A 202 -12.02 -16.00 -8.41 -12.00 -17.63 -9.85 -12.01 -16.81 -9.13 3 0 10.06 -999 ? N2 5GP A 503 >THR^A 203 -12.72 -14.00 -4.06 -14.61 -14.39 -3.12 -13.67 -14.19 -3.59 2 0 13.65 -999 ? C1' 5GP A 503 >GLY^A 204 -9.45 -13.33 -2.26 -9.74 -12.60 -2.50 -9.59 -12.97 -2.38 1 0 9.15 -999 ? O4' 5GP A 503 >LYS^A 205 -6.81 -10.82 -1.20 -5.46 -10.42 4.49 -6.14 -10.62 1.65 2 0 9.87 -999 ? O2P 5GP A 503 >ILE^A 206 -3.95 -7.68 -3.63 -3.99 -7.70 -5.07 -3.97 -7.69 -4.35 3 0 8.68 -999 ? N7 5GP A 503 >CYH^A 207 -0.88 -10.98 -2.31 0.95 -13.07 -2.15 0.04 -12.03 -2.23 2 0 -2.88 -999 ? O1P 5GP A 503s >ASN^A 208 2.64 -10.28 -5.10 2.07 -11.89 -6.36 2.36 -11.09 -5.73 2 0 3.18 -999 ? C4 5GP A 501s >LEU^A 209 0.58 -5.63 -7.17 1.11 -3.80 -6.07 0.84 -4.71 -6.62 3 0 8.95 -999 ? C1' 5GP A 501 >GLN^A 210 5.04 -7.74 -10.23 3.53 -9.17 -9.71 4.28 -8.45 -9.97 2 0 -3.32 -999 ? O4' 5GP A 501s >ARG^A 211 -0.35 -1.62 -9.87 -0.10 1.37 -9.28 -0.23 -0.13 -9.58 2 0 11.34 -999 ? N2 5GP B 501 >SER^A 212 4.05 0.52 -14.32 4.55 -0.65 -16.38 4.30 -0.07 -15.35 2 0 -3.42 -999 ? N2 5GP B 501s >LEU.A 213 2.80 4.14 -17.31 2.93 5.99 -16.23 2.86 5.07 -16.77 3 0 6.82 -999 ? O2P 5GP B 503 >HIS.A 214 4.77 0.65 -20.04 6.12 2.23 -20.36 5.44 1.44 -20.20 3 0 -4.03 -999 ? O2' 5GP B 504s >HIS.A 215 3.08 -4.36 -18.52 3.80 -4.75 -20.46 3.44 -4.56 -19.49 3 0 5.03 -999 ? N2 5GP B 504 >ALA^A 216 -0.62 -3.91 -14.05 -1.87 -3.04 -13.95 -1.25 -3.48 -14.00 2 0 10.48 -999 ? N2 5GP B 501 >ARG^A 217 1.95 -9.04 -15.44 2.72 -7.35 -17.88 2.33 -8.20 -16.66 2 0 6.09 -999 ? N2 5GP B 504 >TYR^A 218 -3.10 -6.90 -9.35 -3.33 -4.11 -9.63 -3.21 -5.51 -9.49 3 0 10.11 -999 ? O6 5GP A 503 >GLY^A 219 -1.17 -12.25 -7.66 -1.67 -11.55 -7.32 -1.42 -11.90 -7.49 1 0 -3.41 -999 ? N7 5GP A 503s >LEU^A 220 -5.61 -12.98 -6.34 -7.48 -12.10 -5.78 -6.54 -12.54 -6.06 3 0 -7.10 -999 ? C4 5GP A 503s >GLU^A 221 -4.02 -16.74 -0.53 -2.57 -16.76 1.03 -3.30 -16.75 0.25 2 0 -3.80 -999 ? C5' 5GP A 503s >PHE^A 222 -8.61 -18.18 -4.72 -8.46 -18.22 -7.53 -8.54 -18.20 -6.12 3 0 7.02 -999 ? N3 5GP A 503 >ASN~A 223 -11.23 -16.20 1.26 -12.84 -15.61 -0.04 -12.04 -15.90 0.61 2 0 12.18 -999 ? O4' 5GP A 503 >GLU~A 224 -13.91 -22.12 2.56 -12.60 -23.72 2.05 -13.25 -22.92 2.30 2 0 13.00 -999 ? O2' 5GP A 503 >GLU~A 225 -17.20 -18.02 -1.84 -18.49 -16.42 -1.38 -17.84 -17.22 -1.61 2 0 17.37 -999 ? C1' 5GP A 503 >GLY~A 226 -12.77 -18.40 -3.65 -12.85 -19.13 -3.25 -12.81 -18.76 -3.45 1 0 11.35 -999 ? O2' 5GP A 503 >ARG~A 227 -8.41 -22.57 -0.79 -8.86 -21.19 1.92 -8.63 -21.88 0.57 2 0 9.27 -999 ? O2' 5GP A 503 >ASN~A 228 -15.80 -23.10 -3.03 -15.83 -24.30 -1.26 -15.81 -23.70 -2.15 2 0 15.14 -999 ? O2' 5GP A 503 >ASN~A 229 -15.77 -19.91 -6.95 -17.66 -19.71 -6.00 -16.72 -19.81 -6.48 2 0 15.77 -999 ? N2 5GP A 503 >ALA~A 230 -11.81 -21.87 -8.37 -10.49 -21.70 -7.62 -11.15 -21.79 -7.99 2 0 8.82 -999 ? N2 5GP A 503 >LYS~A 231 -12.30 -25.66 -8.23 -15.00 -30.02 -6.77 -13.65 -27.84 -7.50 2 0 17.01 -999 ? N2 5GP A 503 >ASN~A 232 -16.83 -24.30 -9.32 -18.42 -24.01 -10.70 -17.63 -24.16 -10.01 2 0 17.03 -999 ? N2 5GP A 503 >LEU~A 233 -13.60 -21.55 -12.39 -12.83 -20.13 -13.84 -13.22 -20.84 -13.11 3 0 11.86 -999 ? N2 5GP A 503 >LEU~A 234 -10.28 -25.63 -12.16 -8.32 -24.79 -11.76 -9.30 -25.21 -11.96 3 0 9.81 -999 ? N2 5GP A 503 >ALA~A 235 -13.63 -28.14 -13.67 -14.57 -28.68 -12.60 -14.10 -28.41 -13.13 2 0 16.06 -999 ? N2 5GP A 503 >GLN~A 236 -17.43 -25.50 -14.77 -19.06 -24.17 -14.53 -18.24 -24.83 -14.65 2 0 18.43 -999 ? N2 5GP A 503 >LEU.A 237 -11.38 -24.85 -17.89 -11.45 -22.76 -17.33 -11.41 -23.81 -17.61 3 0 13.41 -999 ? N2 5GP A 503 >LYS^A 238 -11.18 -27.85 -21.22 -10.52 -26.12 -26.34 -10.85 -26.99 -23.78 2 0 20.41 -999 ? N2 5GP A 503 >PHE^A 239 -5.33 -28.97 -20.44 -2.88 -28.17 -19.34 -4.10 -28.57 -19.89 3 0 14.51 -999 ? N2 5GP A 503 >ASN.A 240 -6.32 -26.29 -25.78 -4.94 -24.70 -25.39 -5.63 -25.50 -25.58 2 0 17.46 -999 ? N2 5GP A 503 >GLY.A 241 -2.49 -29.10 -24.45 -2.74 -28.49 -24.00 -2.61 -28.79 -24.23 1 0 17.94 -999 ? N2 5GP A 502 >THR.A 242 -0.68 -26.03 -23.14 0.30 -25.30 -24.93 -0.19 -25.67 -24.04 2 0 15.07 -999 ? O2' 5GP A 502 >LYS.A 243 -3.40 -23.81 -21.66 -1.39 -18.02 -23.36 -2.39 -20.92 -22.51 2 0 11.72 -999 ? O1P 5GP A 501 >LEU^A 244 -7.28 -23.89 -18.84 -6.70 -25.16 -17.17 -6.99 -24.52 -18.00 3 0 11.50 -999 ? N2 5GP A 503 >THR^A 245 -9.72 -22.64 -22.43 -8.84 -23.36 -24.27 -9.28 -23.00 -23.35 2 0 17.12 -999 ? N2 5GP A 503 >LEU.A 246 -14.17 -20.72 -22.78 -15.18 -19.30 -21.52 -14.68 -20.01 -22.15 3 0 18.08 -999 ? N2 5GP A 503 >ASN.A 247 -15.09 -26.02 -22.46 -15.96 -27.88 -23.01 -15.53 -26.95 -22.74 2 0 21.46 -999 ? N2 5GP A 503 >SER.B 21 11.80 1.18 -29.40 9.64 0.22 -28.71 10.72 0.70 -29.06 2 0 7.11 -999 ? C4' 5GP B 504 >LYS.B 22 14.43 -1.58 -29.69 14.48 -5.51 -28.73 14.45 -3.54 -29.21 2 0 6.77 -999 ? O6 5GP B 502 >THR^B 23 18.04 -0.62 -29.05 18.77 0.88 -27.67 18.40 0.13 -28.36 2 0 6.68 -999 ? O2P 5GP B 504 >VAL^B 24 20.96 -2.55 -30.58 20.93 -3.41 -32.56 20.94 -2.98 -31.57 3 0 11.24 -999 ? N1 5GP B 502 >SER^B 25 24.29 -2.94 -28.91 23.71 -3.59 -26.61 24.00 -3.27 -27.76 2 0 8.20 -999 ? N2 5GP B 502 >THR^B 26 27.28 -5.26 -29.06 28.75 -5.18 -30.60 28.01 -5.22 -29.83 2 0 13.86 -999 ? N2 5GP B 502 >ILE^B 27 26.33 -8.03 -25.43 26.20 -7.06 -24.45 26.27 -7.54 -24.94 3 0 8.24 -999 ? N2 5GP B 502 >ASN^B 28 31.09 -10.16 -23.68 29.88 -10.42 -21.94 30.48 -10.29 -22.81 2 0 11.25 -999 ? N2 5GP B 502 >SER~B 29 29.00 -13.62 -25.96 29.85 -13.98 -28.17 29.43 -13.80 -27.06 2 0 14.68 -999 ? N2 5GP B 502 >THR~B 30 28.89 -15.05 -22.44 30.21 -15.61 -20.83 29.55 -15.33 -21.63 2 0 13.92 -999 ? N2 5GP B 502 >ASP~B 31 26.62 -10.91 -21.17 27.77 -10.66 -19.43 27.19 -10.78 -20.30 2 0 9.39 -999 ? N2 5GP B 502 >ALA~B 32 24.40 -12.51 -24.69 24.92 -12.28 -26.13 24.66 -12.39 -25.41 2 0 9.39 -999 ? N2 5GP B 502 >LEU~B 33 25.04 -17.35 -24.85 25.55 -18.06 -26.85 25.30 -17.70 -25.85 3 0 13.23 -999 ? N2 5GP B 502 >ALA~B 34 22.98 -16.17 -20.87 23.68 -15.32 -19.79 23.33 -15.75 -20.33 2 0 9.39 -999 ? N2 5GP B 502 >MET~B 35 19.86 -14.45 -22.20 20.64 -10.48 -23.28 20.25 -12.46 -22.74 2 0 4.43 -999 ? N2 5GP B 502 >VAL.B 36 18.93 -17.42 -24.34 19.43 -17.62 -26.49 19.18 -17.52 -25.42 3 0 11.37 -999 ? N2 5GP B 502 >GLU.B 37 14.89 -19.48 -21.87 12.88 -20.02 -21.46 13.89 -19.75 -21.67 2 0 9.47 -999 ? O2' 5GP A 502 >HIS.B 38 18.37 -25.45 -21.58 17.13 -26.58 -20.32 17.75 -26.01 -20.95 3 0 14.59 -999 ? N2 5GP A 502 >SER.B 39 16.43 -25.82 -26.02 16.19 -27.57 -24.33 16.31 -26.69 -25.18 2 0 16.47 -999 ? O2' 5GP A 502 >SER.B 40 15.10 -22.68 -27.68 16.58 -20.78 -27.33 15.84 -21.73 -27.50 2 0 15.00 -999 ? O4' 5GP B 502 >GLU^B 41 13.92 -22.52 -33.76 12.06 -22.81 -34.73 12.99 -22.66 -34.24 2 0 21.81 -999 ? O4' 5GP B 502 >LEU^B 42 19.30 -21.45 -33.34 20.42 -21.24 -31.56 19.86 -21.34 -32.45 3 0 18.40 -999 ? N2 5GP B 502 >THR^B 43 17.54 -19.62 -37.01 15.90 -18.46 -37.77 16.72 -19.04 -37.39 2 0 20.49 -999 ? N1 5GP B 502 >LEU^B 44 21.16 -21.76 -39.09 21.36 -22.91 -37.29 21.26 -22.34 -38.19 3 0 23.21 -999 ? N2 5GP B 502 >SER^B 45 21.13 -18.42 -42.40 19.45 -16.75 -41.92 20.29 -17.58 -42.16 2 0 23.17 -999 ? N1 5GP B 502 >ILE^B 46 24.04 -21.17 -44.82 24.22 -22.17 -44.33 24.13 -21.67 -44.57 3 0 28.33 -999 ? N2 5GP B 502 >THR^B 47 24.96 -18.09 -48.08 24.44 -16.06 -48.62 24.70 -17.08 -48.35 2 0 29.72 -999 ? N2 5GP B 502 >THR.B 48 27.32 -20.04 -50.36 26.13 -21.45 -51.46 26.73 -20.75 -50.91 2 0 34.57 -999 ? N2 5GP B 502 >PRO.B 49 31.62 -19.80 -51.26 29.72 -18.90 -51.98 30.67 -19.35 -51.62 3 0 35.12 -999 ? N2 5GP B 502 >VAL.B 50 27.88 -18.47 -55.49 27.79 -20.51 -56.25 27.84 -19.49 -55.87 3 0 38.21 -999 ? N2 5GP B 502 >GLY.B 51 25.12 -16.65 -53.61 25.08 -17.40 -53.63 25.10 -17.03 -53.62 1 0 34.71 -999 ? N2 5GP B 502 >THR.B 52 22.71 -19.50 -52.90 22.52 -21.44 -53.85 22.62 -20.47 -53.38 2 0 36.19 -999 ? N2 5GP B 502 >LYS^B 53 21.00 -18.76 -49.59 20.01 -13.50 -46.17 20.50 -16.13 -47.88 2 0 25.94 -999 ? N1 5GP B 502 >PHE^B 54 19.52 -23.76 -46.53 18.24 -25.93 -45.31 18.88 -24.85 -45.92 3 0 30.76 -999 ? N2 5GP B 502 >VAL^B 55 17.70 -20.85 -43.93 16.89 -18.88 -43.40 17.30 -19.87 -43.67 3 0 26.11 -999 ? N1 5GP B 502 >CYH^B 56 16.87 -23.53 -41.38 19.41 -24.86 -41.02 18.14 -24.20 -41.20 2 0 26.91 -999 ? N2 5GP B 502 >ARG^B 57 12.74 -21.52 -37.99 12.65 -19.93 -40.63 12.70 -20.73 -39.31 2 0 23.91 -999 ? O6 5GP B 502 >THR^B 58 17.14 -26.02 -34.98 19.13 -26.90 -34.98 18.13 -26.46 -34.98 2 0 24.34 -999 ? N2 5GP B 502 >PRO^B 59 15.61 -27.93 -31.56 17.18 -26.38 -31.89 16.39 -27.15 -31.73 3 0 21.86 -999 ? O2' 5GP A 502 >PHE^B 60 20.86 -22.88 -27.53 22.69 -21.84 -25.67 21.77 -22.36 -26.60 3 0 16.50 -999 ? N2 5GP B 502 >ILE^B 61 22.45 -28.48 -27.20 22.72 -29.90 -27.35 22.59 -29.19 -27.28 3 0 22.92 -999 ? O2' 5GP A 502 >GLY^B 62 24.04 -25.17 -24.93 24.38 -25.40 -25.69 24.21 -25.28 -25.31 1 0 19.13 -999 ? N2 5GP B 502 >THR^B 63 27.73 -24.19 -24.89 27.47 -22.08 -24.61 27.60 -23.14 -24.75 2 0 17.51 -999 ? N2 5GP B 502 >HIS^B 64 32.77 -27.54 -23.32 34.29 -28.15 -22.01 33.53 -27.85 -22.66 3 0 25.27 -999 ? N2 5GP B 502 >THR.B 65 32.69 -23.04 -21.67 34.52 -24.21 -21.37 33.60 -23.62 -21.52 2 0 22.96 -999 ? N2 5GP B 502 >ASP.B 66 34.33 -19.34 -24.00 36.40 -19.63 -23.76 35.37 -19.48 -23.88 2 0 21.49 -999 ? N2 5GP B 502 >LYS.B 67 34.83 -23.25 -26.87 39.21 -24.20 -24.21 37.02 -23.72 -25.54 2 0 26.54 -999 ? N2 5GP B 502 >PHE^B 68 33.13 -26.22 -29.79 35.58 -27.04 -30.87 34.35 -26.63 -30.33 3 0 26.49 -999 ? N2 5GP B 502 >LEU^B 69 27.62 -22.38 -30.02 25.64 -21.77 -30.53 26.63 -22.07 -30.28 3 0 19.21 -999 ? N2 5GP B 502 >LEU^B 70 26.26 -28.00 -28.51 27.95 -28.68 -27.32 27.11 -28.34 -27.92 3 0 23.73 -999 ? N2 5GP B 502 >VAL^B 71 22.97 -27.32 -31.60 23.30 -25.87 -33.21 23.13 -26.59 -32.41 3 0 23.01 -999 ? N2 5GP B 502 >GLU^B 72 19.23 -30.83 -30.66 17.20 -30.91 -30.03 18.21 -30.87 -30.34 2 0 22.70 -999 ? O2' 5GP A 502 >MET.B 73 21.57 -31.28 -36.19 24.34 -31.75 -37.70 22.96 -31.51 -36.94 2 0 30.31 -999 ? N2 5GP B 502 >PRO.B 74 20.53 -28.51 -39.51 19.54 -29.79 -38.00 20.03 -29.15 -38.75 3 0 28.44 -999 ? N2 5GP B 502 >LYS.B 75 16.57 -32.07 -40.06 12.36 -33.29 -35.41 14.47 -32.68 -37.73 2 0 26.75 -999 ? O2' 5GP A 502 >ILE.B 76 18.52 -30.16 -43.78 19.35 -29.12 -43.25 18.94 -29.64 -43.51 3 0 31.99 -999 ? N2 5GP B 502 >SER~B 77 18.48 -33.41 -46.87 18.70 -31.99 -48.81 18.59 -32.70 -47.84 2 0 37.47 -999 ? N2 5GP B 502 >ALA~B 78 21.79 -34.92 -47.86 21.97 -36.26 -48.58 21.88 -35.59 -48.22 2 0 40.36 -999 ? N2 5GP B 502 >ASP~B 79 20.26 -32.14 -51.49 19.19 -33.96 -52.00 19.72 -33.05 -51.74 2 0 41.16 -999 ? N2 5GP B 502 >ASP~B 80 19.88 -29.11 -47.51 18.41 -28.30 -48.82 19.14 -28.71 -48.16 2 0 35.14 -999 ? N2 5GP B 502 >LEU~B 81 23.73 -32.12 -45.06 24.65 -32.66 -43.19 24.19 -32.39 -44.13 3 0 34.76 -999 ? N2 5GP B 502 >GLN~B 82 27.22 -32.66 -50.47 28.25 -31.30 -51.73 27.73 -31.98 -51.10 2 0 40.31 -999 ? N2 5GP B 502 >TYR~B 83 25.00 -28.09 -52.43 25.59 -29.61 -54.72 25.30 -28.85 -53.57 3 0 39.81 -999 ? N2 5GP B 502 >PHE~B 84 22.81 -24.80 -48.01 21.59 -23.94 -50.39 22.20 -24.37 -49.20 3 0 33.38 -999 ? N2 5GP B 502 >PHE~B 85 24.69 -27.78 -41.75 24.06 -26.79 -39.21 24.37 -27.28 -40.48 3 0 28.66 -999 ? N2 5GP B 502 >GLN.B 86 29.77 -28.77 -46.85 30.12 -30.87 -46.97 29.94 -29.82 -46.91 2 0 37.00 -999 ? N2 5GP B 502 >GLU.B 87 32.62 -30.19 -40.49 33.84 -31.59 -39.45 33.23 -30.89 -39.97 2 0 34.09 -999 ? N2 5GP B 502 >GLY.B 88 34.23 -24.62 -42.25 33.41 -24.62 -42.21 33.82 -24.62 -42.23 1 0 31.52 -999 ? N2 5GP B 502 >PHE.B 89 29.92 -24.20 -45.38 30.07 -25.48 -47.88 29.99 -24.84 -46.63 3 0 33.16 -999 ? N2 5GP B 502 >TRP^B 90 33.30 -18.58 -42.49 33.98 -17.27 -38.84 33.64 -17.92 -40.67 3 0 26.86 -999 ? N2 5GP B 502 >MET^B 91 26.52 -18.73 -40.94 25.34 -22.34 -39.27 25.93 -20.53 -40.11 2 0 24.73 -999 ? N2 5GP B 502 >ASN^B 92 24.17 -14.62 -40.14 25.83 -13.57 -41.03 25.00 -14.09 -40.59 2 0 22.28 -999 ? N2 5GP B 502 >ILE^B 93 23.16 -17.89 -35.48 23.49 -19.25 -35.04 23.33 -18.57 -35.26 3 0 18.92 -999 ? N2 5GP B 502 >ARG^B 94 16.27 -13.32 -35.49 14.10 -14.07 -37.52 15.19 -13.69 -36.50 2 0 17.92 -999 ? O6 5GP B 502 >ALA^B 95 18.41 -16.50 -31.16 19.52 -16.87 -30.17 18.96 -16.69 -30.66 2 0 13.54 -999 ? N2 5GP B 502 >ILE^B 96 14.13 -15.96 -29.15 13.56 -15.06 -30.07 13.85 -15.51 -29.61 3 0 12.83 -999 ? C6 5GP B 502 >SER^B 97 15.39 -14.23 -25.29 16.30 -13.13 -23.36 15.84 -13.68 -24.33 2 0 6.71 -999 ? N3 5GP B 502 >PRO.B 98 12.84 -16.10 -22.21 12.74 -14.41 -23.66 12.79 -15.26 -22.94 3 0 7.93 -999 ? O4' 5GP B 502 >ARG.B 99 16.74 -12.58 -19.39 19.31 -13.94 -18.37 18.02 -13.26 -18.88 2 0 -6.04 -999 ? O2' 5GP B 502s >GLY.B 100 10.87 -8.75 -20.19 10.80 -9.36 -20.73 10.84 -9.06 -20.46 1 0 -3.42 -999 ? O1P 5GP B 502s >GLU.B 101 8.77 -5.23 -23.05 6.73 -5.67 -22.74 7.75 -5.45 -22.90 2 0 -3.70 -999 ? N2 5GP B 504s >GLY.B 102 11.72 -10.07 -25.28 12.00 -9.28 -25.15 11.86 -9.67 -25.22 1 0 6.75 -999 ? N7 5GP B 502 >ALA^B 103 14.96 -9.63 -27.18 16.02 -9.35 -26.18 15.49 -9.49 -26.68 2 0 5.82 -999 ? N1 5GP B 502 >LEU^B 104 16.48 -10.32 -31.62 14.35 -10.59 -31.62 15.42 -10.45 -31.62 3 0 10.98 -999 ? O6 5GP B 502 >ILE^B 105 20.97 -12.94 -29.18 20.84 -12.79 -28.33 20.91 -12.86 -28.75 3 0 9.97 -999 ? N2 5GP B 502 >HIS^B 106 20.50 -10.76 -34.95 18.49 -10.73 -35.54 19.50 -10.75 -35.25 3 0 14.72 -999 ? N1 5GP B 502 >PHE^B 107 25.68 -15.39 -32.56 24.56 -17.91 -32.03 25.12 -16.65 -32.29 3 0 16.08 -999 ? N2 5GP B 502 >ARG^B 108 29.97 -13.52 -39.83 29.54 -14.55 -42.68 29.76 -14.04 -41.25 2 0 25.34 -999 ? N2 5GP B 502 >SER^B 109 29.54 -18.40 -36.22 29.19 -20.42 -34.87 29.36 -19.41 -35.55 2 0 21.81 -999 ? N2 5GP B 502 >GLN^B 110 33.68 -21.62 -39.45 35.77 -21.35 -39.60 34.73 -21.48 -39.53 2 0 28.85 -999 ? N2 5GP B 502 >LEU^B 111 29.68 -25.27 -39.49 28.58 -27.11 -39.23 29.13 -26.19 -39.36 3 0 28.42 -999 ? N2 5GP B 502 >MET^B 112 33.40 -26.51 -36.71 34.94 -23.72 -36.37 34.17 -25.12 -36.54 2 0 27.69 -999 ? N2 5GP B 502 >HIS^B 113 34.24 -30.25 -34.67 36.21 -29.65 -34.29 35.23 -29.95 -34.48 3 0 31.08 -999 ? N2 5GP B 502 >ILE^B 114 28.85 -32.52 -38.52 27.92 -32.24 -39.58 28.39 -32.38 -39.05 3 0 32.50 -999 ? N2 5GP B 502 >LEU^B 115 29.25 -35.30 -33.27 31.13 -35.53 -32.25 30.19 -35.42 -32.76 3 0 32.63 -999 ? N2 5GP B 502 >GLN.B 116 25.89 -39.51 -37.47 25.03 -37.65 -38.09 25.46 -38.58 -37.78 2 0 35.38 -999 ? N2 5GP A 502 >GLU.B 117 28.07 -42.19 -33.43 26.20 -43.18 -33.28 27.13 -42.68 -33.36 2 0 35.24 -999 ? N2 5GP A 502 >PRO.B 118 26.66 -39.40 -27.46 26.70 -40.04 -29.60 26.68 -39.72 -28.53 3 0 30.72 -999 ? N2 5GP A 502 >VAL.B 119 23.52 -38.16 -30.94 22.57 -37.48 -29.08 23.05 -37.82 -30.01 3 0 28.55 -999 ? N2 5GP A 502 >PRO.B 120 21.99 -37.48 -34.87 23.36 -36.36 -33.47 22.68 -36.92 -34.17 3 0 30.92 -999 ? N2 5GP A 502 >MET^B 121 25.08 -32.53 -32.99 26.07 -33.51 -29.07 25.58 -33.02 -31.03 2 0 27.87 -999 ? N2 5GP A 502 >ALA^B 122 26.74 -29.63 -34.77 25.94 -28.77 -35.77 26.34 -29.20 -35.27 2 0 27.18 -999 ? N2 5GP B 502 >PHE^B 123 30.48 -29.59 -31.51 29.84 -31.58 -29.65 30.16 -30.59 -30.58 3 0 27.69 -999 ? N2 5GP B 502 >LEU^B 124 28.40 -23.20 -34.10 26.78 -23.51 -35.51 27.59 -23.36 -34.80 3 0 23.04 -999 ? N2 5GP B 502 >SER.B 125 32.33 -21.42 -32.96 32.59 -19.79 -34.74 32.46 -20.61 -33.85 2 0 23.14 -999 ? N2 5GP B 502 >ILE.B 126 31.44 -19.10 -28.84 30.77 -19.32 -27.57 31.11 -19.21 -28.21 3 0 18.53 -999 ? N2 5GP B 502 >PRO.B 127 30.08 -14.98 -32.03 32.03 -15.91 -31.44 31.06 -15.44 -31.74 3 0 18.18 -999 ? N2 5GP B 502 >ASN.B 128 34.94 -12.00 -29.01 36.73 -13.13 -29.15 35.83 -12.56 -29.08 2 0 20.35 -999 ? N2 5GP B 502 >THR^B 129 30.67 -10.56 -29.19 31.79 -8.77 -29.69 31.23 -9.67 -29.44 2 0 15.54 -999 ? N2 5GP B 502 >MET^B 130 27.06 -10.62 -30.33 26.01 -14.38 -28.98 26.53 -12.50 -29.65 2 0 12.90 -999 ? N2 5GP B 502 >GLN^B 131 25.32 -7.47 -33.62 26.59 -5.94 -32.88 25.95 -6.70 -33.25 2 0 14.25 -999 ? N2 5GP B 502 >VAL^B 132 21.51 -7.75 -28.89 21.57 -8.47 -26.85 21.54 -8.11 -27.87 3 0 7.55 -999 ? N2 5GP B 502 >SER^B 133 18.25 -6.04 -29.80 18.37 -6.15 -32.20 18.31 -6.09 -31.00 2 0 10.74 -999 ? O6 5GP B 502 >GLN^B 134 18.37 -4.54 -25.16 19.89 -5.12 -23.80 19.13 -4.83 -24.48 2 0 -3.71 -999 ? N2 5GP B 502s >ARG.B 135 11.28 -2.68 -26.28 9.47 -0.72 -24.72 10.38 -1.70 -25.50 2 0 3.37 -999 ? O2' 5GP B 504s >ARG.B 136 16.95 -3.36 -19.17 16.36 -5.07 -16.71 16.65 -4.21 -17.94 2 0 -3.08 -999 ? O2P 5GP B 501s >LYS.B 137 18.65 1.40 -24.20 18.69 6.38 -21.89 18.67 3.89 -23.04 2 0 -5.11 -999 ? O2P 5GP B 504s >GLU.B 138 21.18 2.98 -20.18 21.15 5.10 -19.91 21.17 4.04 -20.05 2 0 5.45 -999 ? O2' 5GP B 503 >PRO.B 139 25.30 -0.36 -19.93 23.09 -0.71 -19.86 24.20 -0.53 -19.90 3 0 8.32 -999 ? O1P 5GP B 504 >ARG.B 140 18.48 -1.60 -15.75 15.49 -1.20 -16.31 16.99 -1.40 -16.03 2 0 -3.18 -999 ? N7 5GP B 501s >PHE^B 141 26.84 -0.62 -14.42 27.57 -0.06 -17.06 27.21 -0.34 -15.74 3 0 8.94 -999 ? N2 5GP B 503 >GLU^B 142 24.15 -6.16 -11.17 22.42 -7.23 -10.70 23.29 -6.70 -10.94 2 0 7.38 -999 ? O1P 5GP B 501 >LEU^B 143 25.90 -1.36 -6.71 24.72 0.35 -7.26 25.31 -0.50 -6.99 3 0 9.83 -999 ? N2 5GP B 503 >ASN^B 144 24.52 -3.95 -2.22 23.95 -5.65 -3.33 24.24 -4.80 -2.78 2 0 12.34 -999 ? O1P 5GP B 501 >LEU^B 145 24.92 1.95 -2.29 26.89 1.97 -3.21 25.91 1.96 -2.75 3 0 13.35 -999 ? N2 5GP B 503 >ALA^B 146 22.31 1.72 1.57 22.69 1.35 2.99 22.50 1.53 2.28 2 0 17.21 -999 ? N1 5GP B 503 >GLY^B 147 20.63 5.07 1.65 20.08 4.49 1.96 20.35 4.78 1.80 1 0 16.01 -999 ? N1 5GP B 503 >LYS^B 148 17.36 6.88 2.29 17.22 5.95 7.76 17.29 6.42 5.02 2 0 21.41 -999 ? O6 5GP B 503 >VAL^B 149 14.47 7.64 0.01 12.79 6.35 -0.47 13.63 6.99 -0.23 3 0 14.50 -999 ? O6 5GP B 503 >LEU^B 150 14.17 12.36 0.54 13.98 14.36 1.35 14.08 13.36 0.95 3 0 19.37 -999 ? C5 5GP B 503 >PHE^B 151 7.59 10.93 -1.38 5.20 11.30 -2.86 6.39 11.12 -2.12 3 0 17.10 -999 ? C8 5GP B 503 >ASP.B 152 6.03 14.20 1.43 4.82 14.44 -0.29 5.42 14.32 0.57 2 0 20.92 -999 ? C8 5GP B 503 >GLU.B 153 9.59 17.83 4.29 11.56 18.37 3.78 10.58 18.10 4.04 2 0 24.92 -999 ? N9 5GP B 503 >HIS^B 154 8.86 9.48 5.42 9.03 7.54 6.22 8.95 8.51 5.82 3 0 21.30 -999 ? O6 5GP B 503 >ARG^B 155 16.17 11.62 5.25 16.10 14.61 4.54 16.14 13.12 4.90 2 0 22.75 -999 ? N1 5GP B 503 >GLY^B 156 12.56 5.67 4.26 13.30 6.05 3.99 12.93 5.86 4.13 1 0 18.03 -999 ? O6 5GP B 503 >ASP^B 157 15.76 2.10 5.27 16.23 2.87 7.17 15.99 2.48 6.22 2 0 19.98 -999 ? O6 5GP B 503 >CYH^B 158 16.52 1.77 0.94 17.32 4.00 -0.65 16.92 2.88 0.14 2 0 12.94 -999 ? O6 5GP B 503 >GLU^B 159 19.92 -1.87 0.87 20.73 -3.83 1.01 20.33 -2.85 0.94 2 0 14.42 -999 ? O1P 5GP B 501 >LEU^B 160 21.31 1.91 -4.71 21.31 3.35 -6.29 21.31 2.63 -5.50 3 0 8.92 -999 ? N2 5GP B 503 >ARG^B 161 20.25 -4.21 -4.17 19.09 -6.47 -2.46 19.67 -5.34 -3.32 2 0 10.19 -999 ? O1P 5GP B 501 >ASP^B 162 20.72 -2.25 -11.05 18.82 -1.77 -11.79 19.77 -2.01 -11.42 2 0 -3.21 -999 ? N1 5GP B 503s >LEU^B 163 23.23 2.66 -10.62 23.55 4.78 -10.33 23.39 3.72 -10.47 3 0 6.30 -999 ? N2 5GP B 503 >SER.B 164 22.30 3.24 -15.10 20.00 3.51 -15.73 21.15 3.38 -15.41 2 0 -3.06 -999 ? N2 5GP B 503s >ARG.B 165 25.49 6.50 -19.55 25.47 8.18 -22.10 25.48 7.34 -20.83 2 0 10.95 -999 ? O2' 5GP B 503 >SER.B 166 19.12 7.20 -16.80 19.23 7.32 -19.22 19.17 7.26 -18.01 2 0 -4.56 -999 ? O2' 5GP B 503s >GLY^B 167 17.65 5.32 -13.84 18.42 5.07 -13.89 18.04 5.20 -13.87 1 0 -3.52 -999 ? N3 5GP B 503s >CYH^B 168 18.10 2.89 -10.99 17.65 4.64 -8.81 17.88 3.76 -9.90 2 0 -6.11 -999 ? C2 5GP B 503s >ARG^B 169 15.51 -3.65 -9.85 12.63 -3.28 -10.86 14.07 -3.46 -10.35 2 0 3.15 -999 ? O4' 5GP B 501s >PHE^B 170 14.90 2.39 -4.65 12.52 3.84 -4.49 13.71 3.12 -4.57 3 0 8.83 -999 ? O6 5GP B 503 >ILE^B 171 14.80 -3.32 -2.44 15.72 -4.39 -2.54 15.26 -3.85 -2.49 3 0 9.93 -999 ? O1P 5GP B 501 >THR.B 172 13.07 -0.94 0.85 11.33 0.22 0.31 12.20 -0.36 0.58 2 0 13.25 -999 ? O6 5GP B 503 >PRO.B 173 13.83 -1.54 5.08 12.54 -2.44 3.51 13.18 -1.99 4.29 3 0 15.25 -999 ? N2 5GP A 501 >PRO.B 174 9.87 -6.42 4.70 9.61 -4.50 3.60 9.74 -5.46 4.15 3 0 11.21 -999 ? N2 5GP A 501 >LEU.B 175 7.37 -2.76 7.66 6.63 -4.44 8.80 7.00 -3.60 8.23 3 0 14.63 -999 ? N2 5GP A 501 >GLY.B 176 8.45 0.69 4.59 7.76 0.33 4.40 8.11 0.51 4.50 1 0 15.68 -999 ? N2 5GP A 501 >LYS.B 177 6.20 3.40 3.14 3.74 6.90 0.19 4.97 5.15 1.67 2 0 18.18 -999 ? N7 5GP B 503 >THR.B 178 5.18 2.37 -0.39 4.08 0.59 -1.03 4.63 1.48 -0.71 2 0 13.28 -999 ? N2 5GP A 501 >TYR.B 179 8.00 5.37 -2.68 9.42 5.88 -0.33 8.71 5.63 -1.51 3 0 14.06 -999 ? O6 5GP B 503 >GLN.B 180 1.00 5.22 -7.25 0.86 3.10 -7.51 0.93 4.16 -7.38 2 0 12.46 -999 ? N2 5GP B 501 >VAL.B 181 4.16 5.09 -10.05 3.74 3.83 -11.77 3.95 4.46 -10.91 3 0 8.99 -999 ? N2 5GP B 501 >GLY.B 182 4.80 8.74 -10.91 5.12 8.44 -10.22 4.96 8.59 -10.56 1 0 10.64 -999 ? O2P 5GP B 503 >ASP.B 183 5.98 8.84 -6.12 4.10 8.56 -5.22 5.04 8.70 -5.67 2 0 14.78 -999 ? C8 5GP B 503 >LEU^B 184 8.81 13.63 -7.64 8.03 14.56 -9.39 8.42 14.09 -8.52 3 0 13.71 -999 ? O4' 5GP B 503 >VAL^B 185 11.43 10.92 -4.89 10.94 8.77 -4.84 11.19 9.84 -4.87 3 0 12.91 -999 ? C8 5GP B 503 >ALA^B 186 15.08 11.53 -4.08 15.34 12.94 -3.54 15.21 12.23 -3.81 2 0 15.58 -999 ? N3 5GP B 503 >LEU^B 187 17.94 7.62 -4.11 16.56 5.98 -4.44 17.25 6.80 -4.27 3 0 11.00 -999 ? N1 5GP B 503 >GLU^B 188 19.09 12.05 0.28 18.26 12.91 2.03 18.68 12.48 1.16 2 0 19.66 -999 ? N2 5GP B 503 >ILE^B 189 23.36 6.68 -2.20 22.64 5.47 -2.28 23.00 6.08 -2.24 3 0 13.31 -999 ? N2 5GP B 503 >PHE^B 190 24.15 6.20 3.95 21.85 6.41 5.54 23.00 6.31 4.74 3 0 19.78 -999 ? N2 5GP B 503 >SER^B 191 28.88 8.05 0.69 29.02 10.31 1.55 28.95 9.18 1.12 2 0 20.64 -999 ? N2 5GP B 503 >ASP^B 192 31.29 7.44 4.69 29.81 8.24 5.93 30.55 7.84 5.31 2 0 23.78 -999 ? N2 5GP B 503 >LEU.B 193 31.47 2.16 5.71 31.96 1.64 3.66 31.72 1.90 4.69 3 0 22.76 -999 ? N2 5GP B 503 >ARG.B 194 30.93 5.45 11.94 31.03 2.40 12.38 30.98 3.93 12.16 2 0 29.09 -999 ? N2 5GP B 503 >GLY^B 195 25.91 6.57 7.23 26.75 6.86 7.26 26.33 6.71 7.24 1 0 22.95 -999 ? N2 5GP B 503 >THR^B 196 26.55 10.21 8.11 28.43 10.63 9.10 27.49 10.42 8.61 2 0 26.66 -999 ? N2 5GP B 503 >LYS^B 197 27.06 11.77 4.67 32.16 14.53 3.48 29.61 13.15 4.08 2 0 25.63 -999 ? N2 5GP B 503 >THR^B 198 25.48 11.05 1.30 23.51 11.27 2.08 24.50 11.16 1.69 2 0 19.41 -999 ? N2 5GP B 503 >PHE.B 199 27.22 9.42 -3.31 29.28 7.53 -3.21 28.25 8.47 -3.26 3 0 15.99 -999 ? N2 5GP B 503 >PRO.B 200 26.16 15.31 -4.75 24.65 13.90 -3.96 25.40 14.60 -4.36 3 0 17.63 -999 ? N2 5GP B 503 >PRO.B 201 19.94 15.33 -4.30 21.11 13.44 -4.41 20.53 14.39 -4.35 3 0 16.21 -999 ? N2 5GP B 503 >LEU^B 202 19.64 9.28 -7.35 21.67 8.53 -7.41 20.66 8.91 -7.38 3 0 10.13 -999 ? N2 5GP B 503 >THR^B 203 16.05 12.53 -8.10 16.70 14.55 -7.92 16.37 13.54 -8.01 2 0 13.83 -999 ? C1' 5GP B 503 >GLY^B 204 13.38 11.08 -10.36 13.05 11.09 -9.62 13.22 11.09 -9.99 1 0 9.35 -999 ? O4' 5GP B 503 >LYS^B 205 9.99 9.47 -10.93 5.99 12.71 -12.05 7.99 11.09 -11.49 2 0 11.91 -999 ? O2P 5GP B 503 >ILE^B 206 7.98 5.59 -8.70 8.79 4.69 -7.90 8.38 5.14 -8.30 3 0 8.65 -999 ? N7 5GP B 503 >CYH^B 207 8.55 4.18 -13.12 9.34 3.16 -15.58 8.95 3.67 -14.35 2 0 -3.09 -999 ? O1P 5GP B 503s >ASN^B 208 8.09 -0.25 -12.93 10.22 -0.52 -12.94 9.15 -0.38 -12.94 2 0 3.32 -999 ? C4 5GP B 501s >LEU^B 209 6.54 -0.46 -7.56 4.51 0.09 -7.05 5.53 -0.18 -7.31 3 0 9.09 -999 ? C1' 5GP B 501 >GLN^B 210 8.07 -5.76 -9.51 9.27 -4.08 -10.08 8.67 -4.92 -9.80 2 0 -3.35 -999 ? O4' 5GP B 501s >ARG^B 211 5.75 -3.10 -1.77 6.04 -2.95 1.30 5.90 -3.02 -0.24 2 0 10.59 -999 ? N2 5GP A 501 >SER^B 212 4.05 -7.86 -1.55 5.95 -9.32 -1.31 5.00 -8.59 -1.43 2 0 -3.80 -999 ? N2 5GP A 501s >LEU.B 213 3.18 -9.15 3.05 1.18 -8.80 3.78 2.18 -8.98 3.41 3 0 6.89 -999 ? O2P 5GP A 503 >HIS.B 214 6.87 -11.47 2.99 5.38 -12.43 4.11 6.13 -11.95 3.55 3 0 5.97 -999 ? O2P 5GP A 503 >HIS.B 215 9.71 -9.70 -1.65 10.01 -11.63 -0.89 9.86 -10.67 -1.27 3 0 5.24 -999 ? N2 5GP A 504 >ALA^B 216 9.18 -3.85 -2.16 8.95 -2.88 -1.03 9.06 -3.37 -1.60 2 0 10.58 -999 ? N2 5GP A 501 >ARG^B 217 12.71 -6.56 -5.78 11.48 -9.32 -5.29 12.10 -7.94 -5.53 2 0 5.28 -999 ? N2 5GP A 504 >TYR^B 218 10.12 1.14 -5.46 8.31 0.83 -3.37 9.22 0.99 -4.41 3 0 9.94 -999 ? O6 5GP B 503 >GLY^B 219 12.44 1.10 -10.89 11.92 1.65 -10.36 12.18 1.38 -10.62 1 0 -3.36 -999 ? N7 5GP B 503s >LEU^B 220 13.90 5.33 -9.79 13.95 7.18 -8.73 13.92 6.25 -9.26 3 0 -7.04 -999 ? C4 5GP B 503s >GLU^B 221 13.32 8.08 -16.39 12.05 7.86 -18.08 12.69 7.97 -17.24 2 0 -3.74 -999 ? C5' 5GP B 503s >PHE^B 222 18.15 9.18 -12.54 19.45 7.12 -11.14 18.80 8.15 -11.84 3 0 7.03 -999 ? N2 5GP B 503 >ASN~B 223 14.31 14.85 -13.21 15.18 15.38 -11.34 14.75 15.12 -12.28 2 0 12.53 -999 ? O4' 5GP B 503 >GLU~B 224 18.71 17.91 -17.02 18.26 19.45 -18.39 18.49 18.68 -17.70 2 0 15.39 -999 ? O2' 5GP B 503 >GLU~B 225 20.76 18.20 -10.67 20.71 19.97 -9.52 20.73 19.09 -10.09 2 0 18.47 -999 ? O2' 5GP B 503 >GLY~B 226 19.22 13.39 -11.22 19.61 13.66 -11.93 19.42 13.52 -11.58 1 0 11.82 -999 ? O2' 5GP B 503 >ARG~B 227 18.93 12.40 -17.66 20.22 10.16 -19.32 19.57 11.28 -18.49 2 0 7.34 -999 ? O2' 5GP B 503 >ASN~B 228 23.85 15.84 -13.36 25.79 16.71 -13.54 24.82 16.28 -13.45 2 0 16.42 -999 ? O2' 5GP B 503 >ASN~B 229 23.26 13.41 -8.66 23.11 15.52 -8.30 23.18 14.46 -8.48 2 0 15.80 -999 ? N2 5GP B 503 >ALA~B 230 24.01 9.47 -11.07 22.93 8.94 -12.01 23.47 9.21 -11.54 2 0 8.86 -999 ? N2 5GP B 503 >LYS~B 231 27.05 10.06 -13.33 30.93 13.21 -16.67 28.99 11.63 -15.00 2 0 17.24 -999 ? N2 5GP B 503 >ASN~B 232 28.36 13.17 -9.81 28.14 14.73 -11.29 28.25 13.95 -10.55 2 0 16.55 -999 ? N2 5GP B 503 >LEU~B 233 26.52 8.55 -7.63 25.98 6.79 -6.45 26.25 7.67 -7.04 3 0 12.01 -999 ? N2 5GP B 503 >LEU~B 234 28.61 6.21 -11.80 27.37 4.72 -12.74 27.99 5.47 -12.27 3 0 10.32 -999 ? N2 5GP B 503 >ALA~B 235 32.43 7.99 -10.93 32.61 9.38 -11.55 32.52 8.68 -11.24 2 0 16.24 -999 ? N2 5GP B 503 >GLN~B 236 32.23 10.51 -6.59 31.17 11.81 -5.22 31.70 11.16 -5.91 2 0 18.45 -999 ? N2 5GP B 503 >LEU.B 237 31.27 3.62 -7.48 29.40 3.56 -6.40 30.34 3.59 -6.94 3 0 13.80 -999 ? N2 5GP B 503 >LYS^B 238 35.18 1.51 -7.03 38.57 0.62 -2.30 36.87 1.06 -4.66 2 0 23.10 -999 ? N2 5GP B 503 >PHE^B 239 34.35 -2.52 -11.71 33.31 -4.63 -13.22 33.83 -3.57 -12.47 3 0 16.07 -999 ? N2 5GP B 503 >ASN.B 240 34.64 -5.12 -6.72 35.68 -6.62 -5.64 35.16 -5.87 -6.18 2 0 20.59 -999 ? N2 5GP B 503 >GLY.B 241 34.82 -7.18 -11.20 34.21 -6.80 -10.90 34.52 -6.99 -11.05 1 0 18.34 -999 ? N2 5GP B 502 >THR.B 242 31.17 -8.06 -10.67 30.30 -9.21 -9.06 30.73 -8.64 -9.86 2 0 15.02 -999 ? O2' 5GP B 502 >LYS.B 243 29.59 -5.07 -8.96 25.76 -8.73 -8.43 27.68 -6.90 -8.69 2 0 11.25 -999 ? O1P 5GP B 501 >LEU^B 244 29.83 -0.34 -8.47 30.03 0.29 -10.51 29.93 -0.03 -9.49 3 0 12.22 -999 ? N2 5GP B 503 >THR^B 245 31.40 -0.64 -4.30 33.20 -1.72 -3.78 32.30 -1.18 -4.04 2 0 18.03 -999 ? N2 5GP B 503 >LEU.B 246 31.33 2.61 -0.67 29.77 4.01 -0.13 30.55 3.31 -0.40 3 0 18.12 -999 ? N2 5GP B 503 >ASN.B 247 35.85 3.11 -0.05 35.29 3.67 1.92 35.57 3.39 0.93 2 0 23.10 -999 ? N2 5GP B 503