#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whr s SER 127 N 0.00 7.27 -0.30 1.61 0.01 -1.26 -5.02 113.70 116.01 1whr s SER 127 Ca 0.00 2.19 -0.15 0.00 1.31 0.00 0.00 55.95 59.30 1whr s SER 127 Cb 0.00 -2.62 0.17 0.00 0.21 0.00 0.00 66.02 63.79 1whr s SER 127 CO 0.00 -0.18 1.02 -0.94 0.41 0.00 0.00 173.24 173.55 1whr s SER 128 N -0.51 -0.52 0.00 2.44 1.04 -1.26 -5.16 113.70 109.73 1whr s SER 128 Ca 0.47 0.62 0.00 0.00 0.48 0.00 0.00 55.95 57.52 1whr s SER 128 Cb -0.31 1.55 0.00 0.00 0.10 0.00 0.00 66.02 67.37 1whr s SER 128 CO 0.38 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 175.11 1whr n GLY 129 N 5.03 2.74 3.23 7.32 0.00 -1.26 -5.13 105.19 117.13 1whr n GLY 129 Ca -0.08 -2.01 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 1whr n GLY 129 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1whr s SER 130 N 0.00 0.17 0.32 1.61 0.01 -1.26 -5.18 113.70 109.37 1whr s SER 130 Ca 0.00 -0.87 -0.19 0.00 1.31 0.00 0.00 55.95 56.20 1whr s SER 130 Cb 0.00 0.35 0.04 0.00 0.21 0.00 0.00 66.02 66.62 1whr s SER 130 CO 0.00 -0.78 0.78 -0.94 0.41 0.00 0.00 173.24 172.72 1whr s SER 131 N -2.94 -0.12 0.00 2.44 1.04 -1.26 -5.07 113.70 107.79 1whr s SER 131 Ca 0.13 -0.85 0.00 0.00 0.48 0.00 0.00 55.95 55.71 1whr s SER 131 Cb 0.05 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.93 1whr s SER 131 CO -0.05 -1.47 0.00 0.61 0.98 0.00 0.00 173.24 173.31 1whr n GLY 132 N -0.50 0.00 3.38 7.32 0.00 -1.26 -5.12 105.19 109.01 1whr n GLY 132 Ca -0.06 -0.36 0.02 0.00 0.00 0.00 0.00 46.02 45.61 1whr n GLY 132 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1whr s THR 133 N -2.02 -0.44 -0.29 2.61 -1.32 -1.26 -5.16 115.64 107.76 1whr s THR 133 Ca 0.00 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.33 1whr s THR 133 Cb 0.00 -1.00 0.12 0.00 -1.51 0.00 0.00 72.50 70.11 1whr s THR 133 CO 0.00 0.00 0.82 -0.62 -2.21 0.00 0.00 174.62 172.61 1whr s ASP 134 N 2.39 -0.79 -0.02 8.08 2.15 -1.26 -5.16 116.67 122.06 1whr s ASP 134 Ca -0.02 1.20 -0.14 0.00 0.43 0.00 0.00 52.55 54.02 1whr s ASP 134 Cb -0.05 1.53 -0.05 0.00 -0.30 0.00 0.00 42.92 44.05 1whr s ASP 134 CO -0.17 -0.18 0.37 -0.94 -0.17 0.00 0.00 175.17 174.08 1whr s SER 135 N 1.89 6.76 -0.35 -0.34 1.04 -1.26 -5.06 113.70 116.38 1whr s SER 135 Ca -0.08 0.90 -0.18 0.00 0.48 0.00 0.00 55.95 57.08 1whr s SER 135 Cb -0.06 -2.23 -0.01 0.00 0.10 0.00 0.00 66.02 63.83 1whr s SER 135 CO -0.18 0.33 0.50 0.42 0.98 0.00 0.00 173.24 175.29 1whr s THR 136 N -1.06 5.03 0.00 2.02 -4.23 -1.26 -4.90 115.64 111.24 1whr s THR 136 Ca 0.23 0.33 0.00 0.00 -1.18 0.00 0.00 61.69 61.07 1whr s THR 136 Cb -0.16 -3.94 0.00 0.00 1.34 0.00 0.00 72.50 69.74 1whr s THR 136 CO 0.12 -0.19 0.00 0.61 -0.54 0.00 0.00 174.62 174.62 1whr n GLY 137 N 4.79 1.58 3.38 3.99 0.00 -1.26 -5.17 105.19 112.50 1whr n GLY 137 Ca -0.05 0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1whr n GLY 137 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1whr s ILE 138 N 1.68 2.16 -0.35 -0.61 -4.36 -1.26 -5.11 121.20 113.33 1whr s ILE 138 Ca 0.00 -1.84 0.00 0.00 -0.26 0.00 0.00 60.65 58.55 1whr s ILE 138 Cb 0.00 -1.96 0.11 0.00 1.25 0.00 0.00 42.46 41.87 1whr s ILE 138 CO 0.00 -0.05 0.15 -1.81 0.24 0.00 0.00 174.94 173.47 1whr s ASP 139 N -2.32 3.84 0.11 4.36 1.01 -1.26 -5.01 116.67 117.40 1whr s ASP 139 Ca 0.15 -1.99 -0.27 0.00 0.71 0.00 0.00 52.55 51.15 1whr s ASP 139 Cb -0.09 -0.89 -0.09 0.00 1.01 0.00 0.00 42.92 42.86 1whr s ASP 139 CO 0.07 -0.36 1.65 -0.07 0.21 0.00 0.00 175.17 176.67 1whr h LEU 140 N 7.58 -0.67 -0.89 1.23 3.38 -2.00 -2.19 115.31 121.75 1whr h LEU 140 Ca -0.08 0.08 0.24 0.00 0.09 0.00 0.00 57.88 58.21 1whr h LEU 140 Cb 0.98 0.25 -0.14 0.00 0.09 0.00 0.00 40.66 41.85 1whr h LEU 140 CO 0.46 -0.33 0.29 -0.74 0.09 0.00 0.00 178.44 178.21 1whr h HIS 141 N -0.45 0.45 -0.52 1.13 2.76 -2.00 0.27 115.15 116.79 1whr h HIS 141 Ca 0.02 0.05 0.05 0.00 -2.20 0.00 0.00 60.37 58.29 1whr h HIS 141 Cb 0.47 -0.05 -0.05 0.00 1.55 0.00 0.00 27.41 29.32 1whr h HIS 141 CO -0.21 -0.19 0.24 0.93 -1.30 0.00 0.00 177.93 177.40 1whr h GLU 142 N 0.24 0.45 0.74 5.26 4.39 -1.83 -2.43 114.58 121.41 1whr h GLU 142 Ca 0.57 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 60.21 1whr h GLU 142 Cb 1.17 -0.10 0.01 0.00 -0.10 0.00 0.00 28.75 29.73 1whr h GLU 142 CO -0.64 0.30 -0.36 0.35 -1.16 0.00 0.00 179.01 177.51 1whr h PHE 143 N 0.47 -0.92 -0.90 4.33 3.04 -0.29 -2.02 116.94 120.64 1whr h PHE 143 Ca 0.24 -0.02 0.09 0.00 3.98 0.00 0.00 57.97 62.25 1whr h PHE 143 Cb 0.18 0.31 -0.11 0.00 2.56 0.00 0.00 35.95 38.88 1whr h PHE 143 CO -0.12 -0.58 -0.51 1.28 -2.02 0.00 0.00 178.31 176.37 1whr n LEU 144 N -5.02 -0.90 -0.20 0.59 4.77 -0.59 0.54 117.00 116.19 1whr n LEU 144 Ca -0.12 1.59 -0.01 0.00 -0.03 0.00 0.00 56.01 57.44 1whr n LEU 144 Cb 0.39 -0.23 0.10 0.00 -2.33 0.00 0.00 43.42 41.36 1whr n LEU 144 CO 0.30 -1.31 1.01 0.58 -1.33 0.00 0.00 177.39 176.63 1whr h VAL 145 N 0.00 0.82 -1.01 4.08 2.07 -1.47 -0.67 116.25 120.07 1whr h VAL 145 Ca 0.17 -0.16 0.24 0.00 0.82 0.00 0.00 66.70 67.77 1whr h VAL 145 Cb 0.39 0.32 -0.09 0.00 -1.52 0.00 0.00 31.29 30.39 1whr h VAL 145 CO -0.85 0.08 0.65 -1.13 0.02 0.00 0.00 177.57 176.34 1whr h ASN 146 N 0.46 0.49 0.00 0.57 -1.24 0.88 0.13 115.58 116.87 1whr h ASN 146 Ca 0.30 0.08 -0.20 0.00 0.71 0.00 0.00 56.30 57.19 1whr h ASN 146 Cb 0.33 -0.00 0.02 0.00 0.73 0.00 0.00 38.32 39.39 1whr h ASN 146 CO -0.27 0.13 -0.77 0.74 -1.29 0.00 0.00 177.43 175.97 1whr h THR 147 N 0.45 1.37 0.06 -3.57 2.02 -0.25 -2.84 112.91 110.15 1whr h THR 147 Ca 0.57 -2.15 -0.00 0.00 0.77 0.00 0.00 66.41 65.60 1whr h THR 147 Cb 1.35 2.53 -0.00 0.00 -1.74 0.00 0.00 68.15 70.29 1whr h THR 147 CO -0.29 0.64 -0.04 -0.07 0.37 0.00 0.00 175.52 176.13 1whr h LEU 148 N 0.07 -0.11 -0.01 2.58 3.38 -0.28 0.69 115.31 121.64 1whr h LEU 148 Ca -0.10 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.89 1whr h LEU 148 Cb 1.46 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 42.22 1whr h LEU 148 CO 0.15 -0.06 -0.21 0.11 0.09 0.00 0.00 178.44 178.52 1whr h LYS 149 N -0.10 -0.25 -0.70 1.13 6.56 -1.43 -1.85 116.57 119.93 1whr h LYS 149 Ca -0.01 0.02 0.15 0.00 -1.06 0.00 0.00 60.65 59.75 1whr h LYS 149 Cb 0.08 0.06 -0.12 0.00 -0.57 0.00 0.00 32.23 31.68 1whr h LYS 149 CO 0.00 -0.17 0.03 0.87 -2.06 0.00 0.00 179.45 178.13 1whr h LYS 150 N -0.26 0.13 -3.40 3.15 1.79 -1.58 -3.12 116.57 113.28 1whr h LYS 150 Ca 0.01 -0.01 -0.71 0.00 -2.18 0.00 0.00 60.65 57.76 1whr h LYS 150 Cb 0.28 -0.03 -0.35 0.00 -1.58 0.00 0.00 32.23 30.56 1whr h LYS 150 CO -0.14 0.08 -0.11 -0.80 -1.08 0.00 0.00 179.45 177.40 1whr s ASN 151 N -5.21 5.95 0.01 0.86 0.01 0.24 -4.88 114.94 111.92 1whr s ASN 151 Ca -0.13 -3.51 0.14 0.00 -0.71 0.00 0.00 52.86 48.65 1whr s ASN 151 Cb 0.21 -1.93 0.62 0.00 0.41 0.00 0.00 41.25 40.56 1whr s ASN 151 CO 0.75 -0.24 1.46 -0.81 -1.51 0.00 0.00 177.10 176.75 1whr n PRO 152 N 2.64 0.01 -0.01 -0.60 -0.04 -0.75 -2.75 135.00 133.49 1whr n PRO 152 Ca 0.19 0.26 -0.19 0.00 -0.04 0.00 0.00 63.50 63.72 1whr n PRO 152 Cb 0.38 -1.51 -0.14 0.00 -0.04 0.00 0.00 33.50 32.18 1whr n PRO 152 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1whr n ARG 153 N -1.53 0.73 0.26 0.54 0.63 -1.26 -3.99 116.66 112.05 1whr n ARG 153 Ca 0.03 0.26 0.18 0.00 -0.92 0.00 0.00 57.85 57.40 1whr n ARG 153 Cb 0.17 -1.71 0.85 0.00 0.45 0.00 0.00 32.46 32.22 1whr n ARG 153 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 1whr h ASP 154 N 0.06 0.00 -0.90 6.15 5.19 -1.86 -2.93 116.42 122.13 1whr h ASP 154 Ca -0.42 0.00 0.20 0.00 -0.62 0.00 0.00 57.03 56.19 1whr h ASP 154 Cb 2.03 0.00 -0.11 0.00 0.18 0.00 0.00 39.33 41.42 1whr h ASP 154 CO 0.08 0.00 0.44 0.08 -3.12 0.00 0.00 179.24 176.72 1whr h ARG 155 N 0.00 0.49 -0.10 3.56 0.11 -1.68 -2.13 114.38 114.62 1whr h ARG 155 Ca 0.00 -0.03 0.01 0.00 0.10 0.00 0.00 59.98 60.06 1whr h ARG 155 Cb 0.23 -0.11 -0.02 0.00 1.11 0.00 0.00 29.97 31.19 1whr h ARG 155 CO 0.00 0.33 -0.12 0.52 0.10 0.00 0.00 179.97 180.80 1whr h MET 156 N 0.51 -0.07 0.26 0.08 2.86 -1.78 -0.32 114.93 116.47 1whr h MET 156 Ca 0.54 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 58.18 1whr h MET 156 Cb 0.95 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1whr h MET 156 CO -0.47 -0.04 -0.22 1.98 1.06 0.00 0.00 176.91 179.22 1whr h MET 157 N -0.07 -0.45 -0.86 1.72 1.85 -1.70 -0.84 114.93 114.58 1whr h MET 157 Ca 0.02 0.03 0.31 0.00 -0.61 0.00 0.00 59.70 59.45 1whr h MET 157 Cb 0.12 0.10 -0.10 0.00 0.43 0.00 0.00 31.60 32.15 1whr h MET 157 CO -0.13 -0.30 0.54 1.28 -0.40 0.00 0.00 176.91 177.90 1whr n LEU 158 N -3.63 0.15 -0.01 3.39 4.77 -0.84 0.24 117.00 121.07 1whr n LEU 158 Ca -0.06 0.94 -0.17 0.00 -0.03 0.00 0.00 56.01 56.69 1whr n LEU 158 Cb 0.20 -0.46 -0.13 0.00 -2.33 0.00 0.00 43.42 40.70 1whr n LEU 158 CO 0.13 -1.02 0.24 -0.07 -1.33 0.00 0.00 177.39 175.33 1whr h LEU 159 N 0.00 0.28 -0.89 2.23 3.38 -0.44 -2.32 115.31 117.55 1whr h LEU 159 Ca 0.57 -0.92 0.13 0.00 0.09 0.00 0.00 57.88 57.76 1whr h LEU 159 Cb 1.80 -0.09 -0.09 0.00 0.09 0.00 0.00 40.66 42.37 1whr h LEU 159 CO -0.34 1.17 0.50 0.07 0.09 0.00 0.00 178.44 179.93 1whr h LYS 160 N -0.57 0.74 0.22 1.13 2.10 0.44 0.33 116.57 120.97 1whr h LYS 160 Ca -0.07 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.52 1whr h LYS 160 Cb 1.28 -0.17 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 1whr h LYS 160 CO 0.08 0.49 -0.11 -0.07 -2.00 0.00 0.00 179.45 177.84 1whr h LEU 161 N 0.76 -0.25 -0.83 7.07 3.38 -1.17 -2.29 115.31 121.97 1whr h LEU 161 Ca 0.46 -0.24 0.21 0.00 0.09 0.00 0.00 57.88 58.39 1whr h LEU 161 Cb 0.55 0.07 -0.13 0.00 0.09 0.00 0.00 40.66 41.24 1whr h LEU 161 CO -0.31 0.26 0.24 -0.08 0.09 0.00 0.00 178.44 178.64 1whr h GLU 162 N -0.94 0.25 -0.10 1.13 4.57 -1.15 -0.01 114.58 118.34 1whr h GLU 162 Ca -0.03 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1whr h GLU 162 Cb 0.48 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.01 1whr h GLU 162 CO 0.05 0.17 0.01 0.37 -1.18 0.00 0.00 179.01 178.43 1whr h GLN 163 N 0.26 0.16 -0.97 1.92 5.75 -1.00 -2.41 115.11 118.82 1whr h GLN 163 Ca 0.50 -0.05 0.16 0.00 -0.15 0.00 0.00 58.65 59.12 1whr h GLN 163 Cb 0.95 -0.02 -0.10 0.00 1.07 0.00 0.00 27.48 29.39 1whr h GLN 163 CO -0.59 0.38 0.58 0.93 -2.65 0.00 0.00 178.83 177.49 1whr h GLU 164 N -0.08 0.78 0.24 1.69 5.08 -0.45 -1.99 114.58 119.85 1whr h GLU 164 Ca 0.03 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1whr h GLU 164 Cb 0.30 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1whr h GLU 164 CO 0.00 0.52 -0.12 0.82 -1.00 0.00 0.00 179.01 179.24 1whr h ILE 165 N 0.81 0.82 -0.48 3.13 2.04 -1.01 -1.72 117.51 121.10 1whr h ILE 165 Ca 0.53 -0.48 0.09 0.00 1.00 0.00 0.00 64.86 65.99 1whr h ILE 165 Cb 0.72 1.10 -0.10 0.00 -0.74 0.00 0.00 36.82 37.80 1whr h ILE 165 CO -0.34 0.11 -0.35 -0.07 0.00 0.00 0.00 178.15 177.50 1whr h LEU 166 N -0.57 -1.17 -1.41 1.44 3.38 -0.87 0.26 115.31 116.36 1whr h LEU 166 Ca -0.03 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1whr h LEU 166 Cb 0.42 0.55 -0.03 0.00 0.09 0.00 0.00 40.66 41.70 1whr h LEU 166 CO 0.05 -0.32 0.36 -0.33 0.09 0.00 0.00 178.44 178.30 1whr h GLU 167 N -0.23 0.76 -0.29 1.13 4.39 -1.40 -2.34 114.58 116.60 1whr h GLU 167 Ca 0.19 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.81 1whr h GLU 167 Cb 0.55 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1whr h GLU 167 CO -0.60 0.51 0.06 0.35 -1.16 0.00 0.00 179.01 178.17 1whr h PHE 168 N 0.78 0.49 -0.24 4.33 3.57 0.28 -1.92 116.94 124.24 1whr h PHE 168 Ca 0.21 -0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.67 1whr h PHE 168 Cb -0.06 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.51 1whr h PHE 168 CO 0.00 0.55 0.09 0.82 -2.23 0.00 0.00 178.31 177.54 1whr h ILE 169 N 0.30 0.95 -0.90 1.41 2.04 -0.21 -2.36 117.51 118.74 1whr h ILE 169 Ca 0.09 -0.07 0.01 0.00 1.00 0.00 0.00 64.86 65.89 1whr h ILE 169 Cb 0.31 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1whr h ILE 169 CO 0.00 0.04 0.60 0.78 0.00 0.00 0.00 178.15 179.57 1whr h ASN 170 N 0.20 1.04 -2.28 1.72 2.35 -1.37 -3.40 115.58 113.84 1whr h ASN 170 Ca 0.10 -0.03 -0.55 0.00 -0.55 0.00 0.00 56.30 55.27 1whr h ASN 170 Cb 0.06 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.16 1whr h ASN 170 CO -0.10 0.75 1.38 -0.62 -1.65 0.00 0.00 177.43 177.19 1whr s ASP 171 N -6.22 5.52 0.05 5.81 2.15 -0.73 -4.85 116.67 118.41 1whr s ASP 171 Ca -0.12 1.25 -0.16 0.00 0.43 0.00 0.00 52.55 53.95 1whr s ASP 171 Cb 0.18 -2.52 -0.20 0.00 -0.30 0.00 0.00 42.92 40.08 1whr s ASP 171 CO 0.80 -2.01 1.20 0.78 -0.17 0.00 0.00 175.17 175.77 1whr h ASN 172 N 14.51 0.74 -0.81 -0.34 4.21 -1.82 -3.28 115.58 128.78 1whr h ASN 172 Ca -0.33 -0.69 0.19 0.00 1.21 0.00 0.00 56.30 56.68 1whr h ASN 172 Cb 1.19 -0.22 -0.14 0.00 -1.12 0.00 0.00 38.32 38.03 1whr h ASN 172 CO 1.06 1.32 -0.01 -1.13 -1.29 0.00 0.00 177.43 177.38 1whr h ASN 173 N 0.21 -0.41 -3.38 5.81 -0.73 -1.95 -3.37 115.58 111.76 1whr h ASN 173 Ca -0.07 0.22 -0.58 0.00 1.87 0.00 0.00 56.30 57.73 1whr h ASN 173 Cb 1.38 0.39 -0.08 0.00 0.27 0.00 0.00 38.32 40.27 1whr h ASN 173 CO 0.14 -0.22 0.09 0.20 -0.37 0.00 0.00 177.43 177.27 1whr s ASN 174 N -5.17 6.78 -0.24 1.15 -0.87 -1.24 -4.95 114.94 110.40 1whr s ASN 174 Ca -0.13 0.94 -0.02 0.00 -1.57 0.00 0.00 52.86 52.07 1whr s ASN 174 Cb 0.24 -2.36 -0.18 0.00 -0.02 0.00 0.00 41.25 38.93 1whr s ASN 174 CO 0.76 -0.20 -0.15 0.00 -2.57 0.00 0.00 177.10 174.94 1whr n GLN 175 N 4.53 0.66 -4.44 -0.60 6.02 -1.26 -4.87 117.38 117.42 1whr n GLN 175 Ca -0.02 0.19 -0.25 0.00 -0.01 0.00 0.00 57.00 56.91 1whr n GLN 175 Cb 0.50 -1.55 -0.10 0.00 1.02 0.00 0.00 30.24 30.11 1whr n GLN 175 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 1whr s PHE 176 N -2.52 2.34 -0.02 1.08 0.08 -1.26 -2.68 117.98 115.01 1whr s PHE 176 Ca -0.34 -0.32 -0.04 0.00 0.12 0.00 0.00 56.93 56.35 1whr s PHE 176 Cb 0.09 -1.06 0.00 0.00 -0.57 0.00 0.00 43.02 41.49 1whr s PHE 176 CO 0.61 0.65 0.09 0.21 -0.10 0.00 0.00 175.22 176.67 1whr s LYS 177 N -3.28 0.26 -0.13 0.44 2.36 -0.88 -5.01 119.74 113.50 1whr s LYS 177 Ca 0.28 -0.15 -0.01 0.00 -2.55 0.00 0.00 55.97 53.54 1whr s LYS 177 Cb -0.06 0.11 -0.02 0.00 -1.05 0.00 0.00 37.83 36.81 1whr s LYS 177 CO 0.14 -0.05 -0.10 0.15 1.55 0.00 0.00 175.35 177.04 1whr s LYS 178 N -0.62 3.42 0.31 4.03 1.02 -1.26 -1.57 119.74 125.07 1whr s LYS 178 Ca -0.07 -0.63 -0.03 0.00 0.02 0.00 0.00 55.97 55.26 1whr s LYS 178 Cb -0.04 -2.70 -0.04 0.00 -0.52 0.00 0.00 37.83 34.52 1whr s LYS 178 CO 0.00 0.25 0.56 -0.06 -0.92 0.00 0.00 175.35 175.19 1whr s PHE 179 N 0.27 3.49 0.93 3.18 0.08 -0.53 -5.03 117.98 120.36 1whr s PHE 179 Ca -0.07 0.56 -0.16 0.00 0.12 0.00 0.00 56.93 57.38 1whr s PHE 179 Cb -0.15 -2.05 0.23 0.00 -0.57 0.00 0.00 43.02 40.48 1whr s PHE 179 CO 0.05 0.14 0.82 -0.35 -0.10 0.00 0.00 175.22 175.78 1whr n PRO 180 N -1.24 -2.63 -2.79 0.24 -0.04 -1.26 -4.24 135.00 123.04 1whr n PRO 180 Ca -0.03 -1.32 -0.41 0.00 -0.04 0.00 0.00 63.50 61.71 1whr n PRO 180 Cb 0.55 -1.24 -0.04 0.00 -0.04 0.00 0.00 33.50 32.73 1whr n PRO 180 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1whr s GLN 181 N -4.87 4.60 0.29 0.54 -0.21 -1.26 -4.53 119.66 114.21 1whr s GLN 181 Ca 0.53 1.34 0.02 0.00 0.02 0.00 0.00 55.36 57.27 1whr s GLN 181 Cb -0.05 -3.41 -0.05 0.00 1.00 0.00 0.00 33.01 30.50 1whr s GLN 181 CO 0.41 0.12 0.10 -1.64 -2.12 0.00 0.00 175.29 172.16 1whr s MET 182 N 0.40 1.51 0.74 2.91 -1.94 -1.26 -5.11 119.30 116.55 1whr s MET 182 Ca 0.47 -1.84 -0.04 0.00 -1.71 0.00 0.00 55.69 52.57 1whr s MET 182 Cb -0.22 -0.40 0.12 0.00 2.01 0.00 0.00 34.83 36.34 1whr s MET 182 CO 0.27 -0.30 1.03 0.95 -0.01 0.00 0.00 175.02 176.97 1whr s THR 183 N -3.60 2.19 0.25 2.05 -4.23 -1.26 -4.78 115.64 106.25 1whr s THR 183 Ca 0.37 -0.43 -0.04 0.00 -1.18 0.00 0.00 61.69 60.40 1whr s THR 183 Cb 0.07 -2.76 0.21 0.00 1.34 0.00 0.00 72.50 71.37 1whr s THR 183 CO 0.15 0.00 1.75 0.77 -0.54 0.00 0.00 174.62 176.75 1whr h SER 184 N -0.68 0.39 0.50 3.99 4.64 -2.02 0.13 113.55 120.50 1whr h SER 184 Ca -0.40 0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 60.99 1whr h SER 184 Cb 1.27 0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1whr h SER 184 CO 0.45 0.17 -0.24 0.22 -0.87 0.00 0.00 176.83 176.56 1whr h TYR 185 N 0.53 -0.62 -0.87 4.77 5.03 -2.00 -3.01 116.97 120.79 1whr h TYR 185 Ca 0.41 -0.01 0.23 0.00 2.58 0.00 0.00 58.73 61.94 1whr h TYR 185 Cb 0.58 0.21 -0.14 0.00 1.55 0.00 0.00 36.73 38.92 1whr h TYR 185 CO -0.13 -0.39 0.27 0.45 -1.32 0.00 0.00 178.16 177.04 1whr h HIS 186 N -1.17 0.41 -0.97 -3.82 3.86 -1.88 0.42 115.15 112.00 1whr h HIS 186 Ca -0.07 0.05 0.07 0.00 -1.16 0.00 0.00 60.37 59.26 1whr h HIS 186 Cb 0.51 -0.04 -0.07 0.00 1.06 0.00 0.00 27.41 28.87 1whr h HIS 186 CO 0.00 -0.18 0.62 -0.09 0.86 0.00 0.00 177.93 179.14 1whr h ARG 187 N 0.24 1.07 -0.26 2.45 2.43 -0.79 -2.05 114.38 117.46 1whr h ARG 187 Ca 0.55 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.63 1whr h ARG 187 Cb 1.09 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 30.39 1whr h ARG 187 CO -0.62 0.71 0.07 1.98 -1.51 0.00 0.00 179.97 180.59 1whr h MET 188 N 1.10 0.42 -0.32 0.20 4.05 -0.04 -1.99 114.93 118.35 1whr h MET 188 Ca 0.43 -0.10 0.06 0.00 -0.28 0.00 0.00 59.70 59.81 1whr h MET 188 Cb 0.22 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 30.91 1whr h MET 188 CO -0.19 0.51 -0.03 -0.07 0.23 0.00 0.00 176.91 177.37 1whr h LEU 189 N 0.26 -0.19 0.09 3.39 3.38 -0.75 -1.62 115.31 119.87 1whr h LEU 189 Ca 0.08 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1whr h LEU 189 Cb 0.28 0.15 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 1whr h LEU 189 CO 0.00 -0.06 -0.07 0.25 0.09 0.00 0.00 178.44 178.66 1whr h LEU 190 N 0.06 -0.17 -1.58 1.67 5.85 -1.32 -2.01 115.31 117.80 1whr h LEU 190 Ca 0.16 0.01 0.22 0.00 0.84 0.00 0.00 57.88 59.11 1whr h LEU 190 Cb 0.22 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.24 1whr h LEU 190 CO -0.28 -0.11 0.62 0.45 -0.34 0.00 0.00 178.44 178.78 1whr h HIS 191 N -0.16 0.45 0.02 1.25 3.86 -0.94 -0.86 115.15 118.76 1whr h HIS 191 Ca -0.00 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1whr h HIS 191 Cb 0.15 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.48 1whr h HIS 191 CO -0.09 0.10 -0.01 0.00 0.86 0.00 0.00 177.93 178.79 1whr h ARG 192 N 0.33 -0.03 0.23 2.45 2.47 -0.61 -2.23 114.38 116.99 1whr h ARG 192 Ca 0.48 0.00 0.01 0.00 -1.26 0.00 0.00 59.98 59.21 1whr h ARG 192 Cb 1.33 0.01 -0.03 0.00 -1.65 0.00 0.00 29.97 29.63 1whr h ARG 192 CO -0.16 0.41 -0.35 0.28 0.56 0.00 0.00 179.97 180.71 1whr h VAL 193 N -0.47 0.27 -0.48 2.04 2.07 -0.62 -0.33 116.25 118.72 1whr h VAL 193 Ca -0.00 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.60 1whr h VAL 193 Cb 0.45 0.27 -0.07 0.00 -1.52 0.00 0.00 31.29 30.42 1whr h VAL 193 CO 0.00 0.00 0.05 0.00 0.02 0.00 0.00 177.57 177.65 1whr h ALA 194 N -0.12 0.51 -0.97 1.67 0.00 -1.39 -0.77 119.26 118.19 1whr h ALA 194 Ca 0.00 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1whr h ALA 194 Cb 0.63 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 18.55 1whr h ALA 194 CO -0.14 -0.35 0.63 0.00 0.00 0.00 0.00 179.25 179.40 1whr h ALA 195 N 1.40 1.42 -0.42 0.00 0.00 -1.03 0.17 119.26 120.81 1whr h ALA 195 Ca 0.24 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.10 1whr h ALA 195 Cb 0.35 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1whr h ALA 195 CO -0.36 0.45 0.16 -0.92 0.00 0.00 0.00 179.25 178.58 1whr h TYR 196 N 1.16 0.65 0.00 0.00 5.03 0.33 -2.03 116.97 122.10 1whr h TYR 196 Ca 0.41 -0.05 0.00 0.00 2.58 0.00 0.00 58.73 61.66 1whr h TYR 196 Cb 0.13 -0.19 0.00 0.00 1.55 0.00 0.00 36.73 38.22 1whr h TYR 196 CO -0.00 0.58 0.00 1.19 -1.32 0.00 0.00 178.16 178.60 1whr n PHE 197 N -4.61 0.00 -1.86 -3.82 3.01 -0.61 -4.90 117.46 104.66 1whr n PHE 197 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1whr n PHE 197 Cb 0.16 -0.49 0.00 0.00 -0.01 0.00 0.00 39.48 39.13 1whr n PHE 197 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1whr n GLY 198 N 0.79 0.52 3.95 1.37 0.00 -0.15 -4.08 105.19 107.59 1whr n GLY 198 Ca 0.06 -0.46 -0.19 0.00 0.00 0.00 0.00 46.02 45.43 1whr n GLY 198 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1whr s MET 199 N -3.64 2.68 -0.42 1.61 -1.94 0.40 -4.40 119.30 113.59 1whr s MET 199 Ca 0.00 -1.39 0.02 0.00 -1.71 0.00 0.00 55.69 52.61 1whr s MET 199 Cb 0.00 -2.58 0.12 0.00 2.01 0.00 0.00 34.83 34.38 1whr s MET 199 CO 0.00 -0.27 0.20 0.34 -0.01 0.00 0.00 175.02 175.28 1whr s ASP 200 N -4.27 3.91 0.53 3.03 2.15 -1.26 -4.61 116.67 116.16 1whr s ASP 200 Ca 0.52 -2.45 -0.01 0.00 0.43 0.00 0.00 52.55 51.04 1whr s ASP 200 Cb -0.07 -1.14 0.02 0.00 -0.30 0.00 0.00 42.92 41.43 1whr s ASP 200 CO 0.31 -0.30 0.78 -1.38 -0.17 0.00 0.00 175.17 174.41 1whr s HIS 201 N 0.55 3.08 0.15 -5.34 -3.43 -1.26 -4.04 115.29 105.00 1whr s HIS 201 Ca 0.15 0.25 -0.15 0.00 -0.80 0.00 0.00 55.06 54.51 1whr s HIS 201 Cb -0.23 -2.62 0.03 0.00 -1.43 0.00 0.00 32.58 28.33 1whr s HIS 201 CO -0.05 -0.72 0.41 1.21 -2.00 0.00 0.00 174.74 173.60 1whr s ASN 202 N -4.33 -0.19 0.32 7.38 3.84 -0.40 -4.99 114.94 116.56 1whr s ASN 202 Ca 0.53 -0.44 -0.14 0.00 0.21 0.00 0.00 52.86 53.02 1whr s ASN 202 Cb -0.10 0.49 -0.08 0.00 -0.55 0.00 0.00 41.25 41.01 1whr s ASN 202 CO 0.40 -0.91 0.71 0.68 -2.79 0.00 0.00 177.10 175.19 1whr s VAL 203 N -3.85 4.73 0.82 -5.21 -7.23 -1.26 -2.20 120.40 106.20 1whr s VAL 203 Ca 0.06 0.85 -0.12 0.00 -1.81 0.00 0.00 61.98 60.96 1whr s VAL 203 Cb 0.01 -3.62 0.09 0.00 0.56 0.00 0.00 36.38 33.42 1whr s VAL 203 CO -0.08 -0.20 1.15 -0.62 -0.31 0.00 0.00 175.10 175.04 1whr s ASP 204 N -2.36 4.35 0.46 4.85 2.15 -1.22 -4.84 116.67 120.06 1whr s ASP 204 Ca 0.53 0.94 0.19 0.00 0.43 0.00 0.00 52.55 54.64 1whr s ASP 204 Cb -0.10 -1.52 1.04 0.00 -0.30 0.00 0.00 42.92 42.03 1whr s ASP 204 CO 0.19 -2.02 1.52 0.06 -0.17 0.00 0.00 175.17 174.76 1whr h GLN 205 N -1.13 0.00 0.00 4.34 3.07 -1.98 -0.92 115.11 118.50 1whr h GLN 205 Ca -0.47 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.16 1whr h GLN 205 Cb 1.31 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.85 1whr h GLN 205 CO 0.64 0.00 -1.41 0.25 0.09 0.00 0.00 178.83 178.40 1whr n THR 206 N -2.37 0.41 -0.52 1.86 -2.24 -1.26 -5.04 114.28 105.12 1whr n THR 206 Ca -0.01 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1whr n THR 206 Cb 0.35 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 1whr n THR 206 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1whr n GLY 207 N 2.73 1.16 0.06 3.38 0.00 -0.35 -5.02 105.19 107.15 1whr n GLY 207 Ca -0.10 -0.33 -0.03 0.00 0.00 0.00 0.00 46.02 45.55 1whr n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1whr h LYS 208 N 0.00 0.00 -6.19 1.61 1.79 -1.96 -3.46 116.57 108.36 1whr h LYS 208 Ca 0.00 0.00 -0.48 0.00 -2.18 0.00 0.00 60.65 57.99 1whr h LYS 208 Cb 0.18 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.81 1whr h LYS 208 CO 0.00 0.00 -0.46 0.00 -1.08 0.00 0.00 179.45 177.91 1whr s ALA 209 N -2.78 3.82 -0.11 3.86 0.00 -1.26 -4.64 121.76 120.66 1whr s ALA 209 Ca -0.11 -1.28 -0.03 0.00 0.00 0.00 0.00 51.96 50.53 1whr s ALA 209 Cb 0.02 -1.59 -0.03 0.00 0.00 0.00 0.00 23.12 21.51 1whr s ALA 209 CO 0.17 0.26 0.02 0.08 0.00 0.00 0.00 175.76 176.28 1whr s VAL 210 N -2.02 4.46 -0.10 0.00 1.01 -1.26 -3.42 120.40 119.07 1whr s VAL 210 Ca 0.34 -0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.15 1whr s VAL 210 Cb -0.09 -2.91 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 1whr s VAL 210 CO 0.28 0.58 -0.14 -0.63 0.00 0.00 0.00 175.10 175.18 1whr s ILE 211 N -0.63 2.98 0.50 2.22 1.09 -0.94 -1.46 121.20 124.96 1whr s ILE 211 Ca 0.11 -0.71 0.03 0.00 -1.10 0.00 0.00 60.65 58.98 1whr s ILE 211 Cb -0.12 -2.22 -0.02 0.00 -1.06 0.00 0.00 42.46 39.05 1whr s ILE 211 CO 0.02 0.55 0.07 0.27 -0.10 0.00 0.00 174.94 175.74 1whr s ILE 212 N 0.04 1.40 0.33 2.92 -4.36 -0.61 -1.28 121.20 119.65 1whr s ILE 212 Ca -0.05 -1.92 0.01 0.00 -0.26 0.00 0.00 60.65 58.44 1whr s ILE 212 Cb -0.15 -2.32 -0.01 0.00 1.25 0.00 0.00 42.46 41.23 1whr s ILE 212 CO 0.04 0.00 0.37 0.54 0.24 0.00 0.00 174.94 176.14 1whr s ASN 213 N -3.91 1.17 -0.08 4.36 2.20 -1.26 -2.06 114.94 115.36 1whr s ASN 213 Ca 0.15 -1.58 0.04 0.00 -0.94 0.00 0.00 52.86 50.53 1whr s ASN 213 Cb 0.02 0.60 -0.00 0.00 -2.00 0.00 0.00 41.25 39.87 1whr s ASN 213 CO 0.08 -1.17 -0.21 -1.59 -2.94 0.00 0.00 177.10 171.27 1whr s LYS 214 N -3.30 2.56 0.15 3.55 0.00 -1.09 -4.66 119.74 116.95 1whr s LYS 214 Ca 0.35 -0.77 0.02 0.00 0.00 0.00 0.00 55.97 55.57 1whr s LYS 214 Cb 0.01 -2.02 -0.04 0.00 0.00 0.00 0.00 37.83 35.77 1whr s LYS 214 CO 0.23 0.20 -0.01 0.95 0.00 0.00 0.00 175.35 176.72 1whr s THR 215 N 0.26 0.65 0.10 3.79 -4.23 -1.26 -5.03 115.64 109.92 1whr s THR 215 Ca -0.13 -1.97 -0.20 0.00 -1.18 0.00 0.00 61.69 58.21 1whr s THR 215 Cb -0.16 -2.02 -0.09 0.00 1.34 0.00 0.00 72.50 71.57 1whr s THR 215 CO 0.06 -0.56 1.65 0.77 -0.54 0.00 0.00 174.62 176.00 1whr h SER 216 N 2.76 0.26 -1.14 3.99 4.64 -2.00 -2.59 113.55 119.48 1whr h SER 216 Ca -0.36 -0.14 0.32 0.00 -0.47 0.00 0.00 61.79 61.14 1whr h SER 216 Cb 1.20 -0.07 -0.10 0.00 -0.31 0.00 0.00 62.40 63.12 1whr h SER 216 CO 0.63 0.33 0.75 0.78 -0.87 0.00 0.00 176.83 178.44 1whr h ASN 217 N 0.17 0.33 -2.52 4.97 2.35 -1.97 -3.37 115.58 115.53 1whr h ASN 217 Ca 0.06 0.08 -0.58 0.00 -0.55 0.00 0.00 56.30 55.32 1whr h ASN 217 Cb 0.14 0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 1whr h ASN 217 CO -0.01 0.01 1.32 -0.89 -1.65 0.00 0.00 177.43 176.21 1whr s THR 218 N -5.36 3.38 0.31 2.81 2.01 -0.98 -4.97 115.64 112.85 1whr s THR 218 Ca -0.08 0.38 0.09 0.00 0.31 0.00 0.00 61.69 62.39 1whr s THR 218 Cb 0.26 -3.51 -0.06 0.00 0.01 0.00 0.00 72.50 69.20 1whr s THR 218 CO 0.81 -0.33 -0.09 -0.60 -0.69 0.00 0.00 174.62 173.71 1whr s ARG 219 N 5.81 1.70 0.18 4.92 3.52 -1.26 -4.88 118.95 128.94 1whr s ARG 219 Ca 0.84 -1.86 -0.30 0.00 -0.13 0.00 0.00 55.73 54.28 1whr s ARG 219 Cb -0.25 -1.49 -0.08 0.00 -1.56 0.00 0.00 34.95 31.57 1whr s ARG 219 CO 0.34 0.12 1.18 0.42 -0.81 0.00 0.00 175.30 176.54 1whr s ILE 220 N -2.76 3.64 0.62 4.11 1.01 -1.26 -4.93 121.20 121.63 1whr s ILE 220 Ca 0.31 1.38 -0.16 0.00 0.00 0.00 0.00 60.65 62.18 1whr s ILE 220 Cb 0.02 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.59 1whr s ILE 220 CO 0.14 0.22 1.12 -2.16 0.00 0.00 0.00 174.94 174.27 1whr s PRO 221 N -0.27 2.98 0.21 2.79 0.04 -1.26 -4.95 135.00 134.55 1whr s PRO 221 Ca 0.52 1.46 -0.09 0.00 0.04 0.00 0.00 61.00 62.93 1whr s PRO 221 Cb -0.32 -1.97 0.25 0.00 0.04 0.00 0.00 34.50 32.51 1whr s PRO 221 CO 0.36 -1.12 1.80 1.49 0.04 0.00 0.00 177.00 179.57 1whr h GLU 222 N 0.41 0.62 -6.82 4.56 4.22 -2.03 -3.42 114.58 112.11 1whr h GLU 222 Ca -0.48 -0.04 -0.68 0.00 0.08 0.00 0.00 59.36 58.25 1whr h GLU 222 Cb 1.25 -0.14 -0.21 0.00 0.50 0.00 0.00 28.75 30.15 1whr h GLU 222 CO 0.55 0.41 -0.86 -1.14 -2.18 0.00 0.00 179.01 175.79 1whr s GLN 223 N -6.09 1.41 0.47 1.92 0.74 -1.26 -5.15 119.66 111.70 1whr s GLN 223 Ca -0.13 -1.38 0.06 0.00 0.05 0.00 0.00 55.36 53.97 1whr s GLN 223 Cb 0.16 -1.87 -0.00 0.00 1.10 0.00 0.00 33.01 32.40 1whr s GLN 223 CO 0.76 0.43 0.32 1.03 -0.55 0.00 0.00 175.29 177.28 1whr s ARG 224 N -2.17 2.32 0.11 1.67 0.52 -1.26 -5.05 118.95 115.08 1whr s ARG 224 Ca 0.15 -1.86 -0.14 0.00 -0.52 0.00 0.00 55.73 53.36 1whr s ARG 224 Cb -0.10 -2.12 -0.07 0.00 0.52 0.00 0.00 34.95 33.19 1whr s ARG 224 CO 0.07 -0.36 1.45 0.74 0.02 0.00 0.00 175.30 177.22 1whr h PHE 225 N 1.04 0.88 -0.82 -0.53 -1.00 -2.00 -3.10 116.94 111.40 1whr h PHE 225 Ca -0.40 -0.25 0.01 0.00 2.81 0.00 0.00 57.97 60.13 1whr h PHE 225 Cb 1.28 -0.19 -0.04 0.00 3.61 0.00 0.00 35.95 40.61 1whr h PHE 225 CO 0.78 1.00 0.53 0.66 -1.61 0.00 0.00 178.31 179.67 1whr h SER 226 N 0.51 0.95 -0.80 2.17 4.64 -1.96 -2.66 113.55 116.40 1whr h SER 226 Ca 0.06 -0.03 0.19 0.00 -0.47 0.00 0.00 61.79 61.53 1whr h SER 226 Cb 0.83 -0.24 -0.14 0.00 -0.31 0.00 0.00 62.40 62.54 1whr h SER 226 CO 0.07 0.70 -0.02 -0.33 -0.87 0.00 0.00 176.83 176.38 1whr h GLU 227 N 1.12 0.07 0.00 4.77 4.39 -1.95 1.05 114.58 124.03 1whr h GLU 227 Ca 0.30 -0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.98 1whr h GLU 227 Cb -0.11 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1whr h GLU 227 CO -0.06 0.05 -0.09 0.45 -1.16 0.00 0.00 179.01 178.20 1whr h HIS 228 N 0.08 0.00 -0.28 4.33 3.86 -1.59 -2.04 115.15 119.51 1whr h HIS 228 Ca 0.44 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.49 1whr h HIS 228 Cb 0.78 0.00 -0.09 0.00 1.06 0.00 0.00 27.41 29.16 1whr h HIS 228 CO -0.47 0.09 0.20 -0.89 0.86 0.00 0.00 177.93 177.72 1whr n ILE 229 N -4.17 1.79 -3.24 2.45 5.41 0.36 -4.84 119.36 117.12 1whr n ILE 229 Ca -0.03 -0.67 -0.41 0.00 1.00 0.00 0.00 62.75 62.64 1whr n ILE 229 Cb 0.17 -0.96 -0.08 0.00 -0.71 0.00 0.00 39.64 38.06 1whr n ILE 229 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1whr s LYS 230 N -0.97 3.66 0.26 0.38 2.47 -0.77 -5.03 119.74 119.74 1whr s LYS 230 Ca 0.17 -0.13 -0.08 0.00 -1.56 0.00 0.00 55.97 54.38 1whr s LYS 230 Cb 0.14 -3.80 -0.01 0.00 -1.46 0.00 0.00 37.83 32.70 1whr s LYS 230 CO 0.02 -0.62 0.39 0.34 0.16 0.00 0.00 175.35 175.65 1whr s ASP 231 N 1.75 0.21 0.33 1.43 2.15 -1.26 -5.03 116.67 116.24 1whr s ASP 231 Ca 0.19 -1.17 0.10 0.00 0.43 0.00 0.00 52.55 52.09 1whr s ASP 231 Cb -0.15 0.56 1.00 0.00 -0.30 0.00 0.00 42.92 44.02 1whr s ASP 231 CO 0.13 -1.11 1.57 -0.08 -0.17 0.00 0.00 175.17 175.52 1whr h GLU 232 N 2.31 0.00 -5.88 4.34 4.81 -2.04 -3.35 114.58 114.77 1whr h GLU 232 Ca -0.29 -0.00 -0.54 0.00 -0.13 0.00 0.00 59.36 58.40 1whr h GLU 232 Cb 1.25 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.63 1whr h GLU 232 CO 0.40 0.00 1.52 0.21 -0.73 0.00 0.00 179.01 180.41 1whr s LYS 233 N -5.81 2.74 0.19 1.92 2.20 -1.26 -4.93 119.74 114.80 1whr s LYS 233 Ca -0.11 1.67 0.01 0.00 -0.36 0.00 0.00 55.97 57.17 1whr s LYS 233 Cb 0.31 -4.44 -0.05 0.00 -1.51 0.00 0.00 37.83 32.15 1whr s LYS 233 CO 0.78 -2.55 0.04 -0.80 -0.36 0.00 0.00 175.35 172.46 1whr s ASN 234 N 9.51 1.06 -0.07 1.43 0.01 -1.26 -5.03 114.94 120.59 1whr s ASN 234 Ca 0.96 -1.24 -0.21 0.00 -0.71 0.00 0.00 52.86 51.65 1whr s ASN 234 Cb -0.25 0.16 0.05 0.00 0.41 0.00 0.00 41.25 41.62 1whr s ASN 234 CO 0.31 -0.64 0.48 0.28 -1.51 0.00 0.00 177.10 176.02 1whr s THR 235 N -3.75 0.02 -0.06 1.60 -1.32 -1.26 -5.16 115.64 105.71 1whr s THR 235 Ca 0.28 -0.20 0.05 0.00 -1.21 0.00 0.00 61.69 60.62 1whr s THR 235 Cb 0.07 -0.76 -0.01 0.00 -1.51 0.00 0.00 72.50 70.28 1whr s THR 235 CO 0.07 -0.11 -0.23 -1.83 -2.21 0.00 0.00 174.62 170.31 1whr s GLU 236 N -0.88 2.60 0.18 7.08 -1.05 -1.26 -5.13 118.70 120.23 1whr s GLU 236 Ca -0.09 -0.86 0.04 0.00 -0.15 0.00 0.00 54.97 53.91 1whr s GLU 236 Cb -0.03 -2.23 -0.04 0.00 -0.44 0.00 0.00 34.13 31.40 1whr s GLU 236 CO 0.05 0.41 0.24 -0.06 0.95 0.00 0.00 175.26 176.85 1whr s PHE 237 N -0.21 3.33 -0.36 4.83 0.08 -1.26 -5.05 117.98 119.34 1whr s PHE 237 Ca -0.02 0.03 0.11 0.00 0.12 0.00 0.00 56.93 57.17 1whr s PHE 237 Cb -0.13 -1.57 0.45 0.00 -0.57 0.00 0.00 43.02 41.19 1whr s PHE 237 CO 0.03 0.51 1.07 0.94 -0.10 0.00 0.00 175.22 177.67 1whr n GLN 238 N -0.69 2.54 -0.63 0.44 -0.06 -1.26 -5.10 117.38 112.62 1whr n GLN 238 Ca -0.08 -3.96 -0.31 0.00 -2.00 0.00 0.00 57.00 50.66 1whr n GLN 238 Cb 0.55 -1.86 0.18 0.00 -4.06 0.00 0.00 30.24 25.05 1whr n GLN 238 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 1whr n GLN 239 N -0.39 -1.87 -1.24 3.69 6.02 -1.26 -4.95 117.38 117.38 1whr n GLN 239 Ca 0.27 -0.53 -0.05 0.00 -0.01 0.00 0.00 57.00 56.68 1whr n GLN 239 Cb 0.77 -1.72 0.13 0.00 1.02 0.00 0.00 30.24 30.43 1whr n GLN 239 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1whr n ARG 240 N -2.42 2.21 -4.48 -1.09 1.74 -1.26 -5.04 116.66 106.33 1whr n ARG 240 Ca 0.01 -3.54 -0.23 0.00 -0.77 0.00 0.00 57.85 53.32 1whr n ARG 240 Cb 0.60 -1.76 -0.09 0.00 -1.02 0.00 0.00 32.46 30.19 1whr n ARG 240 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1whr s PHE 241 N -3.20 1.83 0.23 -1.55 0.08 -1.26 -5.16 117.98 108.96 1whr s PHE 241 Ca 0.42 -1.14 0.04 0.00 0.12 0.00 0.00 56.93 56.37 1whr s PHE 241 Cb 0.38 -1.19 -0.03 0.00 -0.57 0.00 0.00 43.02 41.61 1whr s PHE 241 CO -0.04 -0.17 0.37 0.96 -0.10 0.00 0.00 175.22 176.24 1whr s ILE 242 N -3.29 5.25 0.08 0.64 -4.36 -1.26 -5.12 121.20 113.14 1whr s ILE 242 Ca 0.30 -0.85 -0.09 0.00 -0.26 0.00 0.00 60.65 59.75 1whr s ILE 242 Cb 0.05 -3.83 -0.00 0.00 1.25 0.00 0.00 42.46 39.93 1whr s ILE 242 CO 0.15 -0.30 0.19 -0.76 0.24 0.00 0.00 174.94 174.46 1whr s LEU 243 N -3.83 1.40 0.36 0.37 1.43 -1.26 -5.14 118.68 112.01 1whr s LEU 243 Ca 0.35 -0.60 -0.28 0.00 -1.03 0.00 0.00 54.13 52.57 1whr s LEU 243 Cb -0.10 1.04 -0.12 0.00 0.03 0.00 0.00 46.19 47.04 1whr s LEU 243 CO 0.30 -0.71 1.35 -1.54 0.23 0.00 0.00 176.35 175.98 1whr n SER 244 N 0.05 3.06 -4.75 2.29 3.41 -1.26 -5.00 113.62 111.41 1whr n SER 244 Ca -0.16 1.21 -0.24 0.00 -0.26 0.00 0.00 58.87 59.42 1whr n SER 244 Cb 0.62 -1.53 -0.06 0.00 -0.26 0.00 0.00 64.21 62.98 1whr n SER 244 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1whr s GLY 245 N -0.27 1.57 -1.05 5.00 0.00 -1.26 -5.03 107.32 106.28 1whr s GLY 245 Ca 0.55 -1.43 -0.24 0.00 0.00 0.00 0.00 44.72 43.60 1whr s GLY 245 CO 0.62 -1.47 1.94 2.56 0.00 0.00 0.00 173.10 176.75 1whr s PRO 246 N -3.53 2.53 -0.20 2.90 0.04 -1.26 -4.93 135.00 130.54 1whr s PRO 246 Ca 0.31 -0.74 -0.29 0.00 0.04 0.00 0.00 61.00 60.32 1whr s PRO 246 Cb -0.08 -5.16 -0.02 0.00 0.04 0.00 0.00 34.50 29.28 1whr s PRO 246 CO 0.22 -3.68 1.47 -1.54 0.04 0.00 0.00 177.00 173.52 1whr s SER 247 N 7.23 6.61 0.24 6.66 1.04 -1.26 -4.90 113.70 129.32 1whr s SER 247 Ca 0.69 1.62 -0.06 0.00 0.48 0.00 0.00 55.95 58.68 1whr s SER 247 Cb -0.04 -2.54 0.42 0.00 0.10 0.00 0.00 66.02 63.97 1whr s SER 247 CO 0.06 -1.07 1.70 0.77 0.98 0.00 0.00 173.24 175.68 1whr h SER 248 N 9.70 0.04 0.00 7.02 4.64 -2.08 -3.57 113.55 129.30 1whr h SER 248 Ca -0.31 0.13 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 1whr h SER 248 Cb 1.13 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1whr h SER 248 CO 1.00 -0.01 0.00 0.61 -0.87 0.00 0.00 176.83 177.56