#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bv4 s TYR 116 N 0.00 2.36 0.13 2.13 1.13 -0.90 -4.95 117.35 117.26 1bv4 s TYR 116 Ca 0.00 -0.34 0.11 0.00 -1.41 0.00 0.00 57.07 55.42 1bv4 s TYR 116 Cb 0.00 -1.20 -0.04 0.00 -1.10 0.00 0.00 41.96 39.62 1bv4 s TYR 116 CO 0.00 0.45 -0.25 -0.06 -2.51 0.00 0.00 175.55 173.18 1bv4 s PHE 117 N -1.47 2.35 -0.04 -3.49 0.08 -1.26 -0.73 117.98 113.42 1bv4 s PHE 117 Ca 0.19 -0.36 -0.05 0.00 0.12 0.00 0.00 56.93 56.84 1bv4 s PHE 117 Cb -0.09 -1.26 0.01 0.00 -0.57 0.00 0.00 43.02 41.12 1bv4 s PHE 117 CO 0.09 0.37 0.13 -1.64 -0.10 0.00 0.00 175.22 174.08 1bv4 s MET 118 N -2.15 0.21 0.25 0.44 -1.94 -0.70 -4.98 119.30 110.44 1bv4 s MET 118 Ca 0.15 0.10 0.09 0.00 -1.71 0.00 0.00 55.69 54.32 1bv4 s MET 118 Cb -0.10 0.10 -0.04 0.00 2.01 0.00 0.00 34.83 36.80 1bv4 s MET 118 CO 0.07 -0.03 0.03 -1.54 -0.01 0.00 0.00 175.02 173.54 1bv4 s SER 119 N -0.15 4.75 0.64 3.03 1.04 -1.26 -0.15 113.70 121.59 1bv4 s SER 119 Ca -0.02 -0.55 -0.06 0.00 0.48 0.00 0.00 55.95 55.80 1bv4 s SER 119 Cb -0.02 -0.97 0.03 0.00 0.10 0.00 0.00 66.02 65.16 1bv4 s SER 119 CO 0.00 0.00 0.95 -0.94 0.98 0.00 0.00 173.24 174.24 1bv4 s SER 120 N -3.64 5.28 -0.02 7.02 1.04 0.54 -4.98 113.70 118.94 1bv4 s SER 120 Ca 0.31 0.61 0.18 0.00 0.48 0.00 0.00 55.95 57.53 1bv4 s SER 120 Cb -0.07 -1.46 -0.20 0.00 0.10 0.00 0.00 66.02 64.39 1bv4 s SER 120 CO 0.21 -1.28 0.59 0.52 0.98 0.00 0.00 173.24 174.25 1bv4 n VAL 121 N -2.73 1.08 -4.45 5.02 0.31 -1.26 -4.70 118.33 111.61 1bv4 n VAL 121 Ca 0.06 -0.71 -0.22 0.00 -0.01 0.00 0.00 64.34 63.46 1bv4 n VAL 121 Cb 0.59 -0.58 -0.10 0.00 -0.91 0.00 0.00 33.84 32.84 1bv4 n VAL 121 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bv4 s ARG 122 N -2.90 1.59 0.33 5.55 1.70 -1.26 -5.07 118.95 118.89 1bv4 s ARG 122 Ca -0.05 -1.78 -0.14 0.00 -0.47 0.00 0.00 55.73 53.29 1bv4 s ARG 122 Cb 0.09 -1.37 -0.08 0.00 -0.57 0.00 0.00 34.95 33.02 1bv4 s ARG 122 CO 0.83 0.13 0.73 1.03 -1.08 0.00 0.00 175.30 176.94 1bv4 s ARG 123 N -3.65 3.94 0.14 3.89 0.52 -1.26 -4.40 118.95 118.13 1bv4 s ARG 123 Ca 0.29 0.60 -0.24 0.00 -0.52 0.00 0.00 55.73 55.86 1bv4 s ARG 123 Cb 0.01 -2.44 0.07 0.00 0.52 0.00 0.00 34.95 33.12 1bv4 s ARG 123 CO 0.12 0.13 0.65 0.00 0.02 0.00 0.00 175.30 176.22 1bv4 s MET 124 N -3.15 1.24 0.92 3.54 0.23 -0.41 -4.75 119.30 116.92 1bv4 s MET 124 Ca 0.53 -0.48 -0.12 0.00 -1.03 0.00 0.00 55.69 54.60 1bv4 s MET 124 Cb -0.10 0.56 0.14 0.00 -1.53 0.00 0.00 34.83 33.90 1bv4 s MET 124 CO 0.20 -0.55 1.09 -2.14 -2.03 0.00 0.00 175.02 171.60 1bv4 s PRO 125 N -3.67 1.09 0.23 3.16 0.02 -1.25 -2.48 135.00 132.10 1bv4 s PRO 125 Ca 0.02 0.86 -0.07 0.00 0.02 0.00 0.00 61.00 61.83 1bv4 s PRO 125 Cb -0.01 -1.79 0.32 0.00 0.02 0.00 0.00 34.50 33.04 1bv4 s PRO 125 CO -0.11 -2.37 1.81 1.25 -0.33 0.00 0.00 177.00 177.25 1bv4 h LEU 126 N -1.64 0.63 -0.72 -5.54 5.85 -1.60 -2.20 115.31 110.08 1bv4 h LEU 126 Ca -0.50 0.04 0.12 0.00 0.84 0.00 0.00 57.88 58.38 1bv4 h LEU 126 Cb 1.29 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 42.15 1bv4 h LEU 126 CO 0.54 0.39 0.31 0.78 -0.34 0.00 0.00 178.44 180.12 1bv4 h ASN 127 N 0.76 0.34 0.36 1.25 -0.26 -1.92 -0.02 115.58 116.10 1bv4 h ASN 127 Ca 0.35 0.09 -0.17 0.00 -0.56 0.00 0.00 56.30 56.01 1bv4 h ASN 127 Cb 0.26 0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.56 1bv4 h ASN 127 CO -0.21 0.17 -0.69 0.03 -1.06 0.00 0.00 177.43 175.67 1bv4 h ARG 128 N 0.50 0.29 -0.58 0.81 3.08 -1.82 -3.05 114.38 113.61 1bv4 h ARG 128 Ca 0.38 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 60.13 1bv4 h ARG 128 Cb 0.51 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.58 1bv4 h ARG 128 CO -0.34 0.87 0.09 0.00 -1.07 0.00 0.00 179.97 179.51 1bv4 h ALA 129 N 1.07 0.77 -0.65 0.04 0.00 -0.68 -0.96 119.26 118.86 1bv4 h ALA 129 Ca -0.02 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.65 1bv4 h ALA 129 Cb 1.23 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1bv4 h ALA 129 CO 0.11 0.53 0.42 0.87 0.00 0.00 0.00 179.25 181.17 1bv4 h LYS 130 N 0.86 0.81 -0.58 0.00 1.57 -1.04 -1.45 116.57 116.75 1bv4 h LYS 130 Ca 0.17 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.84 1bv4 h LYS 130 Cb 0.43 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1bv4 h LYS 130 CO 0.01 0.54 0.12 0.00 -0.57 0.00 0.00 179.45 179.55 1bv4 h ALA 131 N 1.26 0.77 0.17 3.86 0.00 -1.39 -2.17 119.26 121.75 1bv4 h ALA 131 Ca 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1bv4 h ALA 131 Cb -0.04 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.53 1bv4 h ALA 131 CO -0.08 0.49 -0.10 1.25 0.00 0.00 0.00 179.25 180.82 1bv4 h LEU 132 N 0.85 -0.24 -0.72 0.00 5.85 -0.64 -1.51 115.31 118.90 1bv4 h LEU 132 Ca 0.18 0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 1bv4 h LEU 132 Cb 0.38 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1bv4 h LEU 132 CO 0.01 -0.16 0.13 0.00 -0.34 0.00 0.00 178.44 178.07 1bv4 h SER 134 N 1.04 0.50 -0.74 0.00 4.64 -1.31 0.17 113.55 117.86 1bv4 h SER 134 Ca 0.21 -0.15 0.13 0.00 -0.47 0.00 0.00 61.79 61.50 1bv4 h SER 134 Cb 0.42 -0.14 -0.05 0.00 -0.31 0.00 0.00 62.40 62.32 1bv4 h SER 134 CO 0.01 0.71 0.49 -0.08 -0.87 0.00 0.00 176.83 177.09 1bv4 h GLU 135 N 0.46 0.47 -0.72 4.77 4.57 -1.12 0.23 114.58 123.25 1bv4 h GLU 135 Ca 0.07 -0.03 -0.31 0.00 -1.18 0.00 0.00 59.36 57.91 1bv4 h GLU 135 Cb 0.60 -0.11 -0.19 0.00 -0.16 0.00 0.00 28.75 28.90 1bv4 h GLU 135 CO 0.04 0.31 0.32 1.28 -1.18 0.00 0.00 179.01 179.78 1bv4 n LEU 136 N -4.49 5.73 -2.79 1.64 4.77 -1.07 -4.93 117.00 115.85 1bv4 n LEU 136 Ca 0.13 -3.50 -0.19 0.00 -0.03 0.00 0.00 56.01 52.42 1bv4 n LEU 136 Cb 0.46 -0.74 0.05 0.00 -2.33 0.00 0.00 43.42 40.85 1bv4 n LEU 136 CO 0.33 1.00 0.09 0.00 -1.33 0.00 0.00 177.39 177.48 1bv4 n GLN 137 N -0.81 -5.24 -0.13 3.23 6.02 0.07 -5.00 117.38 115.53 1bv4 n GLN 137 Ca 0.45 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 58.18 1bv4 n GLN 137 Cb 1.39 -5.33 0.00 0.00 1.02 0.00 0.00 30.24 27.31 1bv4 n GLN 137 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1bv4 n GLY 138 N -1.56 6.12 3.46 1.08 0.00 0.57 -4.71 105.19 110.15 1bv4 n GLY 138 Ca -0.05 -1.68 -0.09 0.00 0.00 0.00 0.00 46.02 44.20 1bv4 n GLY 138 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1bv4 s THR 139 N -0.28 0.04 0.23 2.61 -1.32 -0.91 -3.28 115.64 112.72 1bv4 s THR 139 Ca 0.00 -1.06 -0.31 0.00 -1.21 0.00 0.00 61.69 59.11 1bv4 s THR 139 Cb 0.00 -1.73 -0.11 0.00 -1.51 0.00 0.00 72.50 69.15 1bv4 s THR 139 CO 0.00 -0.18 1.62 -0.69 -2.21 0.00 0.00 174.62 173.16 1bv4 s VAL 140 N -3.92 2.25 0.22 5.08 1.01 -1.26 -0.39 120.40 123.39 1bv4 s VAL 140 Ca 0.13 0.19 -0.32 0.00 0.00 0.00 0.00 61.98 61.98 1bv4 s VAL 140 Cb 0.01 -3.12 -0.13 0.00 0.00 0.00 0.00 36.38 33.13 1bv4 s VAL 140 CO -0.01 0.02 1.47 0.00 0.00 0.00 0.00 175.10 176.58 1bv4 n ALA 141 N 3.24 1.27 -3.82 5.51 0.00 0.49 -3.99 120.51 123.20 1bv4 n ALA 141 Ca 0.12 0.42 -0.30 0.00 0.00 0.00 0.00 53.44 53.68 1bv4 n ALA 141 Cb 0.37 -2.31 -0.15 0.00 0.00 0.00 0.00 19.45 17.36 1bv4 n ALA 141 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1bv4 s THR 142 N 0.23 1.17 0.08 0.00 2.01 -1.26 -0.68 115.64 117.19 1bv4 s THR 142 Ca 0.71 -1.35 -0.31 0.00 0.31 0.00 0.00 61.69 61.05 1bv4 s THR 142 Cb -0.65 -1.74 -0.07 0.00 0.01 0.00 0.00 72.50 70.05 1bv4 s THR 142 CO 0.46 -0.45 1.45 -2.84 -0.69 0.00 0.00 174.62 172.55 1bv4 s PRO 143 N 1.50 4.28 0.00 4.92 0.02 -1.26 -4.89 135.00 139.58 1bv4 s PRO 143 Ca 0.04 2.10 0.21 0.00 0.02 0.00 0.00 61.00 63.37 1bv4 s PRO 143 Cb -0.18 -3.39 0.10 0.00 0.02 0.00 0.00 34.50 31.05 1bv4 s PRO 143 CO -0.15 -0.54 1.10 0.54 -0.33 0.00 0.00 177.00 177.62 1bv4 n ARG 144 N 4.62 1.72 -3.74 5.54 5.12 -1.26 -4.82 116.66 123.84 1bv4 n ARG 144 Ca 0.13 -1.42 -0.03 0.00 -1.93 0.00 0.00 57.85 54.61 1bv4 n ARG 144 Cb 0.42 -1.40 -0.01 0.00 -1.16 0.00 0.00 32.46 30.31 1bv4 n ARG 144 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1bv4 s ASN 145 N -1.96 -0.14 0.48 0.55 2.20 -1.26 -4.58 114.94 110.23 1bv4 s ASN 145 Ca 0.21 -0.38 0.13 0.00 -0.94 0.00 0.00 52.86 51.88 1bv4 s ASN 145 Cb 0.17 0.43 1.11 0.00 -2.00 0.00 0.00 41.25 40.96 1bv4 s ASN 145 CO 0.36 -0.81 2.11 0.00 -2.94 0.00 0.00 177.10 175.82 1bv4 h ALA 146 N 2.00 1.88 -0.32 3.54 0.00 -1.98 -1.45 119.26 122.93 1bv4 h ALA 146 Ca -0.25 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1bv4 h ALA 146 Cb 1.22 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1bv4 h ALA 146 CO 0.27 0.11 -0.02 0.93 0.00 0.00 0.00 179.25 180.54 1bv4 h GLU 147 N 0.20 0.58 -0.55 0.00 3.07 -1.99 -0.58 114.58 115.31 1bv4 h GLU 147 Ca 0.05 -0.20 -0.11 0.00 -0.50 0.00 0.00 59.36 58.61 1bv4 h GLU 147 Cb -0.01 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 27.84 1bv4 h GLU 147 CO -0.01 0.73 -0.10 0.93 -1.40 0.00 0.00 179.01 179.16 1bv4 h GLU 148 N 0.38 1.04 -0.40 2.33 5.08 -1.88 -1.39 114.58 119.74 1bv4 h GLU 148 Ca 0.09 -0.38 0.03 0.00 -1.00 0.00 0.00 59.36 58.10 1bv4 h GLU 148 Cb 0.48 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.62 1bv4 h GLU 148 CO 0.02 1.07 0.19 -0.97 -1.00 0.00 0.00 179.01 178.32 1bv4 h ASN 149 N 0.92 0.28 -0.69 1.42 -1.24 -1.08 0.21 115.58 115.40 1bv4 h ASN 149 Ca 0.15 0.02 -0.04 0.00 0.71 0.00 0.00 56.30 57.13 1bv4 h ASN 149 Cb 0.66 -0.03 -0.03 0.00 0.73 0.00 0.00 38.32 39.66 1bv4 h ASN 149 CO 0.05 0.20 0.26 0.03 -1.29 0.00 0.00 177.43 176.68 1bv4 h ARG 150 N 0.39 1.04 -0.61 6.67 3.08 -0.90 -1.74 114.38 122.32 1bv4 h ARG 150 Ca 0.17 -0.20 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 1bv4 h ARG 150 Cb 0.08 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.94 1bv4 h ARG 150 CO -0.12 0.88 0.27 0.00 -1.07 0.00 0.00 179.97 179.92 1bv4 h ALA 151 N 1.12 0.79 -0.38 0.04 0.00 -0.46 -1.15 119.26 119.21 1bv4 h ALA 151 Ca 0.23 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1bv4 h ALA 151 Cb 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1bv4 h ALA 151 CO -0.02 0.38 -0.19 0.82 0.00 0.00 0.00 179.25 180.24 1bv4 h ILE 152 N 0.84 1.27 -0.08 0.00 2.04 -0.48 -2.04 117.51 119.05 1bv4 h ILE 152 Ca 0.21 -1.27 -0.09 0.00 1.00 0.00 0.00 64.86 64.70 1bv4 h ILE 152 Cb 0.16 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 1bv4 h ILE 152 CO -0.02 0.42 -0.38 -0.61 0.00 0.00 0.00 178.15 177.56 1bv4 h GLN 153 N 0.65 0.17 -0.19 2.37 -0.00 -0.99 0.13 115.11 117.23 1bv4 h GLN 153 Ca 0.10 -0.07 -0.14 0.00 -0.00 0.00 0.00 58.65 58.54 1bv4 h GLN 153 Cb 0.68 -0.01 -0.01 0.00 0.00 0.00 0.00 27.48 28.14 1bv4 h GLN 153 CO 0.05 0.53 -0.47 -0.97 0.00 0.00 0.00 178.83 177.97 1bv4 h ASN 154 N 0.14 0.52 -0.01 -0.69 -1.24 -0.66 -2.94 115.58 110.71 1bv4 h ASN 154 Ca 0.01 -0.25 -0.23 0.00 0.71 0.00 0.00 56.30 56.54 1bv4 h ASN 154 Cb 0.74 -0.15 0.02 0.00 0.73 0.00 0.00 38.32 39.66 1bv4 h ASN 154 CO 0.06 0.91 -0.90 0.58 -1.29 0.00 0.00 177.43 176.79 1bv4 h VAL 155 N 0.39 1.32 -2.77 2.57 2.07 -1.11 -3.38 116.25 115.34 1bv4 h VAL 155 Ca 0.02 -2.18 -0.69 0.00 0.82 0.00 0.00 66.70 64.68 1bv4 h VAL 155 Cb 0.97 2.42 -0.18 0.00 -1.52 0.00 0.00 31.29 32.98 1bv4 h VAL 155 CO 0.09 0.66 0.44 0.00 0.02 0.00 0.00 177.57 178.77 1bv4 s ALA 156 N -3.31 3.37 0.11 1.67 0.00 0.41 -4.74 121.76 119.28 1bv4 s ALA 156 Ca -0.11 -2.37 -0.15 0.00 0.00 0.00 0.00 51.96 49.34 1bv4 s ALA 156 Cb 0.06 -3.77 -0.05 0.00 0.00 0.00 0.00 23.12 19.36 1bv4 s ALA 156 CO 0.89 -2.64 1.50 0.87 0.00 0.00 0.00 175.76 176.38 1bv4 h LYS 157 N 9.08 0.71 -6.72 0.00 1.79 -1.76 -3.41 116.57 116.26 1bv4 h LYS 157 Ca -0.13 -0.29 -0.47 0.00 -2.18 0.00 0.00 60.65 57.57 1bv4 h LYS 157 Cb 1.06 -0.03 0.04 0.00 -1.58 0.00 0.00 32.23 31.72 1bv4 h LYS 157 CO 1.10 0.89 -0.08 0.34 -1.08 0.00 0.00 179.45 180.62 1bv4 s ASP 158 N -6.37 5.04 0.23 0.86 2.15 -1.26 -4.76 116.67 112.55 1bv4 s ASP 158 Ca -0.13 -0.62 -0.32 0.00 0.43 0.00 0.00 52.55 51.91 1bv4 s ASP 158 Cb 0.09 -0.00 -0.13 0.00 -0.30 0.00 0.00 42.92 42.58 1bv4 s ASP 158 CO 0.81 -1.34 1.51 0.52 -0.17 0.00 0.00 175.17 176.49 1bv4 n VAL 159 N -2.31 0.64 -3.95 1.11 0.31 -1.26 -4.87 118.33 108.00 1bv4 n VAL 159 Ca 0.14 -0.16 -0.10 0.00 -0.01 0.00 0.00 64.34 64.21 1bv4 n VAL 159 Cb 0.61 -1.61 -0.11 0.00 -0.91 0.00 0.00 33.84 31.82 1bv4 n VAL 159 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1bv4 s ALA 160 N 0.30 -0.00 0.50 3.52 0.00 -1.07 -2.81 121.76 122.19 1bv4 s ALA 160 Ca 0.71 -0.45 -0.21 0.00 0.00 0.00 0.00 51.96 52.01 1bv4 s ALA 160 Cb -0.62 0.13 -0.07 0.00 0.00 0.00 0.00 23.12 22.57 1bv4 s ALA 160 CO 0.45 -0.17 1.14 -0.06 0.00 0.00 0.00 175.76 177.12 1bv4 s PHE 161 N -1.40 2.77 0.33 0.00 0.08 -0.46 0.03 117.98 119.33 1bv4 s PHE 161 Ca -0.15 1.54 0.09 0.00 0.12 0.00 0.00 56.93 58.53 1bv4 s PHE 161 Cb -0.09 -3.32 -0.05 0.00 -0.57 0.00 0.00 43.02 38.98 1bv4 s PHE 161 CO -0.00 -1.52 -0.01 -0.51 -0.10 0.00 0.00 175.22 173.07 1bv4 s LEU 162 N -3.45 2.97 -1.31 -0.37 1.43 0.01 -4.16 118.68 113.79 1bv4 s LEU 162 Ca 0.69 -0.96 -0.09 0.00 -1.03 0.00 0.00 54.13 52.74 1bv4 s LEU 162 Cb -0.26 -1.36 0.14 0.00 0.03 0.00 0.00 46.19 44.74 1bv4 s LEU 162 CO 0.30 -0.19 2.07 0.61 0.23 0.00 0.00 176.35 179.37 1bv4 n GLY 163 N -0.92 4.86 3.02 -3.19 0.00 0.15 -4.56 105.19 104.55 1bv4 n GLY 163 Ca -0.04 -2.04 -0.13 0.00 0.00 0.00 0.00 46.02 43.81 1bv4 n GLY 163 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bv4 s ILE 164 N 0.18 -0.04 0.12 -0.61 1.01 -1.26 -3.10 121.20 117.50 1bv4 s ILE 164 Ca 0.45 0.15 -0.06 0.00 0.00 0.00 0.00 60.65 61.18 1bv4 s ILE 164 Cb 0.13 -0.34 -0.02 0.00 0.01 0.00 0.00 42.46 42.24 1bv4 s ILE 164 CO -0.03 0.06 0.17 0.42 0.00 0.00 0.00 174.94 175.57 1bv4 s THR 165 N 1.16 0.12 -0.30 2.92 -4.23 -0.52 -3.10 115.64 111.68 1bv4 s THR 165 Ca -0.09 -1.46 0.08 0.00 -1.18 0.00 0.00 61.69 59.04 1bv4 s THR 165 Cb -0.10 -1.67 0.46 0.00 1.34 0.00 0.00 72.50 72.52 1bv4 s THR 165 CO -0.07 -0.53 1.32 -0.90 -0.54 0.00 0.00 174.62 173.90 1bv4 n ASP 166 N -0.10 3.90 -0.11 3.99 5.75 -0.64 -1.19 116.55 128.15 1bv4 n ASP 166 Ca -0.10 -3.80 -0.05 0.00 -0.01 0.00 0.00 54.79 50.82 1bv4 n ASP 166 Cb 0.63 -0.49 0.01 0.00 -1.03 0.00 0.00 41.12 40.23 1bv4 n ASP 166 CO 0.00 0.00 0.00 -0.61 -0.11 0.00 0.00 177.20 176.48 1bv4 h GLN 167 N 1.66 -0.00 0.84 0.11 -0.00 -1.83 -3.17 115.11 112.72 1bv4 h GLN 167 Ca 0.27 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.88 1bv4 h GLN 167 Cb 1.36 0.00 0.01 0.00 0.00 0.00 0.00 27.48 28.85 1bv4 h GLN 167 CO 0.57 -0.00 -0.40 -0.09 0.00 0.00 0.00 178.83 178.91 1bv4 h ARG 168 N -0.00 -1.09 -4.44 1.69 2.43 -1.88 -3.42 114.38 107.67 1bv4 h ARG 168 Ca 0.18 0.07 -0.53 0.00 -0.81 0.00 0.00 59.98 58.90 1bv4 h ARG 168 Cb 0.28 0.25 -0.35 0.00 -0.42 0.00 0.00 29.97 29.73 1bv4 h ARG 168 CO -0.39 -0.72 -0.81 0.99 -1.51 0.00 0.00 179.97 177.53 1bv4 s THR 169 N -5.81 1.13 0.24 0.20 2.01 -1.20 -5.10 115.64 107.11 1bv4 s THR 169 Ca -0.18 -0.42 -0.31 0.00 0.31 0.00 0.00 61.69 61.09 1bv4 s THR 169 Cb 0.02 -1.07 -0.13 0.00 0.01 0.00 0.00 72.50 71.33 1bv4 s THR 169 CO 0.58 0.37 1.39 1.21 -0.69 0.00 0.00 174.62 177.48 1bv4 n GLU 170 N 4.29 2.01 -0.85 4.92 2.13 -1.24 -1.74 120.64 130.16 1bv4 n GLU 170 Ca -0.19 0.72 0.00 0.00 0.66 0.00 0.00 57.16 58.35 1bv4 n GLU 170 Cb 0.51 -2.36 0.00 0.00 0.27 0.00 0.00 31.44 29.86 1bv4 n GLU 170 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1bv4 n ASN 171 N 2.08 -1.47 -4.24 4.31 3.02 -1.26 -4.98 115.26 112.72 1bv4 n ASN 171 Ca 0.11 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.29 1bv4 n ASN 171 Cb 0.31 -1.38 -0.13 0.00 -0.61 0.00 0.00 39.78 37.97 1bv4 n ASN 171 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1bv4 s VAL 172 N -2.27 3.53 -0.16 2.41 1.01 -0.71 -4.89 120.40 119.32 1bv4 s VAL 172 Ca 0.00 -1.20 -0.14 0.00 0.00 0.00 0.00 61.98 60.64 1bv4 s VAL 172 Cb 0.00 -3.00 -0.05 0.00 0.00 0.00 0.00 36.38 33.33 1bv4 s VAL 172 CO 0.00 -0.15 0.32 -0.36 0.00 0.00 0.00 175.10 174.91 1bv4 s PHE 173 N 1.36 3.45 0.19 5.22 0.40 -1.26 -4.17 117.98 123.16 1bv4 s PHE 173 Ca -0.03 0.61 0.11 0.00 -0.60 0.00 0.00 56.93 57.03 1bv4 s PHE 173 Cb -0.19 -2.38 -0.04 0.00 0.51 0.00 0.00 43.02 40.91 1bv4 s PHE 173 CO 0.02 0.19 -0.24 -1.21 0.70 0.00 0.00 175.22 174.68 1bv4 s GLU 174 N 0.62 1.53 0.97 0.44 2.02 -0.33 -1.44 118.70 122.50 1bv4 s GLU 174 Ca 0.17 -1.50 -0.16 0.00 0.02 0.00 0.00 54.97 53.50 1bv4 s GLU 174 Cb -0.13 -1.87 0.23 0.00 0.10 0.00 0.00 34.13 32.46 1bv4 s GLU 174 CO 0.05 0.41 1.08 -0.40 0.02 0.00 0.00 175.26 176.41 1bv4 n ASP 175 N 0.31 -0.90 0.00 -0.19 5.68 0.16 -1.44 116.55 120.17 1bv4 n ASP 175 Ca -0.13 -1.27 0.05 0.00 -0.50 0.00 0.00 54.79 52.95 1bv4 n ASP 175 Cb 0.56 -0.90 0.24 0.00 -1.14 0.00 0.00 41.12 39.88 1bv4 n ASP 175 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1bv4 n LEU 176 N 0.00 0.00 -0.72 -2.12 4.77 -1.18 -1.96 117.00 115.79 1bv4 n LEU 176 Ca 0.14 0.43 0.12 0.00 -0.03 0.00 0.00 56.01 56.68 1bv4 n LEU 176 Cb 0.52 -0.43 0.21 0.00 -2.33 0.00 0.00 43.42 41.38 1bv4 n LEU 176 CO 0.37 -0.28 0.64 0.35 -1.33 0.00 0.00 177.39 177.14 1bv4 n THR 177 N -1.43 0.00 -0.17 -5.08 -2.24 -1.26 -4.95 114.28 99.14 1bv4 n THR 177 Ca 0.03 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1bv4 n THR 177 Cb 0.11 1.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 1bv4 n THR 177 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1bv4 n GLY 178 N 1.32 0.70 3.76 3.38 0.00 -0.83 -5.07 105.19 108.45 1bv4 n GLY 178 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 1bv4 n GLY 178 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1bv4 s ASN 179 N -2.65 6.51 0.29 1.61 0.02 -1.26 -4.84 114.94 114.62 1bv4 s ASN 179 Ca 0.00 0.59 -0.30 0.00 -1.02 0.00 0.00 52.86 52.14 1bv4 s ASN 179 Cb 0.00 -2.19 -0.11 0.00 0.02 0.00 0.00 41.25 38.97 1bv4 s ASN 179 CO 0.00 0.16 1.52 -0.60 0.02 0.00 0.00 177.10 178.19 1bv4 s ARG 180 N 0.08 4.18 0.50 -0.60 3.52 -1.26 -0.67 118.95 124.70 1bv4 s ARG 180 Ca 0.18 2.47 -0.21 0.00 -0.13 0.00 0.00 55.73 58.05 1bv4 s ARG 180 Cb -0.14 -3.04 -0.07 0.00 -1.56 0.00 0.00 34.95 30.14 1bv4 s ARG 180 CO 0.06 -0.53 1.09 0.14 -0.81 0.00 0.00 175.30 175.25 1bv4 s VAL 181 N -0.23 3.45 0.00 7.11 -7.23 -0.52 -4.84 120.40 118.13 1bv4 s VAL 181 Ca 0.60 0.95 0.00 0.00 -1.81 0.00 0.00 61.98 61.71 1bv4 s VAL 181 Cb -0.45 -3.41 0.00 0.00 0.56 0.00 0.00 36.38 33.08 1bv4 s VAL 181 CO 0.49 -0.15 0.00 0.54 -0.31 0.00 0.00 175.10 175.67 1bv4 n ARG 182 N -0.94 0.00 -1.87 4.82 5.12 -1.26 -4.93 116.66 117.60 1bv4 n ARG 182 Ca 0.10 0.10 -0.41 0.00 -1.93 0.00 0.00 57.85 55.71 1bv4 n ARG 182 Cb 0.51 -0.48 -0.02 0.00 -1.16 0.00 0.00 32.46 31.32 1bv4 n ARG 182 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1bv4 s TYR 183 N -0.61 2.85 0.04 -1.55 5.04 -1.26 -5.02 117.35 116.84 1bv4 s TYR 183 Ca 0.00 0.88 -0.03 0.00 -2.44 0.00 0.00 57.07 55.48 1bv4 s TYR 183 Cb 0.00 -3.97 -0.02 0.00 0.35 0.00 0.00 41.96 38.32 1bv4 s TYR 183 CO 0.00 -3.22 0.04 0.95 -1.34 0.00 0.00 175.55 171.98 1bv4 s THR 184 N -0.03 0.16 -0.35 4.34 -4.23 -1.26 -4.95 115.64 109.33 1bv4 s THR 184 Ca 0.61 -1.31 0.15 0.00 -1.18 0.00 0.00 61.69 59.96 1bv4 s THR 184 Cb -0.45 -1.03 0.42 0.00 1.34 0.00 0.00 72.50 72.78 1bv4 s THR 184 CO 0.46 -0.72 0.98 -3.20 -0.54 0.00 0.00 174.62 171.60 1bv4 n ASN 185 N 0.63 0.66 -4.71 3.99 5.15 -1.26 -5.08 115.26 114.63 1bv4 n ASN 185 Ca -0.18 -2.76 -0.43 0.00 -0.60 0.00 0.00 54.58 50.61 1bv4 n ASN 185 Cb 0.59 -0.20 -0.01 0.00 -0.53 0.00 0.00 39.78 39.63 1bv4 n ASN 185 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 1bv4 n TRP 186 N -0.07 2.46 -3.01 1.20 7.02 -1.26 -0.27 117.44 123.51 1bv4 n TRP 186 Ca 0.10 0.47 -0.40 0.00 -1.02 0.00 0.00 57.50 56.65 1bv4 n TRP 186 Cb 0.79 -2.47 -0.05 0.00 -2.42 0.00 0.00 31.31 27.17 1bv4 n TRP 186 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 1bv4 s ASN 187 N -0.06 7.00 -1.34 -0.99 2.47 0.19 -4.04 114.94 118.18 1bv4 s ASN 187 Ca 0.59 1.21 -0.01 0.00 0.42 0.00 0.00 52.86 55.07 1bv4 s ASN 187 Cb -0.56 -2.42 0.01 0.00 -1.45 0.00 0.00 41.25 36.83 1bv4 s ASN 187 CO 0.58 -0.15 0.66 -1.84 -3.72 0.00 0.00 177.10 172.64 1bv4 n GLU 188 N 3.91 -4.63 -1.07 0.43 0.28 -1.26 -4.78 120.64 113.52 1bv4 n GLU 188 Ca -0.00 0.58 0.14 0.00 -0.16 0.00 0.00 57.16 57.71 1bv4 n GLU 188 Cb 0.51 -5.07 -0.05 0.00 1.43 0.00 0.00 31.44 28.26 1bv4 n GLU 188 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1bv4 n GLY 189 N -1.66 -2.42 3.66 -1.84 0.00 -1.26 -4.83 105.19 96.84 1bv4 n GLY 189 Ca -0.28 -1.21 -0.45 0.00 0.00 0.00 0.00 46.02 44.08 1bv4 n GLY 189 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1bv4 n GLU 190 N -3.81 1.91 -1.50 1.61 1.02 -1.26 -4.85 120.64 113.76 1bv4 n GLU 190 Ca -0.03 0.68 -0.36 0.00 -0.02 0.00 0.00 57.16 57.43 1bv4 n GLU 190 Cb 0.50 -2.29 0.08 0.00 -0.02 0.00 0.00 31.44 29.70 1bv4 n GLU 190 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1bv4 n PRO 191 N 1.75 0.72 -3.08 3.49 -0.02 -1.26 -4.97 135.00 131.64 1bv4 n PRO 191 Ca 0.11 0.30 -0.19 0.00 -2.02 0.00 0.00 63.50 61.70 1bv4 n PRO 191 Cb 0.31 -2.29 -0.04 0.00 -0.02 0.00 0.00 33.50 31.46 1bv4 n PRO 191 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1bv4 n ASN 192 N -1.59 -0.92 -4.90 2.55 5.15 -1.26 -4.85 115.26 109.44 1bv4 n ASN 192 Ca 0.14 -2.82 -0.28 0.00 -0.60 0.00 0.00 54.58 51.02 1bv4 n ASN 192 Cb 0.49 0.15 0.00 0.00 -0.53 0.00 0.00 39.78 39.88 1bv4 n ASN 192 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 1bv4 s ASN 193 N -1.03 6.24 -0.01 1.20 0.01 -1.26 -5.11 114.94 114.98 1bv4 s ASN 193 Ca 0.34 1.04 0.00 0.00 -0.71 0.00 0.00 52.86 53.53 1bv4 s ASN 193 Cb 0.16 -2.29 0.01 0.00 0.41 0.00 0.00 41.25 39.54 1bv4 s ASN 193 CO -0.15 -0.66 -0.01 0.54 -1.51 0.00 0.00 177.10 175.31 1bv4 s VAL 194 N -2.85 0.10 -1.22 1.60 0.11 -1.26 -4.83 120.40 112.04 1bv4 s VAL 194 Ca 0.49 0.00 -0.07 0.00 -2.93 0.00 0.00 61.98 59.48 1bv4 s VAL 194 Cb -0.10 -0.13 0.05 0.00 -1.53 0.00 0.00 36.38 34.66 1bv4 s VAL 194 CO 0.47 0.06 0.38 0.61 -3.33 0.00 0.00 175.10 173.30 1bv4 n GLY 195 N 3.41 -0.49 3.94 6.54 0.00 -1.26 -4.93 105.19 112.40 1bv4 n GLY 195 Ca -0.17 0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.68 1bv4 n GLY 195 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1bv4 s SER 196 N -2.56 5.91 0.88 1.61 1.04 -1.26 -5.12 113.70 114.21 1bv4 s SER 196 Ca 0.30 0.40 0.00 0.00 0.48 0.00 0.00 55.95 57.13 1bv4 s SER 196 Cb -0.16 -1.68 0.00 0.00 0.10 0.00 0.00 66.02 64.28 1bv4 s SER 196 CO 0.37 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.54 1bv4 n GLY 197 N -2.10 -0.86 3.70 7.32 0.00 -1.26 -4.95 105.19 107.05 1bv4 n GLY 197 Ca 0.01 -1.71 -0.42 0.00 0.00 0.00 0.00 46.02 43.90 1bv4 n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bv4 s GLU 198 N -2.79 4.25 -0.12 1.61 2.02 -1.26 -4.97 118.70 117.44 1bv4 s GLU 198 Ca 0.00 2.21 -0.05 0.00 0.02 0.00 0.00 54.97 57.15 1bv4 s GLU 198 Cb 0.00 -3.38 -0.04 0.00 0.10 0.00 0.00 34.13 30.81 1bv4 s GLU 198 CO 0.00 -0.59 0.07 -0.80 0.02 0.00 0.00 175.26 173.96 1bv4 s ASN 199 N 1.63 5.82 0.52 -0.19 0.01 -1.26 -1.66 114.94 119.81 1bv4 s ASN 199 Ca 0.69 0.28 0.02 0.00 -0.71 0.00 0.00 52.86 53.14 1bv4 s ASN 199 Cb -0.39 -1.82 0.00 0.00 0.41 0.00 0.00 41.25 39.45 1bv4 s ASN 199 CO 0.30 0.36 0.10 0.00 -1.51 0.00 0.00 177.10 176.35 1bv4 s VAL 201 N -2.86 1.23 0.12 0.00 1.01 -1.18 -0.90 120.40 117.82 1bv4 s VAL 201 Ca 0.12 -0.59 0.10 0.00 0.00 0.00 0.00 61.98 61.61 1bv4 s VAL 201 Cb 0.00 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.26 1bv4 s VAL 201 CO 0.07 0.37 -0.24 0.68 0.00 0.00 0.00 175.10 175.97 1bv4 s VAL 202 N 0.25 2.44 -0.29 2.92 -7.23 -0.31 -0.81 120.40 117.36 1bv4 s VAL 202 Ca -0.07 -1.65 -0.17 0.00 -1.81 0.00 0.00 61.98 58.29 1bv4 s VAL 202 Cb -0.12 -2.08 -0.02 0.00 0.56 0.00 0.00 36.38 34.71 1bv4 s VAL 202 CO 0.02 0.12 0.46 -0.22 -0.31 0.00 0.00 175.10 175.17 1bv4 s LEU 203 N -2.02 4.15 0.74 1.32 2.96 0.10 -1.66 118.68 124.28 1bv4 s LEU 203 Ca 0.15 0.25 -0.10 0.00 -0.22 0.00 0.00 54.13 54.21 1bv4 s LEU 203 Cb -0.10 -2.54 0.05 0.00 0.50 0.00 0.00 46.19 44.10 1bv4 s LEU 203 CO 0.07 -0.31 1.10 -0.76 -1.32 0.00 0.00 176.35 175.13 1bv4 s LEU 204 N 2.23 2.74 0.64 -0.68 1.43 -0.06 -2.61 118.68 122.38 1bv4 s LEU 204 Ca 0.18 0.79 0.41 0.00 -1.03 0.00 0.00 54.13 54.48 1bv4 s LEU 204 Cb -0.16 -3.43 2.23 0.00 0.03 0.00 0.00 46.19 44.86 1bv4 s LEU 204 CO 0.11 -1.62 2.32 0.71 0.23 0.00 0.00 176.35 178.10 1bv4 h THR 205 N -0.77 0.11 -0.23 5.49 1.35 -1.88 0.49 112.91 117.47 1bv4 h THR 205 Ca -0.45 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 1bv4 h THR 205 Cb 1.30 1.05 0.00 0.00 -1.73 0.00 0.00 68.15 68.77 1bv4 h THR 205 CO 0.64 0.00 0.00 -0.46 -0.25 0.00 0.00 175.52 175.45 1bv4 n ASN 206 N -3.24 1.71 0.00 5.36 0.23 -1.26 -4.91 115.26 113.15 1bv4 n ASN 206 Ca -0.03 -1.81 0.00 0.00 -0.53 0.00 0.00 54.58 52.21 1bv4 n ASN 206 Cb 0.09 -0.15 0.00 0.00 -2.08 0.00 0.00 39.78 37.64 1bv4 n ASN 206 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1bv4 n GLY 207 N 1.10 2.11 3.92 4.83 0.00 0.16 -5.02 105.19 112.28 1bv4 n GLY 207 Ca 0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.90 1bv4 n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bv4 s LYS 208 N -0.07 2.81 -0.00 1.61 -0.14 -1.26 -4.76 119.74 117.94 1bv4 s LYS 208 Ca 0.00 0.00 -0.00 0.00 -1.36 0.00 0.00 55.97 54.61 1bv4 s LYS 208 Cb 0.00 -2.23 -0.04 0.00 -1.68 0.00 0.00 37.83 33.88 1bv4 s LYS 208 CO 0.00 -0.81 0.09 -1.58 -0.76 0.00 0.00 175.35 172.29 1bv4 s TRP 209 N -3.06 3.31 0.03 3.18 0.52 0.63 -0.88 118.94 122.67 1bv4 s TRP 209 Ca 0.55 0.21 0.02 0.00 0.02 0.00 0.00 56.10 56.90 1bv4 s TRP 209 Cb -0.11 -1.74 -0.02 0.00 -1.15 0.00 0.00 33.47 30.46 1bv4 s TRP 209 CO 0.46 0.56 -0.07 1.21 0.02 0.00 0.00 176.95 179.13 1bv4 s ASN 210 N -1.79 0.72 0.10 2.95 2.47 -0.66 0.56 114.94 119.29 1bv4 s ASN 210 Ca 0.24 -0.40 -0.13 0.00 0.42 0.00 0.00 52.86 52.99 1bv4 s ASN 210 Cb -0.12 0.01 -0.06 0.00 -1.45 0.00 0.00 41.25 39.62 1bv4 s ASN 210 CO 0.15 -0.13 0.48 1.51 -3.72 0.00 0.00 177.10 175.39 1bv4 s ASP 211 N -1.10 6.77 0.10 -4.21 -4.77 -1.26 -1.16 116.67 111.05 1bv4 s ASP 211 Ca -0.07 0.97 -0.11 0.00 -3.30 0.00 0.00 52.55 50.05 1bv4 s ASP 211 Cb -0.07 -2.25 0.01 0.00 -1.09 0.00 0.00 42.92 39.52 1bv4 s ASP 211 CO 0.00 0.16 0.26 0.68 0.70 0.00 0.00 175.17 176.97 1bv4 s VAL 212 N -1.38 0.12 0.28 2.11 -7.23 -0.08 -4.95 120.40 109.28 1bv4 s VAL 212 Ca 0.34 -1.01 -0.30 0.00 -1.81 0.00 0.00 61.98 59.20 1bv4 s VAL 212 Cb -0.15 -1.31 -0.11 0.00 0.56 0.00 0.00 36.38 35.36 1bv4 s VAL 212 CO 0.18 -0.53 1.60 -2.84 -0.31 0.00 0.00 175.10 173.20 1bv4 s PRO 213 N -3.85 4.13 0.50 4.82 0.02 -1.26 0.10 135.00 139.46 1bv4 s PRO 213 Ca 0.05 2.57 0.34 0.00 0.02 0.00 0.00 61.00 63.98 1bv4 s PRO 213 Cb 0.04 -3.03 1.77 0.00 0.02 0.00 0.00 34.50 33.29 1bv4 s PRO 213 CO -0.11 -0.64 2.03 0.00 -0.33 0.00 0.00 177.00 177.96 1bv4 h SER 215 N 0.00 0.00 -4.39 0.00 4.64 -1.89 -2.43 113.55 109.48 1bv4 h SER 215 Ca 0.00 -0.05 -0.47 0.00 -0.47 0.00 0.00 61.79 60.80 1bv4 h SER 215 Cb 0.10 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.30 1bv4 h SER 215 CO 0.00 0.02 0.36 -1.81 -0.87 0.00 0.00 176.83 174.53 1bv4 s ASP 216 N -4.81 4.30 -0.14 4.97 1.01 -0.73 -4.69 116.67 116.58 1bv4 s ASP 216 Ca 0.08 1.01 -0.02 0.00 0.71 0.00 0.00 52.55 54.34 1bv4 s ASP 216 Cb 0.11 -1.64 -0.02 0.00 1.01 0.00 0.00 42.92 42.38 1bv4 s ASP 216 CO 0.65 -2.06 -0.09 -0.44 0.21 0.00 0.00 175.17 173.44 1bv4 s SER 217 N -4.20 4.35 0.22 0.27 0.01 -1.26 -3.83 113.70 109.26 1bv4 s SER 217 Ca 0.62 -0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.59 1bv4 s SER 217 Cb -0.13 -1.69 -0.03 0.00 0.21 0.00 0.00 66.02 64.38 1bv4 s SER 217 CO 0.52 0.17 0.24 -0.36 0.41 0.00 0.00 173.24 174.22 1bv4 s PHE 218 N 0.37 0.94 0.95 2.43 0.40 -1.03 -4.66 117.98 117.37 1bv4 s PHE 218 Ca -0.08 -1.19 -0.11 0.00 -0.60 0.00 0.00 56.93 54.95 1bv4 s PHE 218 Cb -0.15 -0.33 0.16 0.00 0.51 0.00 0.00 43.02 43.21 1bv4 s PHE 218 CO 0.04 -0.76 1.10 -0.51 0.70 0.00 0.00 175.22 175.79 1bv4 s LEU 219 N -3.12 2.26 0.02 -0.37 1.43 -1.12 -1.29 118.68 116.48 1bv4 s LEU 219 Ca 0.34 1.82 0.07 0.00 -1.03 0.00 0.00 54.13 55.33 1bv4 s LEU 219 Cb 0.04 -4.14 -0.02 0.00 0.03 0.00 0.00 46.19 42.10 1bv4 s LEU 219 CO 0.12 -3.11 -0.21 -0.69 0.23 0.00 0.00 176.35 172.69 1bv4 s VAL 220 N -2.71 1.64 -0.13 -1.59 1.01 -1.26 -1.35 120.40 116.01 1bv4 s VAL 220 Ca 0.66 -1.05 0.01 0.00 0.00 0.00 0.00 61.98 61.60 1bv4 s VAL 220 Cb -0.21 -1.40 0.02 0.00 0.00 0.00 0.00 36.38 34.79 1bv4 s VAL 220 CO 0.59 0.31 -0.16 -0.69 0.00 0.00 0.00 175.10 175.15 1bv4 s VAL 221 N -0.66 1.63 0.07 2.92 1.01 -1.26 -0.34 120.40 123.78 1bv4 s VAL 221 Ca 0.08 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1bv4 s VAL 221 Cb -0.08 -1.49 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1bv4 s VAL 221 CO 0.01 0.47 0.17 0.00 0.00 0.00 0.00 175.10 175.75 1bv4 s GLU 223 N -2.53 2.05 0.17 0.00 -1.05 0.48 -1.71 118.70 116.11 1bv4 s GLU 223 Ca 0.33 -0.97 0.07 0.00 -0.15 0.00 0.00 54.97 54.25 1bv4 s GLU 223 Cb -0.13 -2.07 -0.04 0.00 -0.44 0.00 0.00 34.13 31.45 1bv4 s GLU 223 CO 0.26 0.55 -0.15 -0.06 0.95 0.00 0.00 175.26 176.81 1bv4 s PHE 224 N -0.72 1.60 -0.32 4.83 0.08 0.09 -2.14 117.98 121.40 1bv4 s PHE 224 Ca 0.11 -0.57 0.17 0.00 0.12 0.00 0.00 56.93 56.76 1bv4 s PHE 224 Cb -0.10 -0.78 0.47 0.00 -0.57 0.00 0.00 43.02 42.03 1bv4 s PHE 224 CO 0.01 0.26 1.03 0.43 -0.10 0.00 0.00 175.22 176.85 1bv4 n SER 225 N 0.04 2.16 -0.46 1.36 7.64 -1.26 -2.12 113.62 120.97 1bv4 n SER 225 Ca -0.11 -2.76 0.14 0.00 1.01 0.00 0.00 58.87 57.15 1bv4 n SER 225 Cb 0.59 -0.50 0.54 0.00 -1.01 0.00 0.00 64.21 63.83 1bv4 n SER 225 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50