#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yr1 s SER 116 N 0.00 6.67 0.38 1.61 0.01 -1.26 -5.10 113.70 116.02 1yr1 s SER 116 Ca 0.00 0.92 0.06 0.00 1.31 0.00 0.00 55.95 58.24 1yr1 s SER 116 Cb 0.00 -2.23 -0.02 0.00 0.21 0.00 0.00 66.02 63.98 1yr1 s SER 116 CO 0.00 0.02 0.22 -1.61 0.41 0.00 0.00 173.24 172.28 1yr1 s GLU 117 N -2.45 1.90 0.21 12.44 2.02 -1.26 -5.16 118.70 126.40 1yr1 s GLU 117 Ca 0.42 -2.14 -0.00 0.00 0.02 0.00 0.00 54.97 53.27 1yr1 s GLU 117 Cb -0.13 -0.10 -0.04 0.00 0.10 0.00 0.00 34.13 33.96 1yr1 s GLU 117 CO 0.20 -0.61 0.39 -1.58 0.02 0.00 0.00 175.26 173.69 1yr1 s TRP 118 N -3.28 3.48 0.07 1.61 0.52 -1.26 -5.10 118.94 114.99 1yr1 s TRP 118 Ca 0.31 0.32 -0.08 0.00 0.02 0.00 0.00 56.10 56.67 1yr1 s TRP 118 Cb 0.02 -1.84 -0.06 0.00 -1.15 0.00 0.00 33.47 30.44 1yr1 s TRP 118 CO 0.22 0.38 0.37 -0.98 0.02 0.00 0.00 176.95 176.95 1yr1 s ARG 119 N -3.38 3.70 -0.17 4.98 1.70 -1.26 -4.86 118.95 119.65 1yr1 s ARG 119 Ca 0.38 0.08 -0.23 0.00 -0.47 0.00 0.00 55.73 55.49 1yr1 s ARG 119 Cb -0.11 -2.99 -0.02 0.00 -0.57 0.00 0.00 34.95 31.26 1yr1 s ARG 119 CO 0.29 0.56 0.72 1.03 -1.08 0.00 0.00 175.30 176.83 1yr1 s ARG 120 N -2.00 4.27 0.00 3.89 0.52 -1.26 0.28 118.95 124.65 1yr1 s ARG 120 Ca 0.33 0.81 0.00 0.00 -0.52 0.00 0.00 55.73 56.35 1yr1 s ARG 120 Cb -0.13 -3.56 0.00 0.00 0.52 0.00 0.00 34.95 31.77 1yr1 s ARG 120 CO 0.19 -0.24 0.31 0.44 0.02 0.00 0.00 175.30 176.02 1yr1 n ILE 121 N 4.60 0.00 -3.83 1.52 -0.00 -0.75 -4.92 119.36 115.98 1yr1 n ILE 121 Ca 0.01 -0.33 -0.07 0.00 -0.00 0.00 0.00 62.75 62.37 1yr1 n ILE 121 Cb 0.49 1.34 0.01 0.00 -0.00 0.00 0.00 39.64 41.48 1yr1 n ILE 121 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1yr1 s ALA 122 N -0.02 -1.11 0.25 -1.28 0.00 -1.01 -4.21 121.76 114.38 1yr1 s ALA 122 Ca 0.00 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.48 1yr1 s ALA 122 Cb 0.00 0.72 -0.04 0.00 0.00 0.00 0.00 23.12 23.80 1yr1 s ALA 122 CO 0.00 -1.02 0.17 0.71 0.00 0.00 0.00 175.76 175.62 1yr1 s TYR 123 N -2.61 1.41 -0.11 0.00 1.51 0.15 0.90 117.35 118.60 1yr1 s TYR 123 Ca 0.16 -1.45 -0.01 0.00 -1.01 0.00 0.00 57.07 54.76 1yr1 s TYR 123 Cb -0.04 -0.66 0.03 0.00 -0.11 0.00 0.00 41.96 41.18 1yr1 s TYR 123 CO 0.08 -0.67 -0.02 0.08 -1.11 0.00 0.00 175.55 173.91 1yr1 s VAL 124 N -3.86 0.66 -0.45 0.71 1.01 0.10 0.66 120.40 119.23 1yr1 s VAL 124 Ca 0.39 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 61.91 1yr1 s VAL 124 Cb 0.05 -0.83 0.03 0.00 0.00 0.00 0.00 36.38 35.63 1yr1 s VAL 124 CO 0.17 0.22 1.11 -0.47 0.00 0.00 0.00 175.10 176.13 1yr1 s TYR 125 N 1.84 2.89 -0.24 5.22 6.14 0.46 -0.16 117.35 133.50 1yr1 s TYR 125 Ca 0.04 0.78 -0.27 0.00 0.64 0.00 0.00 57.07 58.26 1yr1 s TYR 125 Cb -0.13 -4.26 0.13 0.00 0.42 0.00 0.00 41.96 38.12 1yr1 s TYR 125 CO -0.07 -1.16 1.06 0.34 0.64 0.00 0.00 175.55 176.36 1yr1 s ASP 126 N 2.29 -0.38 -1.35 4.32 2.15 -0.81 -4.08 116.67 118.81 1yr1 s ASP 126 Ca 0.47 0.63 -0.08 0.00 0.43 0.00 0.00 52.55 53.99 1yr1 s ASP 126 Cb -0.08 0.60 0.01 0.00 -0.30 0.00 0.00 42.92 43.14 1yr1 s ASP 126 CO 0.28 -0.21 1.18 0.54 -0.17 0.00 0.00 175.17 176.79 1yr1 n ARG 127 N 1.60 -7.93 -2.20 4.34 1.74 -1.26 -1.73 116.66 111.22 1yr1 n ARG 127 Ca -0.11 0.83 -0.15 0.00 -0.77 0.00 0.00 57.85 57.65 1yr1 n ARG 127 Cb 0.57 -5.89 -0.02 0.00 -1.02 0.00 0.00 32.46 26.10 1yr1 n ARG 127 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1yr1 n GLN 128 N -4.97 -1.90 -3.78 5.56 6.02 -1.26 -4.94 117.38 112.12 1yr1 n GLN 128 Ca -0.01 0.75 -0.13 0.00 -0.01 0.00 0.00 57.00 57.60 1yr1 n GLN 128 Cb 0.57 -5.28 -0.11 0.00 1.02 0.00 0.00 30.24 26.44 1yr1 n GLN 128 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1yr1 s THR 129 N -2.62 0.01 -0.45 5.09 2.01 -0.71 -4.62 115.64 114.36 1yr1 s THR 129 Ca 0.00 -0.12 -0.22 0.00 0.31 0.00 0.00 61.69 61.66 1yr1 s THR 129 Cb 0.00 -0.45 0.03 0.00 0.01 0.00 0.00 72.50 72.09 1yr1 s THR 129 CO 0.00 -0.07 0.71 -0.36 -0.69 0.00 0.00 174.62 174.21 1yr1 s PHE 130 N -0.18 3.03 -0.14 4.92 0.40 0.12 -1.93 117.98 124.20 1yr1 s PHE 130 Ca -0.03 0.02 -0.29 0.00 -0.60 0.00 0.00 56.93 56.02 1yr1 s PHE 130 Cb -0.03 -3.50 -0.01 0.00 0.51 0.00 0.00 43.02 39.99 1yr1 s PHE 130 CO 0.01 -0.94 1.00 -0.06 0.70 0.00 0.00 175.22 175.94 1yr1 s PHE 131 N 3.03 3.46 0.10 0.36 0.08 0.77 -1.36 117.98 124.42 1yr1 s PHE 131 Ca 0.25 1.54 -0.31 0.00 0.12 0.00 0.00 56.93 58.54 1yr1 s PHE 131 Cb -0.13 -3.20 -0.10 0.00 -0.57 0.00 0.00 43.02 39.02 1yr1 s PHE 131 CO 0.20 -0.29 1.83 -1.25 -0.10 0.00 0.00 175.22 175.61 1yr1 s PRO 132 N 2.32 4.15 -0.21 0.24 0.04 -1.24 0.02 135.00 140.32 1yr1 s PRO 132 Ca 0.47 2.56 -0.06 0.00 0.04 0.00 0.00 61.00 64.00 1yr1 s PRO 132 Cb -0.17 -3.71 -0.03 0.00 0.04 0.00 0.00 34.50 30.62 1yr1 s PRO 132 CO 0.15 -0.85 0.04 -0.51 0.04 0.00 0.00 177.00 175.86 1yr1 s LEU 133 N 3.08 3.49 0.70 -3.56 1.43 0.26 -2.23 118.68 121.86 1yr1 s LEU 133 Ca 0.81 -0.11 -0.09 0.00 -1.03 0.00 0.00 54.13 53.72 1yr1 s LEU 133 Cb -0.44 -1.90 0.05 0.00 0.03 0.00 0.00 46.19 43.93 1yr1 s LEU 133 CO 0.37 0.08 1.04 -0.76 0.23 0.00 0.00 176.35 177.31 1yr1 s LEU 134 N 0.94 2.85 0.50 1.79 1.43 -0.91 -1.81 118.68 123.48 1yr1 s LEU 134 Ca 0.03 0.71 0.19 0.00 -1.03 0.00 0.00 54.13 54.03 1yr1 s LEU 134 Cb -0.14 -3.39 1.26 0.00 0.03 0.00 0.00 46.19 43.95 1yr1 s LEU 134 CO 0.02 -1.51 2.05 1.05 0.23 0.00 0.00 176.35 178.20 1yr1 h GLU 135 N -0.62 0.10 -0.60 1.70 4.11 -0.48 0.17 114.58 118.95 1yr1 h GLU 135 Ca -0.45 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1yr1 h GLU 135 Cb 1.29 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1yr1 h GLU 135 CO 0.62 0.07 0.00 0.27 0.07 0.00 0.00 179.01 180.04 1yr1 n ASN 136 N -4.46 2.94 0.00 3.06 6.94 -1.26 -3.85 115.26 118.64 1yr1 n ASN 136 Ca 0.05 -2.27 0.00 0.00 -0.02 0.00 0.00 54.58 52.34 1yr1 n ASN 136 Cb 0.36 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 37.33 1yr1 n ASN 136 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1yr1 n GLY 137 N 0.73 0.52 3.55 4.83 0.00 0.59 -4.87 105.19 110.54 1yr1 n GLY 137 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.87 1yr1 n GLY 137 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yr1 s ARG 138 N -0.25 1.99 -0.39 1.61 3.00 -1.25 -4.61 118.95 119.06 1yr1 s ARG 138 Ca 0.00 1.03 -0.25 0.00 -1.00 0.00 0.00 55.73 55.51 1yr1 s ARG 138 Cb 0.00 -4.65 0.02 0.00 0.00 0.00 0.00 34.95 30.32 1yr1 s ARG 138 CO 0.00 -3.60 0.89 -1.17 0.00 0.00 0.00 175.30 171.42 1yr1 s LEU 139 N 12.75 4.03 -0.55 -0.88 0.20 -1.26 -2.13 118.68 130.83 1yr1 s LEU 139 Ca 0.93 0.42 -0.11 0.00 0.69 0.00 0.00 54.13 56.06 1yr1 s LEU 139 Cb -0.15 -3.19 0.14 0.00 -0.43 0.00 0.00 46.19 42.55 1yr1 s LEU 139 CO 0.19 -0.88 0.45 -0.76 -0.29 0.00 0.00 176.35 175.07 1yr1 s LEU 140 N 3.46 5.94 0.40 -0.68 1.43 -0.95 -4.91 118.68 123.37 1yr1 s LEU 140 Ca 0.36 -2.06 0.18 0.00 -1.03 0.00 0.00 54.13 51.59 1yr1 s LEU 140 Cb -0.12 -2.08 0.82 0.00 0.03 0.00 0.00 46.19 44.84 1yr1 s LEU 140 CO 0.20 -0.70 1.81 0.11 0.23 0.00 0.00 176.35 178.01 1yr1 h LYS 141 N 8.37 0.00 0.00 1.70 1.57 -1.93 -2.68 116.57 123.59 1yr1 h LYS 141 Ca -0.18 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 1yr1 h LYS 141 Cb 1.07 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 1yr1 h LYS 141 CO 0.88 0.34 -0.15 1.96 -0.57 0.00 0.00 179.45 181.92 1yr1 h GLN 142 N 0.00 0.00 -0.71 3.15 4.20 -1.99 -3.06 115.11 116.71 1yr1 h GLN 142 Ca -0.00 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.46 1yr1 h GLN 142 Cb 0.74 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.37 1yr1 h GLN 142 CO 0.04 0.15 0.28 0.39 -0.67 0.00 0.00 178.83 179.02 1yr1 n GLU 143 N -3.22 3.28 -1.68 1.46 -0.58 -1.01 -5.00 120.64 113.89 1yr1 n GLU 143 Ca 0.01 -3.08 -0.30 0.00 -0.42 0.00 0.00 57.16 53.38 1yr1 n GLU 143 Cb 0.46 -2.15 0.07 0.00 -0.57 0.00 0.00 31.44 29.24 1yr1 n GLU 143 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1yr1 s GLY 144 N -1.29 1.63 0.15 0.62 0.00 -1.16 -4.11 107.32 103.17 1yr1 s GLY 144 Ca 0.54 -0.20 0.07 0.00 0.00 0.00 0.00 44.72 45.12 1yr1 s GLY 144 CO 0.12 0.18 -0.15 -1.08 0.00 0.00 0.00 173.10 172.17 1yr1 s THR 145 N -3.21 1.54 -0.36 0.90 -1.32 -0.47 -4.88 115.64 107.85 1yr1 s THR 145 Ca 0.59 -1.90 0.05 0.00 -1.21 0.00 0.00 61.69 59.23 1yr1 s THR 145 Cb -0.13 -1.75 0.52 0.00 -1.51 0.00 0.00 72.50 69.64 1yr1 s THR 145 CO 0.54 -0.45 1.60 2.29 -2.21 0.00 0.00 174.62 176.39 1yr1 n LYS 146 N 0.23 2.48 -3.80 7.08 -0.00 -1.26 0.13 118.16 123.03 1yr1 n LYS 146 Ca -0.13 -2.23 -0.13 0.00 -0.00 0.00 0.00 58.31 55.83 1yr1 n LYS 146 Cb 0.58 -1.92 -0.12 0.00 -0.00 0.00 0.00 35.03 33.57 1yr1 n LYS 146 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.40 177.32 1yr1 s THR 147 N -2.37 0.00 -0.07 0.58 -1.32 -1.26 -5.00 115.64 106.20 1yr1 s THR 147 Ca 0.41 -0.00 -0.30 0.00 -1.21 0.00 0.00 61.69 60.59 1yr1 s THR 147 Cb 0.34 -0.30 -0.06 0.00 -1.51 0.00 0.00 72.50 70.97 1yr1 s THR 147 CO 0.09 -0.00 1.77 0.00 -2.21 0.00 0.00 174.62 174.27 1yr1 s ALA 148 N 0.11 3.50 -0.55 11.08 0.00 -1.26 -4.73 121.76 129.89 1yr1 s ALA 148 Ca -0.00 0.95 -0.28 0.00 0.00 0.00 0.00 51.96 52.63 1yr1 s ALA 148 Cb -0.01 -3.81 0.01 0.00 0.00 0.00 0.00 23.12 19.31 1yr1 s ALA 148 CO 0.00 -1.62 1.41 -1.25 0.00 0.00 0.00 175.76 174.30 1yr1 s PRO 149 N 4.40 3.32 0.15 0.00 0.04 -1.26 -4.86 135.00 136.79 1yr1 s PRO 149 Ca 0.79 0.47 0.18 0.00 0.04 0.00 0.00 61.00 62.48 1yr1 s PRO 149 Cb -0.34 -4.11 0.78 0.00 0.04 0.00 0.00 34.50 30.86 1yr1 s PRO 149 CO 0.33 -1.91 1.54 0.45 0.04 0.00 0.00 177.00 177.45 1yr1 n SER 150 N 9.49 0.36 0.12 6.66 2.88 -1.26 -2.09 113.62 129.78 1yr1 n SER 150 Ca 0.12 0.60 -0.00 0.00 -1.33 0.00 0.00 58.87 58.26 1yr1 n SER 150 Cb 0.49 -0.67 0.02 0.00 -0.75 0.00 0.00 64.21 63.29 1yr1 n SER 150 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1yr1 h ASP 151 N 0.00 0.00 -5.31 -3.46 5.19 -1.89 -3.47 116.42 107.48 1yr1 h ASP 151 Ca 0.00 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.27 1yr1 h ASP 151 Cb 0.24 0.00 -0.14 0.00 0.18 0.00 0.00 39.33 39.61 1yr1 h ASP 151 CO 0.00 0.65 -0.54 0.00 -3.12 0.00 0.00 179.24 176.23 1yr1 s ALA 152 N -2.97 0.44 0.95 3.45 0.00 -0.89 -4.72 121.76 118.03 1yr1 s ALA 152 Ca 0.02 -1.16 -0.14 0.00 0.00 0.00 0.00 51.96 50.68 1yr1 s ALA 152 Cb 0.09 0.69 0.17 0.00 0.00 0.00 0.00 23.12 24.06 1yr1 s ALA 152 CO 0.76 -0.50 1.18 -1.25 0.00 0.00 0.00 175.76 175.95 1yr1 s PRO 153 N -3.98 0.77 0.12 0.00 0.04 -1.23 -4.59 135.00 126.12 1yr1 s PRO 153 Ca 0.16 0.07 0.06 0.00 0.04 0.00 0.00 61.00 61.33 1yr1 s PRO 153 Cb 0.06 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 32.75 1yr1 s PRO 153 CO -0.03 -2.41 -0.15 0.08 0.04 0.00 0.00 177.00 174.54 1yr1 s VAL 154 N -3.40 1.37 -0.45 -0.36 1.01 -1.26 0.34 120.40 117.64 1yr1 s VAL 154 Ca 0.67 -1.70 -0.02 0.00 0.00 0.00 0.00 61.98 60.93 1yr1 s VAL 154 Cb -0.11 -1.52 0.12 0.00 0.00 0.00 0.00 36.38 34.86 1yr1 s VAL 154 CO 0.53 -0.38 0.25 -0.76 0.00 0.00 0.00 175.10 174.74 1yr1 s LEU 155 N -2.40 5.20 0.07 3.92 1.43 0.21 0.47 118.68 127.58 1yr1 s LEU 155 Ca 0.09 -2.24 -0.27 0.00 -1.03 0.00 0.00 54.13 50.67 1yr1 s LEU 155 Cb -0.05 -1.82 -0.06 0.00 0.03 0.00 0.00 46.19 44.29 1yr1 s LEU 155 CO 0.03 -0.49 0.84 -0.69 0.23 0.00 0.00 176.35 176.27 1yr1 s VAL 156 N 0.83 4.64 -0.35 -1.59 1.01 0.21 -0.41 120.40 124.75 1yr1 s VAL 156 Ca 0.10 1.79 -0.05 0.00 0.00 0.00 0.00 61.98 63.82 1yr1 s VAL 156 Cb -0.22 -4.19 0.01 0.00 0.00 0.00 0.00 36.38 31.98 1yr1 s VAL 156 CO -0.04 0.35 0.20 0.61 0.00 0.00 0.00 175.10 176.22 1yr1 n GLY 157 N 2.33 -3.28 2.91 4.51 0.00 -1.26 -2.08 105.19 108.33 1yr1 n GLY 157 Ca -0.01 0.73 -0.14 0.00 0.00 0.00 0.00 46.02 46.61 1yr1 n GLY 157 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1yr1 s TRP 158 N -1.95 -0.51 -0.10 1.61 0.52 -1.26 -4.42 118.94 112.83 1yr1 s TRP 158 Ca 0.09 0.72 0.15 0.00 0.02 0.00 0.00 56.10 57.08 1yr1 s TRP 158 Cb -0.02 -0.11 -0.22 0.00 -1.15 0.00 0.00 33.47 31.97 1yr1 s TRP 158 CO 0.77 -0.55 0.19 1.63 0.02 0.00 0.00 176.95 179.01 1yr1 n LYS 159 N 5.35 1.03 -3.27 4.98 4.01 -1.26 -4.82 118.16 124.17 1yr1 n LYS 159 Ca -0.05 -0.07 -0.46 0.00 -0.51 0.00 0.00 58.31 57.21 1yr1 n LYS 159 Cb 0.50 -1.40 -0.04 0.00 -0.51 0.00 0.00 35.03 33.58 1yr1 n LYS 159 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1yr1 s ASP 160 N -4.51 6.43 0.66 4.39 1.01 -1.26 -4.90 116.67 118.50 1yr1 s ASP 160 Ca -0.07 -2.10 0.40 0.00 0.71 0.00 0.00 52.55 51.49 1yr1 s ASP 160 Cb 0.07 -2.23 2.20 0.00 1.01 0.00 0.00 42.92 43.98 1yr1 s ASP 160 CO 0.67 -0.79 2.27 1.23 0.21 0.00 0.00 175.17 178.76 1yr1 h GLY 161 N 8.68 0.00 1.04 0.21 0.00 -1.99 0.15 103.07 111.16 1yr1 h GLY 161 Ca -0.12 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.16 1yr1 h GLY 161 CO 0.94 0.00 0.26 -0.55 0.00 0.00 0.00 176.54 177.19 1yr1 h ASP 162 N 0.00 1.01 0.24 0.19 3.32 -1.98 0.12 116.42 119.32 1yr1 h ASP 162 Ca 0.01 -0.19 -0.15 0.00 0.02 0.00 0.00 57.03 56.72 1yr1 h ASP 162 Cb 0.15 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 1yr1 h ASP 162 CO -0.00 0.93 -0.56 0.00 -1.72 0.00 0.00 179.24 177.89 1yr1 h ALA 163 N 1.12 0.83 0.18 3.45 0.00 -1.14 -2.83 119.26 120.87 1yr1 h ALA 163 Ca 0.23 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1yr1 h ALA 163 Cb 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1yr1 h ALA 163 CO -0.01 0.70 -0.09 0.82 0.00 0.00 0.00 179.25 180.67 1yr1 h ILE 164 N 0.26 0.88 -0.56 0.00 2.04 -0.59 -2.15 117.51 117.38 1yr1 h ILE 164 Ca 0.00 -0.26 0.13 0.00 1.00 0.00 0.00 64.86 65.73 1yr1 h ILE 164 Cb 1.07 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 1yr1 h ILE 164 CO 0.09 0.06 0.39 0.00 0.00 0.00 0.00 178.15 178.70 1yr1 h ALA 165 N 0.42 2.28 0.15 1.87 0.00 -0.75 -0.38 119.26 122.84 1yr1 h ALA 165 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1yr1 h ALA 165 Cb 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1yr1 h ALA 165 CO 0.04 -0.43 -0.07 0.93 0.00 0.00 0.00 179.25 179.72 1yr1 h GLU 166 N 0.18 -0.19 0.15 0.00 4.39 -1.20 -0.01 114.58 117.90 1yr1 h GLU 166 Ca 0.27 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.98 1yr1 h GLU 166 Cb 0.81 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.49 1yr1 h GLU 166 CO -0.04 0.11 -0.13 0.52 -1.16 0.00 0.00 179.01 178.31 1yr1 h MET 167 N -0.50 -0.28 -0.49 2.33 2.86 -0.65 -1.81 114.93 116.39 1yr1 h MET 167 Ca -0.02 0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1yr1 h MET 167 Cb 0.39 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.08 1yr1 h MET 167 CO 0.03 -0.19 0.33 1.79 1.06 0.00 0.00 176.91 179.93 1yr1 h THR 168 N -0.29 0.99 -0.77 2.22 1.35 -1.14 -0.91 112.91 114.36 1yr1 h THR 168 Ca -0.00 -0.15 0.02 0.00 -0.55 0.00 0.00 66.41 65.72 1yr1 h THR 168 Cb 0.27 0.50 -0.04 0.00 -1.73 0.00 0.00 68.15 67.15 1yr1 h THR 168 CO -0.02 0.08 0.51 1.23 -0.25 0.00 0.00 175.52 177.07 1yr1 h GLY 169 N 0.45 1.10 1.36 5.82 0.00 -0.16 -0.39 103.07 111.24 1yr1 h GLY 169 Ca 0.21 -0.39 -0.08 0.00 0.00 0.00 0.00 47.33 47.07 1yr1 h GLY 169 CO -0.05 0.37 -0.04 1.46 0.00 0.00 0.00 176.54 178.28 1yr1 h GLN 170 N 1.02 0.78 0.00 4.80 1.08 -0.63 -2.36 115.11 119.80 1yr1 h GLN 170 Ca 0.29 -0.22 -0.07 0.00 -1.45 0.00 0.00 58.65 57.20 1yr1 h GLN 170 Cb -0.08 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.26 1yr1 h GLN 170 CO -0.08 0.81 -0.31 -0.07 -0.95 0.00 0.00 178.83 178.23 1yr1 h LEU 171 N 0.72 0.00 -1.00 1.46 4.07 -0.76 -0.26 115.31 119.54 1yr1 h LEU 171 Ca 0.13 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.09 1yr1 h LEU 171 Cb 0.50 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.24 1yr1 h LEU 171 CO 0.03 0.31 0.00 0.00 -1.08 0.00 0.00 178.44 177.70 1yr1 h ALA 172 N 1.69 1.00 0.00 1.53 0.00 -0.55 -3.29 119.26 119.64 1yr1 h ALA 172 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.57 1yr1 h ALA 172 Cb 0.62 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.35 1yr1 h ALA 172 CO 0.04 0.00 -2.25 -0.85 0.00 0.00 0.00 179.25 176.19 1yr1 n GLU 173 N -2.86 0.54 -1.55 0.00 0.28 -0.89 -5.01 120.64 111.16 1yr1 n GLU 173 Ca 0.02 0.14 -0.32 0.00 -0.16 0.00 0.00 57.16 56.83 1yr1 n GLU 173 Cb 0.33 -1.43 0.06 0.00 1.43 0.00 0.00 31.44 31.84 1yr1 n GLU 173 CO 0.00 0.00 0.00 -0.48 -0.16 0.00 0.00 177.13 176.49 1yr1 s LEU 174 N -6.37 3.23 -0.07 -1.84 0.05 -0.16 -4.92 118.68 108.60 1yr1 s LEU 174 Ca -0.30 1.89 -0.37 0.00 0.05 0.00 0.00 54.13 55.41 1yr1 s LEU 174 Cb 0.08 -4.53 -0.14 0.00 -2.05 0.00 0.00 46.19 39.54 1yr1 s LEU 174 CO 0.50 -1.77 1.67 -2.65 -0.55 0.00 0.00 176.35 173.54 1yr1 n PRO 175 N -2.91 1.61 -0.29 1.48 -0.02 -1.26 -4.84 135.00 128.77 1yr1 n PRO 175 Ca 0.10 0.59 0.21 0.00 -2.02 0.00 0.00 63.50 62.37 1yr1 n PRO 175 Cb 0.53 -2.32 0.50 0.00 -0.02 0.00 0.00 33.50 32.19 1yr1 n PRO 175 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yr1 h ALA 176 N 6.97 2.20 -0.54 3.55 0.00 -1.91 0.11 119.26 129.64 1yr1 h ALA 176 Ca -0.47 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 1yr1 h ALA 176 Cb 1.30 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1yr1 h ALA 176 CO 0.90 -0.54 0.05 0.00 0.00 0.00 0.00 179.25 179.66 1yr1 h ALA 177 N 1.61 0.72 0.49 0.00 0.00 -1.93 0.29 119.26 120.45 1yr1 h ALA 177 Ca 0.53 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1yr1 h ALA 177 Cb 1.31 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.90 1yr1 h ALA 177 CO -0.23 0.50 -0.30 0.28 0.00 0.00 0.00 179.25 179.50 1yr1 h VAL 178 N 0.80 0.39 0.00 0.00 2.07 -1.01 0.97 116.25 119.47 1yr1 h VAL 178 Ca 0.16 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.68 1yr1 h VAL 178 Cb 0.47 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 1yr1 h VAL 178 CO 0.02 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.61 1yr1 n LEU 179 N -5.43 0.38 0.03 2.57 -0.00 -0.85 -1.90 117.00 111.80 1yr1 n LEU 179 Ca -0.11 0.60 0.12 0.00 -0.00 0.00 0.00 56.01 56.62 1yr1 n LEU 179 Cb 0.33 -0.56 0.12 0.00 -0.00 0.00 0.00 43.42 43.31 1yr1 n LEU 179 CO 0.34 -0.48 0.23 0.61 -0.00 0.00 0.00 177.39 178.10 1yr1 n GLY 180 N -0.18 -1.26 3.32 1.47 0.00 0.10 -3.57 105.19 105.07 1yr1 n GLY 180 Ca 0.02 -0.36 -0.44 0.00 0.00 0.00 0.00 46.02 45.24 1yr1 n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yr1 n ALA 181 N -1.70 4.26 -3.60 4.61 0.00 0.20 -4.74 120.51 119.54 1yr1 n ALA 181 Ca 0.04 -4.47 0.02 0.00 0.00 0.00 0.00 53.44 49.03 1yr1 n ALA 181 Cb 0.40 -2.75 -0.00 0.00 0.00 0.00 0.00 19.45 17.10 1yr1 n ALA 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yr1 s MET 182 N -0.06 0.26 -0.22 0.00 0.23 -1.26 -3.19 119.30 115.05 1yr1 s MET 182 Ca 0.37 -0.14 -0.09 0.00 -1.03 0.00 0.00 55.69 54.80 1yr1 s MET 182 Cb -0.04 0.09 -0.10 0.00 -1.53 0.00 0.00 34.83 33.24 1yr1 s MET 182 CO -0.02 -0.12 -0.27 0.43 -2.03 0.00 0.00 175.02 173.01 1yr1 n SER 183 N -0.50 1.73 -3.55 -1.18 7.64 0.17 -4.56 113.62 113.37 1yr1 n SER 183 Ca -0.09 0.20 -0.10 0.00 1.01 0.00 0.00 58.87 59.89 1yr1 n SER 183 Cb 0.63 -0.60 -0.04 0.00 -1.01 0.00 0.00 64.21 63.19 1yr1 n SER 183 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1yr1 s GLU 184 N -2.41 0.71 -0.14 1.43 -1.05 -1.26 -4.25 118.70 111.73 1yr1 s GLU 184 Ca -0.31 -0.02 -0.05 0.00 -0.15 0.00 0.00 54.97 54.44 1yr1 s GLU 184 Cb 0.11 0.33 -0.04 0.00 -0.44 0.00 0.00 34.13 34.09 1yr1 s GLU 184 CO 0.41 -0.26 0.05 0.42 0.95 0.00 0.00 175.26 176.83 1yr1 s ILE 185 N -1.91 4.67 -0.26 1.83 1.01 0.18 -1.28 121.20 125.44 1yr1 s ILE 185 Ca 0.00 -0.09 -0.06 0.00 0.00 0.00 0.00 60.65 60.50 1yr1 s ILE 185 Cb -0.01 -3.04 -0.00 0.00 0.01 0.00 0.00 42.46 39.42 1yr1 s ILE 185 CO -0.02 0.54 0.04 -1.00 0.00 0.00 0.00 174.94 174.50 1yr1 s HIS 186 N -0.29 3.08 -0.47 3.97 3.76 0.17 0.63 115.29 126.15 1yr1 s HIS 186 Ca 0.08 -0.84 -0.27 0.00 -0.15 0.00 0.00 55.06 53.87 1yr1 s HIS 186 Cb -0.12 -2.20 -0.02 0.00 1.11 0.00 0.00 32.58 31.35 1yr1 s HIS 186 CO 0.02 -0.52 1.81 -0.47 -0.85 0.00 0.00 174.74 174.73 1yr1 s TYR 187 N 1.52 1.77 -0.57 1.40 5.04 -0.88 -0.25 117.35 125.37 1yr1 s TYR 187 Ca 0.04 0.73 0.05 0.00 -2.44 0.00 0.00 57.07 55.45 1yr1 s TYR 187 Cb -0.16 -4.11 0.18 0.00 0.35 0.00 0.00 41.96 38.22 1yr1 s TYR 187 CO 0.01 -2.57 0.46 1.63 -1.34 0.00 0.00 175.55 173.75 1yr1 n LYS 188 N 8.76 1.22 -1.15 4.97 5.02 -0.30 -4.95 118.16 131.72 1yr1 n LYS 188 Ca 0.22 -3.94 -0.31 0.00 -2.02 0.00 0.00 58.31 52.26 1yr1 n LYS 188 Cb 0.49 -1.99 0.12 0.00 -0.02 0.00 0.00 35.03 33.63 1yr1 n LYS 188 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1yr1 s PRO 189 N -0.97 1.72 0.14 1.97 0.04 -1.04 -4.38 135.00 132.47 1yr1 s PRO 189 Ca 0.30 1.11 0.01 0.00 0.04 0.00 0.00 61.00 62.45 1yr1 s PRO 189 Cb 0.02 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 1yr1 s PRO 189 CO -0.16 -2.00 0.00 0.95 0.04 0.00 0.00 177.00 175.83 1yr1 s THR 190 N -2.87 0.48 0.59 1.26 -4.23 0.95 -4.91 115.64 106.91 1yr1 s THR 190 Ca 0.63 -1.94 0.29 0.00 -1.18 0.00 0.00 61.69 59.49 1yr1 s THR 190 Cb -0.18 -1.97 0.37 0.00 1.34 0.00 0.00 72.50 72.06 1yr1 s THR 190 CO 0.57 -0.59 2.00 0.08 -0.54 0.00 0.00 174.62 176.14 1yr1 h ARG 191 N 2.83 0.00 0.00 3.99 0.11 -1.99 -0.50 114.38 118.82 1yr1 h ARG 191 Ca -0.36 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.72 1yr1 h ARG 191 Cb 1.19 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.27 1yr1 h ARG 191 CO 0.62 0.00 -1.43 0.39 0.10 0.00 0.00 179.97 179.66 1yr1 n GLU 192 N -3.76 0.91 -3.53 0.08 -0.58 -1.26 -4.79 120.64 107.72 1yr1 n GLU 192 Ca 0.05 -0.10 -0.28 0.00 -0.42 0.00 0.00 57.16 56.41 1yr1 n GLU 192 Cb 0.49 -1.33 -0.11 0.00 -0.57 0.00 0.00 31.44 29.93 1yr1 n GLU 192 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 1yr1 s TYR 193 N -2.90 1.61 0.62 -0.32 2.02 -0.21 -4.95 117.35 113.22 1yr1 s TYR 193 Ca -0.02 -2.46 0.41 0.00 -0.37 0.00 0.00 57.07 54.62 1yr1 s TYR 193 Cb 0.10 -1.35 2.24 0.00 -0.40 0.00 0.00 41.96 42.55 1yr1 s TYR 193 CO 0.64 -0.77 2.26 1.49 -1.57 0.00 0.00 175.55 177.60 1yr1 h GLU 194 N 5.82 0.00 -0.67 -0.62 4.81 -1.81 0.30 114.58 122.41 1yr1 h GLU 194 Ca 0.20 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.97 1yr1 h GLU 194 Cb 0.89 0.00 -0.30 0.00 0.63 0.00 0.00 28.75 29.97 1yr1 h GLU 194 CO 0.44 0.00 -0.25 -0.40 -0.73 0.00 0.00 179.01 178.07 1yr1 n ASP 195 N -3.00 4.74 -4.61 1.04 5.68 -1.26 -4.61 116.55 114.52 1yr1 n ASP 195 Ca -0.03 -3.78 -0.43 0.00 -0.50 0.00 0.00 54.79 50.06 1yr1 n ASP 195 Cb 0.12 -0.56 -0.04 0.00 -1.14 0.00 0.00 41.12 39.50 1yr1 n ASP 195 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1yr1 s ARG 196 N -3.54 3.89 -0.07 0.11 3.52 -0.51 -0.51 118.95 121.84 1yr1 s ARG 196 Ca 0.52 0.66 0.04 0.00 -0.13 0.00 0.00 55.73 56.82 1yr1 s ARG 196 Cb 0.43 -3.78 -0.02 0.00 -1.56 0.00 0.00 34.95 30.02 1yr1 s ARG 196 CO 0.01 -0.90 -0.19 0.14 -0.81 0.00 0.00 175.30 173.55 1yr1 s VAL 197 N 3.42 2.59 -0.36 7.11 -7.23 0.20 -1.15 120.40 124.97 1yr1 s VAL 197 Ca 0.38 -0.87 -0.10 0.00 -1.81 0.00 0.00 61.98 59.58 1yr1 s VAL 197 Cb -0.12 -2.00 0.03 0.00 0.56 0.00 0.00 36.38 34.85 1yr1 s VAL 197 CO 0.17 0.57 0.18 -0.63 -0.31 0.00 0.00 175.10 175.08 1yr1 s ILE 198 N -0.28 4.43 0.34 -0.62 -1.09 0.65 0.19 121.20 124.82 1yr1 s ILE 198 Ca 0.01 -0.88 -0.12 0.00 -2.23 0.00 0.00 60.65 57.43 1yr1 s ILE 198 Cb -0.13 -3.46 -0.08 0.00 -1.58 0.00 0.00 42.46 37.21 1yr1 s ILE 198 CO 0.03 -0.20 0.72 0.68 -1.23 0.00 0.00 174.94 174.93 1yr1 s VAL 199 N 1.53 4.77 -0.38 2.92 -7.23 0.11 0.44 120.40 122.56 1yr1 s VAL 199 Ca 0.02 0.71 -0.07 0.00 -1.81 0.00 0.00 61.98 60.83 1yr1 s VAL 199 Cb -0.19 -3.67 0.07 0.00 0.56 0.00 0.00 36.38 33.15 1yr1 s VAL 199 CO 0.06 -0.31 0.18 -0.31 -0.31 0.00 0.00 175.10 174.41 1yr1 s TYR 200 N -2.12 3.35 0.59 2.82 1.51 -0.40 -0.62 117.35 122.47 1yr1 s TYR 200 Ca 0.52 -1.68 -0.19 0.00 -1.01 0.00 0.00 57.07 54.71 1yr1 s TYR 200 Cb -0.10 -2.73 -0.06 0.00 -0.11 0.00 0.00 41.96 38.96 1yr1 s TYR 200 CO 0.24 -0.83 0.88 -0.12 -1.11 0.00 0.00 175.55 174.61 1yr1 n MET 201 N 4.81 0.84 0.30 -0.62 1.56 -0.23 0.41 117.12 124.19 1yr1 n MET 201 Ca -0.10 0.33 0.18 0.00 -0.27 0.00 0.00 57.70 57.84 1yr1 n MET 201 Cb 0.43 -2.07 0.92 0.00 2.15 0.00 0.00 33.22 34.65 1yr1 n MET 201 CO 0.00 0.00 0.00 -2.95 -0.73 0.00 0.00 175.97 172.29 1yr1 h ASN 202 N 0.48 0.00 1.28 6.12 7.08 -1.79 -1.39 115.58 127.36 1yr1 h ASN 202 Ca -0.48 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.74 1yr1 h ASN 202 Cb 1.37 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.61 1yr1 h ASN 202 CO 0.50 0.03 0.00 0.47 -2.08 0.00 0.00 177.43 176.36 1yr1 n ASP 203 N -3.28 0.56 0.00 6.14 8.00 -1.26 -4.90 116.55 121.81 1yr1 n ASP 203 Ca -0.02 0.56 0.00 0.00 0.71 0.00 0.00 54.79 56.04 1yr1 n ASP 203 Cb 0.19 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 40.58 1yr1 n ASP 203 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yr1 n GLY 204 N 1.26 1.31 3.95 0.44 0.00 -0.53 -5.12 105.19 106.51 1yr1 n GLY 204 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 1yr1 n GLY 204 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yr1 s TYR 205 N -2.00 2.83 -0.21 1.61 1.51 -1.24 -4.92 117.35 114.92 1yr1 s TYR 205 Ca 0.00 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.67 1yr1 s TYR 205 Cb 0.00 -2.19 0.03 0.00 -0.11 0.00 0.00 41.96 39.69 1yr1 s TYR 205 CO 0.00 -0.20 -0.15 -2.00 -1.11 0.00 0.00 175.55 172.09 1yr1 s GLU 206 N -4.21 2.81 0.26 -0.62 2.12 -1.26 -1.07 118.70 116.72 1yr1 s GLU 206 Ca 0.50 -0.96 0.11 0.00 0.36 0.00 0.00 54.97 54.98 1yr1 s GLU 206 Cb -0.07 -2.72 -0.05 0.00 0.26 0.00 0.00 34.13 31.55 1yr1 s GLU 206 CO 0.30 -0.32 -0.16 0.08 -0.54 0.00 0.00 175.26 174.63 1yr1 s VAL 207 N 1.26 2.72 0.08 3.70 1.01 0.21 -4.98 120.40 124.39 1yr1 s VAL 207 Ca 0.01 -2.19 0.09 0.00 0.00 0.00 0.00 61.98 59.90 1yr1 s VAL 207 Cb -0.15 -2.41 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 1yr1 s VAL 207 CO -0.10 -0.33 -0.25 -0.94 0.00 0.00 0.00 175.10 173.49 1yr1 s SER 208 N -3.36 2.98 -0.15 3.32 1.04 -1.26 0.04 113.70 116.30 1yr1 s SER 208 Ca 0.28 -0.65 -0.29 0.00 0.48 0.00 0.00 55.95 55.77 1yr1 s SER 208 Cb -0.06 -0.22 0.11 0.00 0.10 0.00 0.00 66.02 65.94 1yr1 s SER 208 CO 0.15 0.18 0.90 0.00 0.98 0.00 0.00 173.24 175.45 1yr1 s ALA 209 N -0.95 -1.88 0.10 5.32 0.00 0.13 -4.91 121.76 119.56 1yr1 s ALA 209 Ca 0.11 1.58 -0.07 0.00 0.00 0.00 0.00 51.96 53.58 1yr1 s ALA 209 Cb -0.10 -0.65 -0.05 0.00 0.00 0.00 0.00 23.12 22.32 1yr1 s ALA 209 CO 0.04 -0.32 0.36 0.95 0.00 0.00 0.00 175.76 176.79 1yr1 s THR 210 N -0.84 5.17 0.56 0.00 -4.23 -1.26 0.59 115.64 115.64 1yr1 s THR 210 Ca -0.04 0.18 0.24 0.00 -1.18 0.00 0.00 61.69 60.90 1yr1 s THR 210 Cb -0.01 -3.62 0.32 0.00 1.34 0.00 0.00 72.50 70.53 1yr1 s THR 210 CO 0.03 0.18 2.20 0.40 -0.54 0.00 0.00 174.62 176.88 1yr1 h ILE 211 N 2.49 0.72 -0.14 2.99 2.04 -1.18 1.00 117.51 125.42 1yr1 h ILE 211 Ca -0.48 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.26 1yr1 h ILE 211 Cb 1.18 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1yr1 h ILE 211 CO 0.69 0.00 -0.46 0.08 0.00 0.00 0.00 178.15 178.46 1yr1 h ARG 212 N 0.00 0.35 -0.32 2.37 0.11 -1.94 -3.31 114.38 111.65 1yr1 h ARG 212 Ca 0.01 -0.19 -0.25 0.00 0.10 0.00 0.00 59.98 59.65 1yr1 h ARG 212 Cb 0.07 0.01 -0.35 0.00 1.11 0.00 0.00 29.97 30.81 1yr1 h ARG 212 CO -0.00 0.75 -0.95 1.04 0.10 0.00 0.00 179.97 180.91 1yr1 n GLN 213 N -3.99 1.62 -0.24 0.08 6.02 -0.61 -4.88 117.38 115.39 1yr1 n GLN 213 Ca -0.02 -3.21 -0.01 0.00 -0.01 0.00 0.00 57.00 53.76 1yr1 n GLN 213 Cb 0.53 -1.31 0.11 0.00 1.02 0.00 0.00 30.24 30.59 1yr1 n GLN 213 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 1yr1 h PHE 214 N 1.85 0.69 -0.07 1.08 3.04 0.90 0.76 116.94 125.20 1yr1 h PHE 214 Ca -0.04 0.03 -0.01 0.00 3.98 0.00 0.00 57.97 61.93 1yr1 h PHE 214 Cb 1.46 -0.21 -0.00 0.00 2.56 0.00 0.00 35.95 39.76 1yr1 h PHE 214 CO 0.52 0.31 0.02 0.00 -2.02 0.00 0.00 178.31 177.14 1yr1 h ALA 215 N 1.37 0.09 -0.52 2.41 0.00 -1.84 -1.62 119.26 119.15 1yr1 h ALA 215 Ca 0.32 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 55.06 1yr1 h ALA 215 Cb 0.24 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1yr1 h ALA 215 CO -0.21 -0.31 0.09 0.22 0.00 0.00 0.00 179.25 179.04 1yr1 h ASP 216 N -0.08 0.78 0.17 0.00 3.58 -1.84 0.73 116.42 119.77 1yr1 h ASP 216 Ca 0.02 -0.16 0.01 0.00 0.42 0.00 0.00 57.03 57.32 1yr1 h ASP 216 Cb 0.20 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 1yr1 h ASP 216 CO -0.00 0.79 -0.22 0.11 -2.88 0.00 0.00 179.24 177.04 1yr1 h LYS 217 N 0.79 -0.43 0.00 0.28 1.79 0.81 -2.02 116.57 117.78 1yr1 h LYS 217 Ca 0.17 0.03 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 1yr1 h LYS 217 Cb 0.35 0.10 -0.01 0.00 -1.58 0.00 0.00 32.23 31.09 1yr1 h LYS 217 CO 0.01 -0.29 -0.48 -0.07 -1.08 0.00 0.00 179.45 177.54 1yr1 h LEU 218 N -0.45 0.00 -1.37 2.94 -0.00 -1.18 -3.28 115.31 111.97 1yr1 h LEU 218 Ca 0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.83 1yr1 h LEU 218 Cb 0.44 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.09 1yr1 h LEU 218 CO -0.08 0.18 -0.25 0.28 -0.00 0.00 0.00 178.44 178.57 1yr1 h SER 219 N 0.00 0.09 0.29 -0.43 0.02 0.74 -1.93 113.55 112.33 1yr1 h SER 219 Ca -0.02 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 1yr1 h SER 219 Cb 1.15 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.67 1yr1 h SER 219 CO 0.02 0.35 0.00 1.57 -1.14 0.00 0.00 176.83 177.63 1yr1 n HIS 220 N -4.21 0.00 -3.06 3.45 -0.00 -0.78 -4.64 115.22 105.98 1yr1 n HIS 220 Ca -0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 57.72 57.28 1yr1 n HIS 220 Cb 0.33 -0.23 -0.06 0.00 -0.00 0.00 0.00 29.99 30.02 1yr1 n HIS 220 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1yr1 s TYR 221 N -2.46 3.05 0.39 1.57 6.14 -0.72 -4.93 117.35 120.38 1yr1 s TYR 221 Ca 0.20 0.07 0.12 0.00 0.64 0.00 0.00 57.07 58.11 1yr1 s TYR 221 Cb 0.13 -3.42 0.77 0.00 0.42 0.00 0.00 41.96 39.86 1yr1 s TYR 221 CO 0.28 -0.88 1.86 -1.35 0.64 0.00 0.00 175.55 176.10 1yr1 h PRO 222 N 8.85 0.03 -0.07 4.97 0.11 -1.87 -1.86 132.00 142.17 1yr1 h PRO 222 Ca -0.25 -0.01 -0.12 0.00 0.11 0.00 0.00 66.00 65.72 1yr1 h PRO 222 Cb 1.09 -0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.21 1yr1 h PRO 222 CO 0.91 0.34 -0.44 0.00 -0.21 0.00 0.00 178.00 178.60 1yr1 h ALA 223 N 1.66 0.14 0.51 -0.75 0.00 -1.96 -0.89 119.26 117.98 1yr1 h ALA 223 Ca 0.00 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1yr1 h ALA 223 Cb 0.57 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.36 1yr1 h ALA 223 CO 0.04 0.29 -0.25 0.82 0.00 0.00 0.00 179.25 180.16 1yr1 h ILE 224 N -0.05 0.42 -0.33 0.00 2.04 -1.87 -2.59 117.51 115.13 1yr1 h ILE 224 Ca -0.04 -0.34 0.09 0.00 1.00 0.00 0.00 64.86 65.58 1yr1 h ILE 224 Cb 1.11 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1yr1 h ILE 224 CO 0.09 0.05 0.26 0.00 0.00 0.00 0.00 178.15 178.55 1yr1 h ALA 225 N -0.56 2.21 -0.79 1.87 0.00 -1.45 0.32 119.26 120.86 1yr1 h ALA 225 Ca -0.07 -0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.06 1yr1 h ALA 225 Cb 0.61 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1yr1 h ALA 225 CO 0.12 -0.42 0.61 0.00 0.00 0.00 0.00 179.25 179.55 1yr1 h ALA 226 N 1.79 2.70 -0.62 0.00 0.00 -0.73 0.40 119.26 122.80 1yr1 h ALA 226 Ca 0.15 -0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.22 1yr1 h ALA 226 Cb 0.66 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1yr1 h ALA 226 CO -0.00 -1.02 0.55 0.00 0.00 0.00 0.00 179.25 178.79 1yr1 h ALA 227 N 1.53 2.44 0.03 0.00 0.00 -0.97 0.95 119.26 123.24 1yr1 h ALA 227 Ca 0.38 -0.02 -0.22 0.00 0.00 0.00 0.00 54.91 55.05 1yr1 h ALA 227 Cb 1.59 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 1yr1 h ALA 227 CO -0.00 -0.87 -1.00 -0.07 0.00 0.00 0.00 179.25 177.30 1yr1 h LEU 228 N 0.00 0.19 -0.05 0.00 3.38 -0.40 -3.00 115.31 115.43 1yr1 h LEU 228 Ca 0.29 -0.18 -0.25 0.00 0.09 0.00 0.00 57.88 57.83 1yr1 h LEU 228 Cb 1.40 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 42.10 1yr1 h LEU 228 CO -0.00 1.07 -1.06 0.44 0.09 0.00 0.00 178.44 178.98 1yr1 h ASP 229 N 0.06 0.65 0.00 -0.43 3.32 0.71 -3.24 116.42 117.47 1yr1 h ASP 229 Ca -0.05 -0.55 0.00 0.00 0.02 0.00 0.00 57.03 56.44 1yr1 h ASP 229 Cb 1.70 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 41.05 1yr1 h ASP 229 CO 0.15 1.37 0.00 0.54 -1.72 0.00 0.00 179.24 179.57 1yr1 n ARG 230 N -3.74 0.00 -3.17 3.56 1.74 0.51 -4.31 116.66 111.25 1yr1 n ARG 230 Ca -0.09 0.23 -0.44 0.00 -0.77 0.00 0.00 57.85 56.78 1yr1 n ARG 230 Cb 0.90 -1.08 0.00 0.00 -1.02 0.00 0.00 32.46 31.26 1yr1 n ARG 230 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1yr1 n ASN 231 N -1.20 5.51 -4.83 0.55 5.03 -1.13 -5.02 115.26 114.17 1yr1 n ASN 231 Ca 0.00 -3.06 -0.38 0.00 0.87 0.00 0.00 54.58 52.02 1yr1 n ASN 231 Cb 0.00 -1.42 -0.06 0.00 -1.02 0.00 0.00 39.78 37.28 1yr1 n ASN 231 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1yr1 s VAL 232 N -0.61 4.84 0.00 2.41 0.11 -1.22 -4.77 120.40 121.16 1yr1 s VAL 232 Ca 0.34 1.02 0.00 0.00 -2.93 0.00 0.00 61.98 60.41 1yr1 s VAL 232 Cb -0.06 -3.81 0.00 0.00 -1.53 0.00 0.00 36.38 30.98 1yr1 s VAL 232 CO -0.04 0.48 0.00 0.29 -3.33 0.00 0.00 175.10 172.50