#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yr1 n SER 116 N 0.00 0.15 -2.46 1.61 7.64 -1.26 -5.15 113.62 114.16 1yr1 n SER 116 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 1yr1 n SER 116 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 1yr1 n SER 116 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1yr1 n GLU 117 N -2.53 0.78 -1.89 1.43 4.71 -1.26 -5.16 120.64 116.73 1yr1 n GLU 117 Ca 0.00 -1.90 -0.33 0.00 -0.01 0.00 0.00 57.16 54.93 1yr1 n GLU 117 Cb 0.14 2.16 0.03 0.00 -1.01 0.00 0.00 31.44 32.77 1yr1 n GLU 117 CO 0.00 0.00 0.00 -1.58 0.09 0.00 0.00 177.13 175.64 1yr1 s TRP 118 N -3.57 2.83 -0.15 -0.32 0.52 -1.26 -5.03 118.94 111.96 1yr1 s TRP 118 Ca 0.16 1.52 -0.12 0.00 0.02 0.00 0.00 56.10 57.68 1yr1 s TRP 118 Cb -0.03 -3.07 -0.05 0.00 -1.15 0.00 0.00 33.47 29.17 1yr1 s TRP 118 CO 0.12 -1.38 0.25 0.50 0.02 0.00 0.00 176.95 176.46 1yr1 s ARG 119 N -4.13 4.09 0.01 4.98 3.00 -1.26 -4.86 118.95 120.79 1yr1 s ARG 119 Ca 0.65 0.03 -0.30 0.00 -1.00 0.00 0.00 55.73 55.11 1yr1 s ARG 119 Cb -0.18 -3.37 -0.05 0.00 0.00 0.00 0.00 34.95 31.35 1yr1 s ARG 119 CO 0.40 0.37 1.33 1.03 0.00 0.00 0.00 175.30 178.43 1yr1 s ARG 120 N 0.08 4.32 0.00 5.12 0.52 -1.26 -0.87 118.95 126.86 1yr1 s ARG 120 Ca 0.15 1.89 0.00 0.00 -0.52 0.00 0.00 55.73 57.25 1yr1 s ARG 120 Cb -0.13 -3.49 0.00 0.00 0.52 0.00 0.00 34.95 31.85 1yr1 s ARG 120 CO 0.04 -0.48 0.32 0.44 0.02 0.00 0.00 175.30 175.63 1yr1 n ILE 121 N 4.44 0.07 -3.83 1.52 -0.00 -0.76 -4.91 119.36 115.89 1yr1 n ILE 121 Ca 0.12 -0.28 -0.05 0.00 -0.00 0.00 0.00 62.75 62.54 1yr1 n ILE 121 Cb 0.44 1.40 0.01 0.00 -0.00 0.00 0.00 39.64 41.50 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 -0.07 -1.31 0.24 -1.28 0.00 -0.98 -4.22 121.76 114.15 1yr1 s ALA 122 Ca 0.00 -0.39 0.02 0.00 0.00 0.00 0.00 51.96 51.59 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 -1.03 0.18 0.71 0.00 0.00 0.00 175.76 175.61 1yr1 s TYR 123 N -2.54 1.36 -0.10 0.00 1.51 0.15 0.94 117.35 118.68 1yr1 s TYR 123 Ca 0.17 -1.47 -0.01 0.00 -1.01 0.00 0.00 57.07 54.75 1yr1 s TYR 123 Cb -0.03 -0.62 0.03 0.00 -0.11 0.00 0.00 41.96 41.23 1yr1 s TYR 123 CO 0.07 -0.71 -0.03 0.08 -1.11 0.00 0.00 175.55 173.85 1yr1 s VAL 124 N -3.92 0.66 -0.44 0.71 1.01 0.13 0.65 120.40 119.20 1yr1 s VAL 124 Ca 0.40 -0.09 -0.29 0.00 0.00 0.00 0.00 61.98 61.99 1yr1 s VAL 124 Cb 0.06 -0.78 0.03 0.00 0.00 0.00 0.00 36.38 35.68 1yr1 s VAL 124 CO 0.17 0.27 1.12 -0.47 0.00 0.00 0.00 175.10 176.19 1yr1 s TYR 125 N 1.85 2.90 -0.25 5.22 6.14 0.47 0.12 117.35 133.80 1yr1 s TYR 125 Ca 0.05 0.83 -0.20 0.00 0.64 0.00 0.00 57.07 58.39 1yr1 s TYR 125 Cb -0.13 -4.24 0.07 0.00 0.42 0.00 0.00 41.96 38.08 1yr1 s TYR 125 CO -0.07 -1.14 0.65 0.34 0.64 0.00 0.00 175.55 175.97 1yr1 s ASP 126 N 2.25 -0.75 -1.34 4.32 2.15 -0.15 -4.14 116.67 119.01 1yr1 s ASP 126 Ca 0.47 1.36 -0.06 0.00 0.43 0.00 0.00 52.55 54.74 1yr1 s ASP 126 Cb -0.08 1.32 0.02 0.00 -0.30 0.00 0.00 42.92 43.87 1yr1 s ASP 126 CO 0.28 -0.23 1.05 -1.14 -0.17 0.00 0.00 175.17 174.96 1yr1 n ARG 127 N 3.31 -6.90 -2.32 4.34 3.00 -1.26 -1.52 116.66 115.31 1yr1 n ARG 127 Ca -0.16 0.77 -0.16 0.00 -0.00 0.00 0.00 57.85 58.30 1yr1 n ARG 127 Cb 0.56 -5.74 -0.01 0.00 0.00 0.00 0.00 32.46 27.27 1yr1 n ARG 127 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 1yr1 n GLN 128 N -4.65 -1.94 -3.84 -0.14 6.02 -1.26 -4.95 117.38 106.61 1yr1 n GLN 128 Ca -0.10 0.78 -0.12 0.00 -0.01 0.00 0.00 57.00 57.55 1yr1 n GLN 128 Cb 0.60 -5.36 -0.11 0.00 1.02 0.00 0.00 30.24 26.38 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 -2.73 0.04 -0.42 5.09 2.01 -0.57 -4.66 115.64 114.39 1yr1 s THR 129 Ca 0.00 -0.29 -0.19 0.00 0.31 0.00 0.00 61.69 61.52 1yr1 s THR 129 Cb 0.00 -0.30 0.02 0.00 0.01 0.00 0.00 72.50 72.23 1yr1 s THR 129 CO 0.00 -0.16 0.52 -0.36 -0.69 0.00 0.00 174.62 173.93 1yr1 s PHE 130 N -0.52 3.13 -0.13 4.92 0.40 0.12 -0.98 117.98 124.92 1yr1 s PHE 130 Ca -0.06 -0.21 -0.27 0.00 -0.60 0.00 0.00 56.93 55.79 1yr1 s PHE 130 Cb -0.04 -3.07 -0.02 0.00 0.51 0.00 0.00 43.02 40.40 1yr1 s PHE 130 CO 0.01 -0.75 0.89 -0.06 0.70 0.00 0.00 175.22 176.01 1yr1 s PHE 131 N 2.42 3.48 0.15 0.36 0.08 0.12 -1.26 117.98 123.33 1yr1 s PHE 131 Ca 0.17 1.41 -0.32 0.00 0.12 0.00 0.00 56.93 58.31 1yr1 s PHE 131 Cb -0.16 -3.07 -0.11 0.00 -0.57 0.00 0.00 43.02 39.11 1yr1 s PHE 131 CO 0.16 -0.19 1.80 -2.30 -0.10 0.00 0.00 175.22 174.58 1yr1 n PRO 132 N 4.95 2.78 -4.13 0.24 -0.02 -1.23 0.22 135.00 137.81 1yr1 n PRO 132 Ca 0.06 1.01 -0.35 0.00 -2.02 0.00 0.00 63.50 62.20 1yr1 n PRO 132 Cb 0.49 -2.88 -0.13 0.00 -0.02 0.00 0.00 33.50 30.96 1yr1 n PRO 132 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1yr1 s LEU 133 N 2.16 3.16 0.64 2.45 0.20 0.27 -1.27 118.68 126.29 1yr1 s LEU 133 Ca 0.80 -0.23 -0.07 0.00 0.69 0.00 0.00 54.13 55.32 1yr1 s LEU 133 Cb -0.49 -1.79 0.03 0.00 -0.43 0.00 0.00 46.19 43.50 1yr1 s LEU 133 CO 0.36 0.07 0.95 -0.76 -0.29 0.00 0.00 176.35 176.68 1yr1 s LEU 134 N 0.97 3.07 0.51 -0.68 1.43 -0.90 -1.83 118.68 121.24 1yr1 s LEU 134 Ca 0.01 0.66 0.22 0.00 -1.03 0.00 0.00 54.13 53.99 1yr1 s LEU 134 Cb -0.14 -3.43 1.31 0.00 0.03 0.00 0.00 46.19 43.97 1yr1 s LEU 134 CO 0.01 -1.26 2.01 1.05 0.23 0.00 0.00 176.35 178.39 1yr1 h GLU 135 N -0.35 0.07 -0.60 1.70 4.11 -1.32 0.26 114.58 118.45 1yr1 h GLU 135 Ca -0.45 -0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.98 1yr1 h GLU 135 Cb 1.28 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.51 1yr1 h GLU 135 CO 0.61 0.05 0.00 0.27 0.07 0.00 0.00 179.01 180.00 1yr1 n ASN 136 N -4.42 2.98 0.00 3.06 6.94 -1.26 -3.91 115.26 118.65 1yr1 n ASN 136 Ca 0.08 -2.28 0.00 0.00 -0.02 0.00 0.00 54.58 52.36 1yr1 n ASN 136 Cb 0.50 -0.45 0.00 0.00 -2.36 0.00 0.00 39.78 37.47 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 0.70 3.55 4.83 0.00 0.93 -4.88 105.19 111.05 1yr1 n GLY 137 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.18 2.02 -0.00 1.61 6.06 -1.25 -4.59 118.95 122.62 1yr1 s ARG 138 Ca 0.00 1.17 -0.30 0.00 -2.50 0.00 0.00 55.73 54.10 1yr1 s ARG 138 Cb 0.00 -4.62 -0.03 0.00 0.06 0.00 0.00 34.95 30.36 1yr1 s ARG 138 CO 0.00 -3.49 0.96 -1.17 -2.50 0.00 0.00 175.30 169.10 1yr1 s LEU 139 N 12.57 4.37 -0.56 -0.88 0.20 -1.26 -2.13 118.68 130.99 1yr1 s LEU 139 Ca 0.95 1.63 -0.05 0.00 0.69 0.00 0.00 54.13 57.35 1yr1 s LEU 139 Cb -0.16 -3.54 0.15 0.00 -0.43 0.00 0.00 46.19 42.21 1yr1 s LEU 139 CO 0.22 -0.25 0.39 -0.76 -0.29 0.00 0.00 176.35 175.66 1yr1 s LEU 140 N 1.00 5.45 0.31 -0.68 1.43 -0.40 -4.91 118.68 120.88 1yr1 s LEU 140 Ca 0.51 -2.48 0.13 0.00 -1.03 0.00 0.00 54.13 51.26 1yr1 s LEU 140 Cb -0.21 -1.90 0.50 0.00 0.03 0.00 0.00 46.19 44.60 1yr1 s LEU 140 CO 0.27 -0.48 1.68 0.11 0.23 0.00 0.00 176.35 178.16 1yr1 h LYS 141 N 7.58 0.00 0.00 1.70 1.57 -1.93 -2.92 116.57 122.57 1yr1 h LYS 141 Ca -0.07 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 1yr1 h LYS 141 Cb 1.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.31 1yr1 h LYS 141 CO 0.74 0.52 -0.16 1.96 -0.57 0.00 0.00 179.45 181.94 1yr1 h GLN 142 N 0.00 0.00 -0.83 3.15 4.20 -1.99 -3.23 115.11 116.42 1yr1 h GLN 142 Ca -0.01 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.41 1yr1 h GLN 142 Cb 0.98 0.00 -0.18 0.00 0.30 0.00 0.00 27.48 28.59 1yr1 h GLN 142 CO 0.07 0.14 0.37 0.39 -0.67 0.00 0.00 178.83 179.14 1yr1 n GLU 143 N -3.13 3.33 -1.63 1.46 -0.58 -1.10 -4.99 120.64 114.00 1yr1 n GLU 143 Ca 0.03 -3.01 -0.31 0.00 -0.42 0.00 0.00 57.16 53.45 1yr1 n GLU 143 Cb 0.59 -2.20 0.05 0.00 -0.57 0.00 0.00 31.44 29.31 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 -1.05 1.75 0.16 0.62 0.00 -1.22 -4.10 107.32 103.49 1yr1 s GLY 144 Ca 0.55 0.16 0.07 0.00 0.00 0.00 0.00 44.72 45.50 1yr1 s GLY 144 CO 0.13 0.47 -0.15 -1.08 0.00 0.00 0.00 173.10 172.47 1yr1 s THR 145 N -2.92 1.58 -0.36 0.90 -1.32 -0.39 -4.87 115.64 108.26 1yr1 s THR 145 Ca 0.59 -1.94 0.05 0.00 -1.21 0.00 0.00 61.69 59.18 1yr1 s THR 145 Cb -0.15 -1.79 0.53 0.00 -1.51 0.00 0.00 72.50 69.58 1yr1 s THR 145 CO 0.52 -0.46 1.62 2.29 -2.21 0.00 0.00 174.62 176.38 1yr1 n LYS 146 N 0.16 2.42 -3.82 7.08 -0.00 -1.26 0.14 118.16 122.88 1yr1 n LYS 146 Ca -0.12 -2.27 -0.12 0.00 -0.00 0.00 0.00 58.31 55.79 1yr1 n LYS 146 Cb 0.58 -1.93 -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 -2.42 0.01 -0.15 0.58 -1.32 -1.26 -5.00 115.64 106.07 1yr1 s THR 147 Ca 0.42 -0.09 -0.29 0.00 -1.21 0.00 0.00 61.69 60.51 1yr1 s THR 147 Cb 0.35 -0.29 -0.02 0.00 -1.51 0.00 0.00 72.50 71.03 1yr1 s THR 147 CO 0.09 -0.05 1.40 0.00 -2.21 0.00 0.00 174.62 173.85 1yr1 s ALA 148 N -0.11 3.59 -0.51 11.08 0.00 -1.26 -4.70 121.76 129.85 1yr1 s ALA 148 Ca -0.02 0.55 -0.28 0.00 0.00 0.00 0.00 51.96 52.21 1yr1 s ALA 148 Cb -0.02 -3.69 0.01 0.00 0.00 0.00 0.00 23.12 19.42 1yr1 s ALA 148 CO 0.00 -1.36 1.39 -1.25 0.00 0.00 0.00 175.76 174.54 1yr1 s PRO 149 N 3.81 3.43 0.20 0.00 0.04 -1.26 -4.86 135.00 136.35 1yr1 s PRO 149 Ca 0.61 0.61 0.19 0.00 0.04 0.00 0.00 61.00 62.45 1yr1 s PRO 149 Cb -0.25 -4.07 0.86 0.00 0.04 0.00 0.00 34.50 31.08 1yr1 s PRO 149 CO 0.21 -1.77 1.58 0.45 0.04 0.00 0.00 177.00 177.51 1yr1 n SER 150 N 9.17 0.45 0.11 6.66 2.88 -1.26 -2.03 113.62 129.61 1yr1 n SER 150 Ca 0.14 0.64 -0.01 0.00 -1.33 0.00 0.00 58.87 58.30 1yr1 n SER 150 Cb 0.49 -0.72 -0.02 0.00 -0.75 0.00 0.00 64.21 63.21 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 3.32 -1.89 -3.45 116.42 105.63 1yr1 h ASP 151 Ca 0.00 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.89 1yr1 h ASP 151 Cb 0.23 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.63 1yr1 h ASP 151 CO 0.00 0.70 -0.66 0.00 -1.72 0.00 0.00 179.24 177.55 1yr1 s ALA 152 N -2.90 0.72 0.93 3.45 0.00 -0.86 -4.59 121.76 118.51 1yr1 s ALA 152 Ca 0.03 -1.35 -0.14 0.00 0.00 0.00 0.00 51.96 50.49 1yr1 s ALA 152 Cb 0.09 0.58 0.16 0.00 0.00 0.00 0.00 23.12 23.94 1yr1 s ALA 152 CO 0.77 -0.43 1.20 -1.25 0.00 0.00 0.00 175.76 176.06 1yr1 s PRO 153 N -3.98 0.98 0.12 0.00 0.04 -1.21 -4.58 135.00 126.36 1yr1 s PRO 153 Ca 0.16 -0.00 0.06 0.00 0.04 0.00 0.00 61.00 61.26 1yr1 s PRO 153 Cb 0.08 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.73 1yr1 s PRO 153 CO -0.04 -2.25 -0.14 0.08 0.04 0.00 0.00 177.00 174.69 1yr1 s VAL 154 N -3.51 1.32 -0.45 -0.36 1.01 -1.26 0.31 120.40 117.46 1yr1 s VAL 154 Ca 0.67 -1.71 -0.02 0.00 0.00 0.00 0.00 61.98 60.92 1yr1 s VAL 154 Cb -0.10 -1.52 0.12 0.00 0.00 0.00 0.00 36.38 34.88 1yr1 s VAL 154 CO 0.52 -0.41 0.23 -0.76 0.00 0.00 0.00 175.10 174.68 1yr1 s LEU 155 N -2.44 5.15 0.08 3.92 1.43 0.21 0.48 118.68 127.51 1yr1 s LEU 155 Ca 0.09 -2.25 -0.27 0.00 -1.03 0.00 0.00 54.13 50.67 1yr1 s LEU 155 Cb -0.05 -1.80 -0.06 0.00 0.03 0.00 0.00 46.19 44.31 1yr1 s LEU 155 CO 0.03 -0.48 0.86 -0.69 0.23 0.00 0.00 176.35 176.30 1yr1 s VAL 156 N 0.82 4.60 -0.33 -1.59 1.01 0.20 -0.39 120.40 124.72 1yr1 s VAL 156 Ca 0.11 1.85 -0.05 0.00 0.00 0.00 0.00 61.98 63.88 1yr1 s VAL 156 Cb -0.22 -4.22 0.01 0.00 0.00 0.00 0.00 36.38 31.95 1yr1 s VAL 156 CO -0.04 0.35 0.18 0.61 0.00 0.00 0.00 175.10 176.19 1yr1 n GLY 157 N 2.28 -3.25 2.94 4.51 0.00 -1.26 -2.26 105.19 108.15 1yr1 n GLY 157 Ca -0.00 0.69 -0.14 0.00 0.00 0.00 0.00 46.02 46.56 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 -1.88 -0.43 -0.10 1.61 0.52 -1.26 -4.42 118.94 112.97 1yr1 s TRP 158 Ca 0.08 0.79 0.13 0.00 0.02 0.00 0.00 56.10 57.11 1yr1 s TRP 158 Cb -0.02 -0.10 -0.18 0.00 -1.15 0.00 0.00 33.47 32.01 1yr1 s TRP 158 CO 0.75 -0.45 0.12 1.63 0.02 0.00 0.00 176.95 179.02 1yr1 n LYS 159 N 5.35 1.45 -3.20 4.98 5.02 -1.26 -4.84 118.16 125.66 1yr1 n LYS 159 Ca -0.06 -0.04 -0.46 0.00 -2.02 0.00 0.00 58.31 55.74 1yr1 n LYS 159 Cb 0.50 -1.35 -0.03 0.00 -0.02 0.00 0.00 35.03 34.13 1yr1 n LYS 159 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1yr1 s ASP 160 N -4.41 6.45 0.66 4.39 1.01 -1.26 -4.89 116.67 118.62 1yr1 s ASP 160 Ca -0.06 -2.02 0.39 0.00 0.71 0.00 0.00 52.55 51.57 1yr1 s ASP 160 Cb 0.05 -2.27 2.17 0.00 1.01 0.00 0.00 42.92 43.88 1yr1 s ASP 160 CO 0.57 -0.88 2.25 1.23 0.21 0.00 0.00 175.17 178.55 1yr1 h GLY 161 N 9.10 0.00 1.04 0.21 0.00 -1.99 0.17 103.07 111.60 1yr1 h GLY 161 Ca -0.09 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 1yr1 h GLY 161 CO 0.97 0.00 0.28 -0.55 0.00 0.00 0.00 176.54 177.24 1yr1 h ASP 162 N 0.00 1.04 0.19 0.19 5.19 -1.98 0.13 116.42 121.17 1yr1 h ASP 162 Ca 0.01 -0.18 -0.15 0.00 -0.62 0.00 0.00 57.03 56.09 1yr1 h ASP 162 Cb 0.18 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.41 1yr1 h ASP 162 CO -0.00 0.94 -0.55 0.00 -3.12 0.00 0.00 179.24 176.51 1yr1 h ALA 163 N 1.14 0.82 0.15 3.45 0.00 -1.10 -2.82 119.26 120.90 1yr1 h ALA 163 Ca 0.25 -0.51 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1yr1 h ALA 163 Cb 0.24 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1yr1 h ALA 163 CO -0.02 0.69 -0.07 0.82 0.00 0.00 0.00 179.25 180.67 1yr1 h ILE 164 N 0.30 0.91 -0.54 0.00 2.04 -0.62 -2.09 117.51 117.49 1yr1 h ILE 164 Ca 0.01 -0.23 0.13 0.00 1.00 0.00 0.00 64.86 65.76 1yr1 h ILE 164 Cb 1.05 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 38.16 1yr1 h ILE 164 CO 0.09 0.05 0.38 0.00 0.00 0.00 0.00 178.15 178.67 1yr1 h ALA 165 N 0.53 2.28 0.03 1.87 0.00 -0.73 -0.58 119.26 122.65 1yr1 h ALA 165 Ca -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1yr1 h ALA 165 Cb 0.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1yr1 h ALA 165 CO 0.03 -0.42 -0.01 0.93 0.00 0.00 0.00 179.25 179.78 1yr1 h GLU 166 N 0.17 -0.04 0.23 0.00 4.39 -1.18 -0.61 114.58 117.54 1yr1 h GLU 166 Ca 0.26 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.95 1yr1 h GLU 166 Cb 0.79 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.44 1yr1 h GLU 166 CO -0.04 0.31 -0.13 0.52 -1.16 0.00 0.00 179.01 178.51 1yr1 h MET 167 N -0.39 -0.32 -0.52 2.33 2.86 -0.62 -2.04 114.93 116.22 1yr1 h MET 167 Ca -0.00 0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.72 1yr1 h MET 167 Cb 0.36 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.07 1yr1 h MET 167 CO 0.01 -0.21 0.35 1.79 1.06 0.00 0.00 176.91 179.90 1yr1 h THR 168 N -0.33 0.97 -0.89 2.22 1.35 -1.19 -0.58 112.91 114.46 1yr1 h THR 168 Ca -0.03 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1yr1 h THR 168 Cb 0.27 0.48 -0.04 0.00 -1.73 0.00 0.00 68.15 67.12 1yr1 h THR 168 CO 0.04 0.08 0.57 1.23 -0.25 0.00 0.00 175.52 177.19 1yr1 h GLY 169 N 0.45 1.27 1.54 5.82 0.00 -0.42 -0.15 103.07 111.58 1yr1 h GLY 169 Ca 0.23 -0.49 -0.09 0.00 0.00 0.00 0.00 47.33 46.97 1yr1 h GLY 169 CO -0.06 0.48 -0.20 1.46 0.00 0.00 0.00 176.54 178.22 1yr1 h GLN 170 N 1.22 0.54 0.00 4.80 1.08 -0.57 -2.56 115.11 119.62 1yr1 h GLN 170 Ca 0.32 -0.19 -0.10 0.00 -1.45 0.00 0.00 58.65 57.23 1yr1 h GLN 170 Cb -0.11 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.27 1yr1 h GLN 170 CO -0.07 0.72 -0.47 -0.07 -0.95 0.00 0.00 178.83 177.98 1yr1 h LEU 171 N 0.49 0.00 -1.12 1.46 4.07 -0.72 -0.97 115.31 118.53 1yr1 h LEU 171 Ca 0.08 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.04 1yr1 h LEU 171 Cb 0.62 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.36 1yr1 h LEU 171 CO 0.04 0.47 0.00 0.00 -1.08 0.00 0.00 178.44 177.88 1yr1 h ALA 172 N 1.53 1.00 0.00 1.53 0.00 -0.63 -3.26 119.26 119.42 1yr1 h ALA 172 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.56 1yr1 h ALA 172 Cb 0.90 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.62 1yr1 h ALA 172 CO 0.06 0.00 -2.29 -0.85 0.00 0.00 0.00 179.25 176.17 1yr1 n GLU 173 N -2.79 0.56 -1.60 0.00 0.28 -1.01 -5.01 120.64 111.07 1yr1 n GLU 173 Ca 0.01 0.14 -0.32 0.00 -0.16 0.00 0.00 57.16 56.83 1yr1 n GLU 173 Cb 0.29 -1.44 0.06 0.00 1.43 0.00 0.00 31.44 31.78 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 -6.41 3.24 -0.08 -1.84 0.05 -0.40 -4.92 118.68 108.32 1yr1 s LEU 174 Ca -0.31 1.86 -0.37 0.00 0.05 0.00 0.00 54.13 55.37 1yr1 s LEU 174 Cb 0.08 -4.53 -0.14 0.00 -2.05 0.00 0.00 46.19 39.55 1yr1 s LEU 174 CO 0.51 -1.68 1.67 -2.65 -0.55 0.00 0.00 176.35 173.64 1yr1 n PRO 175 N -2.85 1.60 -0.29 1.48 -0.02 -1.26 -4.84 135.00 128.81 1yr1 n PRO 175 Ca 0.09 0.58 0.19 0.00 -2.02 0.00 0.00 63.50 62.35 1yr1 n PRO 175 Cb 0.53 -2.32 0.48 0.00 -0.02 0.00 0.00 33.50 32.17 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 6.98 2.13 -0.56 3.55 0.00 -1.91 0.10 119.26 129.55 1yr1 h ALA 176 Ca -0.47 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 1yr1 h ALA 176 Cb 1.30 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1yr1 h ALA 176 CO 0.91 -0.48 0.17 0.00 0.00 0.00 0.00 179.25 179.85 1yr1 h ALA 177 N 1.62 0.74 0.53 0.00 0.00 -1.93 0.39 119.26 120.60 1yr1 h ALA 177 Ca 0.54 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.23 1yr1 h ALA 177 Cb 1.26 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1yr1 h ALA 177 CO -0.25 0.41 -0.31 0.28 0.00 0.00 0.00 179.25 179.37 1yr1 h VAL 178 N 0.79 0.36 0.00 0.00 2.07 -1.03 0.60 116.25 119.04 1yr1 h VAL 178 Ca 0.18 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.70 1yr1 h VAL 178 Cb 0.29 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1yr1 h VAL 178 CO -0.01 0.00 0.00 0.00 0.02 0.00 0.00 177.57 177.58 1yr1 n LEU 179 N -5.45 0.50 0.05 2.57 -0.00 -0.82 -1.81 117.00 112.05 1yr1 n LEU 179 Ca -0.12 0.64 0.12 0.00 -0.00 0.00 0.00 56.01 56.65 1yr1 n LEU 179 Cb 0.34 -0.60 0.15 0.00 -0.00 0.00 0.00 43.42 43.31 1yr1 n LEU 179 CO 0.35 -0.57 0.28 0.61 -0.00 0.00 0.00 177.39 178.06 1yr1 n GLY 180 N -0.29 -1.35 3.34 1.47 0.00 0.14 -3.35 105.19 105.15 1yr1 n GLY 180 Ca 0.02 -0.30 -0.44 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.79 4.22 0.00 4.61 0.00 0.07 -4.65 120.51 122.98 1yr1 n ALA 181 Ca 0.03 -4.46 0.00 0.00 0.00 0.00 0.00 53.44 49.01 1yr1 n ALA 181 Cb 0.43 -2.76 0.00 0.00 0.00 0.00 0.00 19.45 17.12 1yr1 n ALA 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yr1 n MET 182 N 4.01 0.00 -0.08 0.00 0.00 -1.26 -3.29 117.12 116.49 1yr1 n MET 182 Ca 0.31 0.00 -0.19 0.00 0.00 0.00 0.00 57.70 57.83 1yr1 n MET 182 Cb 0.40 0.00 -0.12 0.00 0.00 0.00 0.00 33.22 33.50 1yr1 n MET 182 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 1yr1 h SER 183 N 0.00 0.02 -4.50 3.17 0.87 -0.24 -3.43 113.55 109.44 1yr1 h SER 183 Ca 0.00 -0.73 0.10 0.00 -1.23 0.00 0.00 61.79 59.93 1yr1 h SER 183 Cb 0.00 -0.01 -0.18 0.00 -0.44 0.00 0.00 62.40 61.78 1yr1 h SER 183 CO 0.00 1.29 0.50 -1.83 -0.53 0.00 0.00 176.83 176.27 1yr1 s GLU 184 N -2.31 0.75 -0.13 2.24 -1.05 -1.25 -4.24 118.70 112.71 1yr1 s GLU 184 Ca -0.24 -0.15 -0.05 0.00 -0.15 0.00 0.00 54.97 54.38 1yr1 s GLU 184 Cb 0.02 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 34.02 1yr1 s GLU 184 CO 0.64 -0.30 0.04 0.42 0.95 0.00 0.00 175.26 177.01 1yr1 s ILE 185 N -2.46 4.65 -0.19 1.83 1.01 0.18 -1.08 121.20 125.14 1yr1 s ILE 185 Ca 0.03 -0.10 -0.06 0.00 0.00 0.00 0.00 60.65 60.51 1yr1 s ILE 185 Cb -0.01 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.40 1yr1 s ILE 185 CO -0.05 0.55 0.03 -1.00 0.00 0.00 0.00 174.94 174.46 1yr1 s HIS 186 N -0.35 3.13 -0.44 3.97 3.76 0.17 0.61 115.29 126.15 1yr1 s HIS 186 Ca 0.08 -0.17 -0.29 0.00 -0.15 0.00 0.00 55.06 54.54 1yr1 s HIS 186 Cb -0.12 -2.07 0.03 0.00 1.11 0.00 0.00 32.58 31.53 1yr1 s HIS 186 CO 0.02 -0.02 1.12 -0.47 -0.85 0.00 0.00 174.74 174.53 1yr1 s TYR 187 N 0.63 2.90 -0.48 1.40 5.04 -0.96 0.08 117.35 125.96 1yr1 s TYR 187 Ca 0.01 0.83 0.06 0.00 -2.44 0.00 0.00 57.07 55.53 1yr1 s TYR 187 Cb -0.14 -4.25 0.22 0.00 0.35 0.00 0.00 41.96 38.15 1yr1 s TYR 187 CO 0.02 -1.15 0.52 1.63 -1.34 0.00 0.00 175.55 175.23 1yr1 n LYS 188 N 7.59 1.09 -1.22 4.97 5.02 -0.49 -4.96 118.16 130.16 1yr1 n LYS 188 Ca 0.12 -3.65 -0.31 0.00 -2.02 0.00 0.00 58.31 52.45 1yr1 n LYS 188 Cb 0.49 -1.66 0.10 0.00 -0.02 0.00 0.00 35.03 33.93 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 -1.18 2.17 0.08 1.97 0.04 -1.11 -4.39 135.00 132.57 1yr1 s PRO 189 Ca 0.34 1.19 -0.02 0.00 0.04 0.00 0.00 61.00 62.56 1yr1 s PRO 189 Cb 0.11 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.73 1yr1 s PRO 189 CO -0.12 -1.71 0.02 0.95 0.04 0.00 0.00 177.00 176.18 1yr1 s THR 190 N -2.89 0.17 0.59 1.26 -4.23 0.33 -4.93 115.64 105.94 1yr1 s THR 190 Ca 0.61 -1.81 0.28 0.00 -1.18 0.00 0.00 61.69 59.60 1yr1 s THR 190 Cb -0.17 -1.71 0.37 0.00 1.34 0.00 0.00 72.50 72.32 1yr1 s THR 190 CO 0.56 -0.77 2.01 0.08 -0.54 0.00 0.00 174.62 175.96 1yr1 h ARG 191 N 3.01 0.00 0.00 3.99 0.11 -1.98 -0.07 114.38 119.44 1yr1 h ARG 191 Ca -0.34 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.72 1yr1 h ARG 191 Cb 1.17 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.24 1yr1 h ARG 191 CO 0.63 0.00 -1.89 0.39 0.10 0.00 0.00 179.97 179.19 1yr1 n GLU 192 N -3.78 0.60 -3.44 0.08 -0.58 -1.26 -4.74 120.64 107.53 1yr1 n GLU 192 Ca 0.05 -0.17 -0.27 0.00 -0.42 0.00 0.00 57.16 56.35 1yr1 n GLU 192 Cb 0.48 -1.46 -0.10 0.00 -0.57 0.00 0.00 31.44 29.80 1yr1 n GLU 192 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1yr1 n TYR 193 N -2.19 0.16 0.28 -0.32 4.01 -0.10 -4.95 117.16 114.05 1yr1 n TYR 193 Ca -0.05 -3.58 0.18 0.00 -0.16 0.00 0.00 57.90 54.30 1yr1 n TYR 193 Cb 0.53 -0.06 0.91 0.00 -0.31 0.00 0.00 39.34 40.41 1yr1 n TYR 193 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1yr1 h GLU 194 N 5.16 0.00 -0.81 -0.72 5.08 -1.69 0.13 114.58 121.74 1yr1 h GLU 194 Ca 0.20 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.99 1yr1 h GLU 194 Cb 0.86 0.00 -0.37 0.00 0.50 0.00 0.00 28.75 29.74 1yr1 h GLU 194 CO 0.48 0.00 -0.22 -0.25 -1.00 0.00 0.00 179.01 178.01 1yr1 n ASP 195 N -3.28 5.73 -4.60 1.42 8.00 -1.26 -4.60 116.55 117.95 1yr1 n ASP 195 Ca -0.00 -3.77 -0.42 0.00 0.71 0.00 0.00 54.79 51.31 1yr1 n ASP 195 Cb 0.32 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 40.80 1yr1 n ASP 195 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1yr1 s ARG 196 N -3.66 3.89 -0.04 -1.24 3.52 -0.38 -0.20 118.95 120.83 1yr1 s ARG 196 Ca 0.55 0.51 0.06 0.00 -0.13 0.00 0.00 55.73 56.72 1yr1 s ARG 196 Cb 0.44 -3.76 -0.01 0.00 -1.56 0.00 0.00 34.95 30.06 1yr1 s ARG 196 CO 0.02 -0.75 -0.23 0.14 -0.81 0.00 0.00 175.30 173.66 1yr1 s VAL 197 N 3.05 1.90 -0.35 7.11 -7.23 0.18 -1.40 120.40 123.66 1yr1 s VAL 197 Ca 0.33 -1.00 -0.09 0.00 -1.81 0.00 0.00 61.98 59.41 1yr1 s VAL 197 Cb -0.14 -1.60 0.03 0.00 0.56 0.00 0.00 36.38 35.24 1yr1 s VAL 197 CO 0.14 0.53 0.15 -0.63 -0.31 0.00 0.00 175.10 174.99 1yr1 s ILE 198 N -0.30 4.24 0.41 -0.62 -1.09 0.11 0.23 121.20 124.18 1yr1 s ILE 198 Ca 0.02 -0.91 -0.13 0.00 -2.23 0.00 0.00 60.65 57.40 1yr1 s ILE 198 Cb -0.12 -3.34 -0.08 0.00 -1.58 0.00 0.00 42.46 37.35 1yr1 s ILE 198 CO 0.02 -0.16 0.81 0.68 -1.23 0.00 0.00 174.94 175.06 1yr1 s VAL 199 N 1.50 4.69 -0.35 2.92 -7.23 0.87 0.43 120.40 123.24 1yr1 s VAL 199 Ca 0.01 0.85 -0.05 0.00 -1.81 0.00 0.00 61.98 60.99 1yr1 s VAL 199 Cb -0.19 -3.69 0.06 0.00 0.56 0.00 0.00 36.38 33.12 1yr1 s VAL 199 CO 0.05 -0.46 0.11 -0.31 -0.31 0.00 0.00 175.10 174.18 1yr1 s TYR 200 N -2.32 3.33 0.60 2.82 1.51 -0.24 -0.90 117.35 122.15 1yr1 s TYR 200 Ca 0.54 -1.76 -0.19 0.00 -1.01 0.00 0.00 57.07 54.65 1yr1 s TYR 200 Cb -0.10 -2.50 -0.05 0.00 -0.11 0.00 0.00 41.96 39.20 1yr1 s TYR 200 CO 0.27 -0.81 1.02 -0.12 -1.11 0.00 0.00 175.55 174.80 1yr1 n MET 201 N 4.73 0.98 0.26 -0.62 1.56 -0.23 0.37 117.12 124.17 1yr1 n MET 201 Ca -0.10 0.38 0.13 0.00 -0.27 0.00 0.00 57.70 57.84 1yr1 n MET 201 Cb 0.43 -2.22 0.71 0.00 2.15 0.00 0.00 33.22 34.29 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 0.58 0.00 1.05 6.12 -1.07 -1.81 -1.87 115.58 118.58 1yr1 h ASN 202 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.88 1yr1 h ASN 202 Cb 1.36 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.61 1yr1 h ASN 202 CO 0.52 0.12 0.00 0.47 0.07 0.00 0.00 177.43 178.61 1yr1 n ASP 203 N -3.53 0.52 0.00 6.14 9.92 -1.26 -4.88 116.55 123.46 1yr1 n ASP 203 Ca -0.01 0.58 0.00 0.00 -0.53 0.00 0.00 54.79 54.83 1yr1 n ASP 203 Cb 0.26 -0.71 0.00 0.00 -0.64 0.00 0.00 41.12 40.03 1yr1 n ASP 203 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1yr1 n GLY 204 N 0.80 1.33 3.94 0.44 0.00 -0.70 -5.12 105.19 105.88 1yr1 n GLY 204 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 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 2.16 -0.10 1.61 2.02 -1.24 -4.93 117.35 114.86 1yr1 s TYR 205 Ca 0.00 -0.62 0.01 0.00 -0.37 0.00 0.00 57.07 56.09 1yr1 s TYR 205 Cb 0.00 -2.15 0.02 0.00 -0.40 0.00 0.00 41.96 39.43 1yr1 s TYR 205 CO 0.00 -0.50 -0.11 -2.00 -1.57 0.00 0.00 175.55 171.37 1yr1 s GLU 206 N -4.33 1.80 0.23 -0.62 2.12 -1.26 -1.07 118.70 115.57 1yr1 s GLU 206 Ca 0.49 -0.39 0.09 0.00 0.36 0.00 0.00 54.97 55.52 1yr1 s GLU 206 Cb -0.05 -1.65 -0.05 0.00 0.26 0.00 0.00 34.13 32.64 1yr1 s GLU 206 CO 0.30 -0.14 -0.16 0.08 -0.54 0.00 0.00 175.26 174.79 1yr1 s VAL 207 N 1.24 1.98 0.05 3.70 1.01 -0.08 -4.97 120.40 123.32 1yr1 s VAL 207 Ca -0.03 -2.26 0.09 0.00 0.00 0.00 0.00 61.98 59.78 1yr1 s VAL 207 Cb -0.14 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1yr1 s VAL 207 CO -0.04 -0.52 -0.24 -0.94 0.00 0.00 0.00 175.10 173.36 1yr1 s SER 208 N -3.34 3.35 -0.09 3.32 1.04 -1.26 -0.09 113.70 116.63 1yr1 s SER 208 Ca 0.24 -0.55 -0.31 0.00 0.48 0.00 0.00 55.95 55.81 1yr1 s SER 208 Cb -0.02 -0.37 0.09 0.00 0.10 0.00 0.00 66.02 65.81 1yr1 s SER 208 CO 0.09 0.25 0.79 0.00 0.98 0.00 0.00 173.24 175.36 1yr1 s ALA 209 N -0.85 -1.83 0.04 5.32 0.00 0.14 -4.91 121.76 119.67 1yr1 s ALA 209 Ca 0.13 1.43 -0.04 0.00 0.00 0.00 0.00 51.96 53.48 1yr1 s ALA 209 Cb -0.10 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.69 1yr1 s ALA 209 CO 0.03 -0.35 0.26 0.95 0.00 0.00 0.00 175.76 176.65 1yr1 s THR 210 N -1.11 5.33 0.56 0.00 -4.23 -1.26 0.48 115.64 115.40 1yr1 s THR 210 Ca -0.07 -0.05 0.24 0.00 -1.18 0.00 0.00 61.69 60.63 1yr1 s THR 210 Cb -0.00 -3.59 0.33 0.00 1.34 0.00 0.00 72.50 70.58 1yr1 s THR 210 CO 0.07 0.24 2.15 0.40 -0.54 0.00 0.00 174.62 176.94 1yr1 h ILE 211 N 2.59 0.69 -0.05 2.99 2.04 -0.96 1.07 117.51 125.89 1yr1 h ILE 211 Ca -0.48 0.00 -0.16 0.00 1.00 0.00 0.00 64.86 65.22 1yr1 h ILE 211 Cb 1.18 0.93 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 1yr1 h ILE 211 CO 0.70 0.00 -0.68 0.08 0.00 0.00 0.00 178.15 178.25 1yr1 h ARG 212 N 0.00 0.23 -0.34 2.37 0.11 -1.93 -3.32 114.38 111.50 1yr1 h ARG 212 Ca 0.05 -0.19 -0.27 0.00 0.10 0.00 0.00 59.98 59.68 1yr1 h ARG 212 Cb 0.25 0.04 -0.32 0.00 1.11 0.00 0.00 29.97 31.04 1yr1 h ARG 212 CO -0.00 0.83 -0.89 1.04 0.10 0.00 0.00 179.97 181.05 1yr1 n GLN 213 N -3.81 1.87 0.08 0.08 6.02 -0.46 -4.88 117.38 116.28 1yr1 n GLN 213 Ca -0.03 -3.33 -0.12 0.00 -0.01 0.00 0.00 57.00 53.51 1yr1 n GLN 213 Cb 0.67 -1.46 -0.06 0.00 1.02 0.00 0.00 30.24 30.42 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 1.81 -0.29 -0.34 1.08 3.04 0.10 0.84 116.94 123.19 1yr1 h PHE 214 Ca 0.02 0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.98 1yr1 h PHE 214 Cb 1.43 0.12 -0.02 0.00 2.56 0.00 0.00 35.95 40.04 1yr1 h PHE 214 CO 0.59 -0.17 0.20 0.00 -2.02 0.00 0.00 178.31 176.90 1yr1 h ALA 215 N 0.70 0.42 -0.61 2.41 0.00 -1.84 -1.53 119.26 118.80 1yr1 h ALA 215 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1yr1 h ALA 215 Cb 0.24 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1yr1 h ALA 215 CO -0.07 -0.15 0.27 0.22 0.00 0.00 0.00 179.25 179.52 1yr1 h ASP 216 N 0.41 0.82 -0.17 0.00 3.58 -1.86 0.87 116.42 120.07 1yr1 h ASP 216 Ca 0.13 -0.15 0.05 0.00 0.42 0.00 0.00 57.03 57.48 1yr1 h ASP 216 Cb -0.01 -0.21 -0.06 0.00 1.72 0.00 0.00 39.33 40.77 1yr1 h ASP 216 CO -0.06 0.74 -0.24 0.11 -2.88 0.00 0.00 179.24 176.91 1yr1 h LYS 217 N 0.84 -0.28 0.00 0.28 1.79 0.12 -1.45 116.57 117.88 1yr1 h LYS 217 Ca 0.21 0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.67 1yr1 h LYS 217 Cb 0.16 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.86 1yr1 h LYS 217 CO -0.02 -0.19 -0.17 -0.07 -1.08 0.00 0.00 179.45 177.92 1yr1 h LEU 218 N -0.29 0.00 -1.62 2.94 -0.00 -1.15 -3.24 115.31 111.96 1yr1 h LEU 218 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.00 1yr1 h LEU 218 Cb 0.46 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.10 1yr1 h LEU 218 CO -0.34 0.12 0.26 -1.28 -0.00 0.00 0.00 178.44 177.20 1yr1 h SER 219 N 0.00 0.45 0.00 -0.43 0.87 0.18 0.20 113.55 114.82 1yr1 h SER 219 Ca -0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.55 1yr1 h SER 219 Cb 1.10 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.94 1yr1 h SER 219 CO 0.02 0.32 0.00 1.41 -0.53 0.00 0.00 176.83 178.05 1yr1 n HIS 220 N -4.48 0.00 -3.39 2.24 8.25 -0.83 -4.60 115.22 112.40 1yr1 n HIS 220 Ca 0.03 0.00 -0.44 0.00 -0.26 0.00 0.00 57.72 57.05 1yr1 n HIS 220 Cb 0.06 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.11 1yr1 n HIS 220 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1yr1 s TYR 221 N -2.00 3.32 0.34 4.41 6.14 0.06 -4.92 117.35 124.69 1yr1 s TYR 221 Ca 0.28 -1.50 0.22 0.00 0.64 0.00 0.00 57.07 56.70 1yr1 s TYR 221 Cb 0.13 -3.70 1.08 0.00 0.42 0.00 0.00 41.96 39.89 1yr1 s TYR 221 CO 0.21 -1.01 1.93 -1.00 0.64 0.00 0.00 175.55 176.32 1yr1 h PRO 222 N 8.72 0.00 0.09 4.97 0.13 -1.84 -1.91 132.00 142.16 1yr1 h PRO 222 Ca -0.26 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1yr1 h PRO 222 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1yr1 h PRO 222 CO 0.98 0.23 -0.04 0.00 -0.23 0.00 0.00 178.00 178.93 1yr1 h ALA 223 N 1.77 -0.12 0.25 -0.56 0.00 -1.95 0.25 119.26 118.89 1yr1 h ALA 223 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1yr1 h ALA 223 Cb 0.54 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1yr1 h ALA 223 CO 0.03 -0.39 -0.12 0.82 0.00 0.00 0.00 179.25 179.59 1yr1 h ILE 224 N -0.48 0.81 -0.52 0.00 2.04 -1.89 -2.33 117.51 115.14 1yr1 h ILE 224 Ca -0.01 -0.41 0.15 0.00 1.00 0.00 0.00 64.86 65.59 1yr1 h ILE 224 Cb 0.40 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.51 1yr1 h ILE 224 CO 0.02 0.09 0.40 0.00 0.00 0.00 0.00 178.15 178.66 1yr1 h ALA 225 N 0.16 2.44 -0.71 1.87 0.00 -1.40 0.11 119.26 121.73 1yr1 h ALA 225 Ca -0.03 -0.02 0.21 0.00 0.00 0.00 0.00 54.91 55.06 1yr1 h ALA 225 Cb 0.40 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1yr1 h ALA 225 CO 0.06 -0.67 0.57 0.00 0.00 0.00 0.00 179.25 179.21 1yr1 h ALA 226 N 1.70 2.59 -0.60 0.00 0.00 0.08 0.42 119.26 123.44 1yr1 h ALA 226 Ca 0.25 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 55.31 1yr1 h ALA 226 Cb 1.04 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1yr1 h ALA 226 CO -0.00 -0.94 0.54 0.00 0.00 0.00 0.00 179.25 178.85 1yr1 h ALA 227 N 1.52 2.42 0.02 0.00 0.00 -0.86 0.87 119.26 123.23 1yr1 h ALA 227 Ca 0.34 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 55.02 1yr1 h ALA 227 Cb 1.48 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1yr1 h ALA 227 CO -0.00 -0.85 -0.94 -0.07 0.00 0.00 0.00 179.25 177.39 1yr1 h LEU 228 N 0.00 0.23 0.57 0.00 3.38 -0.36 -3.33 115.31 115.80 1yr1 h LEU 228 Ca 0.29 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1yr1 h LEU 228 Cb 1.36 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 42.04 1yr1 h LEU 228 CO -0.00 1.04 -0.27 0.44 0.09 0.00 0.00 178.44 179.74 1yr1 h ASP 229 N 0.08 -0.64 -2.55 -0.43 3.32 0.67 -3.46 116.42 113.41 1yr1 h ASP 229 Ca -0.05 -0.04 -0.36 0.00 0.02 0.00 0.00 57.03 56.60 1yr1 h ASP 229 Cb 1.60 0.17 -0.06 0.00 0.22 0.00 0.00 39.33 41.25 1yr1 h ASP 229 CO 0.14 -0.30 -0.41 -1.14 -1.72 0.00 0.00 179.24 175.81 1yr1 n ARG 230 N -5.33 -1.71 0.09 3.56 0.63 -0.83 -4.65 116.66 108.43 1yr1 n ARG 230 Ca -0.11 0.92 0.00 0.00 -0.92 0.00 0.00 57.85 57.74 1yr1 n ARG 230 Cb 0.34 -5.45 0.00 0.00 0.45 0.00 0.00 32.46 27.79 1yr1 n ARG 230 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1yr1 n ASN 231 N -1.61 -0.63 -4.77 6.15 2.85 -1.26 -5.11 115.26 110.88 1yr1 n ASN 231 Ca -0.20 0.32 -0.38 0.00 -0.11 0.00 0.00 54.58 54.21 1yr1 n ASN 231 Cb 0.63 0.74 -0.05 0.00 1.24 0.00 0.00 39.78 42.35 1yr1 n ASN 231 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1yr1 s VAL 232 N -2.00 3.77 0.00 3.44 1.01 -1.26 -5.25 120.40 120.11 1yr1 s VAL 232 Ca 0.00 1.53 0.00 0.00 0.00 0.00 0.00 61.98 63.51 1yr1 s VAL 232 Cb 0.00 -3.87 0.00 0.00 0.00 0.00 0.00 36.38 32.51 1yr1 s VAL 232 CO 0.00 0.17 0.00 1.17 0.00 0.00 0.00 175.10 176.44