#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyx n VAL 122 N 0.00 -3.49 0.00 2.52 0.31 -1.26 -1.43 118.33 114.98 1xyx n VAL 122 Ca 0.00 -0.46 0.00 0.00 -0.01 0.00 0.00 64.34 63.87 1xyx n VAL 122 Cb 0.00 -2.86 0.00 0.00 -0.91 0.00 0.00 33.84 30.07 1xyx n VAL 122 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xyx n GLY 123 N -1.91 1.73 2.63 2.92 0.00 -1.26 -2.53 105.19 106.77 1xyx n GLY 123 Ca -0.17 0.06 -0.04 0.00 0.00 0.00 0.00 46.02 45.87 1xyx n GLY 123 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyx n GLY 124 N 0.00 -0.23 0.17 -0.02 0.00 -1.16 -5.02 105.19 98.94 1xyx n GLY 124 Ca 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.83 1xyx n GLY 124 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1xyx h LEU 125 N 1.31 0.60 0.00 0.99 -0.00 -0.95 -3.48 115.31 113.78 1xyx h LEU 125 Ca -0.50 -0.58 0.00 0.00 -0.00 0.00 0.00 57.88 56.80 1xyx h LEU 125 Cb 1.25 -0.17 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 1xyx h LEU 125 CO -0.17 1.08 0.00 0.61 -0.00 0.00 0.00 178.44 179.95 1xyx n GLY 126 N 0.52 1.27 0.00 0.83 0.00 -1.26 -4.72 105.19 101.83 1xyx n GLY 126 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1xyx n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyx n GLY 127 N 0.00 1.41 3.63 -0.02 0.00 -1.26 -5.11 105.19 103.84 1xyx n GLY 127 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.54 1xyx n GLY 127 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1xyx n TYR 128 N -0.08 1.83 -1.72 1.61 4.02 -1.26 -4.96 117.16 116.59 1xyx n TYR 128 Ca 0.00 0.50 -0.38 0.00 -0.01 0.00 0.00 57.90 58.00 1xyx n TYR 128 Cb 0.00 -2.41 0.05 0.00 -0.02 0.00 0.00 39.34 36.96 1xyx n TYR 128 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 176.86 175.73 1xyx n MET 129 N 2.50 1.48 -4.99 -0.72 1.56 0.32 -4.86 117.12 112.40 1xyx n MET 129 Ca 0.16 0.55 -0.32 0.00 -0.27 0.00 0.00 57.70 57.82 1xyx n MET 129 Cb 0.26 -2.51 -0.17 0.00 2.15 0.00 0.00 33.22 32.95 1xyx n MET 129 CO 0.00 0.00 0.00 -1.17 -0.73 0.00 0.00 175.97 174.07 1xyx s LEU 130 N -3.42 2.08 0.92 -0.89 2.96 -1.26 -1.07 118.68 118.00 1xyx s LEU 130 Ca 0.74 -0.57 -0.13 0.00 -0.22 0.00 0.00 54.13 53.96 1xyx s LEU 130 Cb -0.41 -1.40 0.14 0.00 0.50 0.00 0.00 46.19 45.02 1xyx s LEU 130 CO 0.47 0.13 1.15 -0.83 -1.32 0.00 0.00 176.35 175.95 1xyx s GLY 131 N 0.53 1.59 0.76 7.98 0.00 0.09 -5.00 107.32 113.26 1xyx s GLY 131 Ca -0.14 -0.59 -0.11 0.00 0.00 0.00 0.00 44.72 43.88 1xyx s GLY 131 CO 0.05 -0.01 1.08 -1.35 0.00 0.00 0.00 173.10 172.87 1xyx s SER 132 N -4.11 4.87 0.60 1.64 1.04 -1.26 -4.50 113.70 111.97 1xyx s SER 132 Ca 0.64 1.39 -0.18 0.00 0.48 0.00 0.00 55.95 58.29 1xyx s SER 132 Cb -0.14 -2.18 -0.07 0.00 0.10 0.00 0.00 66.02 63.73 1xyx s SER 132 CO 0.53 -1.74 0.68 0.00 0.98 0.00 0.00 173.24 173.68 1xyx n ALA 133 N -3.30 -0.72 -2.26 5.32 0.00 -1.26 -4.41 120.51 113.88 1xyx n ALA 133 Ca 0.07 -0.03 -0.15 0.00 0.00 0.00 0.00 53.44 53.33 1xyx n ALA 133 Cb 0.55 -1.93 -0.09 0.00 0.00 0.00 0.00 19.45 17.99 1xyx n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xyx s MET 134 N -2.38 1.41 1.22 0.00 0.23 -0.39 -4.94 119.30 114.45 1xyx s MET 134 Ca 0.71 -1.76 -0.14 0.00 -1.03 0.00 0.00 55.69 53.47 1xyx s MET 134 Cb -0.43 0.30 0.31 0.00 -1.53 0.00 0.00 34.83 33.48 1xyx s MET 134 CO 0.52 -0.49 1.01 0.45 -2.03 0.00 0.00 175.02 174.47 1xyx s SER 135 N -3.23 0.54 0.27 -1.18 0.15 -1.26 -4.90 113.70 104.09 1xyx s SER 135 Ca 0.39 1.41 -0.30 0.00 0.70 0.00 0.00 55.95 58.16 1xyx s SER 135 Cb 0.05 -2.18 -0.10 0.00 -1.71 0.00 0.00 66.02 62.07 1xyx s SER 135 CO 0.18 -4.46 1.49 -0.13 1.20 0.00 0.00 173.24 171.52 1xyx s ARG 136 N -4.50 4.22 0.80 5.44 0.52 -1.26 -5.03 118.95 119.13 1xyx s ARG 136 Ca 0.69 2.40 -0.13 0.00 -0.52 0.00 0.00 55.73 58.16 1xyx s ARG 136 Cb -0.24 -3.08 0.20 0.00 0.52 0.00 0.00 34.95 32.35 1xyx s ARG 136 CO 0.64 -0.49 0.79 -0.35 0.02 0.00 0.00 175.30 175.91 1xyx n PRO 137 N 2.23 -2.10 -4.94 3.54 -0.04 -1.26 -5.08 135.00 127.35 1xyx n PRO 137 Ca 0.07 -1.25 -0.31 0.00 -0.04 0.00 0.00 63.50 61.98 1xyx n PRO 137 Cb 0.39 -1.08 -0.17 0.00 -0.04 0.00 0.00 33.50 32.61 1xyx n PRO 137 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xyx s MET 138 N -4.77 2.80 0.20 0.54 0.23 -1.26 -5.12 119.30 111.93 1xyx s MET 138 Ca 0.49 -0.79 0.07 0.00 -1.03 0.00 0.00 55.69 54.43 1xyx s MET 138 Cb -0.04 -2.19 -0.05 0.00 -1.53 0.00 0.00 34.83 31.03 1xyx s MET 138 CO 0.37 0.09 -0.12 0.42 -2.03 0.00 0.00 175.02 173.75 1xyx s ILE 139 N 0.55 1.56 -0.39 3.16 1.01 -1.26 -4.95 121.20 120.88 1xyx s ILE 139 Ca -0.14 -2.16 0.03 0.00 0.00 0.00 0.00 60.65 58.37 1xyx s ILE 139 Cb -0.17 -2.04 0.16 0.00 0.01 0.00 0.00 42.46 40.42 1xyx s ILE 139 CO 0.05 -0.60 0.37 -1.38 0.00 0.00 0.00 174.94 173.38 1xyx s HIS 140 N -3.08 0.12 -0.94 3.97 -3.43 -1.26 -5.01 115.29 105.66 1xyx s HIS 140 Ca 0.22 -1.34 0.24 0.00 -0.80 0.00 0.00 55.06 53.38 1xyx s HIS 140 Cb 0.01 -0.56 0.99 0.00 -1.43 0.00 0.00 32.58 31.59 1xyx s HIS 140 CO 0.06 -0.94 1.76 1.19 -2.00 0.00 0.00 174.74 174.81 1xyx n PHE 141 N 3.72 0.14 -1.98 0.38 3.72 -1.26 -4.91 117.46 117.27 1xyx n PHE 141 Ca 0.17 0.05 -0.15 0.00 -0.05 0.00 0.00 57.45 57.46 1xyx n PHE 141 Cb 0.45 -0.57 -0.03 0.00 -0.94 0.00 0.00 39.48 38.39 1xyx n PHE 141 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xyx n GLY 142 N 0.94 0.40 2.96 1.37 0.00 -1.26 -5.02 105.19 104.57 1xyx n GLY 142 Ca 0.06 -0.27 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 1xyx n GLY 142 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xyx s ASN 143 N -2.51 -0.07 0.12 1.61 0.01 -1.26 -5.04 114.94 107.81 1xyx s ASN 143 Ca 0.00 0.14 -0.18 0.00 -0.71 0.00 0.00 52.86 52.10 1xyx s ASN 143 Cb 0.00 0.16 -0.04 0.00 0.41 0.00 0.00 41.25 41.78 1xyx s ASN 143 CO 0.00 -0.04 1.72 0.44 -1.51 0.00 0.00 177.10 177.71 1xyx h ASP 144 N 5.95 0.36 0.20 -1.22 3.32 -2.00 -1.48 116.42 121.56 1xyx h ASP 144 Ca -0.25 -0.09 -0.12 0.00 0.02 0.00 0.00 57.03 56.59 1xyx h ASP 144 Cb 1.20 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 1xyx h ASP 144 CO 0.46 0.34 -0.45 4.11 -1.72 0.00 0.00 179.24 181.98 1xyx h TRP 145 N 0.35 0.38 -0.11 4.55 5.08 -2.00 -2.76 115.95 121.44 1xyx h TRP 145 Ca 0.10 -0.11 -0.18 0.00 1.08 0.00 0.00 58.89 59.78 1xyx h TRP 145 Cb 0.06 -0.08 -0.00 0.00 -3.00 0.00 0.00 29.16 26.14 1xyx h TRP 145 CO -0.03 0.72 -0.67 0.93 -1.28 0.00 0.00 178.44 178.10 1xyx h GLU 146 N 0.26 0.47 -0.40 0.12 5.08 -1.93 -1.64 114.58 116.53 1xyx h GLU 146 Ca 0.02 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1xyx h GLU 146 Cb 0.90 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.20 1xyx h GLU 146 CO 0.07 0.98 0.24 0.22 -1.00 0.00 0.00 179.01 179.52 1xyx h ASP 147 N 0.33 0.48 -0.33 1.42 3.58 -1.08 0.08 116.42 120.91 1xyx h ASP 147 Ca -0.02 -0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.37 1xyx h ASP 147 Cb 1.24 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 42.15 1xyx h ASP 147 CO 0.12 0.40 0.20 -0.09 -2.88 0.00 0.00 179.24 176.99 1xyx h ARG 148 N 0.52 0.44 0.21 0.28 2.43 -1.49 -2.27 114.38 114.51 1xyx h ARG 148 Ca 0.14 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1xyx h ARG 148 Cb 0.01 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 1xyx h ARG 148 CO -0.03 0.32 -0.28 -0.92 -1.51 0.00 0.00 179.97 177.56 1xyx h TYR 149 N 0.43 -0.75 -0.62 2.20 5.03 -0.30 -1.72 116.97 121.23 1xyx h TYR 149 Ca 0.12 0.01 0.11 0.00 2.58 0.00 0.00 58.73 61.55 1xyx h TYR 149 Cb -0.01 0.30 -0.12 0.00 1.55 0.00 0.00 36.73 38.45 1xyx h TYR 149 CO -0.04 -0.40 -0.30 -0.92 -1.32 0.00 0.00 178.16 175.18 1xyx h TYR 150 N -0.55 -0.80 0.00 -3.82 3.20 -1.03 -2.07 116.97 111.90 1xyx h TYR 150 Ca 0.01 0.07 -0.04 0.00 3.14 0.00 0.00 58.73 61.91 1xyx h TYR 150 Cb 0.54 0.44 -0.01 0.00 1.54 0.00 0.00 36.73 39.24 1xyx h TYR 150 CO -0.21 -0.36 -0.17 0.00 -1.64 0.00 0.00 178.16 175.78 1xyx h ARG 151 N -0.12 0.00 0.00 1.82 3.08 -0.73 -2.42 114.38 116.01 1xyx h ARG 151 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1xyx h ARG 151 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1xyx h ARG 151 CO -0.70 0.17 -1.31 0.39 -1.07 0.00 0.00 179.97 177.45 1xyx n GLU 152 N -4.25 0.42 -2.34 0.04 -0.58 -0.74 -4.41 120.64 108.77 1xyx n GLU 152 Ca -0.02 -0.04 -0.30 0.00 -0.42 0.00 0.00 57.16 56.37 1xyx n GLU 152 Cb 0.24 -1.60 0.01 0.00 -0.57 0.00 0.00 31.44 29.52 1xyx n GLU 152 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1xyx n ASN 153 N -2.12 5.41 -0.81 1.62 3.02 -0.82 -4.66 115.26 116.91 1xyx n ASN 153 Ca 0.00 -3.75 0.10 0.00 -0.03 0.00 0.00 54.58 50.90 1xyx n ASN 153 Cb 0.48 -0.61 0.10 0.00 -0.61 0.00 0.00 39.78 39.14 1xyx n ASN 153 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 1xyx n MET 154 N -0.49 1.79 -0.02 3.52 0.00 -1.20 -4.63 117.12 116.09 1xyx n MET 154 Ca 0.43 -1.73 -0.09 0.00 0.00 0.00 0.00 57.70 56.31 1xyx n MET 154 Cb 0.55 -1.38 -0.14 0.00 0.00 0.00 0.00 33.22 32.25 1xyx n MET 154 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 175.97 178.45 1xyx n TYR 155 N 1.11 1.04 0.07 3.17 4.11 -1.26 -4.24 117.16 121.15 1xyx n TYR 155 Ca 0.12 0.36 -0.04 0.00 -0.00 0.00 0.00 57.90 58.35 1xyx n TYR 155 Cb 0.49 -1.19 -0.07 0.00 -0.00 0.00 0.00 39.34 38.57 1xyx n TYR 155 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 1xyx h ARG 156 N 0.00 0.00 -7.32 -3.48 3.08 -1.96 -3.45 114.38 101.26 1xyx h ARG 156 Ca -0.29 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.25 1xyx h ARG 156 Cb 2.01 0.00 0.10 0.00 0.08 0.00 0.00 29.97 32.16 1xyx h ARG 156 CO 0.08 0.72 0.36 0.71 -1.07 0.00 0.00 179.97 180.76 1xyx s TYR 157 N -2.80 2.96 0.98 3.04 2.02 -1.26 -5.05 117.35 117.24 1xyx s TYR 157 Ca 0.01 1.46 -0.12 0.00 -0.37 0.00 0.00 57.07 58.05 1xyx s TYR 157 Cb 0.09 -2.94 0.18 0.00 -0.40 0.00 0.00 41.96 38.89 1xyx s TYR 157 CO 0.80 -1.38 1.10 -1.25 -1.57 0.00 0.00 175.55 173.25 1xyx s PRO 158 N -4.92 0.60 0.00 -1.71 0.04 -1.26 -4.99 135.00 122.76 1xyx s PRO 158 Ca 0.59 0.45 0.11 0.00 0.04 0.00 0.00 61.00 62.20 1xyx s PRO 158 Cb -0.15 -1.76 0.15 0.00 0.04 0.00 0.00 34.50 32.78 1xyx s PRO 158 CO 0.54 -2.60 0.97 -1.71 0.04 0.00 0.00 177.00 174.24 1xyx n ASN 159 N -4.07 2.22 -4.26 6.66 5.15 -1.26 -4.99 115.26 114.70 1xyx n ASN 159 Ca 0.05 -1.61 -0.14 0.00 -0.60 0.00 0.00 54.58 52.28 1xyx n ASN 159 Cb 0.58 -0.06 -0.10 0.00 -0.53 0.00 0.00 39.78 39.66 1xyx n ASN 159 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1xyx s GLN 160 N -0.97 1.29 0.09 1.20 -0.21 -1.26 -1.26 119.66 118.54 1xyx s GLN 160 Ca 0.16 -1.68 -0.04 0.00 0.02 0.00 0.00 55.36 53.82 1xyx s GLN 160 Cb 0.10 -0.01 -0.03 0.00 1.00 0.00 0.00 33.01 34.08 1xyx s GLN 160 CO 0.15 -0.33 0.08 0.14 -2.12 0.00 0.00 175.29 173.21 1xyx s VAL 161 N -3.94 0.16 0.22 1.09 -7.23 -1.26 -4.98 120.40 104.45 1xyx s VAL 161 Ca 0.37 -1.64 -0.02 0.00 -1.81 0.00 0.00 61.98 58.89 1xyx s VAL 161 Cb 0.07 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.33 1xyx s VAL 161 CO 0.12 -0.71 0.43 -0.31 -0.31 0.00 0.00 175.10 174.31 1xyx s TYR 162 N -3.94 3.48 0.27 2.82 2.02 -1.26 -0.73 117.35 120.01 1xyx s TYR 162 Ca 0.12 0.41 -0.21 0.00 -0.37 0.00 0.00 57.07 57.01 1xyx s TYR 162 Cb 0.07 -1.91 0.02 0.00 -0.40 0.00 0.00 41.96 39.74 1xyx s TYR 162 CO -0.06 0.33 0.74 1.52 -1.57 0.00 0.00 175.55 176.51 1xyx s TYR 163 N -1.92 -0.18 0.41 2.71 1.13 -0.23 -4.77 117.35 114.50 1xyx s TYR 163 Ca 0.40 -0.27 -0.03 0.00 -1.41 0.00 0.00 57.07 55.76 1xyx s TYR 163 Cb -0.11 0.71 -0.04 0.00 -1.10 0.00 0.00 41.96 41.42 1xyx s TYR 163 CO 0.29 -1.21 0.67 1.03 -2.51 0.00 0.00 175.55 173.82 1xyx s ARG 164 N -3.87 3.52 0.99 -3.49 0.52 -1.26 -0.52 118.95 114.83 1xyx s ARG 164 Ca 0.11 -0.04 -0.11 0.00 -0.52 0.00 0.00 55.73 55.17 1xyx s ARG 164 Cb -0.06 -2.51 0.18 0.00 0.52 0.00 0.00 34.95 33.09 1xyx s ARG 164 CO 0.07 -0.03 1.09 -1.25 0.02 0.00 0.00 175.30 175.19 1xyx s PRO 165 N -4.51 0.48 0.00 3.54 0.04 -1.26 -4.90 135.00 128.40 1xyx s PRO 165 Ca 0.44 1.10 0.13 0.00 0.04 0.00 0.00 61.00 62.71 1xyx s PRO 165 Cb -0.10 -1.70 0.60 0.00 0.04 0.00 0.00 34.50 33.34 1xyx s PRO 165 CO 0.40 -2.85 1.39 1.33 0.04 0.00 0.00 177.00 177.31 1xyx n VAL 166 N -4.34 0.93 -1.74 -0.36 0.24 -1.26 -4.63 118.33 107.17 1xyx n VAL 166 Ca 0.07 0.23 -0.42 0.00 -2.04 0.00 0.00 64.34 62.19 1xyx n VAL 166 Cb 0.54 -1.01 -0.02 0.00 -1.47 0.00 0.00 33.84 31.88 1xyx n VAL 166 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1xyx n ASP 167 N -1.42 3.84 0.00 -1.34 8.00 -1.26 -1.87 116.55 122.50 1xyx n ASP 167 Ca 0.04 1.14 0.00 0.00 0.71 0.00 0.00 54.79 56.68 1xyx n ASP 167 Cb 0.13 -1.59 0.00 0.00 -0.02 0.00 0.00 41.12 39.65 1xyx n ASP 167 CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 1xyx n GLN 168 N 2.35 0.00 0.00 -1.24 -0.06 -1.26 -4.80 117.38 112.37 1xyx n GLN 168 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.09 1xyx n GLN 168 Cb 0.36 -1.02 0.00 0.00 -4.06 0.00 0.00 30.24 25.52 1xyx n GLN 168 CO 0.00 0.00 0.00 0.98 -0.20 0.00 0.00 177.06 177.84 1xyx n TYR 169 N 0.00 0.00 -3.31 3.69 9.36 -0.78 -4.87 117.16 121.25 1xyx n TYR 169 Ca 0.00 0.00 -0.26 0.00 3.32 0.00 0.00 57.90 60.96 1xyx n TYR 169 Cb 0.00 0.00 0.02 0.00 -0.63 0.00 0.00 39.34 38.73 1xyx n TYR 169 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1xyx n SER 170 N 1.14 -6.34 -1.87 2.98 7.64 -1.26 -4.72 113.62 111.18 1xyx n SER 170 Ca 0.00 -0.03 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1xyx n SER 170 Cb 0.00 -3.05 0.00 0.00 -1.01 0.00 0.00 64.21 60.15 1xyx n SER 170 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1xyx n ASN 171 N -0.59 -7.16 -0.04 6.43 4.13 -1.26 -4.79 115.26 111.97 1xyx n ASN 171 Ca -0.04 1.23 -0.16 0.00 1.68 0.00 0.00 54.58 57.29 1xyx n ASN 171 Cb 0.61 -3.89 -0.06 0.00 -1.54 0.00 0.00 39.78 34.89 1xyx n ASN 171 CO 0.00 0.00 0.00 -0.61 0.28 0.00 0.00 177.26 176.93 1xyx h GLN 172 N 2.94 0.76 0.22 3.52 -0.00 -1.99 -3.13 115.11 117.43 1xyx h GLN 172 Ca 0.00 -0.57 -0.33 0.00 -0.00 0.00 0.00 58.65 57.75 1xyx h GLN 172 Cb 0.00 0.10 0.03 0.00 0.00 0.00 0.00 27.48 27.61 1xyx h GLN 172 CO 0.00 1.19 -1.51 -0.97 0.00 0.00 0.00 178.83 177.54 1xyx h ASN 173 N 0.49 0.73 0.26 -0.69 -1.24 -1.98 0.13 115.58 113.27 1xyx h ASN 173 Ca -0.03 -0.84 -0.03 0.00 0.71 0.00 0.00 56.30 56.12 1xyx h ASN 173 Cb 1.26 -0.24 -0.00 0.00 0.73 0.00 0.00 38.32 40.07 1xyx h ASN 173 CO 0.13 1.67 -0.15 0.78 -1.29 0.00 0.00 177.43 178.57 1xyx h ASN 174 N 0.13 0.00 -0.16 1.15 2.35 -1.94 -1.11 115.58 116.00 1xyx h ASN 174 Ca -0.26 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.40 1xyx h ASN 174 Cb 2.13 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.50 1xyx h ASN 174 CO 0.24 0.15 -0.27 0.15 -1.65 0.00 0.00 177.43 176.05 1xyx h PHE 175 N 0.00 0.58 -0.44 1.19 3.04 -1.45 -2.75 116.94 117.12 1xyx h PHE 175 Ca -0.00 -0.20 0.09 0.00 3.98 0.00 0.00 57.97 61.83 1xyx h PHE 175 Cb 0.32 -0.11 -0.08 0.00 2.56 0.00 0.00 35.95 38.64 1xyx h PHE 175 CO 0.00 0.90 -0.08 0.28 -2.02 0.00 0.00 178.31 177.40 1xyx h VAL 176 N 0.09 0.59 0.08 1.41 2.07 -0.31 -0.10 116.25 120.08 1xyx h VAL 176 Ca 0.01 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1xyx h VAL 176 Cb 0.86 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.16 1xyx h VAL 176 CO 0.06 0.01 -0.19 -0.74 0.02 0.00 0.00 177.57 176.73 1xyx h HIS 177 N 0.03 -0.49 0.41 1.57 -0.00 -1.24 -0.04 115.15 115.39 1xyx h HIS 177 Ca 0.21 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.58 1xyx h HIS 177 Cb 0.32 0.21 0.00 0.00 -0.00 0.00 0.00 27.41 27.94 1xyx h HIS 177 CO -0.35 -0.27 -0.22 0.22 -0.00 0.00 0.00 177.93 177.30 1xyx h ASP 178 N -0.34 -0.53 -0.31 3.26 1.82 -1.11 0.19 116.42 119.40 1xyx h ASP 178 Ca 0.03 0.02 -0.01 0.00 -0.39 0.00 0.00 57.03 56.69 1xyx h ASP 178 Cb 0.38 0.15 -0.01 0.00 0.68 0.00 0.00 39.33 40.52 1xyx h ASP 178 CO -0.12 -0.36 0.16 0.00 -1.61 0.00 0.00 179.24 177.30 1xyx h VAL 180 N 0.37 0.58 -0.73 0.00 2.07 -0.95 0.13 116.25 117.71 1xyx h VAL 180 Ca 0.11 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.58 1xyx h VAL 180 Cb 0.10 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 1xyx h VAL 180 CO -0.01 0.00 0.27 -1.13 0.02 0.00 0.00 177.57 176.72 1xyx h ASN 181 N -0.18 1.01 -0.01 0.57 -1.24 -0.39 0.39 115.58 115.73 1xyx h ASN 181 Ca 0.10 -0.16 -0.16 0.00 0.71 0.00 0.00 56.30 56.79 1xyx h ASN 181 Cb 0.34 -0.26 0.01 0.00 0.73 0.00 0.00 38.32 39.14 1xyx h ASN 181 CO -0.26 0.91 -0.62 0.40 -1.29 0.00 0.00 177.43 176.56 1xyx h ILE 182 N 1.06 1.41 -0.69 2.57 1.08 -0.88 0.23 117.51 122.30 1xyx h ILE 182 Ca 0.24 -2.06 -0.06 0.00 -0.39 0.00 0.00 64.86 62.59 1xyx h ILE 182 Cb 0.23 2.54 -0.03 0.00 -3.07 0.00 0.00 36.82 36.49 1xyx h ILE 182 CO -0.02 0.60 0.20 0.74 -0.69 0.00 0.00 178.15 178.98 1xyx h THR 183 N -0.05 1.25 0.42 -0.27 2.02 -0.72 0.40 112.91 115.96 1xyx h THR 183 Ca -0.07 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 1xyx h THR 183 Cb 1.32 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.25 1xyx h THR 183 CO 0.12 0.35 -0.20 0.40 0.37 0.00 0.00 175.52 176.56 1xyx h ILE 184 N 1.02 0.59 -0.19 3.11 2.04 -0.94 -2.48 117.51 120.67 1xyx h ILE 184 Ca 0.22 -0.14 0.05 0.00 1.00 0.00 0.00 64.86 65.98 1xyx h ILE 184 Cb 0.31 0.67 -0.07 0.00 -0.74 0.00 0.00 36.82 36.99 1xyx h ILE 184 CO -0.00 0.03 -0.42 0.50 0.00 0.00 0.00 178.15 178.25 1xyx h LYS 185 N -0.64 -0.44 0.12 2.37 3.64 -0.31 0.22 116.57 121.53 1xyx h LYS 185 Ca -0.06 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1xyx h LYS 185 Cb 0.47 0.10 -0.04 0.00 -0.41 0.00 0.00 32.23 32.35 1xyx h LYS 185 CO 0.09 -0.29 -0.37 1.96 -2.27 0.00 0.00 179.45 178.57 1xyx h GLN 186 N -0.45 -0.58 0.00 1.90 7.50 -0.89 0.40 115.11 122.98 1xyx h GLN 186 Ca 0.09 0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.28 1xyx h GLN 186 Cb 0.62 0.13 0.00 0.00 0.05 0.00 0.00 27.48 28.28 1xyx h GLN 186 CO -0.44 -0.39 0.00 0.45 -1.50 0.00 0.00 178.83 176.96 1xyx h HIS 187 N -0.60 0.00 -0.33 2.96 3.86 -0.95 0.35 115.15 120.44 1xyx h HIS 187 Ca 0.03 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1xyx h HIS 187 Cb 0.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.10 1xyx h HIS 187 CO -0.33 0.00 0.00 2.41 0.86 0.00 0.00 177.93 180.87 1xyx n THR 188 N -2.36 0.57 0.10 2.45 -1.04 0.02 -4.26 114.28 109.76 1xyx n THR 188 Ca 0.00 -0.78 0.00 0.00 -2.04 0.00 0.00 64.05 61.23 1xyx n THR 188 Cb 0.14 0.88 0.00 0.00 -1.82 0.00 0.00 70.33 69.53 1xyx n THR 188 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1xyx n VAL 189 N 1.09 0.15 0.00 12.58 0.31 0.12 -4.35 118.33 128.23 1xyx n VAL 189 Ca 0.15 0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.53 1xyx n VAL 189 Cb 0.50 -0.55 0.00 0.00 -0.91 0.00 0.00 33.84 32.88 1xyx n VAL 189 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1xyx n THR 190 N -3.25 1.51 -0.02 2.52 5.66 0.11 -0.80 114.28 120.01 1xyx n THR 190 Ca 0.00 0.39 -0.03 0.00 -3.05 0.00 0.00 64.05 61.36 1xyx n THR 190 Cb 0.00 -1.39 -0.03 0.00 -1.55 0.00 0.00 70.33 67.37 1xyx n THR 190 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1xyx n THR 191 N -1.37 0.28 0.07 1.09 -1.04 -1.22 -4.73 114.28 107.36 1xyx n THR 191 Ca 0.00 -0.13 0.01 0.00 -2.04 0.00 0.00 64.05 61.89 1xyx n THR 191 Cb 0.01 -0.76 0.34 0.00 -1.82 0.00 0.00 70.33 68.10 1xyx n THR 191 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1xyx h THR 192 N 0.00 1.19 -1.01 12.58 2.02 -0.83 -0.66 112.91 126.20 1xyx h THR 192 Ca -0.11 -0.82 0.24 0.00 0.77 0.00 0.00 66.41 66.50 1xyx h THR 192 Cb 1.20 1.13 -0.11 0.00 -1.74 0.00 0.00 68.15 68.62 1xyx h THR 192 CO -0.01 0.26 0.62 0.00 0.37 0.00 0.00 175.52 176.76 1xyx h THR 193 N 0.34 0.56 0.00 3.16 1.03 -1.25 -2.27 112.91 114.47 1xyx h THR 193 Ca 0.07 -0.19 -0.26 0.00 -0.01 0.00 0.00 66.41 66.02 1xyx h THR 193 Cb 0.38 -0.05 -0.05 0.00 -1.07 0.00 0.00 68.15 67.36 1xyx h THR 193 CO 0.02 0.10 -1.88 0.29 -0.01 0.00 0.00 175.52 174.04 1xyx n LYS 194 N -4.81 0.65 0.00 0.00 4.01 -0.38 -4.95 118.16 112.68 1xyx n LYS 194 Ca 0.26 0.12 0.00 0.00 -0.51 0.00 0.00 58.31 58.18 1xyx n LYS 194 Cb 0.75 -1.68 0.00 0.00 -0.51 0.00 0.00 35.03 33.60 1xyx n LYS 194 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1xyx n GLY 195 N 1.55 -0.70 3.45 0.72 0.00 -0.45 -5.12 105.19 104.63 1xyx n GLY 195 Ca -0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 1xyx n GLY 195 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1xyx s GLU 196 N 0.00 3.06 0.31 1.61 2.56 -0.56 -4.89 118.70 120.79 1xyx s GLU 196 Ca 0.00 -0.96 0.03 0.00 0.00 0.00 0.00 54.97 54.05 1xyx s GLU 196 Cb 0.00 -4.04 -0.01 0.00 2.00 0.00 0.00 34.13 32.08 1xyx s GLU 196 CO 0.00 -0.97 0.12 -1.71 -0.56 0.00 0.00 175.26 172.15 1xyx n ASN 197 N 5.59 0.97 -3.90 -1.70 2.85 -1.26 -2.34 115.26 115.46 1xyx n ASN 197 Ca -0.09 -2.66 -0.09 0.00 -0.11 0.00 0.00 54.58 51.63 1xyx n ASN 197 Cb 0.46 0.84 -0.08 0.00 1.24 0.00 0.00 39.78 42.24 1xyx n ASN 197 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1xyx s PHE 198 N -2.75 0.19 0.66 1.20 0.40 -1.26 -5.12 117.98 111.31 1xyx s PHE 198 Ca 0.17 -0.57 -0.09 0.00 -0.60 0.00 0.00 56.93 55.85 1xyx s PHE 198 Cb 0.01 -0.12 0.02 0.00 0.51 0.00 0.00 43.02 43.44 1xyx s PHE 198 CO 0.12 -0.46 1.02 0.95 0.70 0.00 0.00 175.22 177.55 1xyx s THR 199 N -3.34 3.39 0.36 0.64 -4.23 -1.26 -4.74 115.64 106.46 1xyx s THR 199 Ca 0.01 0.21 0.14 0.00 -1.18 0.00 0.00 61.69 60.86 1xyx s THR 199 Cb 0.03 -3.41 0.35 0.00 1.34 0.00 0.00 72.50 70.81 1xyx s THR 199 CO -0.08 -0.48 1.77 -0.08 -0.54 0.00 0.00 174.62 175.21 1xyx h GLU 200 N -0.48 0.51 0.52 3.99 4.81 -2.02 0.27 114.58 122.17 1xyx h GLU 200 Ca -0.45 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 58.72 1xyx h GLU 200 Cb 1.26 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 30.53 1xyx h GLU 200 CO 0.62 0.33 -0.25 1.15 -0.73 0.00 0.00 179.01 180.14 1xyx h THR 201 N 0.52 0.36 -0.36 0.32 2.02 -1.99 0.58 112.91 114.36 1xyx h THR 201 Ca 0.59 -0.40 0.07 0.00 0.77 0.00 0.00 66.41 67.44 1xyx h THR 201 Cb 1.27 0.49 -0.07 0.00 -1.74 0.00 0.00 68.15 68.11 1xyx h THR 201 CO -0.34 0.05 -0.08 0.44 0.37 0.00 0.00 175.52 175.96 1xyx h ASP 202 N -0.98 -0.31 -0.71 4.18 3.32 -1.43 -0.33 116.42 120.17 1xyx h ASP 202 Ca -0.07 0.11 0.12 0.00 0.02 0.00 0.00 57.03 57.20 1xyx h ASP 202 Cb 0.61 0.22 -0.08 0.00 0.22 0.00 0.00 39.33 40.30 1xyx h ASP 202 CO 0.12 -0.11 0.29 0.58 -1.72 0.00 0.00 179.24 178.40 1xyx h VAL 203 N 0.01 0.73 -0.29 -1.35 2.07 -0.56 0.28 116.25 117.14 1xyx h VAL 203 Ca 0.18 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.51 1xyx h VAL 203 Cb 0.27 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1xyx h VAL 203 CO -0.37 0.09 0.07 0.50 0.02 0.00 0.00 177.57 177.88 1xyx h LYS 204 N 0.47 0.47 -0.01 1.57 3.64 0.14 -1.78 116.57 121.07 1xyx h LYS 204 Ca 0.37 -0.11 -0.10 0.00 -1.27 0.00 0.00 60.65 59.54 1xyx h LYS 204 Cb 0.50 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 1xyx h LYS 204 CO -0.35 0.55 -0.45 0.52 -2.27 0.00 0.00 179.45 177.45 1xyx h MET 205 N 0.30 0.02 -0.22 1.90 2.86 -0.24 -2.25 114.93 117.31 1xyx h MET 205 Ca 0.09 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 1xyx h MET 205 Cb 0.29 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1xyx h MET 205 CO 0.00 0.47 0.12 0.52 1.06 0.00 0.00 176.91 179.09 1xyx h MET 206 N 0.02 0.31 0.00 1.72 2.86 -0.29 0.27 114.93 119.83 1xyx h MET 206 Ca -0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1xyx h MET 206 Cb 0.81 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.41 1xyx h MET 206 CO 0.06 0.30 0.11 0.39 1.06 0.00 0.00 176.91 178.82 1xyx n GLU 207 N -4.87 0.09 -0.11 1.72 -0.58 -0.69 -0.83 120.64 115.37 1xyx n GLU 207 Ca -0.03 0.56 -0.19 0.00 -0.42 0.00 0.00 57.16 57.08 1xyx n GLU 207 Cb 0.08 -1.90 -0.07 0.00 -0.57 0.00 0.00 31.44 28.97 1xyx n GLU 207 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1xyx n ARG 208 N -1.99 0.55 -0.20 3.49 5.12 -0.72 -4.16 116.66 118.75 1xyx n ARG 208 Ca -0.01 0.32 -0.10 0.00 -1.93 0.00 0.00 57.85 56.14 1xyx n ARG 208 Cb 0.13 -1.53 0.02 0.00 -1.16 0.00 0.00 32.46 29.91 1xyx n ARG 208 CO 0.00 0.00 0.00 -0.24 -1.93 0.00 0.00 177.63 175.46 1xyx h VAL 209 N -1.00 1.27 -0.44 1.55 3.04 -0.67 -1.11 116.25 118.89 1xyx h VAL 209 Ca -0.35 -1.19 -0.13 0.00 -1.01 0.00 0.00 66.70 64.02 1xyx h VAL 209 Cb 1.25 0.87 -0.01 0.00 -2.01 0.00 0.00 31.29 31.39 1xyx h VAL 209 CO -0.21 0.43 -0.23 0.58 -1.01 0.00 0.00 177.57 177.12 1xyx h VAL 210 N 0.93 1.27 0.95 1.51 2.07 -1.22 0.53 116.25 122.29 1xyx h VAL 210 Ca 0.16 -1.38 -0.05 0.00 0.82 0.00 0.00 66.70 66.26 1xyx h VAL 210 Cb 0.60 1.17 0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1xyx h VAL 210 CO 0.04 0.47 -0.46 -0.08 0.02 0.00 0.00 177.57 177.56 1xyx h GLU 211 N 0.77 -1.23 -0.33 1.57 4.81 -1.69 0.02 114.58 118.50 1xyx h GLU 211 Ca 0.10 0.08 0.06 0.00 -0.13 0.00 0.00 59.36 59.48 1xyx h GLU 211 Cb 0.78 0.28 -0.06 0.00 0.63 0.00 0.00 28.75 30.38 1xyx h GLU 211 CO 0.06 -0.82 -0.02 1.96 -0.73 0.00 0.00 179.01 179.46 1xyx h GLN 212 N -1.29 0.06 -0.33 1.92 1.08 -0.98 0.35 115.11 115.92 1xyx h GLN 212 Ca -0.13 -0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.13 1xyx h GLN 212 Cb 0.98 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 28.34 1xyx h GLN 212 CO 0.21 0.04 -0.02 0.52 -0.95 0.00 0.00 178.83 178.63 1xyx h MET 213 N 0.07 0.06 0.00 1.46 2.86 -0.88 -1.24 114.93 117.26 1xyx h MET 213 Ca 0.16 -0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.62 1xyx h MET 213 Cb 0.23 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.85 1xyx h MET 213 CO -0.29 0.04 -0.83 0.00 1.06 0.00 0.00 176.91 176.90 1xyx h VAL 215 N 0.00 0.94 0.06 0.00 2.07 -0.19 -0.28 116.25 118.86 1xyx h VAL 215 Ca -0.01 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.19 1xyx h VAL 215 Cb 1.60 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.51 1xyx h VAL 215 CO 0.11 0.08 -0.03 0.74 0.02 0.00 0.00 177.57 178.49 1xyx h THR 216 N -0.34 1.00 -0.79 2.57 2.02 -1.24 -2.16 112.91 113.97 1xyx h THR 216 Ca -0.02 -0.19 -0.01 0.00 0.77 0.00 0.00 66.41 66.96 1xyx h THR 216 Cb 0.27 1.12 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1xyx h THR 216 CO 0.03 0.05 0.47 -0.61 0.37 0.00 0.00 175.52 175.83 1xyx h GLN 217 N -0.16 1.07 -0.46 6.66 5.75 -0.66 0.29 115.11 127.60 1xyx h GLN 217 Ca -0.01 -0.10 -0.00 0.00 -0.15 0.00 0.00 58.65 58.39 1xyx h GLN 217 Cb 0.14 -0.22 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 1xyx h GLN 217 CO 0.01 0.76 0.27 -0.92 -2.65 0.00 0.00 178.83 176.31 1xyx h TYR 218 N 1.08 0.60 0.00 3.99 3.20 -1.04 -0.25 116.97 124.55 1xyx h TYR 218 Ca 0.28 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 62.09 1xyx h TYR 218 Cb -0.03 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 1xyx h TYR 218 CO -0.01 0.42 -0.30 1.96 -1.64 0.00 0.00 178.16 178.60 1xyx h GLN 219 N 0.61 0.00 -0.19 1.82 4.20 -0.65 0.67 115.11 121.57 1xyx h GLN 219 Ca 0.16 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.79 1xyx h GLN 219 Cb -0.00 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.78 1xyx h GLN 219 CO -0.03 0.30 -0.21 0.87 -0.67 0.00 0.00 178.83 179.09 1xyx h LYS 220 N 0.00 0.48 -0.34 1.46 1.57 0.24 -0.73 116.57 119.25 1xyx h LYS 220 Ca -0.00 -0.26 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1xyx h LYS 220 Cb 0.58 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1xyx h LYS 220 CO 0.04 0.84 0.18 0.93 -0.57 0.00 0.00 179.45 180.86 1xyx h GLU 221 N 0.14 0.49 -0.99 3.15 4.39 -0.81 -2.14 114.58 118.80 1xyx h GLU 221 Ca 0.03 -0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.68 1xyx h GLU 221 Cb 0.76 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.27 1xyx h GLU 221 CO 0.05 0.43 0.66 1.03 -1.16 0.00 0.00 179.01 180.02 1xyx h SER 222 N 0.42 1.13 -0.68 1.42 0.87 -0.87 -2.10 113.55 113.75 1xyx h SER 222 Ca 0.12 -0.03 -0.04 0.00 -1.23 0.00 0.00 61.79 60.61 1xyx h SER 222 Cb 0.09 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.74 1xyx h SER 222 CO -0.02 0.82 0.26 -0.61 -0.53 0.00 0.00 176.83 176.75 1xyx h GLN 223 N 1.34 1.02 0.00 2.24 4.15 -0.78 -0.44 115.11 122.64 1xyx h GLN 223 Ca 0.37 -0.19 0.00 0.00 0.77 0.00 0.00 58.65 59.60 1xyx h GLN 223 Cb -0.14 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.39 1xyx h GLN 223 CO -0.08 0.86 0.00 0.00 -1.93 0.00 0.00 178.83 177.67 1xyx n ALA 224 N -2.40 1.99 -0.04 3.38 0.00 -0.80 -0.25 120.51 122.39 1xyx n ALA 224 Ca 0.05 -0.03 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 1xyx n ALA 224 Cb 0.18 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 1xyx n ALA 224 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1xyx n TYR 225 N -0.64 0.00 0.17 0.00 4.19 -0.65 -4.70 117.16 115.53 1xyx n TYR 225 Ca 0.03 0.00 0.05 0.00 3.31 0.00 0.00 57.90 61.29 1xyx n TYR 225 Cb 0.01 -0.28 0.21 0.00 0.49 0.00 0.00 39.34 39.78 1xyx n TYR 225 CO 0.00 0.00 0.00 1.88 0.91 0.00 0.00 176.86 179.65 1xyx h TYR 226 N -0.12 0.00 -0.49 2.98 0.05 -0.76 -3.30 116.97 115.32 1xyx h TYR 226 Ca -0.18 0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.65 1xyx h TYR 226 Cb 1.22 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 38.91 1xyx h TYR 226 CO -0.01 0.39 0.23 0.38 -1.05 0.00 0.00 178.16 178.10 1xyx h ASP 227 N 0.00 0.30 0.00 3.88 2.03 -0.87 -3.45 116.42 118.31 1xyx h ASP 227 Ca -0.00 0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.33 1xyx h ASP 227 Cb 1.10 -0.02 0.00 0.00 -0.83 0.00 0.00 39.33 39.58 1xyx h ASP 227 CO 0.05 0.21 0.00 0.61 -1.03 0.00 0.00 179.24 179.08 1xyx n GLY 228 N -1.25 0.12 0.25 7.15 0.00 -1.25 -2.55 105.19 107.66 1xyx n GLY 228 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1xyx n GLY 228 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1xyx n ARG 229 N 0.00 0.00 -0.85 1.61 1.85 -1.26 -4.97 116.66 113.04 1xyx n ARG 229 Ca 0.00 -0.55 -0.03 0.00 -1.00 0.00 0.00 57.85 56.27 1xyx n ARG 229 Cb 0.00 -0.37 0.26 0.00 -1.05 0.00 0.00 32.46 31.31 1xyx n ARG 229 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1xyx n ARG 230 N 0.00 3.02 -1.34 2.89 5.12 -1.06 -4.66 116.66 120.63 1xyx n ARG 230 Ca 0.00 -3.05 -0.28 0.00 -1.93 0.00 0.00 57.85 52.59 1xyx n ARG 230 Cb 0.57 -2.04 -0.08 0.00 -1.16 0.00 0.00 32.46 29.76 1xyx n ARG 230 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 1xyx n SER 231 N -0.52 7.05 0.00 0.55 7.64 -1.26 -5.01 113.62 122.06 1xyx n SER 231 Ca 0.36 -2.74 0.00 0.00 1.01 0.00 0.00 58.87 57.50 1xyx n SER 231 Cb 1.21 -1.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1xyx n SER 231 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83