#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ry4 s SER 129 N 0.00 6.19 -0.13 1.61 0.01 -1.26 -4.76 113.70 115.36 1ry4 s SER 129 Ca 0.00 -1.44 -0.03 0.00 1.31 0.00 0.00 55.95 55.79 1ry4 s SER 129 Cb 0.00 -2.25 -0.07 0.00 0.21 0.00 0.00 66.02 63.91 1ry4 s SER 129 CO 0.00 -0.92 -0.14 0.29 0.41 0.00 0.00 173.24 172.88 1ry4 n LYS 130 N 5.77 0.29 -4.29 12.44 5.02 -1.26 -4.99 118.16 131.14 1ry4 n LYS 130 Ca -0.11 0.10 -0.32 0.00 -2.02 0.00 0.00 58.31 55.95 1ry4 n LYS 130 Cb 0.42 -1.09 -0.09 0.00 -0.02 0.00 0.00 35.03 34.25 1ry4 n LYS 130 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1ry4 s THR 131 N -2.24 4.09 -0.71 -0.18 -1.32 -1.26 -5.07 115.64 108.95 1ry4 s THR 131 Ca -0.17 -0.65 -0.02 0.00 -1.21 0.00 0.00 61.69 59.64 1ry4 s THR 131 Cb 0.06 -2.83 0.18 0.00 -1.51 0.00 0.00 72.50 68.40 1ry4 s THR 131 CO 0.25 0.36 0.54 -0.54 -2.21 0.00 0.00 174.62 173.03 1ry4 s LYS 132 N -1.59 2.78 -0.25 7.08 1.02 -1.26 -4.99 119.74 122.52 1ry4 s LYS 132 Ca 0.20 -2.79 0.02 0.00 0.02 0.00 0.00 55.97 53.41 1ry4 s LYS 132 Cb -0.11 -3.79 0.06 0.00 -0.52 0.00 0.00 37.83 33.47 1ry4 s LYS 132 CO 0.10 -1.21 -0.06 0.00 -0.92 0.00 0.00 175.35 173.27 1ry4 s ALA 133 N -0.51 2.24 -0.15 5.17 0.00 -1.26 -5.09 121.76 122.17 1ry4 s ALA 133 Ca 0.20 -1.61 -0.29 0.00 0.00 0.00 0.00 51.96 50.26 1ry4 s ALA 133 Cb -0.16 -1.54 -0.05 0.00 0.00 0.00 0.00 23.12 21.38 1ry4 s ALA 133 CO -0.06 -1.25 1.82 -2.14 0.00 0.00 0.00 175.76 174.12 1ry4 s PRO 134 N 1.26 3.78 -0.84 0.00 0.02 -1.26 -4.90 135.00 133.05 1ry4 s PRO 134 Ca -0.05 2.00 -0.25 0.00 0.02 0.00 0.00 61.00 62.72 1ry4 s PRO 134 Cb -0.19 -4.13 0.01 0.00 0.02 0.00 0.00 34.50 30.21 1ry4 s PRO 134 CO -0.07 -1.34 1.60 -1.12 -0.33 0.00 0.00 177.00 175.75 1ry4 s SER 135 N 5.01 5.86 0.21 2.53 0.01 -1.26 -4.60 113.70 121.45 1ry4 s SER 135 Ca 0.81 -0.67 0.00 0.00 1.31 0.00 0.00 55.95 57.40 1ry4 s SER 135 Cb -0.31 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.36 1ry4 s SER 135 CO 0.33 -2.05 0.00 -0.38 0.41 0.00 0.00 173.24 171.55 1ry4 n ILE 136 N 7.05 -2.80 -4.00 1.44 5.41 -1.26 -4.96 119.36 120.24 1ry4 n ILE 136 Ca 0.24 1.00 -0.31 0.00 1.00 0.00 0.00 62.75 64.68 1ry4 n ILE 136 Cb 0.50 -1.44 -0.15 0.00 -0.71 0.00 0.00 39.64 37.84 1ry4 n ILE 136 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1ry4 s SER 137 N -2.44 4.68 -0.23 4.38 0.15 -1.26 -5.09 113.70 113.89 1ry4 s SER 137 Ca 0.00 -2.06 -0.16 0.00 0.70 0.00 0.00 55.95 54.43 1ry4 s SER 137 Cb 0.00 -1.56 -0.04 0.00 -1.71 0.00 0.00 66.02 62.71 1ry4 s SER 137 CO 0.00 -0.37 0.40 -0.51 1.20 0.00 0.00 173.24 173.96 1ry4 s ILE 138 N 0.97 5.18 0.15 6.45 2.07 -1.26 -5.05 121.20 129.72 1ry4 s ILE 138 Ca 0.10 0.67 -0.31 0.00 -1.41 0.00 0.00 60.65 59.70 1ry4 s ILE 138 Cb -0.19 -3.72 -0.09 0.00 0.13 0.00 0.00 42.46 38.59 1ry4 s ILE 138 CO -0.09 0.21 1.41 -2.84 -1.91 0.00 0.00 174.94 171.72 1ry4 s PRO 139 N 1.63 4.31 0.48 3.50 0.02 -1.26 -4.99 135.00 138.69 1ry4 s PRO 139 Ca 0.18 2.14 -0.20 0.00 0.02 0.00 0.00 61.00 63.14 1ry4 s PRO 139 Cb -0.15 -3.21 -0.09 0.00 0.02 0.00 0.00 34.50 31.07 1ry4 s PRO 139 CO 0.08 -0.43 1.02 -1.01 -0.33 0.00 0.00 177.00 176.33 1ry4 s HIS 140 N 0.84 3.08 0.48 6.54 3.76 -1.26 -5.01 115.29 123.72 1ry4 s HIS 140 Ca 0.64 1.58 -0.12 0.00 -0.15 0.00 0.00 55.06 57.01 1ry4 s HIS 140 Cb -0.38 -3.00 -0.06 0.00 1.11 0.00 0.00 32.58 30.24 1ry4 s HIS 140 CO 0.33 -0.65 0.88 -0.51 -0.85 0.00 0.00 174.74 173.94 1ry4 s ASP 141 N -2.08 6.49 -0.30 1.40 1.01 -1.26 -5.01 116.67 116.93 1ry4 s ASP 141 Ca 0.66 1.31 -0.23 0.00 0.71 0.00 0.00 52.55 54.99 1ry4 s ASP 141 Cb -0.14 -2.40 -0.00 0.00 1.01 0.00 0.00 42.92 41.38 1ry4 s ASP 141 CO 0.19 -0.55 0.77 -0.36 0.21 0.00 0.00 175.17 175.43 1ry4 s PHE 142 N -2.60 3.22 -1.34 4.23 0.08 -1.26 -4.93 117.98 115.36 1ry4 s PHE 142 Ca 0.54 0.82 -0.12 0.00 0.12 0.00 0.00 56.93 58.29 1ry4 s PHE 142 Cb -0.10 -3.17 0.12 0.00 -0.57 0.00 0.00 43.02 39.30 1ry4 s PHE 142 CO 0.36 -0.53 1.98 0.54 -0.10 0.00 0.00 175.22 177.46 1ry4 n ARG 143 N 6.14 3.32 -2.91 0.44 1.74 -1.26 -4.91 116.66 119.21 1ry4 n ARG 143 Ca 0.03 -3.20 -0.26 0.00 -0.77 0.00 0.00 57.85 53.66 1ry4 n ARG 143 Cb 0.48 -3.08 -0.00 0.00 -1.02 0.00 0.00 32.46 28.84 1ry4 n ARG 143 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1ry4 s GLN 144 N 1.59 3.50 0.47 5.56 -0.21 -1.26 -5.09 119.66 124.22 1ry4 s GLN 144 Ca 0.43 -0.02 -0.15 0.00 0.02 0.00 0.00 55.36 55.64 1ry4 s GLN 144 Cb 0.10 -2.48 -0.08 0.00 1.00 0.00 0.00 33.01 31.55 1ry4 s GLN 144 CO -0.03 -0.08 0.91 0.14 -2.12 0.00 0.00 175.29 174.11 1ry4 s VAL 145 N -2.59 4.60 -0.18 1.09 -7.23 -1.26 -4.97 120.40 109.87 1ry4 s VAL 145 Ca 0.45 1.05 -0.29 0.00 -1.81 0.00 0.00 61.98 61.38 1ry4 s VAL 145 Cb -0.10 -3.71 -0.04 0.00 0.56 0.00 0.00 36.38 33.09 1ry4 s VAL 145 CO 0.41 -0.59 1.79 -0.55 -0.31 0.00 0.00 175.10 175.86 1ry4 s SER 146 N -3.00 6.21 -0.35 4.85 0.15 -1.26 -4.93 113.70 115.38 1ry4 s SER 146 Ca 0.57 1.84 -0.09 0.00 0.70 0.00 0.00 55.95 58.97 1ry4 s SER 146 Cb -0.10 -2.53 0.03 0.00 -1.71 0.00 0.00 66.02 61.71 1ry4 s SER 146 CO 0.29 -1.36 0.15 0.00 1.20 0.00 0.00 173.24 173.53 1ry4 s ALA 147 N 5.68 3.18 -0.14 5.45 0.00 -1.26 -5.05 121.76 129.61 1ry4 s ALA 147 Ca 0.80 -1.66 -0.25 0.00 0.00 0.00 0.00 51.96 50.85 1ry4 s ALA 147 Cb -0.29 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.39 1ry4 s ALA 147 CO 0.32 -1.26 0.83 -1.50 0.00 0.00 0.00 175.76 174.15 1ry4 s ILE 148 N 1.51 4.90 0.32 0.00 1.10 -1.26 -5.04 121.20 122.73 1ry4 s ILE 148 Ca 0.01 1.64 -0.12 0.00 -0.51 0.00 0.00 60.65 61.67 1ry4 s ILE 148 Cb -0.19 -4.14 -0.08 0.00 0.15 0.00 0.00 42.46 38.21 1ry4 s ILE 148 CO 0.05 0.06 0.69 -0.63 -2.11 0.00 0.00 174.94 173.00 1ry4 s ILE 149 N 1.90 4.80 -0.03 2.00 -1.09 -1.26 -4.78 121.20 122.75 1ry4 s ILE 149 Ca 0.39 0.67 -0.02 0.00 -2.23 0.00 0.00 60.65 59.46 1ry4 s ILE 149 Cb -0.17 -3.66 0.01 0.00 -1.58 0.00 0.00 42.46 37.06 1ry4 s ILE 149 CO 0.14 -0.26 0.04 0.47 -1.23 0.00 0.00 174.94 174.10 1ry4 n ASP 150 N -0.62 -3.56 -0.30 3.58 8.00 -1.26 -4.92 116.55 117.47 1ry4 n ASP 150 Ca 0.02 0.69 -0.04 0.00 0.71 0.00 0.00 54.79 56.17 1ry4 n ASP 150 Cb 0.53 -2.76 0.08 0.00 -0.02 0.00 0.00 41.12 38.95 1ry4 n ASP 150 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1ry4 h VAL 151 N 1.74 1.20 -3.35 2.53 3.04 -2.06 -3.34 116.25 116.01 1ry4 h VAL 151 Ca -0.10 -0.37 -0.68 0.00 -1.01 0.00 0.00 66.70 64.54 1ry4 h VAL 151 Cb 0.22 0.02 -0.18 0.00 -2.01 0.00 0.00 31.29 29.35 1ry4 h VAL 151 CO 0.00 0.20 0.03 -0.62 -1.01 0.00 0.00 177.57 176.17 1ry4 s ASP 152 N -5.92 6.24 -0.24 3.17 2.15 -1.26 -5.02 116.67 115.78 1ry4 s ASP 152 Ca -0.13 -0.77 -0.15 0.00 0.43 0.00 0.00 52.55 51.93 1ry4 s ASP 152 Cb 0.16 -2.29 -0.04 0.00 -0.30 0.00 0.00 42.92 40.45 1ry4 s ASP 152 CO 0.79 -0.83 0.36 -0.63 -0.17 0.00 0.00 175.17 174.69 1ry4 s ILE 153 N 2.60 5.20 -0.47 4.11 1.01 -1.26 -5.03 121.20 127.36 1ry4 s ILE 153 Ca 0.16 0.58 -0.10 0.00 0.00 0.00 0.00 60.65 61.29 1ry4 s ILE 153 Cb -0.18 -3.69 0.11 0.00 0.01 0.00 0.00 42.46 38.71 1ry4 s ILE 153 CO 0.13 0.21 0.35 0.54 0.00 0.00 0.00 174.94 176.17 1ry4 s VAL 154 N 1.70 4.35 0.55 2.92 0.11 -1.26 -5.07 120.40 123.69 1ry4 s VAL 154 Ca 0.16 -1.66 -0.18 0.00 -2.93 0.00 0.00 61.98 57.37 1ry4 s VAL 154 Cb -0.15 -3.81 -0.06 0.00 -1.53 0.00 0.00 36.38 30.84 1ry4 s VAL 154 CO 0.09 -0.72 1.05 -2.84 -3.33 0.00 0.00 175.10 169.34 1ry4 s PRO 155 N 1.41 3.53 -1.03 1.54 0.02 -1.26 -4.90 135.00 134.30 1ry4 s PRO 155 Ca 0.05 1.27 -0.25 0.00 0.02 0.00 0.00 61.00 62.09 1ry4 s PRO 155 Cb -0.26 -2.06 -0.15 0.00 0.02 0.00 0.00 34.50 32.05 1ry4 s PRO 155 CO 0.00 -0.65 2.11 -1.21 -0.33 0.00 0.00 177.00 176.92 1ry4 s GLU 156 N -3.72 1.74 -0.44 5.54 8.01 -1.26 -4.86 118.70 123.71 1ry4 s GLU 156 Ca 0.65 -0.43 -0.27 0.00 0.01 0.00 0.00 54.97 54.93 1ry4 s GLU 156 Cb -0.16 -5.02 0.03 0.00 -4.31 0.00 0.00 34.13 24.66 1ry4 s GLU 156 CO 0.30 -4.69 1.01 0.99 0.01 0.00 0.00 175.26 172.88 1ry4 s THR 157 N 14.31 4.39 -0.45 3.63 2.01 -1.26 -4.96 115.64 133.31 1ry4 s THR 157 Ca 0.79 1.04 -0.27 0.00 0.31 0.00 0.00 61.69 63.56 1ry4 s THR 157 Cb -0.06 -4.48 0.03 0.00 0.01 0.00 0.00 72.50 68.00 1ry4 s THR 157 CO 0.13 -0.83 1.03 -1.00 -0.69 0.00 0.00 174.62 173.26 1ry4 s HIS 158 N 3.96 2.90 -0.32 4.92 3.76 -1.26 -4.29 115.29 124.96 1ry4 s HIS 158 Ca 0.42 0.62 -0.17 0.00 -0.15 0.00 0.00 55.06 55.78 1ry4 s HIS 158 Cb -0.09 -4.14 -0.01 0.00 1.11 0.00 0.00 32.58 29.44 1ry4 s HIS 158 CO 0.26 -1.13 0.47 0.50 -0.85 0.00 0.00 174.74 173.99 1ry4 s ARG 159 N 4.05 3.76 -0.24 1.40 3.52 0.73 -4.90 118.95 127.27 1ry4 s ARG 159 Ca 0.43 -0.08 0.01 0.00 -0.13 0.00 0.00 55.73 55.96 1ry4 s ARG 159 Cb -0.09 -3.75 0.06 0.00 -1.56 0.00 0.00 34.95 29.61 1ry4 s ARG 159 CO 0.27 -0.51 -0.05 1.03 -0.81 0.00 0.00 175.30 175.24 1ry4 s ARG 160 N 2.27 1.60 -0.16 5.12 0.52 -1.26 -0.05 118.95 127.00 1ry4 s ARG 160 Ca 0.17 -1.01 -0.06 0.00 -0.52 0.00 0.00 55.73 54.32 1ry4 s ARG 160 Cb -0.16 -2.59 -0.04 0.00 0.52 0.00 0.00 34.95 32.69 1ry4 s ARG 160 CO 0.12 -0.61 0.03 0.14 0.02 0.00 0.00 175.30 175.00 1ry4 s VAL 161 N 1.39 4.54 0.08 3.52 -7.23 -0.80 -4.91 120.40 116.99 1ry4 s VAL 161 Ca -0.05 -0.13 0.07 0.00 -1.81 0.00 0.00 61.98 60.06 1ry4 s VAL 161 Cb -0.19 -3.01 -0.04 0.00 0.56 0.00 0.00 36.38 33.71 1ry4 s VAL 161 CO -0.07 0.50 -0.15 -0.13 -0.31 0.00 0.00 175.10 174.95 1ry4 s ARG 162 N 0.06 2.03 -0.14 4.82 0.52 -1.26 -1.15 118.95 123.83 1ry4 s ARG 162 Ca 0.04 -1.04 0.00 0.00 -0.52 0.00 0.00 55.73 54.21 1ry4 s ARG 162 Cb -0.13 -2.22 0.02 0.00 0.52 0.00 0.00 34.95 33.15 1ry4 s ARG 162 CO 0.01 0.52 -0.12 -0.51 0.02 0.00 0.00 175.30 175.22 1ry4 s LEU 163 N -1.88 1.50 -0.27 2.53 1.43 0.14 -4.99 118.68 117.15 1ry4 s LEU 163 Ca 0.18 -0.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.89 1ry4 s LEU 163 Cb -0.11 -1.06 0.07 0.00 0.03 0.00 0.00 46.19 45.12 1ry4 s LEU 163 CO 0.09 -0.08 -0.08 -1.48 0.23 0.00 0.00 176.35 175.04 1ry4 s LEU 164 N 1.57 3.63 -0.13 1.79 0.05 -1.26 -1.51 118.68 122.82 1ry4 s LEU 164 Ca 0.05 -1.52 -0.29 0.00 0.05 0.00 0.00 54.13 52.41 1ry4 s LEU 164 Cb -0.13 -1.54 -0.02 0.00 -2.05 0.00 0.00 46.19 42.45 1ry4 s LEU 164 CO -0.10 -0.23 1.27 -1.59 -0.55 0.00 0.00 176.35 175.16 1ry4 s LYS 165 N 1.08 4.26 -0.30 1.48 0.00 -1.26 -4.88 119.74 120.13 1ry4 s LYS 165 Ca -0.05 1.70 -0.12 0.00 0.00 0.00 0.00 55.97 57.50 1ry4 s LYS 165 Cb -0.20 -3.72 0.18 0.00 0.00 0.00 0.00 37.83 34.09 1ry4 s LYS 165 CO -0.06 -0.65 1.05 -3.38 0.00 0.00 0.00 175.35 172.31 1ry4 s HIS 166 N 3.20 -0.52 0.00 1.78 -3.43 -1.26 -4.94 115.29 110.12 1ry4 s HIS 166 Ca 0.56 0.43 0.00 0.00 -0.80 0.00 0.00 55.06 55.26 1ry4 s HIS 166 Cb -0.23 0.14 0.00 0.00 -1.43 0.00 0.00 32.58 31.06 1ry4 s HIS 166 CO 0.17 -0.29 0.00 0.41 -2.00 0.00 0.00 174.74 173.03 1ry4 n GLY 167 N 5.33 0.66 3.55 -1.38 0.00 -1.26 -4.98 105.19 107.11 1ry4 n GLY 167 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1ry4 n GLY 167 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ry4 s SER 168 N -2.30 -0.36 -0.84 1.61 0.01 -1.26 -5.09 113.70 105.46 1ry4 s SER 168 Ca 0.00 -0.35 -0.06 0.00 1.31 0.00 0.00 55.95 56.85 1ry4 s SER 168 Cb 0.00 0.61 0.21 0.00 0.21 0.00 0.00 66.02 67.06 1ry4 s SER 168 CO 0.00 -1.08 0.74 -0.62 0.41 0.00 0.00 173.24 172.69 1ry4 s ASP 169 N -2.84 6.22 0.00 2.44 2.15 -1.26 -4.72 116.67 118.66 1ry4 s ASP 169 Ca 0.07 -3.21 0.00 0.00 0.43 0.00 0.00 52.55 49.84 1ry4 s ASP 169 Cb -0.02 -2.02 0.00 0.00 -0.30 0.00 0.00 42.92 40.58 1ry4 s ASP 169 CO -0.04 -0.35 0.00 2.29 -0.17 0.00 0.00 175.17 176.90 1ry4 n LYS 170 N 3.12 -0.96 -2.58 4.34 2.85 -1.26 -4.86 118.16 118.81 1ry4 n LYS 170 Ca 0.16 1.03 -0.41 0.00 -1.05 0.00 0.00 58.31 58.04 1ry4 n LYS 170 Cb 0.40 -0.79 -0.03 0.00 -0.65 0.00 0.00 35.03 33.96 1ry4 n LYS 170 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 1ry4 s PRO 171 N -0.24 3.22 -0.66 -1.58 0.05 -1.26 -4.95 135.00 129.58 1ry4 s PRO 171 Ca 0.00 -0.22 -0.27 0.00 0.05 0.00 0.00 61.00 60.56 1ry4 s PRO 171 Cb 0.00 -4.16 -0.01 0.00 0.05 0.00 0.00 34.50 30.38 1ry4 s PRO 171 CO 0.00 -2.07 1.69 -0.51 0.05 0.00 0.00 177.00 176.16 1ry4 s LEU 172 N 5.53 3.25 -0.50 -3.56 1.02 -1.26 -4.83 118.68 118.33 1ry4 s LEU 172 Ca 0.35 0.07 -0.02 0.00 0.02 0.00 0.00 54.13 54.55 1ry4 s LEU 172 Cb -0.09 -2.54 0.24 0.00 0.02 0.00 0.00 46.19 43.83 1ry4 s LEU 172 CO 0.16 -2.23 2.23 0.61 0.02 0.00 0.00 176.35 177.15 1ry4 n GLY 173 N 5.65 4.76 3.61 -3.19 0.00 -1.26 -4.81 105.19 109.94 1ry4 n GLY 173 Ca 0.16 -1.77 -0.09 0.00 0.00 0.00 0.00 46.02 44.32 1ry4 n GLY 173 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ry4 s PHE 174 N -2.54 -0.35 0.01 1.61 -0.71 -1.26 -1.07 117.98 113.67 1ry4 s PHE 174 Ca 0.49 0.72 0.01 0.00 -1.04 0.00 0.00 56.93 57.11 1ry4 s PHE 174 Cb 0.37 0.43 -0.01 0.00 -1.21 0.00 0.00 43.02 42.59 1ry4 s PHE 174 CO -0.12 -0.25 -0.05 0.71 -1.34 0.00 0.00 175.22 174.18 1ry4 s TYR 175 N -0.54 0.42 0.16 3.49 2.02 -0.63 -4.99 117.35 117.28 1ry4 s TYR 175 Ca 0.02 -0.24 0.09 0.00 -0.37 0.00 0.00 57.07 56.56 1ry4 s TYR 175 Cb -0.02 -0.27 -0.04 0.00 -0.40 0.00 0.00 41.96 41.23 1ry4 s TYR 175 CO -0.03 -0.05 -0.19 0.96 -1.57 0.00 0.00 175.55 174.67 1ry4 s ILE 176 N -0.61 1.84 0.05 2.71 -5.25 -1.26 0.03 121.20 118.72 1ry4 s ILE 176 Ca -0.04 -1.86 -0.02 0.00 -0.99 0.00 0.00 60.65 57.74 1ry4 s ILE 176 Cb -0.05 -1.82 -0.03 0.00 2.95 0.00 0.00 42.46 43.51 1ry4 s ILE 176 CO -0.00 -0.26 0.01 -0.13 -1.79 0.00 0.00 174.94 172.77 1ry4 s ARG 177 N -2.64 0.62 0.05 0.37 1.81 -0.37 -4.80 118.95 113.98 1ry4 s ARG 177 Ca 0.15 -1.10 -0.30 0.00 -1.72 0.00 0.00 55.73 52.76 1ry4 s ARG 177 Cb -0.07 0.22 -0.04 0.00 -0.45 0.00 0.00 34.95 34.61 1ry4 s ARG 177 CO 0.06 -0.13 0.98 0.34 -0.68 0.00 0.00 175.30 175.87 1ry4 s ASP 178 N -2.73 7.41 0.09 0.23 2.15 -1.26 -1.36 116.67 121.20 1ry4 s ASP 178 Ca 0.04 1.73 -0.00 0.00 0.43 0.00 0.00 52.55 54.74 1ry4 s ASP 178 Cb 0.05 -2.58 0.00 0.00 -0.30 0.00 0.00 42.92 40.10 1ry4 s ASP 178 CO -0.09 -0.19 0.12 0.61 -0.17 0.00 0.00 175.17 175.45 1ry4 n GLY 179 N 2.63 2.93 3.20 2.66 0.00 -0.29 -4.92 105.19 111.39 1ry4 n GLY 179 Ca 0.05 -1.45 -0.24 0.00 0.00 0.00 0.00 46.02 44.37 1ry4 n GLY 179 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ry4 s THR 180 N -2.52 1.45 -0.18 2.61 2.01 -1.26 -1.51 115.64 116.25 1ry4 s THR 180 Ca 0.07 -0.99 0.01 0.00 0.31 0.00 0.00 61.69 61.10 1ry4 s THR 180 Cb -0.00 -1.25 0.02 0.00 0.01 0.00 0.00 72.50 71.28 1ry4 s THR 180 CO 0.05 0.24 -0.19 -0.55 -0.69 0.00 0.00 174.62 173.47 1ry4 s SER 181 N -0.88 3.13 -0.22 3.53 0.15 0.79 -4.85 113.70 115.35 1ry4 s SER 181 Ca 0.06 -0.66 -0.17 0.00 0.70 0.00 0.00 55.95 55.89 1ry4 s SER 181 Cb -0.08 -1.46 -0.04 0.00 -1.71 0.00 0.00 66.02 62.74 1ry4 s SER 181 CO 0.01 -0.01 0.44 0.54 1.20 0.00 0.00 173.24 175.42 1ry4 s VAL 182 N 1.30 5.15 0.28 4.45 0.11 -1.26 -0.13 120.40 130.30 1ry4 s VAL 182 Ca 0.05 0.77 0.11 0.00 -2.93 0.00 0.00 61.98 59.97 1ry4 s VAL 182 Cb -0.13 -3.76 -0.05 0.00 -1.53 0.00 0.00 36.38 30.91 1ry4 s VAL 182 CO -0.13 0.19 -0.13 0.00 -3.33 0.00 0.00 175.10 171.71 1ry4 s ARG 183 N 1.66 1.91 -0.44 1.54 1.70 0.13 -4.91 118.95 120.55 1ry4 s ARG 183 Ca 0.20 -1.64 -0.16 0.00 -0.47 0.00 0.00 55.73 53.66 1ry4 s ARG 183 Cb -0.15 -1.92 0.04 0.00 -0.57 0.00 0.00 34.95 32.35 1ry4 s ARG 183 CO 0.09 0.34 0.37 0.54 -1.08 0.00 0.00 175.30 175.56 1ry4 s VAL 184 N -2.44 5.21 0.54 4.99 0.11 -1.26 -0.40 120.40 127.15 1ry4 s VAL 184 Ca 0.31 -0.73 0.06 0.00 -2.93 0.00 0.00 61.98 58.68 1ry4 s VAL 184 Cb -0.05 -4.03 0.04 0.00 -1.53 0.00 0.00 36.38 30.81 1ry4 s VAL 184 CO 0.17 -0.44 0.47 0.42 -3.33 0.00 0.00 175.10 172.39 1ry4 s THR 185 N 1.78 1.77 -0.18 5.04 -4.23 0.17 -4.95 115.64 115.04 1ry4 s THR 185 Ca 0.06 -1.41 0.29 0.00 -1.18 0.00 0.00 61.69 59.45 1ry4 s THR 185 Cb -0.20 -2.18 0.32 0.00 1.34 0.00 0.00 72.50 71.78 1ry4 s THR 185 CO 0.10 0.00 1.85 0.00 -0.54 0.00 0.00 174.62 176.03 1ry4 h ALA 186 N 0.67 1.00 -0.01 3.99 0.00 -2.04 -0.53 119.26 122.34 1ry4 h ALA 186 Ca -0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1ry4 h ALA 186 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1ry4 h ALA 186 CO 0.55 0.00 -0.19 0.43 0.00 0.00 0.00 179.25 180.04 1ry4 n SER 187 N -2.66 0.81 0.00 0.00 7.64 -1.26 -5.04 113.62 113.10 1ry4 n SER 187 Ca 0.01 -0.78 0.00 0.00 1.01 0.00 0.00 58.87 59.11 1ry4 n SER 187 Cb 0.26 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 1ry4 n SER 187 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ry4 n GLY 188 N 1.31 -0.34 3.55 0.23 0.00 -0.21 -4.90 105.19 104.82 1ry4 n GLY 188 Ca 0.13 -2.15 -0.43 0.00 0.00 0.00 0.00 46.02 43.58 1ry4 n GLY 188 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1ry4 s LEU 189 N 0.00 3.94 0.18 0.99 0.05 -1.26 0.41 118.68 122.99 1ry4 s LEU 189 Ca 0.00 -0.13 0.07 0.00 0.05 0.00 0.00 54.13 54.12 1ry4 s LEU 189 Cb 0.00 -3.00 -0.04 0.00 -2.05 0.00 0.00 46.19 41.10 1ry4 s LEU 189 CO 0.00 -1.24 0.03 -1.61 -0.55 0.00 0.00 176.35 172.98 1ry4 s GLU 190 N 4.13 2.50 -0.09 1.48 0.41 0.47 -4.86 118.70 122.74 1ry4 s GLU 190 Ca 0.35 -1.09 -0.02 0.00 -0.41 0.00 0.00 54.97 53.79 1ry4 s GLU 190 Cb -0.11 -2.40 -0.03 0.00 -1.78 0.00 0.00 34.13 29.81 1ry4 s GLU 190 CO 0.22 0.45 0.02 -1.59 -0.49 0.00 0.00 175.26 173.87 1ry4 s LYS 191 N -3.07 3.05 0.00 1.61 -2.85 -1.26 0.21 119.74 117.43 1ry4 s LYS 191 Ca 0.29 -0.38 0.05 0.00 -1.00 0.00 0.00 55.97 54.93 1ry4 s LYS 191 Cb -0.09 -2.84 -0.02 0.00 -2.06 0.00 0.00 37.83 32.82 1ry4 s LYS 191 CO 0.20 0.70 -0.16 -1.14 0.10 0.00 0.00 175.35 175.05 1ry4 s GLN 192 N -0.86 1.22 0.06 1.78 2.00 0.81 -4.94 119.66 119.73 1ry4 s GLN 192 Ca 0.13 -0.64 -0.31 0.00 -2.00 0.00 0.00 55.36 52.54 1ry4 s GLN 192 Cb -0.11 -1.21 -0.08 0.00 0.80 0.00 0.00 33.01 32.41 1ry4 s GLN 192 CO 0.02 0.32 1.58 -2.14 -0.50 0.00 0.00 175.29 174.58 1ry4 s PRO 193 N -0.60 4.22 -0.02 1.67 0.02 -1.26 -0.15 135.00 138.88 1ry4 s PRO 193 Ca 0.05 2.25 -0.01 0.00 0.02 0.00 0.00 61.00 63.31 1ry4 s PRO 193 Cb -0.07 -3.55 0.02 0.00 0.02 0.00 0.00 34.50 30.92 1ry4 s PRO 193 CO 0.00 -0.68 0.03 0.20 -0.33 0.00 0.00 177.00 176.22 1ry4 s GLY 194 N 2.16 0.03 -0.23 0.52 0.00 -0.57 -2.83 107.32 106.40 1ry4 s GLY 194 Ca 0.71 0.21 -0.17 0.00 0.00 0.00 0.00 44.72 45.47 1ry4 s GLY 194 CO 0.31 0.38 0.47 -0.42 0.00 0.00 0.00 173.10 173.84 1ry4 s ILE 195 N 0.52 5.12 0.29 0.90 -1.09 -1.26 -1.14 121.20 124.54 1ry4 s ILE 195 Ca -0.04 0.82 0.08 0.00 -2.23 0.00 0.00 60.65 59.28 1ry4 s ILE 195 Cb -0.06 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 36.99 1ry4 s ILE 195 CO -0.02 0.15 0.19 -0.36 -1.23 0.00 0.00 174.94 173.67 1ry4 s PHE 196 N 1.89 2.93 0.22 3.97 0.08 -0.47 -1.51 117.98 125.09 1ry4 s PHE 196 Ca 0.21 -0.22 -0.30 0.00 0.12 0.00 0.00 56.93 56.74 1ry4 s PHE 196 Cb -0.15 -1.52 -0.08 0.00 -0.57 0.00 0.00 43.02 40.69 1ry4 s PHE 196 CO 0.09 0.41 1.17 0.42 -0.10 0.00 0.00 175.22 177.21 1ry4 s ILE 197 N -2.26 3.54 0.07 0.64 1.01 -1.13 -1.23 121.20 121.84 1ry4 s ILE 197 Ca 0.36 1.37 -0.01 0.00 0.00 0.00 0.00 60.65 62.36 1ry4 s ILE 197 Cb -0.06 -3.87 -0.00 0.00 0.01 0.00 0.00 42.46 38.53 1ry4 s ILE 197 CO 0.24 0.25 -0.03 -0.24 0.00 0.00 0.00 174.94 175.17 1ry4 n SER 198 N 2.06 1.07 -4.37 3.58 2.88 0.11 -4.59 113.62 114.35 1ry4 n SER 198 Ca 0.02 0.14 -0.23 0.00 -1.33 0.00 0.00 58.87 57.47 1ry4 n SER 198 Cb 0.45 -0.34 -0.11 0.00 -0.75 0.00 0.00 64.21 63.46 1ry4 n SER 198 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1ry4 s ARG 199 N -1.96 1.39 -0.02 -1.46 0.52 -1.13 -5.00 118.95 111.28 1ry4 s ARG 199 Ca -0.02 -1.49 0.05 0.00 -0.52 0.00 0.00 55.73 53.75 1ry4 s ARG 199 Cb 0.00 -1.52 -0.01 0.00 0.52 0.00 0.00 34.95 33.95 1ry4 s ARG 199 CO 0.03 0.31 -0.17 -0.51 0.02 0.00 0.00 175.30 174.98 1ry4 s LEU 200 N -2.79 2.00 -0.21 2.53 1.43 -1.26 -1.61 118.68 118.77 1ry4 s LEU 200 Ca 0.19 -0.32 -0.11 0.00 -1.03 0.00 0.00 54.13 52.86 1ry4 s LEU 200 Cb -0.06 -0.90 -0.05 0.00 0.03 0.00 0.00 46.19 45.21 1ry4 s LEU 200 CO 0.08 0.19 0.16 -0.69 0.23 0.00 0.00 176.35 176.32 1ry4 s VAL 201 N -0.28 5.38 0.13 -1.59 1.01 -1.26 -5.04 120.40 118.74 1ry4 s VAL 201 Ca 0.04 0.22 -0.32 0.00 0.00 0.00 0.00 61.98 61.92 1ry4 s VAL 201 Cb -0.08 -3.50 -0.12 0.00 0.00 0.00 0.00 36.38 32.69 1ry4 s VAL 201 CO 0.00 0.40 1.76 -0.81 0.00 0.00 0.00 175.10 176.46 1ry4 n PRO 202 N 3.77 2.59 -1.45 2.72 -0.04 -1.26 -1.47 135.00 139.86 1ry4 n PRO 202 Ca -0.15 0.94 0.00 0.00 -0.04 0.00 0.00 63.50 64.25 1ry4 n PRO 202 Cb 0.52 -2.79 0.00 0.00 -0.04 0.00 0.00 33.50 31.19 1ry4 n PRO 202 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ry4 n GLY 203 N 4.01 0.97 3.74 0.55 0.00 -1.26 -5.08 105.19 108.11 1ry4 n GLY 203 Ca 0.18 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.58 1ry4 n GLY 203 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ry4 s GLY 204 N -2.57 1.72 0.07 -0.02 0.00 -0.54 -4.86 107.32 101.13 1ry4 s GLY 204 Ca 0.00 -1.67 -0.17 0.00 0.00 0.00 0.00 44.72 42.89 1ry4 s GLY 204 CO 0.00 -1.66 1.35 1.41 0.00 0.00 0.00 173.10 174.19 1ry4 h LEU 205 N 1.61 0.65 -0.89 0.66 3.38 -1.40 -1.02 115.31 118.31 1ry4 h LEU 205 Ca -0.45 -0.53 -0.09 0.00 0.09 0.00 0.00 57.88 56.91 1ry4 h LEU 205 Cb 1.25 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1ry4 h LEU 205 CO 0.61 1.05 -0.41 0.00 0.09 0.00 0.00 178.44 179.78 1ry4 h ALA 206 N 0.62 0.98 -0.25 1.53 0.00 -1.65 -1.14 119.26 119.35 1ry4 h ALA 206 Ca 0.02 -0.37 -0.06 0.00 0.00 0.00 0.00 54.91 54.49 1ry4 h ALA 206 Cb 0.92 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1ry4 h ALA 206 CO 0.08 0.51 -0.07 1.49 0.00 0.00 0.00 179.25 181.26 1ry4 h GLU 207 N 0.00 0.49 -0.60 0.00 4.81 -1.70 0.01 114.58 117.59 1ry4 h GLU 207 Ca -0.00 -0.19 -0.06 0.00 -0.13 0.00 0.00 59.36 58.97 1ry4 h GLU 207 Cb 0.94 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.27 1ry4 h GLU 207 CO 0.05 0.72 0.11 1.03 -0.73 0.00 0.00 179.01 180.20 1ry4 h SER 208 N 0.23 0.90 0.59 1.04 0.87 -0.94 -1.86 113.55 114.38 1ry4 h SER 208 Ca 0.06 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1ry4 h SER 208 Cb 0.55 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1ry4 h SER 208 CO 0.03 0.89 0.00 0.35 -0.53 0.00 0.00 176.83 177.57 1ry4 n THR 209 N -4.24 0.05 -0.05 2.23 -2.24 -0.45 -4.69 114.28 104.88 1ry4 n THR 209 Ca 0.04 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1ry4 n THR 209 Cb 0.26 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 1ry4 n THR 209 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ry4 n GLY 210 N 1.20 0.66 0.01 3.38 0.00 -0.02 -3.11 105.19 107.31 1ry4 n GLY 210 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 1ry4 n GLY 210 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ry4 n LEU 211 N 2.73 0.00 -4.66 0.99 4.77 -1.26 -4.89 117.00 114.67 1ry4 n LEU 211 Ca 0.00 -0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.68 1ry4 n LEU 211 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 1ry4 n LEU 211 CO 0.18 0.00 -0.35 -0.76 -1.33 0.00 0.00 177.39 175.12 1ry4 s LEU 212 N -4.40 3.37 0.51 2.23 1.02 -1.18 -5.12 118.68 115.11 1ry4 s LEU 212 Ca -0.07 -0.22 -0.04 0.00 0.02 0.00 0.00 54.13 53.81 1ry4 s LEU 212 Cb 0.13 -2.11 -0.02 0.00 0.02 0.00 0.00 46.19 44.21 1ry4 s LEU 212 CO 0.84 0.18 0.80 0.00 0.02 0.00 0.00 176.35 178.18 1ry4 s ALA 213 N -1.29 3.43 -0.33 4.21 0.00 -1.26 -4.95 121.76 121.57 1ry4 s ALA 213 Ca 0.25 -0.67 0.26 0.00 0.00 0.00 0.00 51.96 51.79 1ry4 s ALA 213 Cb -0.12 -2.50 1.09 0.00 0.00 0.00 0.00 23.12 21.59 1ry4 s ALA 213 CO 0.17 -0.50 1.78 0.28 0.00 0.00 0.00 175.76 177.49 1ry4 h VAL 214 N 0.13 0.00 0.00 0.00 2.07 -1.97 -2.54 116.25 113.94 1ry4 h VAL 214 Ca -0.46 -0.28 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 1ry4 h VAL 214 Cb 1.23 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.05 1ry4 h VAL 214 CO 0.61 0.00 -0.18 0.78 0.02 0.00 0.00 177.57 178.80 1ry4 h ASN 215 N 0.00 0.00 -4.27 0.57 2.35 -1.93 -3.15 115.58 109.15 1ry4 h ASN 215 Ca 0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 1ry4 h ASN 215 Cb 0.38 0.00 0.19 0.00 0.05 0.00 0.00 38.32 38.93 1ry4 h ASN 215 CO 0.00 0.18 0.24 -1.81 -1.65 0.00 0.00 177.43 174.39 1ry4 s ASP 216 N -6.11 3.18 0.00 5.81 1.01 -0.96 -4.70 116.67 114.90 1ry4 s ASP 216 Ca -0.00 2.15 0.01 0.00 0.71 0.00 0.00 52.55 55.41 1ry4 s ASP 216 Cb 0.11 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 1ry4 s ASP 216 CO 0.61 -2.93 0.04 -1.61 0.21 0.00 0.00 175.17 171.49 1ry4 s GLU 217 N -4.66 2.91 0.13 8.23 2.02 -0.57 -2.83 118.70 123.93 1ry4 s GLU 217 Ca 0.66 -0.56 -0.17 0.00 0.02 0.00 0.00 54.97 54.93 1ry4 s GLU 217 Cb -0.22 -2.75 -0.07 0.00 0.10 0.00 0.00 34.13 31.18 1ry4 s GLU 217 CO 0.57 0.63 0.57 0.14 0.02 0.00 0.00 175.26 177.19 1ry4 s VAL 218 N -1.15 4.79 -0.05 2.63 -7.23 -0.57 0.02 120.40 118.84 1ry4 s VAL 218 Ca 0.21 1.01 -0.03 0.00 -1.81 0.00 0.00 61.98 61.36 1ry4 s VAL 218 Cb -0.12 -3.80 -0.03 0.00 0.56 0.00 0.00 36.38 32.99 1ry4 s VAL 218 CO 0.12 0.35 -0.08 -0.38 -0.31 0.00 0.00 175.10 174.80 1ry4 n ILE 219 N 1.13 0.54 -4.11 -0.62 -0.00 0.13 -4.61 119.36 111.82 1ry4 n ILE 219 Ca -0.07 -0.01 -0.13 0.00 -0.00 0.00 0.00 62.75 62.54 1ry4 n ILE 219 Cb 0.51 -1.62 -0.11 0.00 -0.00 0.00 0.00 39.64 38.42 1ry4 n ILE 219 CO 0.00 0.00 0.00 -1.61 -0.00 0.00 0.00 176.55 174.94 1ry4 s GLU 220 N -2.14 0.66 -0.40 0.38 2.02 -1.24 -0.09 118.70 117.88 1ry4 s GLU 220 Ca -0.09 -0.97 0.01 0.00 0.02 0.00 0.00 54.97 53.95 1ry4 s GLU 220 Cb 0.03 -0.31 0.11 0.00 0.10 0.00 0.00 34.13 34.06 1ry4 s GLU 220 CO 0.11 0.04 0.15 0.08 0.02 0.00 0.00 175.26 175.67 1ry4 s VAL 221 N -2.11 2.77 0.00 2.63 1.01 0.17 -0.15 120.40 124.72 1ry4 s VAL 221 Ca -0.02 -2.39 0.00 0.00 0.00 0.00 0.00 61.98 59.57 1ry4 s VAL 221 Cb -0.05 -2.96 0.00 0.00 0.00 0.00 0.00 36.38 33.37 1ry4 s VAL 221 CO -0.01 -0.67 0.00 -3.20 0.00 0.00 0.00 175.10 171.22 1ry4 n ASN 222 N 4.20 0.00 0.00 3.32 2.85 0.13 -0.59 115.26 125.16 1ry4 n ASN 222 Ca 0.02 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.49 1ry4 n ASN 222 Cb 0.40 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.42 1ry4 n ASN 222 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1ry4 n GLY 223 N 0.00 0.64 3.68 8.20 0.00 -1.26 -4.99 105.19 111.46 1ry4 n GLY 223 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1ry4 n GLY 223 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ry4 s ILE 224 N -0.01 5.10 0.41 -0.61 1.01 0.24 -5.08 121.20 122.27 1ry4 s ILE 224 Ca 0.00 0.08 -0.18 0.00 0.00 0.00 0.00 60.65 60.55 1ry4 s ILE 224 Cb 0.00 -3.32 -0.10 0.00 0.01 0.00 0.00 42.46 39.05 1ry4 s ILE 224 CO 0.00 0.44 0.88 -1.61 0.00 0.00 0.00 174.94 174.65 1ry4 s GLU 225 N 0.45 4.10 0.00 2.79 2.02 -1.26 0.43 118.70 127.23 1ry4 s GLU 225 Ca 0.06 0.93 0.03 0.00 0.02 0.00 0.00 54.97 56.01 1ry4 s GLU 225 Cb -0.12 -2.26 0.07 0.00 0.10 0.00 0.00 34.13 31.92 1ry4 s GLU 225 CO -0.00 -0.01 0.92 1.33 0.02 0.00 0.00 175.26 177.52 1ry4 n VAL 226 N -0.72 0.65 -1.54 2.63 0.24 0.87 -4.84 118.33 115.61 1ry4 n VAL 226 Ca 0.06 -0.82 -0.39 0.00 -2.04 0.00 0.00 64.34 61.15 1ry4 n VAL 226 Cb 0.54 0.70 -0.05 0.00 -1.47 0.00 0.00 33.84 33.56 1ry4 n VAL 226 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ry4 n ALA 227 N -0.04 0.86 -0.12 2.33 0.00 -1.22 -0.64 120.51 121.67 1ry4 n ALA 227 Ca 0.03 -0.72 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1ry4 n ALA 227 Cb 0.23 -3.01 0.00 0.00 0.00 0.00 0.00 19.45 16.67 1ry4 n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ry4 n GLY 228 N 6.09 0.58 3.94 0.00 0.00 -1.13 -5.06 105.19 109.60 1ry4 n GLY 228 Ca 0.40 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.18 1ry4 n GLY 228 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ry4 s LYS 229 N -0.88 2.77 0.45 1.61 1.02 0.18 -4.77 119.74 120.12 1ry4 s LYS 229 Ca 0.00 -0.32 -0.06 0.00 0.02 0.00 0.00 55.97 55.61 1ry4 s LYS 229 Cb 0.00 -2.37 -0.04 0.00 -0.52 0.00 0.00 37.83 34.90 1ry4 s LYS 229 CO 0.00 -0.68 0.76 0.99 -0.92 0.00 0.00 175.35 175.50 1ry4 s THR 230 N -2.88 4.90 0.17 2.17 2.01 -1.26 -4.70 115.64 116.05 1ry4 s THR 230 Ca 0.54 0.26 -0.14 0.00 0.31 0.00 0.00 61.69 62.66 1ry4 s THR 230 Cb -0.10 -3.83 0.06 0.00 0.01 0.00 0.00 72.50 68.64 1ry4 s THR 230 CO 0.42 -0.74 1.82 0.17 -0.69 0.00 0.00 174.62 175.60 1ry4 h LEU 231 N 0.54 0.54 -0.44 4.42 -0.00 -1.97 0.73 115.31 119.13 1ry4 h LEU 231 Ca -0.47 -0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.43 1ry4 h LEU 231 Cb 1.20 -0.12 -0.03 0.00 -0.00 0.00 0.00 40.66 41.71 1ry4 h LEU 231 CO 0.62 0.38 0.26 -0.78 -0.00 0.00 0.00 178.44 178.92 1ry4 h ASP 232 N 0.65 0.41 -0.62 0.17 3.58 -1.98 0.25 116.42 118.87 1ry4 h ASP 232 Ca 0.20 0.01 -0.07 0.00 0.42 0.00 0.00 57.03 57.58 1ry4 h ASP 232 Cb -0.03 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 40.92 1ry4 h ASP 232 CO -0.07 0.29 0.13 -0.61 -2.88 0.00 0.00 179.24 176.11 1ry4 h GLN 233 N 0.52 1.04 -0.08 0.28 4.15 -1.83 0.93 115.11 120.11 1ry4 h GLN 233 Ca 0.18 -0.25 -0.20 0.00 0.77 0.00 0.00 58.65 59.14 1ry4 h GLN 233 Cb 0.02 -0.14 0.00 0.00 0.21 0.00 0.00 27.48 27.58 1ry4 h GLN 233 CO -0.09 0.93 -0.79 0.28 -1.93 0.00 0.00 178.83 177.24 1ry4 h VAL 234 N 0.98 1.36 -0.05 2.39 2.07 -0.29 -1.48 116.25 121.23 1ry4 h VAL 234 Ca 0.20 -2.16 -0.20 0.00 0.82 0.00 0.00 66.70 65.37 1ry4 h VAL 234 Cb 0.38 2.14 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1ry4 h VAL 234 CO 0.01 0.66 -0.81 0.00 0.02 0.00 0.00 177.57 177.44 1ry4 h THR 235 N 0.33 1.39 -0.13 2.57 1.03 -0.31 -2.43 112.91 115.37 1ry4 h THR 235 Ca -0.05 -2.28 -0.01 0.00 -0.01 0.00 0.00 66.41 64.07 1ry4 h THR 235 Cb 1.39 2.24 -0.01 0.00 -1.07 0.00 0.00 68.15 70.70 1ry4 h THR 235 CO 0.14 0.68 0.05 -0.78 -0.01 0.00 0.00 175.52 175.60 1ry4 h ASP 236 N 0.25 0.18 -0.80 0.00 3.58 -0.80 -2.58 116.42 116.26 1ry4 h ASP 236 Ca -0.05 -0.18 -0.03 0.00 0.42 0.00 0.00 57.03 57.19 1ry4 h ASP 236 Cb 1.41 -0.05 -0.04 0.00 1.72 0.00 0.00 39.33 42.38 1ry4 h ASP 236 CO 0.14 0.31 0.40 0.00 -2.88 0.00 0.00 179.24 177.21 1ry4 h MET 237 N 0.04 1.14 0.00 0.28 -0.00 -1.29 0.82 114.93 115.92 1ry4 h MET 237 Ca 0.04 -0.15 -0.01 0.00 -0.00 0.00 0.00 59.70 59.57 1ry4 h MET 237 Cb 0.19 -0.21 -0.00 0.00 -0.00 0.00 0.00 31.60 31.58 1ry4 h MET 237 CO -0.00 0.87 -0.07 0.00 -0.00 0.00 0.00 176.91 177.71 1ry4 h MET 238 N 1.14 0.00 0.05 -0.10 -0.00 -1.32 -0.51 114.93 114.19 1ry4 h MET 238 Ca 0.28 0.00 -0.28 0.00 -0.00 0.00 0.00 59.70 59.70 1ry4 h MET 238 Cb 0.09 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 31.66 1ry4 h MET 238 CO -0.04 0.07 -1.50 0.28 -0.00 0.00 0.00 176.91 175.72 1ry4 h VAL 239 N 0.00 1.13 0.00 -0.10 2.07 -0.95 -1.80 116.25 116.60 1ry4 h VAL 239 Ca -0.00 -2.88 -0.05 0.00 0.82 0.00 0.00 66.70 64.59 1ry4 h VAL 239 Cb 0.67 2.63 -0.01 0.00 -1.52 0.00 0.00 31.29 33.06 1ry4 h VAL 239 CO 0.01 0.73 -0.22 0.00 0.02 0.00 0.00 177.57 178.11 1ry4 h ALA 240 N 0.78 1.24 -0.13 1.67 0.00 -0.34 -2.78 119.26 119.68 1ry4 h ALA 240 Ca -0.22 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1ry4 h ALA 240 Cb 1.96 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 1ry4 h ALA 240 CO 0.12 0.27 -0.04 -1.71 0.00 0.00 0.00 179.25 177.89 1ry4 n ASN 241 N -3.70 2.90 0.29 0.00 2.85 -0.25 -4.71 115.26 112.65 1ry4 n ASN 241 Ca -0.01 -3.19 0.20 0.00 -0.11 0.00 0.00 54.58 51.46 1ry4 n ASN 241 Cb 0.34 -0.50 1.03 0.00 1.24 0.00 0.00 39.78 41.89 1ry4 n ASN 241 CO 0.00 0.00 0.00 0.28 -2.11 0.00 0.00 177.26 175.43 1ry4 h SER 242 N 0.86 0.00 -0.27 1.20 0.02 -1.03 -2.93 113.55 111.41 1ry4 h SER 242 Ca 0.02 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1ry4 h SER 242 Cb 1.24 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.74 1ry4 h SER 242 CO 0.12 0.00 0.04 0.77 -1.14 0.00 0.00 176.83 176.63 1ry4 h SER 243 N 0.00 -0.01 -3.48 3.07 4.64 -1.84 -3.31 113.55 112.62 1ry4 h SER 243 Ca 0.00 0.05 -0.61 0.00 -0.47 0.00 0.00 61.79 60.76 1ry4 h SER 243 Cb 0.04 0.06 -0.40 0.00 -0.31 0.00 0.00 62.40 61.80 1ry4 h SER 243 CO 0.00 0.03 -0.74 0.21 -0.87 0.00 0.00 176.83 175.46 1ry4 s ASN 244 N -5.28 3.66 -0.26 4.97 3.84 -1.11 -4.10 114.94 116.66 1ry4 s ASN 244 Ca -0.13 -2.57 -0.11 0.00 0.21 0.00 0.00 52.86 50.26 1ry4 s ASN 244 Cb 0.11 -1.02 -0.05 0.00 -0.55 0.00 0.00 41.25 39.74 1ry4 s ASN 244 CO 0.70 -0.27 0.19 -0.22 -2.79 0.00 0.00 177.10 174.70 1ry4 s LEU 245 N 0.43 4.07 -0.12 3.21 1.98 -0.57 -4.79 118.68 122.89 1ry4 s LEU 245 Ca 0.17 0.08 -0.01 0.00 -2.89 0.00 0.00 54.13 51.48 1ry4 s LEU 245 Cb -0.24 -2.13 0.03 0.00 0.66 0.00 0.00 46.19 44.50 1ry4 s LEU 245 CO -0.00 0.00 -0.07 -0.63 -1.89 0.00 0.00 176.35 173.77 1ry4 s ILE 246 N 1.39 0.99 -0.15 6.68 1.01 -1.26 0.29 121.20 130.14 1ry4 s ILE 246 Ca 0.08 -0.32 -0.03 0.00 0.00 0.00 0.00 60.65 60.37 1ry4 s ILE 246 Cb -0.15 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 1ry4 s ILE 246 CO 0.07 0.31 -0.05 -0.51 0.00 0.00 0.00 174.94 174.77 1ry4 s ILE 247 N 1.72 3.77 -0.17 2.92 1.10 -0.30 0.20 121.20 130.43 1ry4 s ILE 247 Ca 0.04 -0.40 -0.07 0.00 -0.51 0.00 0.00 60.65 59.71 1ry4 s ILE 247 Cb -0.13 -2.65 -0.04 0.00 0.15 0.00 0.00 42.46 39.79 1ry4 s ILE 247 CO -0.08 0.49 0.06 -0.89 -2.11 0.00 0.00 174.94 172.42 1ry4 s THR 248 N 0.39 4.83 -0.01 4.00 2.01 0.79 -1.90 115.64 125.75 1ry4 s THR 248 Ca -0.05 -0.03 0.02 0.00 0.31 0.00 0.00 61.69 61.95 1ry4 s THR 248 Cb -0.14 -3.16 -0.00 0.00 0.01 0.00 0.00 72.50 69.20 1ry4 s THR 248 CO 0.03 0.48 -0.07 0.54 -0.69 0.00 0.00 174.62 174.92 1ry4 s VAL 249 N 0.16 0.57 -0.02 3.82 0.11 0.93 0.19 120.40 126.15 1ry4 s VAL 249 Ca 0.05 -0.30 0.06 0.00 -2.93 0.00 0.00 61.98 58.86 1ry4 s VAL 249 Cb -0.12 -0.48 -0.01 0.00 -1.53 0.00 0.00 36.38 34.23 1ry4 s VAL 249 CO 0.00 0.17 -0.21 -0.75 -3.33 0.00 0.00 175.10 170.98 1ry4 s LYS 250 N -0.10 1.77 0.09 1.54 2.20 0.10 -0.20 119.74 125.15 1ry4 s LYS 250 Ca 0.02 -0.73 -0.34 0.00 -0.36 0.00 0.00 55.97 54.56 1ry4 s LYS 250 Cb -0.04 -1.66 -0.13 0.00 -1.51 0.00 0.00 37.83 34.50 1ry4 s LYS 250 CO -0.00 0.41 1.70 -0.35 -0.36 0.00 0.00 175.35 176.74 1ry4 n PRO 251 N 2.69 2.26 -0.02 4.03 -0.04 -1.26 -1.51 135.00 141.15 1ry4 n PRO 251 Ca -0.16 0.82 -0.10 0.00 -0.04 0.00 0.00 63.50 64.03 1ry4 n PRO 251 Cb 0.53 -2.63 -0.14 0.00 -0.04 0.00 0.00 33.50 31.22 1ry4 n PRO 251 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ry4 n ALA 252 N 4.57 1.45 -3.77 0.55 0.00 -1.26 -4.85 120.51 117.20 1ry4 n ALA 252 Ca 0.19 -0.78 -0.27 0.00 0.00 0.00 0.00 53.44 52.57 1ry4 n ALA 252 Cb 0.30 -0.81 0.05 0.00 0.00 0.00 0.00 19.45 18.99 1ry4 n ALA 252 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ry4 n ASN 253 N -3.06 -5.09 -4.71 0.00 3.02 -1.26 -4.89 115.26 99.27 1ry4 n ASN 253 Ca -0.19 -0.69 -0.42 0.00 -0.03 0.00 0.00 54.58 53.25 1ry4 n ASN 253 Cb 1.06 -4.35 -0.03 0.00 -0.61 0.00 0.00 39.78 35.85 1ry4 n ASN 253 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1ry4 s GLN 254 N -6.44 4.22 0.00 3.52 2.00 -1.26 -5.16 119.66 116.54 1ry4 s GLN 254 Ca 0.58 2.31 0.00 0.00 -2.00 0.00 0.00 55.36 56.25 1ry4 s GLN 254 Cb -0.28 -3.33 0.00 0.00 0.80 0.00 0.00 33.01 30.20 1ry4 s GLN 254 CO 0.79 -0.63 0.00 -2.13 -0.50 0.00 0.00 175.29 172.82