#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fv6 h LYS 65 N 0.00 0.00 -5.79 1.61 1.57 -2.01 -3.43 116.57 108.52 3fv6 h LYS 65 Ca 0.00 0.00 -0.62 0.00 -1.87 0.00 0.00 60.65 58.16 3fv6 h LYS 65 Cb 0.00 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.18 3fv6 h LYS 65 CO 0.00 0.91 -0.62 0.95 -0.57 0.00 0.00 179.45 180.12 3fv6 s THR 66 N -2.73 2.14 0.39 -0.16 -4.23 -1.26 -5.02 115.64 104.77 3fv6 s THR 66 Ca 0.01 -2.03 0.07 0.00 -1.18 0.00 0.00 61.69 58.56 3fv6 s THR 66 Cb 0.10 -2.88 0.21 0.00 1.34 0.00 0.00 72.50 71.27 3fv6 s THR 66 CO 0.81 -0.07 1.98 1.23 -0.54 0.00 0.00 174.62 178.03 3fv6 h GLY 67 N 1.82 0.48 1.73 3.99 0.00 -2.00 -0.29 103.07 108.80 3fv6 h GLY 67 Ca -0.43 -0.23 -0.14 0.00 0.00 0.00 0.00 47.33 46.53 3fv6 h GLY 67 CO 0.76 0.22 -0.57 -0.91 0.00 0.00 0.00 176.54 176.03 3fv6 h THR 68 N 0.45 1.37 -0.34 4.70 1.35 -1.99 -1.75 112.91 116.69 3fv6 h THR 68 Ca 0.11 -1.90 -0.12 0.00 -0.55 0.00 0.00 66.41 63.95 3fv6 h THR 68 Cb 0.14 1.93 -0.01 0.00 -1.73 0.00 0.00 68.15 68.48 3fv6 h THR 68 CO -0.01 0.57 -0.26 1.56 -0.25 0.00 0.00 175.52 177.13 3fv6 h GLN 69 N 0.21 0.69 -0.56 4.72 4.20 -1.80 0.11 115.11 122.69 3fv6 h GLN 69 Ca -0.00 -0.29 -0.08 0.00 0.06 0.00 0.00 58.65 58.34 3fv6 h GLN 69 Cb 1.07 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.80 3fv6 h GLN 69 CO 0.09 0.88 0.04 -0.07 -0.67 0.00 0.00 178.83 179.11 3fv6 h LEU 70 N 0.60 0.93 0.10 1.46 3.38 -0.78 -0.63 115.31 120.37 3fv6 h LEU 70 Ca 0.08 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.77 3fv6 h LEU 70 Cb 0.76 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3fv6 h LEU 70 CO 0.06 0.99 -0.18 0.25 0.09 0.00 0.00 178.44 179.65 3fv6 h LEU 71 N 0.84 -0.50 -0.28 1.67 5.85 -1.21 -1.68 115.31 120.01 3fv6 h LEU 71 Ca 0.16 0.06 0.05 0.00 0.84 0.00 0.00 57.88 58.99 3fv6 h LEU 71 Cb 0.49 0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.66 3fv6 h LEU 71 CO 0.02 -0.26 -0.03 0.00 -0.34 0.00 0.00 178.44 177.83 3fv6 h ALA 72 N 0.49 0.22 -0.60 1.25 0.00 -0.44 -0.82 119.26 119.36 3fv6 h ALA 72 Ca 0.02 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.10 3fv6 h ALA 72 Cb 0.36 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 3fv6 h ALA 72 CO -0.10 -0.44 0.28 -0.44 0.00 0.00 0.00 179.25 178.55 3fv6 h ASP 73 N 0.05 0.36 -0.68 0.00 3.45 -0.99 -0.79 116.42 117.81 3fv6 h ASP 73 Ca 0.13 0.05 -0.03 0.00 0.43 0.00 0.00 57.03 57.61 3fv6 h ASP 73 Cb 0.19 -0.01 -0.03 0.00 -0.56 0.00 0.00 39.33 38.92 3fv6 h ASP 73 CO -0.25 0.23 0.30 0.11 -1.57 0.00 0.00 179.24 178.06 3fv6 h LYS 74 N 0.51 1.00 -0.74 3.56 1.57 -0.92 -2.97 116.57 118.58 3fv6 h LYS 74 Ca 0.28 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.84 3fv6 h LYS 74 Cb 0.26 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 3fv6 h LYS 74 CO -0.23 0.81 0.22 -0.07 -0.57 0.00 0.00 179.45 179.61 3fv6 h LEU 75 N 0.96 1.08 -1.82 2.94 3.38 -0.40 -2.06 115.31 119.40 3fv6 h LEU 75 Ca 0.23 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3fv6 h LEU 75 Cb 0.16 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3fv6 h LEU 75 CO -0.02 1.01 0.00 0.11 0.09 0.00 0.00 178.44 179.62 3fv6 h LYS 76 N 1.10 0.00 0.00 1.13 1.57 -1.02 -2.90 116.57 116.45 3fv6 h LYS 76 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3fv6 h LYS 76 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3fv6 h LYS 76 CO -0.01 0.00 -1.16 1.63 -0.57 0.00 0.00 179.45 179.35 3fv6 n LYS 77 N -2.57 0.17 -1.89 3.15 4.76 -0.78 -4.88 118.16 116.13 3fv6 n LYS 77 Ca -0.01 -0.04 -0.41 0.00 -2.87 0.00 0.00 58.31 54.97 3fv6 n LYS 77 Cb 0.09 -1.52 -0.02 0.00 -1.84 0.00 0.00 35.03 31.74 3fv6 n LYS 77 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3fv6 s LEU 78 N -3.43 4.37 0.01 -0.35 1.43 -1.10 -4.94 118.68 114.67 3fv6 s LEU 78 Ca 0.05 2.80 0.04 0.00 -1.03 0.00 0.00 54.13 55.98 3fv6 s LEU 78 Cb 0.15 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.72 3fv6 s LEU 78 CO 0.86 -0.82 -0.09 -1.10 0.23 0.00 0.00 176.35 175.43 3fv6 s GLN 79 N -0.24 2.48 0.25 1.70 -0.21 -1.26 -1.20 119.66 121.18 3fv6 s GLN 79 Ca 0.63 -0.76 -0.10 0.00 0.02 0.00 0.00 55.36 55.15 3fv6 s GLN 79 Cb -0.45 -2.45 0.38 0.00 1.00 0.00 0.00 33.01 31.49 3fv6 s GLN 79 CO 0.44 0.59 1.60 0.28 -2.12 0.00 0.00 175.29 176.08 3fv6 h VAL 80 N 3.82 0.20 -0.64 1.09 2.07 -1.15 -0.94 116.25 120.71 3fv6 h VAL 80 Ca -0.48 -0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.22 3fv6 h VAL 80 Cb 1.17 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 3fv6 h VAL 80 CO 0.52 0.00 0.78 0.07 0.02 0.00 0.00 177.57 178.97 3fv6 h LYS 81 N 0.01 0.00 -0.01 1.57 2.10 -0.73 0.12 116.57 119.63 3fv6 h LYS 81 Ca 0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.05 3fv6 h LYS 81 Cb 0.64 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.97 3fv6 h LYS 81 CO -0.82 0.00 -0.30 -0.25 -2.00 0.00 0.00 179.45 176.08 3fv6 n ASP 82 N -3.42 1.62 -2.14 7.07 8.00 -0.36 -4.56 116.55 122.76 3fv6 n ASP 82 Ca 0.13 -1.28 0.00 0.00 0.71 0.00 0.00 54.79 54.36 3fv6 n ASP 82 Cb 1.00 0.25 0.04 0.00 -0.02 0.00 0.00 41.12 42.39 3fv6 n ASP 82 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3fv6 n PHE 83 N -0.17 0.28 -4.17 1.24 3.01 0.42 -5.07 117.46 113.00 3fv6 n PHE 83 Ca 0.12 -1.32 -0.22 0.00 1.01 0.00 0.00 57.45 57.03 3fv6 n PHE 83 Cb 0.42 0.09 -0.05 0.00 -0.01 0.00 0.00 39.48 39.92 3fv6 n PHE 83 CO 0.00 0.00 0.00 1.14 1.01 0.00 0.00 176.76 178.91 3fv6 s GLN 84 N -1.56 2.74 0.36 -1.08 -2.07 -1.12 -4.81 119.66 112.12 3fv6 s GLN 84 Ca 0.25 -1.15 0.08 0.00 -1.82 0.00 0.00 55.36 52.72 3fv6 s GLN 84 Cb 0.33 -2.45 -0.04 0.00 -1.09 0.00 0.00 33.01 29.76 3fv6 s GLN 84 CO -0.09 0.40 0.19 -1.12 -1.32 0.00 0.00 175.29 173.34 3fv6 s SER 85 N -3.75 4.74 0.42 12.60 0.01 0.18 -4.94 113.70 122.96 3fv6 s SER 85 Ca 0.32 -0.80 -0.24 0.00 1.31 0.00 0.00 55.95 56.54 3fv6 s SER 85 Cb -0.08 -0.68 -0.08 0.00 0.21 0.00 0.00 66.02 65.39 3fv6 s SER 85 CO 0.23 -0.39 1.12 0.27 0.41 0.00 0.00 173.24 174.88 3fv6 s ILE 86 N -2.45 3.36 0.40 1.44 -4.36 -1.26 -0.88 121.20 117.44 3fv6 s ILE 86 Ca 0.40 1.06 -0.10 0.00 -0.26 0.00 0.00 60.65 61.75 3fv6 s ILE 86 Cb -0.02 -3.55 -0.06 0.00 1.25 0.00 0.00 42.46 40.08 3fv6 s ILE 86 CO 0.24 0.02 0.75 -2.16 0.24 0.00 0.00 174.94 174.02 3fv6 s PRO 87 N -2.53 3.75 -0.23 0.37 0.04 -1.26 -4.39 135.00 130.75 3fv6 s PRO 87 Ca 0.60 0.41 -0.01 0.00 0.04 0.00 0.00 61.00 62.04 3fv6 s PRO 87 Cb -0.26 -2.42 0.02 0.00 0.04 0.00 0.00 34.50 31.88 3fv6 s PRO 87 CO 0.33 -0.02 -0.10 0.08 0.04 0.00 0.00 177.00 177.32 3fv6 s VAL 88 N -2.36 2.61 -0.04 -0.36 1.01 -1.26 -5.01 120.40 115.00 3fv6 s VAL 88 Ca 0.50 -1.02 0.06 0.00 0.00 0.00 0.00 61.98 61.53 3fv6 s VAL 88 Cb -0.10 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.99 3fv6 s VAL 88 CO 0.32 0.29 -0.23 -0.69 0.00 0.00 0.00 175.10 174.79 3fv6 s VAL 89 N 1.30 1.84 0.15 2.92 1.01 -1.26 -1.84 120.40 124.53 3fv6 s VAL 89 Ca 0.01 -0.97 0.08 0.00 0.00 0.00 0.00 61.98 61.10 3fv6 s VAL 89 Cb -0.16 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 3fv6 s VAL 89 CO -0.07 0.52 -0.17 0.27 0.00 0.00 0.00 175.10 175.65 3fv6 s ILE 90 N -0.26 1.65 0.46 2.22 -4.36 0.19 -4.95 121.20 116.15 3fv6 s ILE 90 Ca 0.01 -1.82 -0.21 0.00 -0.26 0.00 0.00 60.65 58.37 3fv6 s ILE 90 Cb -0.12 -1.72 -0.08 0.00 1.25 0.00 0.00 42.46 41.79 3fv6 s ILE 90 CO 0.02 -0.33 1.05 -2.28 0.24 0.00 0.00 174.94 173.64 3fv6 s HIS 91 N -2.01 3.05 -0.01 1.37 5.65 -1.26 -0.99 115.29 121.09 3fv6 s HIS 91 Ca 0.13 1.59 0.29 0.00 0.25 0.00 0.00 55.06 57.32 3fv6 s HIS 91 Cb -0.06 -3.10 1.46 0.00 -1.18 0.00 0.00 32.58 29.70 3fv6 s HIS 91 CO 0.05 -0.84 1.89 1.05 -0.65 0.00 0.00 174.74 176.25 3fv6 h GLU 92 N 1.80 0.00 -0.02 2.88 4.11 -1.59 -2.65 114.58 119.12 3fv6 h GLU 92 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3fv6 h GLU 92 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 3fv6 h GLU 92 CO 0.60 0.00 -0.47 0.09 0.07 0.00 0.00 179.01 179.30 3fv6 n ASN 93 N -2.57 2.03 -4.68 3.06 3.02 -1.26 -1.93 115.26 112.92 3fv6 n ASN 93 Ca -0.01 -1.51 -0.40 0.00 -0.03 0.00 0.00 54.58 52.63 3fv6 n ASN 93 Cb 0.13 0.48 0.03 0.00 -0.61 0.00 0.00 39.78 39.80 3fv6 n ASN 93 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3fv6 n VAL 94 N -0.02 3.10 -1.75 2.41 0.31 -1.00 -4.65 118.33 116.73 3fv6 n VAL 94 Ca 0.09 -0.50 -0.32 0.00 -0.01 0.00 0.00 64.34 63.61 3fv6 n VAL 94 Cb 0.47 -1.43 0.03 0.00 -0.91 0.00 0.00 33.84 32.00 3fv6 n VAL 94 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3fv6 s SER 95 N -0.81 5.58 0.27 4.52 1.04 -1.26 -0.45 113.70 122.59 3fv6 s SER 95 Ca 0.67 1.66 -0.00 0.00 0.48 0.00 0.00 55.95 58.76 3fv6 s SER 95 Cb -0.47 -2.51 0.51 0.00 0.10 0.00 0.00 66.02 63.65 3fv6 s SER 95 CO 0.53 -1.31 1.84 0.58 0.98 0.00 0.00 173.24 175.87 3fv6 h VAL 96 N -0.31 0.95 -0.38 5.02 2.07 -1.09 0.04 116.25 122.55 3fv6 h VAL 96 Ca -0.45 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 3fv6 h VAL 96 Cb 1.21 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.82 3fv6 h VAL 96 CO 0.57 0.18 0.14 0.22 0.02 0.00 0.00 177.57 178.70 3fv6 h TYR 97 N 1.00 0.59 -0.77 1.57 3.20 -1.51 -0.42 116.97 120.63 3fv6 h TYR 97 Ca 0.47 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 62.28 3fv6 h TYR 97 Cb 0.42 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.48 3fv6 h TYR 97 CO -0.01 0.54 0.45 -0.44 -1.64 0.00 0.00 178.16 177.06 3fv6 h ASP 98 N 0.46 0.94 -0.42 -2.11 3.45 -1.62 -1.11 116.42 116.01 3fv6 h ASP 98 Ca 0.12 -0.06 0.02 0.00 0.43 0.00 0.00 57.03 57.54 3fv6 h ASP 98 Cb 0.22 -0.24 -0.03 0.00 -0.56 0.00 0.00 39.33 38.72 3fv6 h ASP 98 CO -0.01 0.73 0.25 0.00 -1.57 0.00 0.00 179.24 178.64 3fv6 h ALA 99 N 1.42 0.53 -0.61 3.45 0.00 -0.54 -1.42 119.26 122.10 3fv6 h ALA 99 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3fv6 h ALA 99 Cb -0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.63 3fv6 h ALA 99 CO -0.05 -0.08 0.39 0.82 0.00 0.00 0.00 179.25 180.33 3fv6 h ILE 100 N 0.50 1.16 -0.66 0.00 2.04 -0.40 -0.62 117.51 119.53 3fv6 h ILE 100 Ca 0.17 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 3fv6 h ILE 100 Cb 0.02 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.35 3fv6 h ILE 100 CO -0.08 0.16 0.32 0.00 0.00 0.00 0.00 178.15 178.55 3fv6 h THR 102 N 0.94 1.27 -0.42 0.00 2.02 -0.64 0.21 112.91 116.29 3fv6 h THR 102 Ca 0.23 -1.37 0.02 0.00 0.77 0.00 0.00 66.41 66.06 3fv6 h THR 102 Cb 0.09 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.67 3fv6 h THR 102 CO -0.03 0.46 0.23 -0.03 0.37 0.00 0.00 175.52 176.52 3fv6 h MET 103 N 0.74 0.46 -0.04 6.66 -1.53 -0.17 -0.36 114.93 120.68 3fv6 h MET 103 Ca 0.10 -0.03 -0.19 0.00 -3.44 0.00 0.00 59.70 56.14 3fv6 h MET 103 Cb 0.77 -0.10 -0.01 0.00 -0.55 0.00 0.00 31.60 31.71 3fv6 h MET 103 CO 0.06 0.30 -0.79 0.74 0.14 0.00 0.00 176.91 177.37 3fv6 h PHE 104 N 0.47 0.46 -0.06 1.39 0.04 -1.14 -0.55 116.94 117.55 3fv6 h PHE 104 Ca 0.17 -0.22 -0.00 0.00 2.80 0.00 0.00 57.97 60.72 3fv6 h PHE 104 Cb 0.03 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.12 3fv6 h PHE 104 CO -0.08 0.99 0.04 1.25 -0.60 0.00 0.00 178.31 179.91 3fv6 h LEU 105 N 0.21 0.08 -0.09 1.54 5.85 -0.35 -3.22 115.31 119.32 3fv6 h LEU 105 Ca -0.04 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3fv6 h LEU 105 Cb 1.38 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.39 3fv6 h LEU 105 CO 0.13 0.10 -0.16 -0.62 -0.34 0.00 0.00 178.44 177.56 3fv6 n GLU 106 N -5.02 0.30 -3.46 1.25 -0.58 -0.17 -4.98 120.64 107.98 3fv6 n GLU 106 Ca -0.06 -0.09 -0.18 0.00 -0.42 0.00 0.00 57.16 56.40 3fv6 n GLU 106 Cb 0.05 -1.50 0.09 0.00 -0.57 0.00 0.00 31.44 29.51 3fv6 n GLU 106 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 3fv6 n ASP 107 N -1.27 -2.76 -4.33 1.62 2.03 -0.24 -5.03 116.55 106.58 3fv6 n ASP 107 Ca 0.10 -0.61 -0.17 0.00 0.52 0.00 0.00 54.79 54.63 3fv6 n ASP 107 Cb 0.31 -5.09 -0.10 0.00 -0.72 0.00 0.00 41.12 35.51 3fv6 n ASP 107 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 3fv6 s VAL 108 N -3.36 1.35 -0.68 5.18 -7.23 -1.03 -5.05 120.40 109.58 3fv6 s VAL 108 Ca 0.10 -2.10 0.07 0.00 -1.81 0.00 0.00 61.98 58.24 3fv6 s VAL 108 Cb -0.04 -2.15 0.16 0.00 0.56 0.00 0.00 36.38 34.91 3fv6 s VAL 108 CO 0.73 -0.51 1.04 0.61 -0.31 0.00 0.00 175.10 176.66 3fv6 n GLY 109 N -0.38 1.83 2.92 2.32 0.00 -1.26 -4.72 105.19 105.91 3fv6 n GLY 109 Ca -0.07 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 3fv6 n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3fv6 s THR 110 N -0.89 0.00 0.03 2.61 2.01 -1.26 -0.70 115.64 117.44 3fv6 s THR 110 Ca 0.13 -0.03 0.07 0.00 0.31 0.00 0.00 61.69 62.17 3fv6 s THR 110 Cb 0.07 -0.09 -0.02 0.00 0.01 0.00 0.00 72.50 72.48 3fv6 s THR 110 CO 0.10 -0.02 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.05 3fv6 s LEU 111 N -0.03 2.13 -0.03 4.42 1.43 0.46 -4.81 118.68 122.26 3fv6 s LEU 111 Ca -0.01 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.59 3fv6 s LEU 111 Cb -0.01 -0.94 -0.04 0.00 0.03 0.00 0.00 46.19 45.23 3fv6 s LEU 111 CO 0.00 0.17 0.15 -0.36 0.23 0.00 0.00 176.35 176.54 3fv6 s PHE 112 N -0.71 3.50 -0.11 0.29 0.08 -0.76 -0.87 117.98 119.39 3fv6 s PHE 112 Ca 0.07 0.36 0.01 0.00 0.12 0.00 0.00 56.93 57.48 3fv6 s PHE 112 Cb -0.08 -1.83 -0.01 0.00 -0.57 0.00 0.00 43.02 40.52 3fv6 s PHE 112 CO 0.01 0.64 -0.15 0.08 -0.10 0.00 0.00 175.22 175.70 3fv6 s VAL 113 N -1.24 2.90 0.32 -0.44 1.01 0.42 -0.64 120.40 122.73 3fv6 s VAL 113 Ca 0.24 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.56 3fv6 s VAL 113 Cb -0.12 -2.19 -0.06 0.00 0.00 0.00 0.00 36.38 34.00 3fv6 s VAL 113 CO 0.15 0.54 -0.05 0.68 0.00 0.00 0.00 175.10 176.42 3fv6 s VAL 114 N 0.19 1.80 0.00 2.92 -7.23 -0.16 -0.68 120.40 117.23 3fv6 s VAL 114 Ca -0.09 -2.12 0.00 0.00 -1.81 0.00 0.00 61.98 57.96 3fv6 s VAL 114 Cb -0.15 -2.60 0.00 0.00 0.56 0.00 0.00 36.38 34.18 3fv6 s VAL 114 CO 0.05 -0.21 0.00 -0.90 -0.31 0.00 0.00 175.10 173.74 3fv6 n ASP 115 N -0.70 0.00 0.00 4.85 5.68 -0.55 -1.45 116.55 124.38 3fv6 n ASP 115 Ca -0.05 -0.94 0.05 0.00 -0.50 0.00 0.00 54.79 53.35 3fv6 n ASP 115 Cb 0.64 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.84 3fv6 n ASP 115 CO 0.00 0.00 0.00 -1.14 -1.33 0.00 0.00 177.20 174.73 3fv6 n ARG 116 N -0.94 0.02 -0.23 0.11 0.63 -1.26 -1.16 116.66 113.83 3fv6 n ARG 116 Ca 0.00 0.31 0.09 0.00 -0.92 0.00 0.00 57.85 57.33 3fv6 n ARG 116 Cb 0.00 -1.50 0.21 0.00 0.45 0.00 0.00 32.46 31.62 3fv6 n ARG 116 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3fv6 n ASP 117 N -1.48 3.30 -2.44 6.15 8.00 -1.26 -4.96 116.55 123.86 3fv6 n ASP 117 Ca 0.03 -1.95 -0.17 0.00 0.71 0.00 0.00 54.79 53.41 3fv6 n ASP 117 Cb 0.11 -0.30 0.03 0.00 -0.02 0.00 0.00 41.12 40.95 3fv6 n ASP 117 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fv6 n ALA 118 N 1.12 -0.78 -2.79 2.24 0.00 -0.31 -5.02 120.51 114.98 3fv6 n ALA 118 Ca 0.17 0.24 -0.36 0.00 0.00 0.00 0.00 53.44 53.49 3fv6 n ALA 118 Cb 0.52 -3.30 -0.08 0.00 0.00 0.00 0.00 19.45 16.59 3fv6 n ALA 118 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3fv6 s VAL 119 N -3.06 4.89 -0.09 0.00 1.01 -1.26 -4.52 120.40 117.37 3fv6 s VAL 119 Ca 0.27 -0.02 -0.35 0.00 0.00 0.00 0.00 61.98 61.87 3fv6 s VAL 119 Cb -0.12 -3.12 -0.13 0.00 0.00 0.00 0.00 36.38 33.02 3fv6 s VAL 119 CO 0.33 0.59 1.80 -0.11 0.00 0.00 0.00 175.10 177.71 3fv6 n LEU 120 N 2.33 3.15 -0.00 3.92 7.94 0.11 -1.48 117.00 132.97 3fv6 n LEU 120 Ca -0.19 1.01 0.02 0.00 -1.11 0.00 0.00 56.01 55.74 3fv6 n LEU 120 Cb 0.54 -1.33 -0.02 0.00 0.53 0.00 0.00 43.42 43.14 3fv6 n LEU 120 CO 0.31 -0.18 -0.49 1.33 -1.11 0.00 0.00 177.39 177.25 3fv6 n VAL 121 N 4.76 0.00 -3.74 1.96 0.24 0.14 -4.78 118.33 116.91 3fv6 n VAL 121 Ca 0.23 -0.11 -0.03 0.00 -2.04 0.00 0.00 64.34 62.39 3fv6 n VAL 121 Cb 0.26 0.48 -0.01 0.00 -1.47 0.00 0.00 33.84 33.10 3fv6 n VAL 121 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3fv6 s GLY 122 N -2.26 -0.25 0.05 7.63 0.00 -1.01 -3.68 107.32 107.80 3fv6 s GLY 122 Ca -0.01 0.18 0.03 0.00 0.00 0.00 0.00 44.72 44.92 3fv6 s GLY 122 CO 0.13 0.01 -0.09 -1.34 0.00 0.00 0.00 173.10 171.81 3fv6 s VAL 123 N -3.20 0.67 -0.07 1.40 -7.23 -0.72 -0.43 120.40 110.82 3fv6 s VAL 123 Ca 0.12 -1.08 0.01 0.00 -1.81 0.00 0.00 61.98 59.23 3fv6 s VAL 123 Cb -0.01 -0.70 0.02 0.00 0.56 0.00 0.00 36.38 36.25 3fv6 s VAL 123 CO 0.02 -0.31 -0.07 -0.76 -0.31 0.00 0.00 175.10 173.67 3fv6 s LEU 124 N -1.52 1.31 0.23 1.32 1.43 -0.05 -1.74 118.68 119.67 3fv6 s LEU 124 Ca -0.07 -0.21 0.05 0.00 -1.03 0.00 0.00 54.13 52.87 3fv6 s LEU 124 Cb -0.09 -0.63 -0.03 0.00 0.03 0.00 0.00 46.19 45.46 3fv6 s LEU 124 CO 0.01 -0.06 0.32 -0.94 0.23 0.00 0.00 176.35 175.91 3fv6 s SER 125 N 1.10 6.20 0.37 2.29 1.04 -1.26 -0.40 113.70 123.03 3fv6 s SER 125 Ca -0.07 0.04 0.14 0.00 0.48 0.00 0.00 55.95 56.53 3fv6 s SER 125 Cb -0.14 -1.80 0.99 0.00 0.10 0.00 0.00 66.02 65.17 3fv6 s SER 125 CO -0.01 -0.05 1.77 -0.09 0.98 0.00 0.00 173.24 175.85 3fv6 h ARG 126 N 1.38 0.49 -0.61 4.02 2.43 -1.29 -1.70 114.38 119.11 3fv6 h ARG 126 Ca -0.51 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 58.64 3fv6 h ARG 126 Cb 1.23 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 30.63 3fv6 h ARG 126 CO 0.62 0.33 0.40 -0.22 -1.51 0.00 0.00 179.97 179.59 3fv6 h LYS 127 N 0.51 0.80 -0.72 0.20 3.64 -1.94 -1.17 116.57 117.87 3fv6 h LYS 127 Ca 0.59 -0.05 0.03 0.00 -1.27 0.00 0.00 60.65 59.95 3fv6 h LYS 127 Cb 1.29 -0.18 -0.05 0.00 -0.41 0.00 0.00 32.23 32.89 3fv6 h LYS 127 CO -0.33 0.53 0.45 -0.44 -2.27 0.00 0.00 179.45 177.38 3fv6 h ASP 128 N 0.82 0.74 -0.31 4.20 3.32 -1.71 -1.06 116.42 122.41 3fv6 h ASP 128 Ca 0.22 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.12 3fv6 h ASP 128 Cb -0.09 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.29 3fv6 h ASP 128 CO -0.05 0.51 -0.41 -0.07 -1.72 0.00 0.00 179.24 177.50 3fv6 h LEU 129 N 0.88 0.90 -0.30 1.55 3.38 -1.18 -1.53 115.31 119.00 3fv6 h LEU 129 Ca 0.29 -0.50 0.02 0.00 0.09 0.00 0.00 57.88 57.78 3fv6 h LEU 129 Cb 0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 3fv6 h LEU 129 CO -0.11 1.22 0.16 0.25 0.09 0.00 0.00 178.44 180.05 3fv6 h LEU 130 N 0.60 0.25 -0.46 1.67 5.85 -1.06 -1.04 115.31 121.13 3fv6 h LEU 130 Ca 0.04 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.83 3fv6 h LEU 130 Cb 1.00 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.94 3fv6 h LEU 130 CO 0.10 0.19 0.14 -0.09 -0.34 0.00 0.00 178.44 178.44 3fv6 h ARG 131 N 0.33 0.30 -0.66 1.25 2.43 -1.07 -1.61 114.38 115.34 3fv6 h ARG 131 Ca 0.12 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 3fv6 h ARG 131 Cb 0.02 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 3fv6 h ARG 131 CO -0.07 0.20 0.41 0.00 -1.51 0.00 0.00 179.97 178.99 3fv6 h ALA 132 N 1.31 0.85 -0.04 2.80 0.00 -1.14 -2.84 119.26 120.20 3fv6 h ALA 132 Ca 0.22 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 3fv6 h ALA 132 Cb 0.24 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3fv6 h ALA 132 CO -0.24 0.31 -0.54 1.03 0.00 0.00 0.00 179.25 179.81 3fv6 h SER 133 N 0.90 0.12 0.03 0.00 0.87 -0.69 -3.27 113.55 111.52 3fv6 h SER 133 Ca 0.24 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 3fv6 h SER 133 Cb -0.05 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 3fv6 h SER 133 CO -0.05 0.64 -1.02 0.00 -0.53 0.00 0.00 176.83 175.87 3fv6 n ILE 134 N -3.91 0.00 -1.46 2.23 0.13 -0.65 -4.97 119.36 110.73 3fv6 n ILE 134 Ca -0.02 -0.02 -0.22 0.00 -1.10 0.00 0.00 62.75 61.39 3fv6 n ILE 134 Cb 0.56 0.91 0.17 0.00 -0.84 0.00 0.00 39.64 40.43 3fv6 n ILE 134 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3fv6 n GLY 135 N 1.49 -1.80 0.17 4.50 0.00 -1.08 -4.97 105.19 103.50 3fv6 n GLY 135 Ca 0.04 -1.63 -0.14 0.00 0.00 0.00 0.00 46.02 44.28 3fv6 n GLY 135 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3fv6 h GLN 136 N 0.00 0.50 -7.00 1.61 4.15 -1.90 -3.44 115.11 109.03 3fv6 h GLN 136 Ca -0.32 -0.49 -0.46 0.00 0.77 0.00 0.00 58.65 58.15 3fv6 h GLN 136 Cb 0.91 0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.73 3fv6 h GLN 136 CO 0.22 1.12 0.37 -0.65 -1.93 0.00 0.00 178.83 177.97 3fv6 s GLN 137 N -3.41 4.19 -0.52 1.69 -1.52 -1.26 -5.01 119.66 113.82 3fv6 s GLN 137 Ca -0.07 1.33 -0.27 0.00 -1.95 0.00 0.00 55.36 54.39 3fv6 s GLN 137 Cb 0.09 -2.39 -0.01 0.00 -0.22 0.00 0.00 33.01 30.48 3fv6 s GLN 137 CO 0.87 -0.08 1.68 -2.00 -0.25 0.00 0.00 175.29 175.51 3fv6 s GLU 138 N -2.76 3.06 0.00 2.91 -6.30 -1.26 -4.80 118.70 109.55 3fv6 s GLU 138 Ca 0.59 0.76 0.02 0.00 -2.50 0.00 0.00 54.97 53.84 3fv6 s GLU 138 Cb -0.16 -4.24 0.01 0.00 0.00 0.00 0.00 34.13 29.74 3fv6 s GLU 138 CO 0.21 -2.21 0.54 1.28 0.02 0.00 0.00 175.26 175.10 3fv6 n LEU 139 N 10.92 1.12 0.23 2.70 4.77 -1.26 -4.65 117.00 130.83 3fv6 n LEU 139 Ca 0.18 -0.99 0.12 0.00 -0.03 0.00 0.00 56.01 55.29 3fv6 n LEU 139 Cb 0.50 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.04 3fv6 n LEU 139 CO 0.70 0.26 0.84 0.71 -1.33 0.00 0.00 177.39 178.58 3fv6 h THR 140 N 0.30 0.32 0.00 -5.08 1.35 -1.87 -3.07 112.91 104.87 3fv6 h THR 140 Ca 0.00 -0.99 0.00 0.00 -0.55 0.00 0.00 66.41 64.87 3fv6 h THR 140 Cb 0.06 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3fv6 h THR 140 CO 0.00 0.14 -0.31 -1.54 -0.25 0.00 0.00 175.52 173.56 3fv6 n SER 141 N -3.24 0.34 -4.86 5.36 3.41 -1.26 -1.36 113.62 112.00 3fv6 n SER 141 Ca 0.01 0.07 -0.31 0.00 -0.26 0.00 0.00 58.87 58.39 3fv6 n SER 141 Cb 0.43 -0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 64.28 3fv6 n SER 141 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3fv6 s VAL 142 N -3.01 4.70 0.37 -3.33 -7.23 -1.16 -4.76 120.40 105.98 3fv6 s VAL 142 Ca 0.12 0.82 -0.28 0.00 -1.81 0.00 0.00 61.98 60.83 3fv6 s VAL 142 Cb 0.18 -3.73 -0.11 0.00 0.56 0.00 0.00 36.38 33.28 3fv6 s VAL 142 CO 0.64 -0.60 1.44 -2.84 -0.31 0.00 0.00 175.10 173.42 3fv6 s PRO 143 N -3.98 4.12 0.61 4.82 0.02 -1.26 -1.25 135.00 138.08 3fv6 s PRO 143 Ca 0.54 2.47 0.30 0.00 0.02 0.00 0.00 61.00 64.32 3fv6 s PRO 143 Cb -0.10 -2.96 1.61 0.00 0.02 0.00 0.00 34.50 33.07 3fv6 s PRO 143 CO 0.32 -0.48 1.99 -0.39 -0.33 0.00 0.00 177.00 178.11 3fv6 h VAL 144 N 2.91 0.32 0.00 3.83 -1.51 -0.72 -1.65 116.25 119.43 3fv6 h VAL 144 Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 3fv6 h VAL 144 Cb 1.24 0.72 0.00 0.00 -2.13 0.00 0.00 31.29 31.12 3fv6 h VAL 144 CO 0.64 0.00 0.00 1.12 -1.23 0.00 0.00 177.57 178.10 3fv6 h HIS 145 N 0.00 0.00 -0.71 5.19 2.07 -1.67 0.11 115.15 120.13 3fv6 h HIS 145 Ca 0.12 0.00 0.04 0.00 -2.85 0.00 0.00 60.37 57.67 3fv6 h HIS 145 Cb 0.79 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.72 3fv6 h HIS 145 CO 0.00 0.00 0.44 0.82 -3.07 0.00 0.00 177.93 176.12 3fv6 h ILE 146 N 0.00 1.07 0.00 6.12 1.08 -1.60 -3.35 117.51 120.84 3fv6 h ILE 146 Ca 0.00 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.18 3fv6 h ILE 146 Cb 0.35 0.16 0.00 0.00 -3.07 0.00 0.00 36.82 34.26 3fv6 h ILE 146 CO 0.00 0.15 -1.20 2.30 -0.69 0.00 0.00 178.15 178.71 3fv6 n ILE 147 N -4.68 0.00 -1.81 -0.67 -5.35 -0.55 -5.03 119.36 101.27 3fv6 n ILE 147 Ca 0.08 -0.26 -0.35 0.00 -0.27 0.00 0.00 62.75 61.95 3fv6 n ILE 147 Cb 0.11 0.51 0.05 0.00 -1.74 0.00 0.00 39.64 38.57 3fv6 n ILE 147 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3fv6 s MET 148 N -2.62 2.69 0.14 6.28 0.23 0.26 -4.97 119.30 121.31 3fv6 s MET 148 Ca -0.01 1.78 -0.31 0.00 -1.03 0.00 0.00 55.69 56.11 3fv6 s MET 148 Cb 0.09 -1.90 -0.09 0.00 -1.53 0.00 0.00 34.83 31.40 3fv6 s MET 148 CO 0.53 -1.41 1.45 0.99 -2.03 0.00 0.00 175.02 174.54 3fv6 s THR 149 N -1.77 3.06 0.48 3.16 2.01 -0.71 -4.89 115.64 116.99 3fv6 s THR 149 Ca 0.76 0.77 0.03 0.00 0.31 0.00 0.00 61.69 63.55 3fv6 s THR 149 Cb -0.29 -3.49 0.02 0.00 0.01 0.00 0.00 72.50 68.74 3fv6 s THR 149 CO 0.38 0.06 0.69 -0.13 -0.69 0.00 0.00 174.62 174.93 3fv6 s ARG 150 N 1.03 2.77 0.36 4.92 0.52 -1.26 -1.75 118.95 125.54 3fv6 s ARG 150 Ca 0.66 -0.80 0.07 0.00 -0.52 0.00 0.00 55.73 55.13 3fv6 s ARG 150 Cb -0.39 -2.58 0.76 0.00 0.52 0.00 0.00 34.95 33.26 3fv6 s ARG 150 CO 0.31 -0.46 1.92 1.98 0.02 0.00 0.00 175.30 179.07 3fv6 h MET 151 N 0.32 0.73 -0.49 3.54 4.05 -1.94 -0.54 114.93 120.59 3fv6 h MET 151 Ca -0.43 -0.04 0.14 0.00 -0.28 0.00 0.00 59.70 59.09 3fv6 h MET 151 Cb 1.28 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 31.90 3fv6 h MET 151 CO 0.52 0.48 0.45 -1.35 0.23 0.00 0.00 176.91 177.25 3fv6 h PRO 152 N 0.75 0.00 -0.26 0.39 0.11 -1.95 -0.44 132.00 130.60 3fv6 h PRO 152 Ca 0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.48 3fv6 h PRO 152 Cb 0.43 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.54 3fv6 h PRO 152 CO -0.14 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.74 3fv6 n ASN 153 N -3.92 3.66 -4.54 -2.05 3.02 -0.22 -4.99 115.26 106.22 3fv6 n ASN 153 Ca 0.09 -2.84 -0.34 0.00 -0.03 0.00 0.00 54.58 51.47 3fv6 n ASN 153 Cb 0.66 -0.48 -0.12 0.00 -0.61 0.00 0.00 39.78 39.23 3fv6 n ASN 153 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3fv6 s ILE 154 N -2.50 3.53 -0.19 2.41 1.01 -0.18 -4.87 121.20 120.42 3fv6 s ILE 154 Ca 0.38 -0.53 -0.05 0.00 0.00 0.00 0.00 60.65 60.45 3fv6 s ILE 154 Cb 0.30 -2.44 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 3fv6 s ILE 154 CO 0.10 0.58 -0.01 -0.89 0.00 0.00 0.00 174.94 174.71 3fv6 s THR 155 N -0.60 3.91 0.46 2.92 2.01 -1.26 -4.99 115.64 118.09 3fv6 s THR 155 Ca 0.09 -0.34 0.06 0.00 0.31 0.00 0.00 61.69 61.82 3fv6 s THR 155 Cb -0.12 -2.75 -0.02 0.00 0.01 0.00 0.00 72.50 69.63 3fv6 s THR 155 CO 0.02 0.45 0.28 0.68 -0.69 0.00 0.00 174.62 175.36 3fv6 s VAL 156 N 0.80 2.12 0.26 3.82 -7.23 -1.26 -4.41 120.40 114.49 3fv6 s VAL 156 Ca -0.00 -1.57 0.01 0.00 -1.81 0.00 0.00 61.98 58.61 3fv6 s VAL 156 Cb -0.14 -2.69 -0.03 0.00 0.56 0.00 0.00 36.38 34.08 3fv6 s VAL 156 CO 0.02 0.00 0.23 0.00 -0.31 0.00 0.00 175.10 175.04 3fv6 s ARG 158 N -3.83 1.36 0.34 0.00 0.52 -1.26 -1.35 118.95 114.73 3fv6 s ARG 158 Ca 0.38 -1.49 0.14 0.00 -0.52 0.00 0.00 55.73 54.24 3fv6 s ARG 158 Cb 0.04 -1.42 1.11 0.00 0.52 0.00 0.00 34.95 35.21 3fv6 s ARG 158 CO 0.18 0.28 1.63 0.00 0.02 0.00 0.00 175.30 177.41 3fv6 h ARG 159 N 3.04 0.19 -0.00 3.54 3.08 -1.95 -2.21 114.38 120.07 3fv6 h ARG 159 Ca -0.42 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.62 3fv6 h ARG 159 Cb 1.21 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.22 3fv6 h ARG 159 CO 0.53 0.12 -0.10 0.39 -1.07 0.00 0.00 179.97 179.85 3fv6 n GLU 160 N -5.16 0.83 -1.74 0.04 4.71 -1.26 -0.03 120.64 118.02 3fv6 n GLU 160 Ca 0.32 -0.30 -0.30 0.00 -0.01 0.00 0.00 57.16 56.87 3fv6 n GLU 160 Cb 1.03 -1.49 0.07 0.00 -1.01 0.00 0.00 31.44 30.04 3fv6 n GLU 160 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3fv6 s ASP 161 N -2.38 4.90 0.02 1.62 -0.00 -0.83 -4.79 116.67 115.20 3fv6 s ASP 161 Ca 0.31 1.16 -0.20 0.00 -0.00 0.00 0.00 52.55 53.82 3fv6 s ASP 161 Cb 0.20 -1.89 -0.06 0.00 -0.00 0.00 0.00 42.92 41.18 3fv6 s ASP 161 CO 0.45 -1.70 0.59 -0.31 -0.00 0.00 0.00 175.17 174.21 3fv6 s TYR 162 N -3.30 3.72 0.22 4.23 2.02 -1.26 -1.32 117.35 121.65 3fv6 s TYR 162 Ca 0.60 1.22 -0.08 0.00 -0.37 0.00 0.00 57.07 58.43 3fv6 s TYR 162 Cb -0.12 -2.58 0.23 0.00 -0.40 0.00 0.00 41.96 39.08 3fv6 s TYR 162 CO 0.52 0.41 1.86 0.28 -1.57 0.00 0.00 175.55 177.06 3fv6 h VAL 163 N 3.97 1.11 -0.42 0.71 2.07 -1.46 -1.69 116.25 120.55 3fv6 h VAL 163 Ca -0.46 -0.33 -0.05 0.00 0.82 0.00 0.00 66.70 66.68 3fv6 h VAL 163 Cb 1.20 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3fv6 h VAL 163 CO 0.68 0.17 0.04 0.24 0.02 0.00 0.00 177.57 178.72 3fv6 h MET 164 N 0.95 0.65 -0.66 1.57 2.86 -1.80 0.69 114.93 119.19 3fv6 h MET 164 Ca 0.31 -0.14 -0.06 0.00 -2.06 0.00 0.00 59.70 57.75 3fv6 h MET 164 Cb 0.03 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 3fv6 h MET 164 CO -0.12 0.64 0.18 -0.44 1.06 0.00 0.00 176.91 178.23 3fv6 h ASP 165 N 0.62 1.00 -0.53 1.22 3.32 -1.72 -2.12 116.42 118.21 3fv6 h ASP 165 Ca 0.13 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 56.93 3fv6 h ASP 165 Cb 0.33 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 3fv6 h ASP 165 CO 0.01 0.96 0.22 0.40 -1.72 0.00 0.00 179.24 179.11 3fv6 h ILE 166 N 0.98 1.21 -0.63 0.35 5.03 -0.93 -2.31 117.51 121.21 3fv6 h ILE 166 Ca 0.21 -0.65 0.08 0.00 -0.12 0.00 0.00 64.86 64.38 3fv6 h ILE 166 Cb 0.34 0.65 -0.07 0.00 -3.03 0.00 0.00 36.82 34.72 3fv6 h ILE 166 CO -0.00 0.25 0.28 0.00 -0.68 0.00 0.00 178.15 178.00 3fv6 h ALA 167 N 1.07 0.83 -0.76 1.87 0.00 -0.81 0.46 119.26 121.92 3fv6 h ALA 167 Ca 0.18 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.18 3fv6 h ALA 167 Cb 0.18 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 3fv6 h ALA 167 CO -0.02 -0.11 0.48 0.87 0.00 0.00 0.00 179.25 180.48 3fv6 h LYS 168 N 0.51 0.91 -0.22 0.00 1.57 -1.20 -1.68 116.57 116.46 3fv6 h LYS 168 Ca 0.30 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.02 3fv6 h LYS 168 Cb 0.31 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 3fv6 h LYS 168 CO -0.26 0.60 0.11 0.45 -0.57 0.00 0.00 179.45 179.79 3fv6 h HIS 169 N 0.94 0.31 -0.61 -1.35 3.86 -0.80 -0.19 115.15 117.31 3fv6 h HIS 169 Ca 0.30 -0.01 0.12 0.00 -1.16 0.00 0.00 60.37 59.62 3fv6 h HIS 169 Cb 0.01 -0.10 -0.09 0.00 1.06 0.00 0.00 27.41 28.29 3fv6 h HIS 169 CO -0.03 0.29 0.10 -0.07 0.86 0.00 0.00 177.93 179.07 3fv6 h LEU 170 N 0.24 -0.07 -0.05 2.43 3.38 -0.39 0.57 115.31 121.42 3fv6 h LEU 170 Ca 0.08 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 3fv6 h LEU 170 Cb 0.09 0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 3fv6 h LEU 170 CO -0.01 -0.03 -0.06 0.40 0.09 0.00 0.00 178.44 178.83 3fv6 h ILE 171 N 0.22 1.40 -0.69 1.22 2.04 -1.12 -0.62 117.51 119.96 3fv6 h ILE 171 Ca 0.32 -1.29 -0.03 0.00 1.00 0.00 0.00 64.86 64.87 3fv6 h ILE 171 Cb 0.50 2.15 -0.03 0.00 -0.74 0.00 0.00 36.82 38.70 3fv6 h ILE 171 CO -0.44 0.35 0.32 -0.33 0.00 0.00 0.00 178.15 178.05 3fv6 h GLU 172 N -0.35 1.00 -0.01 2.37 5.08 -0.80 -2.95 114.58 118.91 3fv6 h GLU 172 Ca 0.01 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 3fv6 h GLU 172 Cb 0.60 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3fv6 h GLU 172 CO 0.01 0.80 -0.18 1.63 -1.00 0.00 0.00 179.01 180.27 3fv6 n LYS 173 N -4.43 0.85 -3.69 2.33 4.01 0.17 -4.96 118.16 112.44 3fv6 n LYS 173 Ca 0.05 -0.43 -0.22 0.00 -0.51 0.00 0.00 58.31 57.21 3fv6 n LYS 173 Cb 0.14 -1.49 0.04 0.00 -0.51 0.00 0.00 35.03 33.21 3fv6 n LYS 173 CO 0.00 0.00 0.00 1.04 -1.11 0.00 0.00 177.40 177.33 3fv6 n GLN 174 N -0.70 -5.35 -4.15 1.97 6.02 -0.28 -4.99 117.38 109.90 3fv6 n GLN 174 Ca 0.14 0.66 -0.14 0.00 -0.01 0.00 0.00 57.00 57.64 3fv6 n GLN 174 Cb 0.32 -5.34 -0.11 0.00 1.02 0.00 0.00 30.24 26.13 3fv6 n GLN 174 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 3fv6 s ILE 175 N -3.57 0.86 -0.26 5.09 -4.36 -0.97 -5.06 121.20 112.94 3fv6 s ILE 175 Ca 0.12 -1.50 0.20 0.00 -0.26 0.00 0.00 60.65 59.21 3fv6 s ILE 175 Cb -0.06 -1.19 0.10 0.00 1.25 0.00 0.00 42.46 42.57 3fv6 s ILE 175 CO 0.80 -0.50 1.29 0.44 0.24 0.00 0.00 174.94 177.21 3fv6 h ASP 176 N 3.81 0.00 -4.99 4.36 3.32 -1.94 -3.43 116.42 117.55 3fv6 h ASP 176 Ca -0.37 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 56.58 3fv6 h ASP 176 Cb 1.19 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.54 3fv6 h ASP 176 CO 0.49 0.22 -0.11 0.00 -1.72 0.00 0.00 179.24 178.12 3fv6 s ALA 177 N -3.14 -1.13 0.08 3.45 0.00 -1.26 -0.94 121.76 118.81 3fv6 s ALA 177 Ca 0.03 0.68 0.08 0.00 0.00 0.00 0.00 51.96 52.74 3fv6 s ALA 177 Cb 0.07 0.05 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 3fv6 s ALA 177 CO 0.74 -0.30 -0.20 -0.51 0.00 0.00 0.00 175.76 175.49 3fv6 s LEU 178 N -1.28 2.24 0.28 0.00 1.43 -0.54 -5.00 118.68 115.82 3fv6 s LEU 178 Ca -0.13 -0.61 -0.24 0.00 -1.03 0.00 0.00 54.13 52.12 3fv6 s LEU 178 Cb -0.03 -0.90 -0.09 0.00 0.03 0.00 0.00 46.19 45.20 3fv6 s LEU 178 CO 0.06 0.09 0.87 -2.16 0.23 0.00 0.00 176.35 175.44 3fv6 s PRO 179 N -1.59 4.51 -0.17 1.29 0.04 -1.26 -2.01 135.00 135.80 3fv6 s PRO 179 Ca 0.06 1.20 -0.15 0.00 0.04 0.00 0.00 61.00 62.16 3fv6 s PRO 179 Cb -0.09 -2.89 -0.04 0.00 0.04 0.00 0.00 34.50 31.51 3fv6 s PRO 179 CO 0.03 0.35 0.33 0.08 0.04 0.00 0.00 177.00 177.83 3fv6 s VAL 180 N -1.53 5.27 0.32 -0.36 1.01 -0.29 -1.37 120.40 123.46 3fv6 s VAL 180 Ca 0.46 0.61 0.04 0.00 0.00 0.00 0.00 61.98 63.10 3fv6 s VAL 180 Cb -0.19 -3.67 -0.06 0.00 0.00 0.00 0.00 36.38 32.46 3fv6 s VAL 180 CO 0.24 0.34 0.04 0.27 0.00 0.00 0.00 175.10 175.99 3fv6 s ILE 181 N 0.73 1.27 -0.06 2.22 -5.25 -0.46 -0.42 121.20 119.22 3fv6 s ILE 181 Ca 0.18 -2.02 0.05 0.00 -0.99 0.00 0.00 60.65 57.87 3fv6 s ILE 181 Cb -0.14 -2.74 -0.00 0.00 2.95 0.00 0.00 42.46 42.53 3fv6 s ILE 181 CO 0.06 -0.05 -0.21 -0.75 -1.79 0.00 0.00 174.94 172.19 3fv6 s LYS 182 N -3.86 2.34 0.09 0.37 2.20 -0.42 -4.33 119.74 116.12 3fv6 s LYS 182 Ca 0.35 -0.76 -0.30 0.00 -0.36 0.00 0.00 55.97 54.90 3fv6 s LYS 182 Cb 0.08 -1.93 -0.06 0.00 -1.51 0.00 0.00 37.83 34.41 3fv6 s LYS 182 CO 0.15 0.27 1.13 -0.51 -0.36 0.00 0.00 175.35 176.03 3fv6 s ASP 183 N 0.08 7.19 0.20 1.43 1.01 -1.26 -1.47 116.67 123.84 3fv6 s ASP 183 Ca -0.08 1.99 0.01 0.00 0.71 0.00 0.00 52.55 55.18 3fv6 s ASP 183 Cb -0.14 -2.59 -0.05 0.00 1.01 0.00 0.00 42.92 41.16 3fv6 s ASP 183 CO 0.04 -0.35 0.05 0.42 0.21 0.00 0.00 175.17 175.54 3fv6 s THR 184 N 0.61 0.51 0.62 -1.27 -4.23 -0.96 -4.95 115.64 105.98 3fv6 s THR 184 Ca 0.55 -1.98 0.32 0.00 -1.18 0.00 0.00 61.69 59.40 3fv6 s THR 184 Cb -0.28 -2.33 0.36 0.00 1.34 0.00 0.00 72.50 71.59 3fv6 s THR 184 CO 0.31 -0.26 2.10 -0.78 -0.54 0.00 0.00 174.62 175.45 3fv6 h ASP 185 N 2.59 0.00 0.16 3.99 1.82 -2.03 -2.07 116.42 120.88 3fv6 h ASP 185 Ca -0.37 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.27 3fv6 h ASP 185 Cb 1.22 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.23 3fv6 h ASP 185 CO 0.61 0.00 -0.55 0.29 -1.61 0.00 0.00 179.24 177.98 3fv6 n LYS 186 N -3.42 0.57 0.00 0.28 5.02 -1.26 -5.08 118.16 114.27 3fv6 n LYS 186 Ca 0.00 -0.42 0.00 0.00 -2.02 0.00 0.00 58.31 55.87 3fv6 n LYS 186 Cb 0.31 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 3fv6 n LYS 186 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fv6 n GLY 187 N 1.43 0.42 3.66 0.72 0.00 -0.78 -4.96 105.19 105.68 3fv6 n GLY 187 Ca 0.08 -2.21 -0.42 0.00 0.00 0.00 0.00 46.02 43.46 3fv6 n GLY 187 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fv6 s PHE 188 N -0.49 3.37 -0.03 1.61 0.08 -1.26 -2.27 117.98 118.99 3fv6 s PHE 188 Ca 0.00 1.35 -0.16 0.00 0.12 0.00 0.00 56.93 58.23 3fv6 s PHE 188 Cb 0.00 -3.14 -0.05 0.00 -0.57 0.00 0.00 43.02 39.25 3fv6 s PHE 188 CO 0.00 -0.38 0.45 -2.00 -0.10 0.00 0.00 175.22 173.19 3fv6 s GLU 189 N 2.73 4.09 -0.16 0.44 2.12 -0.54 -0.71 118.70 126.67 3fv6 s GLU 189 Ca 0.41 0.46 -0.23 0.00 0.36 0.00 0.00 54.97 55.97 3fv6 s GLU 189 Cb -0.16 -3.29 -0.02 0.00 0.26 0.00 0.00 34.13 30.92 3fv6 s GLU 189 CO 0.09 0.52 0.73 0.08 -0.54 0.00 0.00 175.26 176.14 3fv6 s VAL 190 N -0.55 4.96 0.00 3.70 1.01 -1.26 -1.30 120.40 126.96 3fv6 s VAL 190 Ca 0.25 1.43 0.00 0.00 0.00 0.00 0.00 61.98 63.66 3fv6 s VAL 190 Cb -0.17 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.17 3fv6 s VAL 190 CO 0.13 0.10 0.29 2.30 0.00 0.00 0.00 175.10 177.92 3fv6 n ILE 191 N 4.54 0.00 -3.95 2.22 -5.35 0.43 -4.97 119.36 112.28 3fv6 n ILE 191 Ca 0.01 -0.38 0.01 0.00 -0.27 0.00 0.00 62.75 62.12 3fv6 n ILE 191 Cb 0.50 1.19 0.01 0.00 -1.74 0.00 0.00 39.64 39.60 3fv6 n ILE 191 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3fv6 s GLY 192 N -0.16 -0.04 0.01 3.28 0.00 -0.94 -4.63 107.32 104.83 3fv6 s GLY 192 Ca 0.00 -0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.64 3fv6 s GLY 192 CO 0.00 4.60 -0.03 1.09 0.00 0.00 0.00 173.10 178.76 3fv6 s ARG 193 N -2.06 0.26 -0.06 2.90 1.70 -0.06 -1.13 118.95 120.50 3fv6 s ARG 193 Ca 0.27 -0.23 0.04 0.00 -0.47 0.00 0.00 55.73 55.34 3fv6 s ARG 193 Cb -0.01 -0.18 0.00 0.00 -0.57 0.00 0.00 34.95 34.18 3fv6 s ARG 193 CO 0.01 0.04 -0.19 0.54 -1.08 0.00 0.00 175.30 174.63 3fv6 s VAL 194 N -0.37 1.58 0.27 4.99 0.11 -0.85 0.51 120.40 126.63 3fv6 s VAL 194 Ca -0.02 -0.77 0.01 0.00 -2.93 0.00 0.00 61.98 58.27 3fv6 s VAL 194 Cb -0.03 -1.37 -0.05 0.00 -1.53 0.00 0.00 36.38 33.40 3fv6 s VAL 194 CO -0.00 0.45 0.11 0.42 -3.33 0.00 0.00 175.10 172.75 3fv6 s THR 195 N 0.21 0.49 0.46 5.04 -4.23 -1.26 -1.46 115.64 114.90 3fv6 s THR 195 Ca -0.09 -2.00 0.12 0.00 -1.18 0.00 0.00 61.69 58.54 3fv6 s THR 195 Cb -0.14 -2.61 0.24 0.00 1.34 0.00 0.00 72.50 71.33 3fv6 s THR 195 CO 0.04 0.00 2.07 0.11 -0.54 0.00 0.00 174.62 176.30 3fv6 h LYS 196 N 2.36 0.18 -0.33 3.99 1.57 -1.37 -1.90 116.57 121.07 3fv6 h LYS 196 Ca -0.37 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.38 3fv6 h LYS 196 Cb 1.25 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 33.51 3fv6 h LYS 196 CO 0.59 0.18 0.18 1.15 -0.57 0.00 0.00 179.45 180.97 3fv6 h THR 197 N 0.18 1.14 -0.65 -0.16 2.02 -1.96 0.99 112.91 114.48 3fv6 h THR 197 Ca 0.05 -0.38 0.11 0.00 0.77 0.00 0.00 66.41 66.95 3fv6 h THR 197 Cb 0.08 0.79 -0.08 0.00 -1.74 0.00 0.00 68.15 67.20 3fv6 h THR 197 CO -0.00 0.15 0.22 0.78 0.37 0.00 0.00 175.52 177.04 3fv6 h ASN 198 N 0.41 0.18 -0.32 4.18 2.35 -1.74 -0.61 115.58 120.03 3fv6 h ASN 198 Ca 0.12 0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.92 3fv6 h ASN 198 Cb 0.08 0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 3fv6 h ASN 198 CO -0.02 0.09 0.04 0.24 -1.65 0.00 0.00 177.43 176.14 3fv6 h MET 199 N 0.38 0.54 -0.78 0.81 2.86 -1.08 -2.00 114.93 115.66 3fv6 h MET 199 Ca 0.34 -0.15 0.09 0.00 -2.06 0.00 0.00 59.70 57.92 3fv6 h MET 199 Cb 0.47 -0.06 -0.07 0.00 0.06 0.00 0.00 31.60 31.99 3fv6 h MET 199 CO -0.36 0.64 0.43 1.15 1.06 0.00 0.00 176.91 179.83 3fv6 h THR 200 N 0.36 0.88 -0.95 2.22 2.02 -0.29 -1.67 112.91 115.49 3fv6 h THR 200 Ca 0.10 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 67.05 3fv6 h THR 200 Cb 0.37 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.84 3fv6 h THR 200 CO 0.01 0.13 0.63 0.11 0.37 0.00 0.00 175.52 176.77 3fv6 h LYS 201 N 0.71 1.23 -0.50 6.66 1.57 -0.86 -1.97 116.57 123.41 3fv6 h LYS 201 Ca 0.38 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 59.06 3fv6 h LYS 201 Cb 0.37 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 3fv6 h LYS 201 CO -0.26 0.81 0.21 0.82 -0.57 0.00 0.00 179.45 180.47 3fv6 h ILE 202 N 1.26 1.21 -0.25 1.86 2.04 -0.61 -1.87 117.51 121.14 3fv6 h ILE 202 Ca 0.36 -0.63 0.03 0.00 1.00 0.00 0.00 64.86 65.62 3fv6 h ILE 202 Cb -0.10 0.69 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 3fv6 h ILE 202 CO -0.09 0.24 0.09 0.25 0.00 0.00 0.00 178.15 178.64 3fv6 h LEU 203 N 0.67 0.09 -0.52 1.44 6.46 -0.97 -2.11 115.31 120.37 3fv6 h LEU 203 Ca 0.17 0.03 0.03 0.00 -0.12 0.00 0.00 57.88 57.98 3fv6 h LEU 203 Cb 0.17 0.02 -0.04 0.00 -0.73 0.00 0.00 40.66 40.08 3fv6 h LEU 203 CO -0.02 0.09 0.31 0.58 -0.62 0.00 0.00 178.44 178.78 3fv6 h VAL 204 N 0.20 1.05 -0.91 1.05 2.07 -1.21 -2.87 116.25 115.62 3fv6 h VAL 204 Ca 0.11 -0.21 0.08 0.00 0.82 0.00 0.00 66.70 67.50 3fv6 h VAL 204 Cb 0.08 0.38 -0.06 0.00 -1.52 0.00 0.00 31.29 30.17 3fv6 h VAL 204 CO -0.12 0.11 0.59 0.77 0.02 0.00 0.00 177.57 178.95 3fv6 h SER 205 N 0.61 0.88 -1.06 0.57 4.64 -0.83 -0.31 113.55 118.05 3fv6 h SER 205 Ca 0.21 0.01 0.30 0.00 -0.47 0.00 0.00 61.79 61.84 3fv6 h SER 205 Cb 0.03 -0.17 -0.06 0.00 -0.31 0.00 0.00 62.40 61.89 3fv6 h SER 205 CO -0.10 0.55 0.74 -0.07 -0.87 0.00 0.00 176.83 177.08 3fv6 h LEU 206 N 0.99 0.14 -3.53 5.97 3.38 -1.16 -1.81 115.31 119.28 3fv6 h LEU 206 Ca 0.40 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.34 3fv6 h LEU 206 Cb 0.27 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 3fv6 h LEU 206 CO -0.16 0.03 0.07 -1.54 0.09 0.00 0.00 178.44 176.92 3fv6 n SER 207 N -4.34 4.95 -4.07 -0.43 3.41 -0.13 -4.26 113.62 108.76 3fv6 n SER 207 Ca 0.23 -3.06 -0.09 0.00 -0.26 0.00 0.00 58.87 55.69 3fv6 n SER 207 Cb 1.06 -0.67 -0.10 0.00 -0.26 0.00 0.00 64.21 64.24 3fv6 n SER 207 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 3fv6 s GLU 208 N -2.87 0.55 0.00 4.33 1.03 -1.17 -5.13 118.70 115.45 3fv6 s GLU 208 Ca 0.51 -1.01 0.20 0.00 0.03 0.00 0.00 54.97 54.70 3fv6 s GLU 208 Cb 0.41 0.06 1.17 0.00 -0.80 0.00 0.00 34.13 34.96 3fv6 s GLU 208 CO 0.13 -0.06 1.56 0.27 -1.33 0.00 0.00 175.26 175.83