REMARK SOURCE hebe.pdb HEADER UNKNOWN FUNCTION 23-FEB-07 2OYY COMPND HEXAMERIC CYTOCHROME; COMPND 3 CHAIN: A, B, C, D, E, F, G, H; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SILICIBACTER POMEROYI; SOURCE 3 ORGANISM_TAXID: 89184; SOURCE 4 GENE: SPOA0176; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI K12; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 83333; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: K12; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET AUTHOR H.DOBBEK HET IOD A9001 1 HET IOD B9001 1 HET IOD C9001 1 HET IOD D9001 1 HET IOD E9001 1 HET IOD F9001 1 HET IOD G9001 1 HET IOD H9001 1 HET IOD D9002 1 HET IOD C9003 1 HET IOD E9004 1 HET IOD B9005 1 HET HEM A 201 43 HET HEM B 201 43 HET HEM C 201 43 HET HEM D 201 43 HET HEM E 201 43 HET HEM F 201 43 HET HEM G 201 43 HET HEM H 201 43 SITE 1 AC1 1 ARG A 23 SITE 1 AC2 1 ARG B 23 SITE 1 AC3 2 ARG C 23 ARG C 36 SITE 1 AC4 1 ARG D 23 SITE 1 AC5 2 ARG E 23 ARG E 36 SITE 1 AC6 1 ARG F 23 SITE 1 AC7 1 ARG H 36 SITE 1 AC8 4 SER B 22 ARG B 23 VAL B 26 HEM B 201 SITE 1 AC9 13 VAL A 19 SER A 22 ARG A 23 VAL A 26 SITE 1 BC1 17 LYS A 28 THR A 29 PRO A 31 SER A 54 SITE 1 BC2 13 THR A 1 TRP A 2 SER C 22 ARG C 23 SITE 1 BC3 11 LYS C 28 THR C 29 SER D 22 ARG D 23 SITE 1 BC4 14 SER E 22 ARG E 23 VAL E 26 ARG E 36 SITE 1 BC5 12 SER C 54 LYS E 28 THR E 29 SER F 22 SITE 1 BC6 17 THR D 1 TRP D 2 LYS D 20 LYS D 28 SITE 1 BC7 14 GLN B 34 LEU E 50 SER E 54 LYS G 28 >TRP.A 2 -24.08 5.14 -2.28 -20.23 4.35 -2.37 -22.16 4.75 -2.33 3 0 -5.85 -999 ? O1A HEM C 201s >LEU.A 3 -19.88 5.97 -5.62 -17.74 6.47 -5.52 -18.81 6.22 -5.57 3 0 8.95 -999 ? O1A HEM C 201 >PRO.A 4 -21.89 10.00 -9.13 -21.68 7.76 -9.11 -21.79 8.88 -9.12 3 0 5.63 -999 ? I IOD C9003 >THR.A 5 -18.27 8.05 -11.16 -18.86 9.35 -12.79 -18.57 8.70 -11.98 2 0 8.24 -999 ? I IOD C9003 >LEU.A 6 -13.66 7.29 -10.44 -13.43 5.60 -9.17 -13.54 6.45 -9.80 3 0 13.63 -999 ? I IOD C9003 >VAL.A 7 -14.24 10.97 -13.14 -14.52 10.81 -15.29 -14.38 10.89 -14.21 3 0 12.18 -999 ? I IOD C9003 >THR.A 8 -13.39 14.32 -11.56 -12.55 14.56 -9.57 -12.97 14.44 -10.56 2 0 12.91 -999 ? I IOD C9003 >ALA.A 9 -13.08 17.73 -13.33 -14.09 18.87 -13.24 -13.58 18.30 -13.29 2 0 13.18 -999 ? I IOD C9003 >THR~A 10 -9.98 18.88 -11.43 -10.66 20.79 -10.63 -10.32 19.83 -11.03 2 0 13.44 -999 ? O1A HEM D 201 >PRO~A 11 -5.68 17.86 -11.07 -7.60 17.45 -9.99 -6.64 17.65 -10.53 3 0 17.57 -999 ? CMA HEM A 201 >GLN~A 12 -9.05 21.15 -5.20 -8.87 23.25 -5.28 -8.96 22.20 -5.24 2 0 13.20 -999 ? O2A HEM D 201 >GLU~A 13 -13.65 19.09 -8.24 -15.09 19.11 -9.85 -14.37 19.10 -9.05 2 0 10.63 -999 ? I IOD C9001 >GLY~A 14 -10.32 14.10 -6.96 -10.30 14.66 -6.34 -10.31 14.38 -6.65 1 0 12.85 -999 ? CMB HEM A 201 >PHE~A 15 -6.98 15.40 -1.93 -5.63 14.78 0.42 -6.30 15.09 -0.76 3 0 8.58 -999 ? CMB HEM A 201 >ASP~A 16 -13.00 16.79 -2.45 -11.99 18.60 -2.10 -12.50 17.69 -2.27 2 0 8.54 -999 ? CMA HEM A 201 >LEU~A 17 -13.69 12.21 -5.30 -15.08 10.72 -6.15 -14.38 11.46 -5.73 3 0 11.02 -999 ? CAD HEM C 201 >ALA~A 18 -10.75 10.56 -2.18 -9.27 10.81 -2.43 -10.01 10.69 -2.30 2 0 7.96 -999 ? CMB HEM A 201 >VAL~A 19 -11.57 11.94 1.29 -11.08 13.82 2.38 -11.33 12.88 1.83 3 0 -4.29 -999 ? CMB HEM A 201s >LYS~A 20 -15.17 11.04 0.51 -20.44 11.62 -2.97 -17.81 11.33 -1.23 2 0 4.77 -999 ? CAD HEM C 201 >LEU~A 21 -13.52 7.05 -1.67 -14.51 6.49 -3.54 -14.01 6.77 -2.60 3 0 9.69 -999 ? CBB HEM A 201 >SER~A 22 -12.47 7.05 2.77 -10.28 7.99 2.26 -11.38 7.52 2.52 2 0 -4.24 -999 ? CMB HEM A 201s >ARG~A 23 -15.29 11.94 5.59 -17.34 13.42 7.28 -16.31 12.68 6.43 2 0 3.44 -999 ? C1A HEM A 201s >ILE~A 24 -18.54 6.26 1.68 -18.75 5.75 0.93 -18.64 6.00 1.30 3 0 7.12 -999 ? O2D HEM C 201 >ALA~A 25 -16.18 2.90 4.06 -14.72 2.56 3.84 -15.45 2.73 3.95 2 0 6.27 -999 ? CBB HEM A 201 >VAL~A 26 -16.50 4.08 7.64 -15.28 5.38 8.89 -15.89 4.73 8.26 3 0 -4.44 -999 ? CMC HEM A 201s >LYS~A 27 -20.16 5.10 7.41 -24.32 9.68 5.88 -22.24 7.39 6.65 2 0 4.38 -999 ? O2D HEM C 201 >LYS~A 28 -20.98 1.64 5.97 -21.76 1.41 -0.27 -21.37 1.53 2.85 2 0 -7.83 -999 ? CMA HEM B 201s >THR~A 29 -19.22 -0.35 8.63 -17.17 -0.09 8.14 -18.19 -0.22 8.39 2 0 -4.29 -999 ? CHB HEM B 201s >GLN~A 30 -19.92 3.00 13.62 -21.14 1.63 14.73 -20.53 2.32 14.17 2 0 6.77 -999 ? O2A HEM B 201 >PRO.A 31 -24.80 1.26 10.27 -23.38 2.98 10.50 -24.09 2.12 10.39 3 0 -4.51 -999 ? O2A HEM B 201s >ASP~A 32 -24.61 3.61 15.13 -25.38 4.54 16.90 -25.00 4.07 16.01 2 0 9.54 -999 ? O2A HEM B 201 >ALA~A 33 -24.12 8.22 13.54 -25.01 9.21 12.80 -24.56 8.72 13.17 2 0 7.30 -999 ? CMD HEM A 201 >GLN~A 34 -25.27 8.52 19.64 -26.39 7.30 20.98 -25.83 7.91 20.31 2 0 12.21 -999 ? CMD HEM A 201 >VAL~A 35 -21.15 6.41 17.79 -21.35 4.25 17.37 -21.25 5.33 17.58 3 0 6.66 -999 ? CBC HEM A 201 >ARG~A 36 -20.08 6.93 11.08 -23.01 7.75 10.60 -21.54 7.34 10.84 2 0 -5.78 -999 ? I IOD A9001s >ASP~A 37 -20.94 12.01 17.11 -21.89 13.06 15.56 -21.41 12.53 16.34 2 0 -4.17 -999 ? CMD HEM A 201s >THR~A 38 -18.21 9.85 19.83 -19.04 8.85 21.59 -18.63 9.35 20.71 2 0 9.06 -999 ? CAC HEM A 201 >LEU~A 39 -15.31 7.22 16.96 -15.70 5.19 17.58 -15.51 6.21 17.27 3 0 4.30 -999 ? CAC HEM A 201 >ARG~A 40 -14.23 13.93 14.04 -12.67 15.84 12.20 -13.45 14.89 13.12 2 0 -3.79 -999 ? CHA HEM A 201s >ALA~A 41 -14.10 13.43 19.39 -15.08 13.47 20.57 -14.59 13.45 19.98 2 0 8.15 -999 ? CMD HEM A 201 >VAL~A 42 -11.39 10.78 19.94 -11.52 8.82 20.93 -11.46 9.80 20.44 3 0 8.65 -999 ? CAC HEM A 201 >TYR~A 43 -10.57 10.22 14.35 -12.03 11.46 12.28 -11.30 10.84 13.31 3 0 -4.26 -999 ? C1C HEM A 201s >GLU~A 44 -10.97 16.12 16.82 -12.90 16.83 17.27 -11.94 16.47 17.04 2 0 6.17 -999 ? CBD HEM A 201 >LYS.A 45 -7.07 14.90 18.23 -11.06 16.06 22.41 -9.07 15.48 20.32 2 0 11.33 -999 ? CBD HEM A 201 >ASP~A 46 -5.63 10.33 17.87 -4.26 8.67 18.05 -4.94 9.50 17.96 2 0 11.43 -999 ? CMC HEM A 201 >ALA~A 47 -1.77 12.27 15.80 -0.41 12.54 16.42 -1.09 12.40 16.11 2 0 14.51 -999 ? C3B HEM A 201 >ASN~A 48 -1.02 7.41 15.56 0.90 7.62 16.50 -0.06 7.51 16.03 2 0 14.85 -999 ? CAB HEM A 201 >ALA~A 49 -5.03 8.44 13.70 -6.16 8.78 14.63 -5.59 8.61 14.17 2 0 8.19 -999 ? CMC HEM A 201 >LEU~A 50 -4.48 12.97 12.26 -6.09 14.40 12.70 -5.28 13.68 12.48 3 0 8.77 -999 ? C1B HEM A 201 >ILE~A 51 -0.26 9.84 10.49 1.18 9.99 10.63 0.46 9.91 10.56 3 0 11.73 -999 ? CAB HEM A 201 >ALA~A 52 -3.46 6.96 9.34 -3.99 6.13 10.49 -3.72 6.55 9.92 2 0 7.65 -999 ? CAB HEM A 201 >VAL~A 53 -6.28 8.93 7.80 -7.85 10.22 8.56 -7.06 9.58 8.18 3 0 -4.00 -999 ? CAB HEM A 201s >SER~A 54 -4.01 10.62 5.26 -2.33 12.19 4.51 -3.17 11.41 4.88 2 0 -8.22 -999 ? CMB HEM A 201s >ALA~A 55 -2.78 7.10 4.49 -2.29 6.09 5.47 -2.53 6.60 4.98 2 0 8.67 -999 ? CAB HEM A 201 >VAL~A 56 -6.28 5.95 3.47 -8.00 5.25 4.64 -7.14 5.60 4.05 3 0 5.08 -999 ? CBB HEM A 201 >VAL~A 57 -7.06 8.99 1.37 -6.88 11.04 2.17 -6.97 10.01 1.77 3 0 5.07 -999 ? CMB HEM A 201 >ALA~A 58 -3.61 8.51 -0.23 -2.30 8.31 0.53 -2.95 8.41 0.15 2 0 9.77 -999 ? CMB HEM A 201 >THR~A 59 -4.57 5.06 -1.43 -4.52 3.09 -0.60 -4.54 4.07 -1.02 2 0 10.66 -999 ? CBB HEM A 201 >HIS~A 60 -9.91 5.80 -1.35 -11.17 4.25 -0.71 -10.54 5.03 -1.03 3 0 7.99 -999 ? CBB HEM A 201 >PHE~A 61 -5.36 11.68 -4.72 -4.93 13.81 -6.48 -5.14 12.74 -5.60 3 0 12.38 -999 ? CMB HEM A 201 >GLN~A 62 -2.10 5.30 -6.39 -0.75 4.30 -5.07 -1.42 4.80 -5.73 2 0 15.67 -999 ? CMB HEM A 201 >THR~A 63 -7.16 5.15 -7.63 -8.28 3.51 -6.73 -7.72 4.33 -7.18 2 0 14.17 -999 ? CBB HEM A 201 >ILE~A 64 -9.99 9.14 -7.85 -10.44 10.11 -7.36 -10.21 9.62 -7.61 3 0 13.11 -999 ? CMB HEM A 201 >ALA~A 65 -5.95 10.02 -10.19 -4.59 10.20 -9.54 -5.27 10.11 -9.87 2 0 16.08 -999 ? CMB HEM A 201 >ALA~A 66 -5.55 6.99 -12.44 -5.18 5.57 -11.98 -5.37 6.28 -12.21 2 0 18.92 -999 ? CMB HEM A 201 >ALA~A 67 -9.27 7.10 -13.19 -10.42 7.10 -12.18 -9.84 7.10 -12.68 2 0 16.38 -999 ? I IOD C9003 >ASN~A 68 -8.88 11.85 -13.67 -10.77 11.93 -12.74 -9.82 11.89 -13.21 2 0 15.02 -999 ? I IOD C9003 >ASP.A 69 -5.75 9.81 -17.90 -3.95 9.91 -19.03 -4.85 9.86 -18.46 2 0 23.67 -999 ? I IOD C9003 >TYR.A 70 -2.11 10.41 -13.50 -1.54 7.82 -12.66 -1.83 9.12 -13.08 3 0 20.48 -999 ? CMB HEM A 201 >TRP.A 71 -8.58 15.78 -13.19 -7.44 13.56 -10.13 -8.01 14.67 -11.66 3 0 17.57 -999 ? I IOD C9003 >TRP.B 2 -16.39 -18.04 -2.21 -14.01 -14.90 -2.15 -15.20 -16.47 -2.18 3 0 12.06 -999 ? I IOD B9005 >LEU.B 3 -15.05 -14.13 -5.53 -14.03 -12.22 -5.81 -14.54 -13.17 -5.67 3 0 13.42 -999 ? I IOD B9005 >PRO.B 4 -19.57 -13.90 -9.02 -17.53 -14.83 -9.00 -18.55 -14.37 -9.01 3 0 17.80 -999 ? I IOD B9005 >THR.B 5 -16.14 -11.81 -11.26 -17.75 -11.72 -12.69 -16.95 -11.76 -11.97 2 0 20.12 -999 ? CMB HEM B 201 >LEU.B 6 -12.94 -8.29 -10.73 -11.40 -8.87 -9.30 -12.17 -8.58 -10.01 3 0 16.43 -999 ? CMB HEM B 201 >VAL.B 7 -16.52 -6.86 -13.29 -16.61 -7.14 -15.43 -16.57 -7.00 -14.36 3 0 20.17 -999 ? CMB HEM B 201 >THR.B 8 -18.98 -4.41 -11.80 -18.92 -3.62 -9.77 -18.95 -4.01 -10.79 2 0 15.78 -999 ? CMA HEM B 201 >ALA.B 9 -21.58 -2.21 -13.52 -23.11 -2.38 -13.38 -22.35 -2.29 -13.45 2 0 15.67 -999 ? O1A HEM C 201 >THR~B 10 -21.01 1.02 -11.55 -23.06 1.55 -11.01 -22.03 1.29 -11.28 2 0 11.52 -999 ? O1A HEM C 201 >PRO~B 11 -18.11 4.19 -10.73 -18.75 2.29 -9.77 -18.43 3.24 -10.25 3 0 12.17 -999 ? I IOD C9003 >GLN~B 12 -22.91 2.91 -5.26 -24.40 4.43 -5.39 -23.65 3.67 -5.32 2 0 5.39 -999 ? O1A HEM C 201 >GLU~B 13 -23.22 -1.89 -8.10 -24.12 -2.72 -9.79 -23.67 -2.31 -8.95 2 0 13.41 -999 ? O1A HEM C 201 >GLY~B 14 -17.24 -1.51 -7.18 -17.74 -1.32 -6.50 -17.49 -1.42 -6.84 1 0 13.02 -999 ? CMB HEM B 201 >PHE~B 15 -16.78 1.83 -2.11 -15.52 2.86 0.14 -16.15 2.34 -0.99 3 0 8.81 -999 ? CMB HEM B 201 >ASP~B 16 -21.00 -2.80 -2.80 -22.36 -1.20 -2.26 -21.68 -2.00 -2.53 2 0 8.74 -999 ? CMA HEM B 201 >LEU~B 17 -17.36 -5.80 -5.26 -16.56 -7.73 -6.02 -16.96 -6.77 -5.64 3 0 11.76 -999 ? CMB HEM B 201 >ALA~B 18 -14.39 -3.99 -2.41 -13.91 -2.59 -2.63 -14.15 -3.29 -2.52 2 0 8.14 -999 ? CMB HEM B 201 >VAL~B 19 -15.99 -4.00 1.05 -17.35 -2.63 2.08 -16.67 -3.32 1.56 3 0 4.36 -999 ? CMB HEM B 201 >LYS~B 20 -17.19 -7.62 0.63 -19.91 -12.29 -2.87 -18.55 -9.95 -1.12 2 0 11.86 -999 ? I IOD B9001 >LEU~B 21 -12.99 -8.20 -1.67 -13.00 -9.21 -3.58 -12.99 -8.70 -2.63 3 0 9.41 -999 ? CBB HEM B 201 >SER~B 22 -12.34 -7.10 2.60 -12.10 -4.78 2.05 -12.22 -5.94 2.32 2 0 4.35 -999 ? CBB HEM B 201s >ARG~B 23 -18.01 -7.28 5.53 -20.35 -8.48 7.07 -19.18 -7.88 6.30 2 0 -3.72 -999 ? C1A HEM B 201s >ILE~B 24 -14.65 -12.90 1.66 -14.25 -13.29 0.94 -14.45 -13.09 1.30 3 0 7.19 -999 ? I IOD B9005 >ALA~B 25 -10.65 -12.47 4.11 -9.65 -11.35 3.83 -10.15 -11.91 3.97 2 0 5.08 -999 ? I IOD B9005 >VAL~B 26 -11.51 -12.36 7.85 -11.95 -11.01 9.49 -11.73 -11.69 8.67 3 0 3.41 -999 ? I IOD B9005s >LYS~B 27 -14.29 -14.83 7.33 -19.88 -15.42 4.62 -17.08 -15.13 5.98 2 0 6.67 -999 ? I IOD B9001 >LYS~B 28 -11.86 -17.32 5.74 -12.04 -18.37 -0.45 -11.95 -17.85 2.64 2 0 -12.00 -999 ? I IOD B9005s >THR~B 29 -9.19 -16.87 8.41 -8.45 -14.80 8.36 -8.82 -15.84 8.39 2 0 -7.44 -999 ? I IOD B9005s >GLN~B 30 -12.53 -15.79 13.52 -12.05 -17.56 14.63 -12.29 -16.67 14.08 2 0 7.06 -999 ? CBC HEM B 201 >PRO.B 31 -13.20 -20.80 10.51 -14.01 -18.71 10.60 -13.60 -19.75 10.55 3 0 9.19 -999 ? CBC HEM B 201 >ASP~B 32 -15.39 -19.59 15.23 -16.58 -19.71 16.99 -15.98 -19.65 16.10 2 0 9.93 -999 ? CBC HEM B 201 >ALA~B 33 -18.99 -16.77 13.34 -20.30 -17.08 12.60 -19.64 -16.92 12.97 2 0 7.12 -999 ? CMD HEM B 201 >GLN~B 34 -19.89 -17.28 19.48 -18.99 -18.69 20.80 -19.44 -17.99 20.14 2 0 -11.63 -999 ? CMD HEM B 201s >VAL~B 35 -16.13 -15.03 17.94 -14.46 -16.35 17.43 -15.29 -15.69 17.68 3 0 6.73 -999 ? CBC HEM B 201 >ARG~B 36 -15.96 -13.71 11.18 -17.75 -15.85 9.86 -16.86 -14.78 10.52 2 0 -5.22 -999 ? I IOD B9001s >ASP~B 37 -20.80 -12.24 17.15 -22.23 -12.53 15.60 -21.52 -12.39 16.38 2 0 -4.23 -999 ? CMD HEM B 201s >THR~B 38 -17.47 -10.84 19.82 -16.83 -12.17 21.41 -17.15 -11.50 20.62 2 0 8.86 -999 ? CAC HEM B 201 >LEU~B 39 -13.73 -9.46 17.09 -12.40 -10.96 17.88 -13.07 -10.21 17.48 3 0 4.50 -999 ? CAC HEM B 201 >ARG~B 40 -19.26 -5.52 14.00 -20.05 -2.88 12.63 -19.65 -4.20 13.31 2 0 -4.11 -999 ? CHA HEM B 201s >ALA~B 41 -18.40 -5.39 19.28 -18.95 -6.25 20.43 -18.68 -5.82 19.86 2 0 8.26 -999 ? CMD HEM B 201 >VAL~B 42 -14.82 -4.26 19.84 -13.34 -5.50 20.92 -14.08 -4.88 20.38 3 0 8.63 -999 ? CAC HEM B 201 >TYR~B 43 -14.20 -3.83 14.13 -15.98 -4.40 12.03 -15.09 -4.12 13.08 3 0 -4.27 -999 ? C1C HEM B 201s >GLU~B 44 -19.06 -2.04 16.86 -21.03 -2.80 16.87 -20.05 -2.42 16.87 2 0 5.79 -999 ? O2D HEM B 201 >LYS.B 45 -16.41 1.25 18.33 -19.54 -1.62 22.45 -17.98 -0.18 20.39 2 0 11.29 -999 ? O2D HEM B 201 >ASP~B 46 -11.80 0.38 17.69 -9.76 0.79 18.04 -10.78 0.59 17.86 2 0 9.37 -999 ? CMC HEM A 201 >ALA~B 47 -11.47 4.61 15.71 -11.09 5.93 16.34 -11.28 5.27 16.02 2 0 5.38 -999 ? CMC HEM A 201 >ASN~B 48 -6.94 2.93 15.62 -6.16 4.71 16.54 -6.55 3.82 16.08 2 0 8.95 -999 ? CMC HEM A 201 >ALA~B 49 -9.93 0.00 13.81 -10.75 -0.87 14.74 -10.34 -0.43 14.27 2 0 8.09 -999 ? CMC HEM B 201 >LEU~B 50 -13.49 2.73 12.00 -15.51 2.03 12.71 -14.50 2.38 12.36 3 0 -4.31 -999 ? CMC HEM A 201s >ILE~B 51 -8.70 4.77 10.31 -8.22 5.96 10.67 -8.46 5.36 10.49 3 0 4.81 -999 ? CAB HEM A 201 >ALA~B 52 -7.67 0.51 9.31 -7.28 -0.44 10.41 -7.47 0.03 9.86 2 0 7.51 -999 ? CAB HEM B 201 >VAL~B 53 -10.84 -1.07 7.89 -12.74 -1.78 8.61 -11.79 -1.42 8.25 3 0 -3.77 -999 ? CAB HEM B 201s >SER~B 54 -11.24 1.80 5.39 -11.62 4.10 4.63 -11.43 2.95 5.01 2 0 -3.53 -999 ? CBB HEM A 201s >ALA~B 55 -7.65 1.16 4.26 -6.45 1.15 5.18 -7.05 1.16 4.72 2 0 7.69 -999 ? CBB HEM A 201 >VAL~B 56 -8.19 -2.50 3.39 -8.41 -4.36 4.45 -8.30 -3.43 3.92 3 0 4.72 -999 ? CBB HEM B 201 >VAL~B 57 -11.21 -1.61 1.25 -13.07 -0.69 2.21 -12.14 -1.15 1.73 3 0 -5.06 -999 ? CMB HEM B 201s >ALA~B 58 -9.16 1.23 -0.29 -8.49 2.38 0.49 -8.83 1.80 0.10 2 0 8.19 -999 ? CBB HEM A 201 >THR~B 59 -6.62 -1.33 -1.46 -4.92 -2.32 -0.58 -5.77 -1.82 -1.02 2 0 10.19 -999 ? CBB HEM B 201 >HIS~B 60 -9.99 -5.66 -1.33 -9.35 -7.57 -0.76 -9.67 -6.61 -1.04 3 0 7.58 -999 ? CBB HEM B 201 >PHE~B 61 -12.65 1.26 -4.77 -14.15 2.82 -6.52 -13.40 2.04 -5.65 3 0 12.44 -999 ? CMB HEM B 201 >GLN~B 62 -5.47 0.56 -6.25 -4.00 1.55 -5.06 -4.73 1.05 -5.66 2 0 14.84 -999 ? CBB HEM A 201 >THR~B 63 -7.91 -3.55 -7.69 -7.21 -5.35 -6.71 -7.56 -4.45 -7.20 2 0 13.69 -999 ? CBB HEM B 201 >ILE~B 64 -12.76 -4.15 -8.07 -13.86 -3.91 -7.23 -13.31 -4.03 -7.65 3 0 13.15 -999 ? CMB HEM B 201 >ALA~B 65 -11.53 -0.17 -10.16 -11.11 1.06 -9.36 -11.32 0.45 -9.76 2 0 15.87 -999 ? CMB HEM B 201 >ALA~B 66 -8.55 -1.16 -12.33 -7.18 -1.58 -11.79 -7.87 -1.37 -12.06 2 0 18.86 -999 ? CMB HEM B 201 >ALA~B 67 -10.42 -4.34 -13.32 -10.85 -5.39 -12.30 -10.64 -4.86 -12.81 2 0 18.22 -999 ? CMB HEM B 201 >ASN~B 68 -14.40 -1.76 -13.56 -15.50 -3.37 -12.70 -14.95 -2.56 -13.13 2 0 18.14 -999 ? CMB HEM B 201 >ASP.B 69 -11.31 -0.11 -17.93 -10.32 1.29 -19.17 -10.82 0.59 -18.55 2 0 21.48 -999 ? I IOD C9003 >TYR.B 70 -9.79 3.38 -13.47 -7.38 2.49 -12.31 -8.59 2.94 -12.89 3 0 19.97 -999 ? I IOD C9003 >TRP.B 71 -17.72 0.87 -13.46 -15.28 0.75 -10.36 -16.50 0.81 -11.91 3 0 15.43 -999 ? I IOD C9003 >TRP.C 2 -19.40 21.10 -16.30 -23.25 21.77 -16.78 -21.32 21.44 -16.54 3 0 11.51 -999 ? CMA HEM D 201 >LEU.C 3 -23.72 19.14 -19.72 -25.91 18.87 -19.64 -24.82 19.01 -19.68 3 0 11.72 -999 ? I IOD C9003 >PRO.C 4 -21.75 14.32 -22.00 -21.98 16.46 -22.58 -21.86 15.39 -22.29 3 0 13.42 -999 ? I IOD C9003 >THR.C 5 -25.54 15.81 -24.34 -25.09 14.16 -25.67 -25.31 14.99 -25.00 2 0 16.17 -999 ? I IOD C9003 >LEU.C 6 -30.13 16.51 -23.38 -30.11 18.33 -22.17 -30.12 17.42 -22.77 3 0 14.69 -999 ? I IOD C9003 >VAL.C 7 -29.60 12.24 -25.34 -29.28 12.06 -27.46 -29.44 12.15 -26.40 3 0 17.39 -999 ? I IOD C9003 >THR.C 8 -29.74 9.15 -23.17 -30.42 9.18 -21.08 -30.08 9.16 -22.12 2 0 13.23 -999 ? I IOD C9003 >ALA.C 9 -29.89 5.39 -23.78 -28.86 4.36 -23.33 -29.38 4.87 -23.56 2 0 16.76 -999 ? I IOD C9003 >THR~C 10 -32.93 4.64 -21.58 -31.86 3.02 -20.59 -32.40 3.83 -21.09 2 0 16.36 -999 ? I IOD C9003 >PRO~C 11 -37.26 5.46 -21.04 -35.29 6.20 -20.26 -36.27 5.83 -20.65 3 0 17.22 -999 ? I IOD C9003 >GLN~C 12 -32.96 3.84 -15.02 -33.14 1.86 -14.35 -33.05 2.85 -14.69 2 0 13.80 -999 ? CMA HEM C 201 >GLU~C 13 -29.33 5.16 -18.86 -27.77 4.78 -20.20 -28.55 4.97 -19.53 2 0 13.81 -999 ? I IOD C9003 >GLY~C 14 -32.78 10.09 -18.43 -32.61 9.73 -17.68 -32.69 9.91 -18.06 1 0 11.98 -999 ? I IOD C9003 >PHE~C 15 -35.45 9.68 -12.95 -37.09 10.42 -10.83 -36.27 10.05 -11.89 3 0 8.91 -999 ? CMB HEM C 201 >ASP~C 16 -29.42 8.79 -13.72 -29.97 7.15 -12.49 -29.70 7.97 -13.11 2 0 8.14 -999 ? I IOD C9003 >LEU~C 17 -29.46 12.91 -17.24 -28.24 14.21 -18.46 -28.85 13.56 -17.85 3 0 9.02 -999 ? I IOD C9003 >ALA~C 18 -32.24 14.98 -14.39 -33.69 14.56 -14.44 -32.96 14.77 -14.41 2 0 7.80 -999 ? CMB HEM C 201 >VAL~C 19 -30.93 14.35 -10.90 -31.18 12.75 -9.41 -31.06 13.55 -10.16 3 0 4.11 -999 ? CMB HEM C 201 >LYS~C 20 -27.44 15.30 -12.12 -22.48 14.59 -16.06 -24.96 14.94 -14.09 2 0 7.28 -999 ? I IOD C9003 >LEU~C 21 -29.71 18.65 -14.80 -29.07 18.63 -16.87 -29.39 18.64 -15.84 3 0 9.25 -999 ? I IOD C9003 >SER~C 22 -30.66 19.30 -10.50 -32.96 18.54 -10.48 -31.81 18.92 -10.49 2 0 -4.41 -999 ? CMB HEM C 201s >ARG~C 23 -27.05 15.43 -6.98 -24.85 14.51 -5.06 -25.95 14.97 -6.02 2 0 3.33 -999 ? C1A HEM C 201s >ILE~C 24 -24.36 20.51 -12.02 -24.30 20.78 -12.92 -24.33 20.64 -12.47 3 0 7.74 -999 ? I IOD C9001 >ALA~C 25 -26.90 24.03 -10.31 -28.37 24.20 -10.68 -27.63 24.12 -10.49 2 0 6.38 -999 ? CMB HEM D 201 >VAL~C 26 -26.41 23.63 -6.56 -27.37 22.32 -5.07 -26.89 22.98 -5.82 3 0 -4.41 -999 ? CMC HEM C 201s >LYS~C 27 -22.66 23.03 -6.98 -18.60 18.29 -8.47 -20.63 20.66 -7.72 2 0 6.94 -999 ? I IOD C9001 >LYS~C 28 -22.30 26.11 -9.21 -22.46 25.52 -15.35 -22.38 25.82 -12.28 2 0 -7.51 -999 ? CMA HEM D 201s >THR~C 29 -24.11 28.56 -6.95 -26.32 28.36 -6.90 -25.22 28.46 -6.92 2 0 -3.99 -999 ? CHB HEM D 201s >GLN~C 30 -22.68 26.35 -1.41 -21.37 27.95 -0.81 -22.02 27.15 -1.11 2 0 7.11 -999 ? CBC HEM C 201 >PRO.C 31 -18.61 28.12 -5.20 -19.59 26.16 -4.70 -19.10 27.14 -4.95 3 0 4.77 -999 ? O2A HEM D 201 >ASP~C 32 -17.80 26.56 -0.18 -16.54 26.28 1.51 -17.17 26.42 0.66 2 0 9.22 -999 ? O1A HEM A 201 >ALA~C 33 -18.05 21.67 -1.02 -17.07 20.65 -1.60 -17.56 21.16 -1.31 2 0 7.47 -999 ? CMD HEM C 201 >GLN~C 34 -16.59 22.46 5.00 -15.47 23.97 6.04 -16.03 23.22 5.52 2 0 4.52 -999 ? O1A HEM A 201 >VAL~C 35 -20.89 23.94 3.15 -20.91 25.99 2.25 -20.90 24.96 2.70 3 0 6.73 -999 ? CBC HEM C 201 >ARG~C 36 -22.64 21.96 -3.01 -19.84 21.38 -4.14 -21.24 21.67 -3.58 2 0 5.23 -999 ? I IOD C9001s >ASP~C 37 -20.56 18.40 3.64 -19.61 17.35 2.04 -20.08 17.88 2.84 2 0 -4.04 -999 ? CMD HEM C 201s >THR~C 38 -23.39 20.87 6.21 -22.52 22.47 7.43 -22.95 21.67 6.82 2 0 8.34 -999 ? O1A HEM A 201 >LEU~C 39 -26.69 22.75 3.16 -26.26 24.92 3.23 -26.47 23.84 3.20 3 0 4.31 -999 ? CBC HEM C 201 >ARG~C 40 -27.22 15.32 1.88 -28.86 12.94 0.92 -28.04 14.13 1.40 2 0 -3.97 -999 ? CBA HEM C 201s >ALA~C 41 -27.28 17.08 6.77 -26.33 17.43 7.91 -26.80 17.25 7.34 2 0 8.06 -999 ? CMD HEM C 201 >VAL~C 42 -30.32 19.37 7.09 -30.23 21.45 7.86 -30.27 20.41 7.47 3 0 8.93 -999 ? CAC HEM C 201 >TYR~C 43 -31.26 18.65 1.53 -29.83 17.06 -0.32 -30.55 17.85 0.61 3 0 -4.18 -999 ? C1C HEM C 201s >GLU~C 44 -29.96 14.10 5.31 -28.28 12.81 5.44 -29.12 13.46 5.38 2 0 5.94 -999 ? CBD HEM C 201 >LYS.C 45 -33.95 14.79 6.73 -29.33 15.18 10.13 -31.64 14.99 8.43 2 0 10.49 -999 ? CBD HEM C 201 >ASP~C 46 -35.88 18.89 5.36 -37.37 20.37 5.35 -36.63 19.63 5.35 2 0 9.33 -999 ? CMC HEM F 201 >ALA~C 47 -39.68 16.12 4.40 -40.89 15.80 5.23 -40.28 15.96 4.81 2 0 5.39 -999 ? CMC HEM F 201 >ASN~C 48 -40.78 20.78 3.44 -42.71 20.69 4.36 -41.74 20.74 3.90 2 0 8.93 -999 ? CMC HEM F 201 >ALA~C 49 -36.98 19.79 1.15 -35.68 19.76 1.91 -36.33 19.77 1.53 2 0 8.01 -999 ? CMC HEM C 201 >LEU~C 50 -37.07 15.01 0.58 -35.31 13.90 1.28 -36.19 14.45 0.93 3 0 4.52 -999 ? CMC HEM F 201 >ILE~C 51 -41.70 17.37 -1.29 -42.96 17.14 -0.82 -42.33 17.25 -1.06 3 0 5.04 -999 ? CBB HEM F 201 >ALA~C 52 -38.97 20.23 -3.42 -38.47 21.36 -2.57 -38.72 20.80 -2.99 2 0 7.74 -999 ? CAB HEM C 201 >VAL~C 53 -35.99 18.21 -4.68 -34.21 17.29 -3.78 -35.10 17.75 -4.23 3 0 -3.89 -999 ? CAB HEM C 201s >SER~C 54 -38.22 15.69 -6.44 -39.96 14.01 -6.70 -39.09 14.85 -6.57 2 0 -3.59 -999 ? CBB HEM F 201s >ALA~C 55 -39.94 18.72 -7.94 -40.57 19.84 -7.13 -40.25 19.28 -7.53 2 0 7.43 -999 ? CBB HEM F 201 >VAL~C 56 -36.70 19.98 -9.51 -35.01 21.14 -8.74 -35.85 20.56 -9.13 3 0 5.15 -999 ? CAB HEM C 201 >VAL~C 57 -35.82 16.60 -11.05 -35.64 14.76 -9.82 -35.73 15.68 -10.44 3 0 5.19 -999 ? CMB HEM C 201 >ALA~C 58 -39.41 16.53 -12.32 -40.69 16.72 -11.55 -40.05 16.62 -11.93 2 0 8.32 -999 ? CBB HEM F 201 >THR~C 59 -38.85 19.73 -14.34 -38.94 21.84 -13.72 -38.90 20.78 -14.03 2 0 10.54 -999 ? CBB HEM C 201 >HIS~C 60 -33.40 19.55 -14.52 -32.24 21.27 -14.27 -32.82 20.41 -14.40 3 0 8.04 -999 ? CBB HEM C 201 >PHE~C 61 -37.59 12.72 -16.20 -37.99 10.26 -17.43 -37.79 11.49 -16.82 3 0 12.34 -999 ? CMB HEM C 201 >GLN~C 62 -41.36 18.24 -19.01 -42.90 19.12 -17.85 -42.13 18.68 -18.43 2 0 14.89 -999 ? CBB HEM F 201 >THR~C 63 -36.65 18.59 -20.59 -35.53 20.42 -20.25 -36.09 19.51 -20.42 2 0 14.37 -999 ? CBB HEM C 201 >ILE~C 64 -33.43 14.91 -20.21 -32.87 14.13 -19.51 -33.15 14.52 -19.86 3 0 13.00 -999 ? I IOD C9003 >ALA~C 65 -37.57 13.39 -21.82 -38.81 13.35 -20.96 -38.19 13.37 -21.39 2 0 15.83 -999 ? CMB HEM C 201 >ALA~C 66 -38.43 15.62 -24.75 -38.87 17.04 -24.63 -38.65 16.33 -24.69 2 0 19.00 -999 ? CMB HEM C 201 >ALA~C 67 -34.77 15.60 -25.89 -33.58 15.91 -25.02 -34.17 15.76 -25.46 2 0 17.74 -999 ? I IOD C9003 >ASN~C 68 -34.88 10.93 -25.02 -32.99 11.10 -24.13 -33.93 11.02 -24.58 2 0 16.60 -999 ? I IOD C9003 >ASP.C 69 -38.26 11.65 -29.38 -40.08 11.54 -30.43 -39.17 11.60 -29.91 2 0 25.24 -999 ? CMB HEM C 201 >TYR.C 70 -41.58 11.69 -24.67 -42.17 14.40 -24.34 -41.88 13.05 -24.51 3 0 20.17 -999 ? CMB HEM F 201 >TRP.C 71 -34.72 7.14 -24.18 -35.81 9.73 -21.44 -35.27 8.44 -22.81 3 0 17.23 -999 ? I IOD C9003 >TRP.D 2 -29.81 43.01 -20.71 -31.95 39.81 -19.97 -30.88 41.41 -20.34 3 0 -9.37 -999 ? I IOD D9002s >LEU.D 3 -30.66 38.11 -23.54 -31.31 36.09 -23.34 -30.99 37.10 -23.44 3 0 10.81 -999 ? I IOD D9002 >PRO.D 4 -26.27 37.83 -27.18 -28.41 38.47 -27.19 -27.34 38.15 -27.19 3 0 13.09 -999 ? I IOD D9002 >THR.D 5 -29.73 34.93 -28.57 -28.26 34.41 -30.12 -29.00 34.67 -29.34 2 0 16.31 -999 ? I IOD D9002 >LEU.D 6 -32.54 31.49 -26.71 -33.90 32.21 -25.18 -33.22 31.85 -25.95 3 0 15.06 -999 ? I IOD D9002 >VAL.D 7 -29.06 29.65 -29.35 -29.28 29.21 -31.52 -29.17 29.43 -30.44 3 0 18.26 -999 ? I IOD D9002 >THR.D 8 -26.15 28.05 -27.54 -25.91 27.55 -25.45 -26.03 27.80 -26.49 2 0 14.64 -999 ? I IOD D9002 >ALA.D 9 -23.33 25.89 -28.97 -21.88 26.32 -29.08 -22.61 26.10 -29.03 2 0 18.53 -999 ? I IOD D9002 >THR~D 10 -23.31 23.12 -26.28 -21.22 23.11 -25.69 -22.26 23.12 -25.99 2 0 17.64 -999 ? CMA HEM D 201 >PRO~D 11 -25.81 19.82 -24.85 -25.41 21.95 -24.26 -25.61 20.88 -24.55 3 0 16.88 -999 ? I IOD C9003 >GLN~D 12 -21.13 22.58 -19.86 -19.36 21.40 -19.81 -20.24 21.99 -19.84 2 0 14.20 -999 ? CMA HEM D 201 >GLU~D 13 -21.41 27.04 -24.01 -20.77 27.43 -25.99 -21.09 27.24 -25.00 2 0 15.74 -999 ? I IOD D9002 >GLY~D 14 -27.14 26.20 -22.27 -26.59 26.21 -21.63 -26.87 26.20 -21.95 1 0 13.13 -999 ? CMB HEM D 201 >PHE~D 15 -26.97 23.95 -16.55 -27.92 23.33 -14.00 -27.45 23.64 -15.28 3 0 8.82 -999 ? CMB HEM D 201 >ASP~D 16 -23.40 28.66 -18.68 -22.06 27.35 -17.76 -22.73 28.00 -18.22 2 0 8.67 -999 ? CMA HEM D 201 >LEU~D 17 -27.57 30.49 -21.52 -28.43 32.01 -22.80 -28.00 31.25 -22.16 3 0 10.14 -999 ? I IOD D9002 >ALA~D 18 -29.92 29.04 -17.88 -30.17 27.56 -17.79 -30.04 28.30 -17.83 2 0 8.31 -999 ? CMB HEM D 201 >VAL~D 19 -28.10 30.16 -14.69 -26.55 29.26 -13.44 -27.32 29.71 -14.07 3 0 4.56 -999 ? CMB HEM D 201 >LYS~D 20 -27.68 33.64 -16.15 -25.61 36.86 -21.07 -26.64 35.25 -18.61 2 0 -6.76 -999 ? I IOD D9002s >LEU~D 21 -32.22 33.51 -17.70 -32.33 33.82 -19.84 -32.27 33.66 -18.77 3 0 9.03 -999 ? I IOD D9002 >SER~D 22 -32.03 33.22 -13.20 -32.17 30.86 -13.46 -32.10 32.04 -13.33 2 0 -4.44 -999 ? CMB HEM D 201s >ARG~D 23 -26.15 34.50 -11.04 -23.86 36.00 -9.68 -25.00 35.25 -10.36 2 0 3.34 -999 ? C1A HEM D 201s >ILE~D 24 -30.26 38.82 -15.67 -30.79 39.02 -16.32 -30.53 38.92 -16.00 3 0 5.92 -999 ? I IOD D9002 >ALA~D 25 -34.05 38.48 -13.06 -34.93 37.24 -13.10 -34.49 37.86 -13.08 2 0 6.38 -999 ? CBB HEM D 201 >VAL~D 26 -32.81 39.08 -9.48 -32.15 37.72 -7.91 -32.48 38.40 -8.69 3 0 -4.60 -999 ? CMC HEM D 201s >LYS~D 27 -30.34 41.71 -10.66 -25.15 42.94 -14.15 -27.74 42.32 -12.41 2 0 5.91 -999 ? I IOD D9002 >LYS~D 28 -33.21 43.69 -12.25 -34.18 43.13 -18.47 -33.69 43.41 -15.36 2 0 -7.36 -999 ? CMA HEM G 201s >THR~D 29 -35.76 43.56 -9.40 -36.61 41.55 -8.97 -36.18 42.55 -9.18 2 0 -4.06 -999 ? CHB HEM G 201s >GLN~D 30 -31.96 43.94 -4.61 -32.59 45.92 -4.13 -32.27 44.93 -4.37 2 0 6.72 -999 ? O2A HEM G 201 >PRO.D 31 -32.28 48.22 -8.56 -31.09 46.36 -8.26 -31.68 47.29 -8.41 3 0 -4.24 -999 ? O2A HEM G 201s >ASP~D 32 -29.47 48.11 -4.00 -28.06 48.77 -2.55 -28.76 48.44 -3.27 2 0 9.86 -999 ? CBC HEM D 201 >ALA~D 33 -25.74 45.46 -5.57 -24.51 45.82 -6.37 -25.12 45.64 -5.97 2 0 7.39 -999 ? CMD HEM D 201 >GLN~D 34 -24.45 47.56 0.21 -24.47 49.54 1.03 -24.46 48.55 0.62 2 0 12.01 -999 ? CMD HEM D 201 >VAL~D 35 -28.15 44.55 -0.61 -29.98 45.61 -1.20 -29.07 45.08 -0.91 3 0 6.79 -999 ? CBC HEM D 201 >ARG~D 36 -28.34 41.60 -6.75 -27.17 43.79 -8.54 -27.76 42.70 -7.65 2 0 -5.68 -999 ? I IOD D9001s >ASP~D 37 -23.17 41.83 -1.07 -22.38 42.52 -2.93 -22.78 42.17 -2.00 2 0 -4.36 -999 ? CMD HEM D 201s >THR~D 38 -26.14 41.01 2.17 -26.98 42.56 3.50 -26.56 41.78 2.84 2 0 8.90 -999 ? CAC HEM D 201 >LEU~D 39 -29.89 38.91 -0.10 -31.66 40.03 0.54 -30.78 39.47 0.22 3 0 4.37 -999 ? CAC HEM D 201 >ARG~D 40 -24.26 34.76 -2.76 -23.61 31.89 -3.55 -23.93 33.33 -3.15 2 0 -4.12 -999 ? CHA HEM D 201s >ALA~D 41 -24.58 35.61 2.63 -23.94 36.65 3.52 -24.26 36.13 3.07 2 0 8.04 -999 ? CBD HEM D 201 >VAL~D 42 -28.09 34.55 3.74 -29.60 35.87 4.65 -28.85 35.21 4.20 3 0 8.51 -999 ? CAC HEM D 201 >TYR~D 43 -29.11 32.79 -1.55 -27.56 33.11 -3.84 -28.33 32.95 -2.70 3 0 -4.17 -999 ? C1C HEM D 201s >GLU~D 44 -23.67 31.54 1.02 -21.95 32.64 0.51 -22.81 32.09 0.76 2 0 5.33 -999 ? O2D HEM D 201 >LYS.D 45 -26.15 28.64 3.43 -22.49 32.29 5.45 -24.32 30.47 4.44 2 0 9.82 -999 ? O2D HEM D 201 >ASP~D 46 -30.85 29.01 2.63 -32.76 28.65 3.52 -31.81 28.83 3.07 2 0 9.47 -999 ? CMC HEM C 201 >ALA~D 47 -30.65 24.34 1.97 -30.86 23.20 2.89 -30.76 23.77 2.43 2 0 5.47 -999 ? CMC HEM C 201 >ASN~D 48 -35.30 25.63 1.82 -35.76 24.15 3.29 -35.53 24.89 2.55 2 0 8.83 -999 ? CMC HEM C 201 >ALA~D 49 -33.14 28.24 -1.14 -32.56 29.50 -0.55 -32.85 28.87 -0.84 2 0 7.86 -999 ? CMC HEM D 201 >LEU~D 50 -29.18 25.87 -2.52 -27.32 26.93 -2.11 -28.25 26.40 -2.31 3 0 4.50 -999 ? CMC HEM C 201 >ILE~D 51 -33.85 23.03 -2.95 -34.27 21.70 -2.42 -34.06 22.36 -2.69 3 0 4.95 -999 ? CMC HEM C 201 >ALA~D 52 -35.25 26.72 -5.06 -35.81 27.77 -4.12 -35.53 27.25 -4.59 2 0 7.35 -999 ? CAB HEM D 201 >VAL~D 53 -32.45 28.33 -7.03 -30.56 29.30 -6.61 -31.51 28.82 -6.82 3 0 -3.61 -999 ? CAB HEM D 201s >SER~D 54 -31.91 25.03 -8.86 -31.34 22.70 -9.16 -31.62 23.87 -9.01 2 0 -3.64 -999 ? CBB HEM C 201s >ALA~D 55 -35.67 25.00 -9.50 -36.73 25.13 -8.43 -36.20 25.07 -8.97 2 0 7.46 -999 ? CBB HEM C 201 >VAL~D 56 -35.35 28.37 -11.31 -35.41 30.40 -10.43 -35.38 29.39 -10.87 3 0 4.63 -999 ? CBB HEM D 201 >VAL~D 57 -32.63 27.24 -13.69 -30.70 26.42 -12.96 -31.67 26.83 -13.33 3 0 5.43 -999 ? CMB HEM D 201 >ALA~D 58 -34.57 24.04 -14.29 -35.17 23.22 -13.19 -34.87 23.63 -13.74 2 0 8.23 -999 ? CBB HEM C 201 >THR~D 59 -37.38 26.09 -15.89 -39.24 26.95 -15.12 -38.31 26.52 -15.50 2 0 10.56 -999 ? CBB HEM D 201 >HIS~D 60 -34.67 30.74 -16.86 -35.45 32.66 -16.59 -35.06 31.70 -16.73 3 0 7.87 -999 ? CBB HEM D 201 >PHE~D 61 -31.35 23.61 -19.00 -29.77 21.87 -20.49 -30.56 22.74 -19.74 3 0 12.46 -999 ? CMB HEM D 201 >GLN~D 62 -38.66 22.99 -20.15 -39.99 22.21 -18.66 -39.32 22.60 -19.40 2 0 15.01 -999 ? CBB HEM C 201 >THR~D 63 -36.78 27.15 -22.49 -37.60 29.11 -22.12 -37.19 28.13 -22.31 2 0 14.21 -999 ? CBB HEM D 201 >ILE~D 64 -31.95 27.87 -23.22 -30.74 27.78 -22.55 -31.35 27.83 -22.88 3 0 13.25 -999 ? CMB HEM D 201 >ALA~D 65 -33.02 23.57 -24.66 -33.27 22.44 -23.68 -33.14 23.00 -24.17 2 0 16.30 -999 ? CMB HEM D 201 >ALA~D 66 -36.29 23.83 -26.54 -37.62 24.30 -25.91 -36.95 24.06 -26.23 2 0 18.92 -999 ? CMB HEM D 201 >ALA~D 67 -34.67 26.76 -28.40 -34.05 28.00 -27.75 -34.36 27.38 -28.08 2 0 18.46 -999 ? I IOD D9002 >ASN~D 68 -30.33 24.76 -28.53 -29.58 26.69 -28.15 -29.95 25.73 -28.34 2 0 17.82 -999 ? I IOD D9002 >ASP.D 69 -33.60 21.57 -31.76 -34.61 19.84 -32.46 -34.11 20.71 -32.11 2 0 25.36 -999 ? CMB HEM D 201 >TYR.D 70 -34.31 19.13 -26.82 -36.91 19.97 -26.24 -35.61 19.55 -26.53 3 0 20.18 -999 ? CMB HEM C 201 >TRP.D 71 -27.03 22.67 -28.15 -28.96 22.97 -24.72 -28.00 22.82 -26.44 3 0 18.13 -999 ? CMB HEM D 201 >TRP.E 2 -58.58 5.03 -10.40 -56.26 8.08 -11.25 -57.42 6.55 -10.83 3 0 6.02 -999 ? I IOD E9004 >LEU.E 3 -57.99 8.36 -14.88 -57.23 10.19 -15.76 -57.61 9.28 -15.32 3 0 8.32 -999 ? I IOD E9004 >PRO.E 4 -62.71 7.41 -17.85 -60.57 6.67 -17.81 -61.64 7.04 -17.83 3 0 9.49 -999 ? I IOD E9004 >THR.E 5 -59.32 9.24 -20.65 -60.75 8.86 -22.20 -60.04 9.05 -21.42 2 0 13.73 -999 ? I IOD E9004 >LEU.E 6 -56.56 13.14 -21.03 -55.09 13.08 -19.42 -55.82 13.11 -20.22 3 0 14.04 -999 ? I IOD E9004 >VAL.E 7 -60.38 13.81 -23.65 -60.67 13.25 -25.76 -60.52 13.53 -24.71 3 0 16.88 -999 ? I IOD E9004 >THR.E 8 -63.18 16.05 -22.39 -63.23 17.25 -20.61 -63.20 16.65 -21.50 2 0 14.64 -999 ? I IOD E9004 >ALA.E 9 -66.16 17.69 -24.08 -67.63 17.33 -23.78 -66.90 17.51 -23.93 2 0 18.11 -999 ? I IOD E9004 >THR~E 10 -65.57 21.28 -22.86 -67.61 21.59 -22.13 -66.59 21.43 -22.50 2 0 17.54 -999 ? CMA HEM E 201 >PRO~E 11 -62.98 24.80 -23.41 -63.25 23.17 -21.89 -63.11 23.98 -22.65 3 0 17.50 -999 ? CMA HEM E 201 >GLN~E 12 -66.82 24.68 -17.08 -68.73 25.58 -17.19 -67.77 25.13 -17.14 2 0 13.93 -999 ? CMA HEM E 201 >GLU~E 13 -67.27 18.81 -19.13 -68.02 17.25 -20.38 -67.65 18.03 -19.76 2 0 15.46 -999 ? I IOD E9004 >GLY~E 14 -61.38 19.84 -18.55 -61.82 20.24 -17.94 -61.60 20.04 -18.24 1 0 13.10 -999 ? CMB HEM E 201 >PHE~E 15 -60.83 24.43 -14.45 -59.54 25.96 -12.52 -60.18 25.19 -13.49 3 0 8.83 -999 ? CMB HEM E 201 >ASP~E 16 -64.38 19.33 -13.80 -65.82 20.86 -13.74 -65.10 20.10 -13.77 2 0 9.04 -999 ? CMA HEM E 201 >LEU~E 17 -60.47 16.55 -16.13 -60.01 14.39 -16.45 -60.24 15.47 -16.29 3 0 10.34 -999 ? I IOD E9004 >ALA~E 18 -57.59 19.03 -13.57 -57.23 20.44 -13.94 -57.41 19.74 -13.75 2 0 7.78 -999 ? CMB HEM E 201 >VAL~E 19 -59.16 19.51 -10.16 -60.64 20.90 -9.25 -59.90 20.20 -9.70 3 0 4.52 -999 ? CMB HEM E 201 >LYS~E 20 -59.78 15.77 -9.89 -62.23 10.59 -12.60 -61.01 13.18 -11.24 2 0 4.35 -999 ? I IOD E9004 >LEU~E 21 -55.58 15.01 -12.23 -55.76 13.70 -13.98 -55.67 14.35 -13.10 3 0 9.42 -999 ? CBB HEM E 201 >SER~E 22 -54.92 17.08 -8.34 -55.12 19.15 -9.58 -55.02 18.11 -8.96 2 0 -4.48 -999 ? CMB HEM E 201s >ARG~E 23 -60.49 17.16 -4.88 -62.72 16.37 -2.91 -61.60 16.76 -3.90 2 0 3.41 -999 ? CHA HEM E 201s >ILE~E 24 -56.91 10.96 -7.59 -56.53 10.47 -8.25 -56.72 10.71 -7.92 3 0 6.04 -999 ? I IOD E9004 >ALA~E 25 -52.75 12.14 -5.90 -51.89 13.20 -6.57 -52.32 12.67 -6.24 2 0 6.21 -999 ? CMB HEM F 201 >VAL~E 26 -53.59 13.27 -2.34 -54.06 15.23 -1.46 -53.82 14.25 -1.90 3 0 -4.48 -999 ? CMC HEM E 201s >LYS~E 27 -56.04 10.41 -1.98 -61.85 8.27 -3.59 -58.94 9.34 -2.78 2 0 5.07 -999 ? I IOD E9004 >LYS~E 28 -53.36 7.92 -3.15 -53.74 5.50 -8.90 -53.55 6.71 -6.02 2 0 -7.65 -999 ? CMA HEM F 201s >THR~E 29 -50.55 9.27 -0.89 -50.10 11.26 -1.57 -50.32 10.27 -1.23 2 0 -4.17 -999 ? CHB HEM F 201s >GLN~E 30 -53.56 11.25 3.98 -52.90 9.86 5.45 -53.23 10.56 4.72 2 0 6.95 -999 ? CBC HEM E 201 >PRO.E 31 -54.11 5.32 2.09 -55.01 7.38 2.00 -54.56 6.35 2.05 3 0 4.86 -999 ? CGA HEM F 201 >ASP~E 32 -55.91 7.61 6.80 -57.06 7.62 8.58 -56.49 7.62 7.69 2 0 10.01 -999 ? CBC HEM E 201 >ALA~E 33 -59.88 9.66 4.69 -61.19 9.08 4.13 -60.54 9.37 4.41 2 0 7.41 -999 ? CMD HEM E 201 >GLN~E 34 -60.22 10.32 10.89 -59.44 9.10 12.44 -59.83 9.71 11.67 2 0 11.94 -999 ? CMD HEM E 201 >VAL~E 35 -56.99 12.65 8.38 -55.16 11.46 8.09 -56.08 12.05 8.23 3 0 6.57 -999 ? CBC HEM E 201 >ARG~E 36 -57.42 12.59 1.53 -58.92 9.91 1.16 -58.17 11.25 1.34 2 0 5.22 -999 ? I IOD E9001s >ASP~E 37 -61.95 14.87 7.64 -63.48 14.15 6.35 -62.71 14.51 7.00 2 0 4.42 -999 ? CMD HEM E 201 >THR~E 38 -58.51 16.89 9.64 -57.62 16.00 11.45 -58.06 16.45 10.55 2 0 8.93 -999 ? CBC HEM E 201 >LEU~E 39 -55.27 17.66 6.08 -53.54 16.59 6.99 -54.40 17.13 6.53 3 0 -4.24 -999 ? CAC HEM E 201s >ARG~E 40 -61.31 20.93 2.91 -62.55 22.65 0.70 -61.93 21.79 1.81 2 0 -3.86 -999 ? CBA HEM E 201s >ALA~E 41 -60.25 21.96 7.99 -60.58 21.39 9.38 -60.41 21.68 8.68 2 0 7.83 -999 ? CBD HEM E 201 >VAL~E 42 -56.77 23.48 8.07 -55.00 22.68 9.09 -55.88 23.08 8.58 3 0 8.57 -999 ? CAC HEM E 201 >TYR~E 43 -56.34 22.74 2.52 -58.06 21.41 0.73 -57.20 22.08 1.63 3 0 -4.44 -999 ? NC HEM E 201s >GLU~E 44 -61.31 25.00 5.12 -62.94 23.79 5.68 -62.13 24.39 5.40 2 0 5.43 -999 ? O2D HEM E 201 >LYS.E 45 -58.91 28.49 5.64 -61.77 26.20 10.31 -60.34 27.34 7.98 2 0 10.28 -999 ? O2D HEM E 201 >ASP~E 46 -54.30 27.72 4.75 -52.26 28.33 4.82 -53.28 28.02 4.78 2 0 9.29 -999 ? CMC HEM H 201 >ALA~E 47 -54.55 31.55 1.84 -54.33 32.99 2.19 -54.44 32.27 2.01 2 0 5.14 -999 ? CMC HEM H 201 >ASN~E 48 -49.91 30.22 1.86 -49.26 32.17 2.48 -49.59 31.19 2.17 2 0 8.84 -999 ? CMC HEM H 201 >ALA~E 49 -52.51 26.73 0.59 -53.12 26.02 1.75 -52.82 26.38 1.17 2 0 8.18 -999 ? CMC HEM E 201 >LEU~E 50 -56.61 28.54 -1.25 -58.42 27.88 -0.15 -57.52 28.21 -0.70 3 0 -4.49 -999 ? CMC HEM H 201s >ILE~E 51 -52.08 30.70 -3.49 -51.74 32.15 -3.65 -51.91 31.42 -3.57 3 0 4.81 -999 ? CBB HEM H 201 >ALA~E 52 -50.75 26.39 -3.91 -50.11 25.72 -2.71 -50.43 26.05 -3.31 2 0 7.55 -999 ? CAB HEM E 201 >VAL~E 53 -53.85 24.35 -4.62 -55.70 23.71 -3.64 -54.78 24.03 -4.13 3 0 -4.02 -999 ? CAB HEM E 201s >SER~E 54 -54.67 26.65 -7.49 -55.33 28.65 -8.65 -55.00 27.65 -8.07 2 0 -3.55 -999 ? CBB HEM H 201s >ALA~E 55 -51.15 26.09 -8.77 -49.90 26.30 -7.95 -50.53 26.19 -8.36 2 0 7.62 -999 ? CBB HEM H 201 >VAL~E 56 -51.46 22.30 -8.92 -51.24 20.79 -7.36 -51.35 21.54 -8.14 3 0 4.94 -999 ? CBB HEM E 201 >VAL~E 57 -54.71 22.47 -10.90 -56.56 23.46 -10.14 -55.63 22.97 -10.52 3 0 4.94 -999 ? CMB HEM E 201 >ALA~E 58 -53.08 24.96 -13.28 -52.41 26.26 -12.86 -52.74 25.61 -13.07 2 0 8.39 -999 ? CBB HEM H 201 >THR~E 59 -50.41 22.44 -14.20 -48.50 21.78 -13.41 -49.45 22.11 -13.80 2 0 10.51 -999 ? CBB HEM E 201 >HIS~E 60 -53.02 17.92 -12.84 -51.95 16.35 -11.95 -52.49 17.13 -12.39 3 0 7.77 -999 ? CBB HEM E 201 >PHE~E 61 -56.84 23.78 -17.30 -58.73 24.69 -19.18 -57.79 24.24 -18.24 3 0 12.44 -999 ? CMB HEM E 201 >GLN~E 62 -49.86 23.36 -19.45 -48.23 24.36 -18.53 -49.04 23.86 -18.99 2 0 15.20 -999 ? CBB HEM H 201 >THR~E 63 -51.76 18.83 -19.43 -50.81 17.28 -18.21 -51.29 18.05 -18.82 2 0 13.71 -999 ? CBB HEM E 201 >ILE~E 64 -56.62 17.81 -19.20 -57.70 17.99 -18.71 -57.16 17.90 -18.96 3 0 13.18 -999 ? CMB HEM E 201 >ALA~E 65 -55.82 21.23 -22.31 -55.38 22.61 -21.87 -55.60 21.92 -22.09 2 0 15.85 -999 ? CMB HEM E 201 >ALA~E 66 -53.03 19.96 -24.57 -51.60 19.70 -24.10 -52.32 19.83 -24.34 2 0 18.83 -999 ? CMB HEM E 201 >ALA~E 67 -54.71 16.56 -24.75 -55.25 15.75 -23.58 -54.98 16.16 -24.16 2 0 17.98 -999 ? I IOD E9004 >ASN~E 68 -59.03 18.58 -25.12 -59.77 17.02 -23.93 -59.40 17.80 -24.53 2 0 17.55 -999 ? I IOD E9004 >ASP.E 69 -56.39 19.89 -29.89 -55.42 20.94 -31.47 -55.90 20.41 -30.68 2 0 25.34 -999 ? CMB HEM E 201 >TYR.E 70 -55.06 24.22 -26.42 -52.38 23.80 -25.75 -53.72 24.01 -26.08 3 0 20.17 -999 ? CMB HEM H 201 >TRP.E 71 -62.61 20.73 -25.11 -59.88 21.52 -22.38 -61.25 21.12 -23.75 3 0 18.00 -999 ? CMB HEM E 201 >TRP.F 2 -34.40 2.38 -11.46 -36.11 5.82 -12.26 -35.26 4.10 -11.86 3 0 -11.52 -999 ? CMA HEM C 201s >LEU.F 3 -37.49 4.36 -15.50 -38.88 5.99 -15.88 -38.18 5.18 -15.69 3 0 14.71 -999 ? CBB HEM F 201 >PRO.F 4 -39.36 -0.43 -18.09 -37.83 1.18 -18.36 -38.60 0.38 -18.23 3 0 18.39 -999 ? I IOD F9001 >THR.F 5 -40.24 3.24 -20.79 -41.22 1.67 -21.99 -40.73 2.46 -21.39 2 0 20.32 -999 ? CMB HEM F 201 >LEU.F 6 -42.23 7.54 -20.83 -40.94 8.75 -19.64 -41.58 8.14 -20.24 3 0 16.37 -999 ? CMB HEM F 201 >VAL.F 7 -45.24 4.45 -22.72 -45.24 4.10 -24.86 -45.24 4.27 -23.79 3 0 20.25 -999 ? CMB HEM F 201 >THR.F 8 -48.15 3.15 -20.74 -49.01 3.86 -18.89 -48.58 3.51 -19.81 2 0 16.07 -999 ? CMA HEM F 201 >ALA.F 9 -51.30 1.39 -21.92 -51.74 -0.01 -21.51 -51.52 0.69 -21.72 2 0 19.04 -999 ? I IOD E9004 >THR~F 10 -53.79 3.86 -20.32 -55.00 2.22 -19.47 -54.40 3.04 -19.89 2 0 14.82 -999 ? I IOD E9004 >PRO~F 11 -55.82 7.78 -20.25 -54.18 6.74 -19.14 -55.00 7.26 -19.70 3 0 13.50 -999 ? I IOD E9004 >GLN~F 12 -56.11 4.66 -13.60 -58.01 3.82 -13.21 -57.06 4.24 -13.40 2 0 8.22 -999 ? I IOD E9004 >GLU~F 13 -52.01 1.49 -16.53 -51.72 -0.05 -17.91 -51.87 0.72 -17.22 2 0 16.66 -999 ? CMA HEM F 201 >GLY~F 14 -49.64 7.02 -16.84 -50.04 6.84 -16.16 -49.84 6.93 -16.50 1 0 13.21 -999 ? CMB HEM F 201 >PHE~F 15 -52.38 9.97 -12.11 -52.68 11.81 -10.03 -52.53 10.89 -11.07 3 0 8.88 -999 ? CMB HEM F 201 >ASP~F 16 -49.89 4.36 -11.57 -51.87 4.03 -10.99 -50.88 4.19 -11.28 2 0 8.93 -999 ? CMA HEM F 201 >LEU~F 17 -45.94 5.85 -14.80 -44.04 5.29 -15.70 -44.99 5.57 -15.25 3 0 11.98 -999 ? CMB HEM F 201 >ALA~F 18 -46.06 9.67 -12.47 -47.11 10.68 -12.91 -46.58 10.18 -12.69 2 0 8.12 -999 ? CMB HEM F 201 >VAL~F 19 -46.48 8.88 -8.76 -48.27 8.59 -7.56 -47.38 8.74 -8.16 3 0 4.40 -999 ? CMB HEM F 201 >LYS~F 20 -43.70 6.30 -8.97 -41.25 1.09 -11.72 -42.47 3.69 -10.35 2 0 12.08 -999 ? I IOD F9001 >LEU~F 21 -41.63 9.46 -11.94 -41.15 8.62 -13.90 -41.39 9.04 -12.92 3 0 9.67 -999 ? CMB HEM F 201 >SER~F 22 -42.08 11.40 -7.93 -44.04 12.40 -8.86 -43.06 11.90 -8.39 2 0 -4.64 -999 ? CMB HEM F 201s >ARG~F 23 -44.24 6.80 -3.97 -44.29 4.54 -1.92 -44.26 5.67 -2.95 2 0 3.63 -999 ? C1A HEM F 201s >ILE~F 24 -37.90 6.39 -7.95 -37.42 6.39 -8.67 -37.66 6.39 -8.31 3 0 7.75 -999 ? I IOD F9001 >ALA~F 25 -36.44 10.72 -6.74 -37.02 11.97 -7.38 -36.73 11.34 -7.06 2 0 6.40 -999 ? CBB HEM F 201 >VAL~F 26 -37.02 10.74 -2.99 -38.71 11.26 -1.75 -37.86 11.00 -2.37 3 0 -4.42 -999 ? CMC HEM F 201s >LYS~F 27 -35.71 7.25 -2.47 -36.85 1.06 -3.31 -36.28 4.16 -2.89 2 0 7.15 -999 ? I IOD F9001 >LYS~F 28 -32.58 7.99 -4.53 -32.00 6.56 -10.54 -32.29 7.27 -7.53 2 0 -7.71 -999 ? CMA HEM C 201s >THR~F 29 -31.79 11.16 -2.60 -33.13 12.81 -3.01 -32.46 11.99 -2.80 2 0 -4.35 -999 ? CHB HEM C 201s >GLN~F 30 -33.47 9.93 3.18 -31.63 9.98 4.28 -32.55 9.95 3.73 2 0 6.88 -999 ? O2A HEM C 201 >PRO.F 31 -29.66 6.39 0.26 -31.88 6.54 0.65 -30.77 6.46 0.46 3 0 4.80 -999 ? O2A HEM C 201 >ASP~F 32 -31.58 6.20 5.44 -31.35 5.24 7.32 -31.46 5.72 6.38 2 0 9.63 -999 ? O2A HEM C 201 >ALA~F 33 -35.59 3.58 4.34 -35.79 2.08 4.08 -35.69 2.83 4.21 2 0 7.42 -999 ? CMD HEM F 201 >GLN~F 34 -34.80 4.05 10.53 -33.21 3.26 11.71 -34.00 3.65 11.12 2 0 10.51 -999 ? O2A HEM B 201 >VAL~F 35 -35.62 7.99 8.02 -33.77 8.87 7.16 -34.70 8.43 7.59 3 0 6.68 -999 ? CBC HEM F 201 >ARG~F 36 -37.23 7.06 1.51 -35.84 4.40 0.83 -36.53 5.73 1.17 2 0 -5.59 -999 ? I IOD F9001s >ASP~F 37 -40.15 4.82 8.33 -40.79 3.11 7.20 -40.47 3.96 7.76 2 0 -4.28 -999 ? CMD HEM F 201s >THR~F 38 -39.78 9.00 10.10 -38.10 9.33 11.50 -38.94 9.16 10.80 2 0 8.84 -999 ? CAC HEM F 201 >LEU~F 39 -39.56 12.01 6.31 -37.64 13.00 6.53 -38.60 12.51 6.42 3 0 -4.21 -999 ? CBC HEM F 201s >ARG~F 40 -46.02 8.33 4.77 -48.69 8.35 3.24 -47.36 8.34 4.01 2 0 -4.11 -999 ? CHA HEM F 201s >ALA~F 41 -45.28 10.03 9.58 -44.76 9.43 10.87 -45.02 9.73 10.23 2 0 8.07 -999 ? CMD HEM F 201 >VAL~F 42 -44.50 13.77 9.37 -42.66 14.91 9.90 -43.58 14.34 9.63 3 0 8.38 -999 ? CAC HEM F 201 >TYR~F 43 -45.00 13.57 3.76 -45.28 11.27 2.17 -45.14 12.42 2.96 3 0 -4.29 -999 ? NC HEM F 201s >GLU~F 44 -49.04 10.45 7.31 -48.76 8.42 7.72 -48.90 9.44 7.52 2 0 5.91 -999 ? O2D HEM F 201 >LYS.F 45 -50.39 14.54 8.20 -48.58 11.19 12.36 -49.48 12.86 10.28 2 0 10.79 -999 ? CBD HEM F 201 >ASP~F 46 -47.60 18.04 6.53 -47.17 20.07 6.13 -47.39 19.05 6.33 2 0 9.09 -999 ? CMC HEM E 201 >ALA~F 47 -51.64 19.56 4.38 -52.60 20.61 4.87 -52.12 20.08 4.62 2 0 5.25 -999 ? CMC HEM E 201 >ASN~F 48 -48.32 22.93 3.31 -49.59 24.57 3.88 -48.96 23.75 3.59 2 0 8.61 -999 ? CMC HEM E 201 >ALA~F 49 -46.73 18.88 1.98 -46.17 17.96 3.02 -46.45 18.42 2.50 2 0 8.02 -999 ? CMC HEM F 201 >LEU~F 50 -50.69 16.28 1.09 -50.86 14.45 2.20 -50.78 15.37 1.64 3 0 4.33 -999 ? CMC HEM E 201 >ILE~F 51 -50.85 21.05 -1.51 -51.83 22.13 -1.35 -51.34 21.59 -1.43 3 0 4.87 -999 ? CAB HEM E 201 >ALA~F 52 -46.72 19.95 -2.70 -45.66 20.35 -1.65 -46.19 20.15 -2.17 2 0 7.84 -999 ? CAB HEM F 201 >VAL~F 53 -46.65 16.20 -3.26 -46.81 14.36 -2.07 -46.73 15.28 -2.66 3 0 -3.94 -999 ? CAB HEM F 201s >SER~F 54 -49.57 16.41 -5.69 -51.86 16.70 -6.42 -50.72 16.56 -6.06 2 0 -3.47 -999 ? CBB HEM E 201s >ALA~F 55 -47.77 19.20 -7.58 -47.31 20.50 -6.93 -47.54 19.85 -7.26 2 0 7.26 -999 ? CBB HEM E 201 >VAL~F 56 -44.70 17.05 -8.11 -42.99 16.53 -6.90 -43.84 16.79 -7.51 3 0 5.05 -999 ? CBB HEM F 201 >VAL~F 57 -46.84 14.32 -9.70 -48.54 13.31 -8.70 -47.69 13.81 -9.20 3 0 5.17 -999 ? CMB HEM F 201 >ALA~F 58 -48.54 17.00 -11.80 -49.03 18.32 -11.26 -48.78 17.66 -11.53 2 0 8.09 -999 ? CBB HEM E 201 >THR~F 59 -45.23 17.81 -13.43 -43.67 19.15 -12.88 -44.45 18.48 -13.16 2 0 10.58 -999 ? CBB HEM F 201 >HIS~F 60 -42.72 13.12 -12.63 -40.70 13.12 -12.07 -41.71 13.12 -12.35 3 0 8.22 -999 ? CBB HEM F 201 >PHE~F 61 -50.35 12.83 -15.48 -52.49 11.58 -16.79 -51.42 12.20 -16.13 3 0 12.44 -999 ? CMB HEM F 201 >GLN~F 62 -46.70 18.68 -18.42 -47.07 20.58 -17.53 -46.88 19.63 -17.98 2 0 14.47 -999 ? CBB HEM E 201 >THR~F 63 -44.22 14.50 -19.18 -42.18 14.69 -18.63 -43.20 14.60 -18.90 2 0 14.54 -999 ? CBB HEM F 201 >ILE~F 64 -45.74 9.91 -18.22 -46.26 9.18 -17.33 -46.00 9.55 -17.77 3 0 13.04 -999 ? CMB HEM F 201 >ALA~F 65 -48.91 12.16 -20.92 -49.87 13.17 -20.38 -49.39 12.66 -20.65 2 0 16.03 -999 ? CMB HEM F 201 >ALA~F 66 -46.76 13.84 -23.57 -45.64 14.85 -23.30 -46.20 14.34 -23.44 2 0 18.76 -999 ? CMB HEM F 201 >ALA~F 67 -44.99 10.51 -24.19 -44.37 9.69 -23.08 -44.68 10.10 -23.63 2 0 18.38 -999 ? CMB HEM F 201 >ASN~F 68 -48.96 8.05 -23.47 -47.81 6.62 -22.47 -48.38 7.34 -22.97 2 0 18.31 -999 ? CMB HEM F 201 >ASP.F 69 -49.47 10.80 -28.29 -50.21 12.14 -29.74 -49.84 11.47 -29.02 2 0 24.66 -999 ? I IOD E9004 >TYR.F 70 -51.76 14.36 -24.61 -49.81 16.41 -24.58 -50.78 15.39 -24.60 3 0 20.18 -999 ? CBB HEM E 201 >TRP.F 71 -52.30 6.23 -23.00 -51.22 8.82 -20.26 -51.76 7.53 -21.63 3 0 16.94 -999 ? I IOD E9004 >TRP.G 2 -53.37 46.30 -19.65 -51.92 42.68 -19.05 -52.64 44.49 -19.35 3 0 11.44 -999 ? CMA HEM H 201 >LEU.G 3 -50.82 42.67 -22.84 -49.55 40.95 -22.47 -50.19 41.81 -22.65 3 0 14.49 -999 ? I IOD G9001 >PRO.G 4 -48.87 45.76 -27.15 -50.61 44.36 -26.78 -49.74 45.06 -26.97 3 0 18.00 -999 ? I IOD G9001 >THR.G 5 -48.78 41.27 -28.57 -48.07 41.97 -30.48 -48.42 41.62 -29.53 2 0 20.68 -999 ? CMB HEM G 201 >LEU.G 6 -46.82 37.25 -26.88 -47.99 36.64 -25.18 -47.41 36.94 -26.03 3 0 16.47 -999 ? CMB HEM G 201 >VAL.G 7 -44.20 39.10 -30.33 -44.60 38.56 -32.41 -44.40 38.83 -31.37 3 0 20.43 -999 ? CMB HEM G 201 >THR.G 8 -40.89 40.69 -29.45 -40.10 40.70 -27.46 -40.50 40.69 -28.46 2 0 15.87 -999 ? CMA HEM G 201 >ALA.G 9 -38.06 41.98 -31.65 -37.63 43.43 -31.74 -37.85 42.71 -31.70 2 0 19.56 -999 ? CMA HEM G 201 >THR~G 10 -35.24 40.49 -29.53 -34.00 42.27 -29.43 -34.62 41.38 -29.48 2 0 17.77 -999 ? CMA HEM G 201 >PRO~G 11 -33.48 36.69 -28.31 -34.89 38.19 -27.39 -34.18 37.44 -27.85 3 0 16.26 -999 ? I IOD D9002 >GLN~G 12 -32.44 42.54 -23.62 -30.48 43.29 -23.81 -31.46 42.92 -23.72 2 0 12.54 -999 ? I IOD D9002 >GLU~G 13 -36.77 44.38 -26.77 -37.36 45.03 -28.69 -37.07 44.70 -27.73 2 0 16.50 -999 ? CMA HEM G 201 >GLY~G 14 -38.53 39.04 -24.61 -38.14 39.51 -24.06 -38.33 39.28 -24.34 1 0 13.46 -999 ? CMB HEM G 201 >PHE~G 15 -35.50 38.39 -19.19 -35.07 37.49 -16.56 -35.28 37.94 -17.88 3 0 8.62 -999 ? CMB HEM G 201 >ASP~G 16 -38.14 43.62 -20.82 -36.08 43.95 -20.72 -37.11 43.79 -20.77 2 0 8.70 -999 ? CMA HEM G 201 >LEU~G 17 -42.40 40.94 -22.73 -44.44 41.05 -23.52 -43.42 41.00 -23.12 3 0 12.19 -999 ? CMB HEM G 201 >ALA~G 18 -41.76 38.44 -19.00 -40.78 37.31 -19.18 -41.27 37.87 -19.09 2 0 8.25 -999 ? CMB HEM G 201 >VAL~G 19 -40.82 40.75 -16.16 -38.86 41.55 -15.67 -39.84 41.15 -15.91 3 0 4.83 -999 ? CMB HEM G 201 >LYS~G 20 -43.82 42.87 -17.05 -46.50 46.54 -21.46 -45.16 44.71 -19.25 2 0 12.16 -999 ? I IOD G9001 >LEU~G 21 -46.34 38.82 -17.99 -47.34 38.80 -19.92 -46.84 38.81 -18.95 3 0 9.56 -999 ? CBB HEM G 201 >SER~G 22 -45.02 39.04 -13.63 -43.18 37.70 -14.39 -44.10 38.37 -14.01 2 0 -4.54 -999 ? CMB HEM G 201s >ARG~G 23 -42.49 44.68 -12.36 -42.31 47.44 -11.05 -42.40 46.06 -11.70 2 0 -3.22 -999 ? CHA HEM G 201s >ILE~G 24 -49.29 43.40 -15.37 -49.85 43.03 -15.94 -49.57 43.22 -15.66 3 0 7.63 -999 ? I IOD G9001 >ALA~G 25 -50.50 40.15 -12.30 -49.94 38.76 -12.39 -50.22 39.46 -12.35 2 0 6.40 -999 ? CBB HEM G 201 >VAL~G 26 -49.54 41.57 -8.88 -47.74 41.62 -7.61 -48.64 41.60 -8.24 3 0 -4.45 -999 ? CMC HEM G 201s >LYS~G 27 -50.79 45.02 -9.87 -50.51 50.41 -13.37 -50.65 47.72 -11.62 2 0 7.31 -999 ? I IOD G9001 >LYS~G 28 -54.18 43.59 -10.88 -55.67 42.32 -16.79 -54.92 42.95 -13.83 2 0 -7.45 -999 ? CMA HEM H 201s >THR~G 29 -54.72 41.56 -7.73 -53.29 39.95 -7.59 -54.01 40.76 -7.66 2 0 -4.28 -999 ? CHB HEM H 201s >GLN~G 30 -52.16 44.82 -3.33 -53.91 45.72 -2.47 -53.04 45.27 -2.90 2 0 7.12 -999 ? CBC HEM G 201 >PRO.G 31 -56.64 46.97 -6.94 -54.39 47.11 -6.73 -55.51 47.04 -6.83 3 0 4.82 -999 ? CGA HEM H 201 >ASP.G 32 -54.07 49.40 -2.38 -53.60 50.93 -0.94 -53.84 50.16 -1.66 2 0 9.79 -999 ? CBC HEM G 201 >ALA.G 33 -50.45 51.28 -5.23 -50.44 52.40 -6.25 -50.45 51.84 -5.74 2 0 7.64 -999 ? CMD HEM G 201 >GLN~G 34 -50.07 52.91 0.74 -51.08 54.35 1.89 -50.57 53.63 1.32 2 0 11.73 -999 ? CMD HEM G 201 >VAL~G 35 -49.48 48.70 -0.13 -51.42 47.69 -0.28 -50.45 48.19 -0.21 3 0 6.47 -999 ? CBC HEM G 201 >ARG~G 36 -49.02 46.81 -6.61 -50.24 49.16 -8.19 -49.63 47.99 -7.40 2 0 -5.16 -999 ? I IOD G9001s >ASP~G 37 -44.91 51.63 -1.71 -45.04 52.61 -3.60 -44.98 52.12 -2.66 2 0 -4.18 -999 ? CMD HEM G 201s >THR~G 38 -45.04 48.62 1.70 -46.38 49.04 3.34 -45.71 48.83 2.52 2 0 8.85 -999 ? CAC HEM G 201 >LEU~G 39 -45.71 44.29 -0.43 -47.35 43.32 0.60 -46.53 43.81 0.08 3 0 -4.28 -999 ? CAC HEM G 201s >ARG~G 40 -39.95 46.68 -4.42 -37.44 46.12 -6.15 -38.69 46.40 -5.28 2 0 -3.87 -999 ? CHA HEM G 201s >ALA~G 41 -39.75 47.16 0.90 -40.09 48.29 1.86 -39.92 47.73 1.38 2 0 7.86 -999 ? CGD HEM G 201 >VAL~G 42 -40.45 43.73 2.42 -42.07 42.96 3.69 -41.26 43.35 3.05 3 0 8.55 -999 ? CAC HEM G 201 >TYR~G 43 -40.53 41.75 -2.93 -40.71 43.10 -5.38 -40.62 42.42 -4.16 3 0 -4.27 -999 ? C1C HEM G 201s >GLU~G 44 -36.52 45.99 -1.24 -36.73 48.05 -1.70 -36.63 47.02 -1.47 2 0 4.74 -999 ? O2D HEM G 201 >LYS.G 45 -34.60 42.51 0.93 -36.02 47.53 3.66 -35.31 45.02 2.30 2 0 9.79 -999 ? O2D HEM G 201 >ASP~G 46 -37.51 38.84 1.27 -38.19 36.92 1.84 -37.85 37.88 1.55 2 0 9.27 -999 ? CMC HEM D 201 >ALA~G 47 -33.85 36.19 -0.48 -32.78 35.41 0.27 -33.32 35.80 -0.10 2 0 5.20 -999 ? CMC HEM D 201 >ASN~G 48 -37.30 32.93 0.28 -36.05 31.63 1.41 -36.67 32.28 0.84 2 0 8.75 -999 ? CMC HEM D 201 >ALA~G 49 -38.81 36.22 -2.33 -39.12 37.53 -1.65 -38.97 36.88 -1.99 2 0 8.13 -999 ? CMC HEM D 201 >LEU~G 50 -35.00 38.03 -4.70 -34.80 40.18 -4.41 -34.90 39.11 -4.55 3 0 4.37 -999 ? CMC HEM D 201 >ILE~G 51 -35.26 32.53 -5.09 -34.35 31.56 -4.71 -34.81 32.04 -4.90 3 0 4.78 -999 ? CAB HEM D 201 >ALA~G 52 -39.59 33.10 -6.08 -40.46 33.19 -4.84 -40.03 33.14 -5.46 2 0 7.60 -999 ? CAB HEM G 201 >VAL~G 53 -39.83 36.32 -8.08 -39.47 38.48 -7.77 -39.65 37.40 -7.93 3 0 -3.80 -999 ? CAB HEM G 201s >SER~G 54 -37.34 34.97 -10.60 -35.16 34.17 -11.36 -36.25 34.57 -10.98 2 0 -3.64 -999 ? CBB HEM D 201s >ALA~G 55 -39.36 31.76 -10.82 -39.90 31.01 -9.63 -39.63 31.39 -10.22 2 0 7.58 -999 ? CBB HEM D 201 >VAL~G 56 -42.39 33.63 -12.11 -43.97 34.68 -11.03 -43.18 34.15 -11.57 3 0 4.91 -999 ? CBB HEM G 201 >VAL~G 57 -40.41 35.33 -14.91 -38.67 36.69 -14.74 -39.54 36.01 -14.82 3 0 5.27 -999 ? CMB HEM G 201 >ALA~G 58 -38.92 32.01 -15.88 -38.26 31.05 -14.94 -38.59 31.53 -15.41 2 0 8.19 -999 ? CBB HEM D 201 >THR~G 59 -42.45 30.73 -16.52 -43.79 29.69 -15.22 -43.12 30.21 -15.87 2 0 10.47 -999 ? CBB HEM G 201 >HIS~G 60 -45.08 35.48 -17.22 -46.98 35.71 -16.36 -46.03 35.60 -16.79 3 0 7.87 -999 ? CBB HEM G 201 >PHE~G 61 -37.88 34.24 -20.97 -35.97 34.59 -22.94 -36.93 34.42 -21.96 3 0 12.46 -999 ? CMB HEM G 201 >GLN~G 62 -41.27 27.77 -20.90 -40.81 26.36 -19.37 -41.04 27.06 -20.13 2 0 14.48 -999 ? CBB HEM D 201 >THR~G 63 -44.36 31.34 -22.86 -46.27 31.65 -21.87 -45.32 31.50 -22.36 2 0 14.12 -999 ? CBB HEM G 201 >ILE~G 64 -42.88 35.81 -24.31 -42.30 36.89 -23.92 -42.59 36.35 -24.11 3 0 13.40 -999 ? CMB HEM G 201 >ALA~G 65 -39.97 32.49 -25.98 -39.07 31.62 -25.15 -39.52 32.06 -25.57 2 0 16.14 -999 ? CMB HEM G 201 >ALA~G 66 -42.24 29.89 -27.56 -43.26 29.03 -26.80 -42.75 29.46 -27.18 2 0 19.05 -999 ? CMB HEM G 201 >ALA~G 67 -44.39 32.72 -28.97 -44.90 33.91 -28.16 -44.64 33.31 -28.56 2 0 18.35 -999 ? CMB HEM G 201 >ASN~G 68 -40.44 35.25 -29.94 -41.42 37.02 -29.32 -40.93 36.14 -29.63 2 0 18.22 -999 ? CMB HEM G 201 >ASP.G 69 -40.65 30.95 -33.66 -40.21 29.09 -34.51 -40.43 30.02 -34.08 2 0 25.55 -999 ? CMB HEM G 201 >TYR.G 70 -37.68 29.04 -28.82 -39.26 27.41 -27.15 -38.47 28.22 -27.98 3 0 20.07 -999 ? CBB HEM D 201 >TRP.G 71 -36.95 37.12 -30.79 -37.84 35.83 -27.18 -37.39 36.48 -28.98 3 0 18.25 -999 ? CMB HEM G 201 >TRP.H 2 -68.00 27.16 -14.55 -64.08 27.16 -14.80 -66.04 27.16 -14.67 3 0 -11.40 -999 ? CMA HEM E 201s >LEU.H 3 -64.36 27.84 -18.47 -62.21 27.95 -18.85 -63.28 27.90 -18.66 3 0 14.56 -999 ? I IOD H9001 >PRO.H 4 -67.36 30.52 -22.53 -66.72 28.44 -22.03 -67.04 29.48 -22.28 3 0 18.15 -999 ? I IOD H9001 >THR.H 5 -63.52 28.72 -24.46 -64.28 29.53 -26.32 -63.90 29.13 -25.39 2 0 20.17 -999 ? CMB HEM H 201 >LEU.H 6 -58.81 28.34 -23.98 -58.75 26.97 -22.29 -58.78 27.65 -23.14 3 0 16.19 -999 ? CMB HEM H 201 >VAL.H 7 -60.05 31.17 -27.47 -60.61 30.39 -29.42 -60.33 30.78 -28.45 3 0 20.27 -999 ? CMB HEM H 201 >THR.H 8 -59.48 34.84 -26.70 -58.54 35.84 -25.05 -59.01 35.34 -25.88 2 0 15.87 -999 ? CMA HEM H 201 >ALA.H 9 -59.50 37.91 -29.00 -60.57 38.99 -28.95 -60.04 38.45 -28.97 2 0 19.41 -999 ? CMA HEM H 201 >THR~H 10 -56.25 39.49 -27.71 -57.26 41.38 -27.31 -56.75 40.43 -27.51 2 0 17.51 -999 ? CMA HEM H 201 >PRO~H 11 -51.87 39.44 -27.42 -53.61 38.89 -26.10 -52.74 39.16 -26.76 3 0 17.57 -999 ? CMA HEM H 201 >GLN~H 12 -55.03 43.37 -21.93 -54.79 45.44 -22.28 -54.91 44.41 -22.11 2 0 13.73 -999 ? CMA HEM H 201 >GLU~H 13 -59.53 40.22 -24.30 -61.11 39.90 -25.64 -60.32 40.06 -24.97 2 0 16.24 -999 ? CMA HEM H 201 >GLY~H 14 -55.75 36.06 -22.52 -55.84 36.68 -22.00 -55.79 36.37 -22.26 1 0 13.06 -999 ? CMB HEM H 201 >PHE~H 15 -52.26 38.59 -18.09 -50.48 38.71 -15.91 -51.37 38.65 -17.00 3 0 8.85 -999 ? CMB HEM H 201 >ASP~H 16 -58.47 39.13 -18.43 -57.97 41.16 -18.19 -58.22 40.15 -18.31 2 0 8.42 -999 ? CMA HEM H 201 >LEU~H 17 -58.78 34.07 -20.04 -60.05 32.31 -20.46 -59.42 33.19 -20.25 3 0 11.89 -999 ? CMB HEM H 201 >ALA~H 18 -55.50 33.40 -16.97 -54.10 33.61 -17.47 -54.80 33.51 -17.22 2 0 8.20 -999 ? CMB HEM H 201 >VAL~H 19 -56.34 35.49 -13.91 -55.86 37.53 -13.35 -56.10 36.51 -13.63 3 0 4.44 -999 ? CMB HEM H 201 >LYS~H 20 -59.86 34.06 -13.90 -65.24 33.07 -17.14 -62.55 33.56 -15.52 2 0 -12.19 -999 ? I IOD H9001s >LEU~H 21 -58.02 29.81 -15.23 -58.89 29.12 -17.03 -58.45 29.47 -16.13 3 0 9.63 -999 ? CMB HEM H 201 >SER~H 22 -56.39 31.18 -11.30 -54.69 32.44 -12.44 -55.54 31.81 -11.87 2 0 -4.20 -999 ? CMB HEM H 201s >ARG~H 23 -59.80 36.24 -9.28 -61.81 37.99 -7.75 -60.81 37.11 -8.52 2 0 -3.45 -999 ? C1A HEM H 201s >ILE~H 24 -62.71 29.78 -11.19 -62.85 29.15 -11.78 -62.78 29.46 -11.48 3 0 7.54 -999 ? I IOD H9001 >ALA~H 25 -59.91 27.07 -8.57 -58.47 26.73 -8.93 -59.19 26.90 -8.75 2 0 6.30 -999 ? CMB HEM E 201 >VAL~H 26 -59.94 28.96 -5.27 -58.85 30.64 -4.40 -59.40 29.80 -4.84 3 0 -4.47 -999 ? CMC HEM H 201s >LYS~H 27 -63.65 29.65 -5.50 -68.34 33.06 -8.10 -65.99 31.36 -6.80 2 0 7.11 -999 ? I IOD H9001 >LYS~H 28 -64.24 25.92 -6.16 -64.93 24.13 -12.20 -64.58 25.02 -9.18 2 0 -7.68 -999 ? CMA HEM E 201s >THR~H 29 -62.06 24.47 -3.40 -59.93 24.73 -3.68 -61.00 24.60 -3.54 2 0 -4.03 -999 ? CHB HEM E 201s >GLN~H 30 -62.69 28.74 0.86 -63.76 27.70 2.40 -63.23 28.22 1.63 2 0 6.84 -999 ? O2A HEM E 201 >PRO.H 31 -67.56 25.86 -1.59 -66.31 27.71 -1.85 -66.94 26.79 -1.72 3 0 -4.22 -999 ? O2A HEM E 201s >ASP~H 32 -67.36 29.39 2.57 -68.08 30.70 4.08 -67.72 30.05 3.32 2 0 9.60 -999 ? O2A HEM E 201 >ALA~H 33 -67.37 33.49 -0.12 -68.41 34.19 -1.00 -67.89 33.84 -0.56 2 0 7.14 -999 ? CMD HEM H 201 >GLN~H 34 -68.22 35.20 5.85 -69.65 34.55 7.29 -68.93 34.88 6.57 2 0 11.86 -999 ? CMD HEM H 201 >VAL~H 35 -64.00 33.03 4.38 -64.13 30.86 4.23 -64.07 31.94 4.30 3 0 6.59 -999 ? CBC HEM H 201 >ARG~H 36 -63.11 32.13 -2.24 -66.13 32.18 -2.87 -64.62 32.16 -2.56 2 0 5.37 -999 ? I IOD H9001s >ASP~H 37 -64.52 38.21 2.65 -65.52 38.86 0.91 -65.02 38.53 1.78 2 0 -3.97 -999 ? CMD HEM H 201s >THR~H 38 -61.34 36.85 5.63 -61.89 36.01 7.55 -61.61 36.43 6.59 2 0 8.98 -999 ? CAC HEM H 201 >LEU~H 39 -58.57 34.00 2.92 -58.51 32.18 4.08 -58.54 33.09 3.50 3 0 -4.07 -999 ? CBC HEM H 201s >ARG~H 40 -58.24 40.09 -1.66 -56.90 41.89 -3.79 -57.57 40.99 -2.73 2 0 -3.94 -999 ? CHA HEM H 201s >ALA~H 41 -57.59 40.56 3.77 -58.49 40.80 4.96 -58.04 40.68 4.37 2 0 7.99 -999 ? CMD HEM H 201 >VAL~H 42 -54.60 38.31 4.48 -54.44 36.68 5.92 -54.52 37.50 5.20 3 0 8.35 -999 ? CAC HEM H 201 >TYR~H 43 -54.29 36.82 -0.98 -56.09 37.53 -3.03 -55.19 37.17 -2.00 3 0 -4.00 -999 ? NC HEM H 201s >GLU~H 44 -55.25 42.32 1.11 -56.79 43.79 1.09 -56.02 43.06 1.10 2 0 6.20 -999 ? O2D HEM H 201 >LYS.H 45 -51.07 42.46 2.09 -55.06 44.38 5.88 -53.07 43.42 3.99 2 0 10.87 -999 ? O2D HEM H 201 >ASP~H 46 -49.17 38.19 2.25 -47.63 36.78 2.64 -48.40 37.48 2.45 2 0 9.21 -999 ? CMC HEM G 201 >ALA~H 47 -45.71 39.90 -0.59 -44.36 40.58 -0.24 -45.03 40.24 -0.42 2 0 5.04 -999 ? CMC HEM G 201 >ASN~H 48 -44.66 35.25 0.35 -42.60 35.34 0.89 -43.63 35.29 0.62 2 0 8.94 -999 ? CMC HEM G 201 >ALA~H 49 -48.61 35.32 -1.47 -49.72 35.67 -0.52 -49.17 35.50 -1.00 2 0 7.94 -999 ? CMC HEM H 201 >LEU~H 50 -48.76 39.45 -4.08 -50.38 40.85 -3.63 -49.57 40.15 -3.86 3 0 -4.40 -999 ? CMC HEM G 201s >ILE~H 51 -44.32 36.47 -5.23 -42.93 36.78 -5.13 -43.63 36.63 -5.18 3 0 4.71 -999 ? CAB HEM G 201 >ALA~H 52 -47.10 33.04 -5.61 -47.28 32.29 -4.32 -47.19 32.67 -4.97 2 0 7.85 -999 ? CAB HEM H 201 >VAL~H 53 -50.33 34.36 -7.10 -52.00 35.69 -6.58 -51.16 35.03 -6.84 3 0 -3.88 -999 ? CAB HEM H 201s >SER~H 54 -48.44 35.72 -10.14 -46.91 37.02 -11.44 -47.67 36.37 -10.79 2 0 -3.64 -999 ? CBB HEM G 201s >ALA~H 55 -46.88 32.27 -10.41 -46.31 31.47 -9.27 -46.60 31.87 -9.84 2 0 7.52 -999 ? CBB HEM G 201 >VAL~H 56 -50.29 30.65 -10.85 -51.70 29.82 -9.42 -51.00 30.24 -10.14 3 0 5.25 -999 ? CBB HEM H 201 >VAL~H 57 -51.42 33.07 -13.55 -51.44 35.29 -13.30 -51.43 34.18 -13.43 3 0 5.34 -999 ? CMB HEM H 201 >ALA~H 58 -48.05 32.62 -15.29 -46.68 32.65 -14.62 -47.36 32.63 -14.95 2 0 8.11 -999 ? CBB HEM G 201 >THR~H 59 -48.78 28.89 -15.66 -48.35 27.23 -14.38 -48.56 28.06 -15.02 2 0 10.85 -999 ? CBB HEM H 201 >HIS~H 60 -54.23 29.07 -14.99 -55.29 27.68 -13.83 -54.76 28.38 -14.41 3 0 8.01 -999 ? CBB HEM H 201 >PHE~H 61 -50.56 34.38 -20.09 -50.27 36.03 -22.36 -50.41 35.20 -21.23 3 0 12.52 -999 ? CMB HEM H 201 >GLN~H 62 -46.89 28.17 -20.79 -45.28 27.47 -19.61 -46.08 27.82 -20.20 2 0 14.91 -999 ? CBB HEM G 201 >THR~H 63 -51.82 27.23 -21.44 -52.77 25.72 -20.23 -52.30 26.48 -20.83 2 0 14.58 -999 ? CBB HEM H 201 >ILE~H 64 -55.17 30.81 -22.12 -55.66 31.83 -21.71 -55.42 31.32 -21.91 3 0 13.08 -999 ? CMB HEM H 201 >ALA~H 65 -51.35 31.39 -24.92 -50.00 31.87 -24.38 -50.68 31.63 -24.65 2 0 16.03 -999 ? CMB HEM H 201 >ALA~H 66 -50.67 28.08 -26.66 -50.08 26.82 -26.02 -50.37 27.45 -26.34 2 0 19.23 -999 ? CMB HEM H 201 >ALA~H 67 -54.43 27.69 -27.14 -55.47 27.88 -26.06 -54.95 27.79 -26.60 2 0 18.20 -999 ? CMB HEM H 201 >ASN~H 68 -54.78 32.27 -28.46 -56.37 32.14 -27.11 -55.58 32.21 -27.78 2 0 17.97 -999 ? CMB HEM H 201 >ASP.H 69 -51.70 29.87 -32.40 -50.06 29.48 -33.66 -50.88 29.68 -33.03 2 0 25.33 -999 ? CMB HEM H 201 >TYR.H 70 -47.82 31.60 -28.68 -47.16 29.27 -27.35 -47.49 30.44 -28.01 3 0 20.27 -999 ? CBB HEM G 201 >TRP.H 71 -54.66 36.02 -29.30 -53.21 35.00 -25.78 -53.93 35.51 -27.54 3 0 18.05 -999 ? CMB HEM H 201