#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i7x h ASN 138 N 0.00 0.00 -0.21 4.52 2.35 -2.05 -2.88 115.58 117.31 1i7x h ASN 138 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1i7x h ASN 138 Cb 0.00 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.37 1i7x h ASN 138 CO 0.00 0.59 0.00 0.18 -1.65 0.00 0.00 177.43 176.55 1i7x n LEU 139 N -2.90 3.21 -0.07 1.61 4.77 -1.26 -3.63 117.00 118.72 1i7x n LEU 139 Ca -0.09 -1.25 -0.07 0.00 -0.03 0.00 0.00 56.01 54.57 1i7x n LEU 139 Cb 0.84 -0.12 -0.13 0.00 -2.33 0.00 0.00 43.42 41.68 1i7x n LEU 139 CO 0.43 0.62 -0.99 -0.38 -1.33 0.00 0.00 177.39 175.73 1i7x n ILE 140 N 1.40 1.01 1.07 -0.08 2.08 -1.24 -4.45 119.36 119.15 1i7x n ILE 140 Ca 0.16 -0.65 0.11 0.00 0.56 0.00 0.00 62.75 62.94 1i7x n ILE 140 Cb 0.60 -0.53 0.11 0.00 -0.75 0.00 0.00 39.64 39.07 1i7x n ILE 140 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 1i7x n ASN 141 N -2.55 1.35 0.08 4.38 2.04 -1.09 -3.91 115.26 115.56 1i7x n ASN 141 Ca -0.24 -1.08 -0.04 0.00 -0.44 0.00 0.00 54.58 52.78 1i7x n ASN 141 Cb 0.98 0.46 -0.02 0.00 -2.53 0.00 0.00 39.78 38.66 1i7x n ASN 141 CO 0.00 0.00 0.00 0.22 -0.44 0.00 0.00 177.26 177.04 1i7x h TYR 142 N 1.31 -0.22 -0.08 -2.53 3.20 -1.78 -1.51 116.97 115.37 1i7x h TYR 142 Ca 0.00 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.89 1i7x h TYR 142 Cb 0.60 0.07 -0.00 0.00 1.54 0.00 0.00 36.73 38.94 1i7x h TYR 142 CO 0.00 -0.13 0.14 -0.56 -1.64 0.00 0.00 178.16 175.96 1i7x h GLN 143 N -0.50 0.00 0.24 1.82 3.07 -1.80 0.40 115.11 118.34 1i7x h GLN 143 Ca -0.02 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.70 1i7x h GLN 143 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.74 1i7x h GLN 143 CO 0.04 0.00 -0.12 0.22 0.09 0.00 0.00 178.83 179.06 1i7x h ASP 144 N 0.00 -0.27 0.14 0.06 1.82 -1.67 -0.23 116.42 116.27 1i7x h ASP 144 Ca 0.04 0.01 -0.03 0.00 -0.39 0.00 0.00 57.03 56.66 1i7x h ASP 144 Cb 0.31 0.07 -0.00 0.00 0.68 0.00 0.00 39.33 40.39 1i7x h ASP 144 CO -0.00 -0.08 -0.14 0.44 -1.61 0.00 0.00 179.24 177.85 1i7x h ASP 145 N -0.56 0.00 0.52 2.28 3.32 -0.90 0.52 116.42 121.59 1i7x h ASP 145 Ca -0.03 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 1i7x h ASP 145 Cb 0.25 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.80 1i7x h ASP 145 CO 0.05 0.14 -0.25 0.00 -1.72 0.00 0.00 179.24 177.47 1i7x h ALA 146 N 1.86 -0.69 -0.66 3.45 0.00 -0.26 0.22 119.26 123.18 1i7x h ALA 146 Ca -0.00 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1i7x h ALA 146 Cb 0.25 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1i7x h ALA 146 CO 0.02 -0.75 0.42 1.49 0.00 0.00 0.00 179.25 180.43 1i7x h GLU 147 N -0.97 0.82 -0.24 0.00 4.81 -0.70 0.14 114.58 118.44 1i7x h GLU 147 Ca -0.07 -0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.18 1i7x h GLU 147 Cb 0.61 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.80 1i7x h GLU 147 CO 0.12 0.54 0.17 1.25 -0.73 0.00 0.00 179.01 180.36 1i7x h LEU 148 N 0.84 0.01 -0.06 1.64 5.85 0.14 -0.65 115.31 123.08 1i7x h LEU 148 Ca 0.25 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.91 1i7x h LEU 148 Cb -0.03 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.00 1i7x h LEU 148 CO -0.08 0.00 -0.23 0.00 -0.34 0.00 0.00 178.44 177.80 1i7x h ALA 149 N 1.88 0.11 0.00 1.25 0.00 0.21 -2.64 119.26 120.06 1i7x h ALA 149 Ca 0.11 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1i7x h ALA 149 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1i7x h ALA 149 CO -0.00 0.09 0.03 2.41 0.00 0.00 0.00 179.25 181.77 1i7x n THR 150 N -4.52 1.07 0.14 0.00 -1.04 -0.25 0.16 114.28 109.83 1i7x n THR 150 Ca -0.08 0.72 0.09 0.00 -2.04 0.00 0.00 64.05 62.74 1i7x n THR 150 Cb 0.45 -1.72 0.05 0.00 -1.82 0.00 0.00 70.33 67.28 1i7x n THR 150 CO 0.00 0.00 0.00 -0.09 -0.64 0.00 0.00 175.07 174.34 1i7x h ARG 151 N 0.00 0.00 0.00 -2.82 2.43 -0.91 -3.37 114.38 109.71 1i7x h ARG 151 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1i7x h ARG 151 Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1i7x h ARG 151 CO 0.00 0.10 -1.12 0.00 -1.51 0.00 0.00 179.97 177.44 1i7x n ALA 152 N -2.19 2.21 -0.05 2.80 0.00 0.12 -4.76 120.51 118.64 1i7x n ALA 152 Ca 0.00 -0.11 -0.09 0.00 0.00 0.00 0.00 53.44 53.25 1i7x n ALA 152 Cb 0.60 -0.16 -0.06 0.00 0.00 0.00 0.00 19.45 19.84 1i7x n ALA 152 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1i7x h ILE 153 N 0.00 0.00 -0.91 0.00 1.08 -0.46 -0.21 117.51 117.01 1i7x h ILE 153 Ca 0.00 0.00 0.24 0.00 -0.39 0.00 0.00 64.86 64.71 1i7x h ILE 153 Cb 0.20 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 33.82 1i7x h ILE 153 CO 0.00 0.00 0.37 -0.65 -0.69 0.00 0.00 178.15 177.18 1i7x h PRO 154 N -0.28 0.31 0.12 2.37 0.11 -1.84 0.09 132.00 132.88 1i7x h PRO 154 Ca 0.03 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1i7x h PRO 154 Cb 0.38 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1i7x h PRO 154 CO -0.31 0.21 -0.06 0.93 -0.21 0.00 0.00 178.00 178.56 1i7x h GLU 155 N 0.32 -0.15 -0.73 1.05 4.39 -1.73 -2.64 114.58 115.09 1i7x h GLU 155 Ca 0.59 0.01 0.16 0.00 0.34 0.00 0.00 59.36 60.46 1i7x h GLU 155 Cb 1.18 0.04 -0.11 0.00 -0.10 0.00 0.00 28.75 29.75 1i7x h GLU 155 CO -0.58 0.25 0.13 -0.07 -1.16 0.00 0.00 179.01 177.57 1i7x h LEU 156 N -0.60 -0.09 0.00 1.33 3.38 -0.13 -0.38 115.31 118.82 1i7x h LEU 156 Ca -0.02 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1i7x h LEU 156 Cb 0.47 0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1i7x h LEU 156 CO 0.03 -0.08 0.00 0.41 0.09 0.00 0.00 178.44 178.89 1i7x n THR 157 N -5.21 0.00 -0.53 0.22 -1.04 -0.07 -1.19 114.28 106.47 1i7x n THR 157 Ca 0.14 1.45 0.43 0.00 -2.04 0.00 0.00 64.05 64.03 1i7x n THR 157 Cb 0.46 -2.19 0.73 0.00 -1.82 0.00 0.00 70.33 67.51 1i7x n THR 157 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 1i7x h LYS 158 N 0.00 0.04 -0.37 -2.82 1.57 -0.96 0.65 116.57 114.68 1i7x h LYS 158 Ca 0.00 -0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 1i7x h LYS 158 Cb 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1i7x h LYS 158 CO 0.00 0.03 -0.26 -0.07 -0.57 0.00 0.00 179.45 178.57 1i7x h LEU 159 N 0.04 0.87 -1.78 2.94 4.07 0.40 -0.73 115.31 121.12 1i7x h LEU 159 Ca 0.84 -0.44 -0.03 0.00 0.08 0.00 0.00 57.88 58.34 1i7x h LEU 159 Cb 3.00 -0.24 -0.00 0.00 1.08 0.00 0.00 40.66 44.50 1i7x h LEU 159 CO -0.24 1.12 -0.14 -0.07 -1.08 0.00 0.00 178.44 178.03 1i7x h LEU 160 N 0.63 0.00 -0.02 1.67 3.38 0.13 -0.65 115.31 120.45 1i7x h LEU 160 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1i7x h LEU 160 Cb 0.84 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1i7x h LEU 160 CO 0.07 0.14 -0.13 0.78 0.09 0.00 0.00 178.44 179.39 1i7x h ASN 161 N 0.00 0.00 -2.96 -0.43 2.35 -0.99 -3.45 115.58 110.09 1i7x h ASN 161 Ca -0.00 0.00 -0.58 0.00 -0.55 0.00 0.00 56.30 55.17 1i7x h ASN 161 Cb 0.27 0.00 0.17 0.00 0.05 0.00 0.00 38.32 38.81 1i7x h ASN 161 CO 0.02 0.13 -0.36 -0.67 -1.65 0.00 0.00 177.43 174.90 1i7x n ASP 162 N -3.13 -0.93 0.08 5.81 -0.08 -0.25 -4.92 116.55 113.13 1i7x n ASP 162 Ca 0.03 0.75 -0.18 0.00 -1.51 0.00 0.00 54.79 53.89 1i7x n ASP 162 Cb 0.58 -1.18 -0.10 0.00 2.34 0.00 0.00 41.12 42.76 1i7x n ASP 162 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1i7x h GLU 163 N 0.29 0.51 -5.90 -0.67 5.08 -1.90 -3.44 114.58 108.55 1i7x h GLU 163 Ca -0.45 -0.63 -0.59 0.00 -1.00 0.00 0.00 59.36 56.69 1i7x h GLU 163 Cb 1.40 0.20 -0.00 0.00 0.50 0.00 0.00 28.75 30.84 1i7x h GLU 163 CO 0.47 1.25 1.51 -3.47 -1.00 0.00 0.00 179.01 177.78 1i7x n ASP 164 N -3.75 2.78 -0.34 1.42 -0.08 -1.26 -4.81 116.55 110.52 1i7x n ASP 164 Ca -0.10 0.13 0.18 0.00 -1.51 0.00 0.00 54.79 53.49 1i7x n ASP 164 Cb 0.92 -1.48 0.39 0.00 2.34 0.00 0.00 41.12 43.29 1i7x n ASP 164 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 1i7x h GLN 165 N 15.18 0.48 -0.45 -0.67 5.75 -1.99 -0.64 115.11 132.78 1i7x h GLN 165 Ca -0.34 -0.03 -0.10 0.00 -0.15 0.00 0.00 58.65 58.03 1i7x h GLN 165 Cb 1.27 -0.11 -0.02 0.00 1.07 0.00 0.00 27.48 29.69 1i7x h GLN 165 CO 1.02 0.32 -0.13 0.28 -2.65 0.00 0.00 178.83 177.67 1i7x h VAL 166 N 0.50 1.26 0.46 2.39 2.07 -1.97 -1.48 116.25 119.48 1i7x h VAL 166 Ca 0.65 -1.21 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 1i7x h VAL 166 Cb 1.28 1.06 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1i7x h VAL 166 CO -0.51 0.42 -0.30 0.58 0.02 0.00 0.00 177.57 177.78 1i7x h VAL 167 N 0.74 0.39 -0.16 2.57 2.07 -1.48 -2.00 116.25 118.37 1i7x h VAL 167 Ca 0.12 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.69 1i7x h VAL 167 Cb 0.63 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 30.72 1i7x h VAL 167 CO 0.04 0.00 -0.35 0.58 0.02 0.00 0.00 177.57 177.86 1i7x h VAL 168 N -0.72 0.23 -0.37 2.57 2.07 -1.35 -0.51 116.25 118.18 1i7x h VAL 168 Ca -0.05 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.54 1i7x h VAL 168 Cb 0.60 0.23 -0.09 0.00 -1.52 0.00 0.00 31.29 30.52 1i7x h VAL 168 CO 0.04 0.00 -0.41 0.78 0.02 0.00 0.00 177.57 178.00 1i7x h ASN 169 N -0.41 -1.36 -0.57 0.57 -0.26 -1.15 0.24 115.58 112.64 1i7x h ASN 169 Ca 0.10 0.21 0.09 0.00 -0.56 0.00 0.00 56.30 56.13 1i7x h ASN 169 Cb 0.57 0.59 -0.07 0.00 -1.06 0.00 0.00 38.32 38.36 1i7x h ASN 169 CO -0.39 -0.37 0.20 0.11 -1.06 0.00 0.00 177.43 175.92 1i7x h LYS 170 N -0.34 0.37 -0.76 0.81 1.57 -0.92 -1.74 116.57 115.56 1i7x h LYS 170 Ca 0.13 -0.02 0.06 0.00 -1.87 0.00 0.00 60.65 58.95 1i7x h LYS 170 Cb 0.58 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.75 1i7x h LYS 170 CO -0.54 0.25 0.45 0.00 -0.57 0.00 0.00 179.45 179.03 1i7x h ALA 171 N 1.39 1.03 -0.48 3.86 0.00 0.69 -1.49 119.26 124.27 1i7x h ALA 171 Ca 0.28 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.22 1i7x h ALA 171 Cb 0.34 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1i7x h ALA 171 CO -0.29 0.16 0.28 0.00 0.00 0.00 0.00 179.25 179.40 1i7x h ALA 172 N 1.37 0.61 -0.67 0.00 0.00 0.23 -0.42 119.26 120.38 1i7x h ALA 172 Ca 0.34 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.31 1i7x h ALA 172 Cb 0.18 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1i7x h ALA 172 CO -0.18 -0.03 0.35 0.28 0.00 0.00 0.00 179.25 179.68 1i7x h VAL 173 N 0.56 0.92 -0.34 0.00 2.07 -0.68 0.25 116.25 119.03 1i7x h VAL 173 Ca 0.19 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.46 1i7x h VAL 173 Cb 0.02 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 1i7x h VAL 173 CO -0.09 0.12 0.09 0.24 0.02 0.00 0.00 177.57 177.95 1i7x h MET 174 N 0.64 0.53 -0.62 1.57 2.86 -0.55 -1.40 114.93 117.96 1i7x h MET 174 Ca 0.31 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.79 1i7x h MET 174 Cb 0.24 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 1i7x h MET 174 CO -0.21 0.58 0.23 0.28 1.06 0.00 0.00 176.91 178.85 1i7x h VAL 175 N 0.39 1.22 0.81 -2.22 2.07 -0.37 -1.29 116.25 116.86 1i7x h VAL 175 Ca 0.11 -0.72 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 1i7x h VAL 175 Cb 0.28 0.50 0.01 0.00 -1.52 0.00 0.00 31.29 30.56 1i7x h VAL 175 CO -0.00 0.28 -0.39 -0.74 0.02 0.00 0.00 177.57 176.75 1i7x h HIS 176 N 0.89 -1.00 -0.63 1.57 6.17 -0.25 -1.37 115.15 120.52 1i7x h HIS 176 Ca 0.21 -0.02 0.15 0.00 0.71 0.00 0.00 60.37 61.41 1i7x h HIS 176 Cb 0.20 0.33 -0.04 0.00 2.52 0.00 0.00 27.41 30.43 1i7x h HIS 176 CO 0.01 -0.62 0.44 0.37 0.71 0.00 0.00 177.93 178.85 1i7x h GLN 177 N -1.12 0.21 -0.30 5.26 4.15 -1.10 -0.63 115.11 121.59 1i7x h GLN 177 Ca -0.11 -0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.18 1i7x h GLN 177 Cb 0.84 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.47 1i7x h GLN 177 CO 0.18 0.14 -0.29 -0.07 -1.93 0.00 0.00 178.83 176.86 1i7x h LEU 178 N 0.22 0.63 -0.44 -2.39 3.38 -0.79 -2.93 115.31 112.99 1i7x h LEU 178 Ca 0.31 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1i7x h LEU 178 Cb 0.90 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.47 1i7x h LEU 178 CO -0.06 0.89 0.00 -1.54 0.09 0.00 0.00 178.44 177.82 1i7x n SER 179 N -4.09 0.33 -0.02 -0.43 3.41 -0.24 -2.30 113.62 110.29 1i7x n SER 179 Ca -0.01 0.60 -0.15 0.00 -0.26 0.00 0.00 58.87 59.05 1i7x n SER 179 Cb 0.45 -0.66 -0.03 0.00 -0.26 0.00 0.00 64.21 63.71 1i7x n SER 179 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1i7x h LYS 180 N 0.00 0.72 -6.50 4.33 1.57 -1.52 -3.41 116.57 111.76 1i7x h LYS 180 Ca 0.00 -0.54 -0.55 0.00 -1.87 0.00 0.00 60.65 57.69 1i7x h LYS 180 Cb 0.25 0.10 -0.07 0.00 0.08 0.00 0.00 32.23 32.59 1i7x h LYS 180 CO 0.00 1.16 1.04 0.15 -0.57 0.00 0.00 179.45 181.23 1i7x s LYS 181 N -3.83 3.41 0.47 3.15 1.02 -0.97 -4.88 119.74 118.10 1i7x s LYS 181 Ca -0.09 0.36 0.39 0.00 0.02 0.00 0.00 55.97 56.65 1i7x s LYS 181 Cb 0.10 -4.07 1.51 0.00 -0.52 0.00 0.00 37.83 34.85 1i7x s LYS 181 CO 0.88 -1.80 1.46 -1.91 -0.92 0.00 0.00 175.35 173.06 1i7x n GLU 182 N 8.55 -0.02 0.33 1.68 2.13 -1.26 -0.28 120.64 131.77 1i7x n GLU 182 Ca 0.10 1.10 -0.13 0.00 0.66 0.00 0.00 57.16 58.89 1i7x n GLU 182 Cb 0.49 -2.33 -0.06 0.00 0.27 0.00 0.00 31.44 29.81 1i7x n GLU 182 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1i7x h ALA 183 N 1.22 -1.20 -0.43 4.31 0.00 -1.90 -3.04 119.26 118.23 1i7x h ALA 183 Ca 0.85 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 55.63 1i7x h ALA 183 Cb 3.10 0.32 -0.05 0.00 0.00 0.00 0.00 17.79 21.16 1i7x h ALA 183 CO -0.23 -1.14 0.15 0.77 0.00 0.00 0.00 179.25 178.80 1i7x h SER 184 N -0.86 0.15 -1.26 0.00 0.02 -0.84 -2.40 113.55 108.36 1i7x h SER 184 Ca -0.09 0.05 0.40 0.00 -0.84 0.00 0.00 61.79 61.32 1i7x h SER 184 Cb 0.64 0.04 -0.12 0.00 0.14 0.00 0.00 62.40 63.10 1i7x h SER 184 CO 0.14 0.12 0.81 -0.09 -1.14 0.00 0.00 176.83 176.67 1i7x h ARG 185 N 0.31 0.14 0.00 3.45 2.43 -1.18 1.38 114.38 120.91 1i7x h ARG 185 Ca 0.20 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.25 1i7x h ARG 185 Cb 0.19 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.70 1i7x h ARG 185 CO -0.21 0.09 -0.52 0.45 -1.51 0.00 0.00 179.97 178.27 1i7x h HIS 186 N 0.14 0.00 -0.16 2.20 3.86 -1.31 -1.01 115.15 118.86 1i7x h HIS 186 Ca 0.78 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.85 1i7x h HIS 186 Cb 2.36 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.83 1i7x h HIS 186 CO -0.01 0.52 -0.44 0.00 0.86 0.00 0.00 177.93 178.87 1i7x h ALA 187 N 1.48 0.27 -0.07 2.45 0.00 0.18 -2.37 119.26 121.20 1i7x h ALA 187 Ca -0.01 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1i7x h ALA 187 Cb 1.27 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1i7x h ALA 187 CO 0.07 0.40 -0.06 0.82 0.00 0.00 0.00 179.25 180.48 1i7x h ILE 188 N 0.24 1.36 0.00 0.00 2.04 -1.29 -2.59 117.51 117.27 1i7x h ILE 188 Ca -0.01 -1.17 0.00 0.00 1.00 0.00 0.00 64.86 64.68 1i7x h ILE 188 Cb 1.05 2.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.13 1i7x h ILE 188 CO 0.09 0.32 0.17 0.80 0.00 0.00 0.00 178.15 179.54 1i7x n MET 189 N -4.73 0.11 0.00 2.37 1.56 -0.39 -0.65 117.12 115.39 1i7x n MET 189 Ca -0.07 0.60 0.05 0.00 -0.27 0.00 0.00 57.70 58.00 1i7x n MET 189 Cb 0.29 -2.04 0.02 0.00 2.15 0.00 0.00 33.22 33.64 1i7x n MET 189 CO 0.00 0.00 0.00 0.54 -0.73 0.00 0.00 175.97 175.78 1i7x n ARG 190 N -2.15 1.36 -3.50 2.12 1.74 -0.90 -4.67 116.66 110.67 1i7x n ARG 190 Ca -0.01 -0.79 -0.41 0.00 -0.77 0.00 0.00 57.85 55.86 1i7x n ARG 190 Cb 0.20 -1.11 -0.04 0.00 -1.02 0.00 0.00 32.46 30.48 1i7x n ARG 190 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1i7x s SER 191 N -1.08 6.33 0.47 0.55 0.15 0.17 -4.93 113.70 115.36 1i7x s SER 191 Ca 0.09 -3.19 0.31 0.00 0.70 0.00 0.00 55.95 53.87 1i7x s SER 191 Cb 0.08 -2.05 1.41 0.00 -1.71 0.00 0.00 66.02 63.75 1i7x s SER 191 CO 0.18 -0.36 1.71 -0.65 1.20 0.00 0.00 173.24 175.32 1i7x h PRO 192 N 6.91 0.13 0.00 5.44 0.11 -1.88 0.53 132.00 143.24 1i7x h PRO 192 Ca 0.11 -0.01 -0.16 0.00 0.11 0.00 0.00 66.00 66.05 1i7x h PRO 192 Cb 0.93 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.98 1i7x h PRO 192 CO 0.82 0.09 -0.75 1.96 -0.21 0.00 0.00 178.00 179.92 1i7x h GLN 193 N 0.14 0.00 0.14 1.05 4.20 -1.93 -1.85 115.11 116.86 1i7x h GLN 193 Ca 0.70 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.40 1i7x h GLN 193 Cb 2.33 0.00 0.00 0.00 0.30 0.00 0.00 27.48 30.11 1i7x h GLN 193 CO -0.21 0.75 -0.07 1.98 -0.67 0.00 0.00 178.83 180.60 1i7x h MET 194 N 0.00 -0.18 0.08 1.46 4.05 -0.31 -2.46 114.93 117.56 1i7x h MET 194 Ca -0.01 0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.44 1i7x h MET 194 Cb 1.34 0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 32.14 1i7x h MET 194 CO 0.10 0.27 -0.48 0.28 0.23 0.00 0.00 176.91 177.31 1i7x h VAL 195 N -0.80 0.00 -1.09 -5.77 2.07 -1.34 0.13 116.25 109.45 1i7x h VAL 195 Ca -0.02 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.80 1i7x h VAL 195 Cb 0.54 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 30.23 1i7x h VAL 195 CO 0.03 0.00 0.73 0.28 0.02 0.00 0.00 177.57 178.64 1i7x h SER 196 N -0.66 0.28 1.23 0.57 0.02 -1.43 0.86 113.55 114.42 1i7x h SER 196 Ca -0.00 0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 60.86 1i7x h SER 196 Cb 0.68 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.21 1i7x h SER 196 CO -0.28 0.04 -0.68 0.00 -1.14 0.00 0.00 176.83 174.78 1i7x h ALA 197 N 1.55 0.59 -0.01 3.77 0.00 -0.64 -1.69 119.26 122.83 1i7x h ALA 197 Ca 0.59 -0.61 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1i7x h ALA 197 Cb 1.80 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1i7x h ALA 197 CO -0.20 0.84 -0.10 0.82 0.00 0.00 0.00 179.25 180.62 1i7x h ILE 198 N 0.00 1.54 0.08 0.00 2.04 0.32 -0.89 117.51 120.59 1i7x h ILE 198 Ca -0.01 -1.73 0.02 0.00 1.00 0.00 0.00 64.86 64.15 1i7x h ILE 198 Cb 1.47 2.65 -0.04 0.00 -0.74 0.00 0.00 36.82 40.16 1i7x h ILE 198 CO 0.09 0.46 -0.32 0.58 0.00 0.00 0.00 178.15 178.95 1i7x h VAL 199 N -0.58 0.30 -0.62 1.67 2.07 -0.66 0.12 116.25 118.57 1i7x h VAL 199 Ca -0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1i7x h VAL 199 Cb 0.81 0.30 -0.09 0.00 -1.52 0.00 0.00 31.29 30.80 1i7x h VAL 199 CO 0.02 0.00 0.15 -0.09 0.02 0.00 0.00 177.57 177.68 1i7x h ARG 200 N -0.52 0.28 -0.73 1.57 2.43 -1.37 -0.62 114.38 115.42 1i7x h ARG 200 Ca 0.04 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1i7x h ARG 200 Cb 0.57 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.03 1i7x h ARG 200 CO -0.22 0.19 0.43 1.15 -1.51 0.00 0.00 179.97 180.00 1i7x h THR 201 N 0.29 1.21 -0.16 0.20 2.02 -0.20 -1.94 112.91 114.33 1i7x h THR 201 Ca 0.33 -0.49 0.00 0.00 0.77 0.00 0.00 66.41 67.01 1i7x h THR 201 Cb 0.48 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 1i7x h THR 201 CO -0.40 0.23 0.10 -0.03 0.37 0.00 0.00 175.52 175.79 1i7x h MET 202 N 1.00 0.22 -0.01 6.66 1.85 0.71 0.49 114.93 125.85 1i7x h MET 202 Ca 0.26 -0.02 -0.17 0.00 -0.61 0.00 0.00 59.70 59.17 1i7x h MET 202 Cb -0.01 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 31.96 1i7x h MET 202 CO -0.05 0.17 -0.76 -0.56 -0.40 0.00 0.00 176.91 175.31 1i7x h GLN 203 N 0.20 0.08 0.00 0.39 3.07 -1.19 -3.29 115.11 114.38 1i7x h GLN 203 Ca 0.06 -0.08 -0.05 0.00 0.09 0.00 0.00 58.65 58.67 1i7x h GLN 203 Cb 0.01 0.02 -0.01 0.00 0.08 0.00 0.00 27.48 27.58 1i7x h GLN 203 CO -0.01 0.81 -1.23 0.09 0.09 0.00 0.00 178.83 178.57 1i7x n ASN 204 N -3.68 0.76 -4.68 0.06 3.02 -0.74 -4.97 115.26 105.02 1i7x n ASN 204 Ca -0.02 0.31 -0.32 0.00 -0.03 0.00 0.00 54.58 54.52 1i7x n ASN 204 Cb 0.73 0.52 0.15 0.00 -0.61 0.00 0.00 39.78 40.57 1i7x n ASN 204 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1i7x s THR 205 N -3.24 2.06 0.00 3.41 -1.32 0.16 -4.97 115.64 111.74 1i7x s THR 205 Ca -0.02 0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 1i7x s THR 205 Cb 0.10 -2.19 0.00 0.00 -1.51 0.00 0.00 72.50 68.90 1i7x s THR 205 CO 0.81 -0.02 0.40 0.59 -2.21 0.00 0.00 174.62 174.18 1i7x n ASN 206 N -3.88 0.68 -4.63 8.08 5.03 -1.26 -4.97 115.26 114.31 1i7x n ASN 206 Ca 0.12 -1.14 -0.41 0.00 0.87 0.00 0.00 54.58 54.03 1i7x n ASN 206 Cb 0.51 0.00 -0.05 0.00 -1.02 0.00 0.00 39.78 39.22 1i7x n ASN 206 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1i7x s ASP 207 N -0.14 6.68 0.56 6.41 -1.08 -1.26 -4.89 116.67 122.94 1i7x s ASP 207 Ca 0.00 0.78 0.25 0.00 -0.52 0.00 0.00 52.55 53.05 1i7x s ASP 207 Cb 0.00 -2.39 1.50 0.00 -1.46 0.00 0.00 42.92 40.57 1i7x s ASP 207 CO 0.00 -0.50 2.09 -0.37 0.52 0.00 0.00 175.17 176.91 1i7x h VAL 208 N 5.48 0.67 0.11 1.11 -1.51 -1.98 0.37 116.25 120.50 1i7x h VAL 208 Ca -0.25 0.00 -0.19 0.00 -1.23 0.00 0.00 66.70 65.03 1i7x h VAL 208 Cb 1.10 0.86 0.02 0.00 -2.13 0.00 0.00 31.29 31.14 1i7x h VAL 208 CO 0.84 0.00 -0.82 -0.33 -1.23 0.00 0.00 177.57 176.03 1i7x h GLU 209 N 0.00 0.36 -0.80 5.19 4.39 -1.98 -1.71 114.58 120.03 1i7x h GLU 209 Ca 0.11 -0.53 -0.04 0.00 0.34 0.00 0.00 59.36 59.23 1i7x h GLU 209 Cb 0.48 0.19 -0.04 0.00 -0.10 0.00 0.00 28.75 29.28 1i7x h GLU 209 CO -0.00 1.22 0.32 1.15 -1.16 0.00 0.00 179.01 180.55 1i7x h THR 210 N -0.24 1.26 0.66 1.13 2.02 -1.55 0.33 112.91 116.53 1i7x h THR 210 Ca -0.13 -0.81 -0.03 0.00 0.77 0.00 0.00 66.41 66.21 1i7x h THR 210 Cb 1.60 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 68.31 1i7x h THR 210 CO 0.16 0.33 -0.46 0.00 0.37 0.00 0.00 175.52 175.92 1i7x h ALA 211 N 1.17 -1.22 -0.88 6.16 0.00 -0.38 0.32 119.26 124.44 1i7x h ALA 211 Ca 0.27 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 55.08 1i7x h ALA 211 Cb 0.21 0.61 -0.09 0.00 0.00 0.00 0.00 17.79 18.52 1i7x h ALA 211 CO -0.02 -1.19 0.50 0.07 0.00 0.00 0.00 179.25 178.60 1i7x h ARG 212 N -1.07 0.73 0.69 0.00 0.11 -1.00 0.86 114.38 114.70 1i7x h ARG 212 Ca -0.09 -0.04 -0.03 0.00 0.10 0.00 0.00 59.98 59.91 1i7x h ARG 212 Cb 0.87 -0.17 0.01 0.00 1.11 0.00 0.00 29.97 31.80 1i7x h ARG 212 CO 0.05 0.49 -0.33 0.00 0.10 0.00 0.00 179.97 180.28 1i7x h THR 214 N -1.22 0.92 0.19 0.00 1.35 -0.25 0.56 112.91 114.46 1i7x h THR 214 Ca -0.09 -0.29 -0.01 0.00 -0.55 0.00 0.00 66.41 65.47 1i7x h THR 214 Cb 0.71 0.01 0.00 0.00 -1.73 0.00 0.00 68.15 67.14 1i7x h THR 214 CO 0.16 0.15 -0.09 0.00 -0.25 0.00 0.00 175.52 175.49 1i7x h ALA 215 N 1.57 -0.26 -0.07 6.62 0.00 -0.80 -1.58 119.26 124.75 1i7x h ALA 215 Ca 0.44 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.25 1i7x h ALA 215 Cb 0.52 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.38 1i7x h ALA 215 CO -0.20 -0.55 -0.11 0.78 0.00 0.00 0.00 179.25 179.17 1i7x h GLY 216 N -0.44 -0.07 -0.44 0.00 0.00 0.29 -1.30 103.07 101.11 1i7x h GLY 216 Ca -0.03 0.14 0.13 0.00 0.00 0.00 0.00 47.33 47.57 1i7x h GLY 216 CO 0.04 -0.12 -0.24 -0.84 0.00 0.00 0.00 176.54 175.38 1i7x h THR 217 N -0.16 0.23 -1.00 4.70 2.02 0.22 0.43 112.91 119.35 1i7x h THR 217 Ca 0.07 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.26 1i7x h THR 217 Cb 0.25 0.23 -0.05 0.00 -1.74 0.00 0.00 68.15 66.84 1i7x h THR 217 CO -0.16 0.00 0.66 -0.07 0.37 0.00 0.00 175.52 176.32 1i7x h LEU 218 N -0.06 1.14 0.73 2.58 3.38 -0.70 -0.94 115.31 121.43 1i7x h LEU 218 Ca 0.30 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.21 1i7x h LEU 218 Cb 0.54 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.02 1i7x h LEU 218 CO -0.72 0.81 -0.35 -0.74 0.09 0.00 0.00 178.44 177.53 1i7x h HIS 219 N 1.33 -0.91 -1.13 1.13 2.76 0.78 0.37 115.15 119.49 1i7x h HIS 219 Ca 0.38 -0.02 0.32 0.00 -2.20 0.00 0.00 60.37 58.85 1i7x h HIS 219 Cb -0.11 0.30 -0.11 0.00 1.55 0.00 0.00 27.41 29.05 1i7x h HIS 219 CO -0.00 -0.57 0.72 -0.91 -1.30 0.00 0.00 177.93 175.88 1i7x h ASN 220 N -0.99 0.38 -0.18 3.26 -0.26 -0.33 0.59 115.58 118.06 1i7x h ASN 220 Ca -0.10 0.10 -0.19 0.00 -0.56 0.00 0.00 56.30 55.55 1i7x h ASN 220 Cb 0.75 0.05 0.00 0.00 -1.06 0.00 0.00 38.32 38.07 1i7x h ASN 220 CO 0.16 -0.01 -0.62 -0.07 -1.06 0.00 0.00 177.43 175.84 1i7x h LEU 221 N 0.29 0.90 0.00 1.61 3.38 -0.70 -3.25 115.31 117.53 1i7x h LEU 221 Ca 0.67 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1i7x h LEU 221 Cb 1.86 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 42.35 1i7x h LEU 221 CO -0.34 1.30 0.00 -1.54 0.09 0.00 0.00 178.44 177.95 1i7x n SER 222 N -3.97 0.00 -0.08 -0.43 3.41 0.21 -2.19 113.62 110.57 1i7x n SER 222 Ca -0.05 0.01 0.13 0.00 -0.26 0.00 0.00 58.87 58.69 1i7x n SER 222 Cb 0.66 -0.01 0.36 0.00 -0.26 0.00 0.00 64.21 64.96 1i7x n SER 222 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1i7x n HIS 223 N -1.01 0.00 -4.58 7.33 8.25 -1.22 -4.70 115.22 119.30 1i7x n HIS 223 Ca 0.00 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.16 1i7x n HIS 223 Cb 0.00 -0.23 -0.13 0.00 1.12 0.00 0.00 29.99 30.75 1i7x n HIS 223 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1i7x s HIS 224 N -2.81 2.38 0.51 4.41 3.76 -0.93 -5.03 115.29 117.57 1i7x s HIS 224 Ca 0.17 -0.36 0.16 0.00 -0.15 0.00 0.00 55.06 54.87 1i7x s HIS 224 Cb 0.18 -1.34 1.23 0.00 1.11 0.00 0.00 32.58 33.77 1i7x s HIS 224 CO 0.61 0.27 2.13 -0.09 -0.85 0.00 0.00 174.74 176.81 1i7x h ARG 225 N 4.23 0.07 -0.05 1.40 2.43 -1.88 -0.44 114.38 120.14 1i7x h ARG 225 Ca -0.49 -0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.51 1i7x h ARG 225 Cb 1.16 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.68 1i7x h ARG 225 CO 0.42 0.05 -0.70 0.93 -1.51 0.00 0.00 179.97 179.16 1i7x h GLU 226 N 0.07 0.25 -0.46 0.20 3.07 -1.93 -1.75 114.58 114.04 1i7x h GLU 226 Ca 0.04 -0.20 -0.07 0.00 -0.50 0.00 0.00 59.36 58.63 1i7x h GLU 226 Cb 0.07 0.04 -0.02 0.00 -0.84 0.00 0.00 28.75 28.01 1i7x h GLU 226 CO -0.01 0.85 0.01 0.78 -1.40 0.00 0.00 179.01 179.25 1i7x h GLY 227 N 1.55 0.87 1.00 -3.84 0.00 -1.28 0.37 103.07 101.74 1i7x h GLY 227 Ca -0.02 -0.63 -0.05 0.00 0.00 0.00 0.00 47.33 46.63 1i7x h GLY 227 CO 0.11 0.58 -0.44 1.41 0.00 0.00 0.00 176.54 178.20 1i7x h LEU 228 N 0.65 -1.05 -1.59 3.11 3.38 -1.18 0.30 115.31 118.93 1i7x h LEU 228 Ca 0.13 0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.25 1i7x h LEU 228 Cb 0.49 0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.46 1i7x h LEU 228 CO 0.02 -0.74 0.45 0.25 0.09 0.00 0.00 178.44 178.51 1i7x h LEU 229 N -1.25 0.40 0.25 1.67 5.85 -1.26 0.28 115.31 121.25 1i7x h LEU 229 Ca -0.13 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 1i7x h LEU 229 Cb 0.95 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1i7x h LEU 229 CO 0.21 0.23 -0.12 0.00 -0.34 0.00 0.00 178.44 178.41 1i7x h ALA 230 N 1.67 -0.72 -1.17 1.25 0.00 0.10 -0.67 119.26 119.71 1i7x h ALA 230 Ca 0.32 -0.07 0.35 0.00 0.00 0.00 0.00 54.91 55.51 1i7x h ALA 230 Cb 0.66 0.13 -0.12 0.00 0.00 0.00 0.00 17.79 18.46 1i7x h ALA 230 CO -0.10 -0.70 0.74 0.82 0.00 0.00 0.00 179.25 180.02 1i7x h ILE 231 N -0.49 0.30 0.48 0.00 2.04 0.03 -1.47 117.51 118.41 1i7x h ILE 231 Ca -0.03 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.72 1i7x h ILE 231 Cb 0.26 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 1i7x h ILE 231 CO 0.06 0.04 -0.23 0.15 0.00 0.00 0.00 178.15 178.17 1i7x h PHE 232 N 0.23 -0.60 -0.14 1.37 3.57 -0.38 0.45 116.94 121.44 1i7x h PHE 232 Ca 0.72 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 62.25 1i7x h PHE 232 Cb 2.04 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 40.98 1i7x h PHE 232 CO -0.00 -0.37 0.22 0.87 -2.23 0.00 0.00 178.31 176.80 1i7x h LYS 233 N -0.93 0.00 -0.73 1.11 1.57 -0.18 -1.95 116.57 115.46 1i7x h LYS 233 Ca -0.07 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.58 1i7x h LYS 233 Cb 0.50 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.72 1i7x h LYS 233 CO 0.11 0.00 0.17 -1.13 -0.57 0.00 0.00 179.45 178.03 1i7x n SER 234 N -3.51 4.86 -3.09 0.86 3.41 -0.64 -4.93 113.62 110.57 1i7x n SER 234 Ca 0.01 -3.03 -0.20 0.00 -0.26 0.00 0.00 58.87 55.39 1i7x n SER 234 Cb 0.33 -0.71 0.07 0.00 -0.26 0.00 0.00 64.21 63.64 1i7x n SER 234 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i7x n GLY 235 N 0.12 -0.31 0.08 5.00 0.00 -0.73 -4.78 105.19 104.56 1i7x n GLY 235 Ca 0.34 0.11 -0.10 0.00 0.00 0.00 0.00 46.02 46.37 1i7x n GLY 235 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i7x h GLY 236 N -2.26 0.10 0.40 -0.02 0.00 -1.04 -3.32 103.07 96.92 1i7x h GLY 236 Ca -0.48 -0.26 0.03 0.00 0.00 0.00 0.00 47.33 46.62 1i7x h GLY 236 CO 0.47 0.23 -0.26 -2.22 0.00 0.00 0.00 176.54 174.76 1i7x h ILE 237 N 0.02 0.41 -0.76 2.60 2.04 -1.86 0.57 117.51 120.53 1i7x h ILE 237 Ca -0.06 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.86 1i7x h ILE 237 Cb 1.84 0.41 -0.06 0.00 -0.74 0.00 0.00 36.82 38.27 1i7x h ILE 237 CO 0.15 0.00 0.45 -0.65 0.00 0.00 0.00 178.15 178.10 1i7x h PRO 238 N -0.40 0.80 0.08 2.37 0.11 -1.90 0.50 132.00 133.57 1i7x h PRO 238 Ca 0.06 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.12 1i7x h PRO 238 Cb 0.48 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.42 1i7x h PRO 238 CO -0.23 0.53 -0.04 0.00 -0.21 0.00 0.00 178.00 178.05 1i7x h ALA 239 N 1.38 -0.11 -0.25 -0.75 0.00 -1.49 -0.01 119.26 118.04 1i7x h ALA 239 Ca 0.34 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.24 1i7x h ALA 239 Cb 0.18 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.95 1i7x h ALA 239 CO -0.18 -0.52 -0.16 -0.07 0.00 0.00 0.00 179.25 178.32 1i7x h LEU 240 N -0.19 -0.52 -0.52 0.00 3.38 0.94 -0.92 115.31 117.48 1i7x h LEU 240 Ca -0.01 0.11 0.10 0.00 0.09 0.00 0.00 57.88 58.17 1i7x h LEU 240 Cb 0.16 0.27 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 1i7x h LEU 240 CO 0.02 -0.20 0.04 0.58 0.09 0.00 0.00 178.44 178.97 1i7x h VAL 241 N -0.14 0.63 -1.00 1.22 2.07 0.28 0.27 116.25 119.58 1i7x h VAL 241 Ca 0.14 -0.05 0.10 0.00 0.82 0.00 0.00 66.70 67.71 1i7x h VAL 241 Cb 0.35 0.46 -0.08 0.00 -1.52 0.00 0.00 31.29 30.50 1i7x h VAL 241 CO -0.34 0.03 0.63 0.50 0.02 0.00 0.00 177.57 178.41 1i7x h LYS 242 N 0.16 1.01 0.00 1.57 3.64 0.07 0.42 116.57 123.44 1i7x h LYS 242 Ca 0.26 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1i7x h LYS 242 Cb 0.39 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1i7x h LYS 242 CO -0.40 0.66 -0.01 0.52 -2.27 0.00 0.00 179.45 177.95 1i7x h MET 243 N 1.04 0.00 0.00 1.90 2.86 0.33 -0.51 114.93 120.55 1i7x h MET 243 Ca 0.48 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.12 1i7x h MET 243 Cb 0.40 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.06 1i7x h MET 243 CO -0.24 0.01 0.00 1.28 1.06 0.00 0.00 176.91 179.02 1i7x n LEU 244 N -4.05 0.00 -1.07 1.22 4.77 0.14 0.07 117.00 118.08 1i7x n LEU 244 Ca -0.03 0.10 0.10 0.00 -0.03 0.00 0.00 56.01 56.14 1i7x n LEU 244 Cb 0.10 -0.10 0.24 0.00 -2.33 0.00 0.00 43.42 41.33 1i7x n LEU 244 CO 0.30 -0.08 0.70 0.61 -1.33 0.00 0.00 177.39 177.59 1i7x n GLY 245 N -0.77 2.31 3.80 -0.72 0.00 -0.20 -4.93 105.19 104.67 1i7x n GLY 245 Ca 0.03 -0.64 -0.34 0.00 0.00 0.00 0.00 46.02 45.07 1i7x n GLY 245 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1i7x s SER 246 N -1.09 6.53 0.00 1.61 0.15 0.11 -4.94 113.70 116.07 1i7x s SER 246 Ca 0.38 1.91 0.25 0.00 0.70 0.00 0.00 55.95 59.19 1i7x s SER 246 Cb 0.20 -2.56 0.43 0.00 -1.71 0.00 0.00 66.02 62.38 1i7x s SER 246 CO 0.27 -0.65 1.36 -0.81 1.20 0.00 0.00 173.24 174.61 1i7x n PRO 247 N -0.72 0.03 -2.71 5.44 -0.04 -1.26 -4.77 135.00 130.97 1i7x n PRO 247 Ca 0.08 -0.02 -0.42 0.00 -0.04 0.00 0.00 63.50 63.10 1i7x n PRO 247 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 1i7x n PRO 247 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1i7x s VAL 248 N -2.98 4.10 0.20 0.52 1.01 -1.26 -4.93 120.40 117.05 1i7x s VAL 248 Ca 0.11 0.25 -0.16 0.00 0.00 0.00 0.00 61.98 62.18 1i7x s VAL 248 Cb 0.17 -4.73 0.19 0.00 0.00 0.00 0.00 36.38 32.01 1i7x s VAL 248 CO 0.71 -1.48 1.62 0.44 0.00 0.00 0.00 175.10 176.39 1i7x h ASP 249 N 9.64 -0.76 -0.60 3.32 3.32 -2.00 0.40 116.42 129.75 1i7x h ASP 249 Ca -0.27 0.20 0.12 0.00 0.02 0.00 0.00 57.03 57.10 1i7x h ASP 249 Cb 1.06 0.44 -0.11 0.00 0.22 0.00 0.00 39.33 40.94 1i7x h ASP 249 CO 1.19 -0.24 -0.07 0.77 -1.72 0.00 0.00 179.24 179.17 1i7x h SER 250 N -0.07 -0.40 -0.01 6.45 4.64 -1.99 0.99 113.55 123.16 1i7x h SER 250 Ca 0.27 0.16 0.02 0.00 -0.47 0.00 0.00 61.79 61.77 1i7x h SER 250 Cb 0.49 0.31 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 1i7x h SER 250 CO -0.64 -0.15 -0.08 0.58 -0.87 0.00 0.00 176.83 175.67 1i7x h VAL 251 N 0.06 0.79 -0.23 0.95 2.07 -1.32 -1.61 116.25 116.96 1i7x h VAL 251 Ca 0.30 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.88 1i7x h VAL 251 Cb 0.48 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 1i7x h VAL 251 CO -0.56 0.00 -0.17 -0.07 0.02 0.00 0.00 177.57 176.79 1i7x h LEU 252 N -0.14 -0.55 -0.46 2.57 3.38 -0.09 0.16 115.31 120.19 1i7x h LEU 252 Ca 0.04 0.11 0.08 0.00 0.09 0.00 0.00 57.88 58.20 1i7x h LEU 252 Cb 0.18 0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.14 1i7x h LEU 252 CO -0.09 -0.21 0.07 0.15 0.09 0.00 0.00 178.44 178.45 1i7x h PHE 253 N -0.16 0.11 0.56 1.13 3.57 -0.52 0.38 116.94 122.01 1i7x h PHE 253 Ca 0.13 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.63 1i7x h PHE 253 Cb 0.36 0.02 0.01 0.00 2.79 0.00 0.00 35.95 39.13 1i7x h PHE 253 CO -0.33 -0.02 -0.27 1.88 -2.23 0.00 0.00 178.31 177.33 1i7x h TYR 254 N 0.20 -0.70 -0.08 0.41 0.99 -0.46 -1.54 116.97 115.79 1i7x h TYR 254 Ca 0.23 -0.02 0.04 0.00 2.00 0.00 0.00 58.73 60.98 1i7x h TYR 254 Cb 0.31 0.23 -0.06 0.00 1.00 0.00 0.00 36.73 38.21 1i7x h TYR 254 CO -0.24 -0.43 -0.40 0.00 -0.00 0.00 0.00 178.16 177.10 1i7x h ALA 255 N -0.33 -0.57 -0.57 3.88 0.00 -0.31 0.31 119.26 121.67 1i7x h ALA 255 Ca -0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1i7x h ALA 255 Cb 0.59 0.73 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 1i7x h ALA 255 CO 0.13 -0.91 0.30 0.97 0.00 0.00 0.00 179.25 179.74 1i7x h ILE 256 N -0.50 1.18 -0.33 0.00 6.09 -0.94 -1.25 117.51 121.75 1i7x h ILE 256 Ca 0.07 -0.46 -0.15 0.00 -1.37 0.00 0.00 64.86 62.95 1i7x h ILE 256 Cb 0.62 0.42 -0.00 0.00 0.47 0.00 0.00 36.82 38.33 1i7x h ILE 256 CO -0.36 0.20 -0.40 0.74 -3.07 0.00 0.00 178.15 175.26 1i7x h THR 257 N 0.79 1.28 0.53 2.19 2.02 -0.36 0.16 112.91 119.51 1i7x h THR 257 Ca 0.20 -1.58 -0.02 0.00 0.77 0.00 0.00 66.41 65.78 1i7x h THR 257 Cb 0.04 1.51 -0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1i7x h THR 257 CO -0.03 0.52 -0.31 0.74 0.37 0.00 0.00 175.52 176.80 1i7x h THR 258 N 0.64 0.36 -0.72 3.16 2.02 -0.05 -1.83 112.91 116.50 1i7x h THR 258 Ca 0.04 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.36 1i7x h THR 258 Cb 0.99 0.36 -0.10 0.00 -1.74 0.00 0.00 68.15 67.66 1i7x h THR 258 CO 0.10 0.00 0.24 -0.07 0.37 0.00 0.00 175.52 176.15 1i7x h LEU 259 N -0.79 0.16 -0.00 2.58 3.38 -1.20 -0.47 115.31 118.96 1i7x h LEU 259 Ca -0.06 0.12 0.03 0.00 0.09 0.00 0.00 57.88 58.06 1i7x h LEU 259 Cb 0.64 0.12 -0.05 0.00 0.09 0.00 0.00 40.66 41.47 1i7x h LEU 259 CO 0.07 0.05 -0.27 -0.74 0.09 0.00 0.00 178.44 177.64 1i7x h HIS 260 N 0.36 -0.73 -0.83 1.13 2.76 -0.56 0.27 115.15 117.55 1i7x h HIS 260 Ca 0.39 0.02 0.10 0.00 -2.20 0.00 0.00 60.37 58.69 1i7x h HIS 260 Cb 0.61 0.32 -0.08 0.00 1.55 0.00 0.00 27.41 29.81 1i7x h HIS 260 CO -0.20 -0.36 0.47 -0.91 -1.30 0.00 0.00 177.93 175.63 1i7x h ASN 261 N -0.41 0.66 -0.54 3.26 2.35 -0.46 -0.01 115.58 120.43 1i7x h ASN 261 Ca 0.06 0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1i7x h ASN 261 Cb 0.50 -0.07 -0.03 0.00 0.05 0.00 0.00 38.32 38.77 1i7x h ASN 261 CO -0.24 0.36 0.32 -0.07 -1.65 0.00 0.00 177.43 176.16 1i7x h LEU 262 N 0.77 0.65 -0.38 1.61 3.38 0.08 0.16 115.31 121.58 1i7x h LEU 262 Ca 0.41 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.31 1i7x h LEU 262 Cb 0.42 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1i7x h LEU 262 CO -0.27 0.52 0.18 -0.07 0.09 0.00 0.00 178.44 178.89 1i7x h LEU 263 N 0.72 0.51 -0.63 1.67 3.38 0.87 0.44 115.31 122.27 1i7x h LEU 263 Ca 0.19 -0.14 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 1i7x h LEU 263 Cb -0.01 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1i7x h LEU 263 CO -0.04 0.50 -0.36 -0.07 0.09 0.00 0.00 178.44 178.56 1i7x h LEU 264 N 0.48 0.71 0.00 1.67 3.38 -0.80 -3.40 115.31 117.35 1i7x h LEU 264 Ca 0.13 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1i7x h LEU 264 Cb 0.13 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.69 1i7x h LEU 264 CO -0.02 1.00 -0.68 1.41 0.09 0.00 0.00 178.44 180.25 1i7x n HIS 265 N -4.05 0.00 -3.35 1.13 8.25 0.54 -5.00 115.22 112.73 1i7x n HIS 265 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 1i7x n HIS 265 Cb 0.50 -0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.52 1i7x n HIS 265 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1i7x s GLN 266 N -1.69 3.56 0.00 -0.41 2.00 0.15 -5.03 119.66 118.25 1i7x s GLN 266 Ca -0.00 -0.36 -0.32 0.00 -2.00 0.00 0.00 55.36 52.69 1i7x s GLN 266 Cb 0.00 -3.81 -0.10 0.00 0.80 0.00 0.00 33.01 29.90 1i7x s GLN 266 CO 0.01 -0.57 1.93 -1.91 -0.50 0.00 0.00 175.29 174.26 1i7x n GLU 267 N 5.49 2.64 -0.01 1.67 4.07 -1.26 -1.33 120.64 131.90 1i7x n GLU 267 Ca -0.08 0.97 0.00 0.00 -0.06 0.00 0.00 57.16 57.99 1i7x n GLU 267 Cb 0.49 -2.88 0.00 0.00 -0.06 0.00 0.00 31.44 28.99 1i7x n GLU 267 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1i7x n GLY 268 N 4.47 0.20 0.35 8.31 0.00 -1.26 -4.96 105.19 112.30 1i7x n GLY 268 Ca 0.21 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.18 1i7x n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i7x h ALA 269 N 0.00 1.09 0.86 4.61 0.00 -1.47 -2.77 119.26 121.58 1i7x h ALA 269 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1i7x h ALA 269 Cb 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1i7x h ALA 269 CO 0.00 0.65 -0.46 0.87 0.00 0.00 0.00 179.25 180.31 1i7x h LYS 270 N 1.20 -1.17 -0.40 0.00 1.57 -1.87 -0.15 116.57 115.77 1i7x h LYS 270 Ca 0.29 0.08 0.08 0.00 -1.87 0.00 0.00 60.65 59.23 1i7x h LYS 270 Cb 0.11 0.27 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1i7x h LYS 270 CO -0.04 -0.78 0.27 1.98 -0.57 0.00 0.00 179.45 180.32 1i7x h MET 271 N -1.21 0.19 -0.43 3.15 4.05 -1.98 -0.52 114.93 118.18 1i7x h MET 271 Ca -0.12 -0.01 -0.08 0.00 -0.28 0.00 0.00 59.70 59.21 1i7x h MET 271 Cb 0.95 -0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.69 1i7x h MET 271 CO 0.16 0.12 -0.05 0.00 0.23 0.00 0.00 176.91 177.38 1i7x h ALA 272 N 1.80 0.58 -0.05 0.39 0.00 -1.16 -1.38 119.26 119.43 1i7x h ALA 272 Ca 0.18 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1i7x h ALA 272 Cb 0.47 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1i7x h ALA 272 CO -0.03 0.42 -0.35 0.28 0.00 0.00 0.00 179.25 179.57 1i7x h VAL 273 N 0.62 1.27 -0.24 0.00 2.07 0.48 -1.53 116.25 118.92 1i7x h VAL 273 Ca 0.12 -1.28 -0.09 0.00 0.82 0.00 0.00 66.70 66.27 1i7x h VAL 273 Cb 0.56 1.62 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 1i7x h VAL 273 CO 0.03 0.37 -0.22 0.03 0.02 0.00 0.00 177.57 177.81 1i7x h ARG 274 N 0.09 0.56 -0.48 1.57 3.08 -0.90 -1.91 114.38 116.40 1i7x h ARG 274 Ca 0.01 -0.29 -0.07 0.00 0.07 0.00 0.00 59.98 59.70 1i7x h ARG 274 Cb 0.66 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.70 1i7x h ARG 274 CO 0.05 0.88 0.02 -0.07 -1.07 0.00 0.00 179.97 179.78 1i7x h LEU 275 N 0.27 0.74 -0.90 3.04 3.38 -0.95 -2.53 115.31 118.35 1i7x h LEU 275 Ca 0.04 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1i7x h LEU 275 Cb 0.76 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1i7x h LEU 275 CO 0.05 0.79 0.00 0.00 0.09 0.00 0.00 178.44 179.38 1i7x h ALA 276 N 1.30 1.00 0.00 1.53 0.00 -1.24 -3.46 119.26 118.38 1i7x h ALA 276 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1i7x h ALA 276 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1i7x h ALA 276 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 1i7x n GLY 277 N -0.15 0.90 0.35 0.00 0.00 -0.95 -4.94 105.19 100.39 1i7x n GLY 277 Ca 0.01 -0.49 -0.00 0.00 0.00 0.00 0.00 46.02 45.54 1i7x n GLY 277 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i7x h GLY 278 N 0.00 1.08 0.18 -0.02 0.00 -1.55 -3.25 103.07 99.51 1i7x h GLY 278 Ca 0.00 -0.44 0.10 0.00 0.00 0.00 0.00 47.33 46.99 1i7x h GLY 278 CO 0.00 0.42 0.03 1.41 0.00 0.00 0.00 176.54 178.40 1i7x h LEU 279 N 1.03 -0.17 -0.26 3.11 3.38 -1.89 0.24 115.31 120.75 1i7x h LEU 279 Ca 0.27 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.36 1i7x h LEU 279 Cb -0.06 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1i7x h LEU 279 CO -0.05 -0.06 0.15 -0.61 0.09 0.00 0.00 178.44 177.96 1i7x h GLN 280 N 0.14 0.36 -0.22 1.13 4.15 -1.89 0.37 115.11 119.14 1i7x h GLN 280 Ca 0.26 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.62 1i7x h GLN 280 Cb 0.40 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1i7x h GLN 280 CO -0.41 0.29 0.01 0.87 -1.93 0.00 0.00 178.83 177.66 1i7x h LYS 281 N 0.32 0.32 -0.12 1.69 1.57 -1.46 -1.36 116.57 117.53 1i7x h LYS 281 Ca 0.09 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.69 1i7x h LYS 281 Cb 0.03 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1i7x h LYS 281 CO -0.02 0.34 -0.46 0.52 -0.57 0.00 0.00 179.45 179.27 1i7x h MET 282 N 0.32 0.53 -0.38 3.15 2.86 0.17 -2.64 114.93 118.93 1i7x h MET 282 Ca 0.08 -0.40 -0.05 0.00 -2.06 0.00 0.00 59.70 57.26 1i7x h MET 282 Cb 0.20 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.92 1i7x h MET 282 CO 0.00 1.03 0.03 0.28 1.06 0.00 0.00 176.91 179.31 1i7x h VAL 283 N 0.14 1.20 0.00 -2.22 2.07 -0.69 -1.17 116.25 115.57 1i7x h VAL 283 Ca -0.02 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.69 1i7x h VAL 283 Cb 1.09 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1i7x h VAL 283 CO 0.10 0.27 -0.15 0.00 0.02 0.00 0.00 177.57 177.81 1i7x h ALA 284 N 1.47 1.59 0.00 1.67 0.00 -1.18 -1.49 119.26 121.32 1i7x h ALA 284 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1i7x h ALA 284 Cb 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1i7x h ALA 284 CO 0.01 0.19 0.00 -0.07 0.00 0.00 0.00 179.25 179.37 1i7x h LEU 285 N 0.00 0.00 0.00 0.00 3.38 -0.84 -3.03 115.31 114.82 1i7x h LEU 285 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i7x h LEU 285 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1i7x h LEU 285 CO 0.02 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.73 1i7x n LEU 286 N -2.52 0.00 0.22 1.67 4.77 -0.56 -0.27 117.00 120.30 1i7x n LEU 286 Ca 0.04 0.38 0.15 0.00 -0.03 0.00 0.00 56.01 56.54 1i7x n LEU 286 Cb 0.38 -0.38 0.51 0.00 -2.33 0.00 0.00 43.42 41.59 1i7x n LEU 286 CO 0.28 -0.36 0.92 -1.13 -1.33 0.00 0.00 177.39 175.76 1i7x h ASN 287 N 0.00 0.00 -3.36 -1.43 -1.24 -1.71 -3.46 115.58 104.38 1i7x h ASN 287 Ca 0.00 0.00 -0.41 0.00 0.71 0.00 0.00 56.30 56.60 1i7x h ASN 287 Cb 0.02 0.00 0.20 0.00 0.73 0.00 0.00 38.32 39.27 1i7x h ASN 287 CO 0.00 0.00 0.04 -0.54 -1.29 0.00 0.00 177.43 175.64 1i7x s LYS 288 N -3.44 -1.63 0.00 6.67 -0.14 0.62 -5.03 119.74 116.80 1i7x s LYS 288 Ca 0.04 0.13 0.00 0.00 -1.36 0.00 0.00 55.97 54.78 1i7x s LYS 288 Cb 0.08 -1.53 0.00 0.00 -1.68 0.00 0.00 37.83 34.70 1i7x s LYS 288 CO 0.55 -4.02 0.24 0.25 -0.76 0.00 0.00 175.35 171.61 1i7x n THR 289 N -5.02 0.00 -2.73 2.17 -2.24 -1.26 -4.98 114.28 100.22 1i7x n THR 289 Ca 0.11 -0.31 -0.42 0.00 -2.27 0.00 0.00 64.05 61.16 1i7x n THR 289 Cb 0.59 1.31 -0.03 0.00 -2.10 0.00 0.00 70.33 70.09 1i7x n THR 289 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1i7x s ASN 290 N -0.13 6.26 0.24 3.42 3.84 -1.26 -4.92 114.94 122.39 1i7x s ASN 290 Ca 0.00 -0.49 -0.13 0.00 0.21 0.00 0.00 52.86 52.45 1i7x s ASN 290 Cb 0.00 -2.48 0.33 0.00 -0.55 0.00 0.00 41.25 38.54 1i7x s ASN 290 CO 0.00 -1.49 1.57 -0.37 -2.79 0.00 0.00 177.10 174.02 1i7x h VAL 291 N 6.03 0.08 -0.22 -5.21 -1.51 -1.98 0.33 116.25 113.77 1i7x h VAL 291 Ca -0.27 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.19 1i7x h VAL 291 Cb 1.06 0.08 -0.01 0.00 -2.13 0.00 0.00 31.29 30.29 1i7x h VAL 291 CO 1.18 0.00 0.12 0.11 -1.23 0.00 0.00 177.57 177.75 1i7x h LYS 292 N -0.02 0.29 0.40 5.19 1.57 -1.99 0.31 116.57 122.31 1i7x h LYS 292 Ca 0.39 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.13 1i7x h LYS 292 Cb 0.63 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.88 1i7x h LYS 292 CO -0.92 0.22 -0.19 0.35 -0.57 0.00 0.00 179.45 178.34 1i7x h PHE 293 N 0.30 -0.49 -0.98 -1.35 3.57 -0.81 -2.93 116.94 114.24 1i7x h PHE 293 Ca 0.08 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 61.75 1i7x h PHE 293 Cb 0.01 0.16 -0.11 0.00 2.79 0.00 0.00 35.95 38.81 1i7x h PHE 293 CO 0.00 -0.16 0.58 -0.07 -2.23 0.00 0.00 178.31 176.42 1i7x h LEU 294 N -0.94 0.73 0.37 0.59 3.38 -0.68 -0.24 115.31 118.52 1i7x h LEU 294 Ca -0.05 0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1i7x h LEU 294 Cb 0.55 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.24 1i7x h LEU 294 CO 0.09 0.25 -0.52 0.00 0.09 0.00 0.00 178.44 178.36 1i7x h ALA 295 N 1.64 -1.09 0.22 1.53 0.00 -0.36 0.11 119.26 121.30 1i7x h ALA 295 Ca 0.56 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.32 1i7x h ALA 295 Cb 0.88 0.80 -0.04 0.00 0.00 0.00 0.00 17.79 19.42 1i7x h ALA 295 CO -0.39 -1.17 -0.51 0.82 0.00 0.00 0.00 179.25 178.01 1i7x h ILE 296 N -0.92 0.03 -0.58 0.00 1.08 -1.04 -2.13 117.51 113.95 1i7x h ILE 296 Ca -0.04 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.50 1i7x h ILE 296 Cb 0.84 0.03 -0.10 0.00 -3.07 0.00 0.00 36.82 34.52 1i7x h ILE 296 CO -0.15 0.00 -0.50 0.74 -0.69 0.00 0.00 178.15 177.55 1i7x h THR 297 N -0.81 0.04 -0.93 -0.27 2.02 -0.87 0.73 112.91 112.83 1i7x h THR 297 Ca -0.02 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.25 1i7x h THR 297 Cb 0.78 0.04 -0.07 0.00 -1.74 0.00 0.00 68.15 67.16 1i7x h THR 297 CO -0.22 0.00 0.58 0.71 0.37 0.00 0.00 175.52 176.95 1i7x h THR 298 N -0.26 0.98 -0.23 3.16 1.35 -0.65 0.17 112.91 117.43 1i7x h THR 298 Ca 0.14 -0.34 -0.04 0.00 -0.55 0.00 0.00 66.41 65.62 1i7x h THR 298 Cb 0.56 -0.09 -0.01 0.00 -1.73 0.00 0.00 68.15 66.87 1i7x h THR 298 CO -0.69 0.18 -0.04 -0.78 -0.25 0.00 0.00 175.52 173.93 1i7x h ASP 299 N 0.99 0.33 0.13 5.36 3.58 -0.34 0.84 116.42 127.30 1i7x h ASP 299 Ca 0.43 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.82 1i7x h ASP 299 Cb 0.32 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.28 1i7x h ASP 299 CO -0.22 0.42 -0.06 0.00 -2.88 0.00 0.00 179.24 176.50 1i7x h LEU 301 N -0.51 0.04 -0.02 0.00 3.38 0.28 -0.61 115.31 117.88 1i7x h LEU 301 Ca -0.02 0.13 -0.00 0.00 0.09 0.00 0.00 57.88 58.08 1i7x h LEU 301 Cb 0.41 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 1i7x h LEU 301 CO 0.03 -0.00 0.01 -0.61 0.09 0.00 0.00 178.44 177.96 1i7x h GLN 302 N 0.29 0.02 -0.93 1.13 -0.00 0.86 -0.62 115.11 115.86 1i7x h GLN 302 Ca 0.38 -0.00 0.09 0.00 -0.00 0.00 0.00 58.65 59.12 1i7x h GLN 302 Cb 0.62 -0.00 -0.07 0.00 0.00 0.00 0.00 27.48 28.02 1i7x h GLN 302 CO -0.46 0.09 0.58 0.82 0.00 0.00 0.00 178.83 179.85 1i7x h ILE 303 N -0.05 0.98 0.00 2.39 2.04 0.44 -0.69 117.51 122.62 1i7x h ILE 303 Ca 0.01 -0.34 -0.11 0.00 1.00 0.00 0.00 64.86 65.42 1i7x h ILE 303 Cb 0.07 -0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 36.05 1i7x h ILE 303 CO -0.00 0.18 -0.53 -0.07 0.00 0.00 0.00 178.15 177.73 1i7x h LEU 304 N 0.98 0.00 0.11 1.44 3.38 -1.05 -3.33 115.31 116.84 1i7x h LEU 304 Ca 0.43 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 58.10 1i7x h LEU 304 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1i7x h LEU 304 CO -0.22 0.53 -1.50 0.00 0.09 0.00 0.00 178.44 177.34 1i7x h ALA 305 N 1.47 0.27 -1.40 1.53 0.00 -0.40 -3.42 119.26 117.31 1i7x h ALA 305 Ca -0.01 -1.09 -0.76 0.00 0.00 0.00 0.00 54.91 53.05 1i7x h ALA 305 Cb 1.39 0.25 0.02 0.00 0.00 0.00 0.00 17.79 19.45 1i7x h ALA 305 CO 0.07 1.14 0.70 0.98 0.00 0.00 0.00 179.25 182.13 1i7x n TYR 306 N -3.45 1.76 -1.22 0.00 9.36 -0.33 -0.97 117.16 122.32 1i7x n TYR 306 Ca -0.15 0.74 -0.10 0.00 3.32 0.00 0.00 57.90 61.71 1i7x n TYR 306 Cb 1.04 -2.35 -0.04 0.00 -0.63 0.00 0.00 39.34 37.36 1i7x n TYR 306 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1i7x n GLY 307 N 3.60 0.93 3.05 2.98 0.00 -1.26 -4.95 105.19 109.55 1i7x n GLY 307 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 1i7x n GLY 307 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1i7x s ASN 308 N -2.17 3.93 0.01 1.61 3.84 -0.14 -5.02 114.94 117.00 1i7x s ASN 308 Ca 0.00 -1.13 -0.25 0.00 0.21 0.00 0.00 52.86 51.68 1i7x s ASN 308 Cb 0.00 -1.43 -0.17 0.00 -0.55 0.00 0.00 41.25 39.10 1i7x s ASN 308 CO 0.00 -0.15 1.27 1.56 -2.79 0.00 0.00 177.10 176.99 1i7x h GLN 309 N 7.86 -0.37 -0.85 0.43 4.20 -1.93 -1.52 115.11 122.93 1i7x h GLN 309 Ca -0.26 0.03 0.19 0.00 0.06 0.00 0.00 58.65 58.67 1i7x h GLN 309 Cb 1.07 0.08 -0.11 0.00 0.30 0.00 0.00 27.48 28.82 1i7x h GLN 309 CO 0.49 -0.06 0.35 0.93 -0.67 0.00 0.00 178.83 179.88 1i7x h GLU 310 N -0.71 0.40 0.38 1.46 3.07 -1.97 0.32 114.58 117.53 1i7x h GLU 310 Ca -0.04 -0.02 -0.02 0.00 -0.50 0.00 0.00 59.36 58.78 1i7x h GLU 310 Cb 0.48 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 1i7x h GLU 310 CO 0.06 0.27 -0.18 0.77 -1.40 0.00 0.00 179.01 178.53 1i7x h SER 311 N 0.42 -0.43 -0.81 1.42 0.02 -1.86 0.12 113.55 112.42 1i7x h SER 311 Ca 0.51 -0.09 0.17 0.00 -0.84 0.00 0.00 61.79 61.54 1i7x h SER 311 Cb 0.90 0.11 -0.11 0.00 0.14 0.00 0.00 62.40 63.44 1i7x h SER 311 CO -0.49 -0.16 0.32 0.11 -1.14 0.00 0.00 176.83 175.47 1i7x h LYS 312 N -0.71 0.40 0.23 3.45 1.57 -0.14 0.21 116.57 121.57 1i7x h LYS 312 Ca -0.05 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1i7x h LYS 312 Cb 0.50 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.72 1i7x h LYS 312 CO 0.09 0.26 -0.11 -0.07 -0.57 0.00 0.00 179.45 179.05 1i7x h LEU 313 N 0.41 -0.26 -0.90 2.94 3.38 -0.17 -1.64 115.31 119.07 1i7x h LEU 313 Ca 0.47 -0.09 0.08 0.00 0.09 0.00 0.00 57.88 58.44 1i7x h LEU 313 Cb 0.80 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.55 1i7x h LEU 313 CO -0.47 -0.07 0.55 0.40 0.09 0.00 0.00 178.44 178.95 1i7x h ILE 314 N -0.44 0.98 -0.69 1.22 2.04 0.70 0.43 117.51 121.75 1i7x h ILE 314 Ca -0.03 -0.33 0.04 0.00 1.00 0.00 0.00 64.86 65.54 1i7x h ILE 314 Cb 0.33 -0.05 -0.05 0.00 -0.74 0.00 0.00 36.82 36.31 1i7x h ILE 314 CO 0.05 0.17 0.41 0.40 0.00 0.00 0.00 178.15 179.19 1i7x h ILE 315 N 0.95 1.04 0.10 -0.67 2.04 -0.47 0.18 117.51 120.67 1i7x h ILE 315 Ca 0.42 -0.27 -0.00 0.00 1.00 0.00 0.00 64.86 66.00 1i7x h ILE 315 Cb 0.30 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 1i7x h ILE 315 CO -0.22 0.14 -0.05 0.25 0.00 0.00 0.00 178.15 178.28 1i7x h LEU 316 N 0.79 -0.11 -2.03 1.44 5.85 -0.01 0.11 115.31 121.35 1i7x h LEU 316 Ca 0.29 -0.11 0.06 0.00 0.84 0.00 0.00 57.88 58.95 1i7x h LEU 316 Cb 0.09 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1i7x h LEU 316 CO -0.14 0.05 0.15 0.00 -0.34 0.00 0.00 178.44 178.16 1i7x h ALA 317 N 0.63 2.15 -0.41 1.25 0.00 0.23 -1.08 119.26 122.03 1i7x h ALA 317 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1i7x h ALA 317 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1i7x h ALA 317 CO 0.02 -0.25 0.00 0.43 0.00 0.00 0.00 179.25 179.45 1i7x n SER 318 N -4.41 3.30 -0.88 0.00 7.64 0.01 -4.90 113.62 114.38 1i7x n SER 318 Ca 0.02 -2.31 -0.07 0.00 1.01 0.00 0.00 58.87 57.51 1i7x n SER 318 Cb 0.29 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 1i7x n SER 318 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i7x n GLY 319 N 0.79 0.12 0.13 0.23 0.00 -0.41 -4.84 105.19 101.21 1i7x n GLY 319 Ca 0.17 -0.57 -0.12 0.00 0.00 0.00 0.00 46.02 45.49 1i7x n GLY 319 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i7x h GLY 320 N -0.10 -0.17 -0.37 -0.02 0.00 -0.92 -2.65 103.07 98.84 1i7x h GLY 320 Ca -0.17 0.10 0.12 0.00 0.00 0.00 0.00 47.33 47.38 1i7x h GLY 320 CO 0.20 -0.09 -0.25 -2.55 0.00 0.00 0.00 176.54 173.84 1i7x h PRO 321 N -0.19 -0.09 -0.70 4.80 0.11 -1.87 0.49 132.00 134.55 1i7x h PRO 321 Ca 0.01 0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.10 1i7x h PRO 321 Cb 0.19 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.29 1i7x h PRO 321 CO -0.03 -0.06 0.35 0.37 -0.21 0.00 0.00 178.00 178.42 1i7x h GLN 322 N -0.09 0.99 -0.02 1.05 5.75 -1.89 0.18 115.11 121.08 1i7x h GLN 322 Ca 0.27 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.64 1i7x h GLN 322 Cb 0.52 -0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.89 1i7x h GLN 322 CO -0.68 0.76 -0.02 0.00 -2.65 0.00 0.00 178.83 176.24 1i7x h ALA 323 N 1.39 0.03 -0.12 3.38 0.00 -0.60 -2.09 119.26 121.25 1i7x h ALA 323 Ca 0.25 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1i7x h ALA 323 Cb 0.08 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1i7x h ALA 323 CO -0.03 -0.19 -0.04 -0.07 0.00 0.00 0.00 179.25 178.91 1i7x h LEU 324 N -0.46 -0.15 -0.03 0.00 3.38 0.13 -1.76 115.31 116.42 1i7x h LEU 324 Ca 0.00 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.05 1i7x h LEU 324 Cb 0.55 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.34 1i7x h LEU 324 CO 0.01 -0.06 -0.27 0.58 0.09 0.00 0.00 178.44 178.78 1i7x h VAL 325 N -0.02 0.38 -0.84 1.22 2.07 -0.69 -1.15 116.25 117.22 1i7x h VAL 325 Ca 0.06 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.78 1i7x h VAL 325 Cb 0.11 0.38 -0.12 0.00 -1.52 0.00 0.00 31.29 30.14 1i7x h VAL 325 CO -0.13 0.00 0.27 0.78 0.02 0.00 0.00 177.57 178.50 1i7x h ASN 326 N -0.40 0.12 0.32 0.57 -0.26 -0.94 0.28 115.58 115.25 1i7x h ASN 326 Ca 0.07 0.16 -0.00 0.00 -0.56 0.00 0.00 56.30 55.97 1i7x h ASN 326 Cb 0.50 0.20 -0.02 0.00 -1.06 0.00 0.00 38.32 37.94 1i7x h ASN 326 CO -0.26 -0.06 -0.29 0.40 -1.06 0.00 0.00 177.43 176.16 1i7x h ILE 327 N 0.30 0.39 -1.11 2.81 2.04 -0.37 -1.29 117.51 120.28 1i7x h ILE 327 Ca 0.51 0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.67 1i7x h ILE 327 Cb 0.95 0.39 -0.10 0.00 -0.74 0.00 0.00 36.82 37.32 1i7x h ILE 327 CO -0.56 0.00 0.72 0.24 0.00 0.00 0.00 178.15 178.55 1i7x h MET 328 N -0.63 0.29 -0.02 2.37 2.86 0.42 0.11 114.93 120.34 1i7x h MET 328 Ca -0.02 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1i7x h MET 328 Cb 0.56 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.16 1i7x h MET 328 CO -0.04 0.19 -0.10 2.89 1.06 0.00 0.00 176.91 180.91 1i7x n ARG 329 N -4.62 1.74 -0.05 1.72 1.85 -0.55 -4.63 116.66 112.11 1i7x n ARG 329 Ca 0.28 -1.27 -0.12 0.00 -1.00 0.00 0.00 57.85 55.75 1i7x n ARG 329 Cb 1.02 -1.47 -0.04 0.00 -1.05 0.00 0.00 32.46 30.92 1i7x n ARG 329 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1i7x n THR 330 N 0.47 0.60 -2.57 8.89 -1.04 0.33 -5.08 114.28 115.88 1i7x n THR 330 Ca 0.15 -0.15 -0.25 0.00 -2.04 0.00 0.00 64.05 61.76 1i7x n THR 330 Cb 0.46 -1.64 0.03 0.00 -1.82 0.00 0.00 70.33 67.36 1i7x n THR 330 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1i7x s TYR 331 N -2.20 3.14 -0.01 -1.42 1.51 -0.80 -5.03 117.35 112.55 1i7x s TYR 331 Ca -0.15 0.40 0.01 0.00 -1.01 0.00 0.00 57.07 56.32 1i7x s TYR 331 Cb 0.06 -2.68 0.01 0.00 -0.11 0.00 0.00 41.96 39.24 1i7x s TYR 331 CO 0.19 -0.78 0.83 0.25 -1.11 0.00 0.00 175.55 174.93 1i7x n THR 332 N -2.45 0.66 -2.56 -0.71 -2.24 -1.26 -4.90 114.28 100.81 1i7x n THR 332 Ca 0.05 -0.67 -0.41 0.00 -2.27 0.00 0.00 64.05 60.74 1i7x n THR 332 Cb 0.58 0.65 -0.03 0.00 -2.10 0.00 0.00 70.33 69.43 1i7x n THR 332 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1i7x s TYR 333 N -0.70 2.34 0.02 4.78 5.04 -1.26 -4.92 117.35 122.65 1i7x s TYR 333 Ca 0.01 -0.22 -0.04 0.00 -2.44 0.00 0.00 57.07 54.39 1i7x s TYR 333 Cb 0.01 -4.63 -0.01 0.00 0.35 0.00 0.00 41.96 37.68 1i7x s TYR 333 CO 0.00 -2.04 0.45 -1.91 -1.34 0.00 0.00 175.55 170.71 1i7x n GLU 334 N 9.23 -0.05 -0.28 4.97 0.00 -1.26 0.24 120.64 133.49 1i7x n GLU 334 Ca 0.09 0.44 0.05 0.00 0.00 0.00 0.00 57.16 57.74 1i7x n GLU 334 Cb 0.49 -0.66 0.14 0.00 0.00 0.00 0.00 31.44 31.41 1i7x n GLU 334 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.13 176.91 1i7x h LYS 335 N 0.00 0.03 0.43 5.31 3.64 -1.99 0.17 116.57 124.15 1i7x h LYS 335 Ca 0.02 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1i7x h LYS 335 Cb 0.05 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1i7x h LYS 335 CO -0.11 0.02 -0.21 1.25 -2.27 0.00 0.00 179.45 178.14 1i7x h LEU 336 N 0.03 -0.49 -0.73 5.20 5.85 -0.54 -1.10 115.31 123.53 1i7x h LEU 336 Ca 0.42 -0.02 0.11 0.00 0.84 0.00 0.00 57.88 59.24 1i7x h LEU 336 Cb 0.71 0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.79 1i7x h LEU 336 CO -0.80 -0.30 0.34 -0.07 -0.34 0.00 0.00 178.44 177.27 1i7x h LEU 337 N -0.63 0.42 0.23 2.25 3.38 -0.38 0.23 115.31 120.81 1i7x h LEU 337 Ca -0.06 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1i7x h LEU 337 Cb 0.47 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1i7x h LEU 337 CO 0.10 0.22 -0.11 -0.25 0.09 0.00 0.00 178.44 178.48 1i7x h TRP 338 N 0.56 -0.29 -0.26 1.13 7.01 -0.62 -1.43 115.95 122.06 1i7x h TRP 338 Ca 0.37 -0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.41 1i7x h TRP 338 Cb 0.46 0.10 -0.04 0.00 -2.10 0.00 0.00 29.16 27.57 1i7x h TRP 338 CO -0.12 -0.09 -0.01 1.15 -2.79 0.00 0.00 178.44 176.58 1i7x h THR 339 N -0.43 0.80 -0.96 2.65 2.02 -0.61 -0.49 112.91 115.89 1i7x h THR 339 Ca -0.03 -0.02 0.06 0.00 0.77 0.00 0.00 66.41 67.19 1i7x h THR 339 Cb 0.33 0.73 -0.07 0.00 -1.74 0.00 0.00 68.15 67.40 1i7x h THR 339 CO 0.05 0.01 0.62 0.74 0.37 0.00 0.00 175.52 177.31 1i7x h THR 340 N 0.07 1.07 -0.20 3.16 2.02 -0.48 -0.51 112.91 118.05 1i7x h THR 340 Ca 0.12 -0.38 -0.09 0.00 0.77 0.00 0.00 66.41 66.83 1i7x h THR 340 Cb 0.16 -0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 66.42 1i7x h THR 340 CO -0.22 0.20 -0.26 0.77 0.37 0.00 0.00 175.52 176.39 1i7x h SER 341 N 1.12 0.37 0.18 4.18 4.64 -0.48 -0.64 113.55 122.92 1i7x h SER 341 Ca 0.42 -0.12 -0.07 0.00 -0.47 0.00 0.00 61.79 61.55 1i7x h SER 341 Cb 0.17 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1i7x h SER 341 CO -0.17 0.63 -0.28 0.03 -0.87 0.00 0.00 176.83 176.17 1i7x h ARG 342 N 0.33 0.17 0.17 4.77 3.08 0.45 0.36 114.38 123.71 1i7x h ARG 342 Ca 0.05 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1i7x h ARG 342 Cb 0.63 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.67 1i7x h ARG 342 CO 0.05 0.44 -0.08 0.28 -1.07 0.00 0.00 179.97 179.58 1i7x h VAL 343 N 0.15 0.94 -0.66 2.04 2.07 -0.49 -2.05 116.25 118.25 1i7x h VAL 343 Ca 0.02 -0.94 0.11 0.00 0.82 0.00 0.00 66.70 66.71 1i7x h VAL 343 Cb 0.57 1.47 -0.08 0.00 -1.52 0.00 0.00 31.29 31.73 1i7x h VAL 343 CO 0.04 0.20 0.25 -0.07 0.02 0.00 0.00 177.57 178.01 1i7x h LEU 344 N -0.72 0.24 -0.49 2.57 3.38 -0.86 0.20 115.31 119.64 1i7x h LEU 344 Ca -0.02 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.10 1i7x h LEU 344 Cb 0.51 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 1i7x h LEU 344 CO 0.04 0.13 0.17 0.50 0.09 0.00 0.00 178.44 179.37 1i7x h LYS 345 N 0.43 0.34 -0.45 1.13 3.64 -0.26 0.35 116.57 121.75 1i7x h LYS 345 Ca 0.34 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.65 1i7x h LYS 345 Cb 0.45 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1i7x h LYS 345 CO -0.33 0.23 0.09 0.28 -2.27 0.00 0.00 179.45 177.44 1i7x h VAL 346 N 0.35 1.21 -0.00 2.00 2.07 -0.34 -2.52 116.25 119.02 1i7x h VAL 346 Ca 0.23 -0.76 -0.18 0.00 0.82 0.00 0.00 66.70 66.81 1i7x h VAL 346 Cb 0.24 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1i7x h VAL 346 CO -0.23 0.27 -0.83 -0.07 0.02 0.00 0.00 177.57 176.73 1i7x h LEU 347 N 0.66 0.18 -1.98 2.57 3.38 0.05 -3.28 115.31 116.88 1i7x h LEU 347 Ca 0.15 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i7x h LEU 347 Cb 0.28 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.98 1i7x h LEU 347 CO 0.00 0.93 0.02 0.77 0.09 0.00 0.00 178.44 180.25 1i7x h SER 348 N 0.08 0.00 0.68 -0.43 4.64 0.13 0.25 113.55 118.89 1i7x h SER 348 Ca -0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1i7x h SER 348 Cb 1.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.53 1i7x h SER 348 CO 0.12 0.00 -0.29 1.33 -0.87 0.00 0.00 176.83 177.12 1i7x n VAL 349 N -2.55 0.00 -2.76 0.95 0.24 -1.24 -4.58 118.33 108.39 1i7x n VAL 349 Ca -0.02 -0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.86 1i7x n VAL 349 Cb 0.07 -0.04 -0.04 0.00 -1.47 0.00 0.00 33.84 32.35 1i7x n VAL 349 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1i7x h SER 351 N 5.95 0.00 0.49 0.00 4.64 -1.88 -1.62 113.55 121.12 1i7x h SER 351 Ca -0.42 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.62 1i7x h SER 351 Cb 1.21 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.25 1i7x h SER 351 CO 0.73 0.18 -1.71 -1.20 -0.87 0.00 0.00 176.83 173.95 1i7x n SER 352 N -4.01 0.79 0.08 4.97 7.64 -1.26 -4.19 113.62 117.63 1i7x n SER 352 Ca -0.02 0.37 -0.14 0.00 1.01 0.00 0.00 58.87 60.09 1i7x n SER 352 Cb 0.26 0.08 -0.14 0.00 -1.01 0.00 0.00 64.21 63.41 1i7x n SER 352 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1i7x h ASN 353 N 0.00 0.30 -0.02 6.43 4.21 -1.77 -3.33 115.58 121.39 1i7x h ASN 353 Ca -0.28 -0.34 0.00 0.00 1.21 0.00 0.00 56.30 56.89 1i7x h ASN 353 Cb 1.94 -0.10 -0.00 0.00 -1.12 0.00 0.00 38.32 39.04 1i7x h ASN 353 CO 0.07 1.27 -0.02 0.50 -1.29 0.00 0.00 177.43 177.96 1i7x h LYS 354 N 0.05 -0.00 -0.73 0.81 3.64 -1.46 0.32 116.57 119.19 1i7x h LYS 354 Ca -0.13 0.00 0.11 0.00 -1.27 0.00 0.00 60.65 59.36 1i7x h LYS 354 Cb 1.93 0.00 -0.08 0.00 -0.41 0.00 0.00 32.23 33.68 1i7x h LYS 354 CO 0.17 -0.00 0.34 -1.00 -2.27 0.00 0.00 179.45 176.69 1i7x h PRO 355 N -0.00 0.53 -0.22 1.90 0.13 -1.77 -1.92 132.00 130.65 1i7x h PRO 355 Ca 0.00 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 65.16 1i7x h PRO 355 Cb 0.01 -0.12 -0.06 0.00 0.13 0.00 0.00 31.00 30.97 1i7x h PRO 355 CO -0.02 0.35 -0.15 0.00 -0.23 0.00 0.00 178.00 177.95 1i7x h ALA 356 N 1.47 0.01 -0.98 -0.56 0.00 -1.28 0.22 119.26 118.14 1i7x h ALA 356 Ca 0.37 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.38 1i7x h ALA 356 Cb 0.46 0.33 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 1i7x h ALA 356 CO -0.32 -0.57 0.65 0.82 0.00 0.00 0.00 179.25 179.84 1i7x h ILE 357 N -0.14 1.25 0.82 0.00 2.04 0.20 0.27 117.51 121.95 1i7x h ILE 357 Ca 0.12 -0.46 -0.04 0.00 1.00 0.00 0.00 64.86 65.49 1i7x h ILE 357 Cb 0.33 -0.20 0.01 0.00 -0.74 0.00 0.00 36.82 36.22 1i7x h ILE 357 CO -0.30 0.24 -0.39 0.58 0.00 0.00 0.00 178.15 178.27 1i7x h VAL 358 N 1.33 0.10 -0.34 1.67 2.07 -0.62 0.28 116.25 120.74 1i7x h VAL 358 Ca 0.36 -0.12 0.10 0.00 0.82 0.00 0.00 66.70 67.86 1i7x h VAL 358 Cb -0.15 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.73 1i7x h VAL 358 CO -0.08 0.01 0.35 -0.33 0.02 0.00 0.00 177.57 177.53 1i7x h GLU 359 N -1.21 0.00 -0.00 1.57 4.39 -0.22 0.47 114.58 119.58 1i7x h GLU 359 Ca -0.11 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.59 1i7x h GLU 359 Cb 0.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1i7x h GLU 359 CO 0.19 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 178.04 1i7x n ALA 360 N -2.37 2.65 -0.66 3.43 0.00 0.91 -4.85 120.51 119.63 1i7x n ALA 360 Ca 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1i7x n ALA 360 Cb 0.51 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1i7x n ALA 360 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i7x n GLY 361 N 0.94 0.60 0.36 0.00 0.00 0.17 -4.92 105.19 102.33 1i7x n GLY 361 Ca 0.20 -0.68 0.03 0.00 0.00 0.00 0.00 46.02 45.57 1i7x n GLY 361 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i7x h GLY 362 N 0.00 1.50 0.50 -0.02 0.00 -0.36 -2.13 103.07 102.56 1i7x h GLY 362 Ca 0.00 -0.45 0.02 0.00 0.00 0.00 0.00 47.33 46.90 1i7x h GLY 362 CO 0.00 0.30 -0.28 -0.33 0.00 0.00 0.00 176.54 176.23 1i7x h MET 363 N 1.12 -0.46 -0.38 4.80 2.86 -1.79 -0.48 114.93 120.59 1i7x h MET 363 Ca 0.43 0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 58.05 1i7x h MET 363 Cb 0.21 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.96 1i7x h MET 363 CO -0.19 -0.31 0.03 1.96 1.06 0.00 0.00 176.91 179.47 1i7x h GLN 364 N -0.48 0.65 0.22 1.72 7.50 -1.88 -0.40 115.11 122.43 1i7x h GLN 364 Ca 0.03 -0.19 0.01 0.00 0.50 0.00 0.00 58.65 59.00 1i7x h GLN 364 Cb 0.52 -0.07 -0.02 0.00 0.05 0.00 0.00 27.48 27.96 1i7x h GLN 364 CO -0.17 0.72 -0.24 0.00 -1.50 0.00 0.00 178.83 177.64 1i7x h ALA 365 N 0.90 -0.48 -0.92 3.87 0.00 -1.31 -1.40 119.26 119.92 1i7x h ALA 365 Ca 0.11 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 55.06 1i7x h ALA 365 Cb 0.41 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.48 1i7x h ALA 365 CO 0.01 -0.80 0.59 -0.07 0.00 0.00 0.00 179.25 178.98 1i7x h LEU 366 N -0.50 0.83 -0.76 0.00 3.38 -1.00 -1.65 115.31 115.62 1i7x h LEU 366 Ca 0.00 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.07 1i7x h LEU 366 Cb 0.47 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 1i7x h LEU 366 CO -0.07 0.48 0.44 1.23 0.09 0.00 0.00 178.44 180.61 1i7x h GLY 367 N 0.92 1.15 0.40 0.83 0.00 -0.02 -2.72 103.07 103.63 1i7x h GLY 367 Ca 0.43 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1i7x h GLY 367 CO -0.19 0.17 0.74 1.41 0.00 0.00 0.00 176.54 178.67 1i7x h LEU 368 N 0.79 0.00 -2.60 3.11 3.38 -0.51 -1.29 115.31 118.18 1i7x h LEU 368 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1i7x h LEU 368 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1i7x h LEU 368 CO -0.20 0.00 0.00 1.41 0.09 0.00 0.00 178.44 179.74 1i7x n HIS 369 N -2.38 0.28 0.32 1.13 8.25 -1.02 -4.63 115.22 117.16 1i7x n HIS 369 Ca -0.01 -0.40 0.03 0.00 -0.26 0.00 0.00 57.72 57.08 1i7x n HIS 369 Cb 0.75 -0.03 0.17 0.00 1.12 0.00 0.00 29.99 32.00 1i7x n HIS 369 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1i7x n LEU 370 N 0.31 0.00 -0.00 2.41 4.77 -0.49 -1.84 117.00 122.15 1i7x n LEU 370 Ca 0.08 0.27 0.05 0.00 -0.03 0.00 0.00 56.01 56.38 1i7x n LEU 370 Cb 0.35 -0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 41.11 1i7x n LEU 370 CO 0.06 -0.21 -0.19 0.41 -1.33 0.00 0.00 177.39 176.13 1i7x n THR 371 N -1.27 0.00 -1.51 -5.08 -1.04 -1.26 -4.97 114.28 99.15 1i7x n THR 371 Ca 0.03 -0.25 -0.39 0.00 -2.04 0.00 0.00 64.05 61.40 1i7x n THR 371 Cb 0.05 0.80 0.03 0.00 -1.82 0.00 0.00 70.33 69.39 1i7x n THR 371 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 1i7x n ASP 372 N -1.41 -0.44 0.14 8.00 2.03 -0.77 -4.87 116.55 119.23 1i7x n ASP 372 Ca 0.01 0.80 0.03 0.00 0.52 0.00 0.00 54.79 56.15 1i7x n ASP 372 Cb 0.19 -1.22 0.42 0.00 -0.72 0.00 0.00 41.12 39.79 1i7x n ASP 372 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1i7x h PRO 373 N 0.49 0.18 -6.12 -0.67 0.11 -1.96 -3.41 132.00 120.62 1i7x h PRO 373 Ca -0.45 -0.04 -0.55 0.00 0.11 0.00 0.00 66.00 65.07 1i7x h PRO 373 Cb 1.39 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.45 1i7x h PRO 373 CO 0.49 0.32 1.34 0.45 -0.21 0.00 0.00 178.00 180.39 1i7x s SER 374 N -6.91 5.57 0.40 -2.05 0.15 -1.26 -4.82 113.70 104.78 1i7x s SER 374 Ca -0.05 1.04 0.10 0.00 0.70 0.00 0.00 55.95 57.73 1i7x s SER 374 Cb 0.16 -2.52 0.82 0.00 -1.71 0.00 0.00 66.02 62.77 1i7x s SER 374 CO 0.72 -2.01 1.95 1.56 1.20 0.00 0.00 173.24 176.66 1i7x h GLN 375 N 14.12 0.25 -0.21 5.44 1.08 -2.00 -2.06 115.11 131.75 1i7x h GLN 375 Ca -0.31 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 56.75 1i7x h GLN 375 Cb 1.18 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.56 1i7x h GLN 375 CO 1.09 0.35 -0.26 0.07 -0.95 0.00 0.00 178.83 179.13 1i7x h ARG 376 N 0.24 0.39 0.04 1.46 0.11 -1.95 -0.06 114.38 114.61 1i7x h ARG 376 Ca 0.05 -0.14 -0.00 0.00 0.10 0.00 0.00 59.98 59.99 1i7x h ARG 376 Cb 0.30 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.36 1i7x h ARG 376 CO 0.01 0.62 -0.02 1.25 0.10 0.00 0.00 179.97 181.94 1i7x h LEU 377 N 0.35 -0.05 -0.11 0.08 5.85 -1.79 -2.72 115.31 116.92 1i7x h LEU 377 Ca 0.05 -0.35 0.03 0.00 0.84 0.00 0.00 57.88 58.45 1i7x h LEU 377 Cb 0.64 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.65 1i7x h LEU 377 CO 0.05 0.33 -0.11 0.58 -0.34 0.00 0.00 178.44 178.95 1i7x h VAL 378 N -0.44 0.70 -0.30 1.05 2.07 -1.16 -1.99 116.25 116.19 1i7x h VAL 378 Ca -0.01 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1i7x h VAL 378 Cb 0.40 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1i7x h VAL 378 CO 0.01 0.00 0.14 -0.61 0.02 0.00 0.00 177.57 177.13 1i7x h GLN 379 N -0.13 0.41 -0.07 1.57 5.75 -1.06 -0.44 115.11 121.14 1i7x h GLN 379 Ca 0.08 -0.04 -0.18 0.00 -0.15 0.00 0.00 58.65 58.36 1i7x h GLN 379 Cb 0.24 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1i7x h GLN 379 CO -0.19 0.32 -0.72 -0.91 -2.65 0.00 0.00 178.83 174.69 1i7x h ASN 380 N 0.41 0.40 -0.23 -0.69 -0.26 -1.12 -1.26 115.58 112.83 1i7x h ASN 380 Ca 0.11 -0.26 -0.10 0.00 -0.56 0.00 0.00 56.30 55.48 1i7x h ASN 380 Cb 0.05 -0.12 -0.00 0.00 -1.06 0.00 0.00 38.32 37.19 1i7x h ASN 380 CO -0.02 0.99 -0.25 0.00 -1.06 0.00 0.00 177.43 177.10 1i7x h LEU 382 N 0.28 0.38 0.17 0.00 3.38 -0.98 0.91 115.31 119.45 1i7x h LEU 382 Ca 0.04 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1i7x h LEU 382 Cb 0.80 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1i7x h LEU 382 CO 0.06 0.26 -0.08 -0.50 0.09 0.00 0.00 178.44 178.27 1i7x h TRP 383 N 0.50 -0.21 -0.62 1.13 6.55 -1.16 -0.17 115.95 121.97 1i7x h TRP 383 Ca 0.22 -0.01 0.04 0.00 0.95 0.00 0.00 58.89 60.09 1i7x h TRP 383 Cb 0.12 0.07 -0.04 0.00 -0.86 0.00 0.00 29.16 28.45 1i7x h TRP 383 CO -0.10 -0.08 0.37 1.15 -1.05 0.00 0.00 178.44 178.73 1i7x h THR 384 N -0.29 1.04 -1.00 1.49 2.02 -0.58 -1.17 112.91 114.41 1i7x h THR 384 Ca -0.02 -0.24 0.03 0.00 0.77 0.00 0.00 66.41 66.94 1i7x h THR 384 Cb 0.23 0.26 -0.06 0.00 -1.74 0.00 0.00 68.15 66.85 1i7x h THR 384 CO 0.04 0.13 0.66 -0.07 0.37 0.00 0.00 175.52 176.64 1i7x h LEU 385 N 0.71 1.10 -0.48 2.58 3.38 0.11 -1.42 115.31 121.29 1i7x h LEU 385 Ca 0.26 -0.01 -0.15 0.00 0.09 0.00 0.00 57.88 58.07 1i7x h LEU 385 Cb 0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1i7x h LEU 385 CO -0.13 0.76 -0.37 -0.09 0.09 0.00 0.00 178.44 178.71 1i7x h ARG 386 N 1.28 0.85 -0.39 1.13 2.43 -0.03 -0.77 114.38 118.88 1i7x h ARG 386 Ca 0.39 -0.43 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 1i7x h ARG 386 Cb -0.03 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 1i7x h ARG 386 CO -0.12 1.07 -0.09 -0.91 -1.51 0.00 0.00 179.97 178.42 1i7x h ASN 387 N 0.70 0.65 0.91 -3.80 2.35 -0.73 -2.83 115.58 112.83 1i7x h ASN 387 Ca 0.06 -0.17 -0.13 0.00 -0.55 0.00 0.00 56.30 55.51 1i7x h ASN 387 Cb 0.94 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 39.11 1i7x h ASN 387 CO 0.09 0.77 -0.62 -0.07 -1.65 0.00 0.00 177.43 175.95 1i7x h LEU 388 N 0.61 0.00 -0.96 1.61 3.38 -1.12 -3.38 115.31 115.46 1i7x h LEU 388 Ca 0.11 0.00 0.32 0.00 0.09 0.00 0.00 57.88 58.40 1i7x h LEU 388 Cb 0.51 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.09 1i7x h LEU 388 CO 0.03 0.62 0.22 -1.54 0.09 0.00 0.00 178.44 177.86 1i7x n SER 389 N -3.53 0.07 0.22 -0.43 3.41 -0.31 -0.55 113.62 112.50 1i7x n SER 389 Ca -0.00 1.61 0.07 0.00 -0.26 0.00 0.00 58.87 60.29 1i7x n SER 389 Cb 0.68 -0.67 0.49 0.00 -0.26 0.00 0.00 64.21 64.45 1i7x n SER 389 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 1i7x h ASP 390 N 0.00 0.00 -0.08 4.04 2.03 -1.77 -2.35 116.42 118.28 1i7x h ASP 390 Ca 0.68 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.98 1i7x h ASP 390 Cb 1.59 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.09 1i7x h ASP 390 CO -0.84 0.26 0.00 0.00 -1.03 0.00 0.00 179.24 177.64 1i7x n ALA 391 N -2.38 2.54 -1.33 4.15 0.00 0.29 -4.16 120.51 119.63 1i7x n ALA 391 Ca -0.02 -0.50 -0.00 0.00 0.00 0.00 0.00 53.44 52.92 1i7x n ALA 391 Cb 0.35 -1.11 0.21 0.00 0.00 0.00 0.00 19.45 18.90 1i7x n ALA 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i7x n ALA 392 N 0.32 3.88 0.23 0.00 0.00 -0.89 -4.68 120.51 119.38 1i7x n ALA 392 Ca 0.18 -2.93 0.12 0.00 0.00 0.00 0.00 53.44 50.81 1i7x n ALA 392 Cb 0.36 -0.70 0.37 0.00 0.00 0.00 0.00 19.45 19.48 1i7x n ALA 392 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1i7x h THR 393 N 1.12 0.17 -0.43 0.00 1.35 -1.72 -3.09 112.91 110.32 1i7x h THR 393 Ca 0.15 -0.98 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 1i7x h THR 393 Cb 1.56 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.82 1i7x h THR 393 CO 0.32 0.08 0.00 0.29 -0.25 0.00 0.00 175.52 175.96 1i7x n LYS 394 N -3.15 2.45 -2.19 4.72 5.02 -1.26 -4.70 118.16 119.05 1i7x n LYS 394 Ca 0.02 -2.25 -0.41 0.00 -2.02 0.00 0.00 58.31 53.66 1i7x n LYS 394 Cb 0.46 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 1i7x n LYS 394 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1i7x s GLN 395 N -1.27 4.42 0.45 1.97 -1.52 -1.17 -5.05 119.66 117.49 1i7x s GLN 395 Ca 0.37 2.13 0.08 0.00 -1.95 0.00 0.00 55.36 55.98 1i7x s GLN 395 Cb 0.21 -3.10 0.01 0.00 -0.22 0.00 0.00 33.01 29.91 1i7x s GLN 395 CO 0.28 -0.10 0.51 -1.21 -0.25 0.00 0.00 175.29 174.52 1i7x s GLU 396 N -1.68 2.59 -0.89 2.91 0.41 -1.26 -4.76 118.70 116.03 1i7x s GLU 396 Ca 0.48 -1.48 -0.05 0.00 -0.41 0.00 0.00 54.97 53.52 1i7x s GLU 396 Cb -0.38 -2.54 -0.01 0.00 -1.78 0.00 0.00 34.13 29.42 1i7x s GLU 396 CO 0.50 -0.34 0.74 0.41 -0.49 0.00 0.00 175.26 176.08 1i7x n GLY 397 N -1.77 -1.19 0.00 -1.39 0.00 -1.26 -4.95 105.19 94.62 1i7x n GLY 397 Ca 0.06 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.60 1i7x n GLY 397 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1i7x n MET 398 N -2.63 -0.52 -0.19 1.61 2.81 -1.26 -4.86 117.12 112.08 1i7x n MET 398 Ca -0.08 -0.54 -0.06 0.00 -1.81 0.00 0.00 57.70 55.21 1i7x n MET 398 Cb 0.57 -0.94 -0.05 0.00 -0.71 0.00 0.00 33.22 32.09 1i7x n MET 398 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1i7x h GLU 399 N 0.00 -0.03 -0.38 0.03 3.07 -1.97 0.45 114.58 115.74 1i7x h GLU 399 Ca 0.00 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 58.93 1i7x h GLU 399 Cb 0.11 0.01 -0.09 0.00 -0.84 0.00 0.00 28.75 27.94 1i7x h GLU 399 CO 0.00 -0.02 -0.46 0.78 -1.40 0.00 0.00 179.01 177.92 1i7x h GLY 400 N -0.03 -0.66 0.29 -3.84 0.00 -1.98 0.87 103.07 97.72 1i7x h GLY 400 Ca 0.07 0.58 0.00 0.00 0.00 0.00 0.00 47.33 47.99 1i7x h GLY 400 CO -0.45 -0.17 -0.52 -2.00 0.00 0.00 0.00 176.54 173.39 1i7x h LEU 401 N -0.36 -1.52 -1.43 3.11 5.85 -1.67 0.38 115.31 119.68 1i7x h LEU 401 Ca 0.12 0.14 0.26 0.00 0.84 0.00 0.00 57.88 59.25 1i7x h LEU 401 Cb 0.59 0.54 -0.09 0.00 0.37 0.00 0.00 40.66 42.07 1i7x h LEU 401 CO -0.57 -0.61 0.67 -0.07 -0.34 0.00 0.00 178.44 177.53 1i7x h LEU 402 N -0.87 0.41 0.24 2.25 3.38 0.53 0.68 115.31 121.92 1i7x h LEU 402 Ca -0.03 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1i7x h LEU 402 Cb 0.81 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.57 1i7x h LEU 402 CO -0.19 0.09 -0.11 1.23 0.09 0.00 0.00 178.44 179.54 1i7x h GLY 403 N 0.36 -0.33 0.73 0.83 0.00 0.32 -2.66 103.07 102.32 1i7x h GLY 403 Ca 0.58 0.12 0.04 0.00 0.00 0.00 0.00 47.33 48.07 1i7x h GLY 403 CO -0.26 -0.12 0.14 -0.84 0.00 0.00 0.00 176.54 175.46 1i7x h THR 404 N -0.71 0.92 -0.45 4.70 2.02 0.12 -2.21 112.91 117.31 1i7x h THR 404 Ca -0.03 -0.10 0.09 0.00 0.77 0.00 0.00 66.41 67.13 1i7x h THR 404 Cb 0.48 0.59 -0.09 0.00 -1.74 0.00 0.00 68.15 67.40 1i7x h THR 404 CO 0.05 0.06 -0.12 -0.07 0.37 0.00 0.00 175.52 175.81 1i7x h LEU 405 N 0.30 -0.44 -0.49 2.58 3.38 -0.99 0.14 115.31 119.79 1i7x h LEU 405 Ca 0.16 0.14 0.08 0.00 0.09 0.00 0.00 57.88 58.35 1i7x h LEU 405 Cb 0.12 0.29 -0.07 0.00 0.09 0.00 0.00 40.66 41.09 1i7x h LEU 405 CO -0.15 -0.16 0.12 0.58 0.09 0.00 0.00 178.44 178.93 1i7x h VAL 406 N -0.01 0.75 0.23 1.22 2.07 -1.04 -1.86 116.25 117.62 1i7x h VAL 406 Ca 0.22 -0.09 0.01 0.00 0.82 0.00 0.00 66.70 67.65 1i7x h VAL 406 Cb 0.34 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1i7x h VAL 406 CO -0.47 0.05 -0.28 1.56 0.02 0.00 0.00 177.57 178.45 1i7x h GLN 407 N 0.27 -0.54 -0.31 1.57 4.20 -0.55 -1.87 115.11 117.87 1i7x h GLN 407 Ca 0.25 0.04 0.09 0.00 0.06 0.00 0.00 58.65 59.08 1i7x h GLN 407 Cb 0.31 0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 1i7x h GLN 407 CO -0.30 -0.36 0.56 -0.07 -0.67 0.00 0.00 178.83 177.99 1i7x h LEU 408 N -0.56 0.00 -1.95 1.46 3.38 -0.02 0.25 115.31 117.86 1i7x h LEU 408 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i7x h LEU 408 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1i7x h LEU 408 CO -0.09 0.00 0.03 -0.07 0.09 0.00 0.00 178.44 178.40 1i7x h LEU 409 N 0.00 0.00 -2.81 1.67 3.38 -0.69 0.43 115.31 117.28 1i7x h LEU 409 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 1i7x h LEU 409 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1i7x h LEU 409 CO -0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1i7x n GLY 410 N -1.22 2.42 3.67 0.83 0.00 0.87 -4.78 105.19 106.98 1i7x n GLY 410 Ca -0.02 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 1i7x n GLY 410 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1i7x s SER 411 N -0.83 2.60 -0.12 1.61 0.15 0.14 -4.96 113.70 112.29 1i7x s SER 411 Ca 0.45 1.21 0.18 0.00 0.70 0.00 0.00 55.95 58.50 1i7x s SER 411 Cb 0.30 -1.88 -0.25 0.00 -1.71 0.00 0.00 66.02 62.47 1i7x s SER 411 CO 0.21 -3.15 0.31 0.47 1.20 0.00 0.00 173.24 172.29 1i7x n ASP 412 N -4.19 0.21 -4.65 5.45 8.00 -1.26 -4.87 116.55 115.25 1i7x n ASP 412 Ca 0.05 0.10 -0.43 0.00 0.71 0.00 0.00 54.79 55.22 1i7x n ASP 412 Cb 0.57 0.95 -0.02 0.00 -0.02 0.00 0.00 41.12 42.60 1i7x n ASP 412 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1i7x s ASP 413 N -5.41 6.73 0.21 -2.24 -1.08 -1.26 -4.91 116.67 108.71 1i7x s ASP 413 Ca -0.08 1.66 -0.09 0.00 -0.52 0.00 0.00 52.55 53.52 1i7x s ASP 413 Cb 0.08 -2.54 0.17 0.00 -1.46 0.00 0.00 42.92 39.17 1i7x s ASP 413 CO 0.84 -0.95 1.83 0.40 0.52 0.00 0.00 175.17 177.81 1i7x h ILE 414 N 5.73 1.24 -0.69 4.11 2.04 -1.99 -0.84 117.51 127.10 1i7x h ILE 414 Ca -0.30 -0.62 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1i7x h ILE 414 Cb 1.12 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 1i7x h ILE 414 CO 0.99 0.27 0.44 0.78 0.00 0.00 0.00 178.15 180.63 1i7x h ASN 415 N 1.12 0.82 0.69 1.72 -0.26 -1.99 0.24 115.58 117.92 1i7x h ASN 415 Ca 0.28 -0.04 -0.03 0.00 -0.56 0.00 0.00 56.30 55.94 1i7x h ASN 415 Cb 0.05 -0.20 0.01 0.00 -1.06 0.00 0.00 38.32 37.11 1i7x h ASN 415 CO -0.04 0.62 -0.33 0.58 -1.06 0.00 0.00 177.43 177.19 1i7x h VAL 416 N 0.94 0.23 -0.37 2.81 2.07 -1.84 -1.79 116.25 118.31 1i7x h VAL 416 Ca 0.25 -0.19 0.08 0.00 0.82 0.00 0.00 66.70 67.66 1i7x h VAL 416 Cb -0.07 0.28 -0.08 0.00 -1.52 0.00 0.00 31.29 29.91 1i7x h VAL 416 CO -0.05 0.02 -0.14 0.58 0.02 0.00 0.00 177.57 178.00 1i7x h VAL 417 N -1.07 0.53 -0.06 2.57 2.07 -0.99 -0.27 116.25 119.02 1i7x h VAL 417 Ca -0.09 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.45 1i7x h VAL 417 Cb 0.74 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 1i7x h VAL 417 CO 0.16 0.00 -0.53 0.74 0.02 0.00 0.00 177.57 177.96 1i7x h THR 418 N -0.07 0.01 -0.73 2.57 2.02 -0.45 0.23 112.91 116.49 1i7x h THR 418 Ca 0.18 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.48 1i7x h THR 418 Cb 0.35 0.01 -0.08 0.00 -1.74 0.00 0.00 68.15 66.69 1i7x h THR 418 CO -0.41 0.00 0.32 0.00 0.37 0.00 0.00 175.52 175.80 1i7x h ALA 420 N 1.49 0.34 -0.66 0.00 0.00 -0.05 0.24 119.26 120.62 1i7x h ALA 420 Ca 0.38 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.27 1i7x h ALA 420 Cb 0.51 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1i7x h ALA 420 CO -0.34 -0.23 0.33 0.00 0.00 0.00 0.00 179.25 179.01 1i7x h ALA 421 N 1.13 0.85 -0.01 0.00 0.00 0.72 -0.59 119.26 121.37 1i7x h ALA 421 Ca 0.11 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1i7x h ALA 421 Cb 0.01 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1i7x h ALA 421 CO -0.06 0.41 0.01 0.78 0.00 0.00 0.00 179.25 180.38 1i7x h GLY 422 N 0.92 0.02 0.68 0.00 0.00 0.09 -0.63 103.07 104.14 1i7x h GLY 422 Ca 0.23 -0.01 0.01 0.00 0.00 0.00 0.00 47.33 47.57 1i7x h GLY 422 CO -0.03 0.01 -0.18 -2.22 0.00 0.00 0.00 176.54 174.12 1i7x h ILE 423 N -0.09 0.59 -0.94 2.60 2.04 -0.30 -2.01 117.51 119.41 1i7x h ILE 423 Ca 0.00 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.98 1i7x h ILE 423 Cb 0.11 0.59 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 1i7x h ILE 423 CO -0.00 0.00 0.60 -0.07 0.00 0.00 0.00 178.15 178.68 1i7x h LEU 424 N -0.34 0.83 0.31 1.44 3.38 -1.02 0.73 115.31 120.64 1i7x h LEU 424 Ca 0.03 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 1i7x h LEU 424 Cb 0.36 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1i7x h LEU 424 CO -0.11 0.46 -0.32 -1.28 0.09 0.00 0.00 178.44 177.29 1i7x h SER 425 N 0.90 -0.87 -0.37 -0.43 0.87 -0.39 -1.95 113.55 111.31 1i7x h SER 425 Ca 0.45 0.07 0.02 0.00 -1.23 0.00 0.00 61.79 61.10 1i7x h SER 425 Cb 0.50 0.29 -0.03 0.00 -0.44 0.00 0.00 62.40 62.72 1i7x h SER 425 CO -0.22 -0.41 0.21 0.78 -0.53 0.00 0.00 176.83 176.65 1i7x h ASN 426 N -0.63 0.33 -0.03 6.23 2.35 -0.93 -2.57 115.58 120.33 1i7x h ASN 426 Ca -0.04 0.01 0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1i7x h ASN 426 Cb 0.54 -0.06 -0.00 0.00 0.05 0.00 0.00 38.32 38.85 1i7x h ASN 426 CO -0.04 0.24 0.08 -0.07 -1.65 0.00 0.00 177.43 175.99 1i7x h LEU 427 N 0.42 0.00 -3.67 1.61 3.38 -0.82 0.05 115.31 116.28 1i7x h LEU 427 Ca 0.15 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.94 1i7x h LEU 427 Cb 0.02 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.67 1i7x h LEU 427 CO -0.08 0.00 0.23 0.35 0.09 0.00 0.00 178.44 179.03 1i7x n THR 428 N -3.38 2.87 -3.27 0.22 -2.24 -0.74 -4.67 114.28 103.07 1i7x n THR 428 Ca -0.02 -1.55 -0.44 0.00 -2.27 0.00 0.00 64.05 59.77 1i7x n THR 428 Cb 0.16 -0.36 -0.07 0.00 -2.10 0.00 0.00 70.33 67.96 1i7x n THR 428 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i7x n ASN 430 N 5.73 -5.29 -4.08 0.00 5.15 -1.26 -4.95 115.26 110.56 1i7x n ASN 430 Ca -0.09 0.44 -0.34 0.00 -0.60 0.00 0.00 54.58 53.99 1i7x n ASN 430 Cb 0.45 -4.35 -0.13 0.00 -0.53 0.00 0.00 39.78 35.22 1i7x n ASN 430 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 1i7x s ASN 431 N -2.76 5.05 0.28 1.20 3.84 -1.26 -4.98 114.94 116.31 1i7x s ASN 431 Ca 0.00 -2.20 -0.01 0.00 0.21 0.00 0.00 52.86 50.86 1i7x s ASN 431 Cb 0.00 -1.76 0.39 0.00 -0.55 0.00 0.00 41.25 39.33 1i7x s ASN 431 CO 0.00 -0.46 1.81 0.10 -2.79 0.00 0.00 177.10 175.76 1i7x h TYR 432 N 7.74 0.84 -0.68 0.43 -0.00 -1.93 -1.92 116.97 121.45 1i7x h TYR 432 Ca -0.09 -0.09 -0.03 0.00 0.00 0.00 0.00 58.73 58.52 1i7x h TYR 432 Cb 1.02 -0.24 -0.03 0.00 0.00 0.00 0.00 36.73 37.48 1i7x h TYR 432 CO 0.54 0.72 0.29 0.87 -0.00 0.00 0.00 178.16 180.58 1i7x h LYS 433 N 0.77 0.99 -0.18 0.10 1.57 -1.96 -0.79 116.57 117.06 1i7x h LYS 433 Ca 0.16 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1i7x h LYS 433 Cb 0.34 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1i7x h LYS 433 CO 0.00 0.79 0.05 -0.91 -0.57 0.00 0.00 179.45 178.81 1i7x h ASN 434 N 0.97 0.28 0.17 0.86 4.21 -1.76 -1.95 115.58 118.35 1i7x h ASN 434 Ca 0.23 -0.22 0.02 0.00 1.21 0.00 0.00 56.30 57.53 1i7x h ASN 434 Cb 0.16 -0.07 -0.04 0.00 -1.12 0.00 0.00 38.32 37.24 1i7x h ASN 434 CO -0.02 0.43 -0.38 0.11 -1.29 0.00 0.00 177.43 176.28 1i7x h LYS 435 N 0.11 -0.61 -0.67 0.81 1.57 -0.91 -0.01 116.57 116.85 1i7x h LYS 435 Ca 0.06 0.04 0.14 0.00 -1.87 0.00 0.00 60.65 59.02 1i7x h LYS 435 Cb 0.26 0.14 -0.10 0.00 0.08 0.00 0.00 32.23 32.61 1i7x h LYS 435 CO 0.00 -0.41 0.15 0.52 -0.57 0.00 0.00 179.45 179.14 1i7x h MET 436 N -0.64 0.26 -0.26 3.15 2.86 -1.12 -1.34 114.93 117.84 1i7x h MET 436 Ca 0.02 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1i7x h MET 436 Cb 0.65 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 1i7x h MET 436 CO -0.19 0.17 0.10 0.52 1.06 0.00 0.00 176.91 178.57 1i7x h MET 437 N 0.26 0.39 -0.18 1.72 2.86 -0.75 -2.22 114.93 117.02 1i7x h MET 437 Ca 0.36 -0.07 0.02 0.00 -2.06 0.00 0.00 59.70 57.95 1i7x h MET 437 Cb 0.58 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 1i7x h MET 437 CO -0.46 0.43 0.06 0.28 1.06 0.00 0.00 176.91 178.29 1i7x h VAL 438 N 0.27 0.96 -0.88 -2.22 2.07 -0.19 -1.69 116.25 114.57 1i7x h VAL 438 Ca 0.09 -0.05 0.12 0.00 0.82 0.00 0.00 66.70 67.68 1i7x h VAL 438 Cb 0.19 0.80 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 1i7x h VAL 438 CO -0.01 0.03 0.57 0.00 0.02 0.00 0.00 177.57 178.18 1i7x n GLN 440 N -4.55 0.25 -0.55 0.00 1.13 -0.69 -3.34 117.38 109.63 1i7x n GLN 440 Ca 0.16 0.04 0.03 0.00 -1.94 0.00 0.00 57.00 55.30 1i7x n GLN 440 Cb 0.40 -1.50 0.21 0.00 0.11 0.00 0.00 30.24 29.46 1i7x n GLN 440 CO 0.00 0.00 0.00 1.33 -1.44 0.00 0.00 177.06 176.95 1i7x n VAL 441 N -1.36 2.31 -1.12 5.09 0.24 -0.34 -4.95 118.33 118.20 1i7x n VAL 441 Ca 0.10 -2.52 0.00 0.00 -2.04 0.00 0.00 64.34 59.88 1i7x n VAL 441 Cb 0.24 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.34 1i7x n VAL 441 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1i7x n GLY 442 N -1.03 0.40 0.10 7.63 0.00 -1.20 -4.92 105.19 106.16 1i7x n GLY 442 Ca 0.25 -1.05 -0.11 0.00 0.00 0.00 0.00 46.02 45.11 1i7x n GLY 442 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1i7x h GLY 443 N 0.00 0.24 0.48 -0.02 0.00 -1.49 -1.74 103.07 100.55 1i7x h GLY 443 Ca 0.00 -0.12 0.03 0.00 0.00 0.00 0.00 47.33 47.24 1i7x h GLY 443 CO 0.00 0.12 -0.25 -2.22 0.00 0.00 0.00 176.54 174.19 1i7x h ILE 444 N 0.13 0.44 -0.40 2.60 1.08 -1.84 0.45 117.51 119.97 1i7x h ILE 444 Ca 0.05 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.57 1i7x h ILE 444 Cb 0.12 0.44 -0.04 0.00 -3.07 0.00 0.00 36.82 34.27 1i7x h ILE 444 CO -0.01 0.00 0.15 -0.08 -0.69 0.00 0.00 178.15 177.52 1i7x h GLU 445 N -0.40 0.30 0.16 2.37 4.81 -1.89 0.18 114.58 120.12 1i7x h GLU 445 Ca 0.05 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1i7x h GLU 445 Cb 0.47 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1i7x h GLU 445 CO -0.19 0.20 -0.15 0.00 -0.73 0.00 0.00 179.01 178.14 1i7x h ALA 446 N 1.25 -0.30 -0.62 2.92 0.00 -0.64 0.14 119.26 121.99 1i7x h ALA 446 Ca 0.18 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1i7x h ALA 446 Cb 0.15 0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1i7x h ALA 446 CO -0.18 -0.69 0.37 -0.07 0.00 0.00 0.00 179.25 178.68 1i7x h LEU 447 N -0.33 0.59 0.29 0.00 3.38 0.20 0.38 115.31 119.83 1i7x h LEU 447 Ca 0.00 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1i7x h LEU 447 Cb 0.31 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1i7x h LEU 447 CO -0.03 0.41 -0.20 0.58 0.09 0.00 0.00 178.44 179.29 1i7x h VAL 448 N 0.72 0.58 -1.01 1.22 2.07 -0.24 -0.70 116.25 118.90 1i7x h VAL 448 Ca 0.26 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.89 1i7x h VAL 448 Cb 0.06 0.58 -0.08 0.00 -1.52 0.00 0.00 31.29 30.33 1i7x h VAL 448 CO -0.12 0.00 0.64 0.03 0.02 0.00 0.00 177.57 178.13 1i7x h ARG 449 N -0.48 0.99 0.27 1.57 3.08 -0.27 -0.56 114.38 118.99 1i7x h ARG 449 Ca -0.02 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1i7x h ARG 449 Cb 0.41 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1i7x h ARG 449 CO 0.01 0.66 -0.13 1.15 -1.07 0.00 0.00 179.97 180.59 1i7x h THR 450 N 1.02 0.75 -0.93 2.04 2.02 -0.37 -0.23 112.91 117.21 1i7x h THR 450 Ca 0.49 -0.13 0.16 0.00 0.77 0.00 0.00 66.41 67.69 1i7x h THR 450 Cb 0.45 0.83 -0.08 0.00 -1.74 0.00 0.00 68.15 67.61 1i7x h THR 450 CO -0.25 0.03 0.60 0.58 0.37 0.00 0.00 175.52 176.84 1i7x h VAL 451 N -0.43 0.80 0.58 3.16 2.07 -0.50 0.36 116.25 122.29 1i7x h VAL 451 Ca -0.04 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 1i7x h VAL 451 Cb 0.33 0.02 0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1i7x h VAL 451 CO 0.06 0.13 -0.28 0.25 0.02 0.00 0.00 177.57 177.75 1i7x h LEU 452 N 0.72 -0.66 -1.84 2.57 5.85 -0.66 -3.15 115.31 118.13 1i7x h LEU 452 Ca 0.49 -0.04 -0.03 0.00 0.84 0.00 0.00 57.88 59.14 1i7x h LEU 452 Cb 0.78 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.98 1i7x h LEU 452 CO -0.25 -0.34 -0.13 -0.09 -0.34 0.00 0.00 178.44 177.29 1i7x h ARG 453 N -1.00 0.00 0.00 1.25 2.43 -0.14 -3.06 114.38 113.86 1i7x h ARG 453 Ca -0.08 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1i7x h ARG 453 Cb 0.66 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1i7x h ARG 453 CO 0.13 0.13 -0.08 0.00 -1.51 0.00 0.00 179.97 178.64 1i7x h ALA 454 N 1.87 1.01 -0.54 2.80 0.00 -0.28 -3.48 119.26 120.64 1i7x h ALA 454 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1i7x h ALA 454 Cb 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1i7x h ALA 454 CO 0.02 0.10 0.00 0.41 0.00 0.00 0.00 179.25 179.77 1i7x n GLY 455 N 0.18 3.15 0.09 0.00 0.00 -1.16 -1.03 105.19 106.42 1i7x n GLY 455 Ca 0.01 -0.02 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1i7x n GLY 455 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1i7x n ASP 456 N 3.36 0.47 -4.56 1.61 5.75 -1.26 -4.69 116.55 117.23 1i7x n ASP 456 Ca 0.00 0.61 -0.23 0.00 -0.01 0.00 0.00 54.79 55.16 1i7x n ASP 456 Cb 0.00 -0.71 -0.05 0.00 -1.03 0.00 0.00 41.12 39.32 1i7x n ASP 456 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1i7x s ARG 457 N -3.21 2.13 0.08 0.11 0.52 -0.20 -4.80 118.95 113.58 1i7x s ARG 457 Ca 0.05 0.27 0.16 0.00 -0.52 0.00 0.00 55.73 55.69 1i7x s ARG 457 Cb 0.09 -4.84 0.68 0.00 0.52 0.00 0.00 34.95 31.40 1i7x s ARG 457 CO 0.36 -3.75 1.49 0.39 0.02 0.00 0.00 175.30 173.81 1i7x n GLU 458 N 8.89 0.06 0.22 3.54 1.02 -1.26 -1.95 120.64 131.16 1i7x n GLU 458 Ca 0.41 0.34 0.10 0.00 -0.02 0.00 0.00 57.16 57.99 1i7x n GLU 458 Cb 0.47 -1.62 0.48 0.00 -0.02 0.00 0.00 31.44 30.74 1i7x n GLU 458 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1i7x h ASP 459 N 0.00 0.00 0.00 1.62 3.32 -1.98 -2.58 116.42 116.80 1i7x h ASP 459 Ca 0.00 0.00 -0.41 0.00 0.02 0.00 0.00 57.03 56.64 1i7x h ASP 459 Cb 0.25 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.73 1i7x h ASP 459 CO 0.00 0.22 -2.50 -0.38 -1.72 0.00 0.00 179.24 174.86 1i7x n ILE 460 N -3.40 1.50 -0.03 0.35 5.41 -0.82 -4.60 119.36 117.77 1i7x n ILE 460 Ca 0.00 -0.51 -0.07 0.00 1.00 0.00 0.00 62.75 63.17 1i7x n ILE 460 Cb 0.42 -1.56 0.12 0.00 -0.71 0.00 0.00 39.64 37.90 1i7x n ILE 460 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1i7x h THR 461 N -0.31 1.28 0.28 1.39 1.35 -1.43 -2.55 112.91 112.92 1i7x h THR 461 Ca -0.62 -1.45 -0.01 0.00 -0.55 0.00 0.00 66.41 63.78 1i7x h THR 461 Cb 1.81 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 69.65 1i7x h THR 461 CO -0.19 0.46 -0.13 -0.08 -0.25 0.00 0.00 175.52 175.33 1i7x h GLU 462 N 0.52 -0.36 -0.66 4.72 4.81 -1.72 0.40 114.58 122.29 1i7x h GLU 462 Ca 0.06 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1i7x h GLU 462 Cb 0.81 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.25 1i7x h GLU 462 CO 0.07 -0.10 0.33 -1.00 -0.73 0.00 0.00 179.01 177.57 1i7x h PRO 463 N -0.59 0.95 -0.04 0.92 0.13 -1.81 0.67 132.00 132.22 1i7x h PRO 463 Ca -0.04 -0.13 0.03 0.00 -0.87 0.00 0.00 66.00 64.98 1i7x h PRO 463 Cb 0.43 -0.17 -0.03 0.00 0.13 0.00 0.00 31.00 31.35 1i7x h PRO 463 CO 0.06 0.75 -0.13 0.00 -0.23 0.00 0.00 178.00 178.45 1i7x h ALA 464 N 1.15 -0.11 -0.34 -0.56 0.00 -1.36 0.21 119.26 118.25 1i7x h ALA 464 Ca 0.23 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 1i7x h ALA 464 Cb 0.10 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1i7x h ALA 464 CO -0.03 -0.61 0.20 0.82 0.00 0.00 0.00 179.25 179.63 1i7x h ILE 465 N -0.20 1.13 -0.64 0.00 1.08 0.04 -1.31 117.51 117.60 1i7x h ILE 465 Ca 0.06 -0.32 0.09 0.00 -0.39 0.00 0.00 64.86 64.30 1i7x h ILE 465 Cb 0.28 0.72 -0.07 0.00 -3.07 0.00 0.00 36.82 34.67 1i7x h ILE 465 CO -0.16 0.13 0.28 0.00 -0.69 0.00 0.00 178.15 177.72 1i7x h ALA 467 N 1.41 -0.42 -0.54 0.00 0.00 -0.02 0.14 119.26 119.83 1i7x h ALA 467 Ca 0.32 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.35 1i7x h ALA 467 Cb 0.36 0.54 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1i7x h ALA 467 CO -0.28 -0.81 0.38 -0.07 0.00 0.00 0.00 179.25 178.47 1i7x h LEU 468 N -0.44 0.15 -0.07 0.00 3.38 0.02 0.25 115.31 118.59 1i7x h LEU 468 Ca 0.07 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1i7x h LEU 468 Cb 0.54 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1i7x h LEU 468 CO -0.27 0.08 -0.12 -0.09 0.09 0.00 0.00 178.44 178.14 1i7x h ARG 469 N 0.16 0.20 -0.56 1.13 2.43 0.11 -2.63 114.38 115.21 1i7x h ARG 469 Ca 0.26 -0.12 0.06 0.00 -0.81 0.00 0.00 59.98 59.36 1i7x h ARG 469 Cb 0.80 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.31 1i7x h ARG 469 CO -0.04 0.70 0.27 0.45 -1.51 0.00 0.00 179.97 179.84 1i7x h HIS 470 N -0.27 0.49 0.00 2.20 3.86 0.86 -1.16 115.15 121.13 1i7x h HIS 470 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 1i7x h HIS 470 Cb 0.68 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.02 1i7x h HIS 470 CO 0.11 0.22 0.00 -0.07 0.86 0.00 0.00 177.93 179.04 1i7x h LEU 471 N 0.51 0.00 -3.55 2.43 3.38 -0.58 -3.07 115.31 114.43 1i7x h LEU 471 Ca 0.26 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.10 1i7x h LEU 471 Cb 0.20 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 1i7x h LEU 471 CO -0.20 0.00 0.12 0.35 0.09 0.00 0.00 178.44 178.81 1i7x n THR 472 N -2.34 2.71 -3.52 0.22 -2.24 -0.44 -4.36 114.28 104.32 1i7x n THR 472 Ca 0.01 -1.79 -0.13 0.00 -2.27 0.00 0.00 64.05 59.88 1i7x n THR 472 Cb 0.18 -0.32 -0.04 0.00 -2.10 0.00 0.00 70.33 68.06 1i7x n THR 472 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1i7x s SER 473 N -1.39 -0.47 -1.30 3.42 1.04 -1.16 -4.73 113.70 109.11 1i7x s SER 473 Ca 0.51 0.05 -0.05 0.00 0.48 0.00 0.00 55.95 56.94 1i7x s SER 473 Cb 0.41 0.54 -0.00 0.00 0.10 0.00 0.00 66.02 67.06 1i7x s SER 473 CO 0.11 -0.84 0.63 0.54 0.98 0.00 0.00 173.24 174.66 1i7x n ARG 474 N -0.00 -3.49 -3.65 4.02 1.74 -1.26 -4.88 116.66 109.14 1i7x n ARG 474 Ca -0.17 0.52 -0.02 0.00 -0.77 0.00 0.00 57.85 57.40 1i7x n ARG 474 Cb 0.63 -4.75 -0.06 0.00 -1.02 0.00 0.00 32.46 27.26 1i7x n ARG 474 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1i7x s HIS 475 N -3.72 -0.04 0.61 -1.55 -3.43 -1.26 -4.77 115.29 101.12 1i7x s HIS 475 Ca 0.11 0.09 0.27 0.00 -0.80 0.00 0.00 55.06 54.73 1i7x s HIS 475 Cb -0.04 0.49 1.17 0.00 -1.43 0.00 0.00 32.58 32.77 1i7x s HIS 475 CO 0.85 -0.03 1.58 1.96 -2.00 0.00 0.00 174.74 177.10 1i7x h GLN 476 N 2.57 0.00 -0.10 -0.38 4.20 -1.94 0.15 115.11 119.62 1i7x h GLN 476 Ca -0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.54 1i7x h GLN 476 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1i7x h GLN 476 CO 0.20 0.00 0.00 0.39 -0.67 0.00 0.00 178.83 178.75 1i7x n GLU 477 N -3.39 2.22 -0.05 1.46 -0.58 -1.26 -4.51 120.64 114.53 1i7x n GLU 477 Ca 0.14 -1.79 -0.08 0.00 -0.42 0.00 0.00 57.16 55.02 1i7x n GLU 477 Cb 1.07 -1.47 -0.01 0.00 -0.57 0.00 0.00 31.44 30.46 1i7x n GLU 477 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1i7x h ALA 478 N 4.59 0.01 -0.50 0.62 0.00 -0.89 -1.93 119.26 121.16 1i7x h ALA 478 Ca 0.00 0.09 0.09 0.00 0.00 0.00 0.00 54.91 55.08 1i7x h ALA 478 Cb 0.89 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 18.96 1i7x h ALA 478 CO 0.00 -0.57 0.08 1.49 0.00 0.00 0.00 179.25 180.25 1i7x h GLU 479 N -0.14 0.20 -0.55 0.00 4.81 -1.79 0.24 114.58 117.35 1i7x h GLU 479 Ca 0.13 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.42 1i7x h GLU 479 Cb 0.34 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.62 1i7x h GLU 479 CO -0.32 0.13 0.24 1.98 -0.73 0.00 0.00 179.01 180.31 1i7x h MET 480 N 0.21 0.43 -0.59 1.92 4.05 -1.69 -1.77 114.93 117.49 1i7x h MET 480 Ca 0.25 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.59 1i7x h MET 480 Cb 0.35 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.02 1i7x h MET 480 CO -0.34 0.29 0.14 0.00 0.23 0.00 0.00 176.91 177.23 1i7x h ALA 481 N 1.34 1.14 -0.54 0.39 0.00 -0.52 0.41 119.26 121.49 1i7x h ALA 481 Ca 0.26 -0.22 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1i7x h ALA 481 Cb 0.25 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1i7x h ALA 481 CO -0.23 0.58 0.33 1.96 0.00 0.00 0.00 179.25 181.89 1i7x h GLN 482 N 0.88 0.64 0.03 0.00 4.20 0.28 -0.80 115.11 120.33 1i7x h GLN 482 Ca 0.19 -0.04 -0.21 0.00 0.06 0.00 0.00 58.65 58.65 1i7x h GLN 482 Cb 0.31 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1i7x h GLN 482 CO -0.00 0.42 -0.98 -0.91 -0.67 0.00 0.00 178.83 176.69 1i7x h ASN 483 N 0.65 0.23 -0.45 1.46 2.35 -1.11 -3.30 115.58 115.41 1i7x h ASN 483 Ca 0.21 -0.21 0.05 0.00 -0.55 0.00 0.00 56.30 55.81 1i7x h ASN 483 Cb 0.01 -0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.26 1i7x h ASN 483 CO -0.09 1.07 0.18 0.00 -1.65 0.00 0.00 177.43 176.95 1i7x h ALA 484 N 0.90 0.56 -0.65 -0.83 0.00 0.33 0.18 119.26 119.76 1i7x h ALA 484 Ca -0.05 0.05 0.08 0.00 0.00 0.00 0.00 54.91 54.98 1i7x h ALA 484 Cb 1.65 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.38 1i7x h ALA 484 CO 0.15 -0.20 0.31 0.28 0.00 0.00 0.00 179.25 179.79 1i7x h VAL 485 N 0.37 0.87 0.36 0.00 2.07 -1.24 -2.12 116.25 116.57 1i7x h VAL 485 Ca 0.21 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 1i7x h VAL 485 Cb 0.18 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1i7x h VAL 485 CO -0.19 0.10 -0.17 -0.09 0.02 0.00 0.00 177.57 177.23 1i7x h ARG 486 N 0.56 -0.47 0.00 1.57 2.43 -1.52 -0.19 114.38 116.77 1i7x h ARG 486 Ca 0.31 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 1i7x h ARG 486 Cb 0.29 0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1i7x h ARG 486 CO -0.24 -0.15 0.01 1.28 -1.51 0.00 0.00 179.97 179.36 1i7x n LEU 487 N -5.16 0.00 -0.31 3.80 4.77 0.59 -0.05 117.00 120.65 1i7x n LEU 487 Ca -0.10 0.18 0.03 0.00 -0.03 0.00 0.00 56.01 56.10 1i7x n LEU 487 Cb 0.28 -0.18 0.08 0.00 -2.33 0.00 0.00 43.42 41.27 1i7x n LEU 487 CO 0.29 -0.18 0.57 1.41 -1.33 0.00 0.00 177.39 178.14 1i7x n HIS 488 N -1.17 0.23 -2.70 -1.77 8.25 -0.81 -4.99 115.22 112.25 1i7x n HIS 488 Ca 0.00 -0.53 -0.12 0.00 -0.26 0.00 0.00 57.72 56.80 1i7x n HIS 488 Cb 0.01 -0.05 0.02 0.00 1.12 0.00 0.00 29.99 31.09 1i7x n HIS 488 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1i7x n TYR 489 N -0.11 -1.11 -0.01 4.41 4.02 0.93 -4.93 117.16 120.35 1i7x n TYR 489 Ca 0.06 0.31 -0.09 0.00 -0.01 0.00 0.00 57.90 58.17 1i7x n TYR 489 Cb 0.36 -2.94 -0.14 0.00 -0.02 0.00 0.00 39.34 36.60 1i7x n TYR 489 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1i7x h GLY 490 N -0.82 0.01 -0.66 2.72 0.00 -1.17 -3.39 103.07 99.76 1i7x h GLY 490 Ca -0.29 -0.02 0.17 0.00 0.00 0.00 0.00 47.33 47.18 1i7x h GLY 490 CO 0.31 0.02 -0.21 1.41 0.00 0.00 0.00 176.54 178.07 1i7x h LEU 491 N 0.00 -0.78 0.34 3.11 3.38 -1.85 0.27 115.31 119.78 1i7x h LEU 491 Ca -0.25 0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1i7x h LEU 491 Cb 1.99 0.52 -0.03 0.00 0.09 0.00 0.00 40.66 43.23 1i7x h LEU 491 CO 0.09 -0.27 -0.46 -0.65 0.09 0.00 0.00 178.44 177.23 1i7x h PRO 492 N -0.00 -0.79 -0.88 1.13 0.11 -1.96 0.60 132.00 130.20 1i7x h PRO 492 Ca 0.40 0.05 0.12 0.00 0.11 0.00 0.00 66.00 66.68 1i7x h PRO 492 Cb 0.61 0.18 -0.07 0.00 0.11 0.00 0.00 31.00 31.83 1i7x h PRO 492 CO -0.85 -0.53 0.57 -0.24 -0.21 0.00 0.00 178.00 176.74 1i7x h VAL 493 N -0.83 0.91 0.18 3.15 3.04 -1.59 -0.65 116.25 120.46 1i7x h VAL 493 Ca -0.04 -0.27 -0.01 0.00 -1.01 0.00 0.00 66.70 65.37 1i7x h VAL 493 Cb 0.74 0.05 0.00 0.00 -2.01 0.00 0.00 31.29 30.07 1i7x h VAL 493 CO -0.12 0.14 -0.09 0.58 -1.01 0.00 0.00 177.57 177.08 1i7x h VAL 494 N 0.79 0.92 -0.97 1.51 2.07 -0.43 -2.49 116.25 117.65 1i7x h VAL 494 Ca 0.43 -0.49 0.08 0.00 0.82 0.00 0.00 66.70 67.53 1i7x h VAL 494 Cb 0.55 1.21 -0.07 0.00 -1.52 0.00 0.00 31.29 31.46 1i7x h VAL 494 CO -0.19 0.11 0.62 0.58 0.02 0.00 0.00 177.57 178.72 1i7x h VAL 495 N -0.48 1.03 -0.92 2.57 2.07 -0.31 -2.30 116.25 117.91 1i7x h VAL 495 Ca -0.02 -0.37 0.05 0.00 0.82 0.00 0.00 66.70 67.18 1i7x h VAL 495 Cb 0.37 -0.13 -0.06 0.00 -1.52 0.00 0.00 31.29 29.95 1i7x h VAL 495 CO 0.04 0.20 0.60 0.50 0.02 0.00 0.00 177.57 178.93 1i7x h LYS 496 N 1.07 1.06 0.00 1.57 3.64 -0.93 -1.28 116.57 121.69 1i7x h LYS 496 Ca 0.43 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 1i7x h LYS 496 Cb 0.27 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1i7x h LYS 496 CO -0.19 0.70 0.00 1.28 -2.27 0.00 0.00 179.45 178.97 1i7x n LEU 497 N -4.47 0.19 0.08 5.20 4.77 -0.86 -0.89 117.00 121.01 1i7x n LEU 497 Ca 0.13 0.58 0.11 0.00 -0.03 0.00 0.00 56.01 56.80 1i7x n LEU 497 Cb 0.16 -0.59 0.44 0.00 -2.33 0.00 0.00 43.42 41.11 1i7x n LEU 497 CO 0.33 -0.57 0.84 0.18 -1.33 0.00 0.00 177.39 176.84 1i7x n LEU 498 N -1.74 0.45 -4.77 2.23 4.77 -0.48 -4.64 117.00 112.82 1i7x n LEU 498 Ca 0.00 0.59 -0.25 0.00 -0.03 0.00 0.00 56.01 56.32 1i7x n LEU 498 Cb 0.05 -0.50 -0.06 0.00 -2.33 0.00 0.00 43.42 40.59 1i7x n LEU 498 CO 0.06 -0.35 -0.24 -1.00 -1.33 0.00 0.00 177.39 174.54 1i7x s HIS 499 N -3.16 3.04 0.79 -1.77 3.76 -0.07 -5.00 115.29 112.88 1i7x s HIS 499 Ca 0.07 -0.08 -0.15 0.00 -0.15 0.00 0.00 55.06 54.75 1i7x s HIS 499 Cb 0.11 -1.43 -0.01 0.00 1.11 0.00 0.00 32.58 32.37 1i7x s HIS 499 CO 0.41 0.53 0.58 -2.30 -0.85 0.00 0.00 174.74 173.11 1i7x n PRO 500 N -0.58 0.15 0.27 8.40 -0.02 -1.26 -2.99 135.00 138.97 1i7x n PRO 500 Ca -0.08 0.10 0.15 0.00 -2.02 0.00 0.00 63.50 61.65 1i7x n PRO 500 Cb 0.56 -1.91 0.73 0.00 -0.02 0.00 0.00 33.50 32.86 1i7x n PRO 500 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1i7x h PRO 501 N -0.73 0.00 -0.38 0.52 0.13 -1.95 -3.50 132.00 126.09 1i7x h PRO 501 Ca -0.45 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.63 1i7x h PRO 501 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1i7x h PRO 501 CO 0.41 0.08 0.02 0.43 -0.23 0.00 0.00 178.00 178.71 1i7x n SER 502 N -3.31 0.03 -4.92 1.44 7.64 -1.16 -4.91 113.62 108.42 1i7x n SER 502 Ca -0.01 0.07 -0.26 0.00 1.01 0.00 0.00 58.87 59.69 1i7x n SER 502 Cb 0.28 -0.06 -0.00 0.00 -1.01 0.00 0.00 64.21 63.42 1i7x n SER 502 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1i7x s HIS 503 N 0.07 3.51 0.20 1.43 3.76 -1.26 -4.82 115.29 118.18 1i7x s HIS 503 Ca 0.06 0.59 -0.23 0.00 -0.15 0.00 0.00 55.06 55.33 1i7x s HIS 503 Cb -0.09 -2.16 0.11 0.00 1.11 0.00 0.00 32.58 31.55 1i7x s HIS 503 CO 0.04 -0.15 1.55 -1.49 -0.85 0.00 0.00 174.74 173.84 1i7x h TRP 504 N 0.42 -1.39 -0.58 1.40 -0.00 -1.91 0.41 115.95 114.30 1i7x h TRP 504 Ca -0.48 0.11 0.12 0.00 -0.00 0.00 0.00 58.89 58.64 1i7x h TRP 504 Cb 1.21 0.74 -0.11 0.00 -0.00 0.00 0.00 29.16 31.00 1i7x h TRP 504 CO 0.54 -0.40 -0.15 -1.00 -0.00 0.00 0.00 178.44 177.44 1i7x h PRO 505 N -0.03 -0.00 -0.40 0.49 0.13 -1.89 0.17 132.00 130.46 1i7x h PRO 505 Ca 0.26 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.38 1i7x h PRO 505 Cb 0.53 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.64 1i7x h PRO 505 CO -0.93 -0.00 0.20 1.25 -0.23 0.00 0.00 178.00 178.29 1i7x h LEU 506 N -0.00 0.51 -0.35 1.56 5.85 -1.39 -2.44 115.31 119.04 1i7x h LEU 506 Ca 0.28 -0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1i7x h LEU 506 Cb 0.43 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 1i7x h LEU 506 CO -0.60 0.47 0.22 0.40 -0.34 0.00 0.00 178.44 178.59 1i7x h ILE 507 N 0.50 1.11 -0.45 4.05 2.04 0.02 0.35 117.51 125.14 1i7x h ILE 507 Ca 0.14 -0.25 0.09 0.00 1.00 0.00 0.00 64.86 65.84 1i7x h ILE 507 Cb 0.09 0.64 -0.08 0.00 -0.74 0.00 0.00 36.82 36.73 1i7x h ILE 507 CO -0.02 0.11 -0.08 0.50 0.00 0.00 0.00 178.15 178.67 1i7x h LYS 508 N 0.46 0.03 -0.59 2.37 3.64 -0.58 0.24 116.57 122.14 1i7x h LYS 508 Ca 0.13 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1i7x h LYS 508 Cb -0.01 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 31.78 1i7x h LYS 508 CO -0.02 0.02 0.34 0.00 -2.27 0.00 0.00 179.45 177.51 1i7x h ALA 509 N 1.43 0.75 -0.64 5.00 0.00 -1.03 -1.63 119.26 123.13 1i7x h ALA 509 Ca 0.22 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1i7x h ALA 509 Cb 0.33 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1i7x h ALA 509 CO -0.43 0.25 0.09 1.15 0.00 0.00 0.00 179.25 180.31 1i7x h THR 510 N 0.79 1.26 0.10 0.00 2.02 0.07 -0.63 112.91 116.53 1i7x h THR 510 Ca 0.21 -1.04 -0.00 0.00 0.77 0.00 0.00 66.41 66.34 1i7x h THR 510 Cb 0.01 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1i7x h THR 510 CO -0.04 0.39 -0.07 0.58 0.37 0.00 0.00 175.52 176.76 1i7x h VAL 511 N 0.99 0.86 -0.82 3.16 2.07 -0.26 0.37 116.25 122.61 1i7x h VAL 511 Ca 0.19 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.83 1i7x h VAL 511 Cb 0.45 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 31.00 1i7x h VAL 511 CO 0.02 0.00 0.45 1.23 0.02 0.00 0.00 177.57 179.28 1i7x h GLY 512 N -0.17 1.30 0.97 2.17 0.00 -0.99 -0.41 103.07 105.94 1i7x h GLY 512 Ca -0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.00 1i7x h GLY 512 CO 0.01 0.06 0.15 -2.00 0.00 0.00 0.00 176.54 174.76 1i7x h LEU 513 N 0.71 0.71 -1.14 3.11 5.85 -0.57 -2.39 115.31 121.58 1i7x h LEU 513 Ca 0.42 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 1i7x h LEU 513 Cb 0.48 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1i7x h LEU 513 CO -0.29 0.73 0.29 0.40 -0.34 0.00 0.00 178.44 179.22 1i7x h ILE 514 N 0.66 1.21 -0.07 4.05 2.04 0.12 -0.31 117.51 125.20 1i7x h ILE 514 Ca 0.16 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.42 1i7x h ILE 514 Cb 0.27 0.42 -0.00 0.00 -0.74 0.00 0.00 36.82 36.76 1i7x h ILE 514 CO -0.01 0.25 0.04 -0.09 0.00 0.00 0.00 178.15 178.34 1i7x h ARG 515 N 0.89 0.08 -0.17 2.37 2.43 -0.68 -0.53 114.38 118.75 1i7x h ARG 515 Ca 0.22 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1i7x h ARG 515 Cb 0.11 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1i7x h ARG 515 CO -0.03 0.05 0.11 -0.91 -1.51 0.00 0.00 179.97 177.69 1i7x h ASN 516 N 0.08 0.20 -0.74 -3.80 2.35 -0.93 -1.29 115.58 111.45 1i7x h ASN 516 Ca 0.03 -0.01 0.18 0.00 -0.55 0.00 0.00 56.30 55.94 1i7x h ASN 516 Cb -0.00 -0.05 -0.04 0.00 0.05 0.00 0.00 38.32 38.28 1i7x h ASN 516 CO -0.01 0.15 0.51 -0.07 -1.65 0.00 0.00 177.43 176.36 1i7x h LEU 517 N 0.23 0.23 -0.16 1.61 3.38 -0.81 0.30 115.31 120.09 1i7x h LEU 517 Ca 0.06 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1i7x h LEU 517 Cb -0.02 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1i7x h LEU 517 CO -0.01 0.11 0.00 0.00 0.09 0.00 0.00 178.44 178.62 1i7x n ALA 518 N -2.58 1.71 0.22 1.53 0.00 -0.23 -2.47 120.51 118.68 1i7x n ALA 518 Ca 0.15 -0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.65 1i7x n ALA 518 Cb 0.65 -1.29 0.51 0.00 0.00 0.00 0.00 19.45 19.32 1i7x n ALA 518 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1i7x h LEU 519 N 0.00 0.00 -8.62 0.00 3.38 -0.31 -3.39 115.31 106.37 1i7x h LEU 519 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 1i7x h LEU 519 Cb 0.30 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.90 1i7x h LEU 519 CO 0.00 0.25 0.16 0.00 0.09 0.00 0.00 178.44 178.94 1i7x h PRO 521 N 8.85 0.00 -0.03 0.00 0.13 -1.86 0.29 132.00 139.38 1i7x h PRO 521 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1i7x h PRO 521 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1i7x h PRO 521 CO 0.90 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.67 1i7x n ALA 522 N -2.67 2.08 0.01 -0.56 0.00 -1.26 -2.39 120.51 115.71 1i7x n ALA 522 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1i7x n ALA 522 Cb 0.91 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.36 1i7x n ALA 522 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1i7x n ASN 523 N -0.46 2.40 0.18 0.00 3.02 0.10 -4.73 115.26 115.78 1i7x n ASN 523 Ca 0.00 -0.26 -0.12 0.00 -0.03 0.00 0.00 54.58 54.17 1i7x n ASN 523 Cb 0.01 1.01 -0.07 0.00 -0.61 0.00 0.00 39.78 40.12 1i7x n ASN 523 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1i7x h HIS 524 N 0.00 -0.98 0.54 3.10 3.86 -1.56 0.14 115.15 120.24 1i7x h HIS 524 Ca 0.00 0.01 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 1i7x h HIS 524 Cb 0.01 0.39 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 1i7x h HIS 524 CO 0.00 -0.45 -0.38 0.00 0.86 0.00 0.00 177.93 177.96 1i7x h ALA 525 N -1.12 -0.91 -0.59 2.45 0.00 -1.88 0.36 119.26 117.57 1i7x h ALA 525 Ca -0.04 -0.17 0.12 0.00 0.00 0.00 0.00 54.91 54.82 1i7x h ALA 525 Cb 0.59 0.49 -0.10 0.00 0.00 0.00 0.00 17.79 18.77 1i7x h ALA 525 CO -0.07 -1.03 0.03 -1.35 0.00 0.00 0.00 179.25 176.83 1i7x h PRO 526 N -0.88 0.15 -0.69 0.00 0.11 -1.84 0.19 132.00 129.03 1i7x h PRO 526 Ca -0.06 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 1i7x h PRO 526 Cb 0.74 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.78 1i7x h PRO 526 CO 0.03 0.10 0.30 1.25 -0.21 0.00 0.00 178.00 179.47 1i7x h LEU 527 N 0.15 0.91 0.05 2.35 5.85 -0.46 -2.75 115.31 121.42 1i7x h LEU 527 Ca 0.31 -0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1i7x h LEU 527 Cb 0.49 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.28 1i7x h LEU 527 CO -0.48 0.80 -0.02 -0.09 -0.34 0.00 0.00 178.44 178.31 1i7x h ARG 528 N 0.99 -0.06 0.00 1.25 2.43 0.19 -2.71 114.38 116.47 1i7x h ARG 528 Ca 0.24 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1i7x h ARG 528 Cb 0.15 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1i7x h ARG 528 CO -0.03 0.20 0.00 0.39 -1.51 0.00 0.00 179.97 179.03 1i7x n GLU 529 N -5.00 0.01 -0.38 0.20 1.02 0.45 -0.57 120.64 116.37 1i7x n GLU 529 Ca -0.08 0.27 0.11 0.00 -0.02 0.00 0.00 57.16 57.44 1i7x n GLU 529 Cb 0.16 -1.50 0.31 0.00 -0.02 0.00 0.00 31.44 30.40 1i7x n GLU 529 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1i7x n GLN 530 N -1.28 2.72 -2.23 3.49 1.13 -1.02 -4.93 117.38 115.26 1i7x n GLN 530 Ca 0.00 -2.56 -0.15 0.00 -1.94 0.00 0.00 57.00 52.36 1i7x n GLN 530 Cb 0.01 -1.58 -0.01 0.00 0.11 0.00 0.00 30.24 28.77 1i7x n GLN 530 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1i7x n GLY 531 N 1.58 -0.14 0.20 1.08 0.00 0.26 -4.91 105.19 103.27 1i7x n GLY 531 Ca 0.24 -0.26 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 1i7x n GLY 531 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i7x h ALA 532 N 0.66 0.36 -0.10 4.61 0.00 -1.66 -3.22 119.26 119.91 1i7x h ALA 532 Ca -0.35 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.13 1i7x h ALA 532 Cb 1.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1i7x h ALA 532 CO 0.42 0.45 -0.00 0.82 0.00 0.00 0.00 179.25 180.94 1i7x h ILE 533 N 0.39 0.93 -0.55 0.00 2.04 -1.83 0.16 117.51 118.65 1i7x h ILE 533 Ca 0.02 -0.01 0.08 0.00 1.00 0.00 0.00 64.86 65.95 1i7x h ILE 533 Cb 0.98 0.90 -0.07 0.00 -0.74 0.00 0.00 36.82 37.89 1i7x h ILE 533 CO 0.09 0.01 0.18 -0.65 0.00 0.00 0.00 178.15 177.78 1i7x h PRO 534 N 0.03 0.34 -0.63 2.37 0.11 -1.94 -1.90 132.00 130.38 1i7x h PRO 534 Ca 0.05 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 66.06 1i7x h PRO 534 Cb 0.05 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.06 1i7x h PRO 534 CO -0.08 0.23 0.12 -0.09 -0.21 0.00 0.00 178.00 177.97 1i7x h ARG 535 N 0.35 1.03 -0.43 1.05 9.65 -1.44 -1.58 114.38 123.01 1i7x h ARG 535 Ca 0.27 -0.27 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1i7x h ARG 535 Cb 0.33 -0.13 -0.02 0.00 -1.39 0.00 0.00 29.97 28.76 1i7x h ARG 535 CO -0.29 0.95 0.28 -0.07 2.80 0.00 0.00 179.97 183.64 1i7x h LEU 536 N 0.95 0.51 -1.29 3.80 3.38 -0.33 -0.97 115.31 121.35 1i7x h LEU 536 Ca 0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1i7x h LEU 536 Cb 0.41 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1i7x h LEU 536 CO 0.01 0.38 0.34 0.58 0.09 0.00 0.00 178.44 179.84 1i7x h VAL 537 N 0.58 1.18 -0.10 1.22 2.07 -1.07 0.35 116.25 120.48 1i7x h VAL 537 Ca 0.16 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1i7x h VAL 537 Cb -0.05 0.35 -0.00 0.00 -1.52 0.00 0.00 31.29 30.07 1i7x h VAL 537 CO -0.03 0.20 0.04 -0.61 0.02 0.00 0.00 177.57 177.18 1i7x h GLN 538 N 0.84 0.15 -0.71 1.57 4.15 -0.53 0.16 115.11 120.73 1i7x h GLN 538 Ca 0.22 -0.03 -0.04 0.00 0.77 0.00 0.00 58.65 59.57 1i7x h GLN 538 Cb 0.00 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 27.64 1i7x h GLN 538 CO -0.04 0.27 0.30 -0.07 -1.93 0.00 0.00 178.83 177.36 1i7x h LEU 539 N -0.00 0.97 0.03 -2.39 3.38 -0.60 -1.73 115.31 114.97 1i7x h LEU 539 Ca 0.03 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1i7x h LEU 539 Cb 0.18 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 1i7x h LEU 539 CO -0.00 0.87 -0.03 0.25 0.09 0.00 0.00 178.44 179.62 1i7x h LEU 540 N 1.01 -0.07 0.24 1.67 5.85 0.00 -0.90 115.31 123.12 1i7x h LEU 540 Ca 0.24 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 1i7x h LEU 540 Cb 0.19 0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 1i7x h LEU 540 CO -0.02 -0.04 -0.17 0.58 -0.34 0.00 0.00 178.44 178.44 1i7x h VAL 541 N -0.06 0.00 -0.59 1.05 2.07 -0.44 -0.05 116.25 118.22 1i7x h VAL 541 Ca -0.00 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.64 1i7x h VAL 541 Cb 0.06 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 29.72 1i7x h VAL 541 CO -0.00 0.00 -0.09 0.03 0.02 0.00 0.00 177.57 177.53 1i7x h ARG 542 N -0.39 0.04 -0.12 1.57 2.47 -1.35 0.25 114.38 116.85 1i7x h ARG 542 Ca -0.03 -0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.69 1i7x h ARG 542 Cb 0.32 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.62 1i7x h ARG 542 CO 0.01 0.03 0.05 0.00 0.56 0.00 0.00 179.97 180.62 1i7x h ALA 543 N 1.57 0.13 -0.79 0.04 0.00 -1.14 -1.32 119.26 117.74 1i7x h ALA 543 Ca 0.29 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.22 1i7x h ALA 543 Cb 0.46 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1i7x h ALA 543 CO -0.57 -0.40 0.53 1.25 0.00 0.00 0.00 179.25 180.06 1i7x h HIS 544 N 0.11 0.99 -0.50 0.00 -0.00 0.37 -0.75 115.15 115.37 1i7x h HIS 544 Ca 0.05 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.41 1i7x h HIS 544 Cb 0.02 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 27.07 1i7x h HIS 544 CO -0.09 0.61 0.17 1.96 -0.00 0.00 0.00 177.93 180.58 1i7x h GLN 545 N 1.06 0.73 -0.20 5.26 4.20 -0.01 -2.19 115.11 123.96 1i7x h GLN 545 Ca 0.30 -0.12 -0.02 0.00 0.06 0.00 0.00 58.65 58.87 1i7x h GLN 545 Cb -0.09 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.55 1i7x h GLN 545 CO -0.07 0.63 0.06 0.22 -0.67 0.00 0.00 178.83 179.00 1i7x h ASP 546 N 0.72 0.29 0.18 1.46 1.82 -0.06 0.14 116.42 120.98 1i7x h ASP 546 Ca 0.17 -0.20 0.00 0.00 -0.39 0.00 0.00 57.03 56.61 1i7x h ASP 546 Cb 0.19 -0.08 0.00 0.00 0.68 0.00 0.00 39.33 40.12 1i7x h ASP 546 CO -0.01 0.42 0.00 0.35 -1.61 0.00 0.00 179.24 178.39 1i7x n THR 547 N -4.79 1.28 -0.11 2.25 -2.24 -0.46 -1.99 114.28 108.21 1i7x n THR 547 Ca -0.04 0.32 -0.14 0.00 -2.27 0.00 0.00 64.05 61.92 1i7x n THR 547 Cb 0.15 -1.21 -0.12 0.00 -2.10 0.00 0.00 70.33 67.05 1i7x n THR 547 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i7x n GLN 548 N -1.41 0.71 0.00 -0.78 1.13 -0.62 -4.25 117.38 112.17 1i7x n GLN 548 Ca 0.02 0.09 0.09 0.00 -1.94 0.00 0.00 57.00 55.27 1i7x n GLN 548 Cb 0.07 -1.46 0.41 0.00 0.11 0.00 0.00 30.24 29.36 1i7x n GLN 548 CO 0.00 0.00 0.00 2.89 -1.44 0.00 0.00 177.06 178.51 1i7x n ARG 549 N -3.04 0.00 -0.27 -1.09 1.85 0.38 -1.93 116.66 112.57 1i7x n ARG 549 Ca -0.38 0.17 0.05 0.00 -1.00 0.00 0.00 57.85 56.69 1i7x n ARG 549 Cb 0.98 -1.50 0.18 0.00 -1.05 0.00 0.00 32.46 31.06 1i7x n ARG 549 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1i7x n ARG 550 N -1.51 2.20 -0.09 2.89 5.12 -0.84 -3.84 116.66 120.59 1i7x n ARG 550 Ca 0.05 -1.42 -0.12 0.00 -1.93 0.00 0.00 57.85 54.42 1i7x n ARG 550 Cb 0.23 -1.47 -0.09 0.00 -1.16 0.00 0.00 32.46 29.96 1i7x n ARG 550 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1i7x n THR 551 N 0.51 1.07 0.75 0.55 -1.04 -0.81 -5.09 114.28 110.22 1i7x n THR 551 Ca 0.13 -0.45 0.12 0.00 -2.04 0.00 0.00 64.05 61.81 1i7x n THR 551 Cb 0.44 -1.07 0.49 0.00 -1.82 0.00 0.00 70.33 68.37 1i7x n THR 551 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1i7x n SER 552 N -2.96 0.26 0.00 8.00 3.41 -1.25 -5.17 113.62 115.90 1i7x n SER 552 Ca -0.32 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 58.83 1i7x n SER 552 Cb 0.88 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 1i7x n SER 552 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1i7x n PHE 560 N -1.75 0.00 -3.26 7.33 3.01 -1.26 -5.04 117.46 116.49 1i7x n PHE 560 Ca 0.05 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.50 1i7x n PHE 560 Cb 0.31 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.75 1i7x n PHE 560 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1i7x s VAL 561 N 0.00 -0.85 -1.45 -4.37 1.01 0.11 -4.87 120.40 109.98 1i7x s VAL 561 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.96 1i7x s VAL 561 Cb 0.00 -0.92 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1i7x s VAL 561 CO 0.00 -0.04 0.00 -0.62 0.00 0.00 0.00 175.10 174.44 1i7x n GLU 562 N 5.41 -1.28 0.00 2.72 1.02 -1.26 -2.45 120.64 124.79 1i7x n GLU 562 Ca -0.03 0.84 0.00 0.00 -0.02 0.00 0.00 57.16 57.95 1i7x n GLU 562 Cb 0.51 -5.21 0.00 0.00 -0.02 0.00 0.00 31.44 26.71 1i7x n GLU 562 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1i7x n GLY 563 N -1.01 2.46 3.77 0.62 0.00 -1.26 -4.55 105.19 105.21 1i7x n GLY 563 Ca -0.19 -0.53 -0.40 0.00 0.00 0.00 0.00 46.02 44.91 1i7x n GLY 563 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i7x s VAL 564 N -0.11 2.81 -0.15 1.61 1.01 -1.03 -4.89 120.40 119.65 1i7x s VAL 564 Ca 0.00 0.75 -0.02 0.00 0.00 0.00 0.00 61.98 62.71 1i7x s VAL 564 Cb 0.00 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 1i7x s VAL 564 CO 0.00 0.13 -0.09 0.00 0.00 0.00 0.00 175.10 175.14 1i7x s ARG 565 N -2.05 3.48 0.41 2.72 1.70 -1.26 0.06 118.95 124.01 1i7x s ARG 565 Ca 0.53 -0.62 0.26 0.00 -0.47 0.00 0.00 55.73 55.44 1i7x s ARG 565 Cb -0.37 -2.77 1.39 0.00 -0.57 0.00 0.00 34.95 32.63 1i7x s ARG 565 CO 0.48 0.18 1.60 0.52 -1.08 0.00 0.00 175.30 176.99 1i7x h MET 566 N 6.86 0.05 -0.65 3.89 2.86 -1.93 0.40 114.93 126.41 1i7x h MET 566 Ca -0.29 -0.00 0.18 0.00 -2.06 0.00 0.00 59.70 57.52 1i7x h MET 566 Cb 1.20 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 32.82 1i7x h MET 566 CO 0.59 0.04 0.46 0.93 1.06 0.00 0.00 176.91 179.98 1i7x h GLU 567 N 0.05 0.06 -0.10 1.72 5.08 -1.95 0.38 114.58 119.82 1i7x h GLU 567 Ca 0.84 -0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 59.17 1i7x h GLU 567 Cb 2.47 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 31.70 1i7x h GLU 567 CO -0.57 0.04 -0.06 0.93 -1.00 0.00 0.00 179.01 178.35 1i7x h GLU 568 N 0.06 0.23 0.00 2.33 5.08 -0.61 -1.79 114.58 119.87 1i7x h GLU 568 Ca 0.31 -0.10 -0.01 0.00 -1.00 0.00 0.00 59.36 58.56 1i7x h GLU 568 Cb 1.15 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 1i7x h GLU 568 CO -0.02 0.59 -0.04 0.82 -1.00 0.00 0.00 179.01 179.36 1i7x h ILE 569 N -0.14 0.84 0.50 3.13 1.08 -0.44 0.59 117.51 123.06 1i7x h ILE 569 Ca 0.02 -0.13 -0.02 0.00 -0.39 0.00 0.00 64.86 64.33 1i7x h ILE 569 Cb 0.53 1.08 0.00 0.00 -3.07 0.00 0.00 36.82 35.36 1i7x h ILE 569 CO 0.02 0.04 -0.24 0.58 -0.69 0.00 0.00 178.15 177.86 1i7x h VAL 570 N 0.00 0.17 -0.32 1.67 2.07 -0.39 -1.37 116.25 118.08 1i7x h VAL 570 Ca -0.00 -0.52 0.05 0.00 0.82 0.00 0.00 66.70 67.05 1i7x h VAL 570 Cb 0.07 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.06 1i7x h VAL 570 CO 0.00 0.03 0.03 -0.08 0.02 0.00 0.00 177.57 177.58 1i7x h GLU 571 N -1.11 0.13 0.00 1.57 4.81 -0.87 -0.24 114.58 118.87 1i7x h GLU 571 Ca -0.07 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.18 1i7x h GLU 571 Cb 0.57 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.88 1i7x h GLU 571 CO 0.11 0.09 -0.21 0.78 -0.73 0.00 0.00 179.01 179.05 1i7x h GLY 572 N 0.13 -0.30 0.99 1.92 0.00 0.13 0.14 103.07 106.08 1i7x h GLY 572 Ca 0.15 0.25 -0.07 0.00 0.00 0.00 0.00 47.33 47.67 1i7x h GLY 572 CO -0.23 -0.19 0.03 0.00 0.00 0.00 0.00 176.54 176.16 1i7x h THR 574 N 0.70 1.23 -0.62 0.00 2.02 -0.90 -2.15 112.91 113.19 1i7x h THR 574 Ca 0.14 -0.88 -0.08 0.00 0.77 0.00 0.00 66.41 66.36 1i7x h THR 574 Cb 0.46 0.78 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1i7x h THR 574 CO 0.02 0.32 0.07 1.23 0.37 0.00 0.00 175.52 177.53 1i7x h GLY 575 N 0.96 1.11 2.00 2.16 0.00 -0.39 -0.53 103.07 108.37 1i7x h GLY 575 Ca 0.16 -0.75 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1i7x h GLY 575 CO 0.01 0.69 -0.03 0.00 0.00 0.00 0.00 176.54 177.21 1i7x h ALA 576 N 1.11 1.00 0.00 3.60 0.00 -0.91 -2.39 119.26 121.66 1i7x h ALA 576 Ca 0.19 -0.03 -0.19 0.00 0.00 0.00 0.00 54.91 54.87 1i7x h ALA 576 Cb 0.46 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1i7x h ALA 576 CO 0.02 0.04 -1.09 -0.07 0.00 0.00 0.00 179.25 178.15 1i7x h LEU 577 N 0.00 0.00 -0.37 0.00 3.38 -0.84 -2.06 115.31 115.43 1i7x h LEU 577 Ca -0.00 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.82 1i7x h LEU 577 Cb 0.65 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1i7x h LEU 577 CO 0.00 0.78 -0.37 -0.74 0.09 0.00 0.00 178.44 178.21 1i7x h HIS 578 N 0.00 1.08 0.00 1.13 2.76 -0.64 0.66 115.15 120.14 1i7x h HIS 578 Ca -0.09 -0.32 -0.09 0.00 -2.20 0.00 0.00 60.37 57.66 1i7x h HIS 578 Cb 1.68 -0.23 -0.01 0.00 1.55 0.00 0.00 27.41 30.40 1i7x h HIS 578 CO 0.00 1.14 -0.65 0.82 -1.30 0.00 0.00 177.93 177.94 1i7x h ILE 579 N 0.71 0.55 0.01 6.26 1.08 -1.54 -3.16 117.51 121.42 1i7x h ILE 579 Ca 0.06 -1.84 -0.21 0.00 -0.39 0.00 0.00 64.86 62.48 1i7x h ILE 579 Cb 0.96 2.18 -0.01 0.00 -3.07 0.00 0.00 36.82 36.88 1i7x h ILE 579 CO 0.09 0.32 -0.91 0.25 -0.69 0.00 0.00 178.15 177.20 1i7x h LEU 580 N 0.00 0.37 -1.03 1.44 5.85 -1.13 -3.23 115.31 117.58 1i7x h LEU 580 Ca -0.04 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1i7x h LEU 580 Cb 1.32 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1i7x h LEU 580 CO 0.04 1.10 0.00 0.00 -0.34 0.00 0.00 178.44 179.25 1i7x n ALA 581 N -2.49 1.39 0.22 1.25 0.00 0.23 -2.89 120.51 118.22 1i7x n ALA 581 Ca -0.05 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.51 1i7x n ALA 581 Cb 0.82 -1.00 0.01 0.00 0.00 0.00 0.00 19.45 19.28 1i7x n ALA 581 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1i7x n ARG 582 N 0.39 0.52 -3.53 0.00 1.74 -1.22 -4.68 116.66 109.89 1i7x n ARG 582 Ca 0.00 0.06 -0.37 0.00 -0.77 0.00 0.00 57.85 56.77 1i7x n ARG 582 Cb 0.07 -1.74 -0.08 0.00 -1.02 0.00 0.00 32.46 29.68 1i7x n ARG 582 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1i7x s ASP 583 N -4.90 6.30 0.27 0.55 2.15 -1.14 -4.98 116.67 114.91 1i7x s ASP 583 Ca 0.00 0.34 -0.01 0.00 0.43 0.00 0.00 52.55 53.32 1i7x s ASP 583 Cb 0.11 -2.17 0.58 0.00 -0.30 0.00 0.00 42.92 41.14 1i7x s ASP 583 CO 0.80 0.02 1.70 1.62 -0.17 0.00 0.00 175.17 179.13 1i7x h VAL 584 N 4.96 0.53 -0.79 1.11 3.04 -1.92 0.29 116.25 123.48 1i7x h VAL 584 Ca -0.38 -0.13 -0.03 0.00 -1.01 0.00 0.00 66.70 65.15 1i7x h VAL 584 Cb 1.16 0.12 -0.04 0.00 -2.01 0.00 0.00 31.29 30.53 1i7x h VAL 584 CO 0.70 0.07 0.36 0.45 -1.01 0.00 0.00 177.57 178.14 1i7x h HIS 585 N 0.37 1.15 -0.34 3.17 3.86 -1.97 -1.49 115.15 119.90 1i7x h HIS 585 Ca 0.48 -0.06 -0.15 0.00 -1.16 0.00 0.00 60.37 59.47 1i7x h HIS 585 Cb 0.84 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 28.95 1i7x h HIS 585 CO -0.19 0.85 -0.40 -0.91 0.86 0.00 0.00 177.93 178.14 1i7x h ASN 586 N 1.13 0.88 -0.83 2.45 2.35 -1.12 -2.31 115.58 118.13 1i7x h ASN 586 Ca 0.27 -0.40 0.05 0.00 -0.55 0.00 0.00 56.30 55.67 1i7x h ASN 586 Cb 0.15 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.22 1i7x h ASN 586 CO -0.03 1.17 0.54 0.03 -1.65 0.00 0.00 177.43 177.49 1i7x h ARG 587 N 0.67 0.92 -0.14 0.81 3.08 0.10 0.51 114.38 120.33 1i7x h ARG 587 Ca 0.05 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1i7x h ARG 587 Cb 0.97 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.81 1i7x h ARG 587 CO 0.09 0.61 0.04 0.82 -1.07 0.00 0.00 179.97 180.46 1i7x h ILE 588 N 0.95 1.19 0.12 2.04 2.04 -1.03 -1.32 117.51 121.49 1i7x h ILE 588 Ca 0.35 -0.60 -0.01 0.00 1.00 0.00 0.00 64.86 65.61 1i7x h ILE 588 Cb 0.16 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.57 1i7x h ILE 588 CO -0.12 0.18 -0.06 0.58 0.00 0.00 0.00 178.15 178.73 1i7x h VAL 589 N 0.04 0.94 -0.83 1.67 2.07 -0.73 0.42 116.25 119.82 1i7x h VAL 589 Ca 0.04 -0.20 0.10 0.00 0.82 0.00 0.00 66.70 67.47 1i7x h VAL 589 Cb 0.24 1.06 -0.07 0.00 -1.52 0.00 0.00 31.29 31.00 1i7x h VAL 589 CO -0.00 0.05 0.47 0.40 0.02 0.00 0.00 177.57 178.51 1i7x h ILE 590 N -0.25 0.89 -0.29 4.57 2.04 -0.95 -1.33 117.51 122.19 1i7x h ILE 590 Ca -0.02 -0.27 -0.14 0.00 1.00 0.00 0.00 64.86 65.44 1i7x h ILE 590 Cb 0.20 0.05 -0.00 0.00 -0.74 0.00 0.00 36.82 36.33 1i7x h ILE 590 CO 0.03 0.14 -0.37 -0.09 0.00 0.00 0.00 178.15 177.85 1i7x h ARG 591 N 0.77 0.77 0.00 2.37 2.43 -0.90 -3.06 114.38 116.77 1i7x h ARG 591 Ca 0.40 -0.44 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1i7x h ARG 591 Cb 0.39 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1i7x h ARG 591 CO -0.26 1.07 0.00 0.78 -1.51 0.00 0.00 179.97 180.05 1i7x h GLY 592 N 0.53 0.00 -0.96 2.80 0.00 0.91 -1.64 103.07 104.72 1i7x h GLY 592 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 1i7x h GLY 592 CO 0.09 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.67 1i7x n LEU 593 N -2.35 1.38 -3.49 3.11 4.77 -0.73 -4.90 117.00 114.79 1i7x n LEU 593 Ca -0.00 -0.69 -0.20 0.00 -0.03 0.00 0.00 56.01 55.09 1i7x n LEU 593 Cb 0.12 -0.19 0.06 0.00 -2.33 0.00 0.00 43.42 41.07 1i7x n LEU 593 CO 0.15 0.32 0.01 -3.20 -1.33 0.00 0.00 177.39 173.34 1i7x n ASN 594 N 0.19 -3.50 -0.04 -1.43 5.15 -0.62 -4.93 115.26 110.09 1i7x n ASN 594 Ca 0.08 -0.76 0.02 0.00 -0.60 0.00 0.00 54.58 53.32 1i7x n ASN 594 Cb 0.23 -4.61 -0.16 0.00 -0.53 0.00 0.00 39.78 34.72 1i7x n ASN 594 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1i7x n THR 595 N -3.92 0.65 -0.15 -0.44 -2.24 -1.25 -4.62 114.28 102.31 1i7x n THR 595 Ca -0.21 -0.66 -0.08 0.00 -2.27 0.00 0.00 64.05 60.84 1i7x n THR 595 Cb 0.65 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.61 1i7x n THR 595 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1i7x h ILE 596 N 0.00 0.16 -0.80 2.28 2.04 -1.85 -0.90 117.51 118.44 1i7x h ILE 596 Ca -0.23 0.00 0.15 0.00 1.00 0.00 0.00 64.86 65.78 1i7x h ILE 596 Cb 1.54 0.16 -0.10 0.00 -0.74 0.00 0.00 36.82 37.68 1i7x h ILE 596 CO 0.02 0.00 0.36 1.55 0.00 0.00 0.00 178.15 180.08 1i7x h PRO 597 N -0.26 0.50 0.08 2.37 0.13 -1.95 -1.47 132.00 131.39 1i7x h PRO 597 Ca 0.17 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1i7x h PRO 597 Cb 0.56 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.58 1i7x h PRO 597 CO -0.59 0.33 -0.04 1.25 -0.23 0.00 0.00 178.00 178.72 1i7x h LEU 598 N 0.51 -0.09 -0.50 1.56 5.85 -1.50 -2.27 115.31 118.88 1i7x h LEU 598 Ca 0.45 -0.09 0.10 0.00 0.84 0.00 0.00 57.88 59.18 1i7x h LEU 598 Cb 0.67 0.02 -0.10 0.00 0.37 0.00 0.00 40.66 41.63 1i7x h LEU 598 CO -0.40 0.03 -0.14 -0.26 -0.34 0.00 0.00 178.44 177.34 1i7x h PHE 599 N -0.20 -0.30 -0.41 1.25 0.04 -0.44 -0.43 116.94 116.45 1i7x h PHE 599 Ca -0.01 0.05 0.08 0.00 2.80 0.00 0.00 57.97 60.88 1i7x h PHE 599 Cb 0.17 0.21 -0.07 0.00 2.20 0.00 0.00 35.95 38.46 1i7x h PHE 599 CO -0.04 -0.23 -0.03 0.28 -0.60 0.00 0.00 178.31 177.69 1i7x h VAL 600 N -0.02 0.66 -0.91 -0.55 2.07 -1.16 -0.03 116.25 116.31 1i7x h VAL 600 Ca 0.24 -0.02 0.16 0.00 0.82 0.00 0.00 66.70 67.89 1i7x h VAL 600 Cb 0.38 0.58 -0.10 0.00 -1.52 0.00 0.00 31.29 30.64 1i7x h VAL 600 CO -0.52 0.01 0.51 1.56 0.02 0.00 0.00 177.57 179.15 1i7x h GLN 601 N 0.07 0.67 0.00 1.57 1.08 -0.52 0.20 115.11 118.18 1i7x h GLN 601 Ca 0.20 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.36 1i7x h GLN 601 Cb 0.29 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.57 1i7x h GLN 601 CO -0.36 0.45 -0.01 -0.07 -0.95 0.00 0.00 178.83 177.89 1i7x h LEU 602 N 0.69 0.00 -1.74 1.46 3.38 0.12 0.50 115.31 119.73 1i7x h LEU 602 Ca 0.50 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.44 1i7x h LEU 602 Cb 0.72 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.47 1i7x h LEU 602 CO -0.36 0.01 -0.15 -0.07 0.09 0.00 0.00 178.44 177.95 1i7x h LEU 603 N 0.00 0.00 -0.20 1.67 3.38 -0.39 0.14 115.31 119.91 1i7x h LEU 603 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1i7x h LEU 603 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1i7x h LEU 603 CO 0.00 0.15 0.00 -1.22 0.09 0.00 0.00 178.44 177.46 1i7x n TYR 604 N -4.24 0.07 -2.52 1.13 0.53 0.17 -4.85 117.16 107.45 1i7x n TYR 604 Ca -0.02 -0.04 -0.35 0.00 -1.02 0.00 0.00 57.90 56.47 1i7x n TYR 604 Cb 0.22 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 38.50 1i7x n TYR 604 CO 0.00 0.00 0.00 0.45 -1.02 0.00 0.00 176.86 176.29 1i7x s SER 605 N -1.02 6.41 0.23 7.72 0.15 0.48 -4.95 113.70 122.73 1i7x s SER 605 Ca 0.05 1.99 0.14 0.00 0.70 0.00 0.00 55.95 58.82 1i7x s SER 605 Cb 0.02 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1i7x s SER 605 CO 0.03 -0.73 1.36 1.55 1.20 0.00 0.00 173.24 176.65 1i7x h PRO 606 N 1.81 0.00 -6.60 5.44 0.13 -1.89 -3.45 132.00 127.45 1i7x h PRO 606 Ca -0.49 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.08 1i7x h PRO 606 Cb 1.22 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.29 1i7x h PRO 606 CO 0.60 0.56 1.00 0.42 -0.23 0.00 0.00 178.00 180.35 1i7x s ILE 607 N -2.92 4.03 0.29 -3.56 1.01 -1.26 -4.93 121.20 113.87 1i7x s ILE 607 Ca 0.03 1.00 0.01 0.00 0.00 0.00 0.00 60.65 61.69 1i7x s ILE 607 Cb 0.08 -4.50 0.36 0.00 0.01 0.00 0.00 42.46 38.41 1i7x s ILE 607 CO 0.76 -1.03 1.60 -0.33 0.00 0.00 0.00 174.94 175.95 1i7x h GLU 608 N 9.96 0.08 -0.87 2.79 5.08 -1.99 0.09 114.58 129.73 1i7x h GLU 608 Ca -0.25 -0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.11 1i7x h GLU 608 Cb 1.08 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 30.26 1i7x h GLU 608 CO 1.14 0.05 0.58 -0.91 -1.00 0.00 0.00 179.01 178.87 1i7x h ASN 609 N 0.08 1.00 0.09 1.42 2.35 -1.98 0.38 115.58 118.92 1i7x h ASN 609 Ca 0.57 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 56.28 1i7x h ASN 609 Cb 1.16 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 39.28 1i7x h ASN 609 CO -0.79 0.73 -0.04 0.40 -1.65 0.00 0.00 177.43 176.07 1i7x h ILE 610 N 1.18 1.08 -0.81 2.81 2.04 -1.42 -1.54 117.51 120.85 1i7x h ILE 610 Ca 0.32 -0.62 0.20 0.00 1.00 0.00 0.00 64.86 65.75 1i7x h ILE 610 Cb -0.14 1.48 -0.14 0.00 -0.74 0.00 0.00 36.82 37.29 1i7x h ILE 610 CO -0.07 0.15 0.11 1.56 0.00 0.00 0.00 178.15 179.91 1i7x h GLN 611 N -0.40 0.15 0.49 2.37 4.20 -0.54 0.13 115.11 121.51 1i7x h GLN 611 Ca -0.01 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 1i7x h GLN 611 Cb 0.34 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1i7x h GLN 611 CO 0.02 0.10 -0.39 -0.09 -0.67 0.00 0.00 178.83 177.80 1i7x h ARG 612 N 0.16 -0.84 -0.13 1.46 2.43 0.29 -0.84 114.38 116.92 1i7x h ARG 612 Ca 0.47 0.06 -0.09 0.00 -0.81 0.00 0.00 59.98 59.61 1i7x h ARG 612 Cb 0.89 0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 30.62 1i7x h ARG 612 CO -0.66 -0.56 -0.32 -0.39 -1.51 0.00 0.00 179.97 176.54 1i7x h VAL 613 N -0.87 1.27 0.31 0.20 -1.51 -0.37 0.28 116.25 115.56 1i7x h VAL 613 Ca -0.05 -1.29 -0.02 0.00 -1.23 0.00 0.00 66.70 64.11 1i7x h VAL 613 Cb 0.74 1.52 0.00 0.00 -2.13 0.00 0.00 31.29 31.43 1i7x h VAL 613 CO -0.01 0.39 -0.15 0.00 -1.23 0.00 0.00 177.57 176.57 1i7x h ALA 614 N 1.45 -0.42 -0.60 5.19 0.00 -0.67 0.31 119.26 124.52 1i7x h ALA 614 Ca 0.03 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1i7x h ALA 614 Cb 0.68 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1i7x h ALA 614 CO 0.05 -0.65 0.30 0.00 0.00 0.00 0.00 179.25 178.96 1i7x h ALA 615 N 0.02 1.40 -0.28 0.00 0.00 -1.03 -0.95 119.26 118.42 1i7x h ALA 615 Ca -0.04 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1i7x h ALA 615 Cb 0.44 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1i7x h ALA 615 CO 0.07 0.48 0.06 0.78 0.00 0.00 0.00 179.25 180.64 1i7x h GLY 616 N 0.92 0.48 1.66 0.00 0.00 -0.04 0.10 103.07 106.20 1i7x h GLY 616 Ca 0.21 -0.31 -0.13 0.00 0.00 0.00 0.00 47.33 47.10 1i7x h GLY 616 CO -0.03 0.29 -0.46 -0.24 0.00 0.00 0.00 176.54 176.10 1i7x h VAL 617 N 0.27 1.32 -0.68 4.60 3.04 -0.21 -2.33 116.25 122.27 1i7x h VAL 617 Ca 0.08 -1.65 -0.04 0.00 -1.01 0.00 0.00 66.70 64.09 1i7x h VAL 617 Cb 0.31 1.71 -0.03 0.00 -2.01 0.00 0.00 31.29 31.27 1i7x h VAL 617 CO 0.00 0.50 0.27 -0.07 -1.01 0.00 0.00 177.57 177.26 1i7x h LEU 618 N 0.30 0.92 -0.33 3.16 3.38 -0.88 -1.84 115.31 120.02 1i7x h LEU 618 Ca 0.02 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1i7x h LEU 618 Cb 0.92 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1i7x h LEU 618 CO 0.08 0.82 0.10 0.00 0.09 0.00 0.00 178.44 179.53 1i7x h GLU 620 N 0.39 0.89 -0.02 0.00 4.39 -1.04 -3.05 114.58 116.13 1i7x h GLU 620 Ca 0.11 -0.12 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 1i7x h GLU 620 Cb 0.26 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.75 1i7x h GLU 620 CO -0.00 0.71 -0.12 -0.07 -1.16 0.00 0.00 179.01 178.37 1i7x h LEU 621 N 0.88 0.14 0.00 1.33 3.38 -1.17 -3.23 115.31 116.64 1i7x h LEU 621 Ca 0.22 -0.67 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1i7x h LEU 621 Cb 0.12 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1i7x h LEU 621 CO -0.03 0.79 0.02 0.00 0.09 0.00 0.00 178.44 179.32 1i7x n ALA 622 N -2.47 1.11 1.91 1.53 0.00 0.07 -1.72 120.51 120.94 1i7x n ALA 622 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.47 1i7x n ALA 622 Cb 0.40 -0.80 0.69 0.00 0.00 0.00 0.00 19.45 19.73 1i7x n ALA 622 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i7x n GLN 623 N -1.02 0.96 -5.03 0.00 10.64 -1.20 -4.32 117.38 117.40 1i7x n GLN 623 Ca 0.00 0.00 -0.29 0.00 -1.83 0.00 0.00 57.00 54.88 1i7x n GLN 623 Cb 0.02 -1.38 -0.17 0.00 -0.86 0.00 0.00 30.24 27.86 1i7x n GLN 623 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1i7x s ASP 624 N -1.77 2.65 0.00 2.61 1.01 -0.70 -5.03 116.67 115.45 1i7x s ASP 624 Ca 0.35 -0.46 0.00 0.00 0.71 0.00 0.00 52.55 53.14 1i7x s ASP 624 Cb 0.16 -1.08 0.00 0.00 1.01 0.00 0.00 42.92 43.00 1i7x s ASP 624 CO 0.27 0.14 0.93 1.17 0.21 0.00 0.00 175.17 177.89 1i7x n LYS 625 N 3.46 0.00 -0.28 8.23 4.81 -1.26 0.87 118.16 133.99 1i7x n LYS 625 Ca -0.20 0.86 -0.02 0.00 -0.87 0.00 0.00 58.31 58.09 1i7x n LYS 625 Cb 0.53 -1.43 0.04 0.00 0.02 0.00 0.00 35.03 34.19 1i7x n LYS 625 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1i7x h GLU 626 N 0.00 -0.07 0.13 1.64 3.07 -1.96 0.21 114.58 117.60 1i7x h GLU 626 Ca 0.00 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.88 1i7x h GLU 626 Cb 0.00 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 27.89 1i7x h GLU 626 CO 0.00 -0.05 -0.31 0.00 -1.40 0.00 0.00 179.01 177.25 1i7x h ALA 627 N 1.31 -0.55 -0.58 3.43 0.00 -1.73 0.26 119.26 121.40 1i7x h ALA 627 Ca 0.31 -0.05 0.12 0.00 0.00 0.00 0.00 54.91 55.28 1i7x h ALA 627 Cb 0.58 0.51 -0.11 0.00 0.00 0.00 0.00 17.79 18.77 1i7x h ALA 627 CO -0.82 -0.86 -0.16 0.00 0.00 0.00 0.00 179.25 177.40 1i7x h ALA 628 N 0.10 0.34 -0.19 0.00 0.00 0.34 0.11 119.26 119.96 1i7x h ALA 628 Ca 0.03 0.22 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1i7x h ALA 628 Cb 0.57 0.48 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 1i7x h ALA 628 CO -0.18 -0.45 -0.49 1.05 0.00 0.00 0.00 179.25 179.18 1i7x h GLU 629 N -0.02 0.53 -0.94 0.00 4.11 -0.31 0.22 114.58 118.17 1i7x h GLU 629 Ca 0.28 -0.31 0.03 0.00 0.07 0.00 0.00 59.36 59.43 1i7x h GLU 629 Cb 0.44 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.67 1i7x h GLU 629 CO -0.61 0.90 0.62 0.00 0.07 0.00 0.00 179.01 179.99 1i7x h ALA 630 N 1.05 1.38 0.29 1.06 0.00 0.68 0.67 119.26 124.38 1i7x h ALA 630 Ca 0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1i7x h ALA 630 Cb 1.01 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1i7x h ALA 630 CO 0.09 0.54 -0.14 0.82 0.00 0.00 0.00 179.25 180.57 1i7x h ILE 631 N 1.21 0.73 -0.68 0.00 2.04 -0.48 -2.08 117.51 118.25 1i7x h ILE 631 Ca 0.37 -0.61 0.13 0.00 1.00 0.00 0.00 64.86 65.75 1i7x h ILE 631 Cb -0.03 1.04 -0.09 0.00 -0.74 0.00 0.00 36.82 37.00 1i7x h ILE 631 CO -0.10 0.12 0.20 -0.08 0.00 0.00 0.00 178.15 178.28 1i7x h GLU 632 N -0.73 0.31 0.00 2.37 4.81 -0.35 0.34 114.58 121.33 1i7x h GLU 632 Ca -0.04 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1i7x h GLU 632 Cb 0.49 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.80 1i7x h GLU 632 CO 0.06 0.21 0.00 0.00 -0.73 0.00 0.00 179.01 178.55 1i7x h ALA 633 N 1.53 1.00 -0.00 2.92 0.00 0.45 -1.16 119.26 124.00 1i7x h ALA 633 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1i7x h ALA 633 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1i7x h ALA 633 CO -0.43 0.00 -0.17 -1.91 0.00 0.00 0.00 179.25 176.74 1i7x n GLU 634 N -2.77 0.13 -0.77 0.00 4.07 0.12 -4.91 120.64 116.50 1i7x n GLU 634 Ca -0.01 -0.04 0.00 0.00 -0.06 0.00 0.00 57.16 57.05 1i7x n GLU 634 Cb 0.14 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.02 1i7x n GLU 634 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1i7x n GLY 635 N 1.46 0.99 0.16 8.31 0.00 -0.44 -4.97 105.19 110.71 1i7x n GLY 635 Ca 0.08 -0.48 0.03 0.00 0.00 0.00 0.00 46.02 45.66 1i7x n GLY 635 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i7x h ALA 636 N 0.00 0.87 -0.58 4.61 0.00 -1.69 -3.28 119.26 119.19 1i7x h ALA 636 Ca 0.00 -0.44 0.12 0.00 0.00 0.00 0.00 54.91 54.59 1i7x h ALA 636 Cb 0.28 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 17.89 1i7x h ALA 636 CO 0.00 0.60 -0.06 1.15 0.00 0.00 0.00 179.25 180.95 1i7x h THR 637 N 0.00 0.48 0.60 0.00 2.02 -1.84 -0.47 112.91 113.71 1i7x h THR 637 Ca -0.00 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 1i7x h THR 637 Cb 1.09 0.41 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 1i7x h THR 637 CO 0.06 0.01 -0.35 0.00 0.37 0.00 0.00 175.52 175.62 1i7x h ALA 638 N 1.55 -1.19 -0.49 6.16 0.00 -1.95 -2.37 119.26 120.96 1i7x h ALA 638 Ca 0.29 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1i7x h ALA 638 Cb 0.46 0.44 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 1i7x h ALA 638 CO -0.54 -1.15 0.26 -1.00 0.00 0.00 0.00 179.25 176.82 1i7x h PRO 639 N -0.88 0.49 -0.52 0.00 0.13 -1.69 -2.61 132.00 126.92 1i7x h PRO 639 Ca -0.08 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 65.08 1i7x h PRO 639 Cb 0.70 -0.11 -0.05 0.00 0.13 0.00 0.00 31.00 31.66 1i7x h PRO 639 CO 0.10 0.33 0.24 -0.07 -0.23 0.00 0.00 178.00 178.36 1i7x h LEU 640 N 0.51 0.31 -0.62 1.56 3.38 -1.15 -0.77 115.31 118.53 1i7x h LEU 640 Ca 0.21 0.04 0.12 0.00 0.09 0.00 0.00 57.88 58.34 1i7x h LEU 640 Cb 0.10 -0.01 -0.12 0.00 0.09 0.00 0.00 40.66 40.72 1i7x h LEU 640 CO -0.14 0.21 -0.27 0.74 0.09 0.00 0.00 178.44 179.08 1i7x h THR 641 N 0.45 0.23 0.00 0.22 2.02 -1.03 0.28 112.91 115.09 1i7x h THR 641 Ca 0.24 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.36 1i7x h THR 641 Cb 0.20 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1i7x h THR 641 CO -0.20 0.00 -0.29 -0.08 0.37 0.00 0.00 175.52 175.32 1i7x h GLU 642 N -0.10 0.00 0.00 6.66 4.81 -1.28 -2.22 114.58 122.44 1i7x h GLU 642 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1i7x h GLU 642 Cb 0.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.91 1i7x h GLU 642 CO -0.68 0.29 0.00 1.28 -0.73 0.00 0.00 179.01 179.17 1i7x n LEU 643 N -3.60 0.00 0.09 1.64 4.77 0.95 -1.96 117.00 118.88 1i7x n LEU 643 Ca -0.01 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.86 1i7x n LEU 643 Cb 0.42 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.40 1i7x n LEU 643 CO 0.35 0.00 0.06 -0.07 -1.33 0.00 0.00 177.39 176.40 1i7x h LEU 644 N 0.00 0.24 -2.93 2.23 3.38 -1.05 -3.13 115.31 114.05 1i7x h LEU 644 Ca 0.00 -0.25 -0.24 0.00 0.09 0.00 0.00 57.88 57.48 1i7x h LEU 644 Cb 0.00 -0.08 -0.14 0.00 0.09 0.00 0.00 40.66 40.53 1i7x h LEU 644 CO 0.00 1.18 0.31 1.41 0.09 0.00 0.00 178.44 181.42 1i7x n HIS 645 N -3.48 1.46 -3.01 1.13 8.25 -0.83 -4.82 115.22 113.92 1i7x n HIS 645 Ca -0.05 -1.12 -0.37 0.00 -0.26 0.00 0.00 57.72 55.92 1i7x n HIS 645 Cb 0.96 -0.58 -0.06 0.00 1.12 0.00 0.00 29.99 31.44 1i7x n HIS 645 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1i7x s SER 646 N -0.10 7.21 0.35 0.41 0.15 -1.18 -4.95 113.70 115.58 1i7x s SER 646 Ca 0.27 1.56 0.27 0.00 0.70 0.00 0.00 55.95 58.75 1i7x s SER 646 Cb 0.23 -2.47 1.04 0.00 -1.71 0.00 0.00 66.02 63.11 1i7x s SER 646 CO 0.05 0.07 1.79 0.08 1.20 0.00 0.00 173.24 176.44 1i7x h ARG 647 N 3.66 0.00 -5.80 5.44 0.11 -1.91 -3.43 114.38 112.45 1i7x h ARG 647 Ca -0.47 0.00 -0.61 0.00 0.10 0.00 0.00 59.98 58.99 1i7x h ARG 647 Cb 1.20 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 32.16 1i7x h ARG 647 CO 0.65 0.00 0.38 1.21 0.10 0.00 0.00 179.97 182.31 1i7x s ASN 648 N -4.81 6.52 0.10 0.08 3.84 -1.26 -4.97 114.94 114.45 1i7x s ASN 648 Ca 0.04 0.26 -0.27 0.00 0.21 0.00 0.00 52.86 53.11 1i7x s ASN 648 Cb 0.09 -2.40 -0.09 0.00 -0.55 0.00 0.00 41.25 38.30 1i7x s ASN 648 CO 0.48 -0.78 1.44 -0.33 -2.79 0.00 0.00 177.10 175.12 1i7x h GLU 649 N 8.59 -0.35 -0.50 0.43 4.39 -2.00 -1.11 114.58 124.02 1i7x h GLU 649 Ca -0.25 0.02 0.10 0.00 0.34 0.00 0.00 59.36 59.58 1i7x h GLU 649 Cb 1.09 0.08 -0.09 0.00 -0.10 0.00 0.00 28.75 29.73 1i7x h GLU 649 CO 0.92 -0.24 -0.07 0.78 -1.16 0.00 0.00 179.01 179.25 1i7x h GLY 650 N -0.37 0.43 0.40 -3.84 0.00 -1.97 -0.79 103.07 96.94 1i7x h GLY 650 Ca 0.05 0.12 0.04 0.00 0.00 0.00 0.00 47.33 47.54 1i7x h GLY 650 CO -0.43 -0.17 -0.23 -2.08 0.00 0.00 0.00 176.54 173.62 1i7x h VAL 651 N 0.05 0.46 -0.13 4.60 2.07 -1.76 -1.05 116.25 120.48 1i7x h VAL 651 Ca 0.25 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.78 1i7x h VAL 651 Cb 0.38 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1i7x h VAL 651 CO -0.48 0.00 0.04 0.00 0.02 0.00 0.00 177.57 177.16 1i7x h ALA 652 N 0.57 0.14 -0.28 1.67 0.00 -0.74 -1.33 119.26 119.29 1i7x h ALA 652 Ca 0.08 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.07 1i7x h ALA 652 Cb 0.44 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.16 1i7x h ALA 652 CO -0.24 -0.40 -0.25 1.15 0.00 0.00 0.00 179.25 179.51 1i7x h THR 653 N 0.11 0.38 -0.57 0.00 2.02 -0.85 0.16 112.91 114.16 1i7x h THR 653 Ca 0.05 0.00 0.06 0.00 0.77 0.00 0.00 66.41 67.29 1i7x h THR 653 Cb 0.03 0.38 -0.05 0.00 -1.74 0.00 0.00 68.15 66.76 1i7x h THR 653 CO -0.06 0.00 0.28 1.88 0.37 0.00 0.00 175.52 178.00 1i7x h TYR 654 N -0.23 0.52 0.37 3.16 0.05 -0.96 0.57 116.97 120.44 1i7x h TYR 654 Ca 0.15 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.94 1i7x h TYR 654 Cb 0.46 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 1i7x h TYR 654 CO -0.42 0.24 -0.34 0.00 -1.05 0.00 0.00 178.16 176.59 1i7x h ALA 655 N 1.31 -1.04 -0.92 3.88 0.00 -0.04 -0.61 119.26 121.84 1i7x h ALA 655 Ca 0.26 -0.13 0.27 0.00 0.00 0.00 0.00 54.91 55.30 1i7x h ALA 655 Cb 0.18 0.55 -0.04 0.00 0.00 0.00 0.00 17.79 18.48 1i7x h ALA 655 CO -0.18 -1.06 0.66 0.00 0.00 0.00 0.00 179.25 178.67 1i7x h ALA 656 N -1.23 2.85 -0.07 0.00 0.00 -0.50 0.08 119.26 120.39 1i7x h ALA 656 Ca -0.05 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1i7x h ALA 656 Cb 0.59 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1i7x h ALA 656 CO -0.02 -1.12 -0.03 0.00 0.00 0.00 0.00 179.25 178.08 1i7x h ALA 657 N 1.54 0.09 0.35 0.00 0.00 0.09 -2.02 119.26 119.31 1i7x h ALA 657 Ca 0.44 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1i7x h ALA 657 Cb 1.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.51 1i7x h ALA 657 CO -0.01 -0.17 -0.17 0.28 0.00 0.00 0.00 179.25 179.19 1i7x h VAL 658 N -0.23 0.67 -1.19 0.00 2.07 0.47 0.71 116.25 118.74 1i7x h VAL 658 Ca 0.02 -0.35 0.34 0.00 0.82 0.00 0.00 66.70 67.52 1i7x h VAL 658 Cb 0.46 0.85 -0.08 0.00 -1.52 0.00 0.00 31.29 30.99 1i7x h VAL 658 CO 0.01 0.07 0.81 -0.07 0.02 0.00 0.00 177.57 178.41 1i7x h LEU 659 N -0.67 0.22 0.01 2.57 3.38 -1.31 0.65 115.31 120.16 1i7x h LEU 659 Ca -0.05 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1i7x h LEU 659 Cb 0.47 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1i7x h LEU 659 CO 0.08 0.00 -0.00 0.15 0.09 0.00 0.00 178.44 178.76 1i7x h PHE 660 N 0.17 -0.01 -0.99 1.13 3.57 -0.74 -3.13 116.94 116.95 1i7x h PHE 660 Ca 0.64 -0.00 0.16 0.00 3.53 0.00 0.00 57.97 62.30 1i7x h PHE 660 Cb 2.09 0.00 -0.09 0.00 2.79 0.00 0.00 35.95 40.74 1i7x h PHE 660 CO -0.00 0.77 0.62 0.00 -2.23 0.00 0.00 178.31 177.46 1i7x h ARG 661 N -0.98 0.82 0.74 1.11 2.47 0.32 0.50 114.38 119.36 1i7x h ARG 661 Ca -0.00 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 58.63 1i7x h ARG 661 Cb 0.78 -0.19 0.01 0.00 -1.65 0.00 0.00 29.97 28.92 1i7x h ARG 661 CO 0.00 0.54 -0.35 0.52 0.56 0.00 0.00 179.97 181.24 1i7x h MET 662 N 0.85 -0.95 0.00 0.04 2.86 0.04 -3.14 114.93 114.63 1i7x h MET 662 Ca 0.53 0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 58.23 1i7x h MET 662 Cb 0.72 0.22 -0.00 0.00 0.06 0.00 0.00 31.60 32.59 1i7x h MET 662 CO -0.31 -0.62 -0.01 0.77 1.06 0.00 0.00 176.91 177.80 1i7x h SER 663 N -1.05 0.00 -1.30 1.22 0.02 -1.39 -3.43 113.55 107.62 1i7x h SER 663 Ca -0.10 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.51 1i7x h SER 663 Cb 0.77 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1i7x h SER 663 CO 0.17 0.01 1.17 -0.70 -1.14 0.00 0.00 176.83 176.34 1i7x s GLU 664 N -3.50 2.02 0.00 3.45 2.56 0.17 -5.09 118.70 118.31 1i7x s GLU 664 Ca 0.03 1.06 0.00 0.00 0.00 0.00 0.00 54.97 56.06 1i7x s GLU 664 Cb 0.08 -4.64 0.00 0.00 2.00 0.00 0.00 34.13 31.57 1i7x s GLU 664 CO 0.59 -3.55 0.38 -0.25 -0.56 0.00 0.00 175.26 171.87