#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 1.96 -0.16 1.61 1.04 -1.26 -5.12 113.70 111.77 1ry4 s SER 129 Ca 0.00 -0.38 -0.09 0.00 0.48 0.00 0.00 55.95 55.96 1ry4 s SER 129 Cb 0.00 -0.18 0.06 0.00 0.10 0.00 0.00 66.02 65.99 1ry4 s SER 129 CO 0.00 0.15 0.40 -1.59 0.98 0.00 0.00 173.24 173.18 1ry4 s LYS 130 N -0.74 0.38 0.25 4.02 -2.85 -1.26 -5.14 119.74 114.40 1ry4 s LYS 130 Ca 0.05 0.77 -0.30 0.00 -1.00 0.00 0.00 55.97 55.49 1ry4 s LYS 130 Cb -0.07 -0.03 -0.09 0.00 -2.06 0.00 0.00 37.83 35.58 1ry4 s LYS 130 CO 0.00 -0.16 1.06 -0.08 0.10 0.00 0.00 175.35 176.27 1ry4 s THR 131 N 1.38 3.71 -0.24 3.79 -1.32 -1.26 -5.00 115.64 116.69 1ry4 s THR 131 Ca -0.09 1.68 -0.16 0.00 -1.21 0.00 0.00 61.69 61.90 1ry4 s THR 131 Cb -0.08 -4.07 -0.04 0.00 -1.51 0.00 0.00 72.50 66.80 1ry4 s THR 131 CO -0.12 0.38 0.42 -0.54 -2.21 0.00 0.00 174.62 172.55 1ry4 s LYS 132 N -1.19 4.09 -0.33 7.08 3.01 -1.26 -5.05 119.74 126.09 1ry4 s LYS 132 Ca 0.44 0.17 -0.09 0.00 -1.01 0.00 0.00 55.97 55.48 1ry4 s LYS 132 Cb -0.30 -3.61 0.01 0.00 -1.01 0.00 0.00 37.83 32.92 1ry4 s LYS 132 CO 0.38 -0.20 0.16 0.00 0.51 0.00 0.00 175.35 176.19 1ry4 s ALA 133 N 1.83 3.22 0.21 5.17 0.00 -1.26 -5.06 121.76 125.87 1ry4 s ALA 133 Ca 0.18 -1.55 -0.30 0.00 0.00 0.00 0.00 51.96 50.29 1ry4 s ALA 133 Cb -0.15 -2.41 -0.10 0.00 0.00 0.00 0.00 23.12 20.46 1ry4 s ALA 133 CO 0.09 -1.11 1.44 -1.25 0.00 0.00 0.00 175.76 174.93 1ry4 s PRO 134 N 1.55 4.28 -0.68 0.00 0.04 -1.26 -4.95 135.00 133.98 1ry4 s PRO 134 Ca 0.03 2.25 -0.17 0.00 0.04 0.00 0.00 61.00 63.14 1ry4 s PRO 134 Cb -0.18 -3.15 0.14 0.00 0.04 0.00 0.00 34.50 31.35 1ry4 s PRO 134 CO 0.05 -0.44 0.74 0.45 0.04 0.00 0.00 177.00 177.84 1ry4 s SER 135 N 0.62 6.38 0.28 6.66 0.15 -1.26 -5.02 113.70 121.52 1ry4 s SER 135 Ca 0.62 -1.89 -0.12 0.00 0.70 0.00 0.00 55.95 55.27 1ry4 s SER 135 Cb -0.41 -2.28 -0.08 0.00 -1.71 0.00 0.00 66.02 61.55 1ry4 s SER 135 CO 0.38 -0.93 0.64 -0.63 1.20 0.00 0.00 173.24 173.90 1ry4 s ILE 136 N 1.87 4.82 -0.36 6.45 1.09 -1.26 -5.04 121.20 128.77 1ry4 s ILE 136 Ca 0.14 0.66 0.05 0.00 -1.10 0.00 0.00 60.65 60.40 1ry4 s ILE 136 Cb -0.19 -3.62 0.19 0.00 -1.06 0.00 0.00 42.46 37.77 1ry4 s ILE 136 CO -0.00 -0.15 0.67 -0.55 -0.10 0.00 0.00 174.94 174.81 1ry4 s SER 137 N -2.40 -1.42 -0.36 3.58 0.15 -1.26 -5.11 113.70 106.88 1ry4 s SER 137 Ca 0.50 -0.42 -0.19 0.00 0.70 0.00 0.00 55.95 56.53 1ry4 s SER 137 Cb -0.11 1.83 0.00 0.00 -1.71 0.00 0.00 66.02 66.04 1ry4 s SER 137 CO 0.20 -0.19 0.58 -0.63 1.20 0.00 0.00 173.24 174.41 1ry4 s ILE 138 N 2.18 4.94 -0.06 6.45 1.01 -1.26 -5.03 121.20 129.42 1ry4 s ILE 138 Ca 0.15 0.41 -0.30 0.00 0.00 0.00 0.00 60.65 60.91 1ry4 s ILE 138 Cb -0.05 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 1ry4 s ILE 138 CO -0.14 -0.31 1.36 -2.84 0.00 0.00 0.00 174.94 173.02 1ry4 s PRO 139 N 2.58 4.27 -0.16 2.79 0.02 -1.26 -5.01 135.00 138.22 1ry4 s PRO 139 Ca 0.22 1.86 -0.11 0.00 0.02 0.00 0.00 61.00 62.98 1ry4 s PRO 139 Cb -0.15 -3.68 -0.05 0.00 0.02 0.00 0.00 34.50 30.64 1ry4 s PRO 139 CO 0.15 -0.63 0.20 -1.01 -0.33 0.00 0.00 177.00 175.38 1ry4 s HIS 140 N 2.91 3.47 0.20 6.54 3.76 -1.26 -5.08 115.29 125.83 1ry4 s HIS 140 Ca 0.61 0.48 0.06 0.00 -0.15 0.00 0.00 55.06 56.06 1ry4 s HIS 140 Cb -0.28 -2.19 -0.04 0.00 1.11 0.00 0.00 32.58 31.19 1ry4 s HIS 140 CO 0.23 0.37 0.16 -0.51 -0.85 0.00 0.00 174.74 174.14 1ry4 s ASP 141 N 0.08 5.51 -0.06 1.40 1.11 -1.26 -5.10 116.67 118.35 1ry4 s ASP 141 Ca 0.13 -0.19 -0.12 0.00 0.18 0.00 0.00 52.55 52.55 1ry4 s ASP 141 Cb -0.12 -1.42 -0.05 0.00 1.07 0.00 0.00 42.92 42.40 1ry4 s ASP 141 CO 0.02 0.02 0.29 0.72 1.18 0.00 0.00 175.17 177.40 1ry4 s PHE 142 N -1.92 3.65 -0.36 4.23 -0.71 -1.26 -5.03 117.98 116.57 1ry4 s PHE 142 Ca 0.32 0.77 0.05 0.00 -1.04 0.00 0.00 56.93 57.02 1ry4 s PHE 142 Cb -0.09 -2.16 0.17 0.00 -1.21 0.00 0.00 43.02 39.73 1ry4 s PHE 142 CO 0.24 0.64 0.50 -0.98 -1.34 0.00 0.00 175.22 174.28 1ry4 s ARG 143 N -0.89 0.66 0.17 1.99 1.70 -1.26 -5.14 118.95 116.19 1ry4 s ARG 143 Ca 0.19 -0.32 -0.25 0.00 -0.47 0.00 0.00 55.73 54.88 1ry4 s ARG 143 Cb -0.14 -0.24 -0.08 0.00 -0.57 0.00 0.00 34.95 33.91 1ry4 s ARG 143 CO 0.09 -1.15 0.78 -0.65 -1.08 0.00 0.00 175.30 173.28 1ry4 s GLN 144 N 1.92 4.56 -0.12 3.89 -1.52 -1.26 -5.02 119.66 122.12 1ry4 s GLN 144 Ca 0.15 1.15 -0.30 0.00 -1.95 0.00 0.00 55.36 54.41 1ry4 s GLN 144 Cb -0.10 -3.24 -0.01 0.00 -0.22 0.00 0.00 33.01 29.43 1ry4 s GLN 144 CO -0.12 0.56 1.06 0.14 -0.25 0.00 0.00 175.29 176.69 1ry4 s VAL 145 N -1.17 4.65 -0.34 1.09 -7.23 -1.26 -4.99 120.40 111.15 1ry4 s VAL 145 Ca 0.36 1.93 -0.24 0.00 -1.81 0.00 0.00 61.98 62.23 1ry4 s VAL 145 Cb -0.23 -4.24 0.01 0.00 0.56 0.00 0.00 36.38 32.47 1ry4 s VAL 145 CO 0.26 -0.03 0.81 -0.44 -0.31 0.00 0.00 175.10 175.39 1ry4 s SER 146 N 1.22 6.62 -0.46 4.85 0.01 -1.26 -5.00 113.70 119.68 1ry4 s SER 146 Ca 0.49 0.53 -0.14 0.00 1.31 0.00 0.00 55.95 58.14 1ry4 s SER 146 Cb -0.19 -2.41 0.07 0.00 0.21 0.00 0.00 66.02 63.70 1ry4 s SER 146 CO 0.17 -0.69 0.37 0.00 0.41 0.00 0.00 173.24 173.49 1ry4 s ALA 147 N 3.08 3.51 -0.75 1.44 0.00 -1.26 -5.02 121.76 122.77 1ry4 s ALA 147 Ca 0.33 -2.11 -0.21 0.00 0.00 0.00 0.00 51.96 49.96 1ry4 s ALA 147 Cb -0.13 -2.99 0.09 0.00 0.00 0.00 0.00 23.12 20.08 1ry4 s ALA 147 CO 0.15 -1.71 1.02 0.42 0.00 0.00 0.00 175.76 175.65 1ry4 s ILE 148 N 1.60 4.43 0.11 0.00 1.09 -1.26 -5.00 121.20 122.17 1ry4 s ILE 148 Ca 0.04 -0.72 0.04 0.00 -1.10 0.00 0.00 60.65 58.91 1ry4 s ILE 148 Cb -0.24 -4.72 -0.04 0.00 -1.06 0.00 0.00 42.46 36.40 1ry4 s ILE 148 CO 0.06 -1.49 0.09 0.27 -0.10 0.00 0.00 174.94 173.77 1ry4 s ILE 149 N 3.70 4.44 0.26 2.92 -0.00 -1.26 -5.12 121.20 126.14 1ry4 s ILE 149 Ca 0.26 -0.91 -0.00 0.00 -0.00 0.00 0.00 60.65 59.99 1ry4 s ILE 149 Cb -0.13 -3.18 0.05 0.00 -0.00 0.00 0.00 42.46 39.20 1ry4 s ILE 149 CO 0.04 0.04 0.35 -0.90 -0.00 0.00 0.00 174.94 174.47 1ry4 n ASP 150 N 0.19 0.47 -3.85 4.36 5.75 -1.26 -5.09 116.55 117.11 1ry4 n ASP 150 Ca -0.09 -1.40 -0.25 0.00 -0.01 0.00 0.00 54.79 53.04 1ry4 n ASP 150 Cb 0.53 -0.23 -0.17 0.00 -1.03 0.00 0.00 41.12 40.22 1ry4 n ASP 150 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ry4 s VAL 151 N -0.95 0.77 0.04 2.12 1.01 -1.26 -5.08 120.40 117.06 1ry4 s VAL 151 Ca 0.23 -0.13 -0.30 0.00 0.00 0.00 0.00 61.98 61.78 1ry4 s VAL 151 Cb -0.01 -0.85 -0.09 0.00 0.00 0.00 0.00 36.38 35.43 1ry4 s VAL 151 CO 0.16 0.33 1.91 -0.62 0.00 0.00 0.00 175.10 176.87 1ry4 s ASP 152 N 1.81 6.47 -0.02 3.32 2.15 -1.26 -4.95 116.67 124.19 1ry4 s ASP 152 Ca 0.05 2.64 -0.22 0.00 0.43 0.00 0.00 52.55 55.45 1ry4 s ASP 152 Cb -0.12 -2.54 0.05 0.00 -0.30 0.00 0.00 42.92 40.01 1ry4 s ASP 152 CO -0.07 -1.03 0.49 -0.51 -0.17 0.00 0.00 175.17 173.88 1ry4 s ILE 153 N 4.10 0.03 -0.36 4.11 2.07 -1.26 -5.12 121.20 124.78 1ry4 s ILE 153 Ca 0.85 -0.26 -0.02 0.00 -1.41 0.00 0.00 60.65 59.82 1ry4 s ILE 153 Cb -0.42 -0.84 0.08 0.00 0.13 0.00 0.00 42.46 41.41 1ry4 s ILE 153 CO 0.39 -0.14 0.11 -0.69 -1.91 0.00 0.00 174.94 172.70 1ry4 s VAL 154 N -1.52 3.13 0.64 4.00 1.01 -0.57 -5.02 120.40 122.07 1ry4 s VAL 154 Ca -0.11 -1.75 -0.17 0.00 0.00 0.00 0.00 61.98 59.95 1ry4 s VAL 154 Cb -0.02 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 1ry4 s VAL 154 CO 0.05 -0.42 1.20 -2.16 0.00 0.00 0.00 175.10 173.76 1ry4 s PRO 155 N 1.18 2.72 -1.09 2.72 0.04 -1.26 -2.97 135.00 136.34 1ry4 s PRO 155 Ca 0.02 1.75 -0.24 0.00 0.04 0.00 0.00 61.00 62.58 1ry4 s PRO 155 Cb -0.21 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 32.29 1ry4 s PRO 155 CO -0.03 -1.39 1.95 -0.85 0.04 0.00 0.00 177.00 176.73 1ry4 n GLU 156 N -2.01 1.30 -2.62 4.56 0.28 -1.26 -4.84 120.64 116.05 1ry4 n GLU 156 Ca 0.13 -2.24 -0.41 0.00 -0.16 0.00 0.00 57.16 54.48 1ry4 n GLU 156 Cb 0.50 -3.65 -0.03 0.00 1.43 0.00 0.00 31.44 29.69 1ry4 n GLU 156 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 1ry4 s THR 157 N 11.36 3.92 -0.13 3.84 -4.23 -1.26 -4.94 115.64 124.20 1ry4 s THR 157 Ca 0.69 -0.12 -0.29 0.00 -1.18 0.00 0.00 61.69 60.80 1ry4 s THR 157 Cb 0.01 -4.91 -0.05 0.00 1.34 0.00 0.00 72.50 68.89 1ry4 s THR 157 CO 0.15 -1.80 1.77 -1.00 -0.54 0.00 0.00 174.62 173.20 1ry4 s HIS 158 N 5.11 1.80 -0.26 3.99 3.76 -1.26 -4.84 115.29 123.58 1ry4 s HIS 158 Ca 0.36 0.28 -0.05 0.00 -0.15 0.00 0.00 55.06 55.49 1ry4 s HIS 158 Cb -0.07 -4.00 0.00 0.00 1.11 0.00 0.00 32.58 29.62 1ry4 s HIS 158 CO 0.07 -3.78 0.03 0.50 -0.85 0.00 0.00 174.74 170.70 1ry4 s ARG 159 N 4.71 3.18 -0.36 1.40 6.06 -1.26 -5.06 118.95 127.62 1ry4 s ARG 159 Ca 0.79 -0.78 -0.14 0.00 -2.50 0.00 0.00 55.73 53.10 1ry4 s ARG 159 Cb -0.31 -3.21 -0.00 0.00 0.06 0.00 0.00 34.95 31.48 1ry4 s ARG 159 CO 0.32 -0.35 0.30 -0.98 -2.50 0.00 0.00 175.30 172.09 1ry4 s ARG 160 N 1.48 3.35 -0.14 5.12 1.70 -1.26 -3.67 118.95 125.52 1ry4 s ARG 160 Ca 0.03 -0.70 -0.12 0.00 -0.47 0.00 0.00 55.73 54.47 1ry4 s ARG 160 Cb -0.16 -3.86 -0.05 0.00 -0.57 0.00 0.00 34.95 30.31 1ry4 s ARG 160 CO 0.00 -0.57 0.26 0.08 -1.08 0.00 0.00 175.30 173.99 1ry4 s VAL 161 N 1.81 5.32 0.08 4.99 1.01 -0.26 -4.88 120.40 128.47 1ry4 s VAL 161 Ca 0.07 0.48 0.06 0.00 0.00 0.00 0.00 61.98 62.60 1ry4 s VAL 161 Cb -0.18 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1ry4 s VAL 161 CO 0.11 0.44 -0.08 0.00 0.00 0.00 0.00 175.10 175.57 1ry4 s ARG 162 N 0.11 2.26 -0.24 2.72 1.70 -1.26 -0.07 118.95 124.16 1ry4 s ARG 162 Ca 0.16 -0.95 -0.09 0.00 -0.47 0.00 0.00 55.73 54.38 1ry4 s ARG 162 Cb -0.13 -2.37 -0.04 0.00 -0.57 0.00 0.00 34.95 31.84 1ry4 s ARG 162 CO 0.04 0.53 0.11 -1.17 -1.08 0.00 0.00 175.30 173.73 1ry4 s LEU 163 N -2.06 3.76 -0.45 -1.89 1.98 0.07 -4.92 118.68 115.18 1ry4 s LEU 163 Ca 0.21 -0.06 -0.08 0.00 -2.89 0.00 0.00 54.13 51.32 1ry4 s LEU 163 Cb -0.11 -2.01 0.11 0.00 0.66 0.00 0.00 46.19 44.84 1ry4 s LEU 163 CO 0.13 0.01 0.29 -1.48 -1.89 0.00 0.00 176.35 173.42 1ry4 s LEU 164 N 1.35 5.46 0.12 -0.68 -0.00 -1.26 -2.51 118.68 121.17 1ry4 s LEU 164 Ca 0.06 -1.83 -0.31 0.00 -0.00 0.00 0.00 54.13 52.06 1ry4 s LEU 164 Cb -0.15 -1.97 -0.07 0.00 -0.00 0.00 0.00 46.19 44.00 1ry4 s LEU 164 CO 0.05 -0.62 1.26 -0.54 -0.00 0.00 0.00 176.35 176.50 1ry4 s LYS 165 N 1.34 4.41 -0.49 1.48 1.02 -0.32 -4.92 119.74 122.25 1ry4 s LYS 165 Ca 0.05 1.91 0.05 0.00 0.02 0.00 0.00 55.97 58.00 1ry4 s LYS 165 Cb -0.25 -3.27 0.20 0.00 -0.52 0.00 0.00 37.83 33.99 1ry4 s LYS 165 CO -0.01 -0.26 0.80 -2.39 -0.92 0.00 0.00 175.35 172.57 1ry4 n HIS 166 N 3.41 -3.37 -0.90 3.18 1.44 -1.26 -4.85 115.22 112.86 1ry4 n HIS 166 Ca 0.08 -1.29 0.00 0.00 -2.01 0.00 0.00 57.72 54.50 1ry4 n HIS 166 Cb 0.44 1.44 0.00 0.00 0.12 0.00 0.00 29.99 32.00 1ry4 n HIS 166 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1ry4 n GLY 167 N 2.77 0.47 3.45 -1.39 0.00 -1.26 -5.00 105.19 104.22 1ry4 n GLY 167 Ca 0.16 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.69 5.76 0.00 1.61 0.01 -1.26 -4.82 113.70 112.31 1ry4 s SER 168 Ca 0.00 -0.64 0.00 0.00 1.31 0.00 0.00 55.95 56.62 1ry4 s SER 168 Cb 0.00 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 64.18 1ry4 s SER 168 CO 0.00 -0.27 0.56 -0.67 0.41 0.00 0.00 173.24 173.27 1ry4 n ASP 169 N 5.03 0.99 -4.77 2.44 2.03 -1.26 -4.95 116.55 116.06 1ry4 n ASP 169 Ca -0.13 -1.29 -0.29 0.00 0.52 0.00 0.00 54.79 53.60 1ry4 n ASP 169 Cb 0.48 0.00 0.14 0.00 -0.72 0.00 0.00 41.12 41.02 1ry4 n ASP 169 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1ry4 s LYS 170 N -0.29 1.16 0.51 -0.67 -2.85 -1.26 -5.00 119.74 111.34 1ry4 s LYS 170 Ca 0.00 0.37 -0.22 0.00 -1.00 0.00 0.00 55.97 55.12 1ry4 s LYS 170 Cb 0.00 -1.83 -0.07 0.00 -2.06 0.00 0.00 37.83 33.87 1ry4 s LYS 170 CO 0.00 -2.20 1.13 -2.30 0.10 0.00 0.00 175.35 172.08 1ry4 n PRO 171 N -3.78 1.39 -0.12 1.78 -0.02 -1.26 -4.92 135.00 128.07 1ry4 n PRO 171 Ca 0.06 0.51 -0.06 0.00 -2.02 0.00 0.00 63.50 62.00 1ry4 n PRO 171 Cb 0.59 -2.28 0.03 0.00 -0.02 0.00 0.00 33.50 31.81 1ry4 n PRO 171 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1ry4 h LEU 172 N 1.25 0.17 0.00 2.45 4.07 -2.01 -3.46 115.31 117.78 1ry4 h LEU 172 Ca -0.48 0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.52 1ry4 h LEU 172 Cb 1.33 0.02 0.00 0.00 1.08 0.00 0.00 40.66 43.09 1ry4 h LEU 172 CO 0.55 0.14 0.00 0.61 -1.08 0.00 0.00 178.44 178.66 1ry4 n GLY 173 N -1.23 2.33 2.97 0.83 0.00 -1.26 -4.51 105.19 104.32 1ry4 n GLY 173 Ca 0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.18 0.92 0.02 1.61 -0.12 -1.26 -0.94 117.98 116.04 1ry4 s PHE 174 Ca 0.00 -0.26 0.01 0.00 -0.05 0.00 0.00 56.93 56.64 1ry4 s PHE 174 Cb 0.00 -0.70 -0.02 0.00 -0.63 0.00 0.00 43.02 41.67 1ry4 s PHE 174 CO 0.00 -0.15 -0.05 0.71 -0.05 0.00 0.00 175.22 175.69 1ry4 s TYR 175 N 0.46 0.42 0.02 3.49 1.51 -0.03 -4.97 117.35 118.25 1ry4 s TYR 175 Ca -0.07 -0.42 0.07 0.00 -1.01 0.00 0.00 57.07 55.63 1ry4 s TYR 175 Cb -0.11 -0.27 -0.02 0.00 -0.11 0.00 0.00 41.96 41.45 1ry4 s TYR 175 CO 0.01 -0.11 -0.20 0.96 -1.11 0.00 0.00 175.55 175.09 1ry4 s ILE 176 N -1.16 1.63 0.05 2.71 -4.36 -1.26 0.01 121.20 118.81 1ry4 s ILE 176 Ca -0.10 -1.07 -0.01 0.00 -0.26 0.00 0.00 60.65 59.20 1ry4 s ILE 176 Cb -0.08 -1.39 -0.04 0.00 1.25 0.00 0.00 42.46 42.20 1ry4 s ILE 176 CO -0.00 0.29 -0.02 -0.13 0.24 0.00 0.00 174.94 175.31 1ry4 s ARG 177 N -0.92 0.60 0.11 0.37 1.81 -0.77 -4.84 118.95 115.31 1ry4 s ARG 177 Ca 0.07 -1.17 -0.28 0.00 -1.72 0.00 0.00 55.73 52.63 1ry4 s ARG 177 Cb -0.08 0.21 -0.06 0.00 -0.45 0.00 0.00 34.95 34.56 1ry4 s ARG 177 CO 0.01 -0.11 0.89 0.34 -0.68 0.00 0.00 175.30 175.75 1ry4 s ASP 178 N -2.83 7.43 0.28 0.23 -1.08 -1.26 -1.78 116.67 117.65 1ry4 s ASP 178 Ca 0.06 1.71 0.01 0.00 -0.52 0.00 0.00 52.55 53.80 1ry4 s ASP 178 Cb 0.07 -2.55 -0.03 0.00 -1.46 0.00 0.00 42.92 38.95 1ry4 s ASP 178 CO -0.09 0.01 0.27 -0.83 0.52 0.00 0.00 175.17 175.04 1ry4 s GLY 179 N -0.27 1.74 -0.11 2.66 0.00 0.43 -4.97 107.32 106.80 1ry4 s GLY 179 Ca 0.43 -1.76 -0.14 0.00 0.00 0.00 0.00 44.72 43.25 1ry4 s GLY 179 CO 0.28 -1.31 0.34 -1.59 0.00 0.00 0.00 173.10 170.82 1ry4 s THR 180 N -3.69 5.23 -0.27 0.90 2.01 -1.26 -0.01 115.64 118.55 1ry4 s THR 180 Ca 0.37 0.66 -0.09 0.00 0.31 0.00 0.00 61.69 62.94 1ry4 s THR 180 Cb 0.03 -3.66 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 1ry4 s THR 180 CO 0.19 0.45 0.12 -0.55 -0.69 0.00 0.00 174.62 174.14 1ry4 s SER 181 N -0.02 5.49 -0.21 3.53 0.15 0.19 -4.85 113.70 117.97 1ry4 s SER 181 Ca 0.20 -0.21 -0.05 0.00 0.70 0.00 0.00 55.95 56.58 1ry4 s SER 181 Cb -0.14 -2.00 -0.02 0.00 -1.71 0.00 0.00 66.02 62.15 1ry4 s SER 181 CO 0.07 -0.07 0.01 0.54 1.20 0.00 0.00 173.24 174.99 1ry4 s VAL 182 N 1.66 3.96 0.03 4.45 0.11 -1.26 -1.17 120.40 128.18 1ry4 s VAL 182 Ca 0.06 -0.30 0.04 0.00 -2.93 0.00 0.00 61.98 58.85 1ry4 s VAL 182 Cb -0.16 -2.81 -0.02 0.00 -1.53 0.00 0.00 36.38 31.87 1ry4 s VAL 182 CO 0.06 0.41 -0.12 0.00 -3.33 0.00 0.00 175.10 172.12 1ry4 s ARG 183 N 1.18 0.86 -0.44 1.54 1.70 0.04 -4.95 118.95 118.87 1ry4 s ARG 183 Ca 0.03 -0.66 -0.14 0.00 -0.47 0.00 0.00 55.73 54.48 1ry4 s ARG 183 Cb -0.14 -0.83 0.05 0.00 -0.57 0.00 0.00 34.95 33.45 1ry4 s ARG 183 CO 0.01 0.21 0.33 0.08 -1.08 0.00 0.00 175.30 174.86 1ry4 s VAL 184 N -0.76 5.12 0.55 4.99 1.01 -1.26 0.02 120.40 130.06 1ry4 s VAL 184 Ca 0.01 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.12 1ry4 s VAL 184 Cb -0.07 -3.97 0.03 0.00 0.00 0.00 0.00 36.38 32.37 1ry4 s VAL 184 CO 0.01 -0.44 0.33 0.42 0.00 0.00 0.00 175.10 175.41 1ry4 s THR 185 N 1.63 1.50 -0.42 3.92 -4.23 0.15 -4.96 115.64 113.22 1ry4 s THR 185 Ca 0.04 -1.59 0.25 0.00 -1.18 0.00 0.00 61.69 59.20 1ry4 s THR 185 Cb -0.22 -2.09 0.26 0.00 1.34 0.00 0.00 72.50 71.80 1ry4 s THR 185 CO 0.08 0.00 1.74 0.00 -0.54 0.00 0.00 174.62 175.90 1ry4 h ALA 186 N 0.84 1.00 -0.01 3.99 0.00 -2.02 -0.99 119.26 122.07 1ry4 h ALA 186 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1ry4 h ALA 186 Cb 1.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1ry4 h ALA 186 CO 0.60 0.00 -0.20 0.43 0.00 0.00 0.00 179.25 180.08 1ry4 n SER 187 N -2.33 0.74 0.00 0.00 7.64 -1.26 -5.03 113.62 113.38 1ry4 n SER 187 Ca 0.02 -0.68 0.00 0.00 1.01 0.00 0.00 58.87 59.22 1ry4 n SER 187 Cb 0.24 0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 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 1.33 -0.00 3.72 0.23 0.00 -0.38 -4.94 105.19 105.15 1ry4 n GLY 188 Ca 0.13 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.59 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 4.30 0.09 0.99 0.05 -1.26 0.31 118.68 123.17 1ry4 s LEU 189 Ca 0.00 1.07 0.10 0.00 0.05 0.00 0.00 54.13 55.35 1ry4 s LEU 189 Cb 0.00 -2.96 -0.03 0.00 -2.05 0.00 0.00 46.19 41.14 1ry4 s LEU 189 CO 0.00 -0.08 -0.26 -1.61 -0.55 0.00 0.00 176.35 173.85 1ry4 s GLU 190 N 0.75 1.51 -0.09 1.48 2.02 0.10 -4.95 118.70 119.52 1ry4 s GLU 190 Ca 0.34 -1.23 0.04 0.00 0.02 0.00 0.00 54.97 54.14 1ry4 s GLU 190 Cb -0.17 -1.86 0.00 0.00 0.10 0.00 0.00 34.13 32.20 1ry4 s GLU 190 CO 0.16 0.46 -0.22 0.15 0.02 0.00 0.00 175.26 175.82 1ry4 s LYS 191 N -1.72 2.83 0.04 1.61 1.02 -1.26 -0.78 119.74 121.48 1ry4 s LYS 191 Ca 0.12 -0.81 -0.03 0.00 0.02 0.00 0.00 55.97 55.27 1ry4 s LYS 191 Cb -0.10 -2.16 -0.02 0.00 -0.52 0.00 0.00 37.83 35.03 1ry4 s LYS 191 CO 0.04 0.16 0.04 -0.65 -0.92 0.00 0.00 175.35 174.03 1ry4 s GLN 192 N 0.38 0.53 -0.14 1.68 -0.21 -0.32 -4.95 119.66 116.64 1ry4 s GLN 192 Ca -0.18 -0.81 -0.29 0.00 0.02 0.00 0.00 55.36 54.09 1ry4 s GLN 192 Cb -0.18 0.20 -0.02 0.00 1.00 0.00 0.00 33.01 34.02 1ry4 s GLN 192 CO 0.08 -0.12 1.23 -2.14 -2.12 0.00 0.00 175.29 172.22 1ry4 s PRO 193 N -2.62 4.27 -0.01 2.91 0.02 -1.26 0.54 135.00 138.85 1ry4 s PRO 193 Ca -0.05 1.64 0.02 0.00 0.02 0.00 0.00 61.00 62.63 1ry4 s PRO 193 Cb -0.01 -3.70 -0.00 0.00 0.02 0.00 0.00 34.50 30.81 1ry4 s PRO 193 CO -0.05 -0.62 -0.06 0.20 -0.33 0.00 0.00 177.00 176.14 1ry4 s GLY 194 N 1.77 0.30 -0.22 0.52 0.00 0.98 -4.84 107.32 105.83 1ry4 s GLY 194 Ca 0.54 -0.24 -0.10 0.00 0.00 0.00 0.00 44.72 44.92 1ry4 s GLY 194 CO 0.16 -0.17 0.14 -0.26 0.00 0.00 0.00 173.10 172.97 1ry4 s ILE 195 N -0.07 5.28 0.46 0.90 -4.36 -1.26 -0.43 121.20 121.72 1ry4 s ILE 195 Ca 0.01 0.15 0.04 0.00 -0.26 0.00 0.00 60.65 60.59 1ry4 s ILE 195 Cb -0.03 -3.44 -0.04 0.00 1.25 0.00 0.00 42.46 40.19 1ry4 s ILE 195 CO -0.00 0.38 0.01 -0.36 0.24 0.00 0.00 174.94 175.21 1ry4 s PHE 196 N 0.83 2.16 0.24 1.37 0.08 -0.74 -3.33 117.98 118.60 1ry4 s PHE 196 Ca 0.07 -0.83 -0.30 0.00 0.12 0.00 0.00 56.93 55.99 1ry4 s PHE 196 Cb -0.13 -1.68 -0.09 0.00 -0.57 0.00 0.00 43.02 40.55 1ry4 s PHE 196 CO 0.02 0.32 1.33 0.42 -0.10 0.00 0.00 175.22 177.22 1ry4 s ILE 197 N -2.81 3.01 0.10 0.64 1.01 -0.48 -1.85 121.20 120.82 1ry4 s ILE 197 Ca 0.20 0.87 0.00 0.00 0.00 0.00 0.00 60.65 61.71 1ry4 s ILE 197 Cb 0.06 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.97 1ry4 s ILE 197 CO 0.10 0.15 0.00 -0.24 0.00 0.00 0.00 174.94 174.95 1ry4 n SER 198 N 2.20 0.97 -4.31 3.58 2.88 0.10 -4.65 113.62 114.39 1ry4 n SER 198 Ca 0.05 0.15 -0.27 0.00 -1.33 0.00 0.00 58.87 57.47 1ry4 n SER 198 Cb 0.42 -0.27 -0.14 0.00 -0.75 0.00 0.00 64.21 63.47 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 -2.00 1.41 -0.05 -1.46 0.52 -0.60 -4.97 118.95 111.81 1ry4 s ARG 199 Ca 0.00 -1.11 0.04 0.00 -0.52 0.00 0.00 55.73 54.13 1ry4 s ARG 199 Cb 0.00 -1.65 0.00 0.00 0.52 0.00 0.00 34.95 33.82 1ry4 s ARG 199 CO 0.00 0.41 -0.15 -0.51 0.02 0.00 0.00 175.30 175.07 1ry4 s LEU 200 N -1.54 1.84 -0.20 2.53 1.43 -1.26 -0.85 118.68 120.63 1ry4 s LEU 200 Ca 0.09 -0.32 -0.10 0.00 -1.03 0.00 0.00 54.13 52.78 1ry4 s LEU 200 Cb -0.10 -0.89 -0.05 0.00 0.03 0.00 0.00 46.19 45.19 1ry4 s LEU 200 CO 0.03 0.11 0.12 -0.69 0.23 0.00 0.00 176.35 176.16 1ry4 s VAL 201 N 0.20 5.29 0.01 -1.59 1.01 -0.11 -5.00 120.40 120.21 1ry4 s VAL 201 Ca -0.06 0.15 -0.36 0.00 0.00 0.00 0.00 61.98 61.70 1ry4 s VAL 201 Cb -0.12 -3.42 -0.15 0.00 0.00 0.00 0.00 36.38 32.70 1ry4 s VAL 201 CO 0.02 0.43 1.58 -0.81 0.00 0.00 0.00 175.10 176.33 1ry4 n PRO 202 N 3.61 1.65 -0.41 2.72 -0.04 -1.26 -0.04 135.00 141.23 1ry4 n PRO 202 Ca -0.16 0.60 0.00 0.00 -0.04 0.00 0.00 63.50 63.90 1ry4 n PRO 202 Cb 0.52 -2.33 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 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 3.44 0.70 3.84 0.55 0.00 -1.26 -5.05 105.19 107.41 1ry4 n GLY 203 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.41 1.79 0.29 -0.02 0.00 0.94 -4.81 107.32 104.10 1ry4 s GLY 204 Ca 0.00 0.09 0.01 0.00 0.00 0.00 0.00 44.72 44.82 1ry4 s GLY 204 CO 0.00 0.38 1.87 1.41 0.00 0.00 0.00 173.10 176.76 1ry4 h LEU 205 N -0.16 0.92 -0.69 0.66 -0.00 -1.81 0.11 115.31 114.34 1ry4 h LEU 205 Ca -0.45 0.03 -0.10 0.00 -0.00 0.00 0.00 57.88 57.36 1ry4 h LEU 205 Cb 1.20 -0.16 -0.01 0.00 -0.00 0.00 0.00 40.66 41.68 1ry4 h LEU 205 CO 0.59 0.54 -0.49 0.00 -0.00 0.00 0.00 178.44 179.09 1ry4 h ALA 206 N 1.52 0.89 -0.08 1.53 0.00 -1.93 -2.77 119.26 118.42 1ry4 h ALA 206 Ca 0.45 -0.45 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1ry4 h ALA 206 Cb 0.36 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ry4 h ALA 206 CO -0.20 0.61 -0.33 1.49 0.00 0.00 0.00 179.25 180.81 1ry4 h GLU 207 N 0.00 0.37 -0.58 0.00 4.57 -1.35 -3.18 114.58 114.41 1ry4 h GLU 207 Ca -0.00 -0.29 0.13 0.00 -1.18 0.00 0.00 59.36 58.01 1ry4 h GLU 207 Cb 1.08 0.06 -0.03 0.00 -0.16 0.00 0.00 28.75 29.69 1ry4 h GLU 207 CO 0.06 0.92 0.40 0.77 -1.18 0.00 0.00 179.01 179.99 1ry4 h SER 208 N -0.09 0.21 -0.55 1.04 0.02 -0.76 -2.04 113.55 111.38 1ry4 h SER 208 Ca -0.02 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.92 1ry4 h SER 208 Cb 0.97 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 1ry4 h SER 208 CO 0.07 0.12 0.25 0.74 -1.14 0.00 0.00 176.83 176.88 1ry4 h THR 209 N 0.23 1.21 0.00 -2.27 2.02 -1.46 -3.46 112.91 109.17 1ry4 h THR 209 Ca 0.28 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1ry4 h THR 209 Cb 0.78 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1ry4 h THR 209 CO -0.06 0.24 0.00 0.61 0.37 0.00 0.00 175.52 176.68 1ry4 n GLY 210 N -0.90 2.30 1.14 2.16 0.00 -0.77 -4.70 105.19 104.42 1ry4 n GLY 210 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1ry4 n GLY 210 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1ry4 n LEU 211 N 0.00 3.34 -4.46 0.99 -0.00 -1.26 -4.90 117.00 110.71 1ry4 n LEU 211 Ca 0.00 -1.58 -0.31 0.00 -0.00 0.00 0.00 56.01 54.12 1ry4 n LEU 211 Cb 0.00 -0.35 -0.13 0.00 -0.00 0.00 0.00 43.42 42.94 1ry4 n LEU 211 CO 0.00 0.79 -0.49 -0.76 -0.00 0.00 0.00 177.39 176.93 1ry4 s LEU 212 N -1.20 2.62 0.24 1.47 1.43 -1.26 -4.92 118.68 117.06 1ry4 s LEU 212 Ca 0.41 -0.42 0.08 0.00 -1.03 0.00 0.00 54.13 53.17 1ry4 s LEU 212 Cb 0.22 -1.53 -0.05 0.00 0.03 0.00 0.00 46.19 44.86 1ry4 s LEU 212 CO 0.30 0.26 -0.12 0.00 0.23 0.00 0.00 176.35 177.02 1ry4 s ALA 213 N -0.92 2.23 0.38 4.21 0.00 -1.26 -5.01 121.76 121.39 1ry4 s ALA 213 Ca 0.15 -1.78 0.39 0.00 0.00 0.00 0.00 51.96 50.71 1ry4 s ALA 213 Cb -0.11 0.00 1.96 0.00 0.00 0.00 0.00 23.12 24.98 1ry4 s ALA 213 CO 0.05 0.04 2.18 0.28 0.00 0.00 0.00 175.76 178.31 1ry4 h VAL 214 N 2.41 0.00 0.00 0.00 2.07 -1.94 -1.24 116.25 117.56 1ry4 h VAL 214 Ca -0.39 -0.17 -0.08 0.00 0.82 0.00 0.00 66.70 66.88 1ry4 h VAL 214 Cb 1.23 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.11 1ry4 h VAL 214 CO 0.64 0.00 -0.37 -1.13 0.02 0.00 0.00 177.57 176.72 1ry4 h ASN 215 N 0.00 0.00 -4.24 0.57 -1.24 -1.96 -3.34 115.58 105.37 1ry4 h ASN 215 Ca 0.00 0.00 -0.51 0.00 0.71 0.00 0.00 56.30 56.50 1ry4 h ASN 215 Cb 0.18 0.00 0.10 0.00 0.73 0.00 0.00 38.32 39.33 1ry4 h ASN 215 CO 0.00 0.37 0.36 -1.81 -1.29 0.00 0.00 177.43 175.07 1ry4 s ASP 216 N -6.37 5.09 0.28 1.15 1.01 -0.47 -4.64 116.67 112.72 1ry4 s ASP 216 Ca 0.02 1.89 0.06 0.00 0.71 0.00 0.00 52.55 55.22 1ry4 s ASP 216 Cb 0.09 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.43 1ry4 s ASP 216 CO 0.69 -1.64 -0.03 -1.83 0.21 0.00 0.00 175.17 172.57 1ry4 s GLU 217 N -4.38 1.55 0.24 8.23 1.03 -1.08 -1.38 118.70 122.91 1ry4 s GLU 217 Ca 0.64 -1.80 -0.24 0.00 0.03 0.00 0.00 54.97 53.60 1ry4 s GLU 217 Cb -0.18 -1.07 -0.09 0.00 -0.80 0.00 0.00 34.13 31.99 1ry4 s GLU 217 CO 0.46 -0.01 0.83 0.14 -1.33 0.00 0.00 175.26 175.35 1ry4 s VAL 218 N -3.09 4.34 -0.05 1.83 -7.23 -1.21 -0.97 120.40 114.03 1ry4 s VAL 218 Ca 0.30 1.66 -0.02 0.00 -1.81 0.00 0.00 61.98 62.11 1ry4 s VAL 218 Cb 0.05 -4.03 -0.03 0.00 0.56 0.00 0.00 36.38 32.93 1ry4 s VAL 218 CO 0.12 0.29 -0.06 -0.38 -0.31 0.00 0.00 175.10 174.76 1ry4 n ILE 219 N 0.96 0.30 -3.89 -0.62 2.08 0.15 -4.85 119.36 113.49 1ry4 n ILE 219 Ca -0.02 -0.09 -0.09 0.00 0.56 0.00 0.00 62.75 63.12 1ry4 n ILE 219 Cb 0.50 -1.34 -0.08 0.00 -0.75 0.00 0.00 39.64 37.97 1ry4 n ILE 219 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1ry4 s GLU 220 N -2.10 0.80 -0.38 0.38 2.02 -1.19 -3.39 118.70 114.85 1ry4 s GLU 220 Ca -0.07 -0.96 0.03 0.00 0.02 0.00 0.00 54.97 53.98 1ry4 s GLU 220 Cb 0.03 0.32 0.11 0.00 0.10 0.00 0.00 34.13 34.68 1ry4 s GLU 220 CO 0.10 -0.24 0.11 0.08 0.02 0.00 0.00 175.26 175.34 1ry4 s VAL 221 N -3.74 1.96 0.00 2.63 1.01 0.12 -0.65 120.40 121.73 1ry4 s VAL 221 Ca 0.04 -2.35 0.00 0.00 0.00 0.00 0.00 61.98 59.67 1ry4 s VAL 221 Cb 0.05 -2.43 0.00 0.00 0.00 0.00 0.00 36.38 33.99 1ry4 s VAL 221 CO -0.10 -0.68 0.00 -3.20 0.00 0.00 0.00 175.10 171.12 1ry4 n ASN 222 N 4.10 0.00 -0.38 3.32 5.15 -0.17 -0.92 115.26 126.37 1ry4 n ASN 222 Ca 0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.01 1ry4 n ASN 222 Cb 0.39 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.64 1ry4 n ASN 222 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ry4 n GLY 223 N 0.00 0.55 3.32 8.20 0.00 -1.26 -5.04 105.19 110.96 1ry4 n GLY 223 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 2.07 0.39 -0.61 1.01 -0.09 -5.12 121.20 118.84 1ry4 s ILE 224 Ca 0.00 -1.25 -0.11 0.00 0.00 0.00 0.00 60.65 59.29 1ry4 s ILE 224 Cb 0.00 -1.74 -0.07 0.00 0.01 0.00 0.00 42.46 40.66 1ry4 s ILE 224 CO 0.00 0.46 0.76 -1.61 0.00 0.00 0.00 174.94 174.55 1ry4 s GLU 225 N -0.94 3.82 0.00 2.79 0.41 -1.26 0.13 118.70 123.65 1ry4 s GLU 225 Ca 0.11 0.51 0.02 0.00 -0.41 0.00 0.00 54.97 55.20 1ry4 s GLU 225 Cb -0.10 -2.40 0.00 0.00 -1.78 0.00 0.00 34.13 29.86 1ry4 s GLU 225 CO 0.01 0.00 0.41 1.33 -0.49 0.00 0.00 175.26 176.52 1ry4 n VAL 226 N -1.12 0.00 -2.97 2.63 0.24 -1.22 -4.80 118.33 111.10 1ry4 n VAL 226 Ca 0.03 -0.48 -0.41 0.00 -2.04 0.00 0.00 64.34 61.43 1ry4 n VAL 226 Cb 0.54 1.03 -0.05 0.00 -1.47 0.00 0.00 33.84 33.89 1ry4 n VAL 226 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ry4 s ALA 227 N -0.54 3.58 0.00 2.33 0.00 -1.26 -3.05 121.76 122.83 1ry4 s ALA 227 Ca 0.02 -0.15 0.00 0.00 0.00 0.00 0.00 51.96 51.83 1ry4 s ALA 227 Cb 0.02 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1ry4 s ALA 227 CO 0.05 -0.75 0.00 0.41 0.00 0.00 0.00 175.76 175.46 1ry4 n GLY 228 N 3.73 0.98 3.90 0.00 0.00 -1.26 -5.03 105.19 107.51 1ry4 n GLY 228 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 1ry4 n GLY 228 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ry4 s LYS 229 N -0.69 3.66 0.62 1.61 2.20 -1.17 -5.07 119.74 120.90 1ry4 s LYS 229 Ca 0.00 0.06 -0.14 0.00 -0.36 0.00 0.00 55.97 55.53 1ry4 s LYS 229 Cb 0.00 -2.64 -0.03 0.00 -1.51 0.00 0.00 37.83 33.65 1ry4 s LYS 229 CO 0.00 0.23 1.05 0.99 -0.36 0.00 0.00 175.35 177.26 1ry4 s THR 230 N -2.04 3.93 0.27 3.43 2.01 -1.26 -4.93 115.64 117.06 1ry4 s THR 230 Ca 0.45 0.83 -0.01 0.00 0.31 0.00 0.00 61.69 63.26 1ry4 s THR 230 Cb -0.11 -3.41 0.13 0.00 0.01 0.00 0.00 72.50 69.12 1ry4 s THR 230 CO 0.28 -0.63 1.79 0.17 -0.69 0.00 0.00 174.62 175.55 1ry4 h LEU 231 N 0.13 0.74 -1.32 4.42 -0.00 -1.97 -2.11 115.31 115.19 1ry4 h LEU 231 Ca -0.46 -0.16 0.02 0.00 -0.00 0.00 0.00 57.88 57.28 1ry4 h LEU 231 Cb 1.21 -0.20 -0.04 0.00 -0.00 0.00 0.00 40.66 41.64 1ry4 h LEU 231 CO 0.58 0.79 0.47 -0.78 -0.00 0.00 0.00 178.44 179.49 1ry4 h ASP 232 N 0.74 0.78 -0.03 0.17 3.58 -1.99 0.66 116.42 120.33 1ry4 h ASP 232 Ca 0.15 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.56 1ry4 h ASP 232 Cb 0.39 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 41.26 1ry4 h ASP 232 CO 0.01 0.55 -0.10 -0.61 -2.88 0.00 0.00 179.24 176.21 1ry4 h GLN 233 N 0.91 0.13 -0.25 0.28 5.75 -1.78 -2.31 115.11 117.84 1ry4 h GLN 233 Ca 0.27 -0.09 0.04 0.00 -0.15 0.00 0.00 58.65 58.72 1ry4 h GLN 233 Cb -0.02 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.51 1ry4 h GLN 233 CO -0.07 0.71 0.03 0.28 -2.65 0.00 0.00 178.83 177.13 1ry4 h VAL 234 N -0.44 0.86 -0.28 2.39 2.07 -0.84 0.12 116.25 120.14 1ry4 h VAL 234 Ca -0.00 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 1ry4 h VAL 234 Cb 0.72 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 1ry4 h VAL 234 CO 0.02 0.02 -0.10 0.71 0.02 0.00 0.00 177.57 178.24 1ry4 h THR 235 N 0.12 1.21 -0.41 2.57 1.35 -0.95 -2.30 112.91 114.50 1ry4 h THR 235 Ca 0.12 -0.93 -0.13 0.00 -0.55 0.00 0.00 66.41 64.92 1ry4 h THR 235 Cb 0.13 1.11 -0.01 0.00 -1.73 0.00 0.00 68.15 67.65 1ry4 h THR 235 CO -0.17 0.30 -0.26 -0.78 -0.25 0.00 0.00 175.52 174.37 1ry4 h ASP 236 N 0.43 0.89 -0.51 5.36 3.58 -0.68 -1.88 116.42 123.61 1ry4 h ASP 236 Ca 0.08 -0.34 0.04 0.00 0.42 0.00 0.00 57.03 57.23 1ry4 h ASP 236 Cb 0.44 -0.25 -0.04 0.00 1.72 0.00 0.00 39.33 41.20 1ry4 h ASP 236 CO 0.02 1.09 0.27 0.24 -2.88 0.00 0.00 179.24 177.99 1ry4 h MET 237 N 0.74 0.52 0.00 0.28 2.86 -0.31 0.16 114.93 119.19 1ry4 h MET 237 Ca 0.09 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1ry4 h MET 237 Cb 0.80 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.35 1ry4 h MET 237 CO 0.07 0.34 0.00 0.00 1.06 0.00 0.00 176.91 178.38 1ry4 h MET 238 N 0.54 0.00 0.16 1.72 -0.00 -1.25 -2.92 114.93 113.18 1ry4 h MET 238 Ca 0.22 0.00 -0.30 0.00 -0.00 0.00 0.00 59.70 59.61 1ry4 h MET 238 Cb 0.09 0.00 0.03 0.00 -0.00 0.00 0.00 31.60 31.72 1ry4 h MET 238 CO -0.13 0.00 -1.31 0.28 -0.00 0.00 0.00 176.91 175.75 1ry4 h VAL 239 N 0.00 1.33 0.00 -0.10 2.07 -0.19 -1.87 116.25 117.49 1ry4 h VAL 239 Ca 0.00 -2.65 -0.07 0.00 0.82 0.00 0.00 66.70 64.80 1ry4 h VAL 239 Cb 0.57 2.84 -0.01 0.00 -1.52 0.00 0.00 31.29 33.18 1ry4 h VAL 239 CO 0.00 0.80 -0.33 0.00 0.02 0.00 0.00 177.57 178.06 1ry4 h ALA 240 N 0.33 1.36 -0.55 1.67 0.00 -1.04 -2.46 119.26 118.58 1ry4 h ALA 240 Ca -0.20 -0.30 -0.32 0.00 0.00 0.00 0.00 54.91 54.10 1ry4 h ALA 240 Cb 1.99 -0.05 -0.19 0.00 0.00 0.00 0.00 17.79 19.54 1ry4 h ALA 240 CO 0.24 0.41 0.02 0.09 0.00 0.00 0.00 179.25 180.01 1ry4 n ASN 241 N -4.01 3.41 0.28 0.00 3.02 -1.11 -4.81 115.26 112.04 1ry4 n ASN 241 Ca -0.02 -3.77 0.12 0.00 -0.03 0.00 0.00 54.58 50.88 1ry4 n ASN 241 Cb 0.38 -0.66 0.79 0.00 -0.61 0.00 0.00 39.78 39.67 1ry4 n ASN 241 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1ry4 h SER 242 N 1.23 0.00 -0.20 6.41 4.64 -0.83 -3.03 113.55 121.78 1ry4 h SER 242 Ca 0.33 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.68 1ry4 h SER 242 Cb 1.72 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.77 1ry4 h SER 242 CO 0.65 0.00 -0.36 0.77 -0.87 0.00 0.00 176.83 177.02 1ry4 h SER 243 N 0.00 -1.17 -3.31 4.97 4.64 -1.86 -3.29 113.55 113.53 1ry4 h SER 243 Ca -0.00 0.15 -0.61 0.00 -0.47 0.00 0.00 61.79 60.86 1ry4 h SER 243 Cb 0.00 0.47 -0.40 0.00 -0.31 0.00 0.00 62.40 62.16 1ry4 h SER 243 CO 0.00 -0.28 -0.75 0.20 -0.87 0.00 0.00 176.83 175.13 1ry4 s ASN 244 N -4.15 3.52 -0.07 4.97 0.01 -1.23 -1.18 114.94 116.81 1ry4 s ASN 244 Ca -0.10 -2.80 -0.19 0.00 -0.71 0.00 0.00 52.86 49.06 1ry4 s ASN 244 Cb 0.05 -1.02 -0.05 0.00 0.41 0.00 0.00 41.25 40.64 1ry4 s ASN 244 CO 0.40 -0.24 0.54 -1.48 -1.51 0.00 0.00 177.10 174.81 1ry4 s LEU 245 N 0.13 4.33 -0.20 0.60 0.05 -1.04 -4.82 118.68 117.72 1ry4 s LEU 245 Ca 0.20 0.97 -0.06 0.00 0.05 0.00 0.00 54.13 55.29 1ry4 s LEU 245 Cb -0.19 -2.81 -0.03 0.00 -2.05 0.00 0.00 46.19 41.11 1ry4 s LEU 245 CO -0.04 0.03 0.03 -0.63 -0.55 0.00 0.00 176.35 175.19 1ry4 s ILE 246 N 0.32 4.26 -0.16 1.48 1.09 -1.26 -0.75 121.20 126.18 1ry4 s ILE 246 Ca 0.29 -0.21 -0.02 0.00 -1.10 0.00 0.00 60.65 59.61 1ry4 s ILE 246 Cb -0.16 -2.94 -0.02 0.00 -1.06 0.00 0.00 42.46 38.28 1ry4 s ILE 246 CO 0.14 0.42 -0.07 -0.51 -0.10 0.00 0.00 174.94 174.81 1ry4 s ILE 247 N 0.94 3.50 -0.17 2.92 2.07 0.90 -0.99 121.20 130.36 1ry4 s ILE 247 Ca 0.02 -0.49 -0.06 0.00 -1.41 0.00 0.00 60.65 58.72 1ry4 s ILE 247 Cb -0.14 -2.52 -0.03 0.00 0.13 0.00 0.00 42.46 39.89 1ry4 s ILE 247 CO 0.02 0.49 0.01 -0.89 -1.91 0.00 0.00 174.94 172.67 1ry4 s THR 248 N 0.55 4.33 0.18 4.00 2.01 0.17 -1.10 115.64 125.77 1ry4 s THR 248 Ca -0.05 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 61.76 1ry4 s THR 248 Cb -0.15 -2.93 -0.05 0.00 0.01 0.00 0.00 72.50 69.39 1ry4 s THR 248 CO 0.03 0.47 0.03 0.68 -0.69 0.00 0.00 174.62 175.14 1ry4 s VAL 249 N 0.42 0.56 -0.08 3.82 -7.23 -1.24 0.31 120.40 116.96 1ry4 s VAL 249 Ca -0.00 -1.97 0.02 0.00 -1.81 0.00 0.00 61.98 58.22 1ry4 s VAL 249 Cb -0.13 -2.19 0.01 0.00 0.56 0.00 0.00 36.38 34.62 1ry4 s VAL 249 CO 0.02 -0.39 -0.15 -0.54 -0.31 0.00 0.00 175.10 173.73 1ry4 s LYS 250 N -3.96 2.05 0.14 4.82 1.02 -0.14 -4.18 119.74 119.50 1ry4 s LYS 250 Ca 0.26 -0.53 -0.32 0.00 0.02 0.00 0.00 55.97 55.40 1ry4 s LYS 250 Cb 0.07 -1.67 -0.12 0.00 -0.52 0.00 0.00 37.83 35.59 1ry4 s LYS 250 CO 0.05 0.04 1.76 -2.30 -0.92 0.00 0.00 175.35 173.98 1ry4 n PRO 251 N 3.84 2.63 -0.15 -1.68 -0.02 -1.26 -2.65 135.00 135.71 1ry4 n PRO 251 Ca -0.21 0.95 0.05 0.00 -2.02 0.00 0.00 63.50 62.27 1ry4 n PRO 251 Cb 0.52 -2.81 0.15 0.00 -0.02 0.00 0.00 33.50 31.34 1ry4 n PRO 251 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ry4 n ALA 252 N 4.79 2.46 -0.02 3.55 0.00 -1.26 -3.45 120.51 126.57 1ry4 n ALA 252 Ca 0.18 -0.53 0.06 0.00 0.00 0.00 0.00 53.44 53.15 1ry4 n ALA 252 Cb 0.34 -0.98 0.26 0.00 0.00 0.00 0.00 19.45 19.07 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 0.38 3.63 -4.85 0.00 3.02 -1.26 -4.86 115.26 111.32 1ry4 n ASN 253 Ca 0.10 -2.37 -0.35 0.00 -0.03 0.00 0.00 54.58 51.93 1ry4 n ASN 253 Cb 0.26 -0.51 -0.06 0.00 -0.61 0.00 0.00 39.78 38.86 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 -1.84 3.95 0.00 3.52 0.74 -1.16 -1.51 119.66 123.37 1ry4 s GLN 254 Ca 0.36 0.44 0.00 0.00 0.05 0.00 0.00 55.36 56.22 1ry4 s GLN 254 Cb 0.24 -2.96 0.00 0.00 1.10 0.00 0.00 33.01 31.39 1ry4 s GLN 254 CO 0.16 0.50 0.00 -2.13 -0.55 0.00 0.00 175.29 173.28