#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qzq s ASN 162 N 0.00 -0.02 0.50 1.61 6.03 -1.26 -5.06 114.94 116.75 1qzq s ASN 162 Ca 0.00 -0.88 0.29 0.00 -1.03 0.00 0.00 52.86 51.24 1qzq s ASN 162 Cb 0.00 0.49 1.23 0.00 -3.03 0.00 0.00 41.25 39.94 1qzq s ASN 162 CO 0.00 -0.98 1.95 1.55 -2.03 0.00 0.00 177.10 177.59 1qzq h PRO 163 N 2.43 0.00 0.00 3.55 0.13 -1.97 -3.03 132.00 133.10 1qzq h PRO 163 Ca -0.30 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.69 1qzq h PRO 163 Cb 1.24 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 1qzq h PRO 163 CO 0.44 0.11 -0.75 0.74 -0.23 0.00 0.00 178.00 178.31 1qzq h PHE 164 N 0.00 0.00 -5.97 1.56 0.04 -1.96 -3.48 116.94 107.13 1qzq h PHE 164 Ca -0.00 0.00 -0.44 0.00 2.80 0.00 0.00 57.97 60.33 1qzq h PHE 164 Cb 0.56 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.74 1qzq h PHE 164 CO 0.00 0.61 -0.71 1.04 -0.60 0.00 0.00 178.31 178.65 1qzq n GLN 165 N -3.19 -6.18 -3.94 1.51 1.13 -1.15 -4.84 117.38 100.73 1qzq n GLN 165 Ca -0.00 0.69 -0.35 0.00 -1.94 0.00 0.00 57.00 55.39 1qzq n GLN 165 Cb 0.79 -5.63 -0.13 0.00 0.11 0.00 0.00 30.24 25.38 1qzq n GLN 165 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 1qzq s PHE 166 N -3.28 3.02 0.23 1.08 2.19 -1.26 -1.93 117.98 118.04 1qzq s PHE 166 Ca 0.60 -0.59 0.05 0.00 0.33 0.00 0.00 56.93 57.32 1qzq s PHE 166 Cb -0.29 -2.13 -0.05 0.00 -1.31 0.00 0.00 43.02 39.24 1qzq s PHE 166 CO 0.75 -0.37 -0.05 0.71 1.83 0.00 0.00 175.22 178.09 1qzq s TYR 167 N 1.31 1.63 0.23 10.12 1.51 0.25 -4.98 117.35 127.42 1qzq s TYR 167 Ca 0.04 -0.80 0.08 0.00 -1.01 0.00 0.00 57.07 55.37 1qzq s TYR 167 Cb -0.15 -0.91 -0.04 0.00 -0.11 0.00 0.00 41.96 40.76 1qzq s TYR 167 CO 0.01 0.10 0.10 -0.51 -1.11 0.00 0.00 175.55 174.14 1qzq s LEU 168 N -3.32 3.55 0.49 -1.29 1.43 -1.26 -0.57 118.68 117.71 1qzq s LEU 168 Ca 0.26 -0.38 -0.18 0.00 -1.03 0.00 0.00 54.13 52.80 1qzq s LEU 168 Cb 0.04 -2.10 -0.09 0.00 0.03 0.00 0.00 46.19 44.07 1qzq s LEU 168 CO 0.08 0.01 0.98 0.42 0.23 0.00 0.00 176.35 178.06 1qzq s THR 169 N -2.09 4.46 0.47 5.49 -4.23 -0.92 -1.04 115.64 117.78 1qzq s THR 169 Ca 0.31 1.28 -0.24 0.00 -1.18 0.00 0.00 61.69 61.86 1qzq s THR 169 Cb -0.08 -3.67 -0.07 0.00 1.34 0.00 0.00 72.50 70.01 1qzq s THR 169 CO 0.22 -0.58 1.35 -0.13 -0.54 0.00 0.00 174.62 174.95 1qzq s ARG 170 N -3.82 3.62 -0.14 3.99 0.52 -0.36 -4.67 118.95 118.09 1qzq s ARG 170 Ca 0.60 2.24 0.02 0.00 -0.52 0.00 0.00 55.73 58.07 1qzq s ARG 170 Cb -0.10 -2.55 0.00 0.00 0.52 0.00 0.00 34.95 32.82 1qzq s ARG 170 CO 0.26 -0.81 -0.20 0.08 0.02 0.00 0.00 175.30 174.65 1qzq s VAL 171 N -1.27 2.27 0.01 3.52 1.01 -1.26 -4.58 120.40 120.09 1qzq s VAL 171 Ca 0.63 -0.91 -0.27 0.00 0.00 0.00 0.00 61.98 61.42 1qzq s VAL 171 Cb -0.40 -1.92 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1qzq s VAL 171 CO 0.50 0.54 0.87 -0.44 0.00 0.00 0.00 175.10 176.57 1qzq s SER 172 N 0.73 7.26 0.00 3.32 0.01 -0.59 -3.84 113.70 120.59 1qzq s SER 172 Ca -0.08 1.52 0.00 0.00 1.31 0.00 0.00 55.95 58.70 1qzq s SER 172 Cb -0.16 -2.51 0.00 0.00 0.21 0.00 0.00 66.02 63.56 1qzq s SER 172 CO 0.00 -0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.12 1qzq n GLY 173 N 2.77 0.67 3.62 3.44 0.00 -1.26 -4.78 105.19 109.65 1qzq n GLY 173 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.80 1qzq n GLY 173 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qzq s VAL 174 N -2.00 2.85 0.55 1.61 -7.23 -1.25 -5.10 120.40 109.82 1qzq s VAL 174 Ca 0.00 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 57.95 1qzq s VAL 174 Cb 0.00 -2.75 -0.05 0.00 0.56 0.00 0.00 36.38 34.14 1qzq s VAL 174 CO 0.00 -0.27 1.35 -0.54 -0.31 0.00 0.00 175.10 175.33 1qzq s LYS 175 N -3.69 3.14 0.52 4.82 1.02 -1.26 -4.89 119.74 119.41 1qzq s LYS 175 Ca 0.33 2.21 0.26 0.00 0.02 0.00 0.00 55.97 58.80 1qzq s LYS 175 Cb -0.03 -2.25 1.39 0.00 -0.52 0.00 0.00 37.83 36.42 1qzq s LYS 175 CO 0.19 -1.18 1.97 -1.00 -0.92 0.00 0.00 175.35 174.41 1qzq h PRO 176 N 1.45 0.03 0.00 -1.68 0.13 -1.99 -0.62 132.00 129.33 1qzq h PRO 176 Ca -0.51 -0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.60 1qzq h PRO 176 Cb 1.30 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 1qzq h PRO 176 CO 0.57 0.02 -0.09 1.57 -0.23 0.00 0.00 178.00 179.85 1qzq h LYS 177 N 0.03 0.00 -0.00 0.86 2.10 -1.95 -0.63 116.57 116.98 1qzq h LYS 177 Ca 0.30 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.95 1qzq h LYS 177 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 1qzq h LYS 177 CO -0.01 0.09 -0.09 0.66 -2.00 0.00 0.00 179.45 178.10 1qzq n TYR 178 N -3.76 0.00 0.29 0.07 4.01 -0.24 -3.37 117.16 114.16 1qzq n TYR 178 Ca -0.02 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.75 1qzq n TYR 178 Cb 0.19 -0.24 0.02 0.00 -0.31 0.00 0.00 39.34 39.00 1qzq n TYR 178 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1qzq n ASN 179 N -1.12 1.38 -4.64 7.72 3.02 -0.30 -4.74 115.26 116.58 1qzq n ASN 179 Ca 0.14 -1.19 -0.43 0.00 -0.03 0.00 0.00 54.58 53.07 1qzq n ASN 179 Cb 0.27 0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.57 1qzq n ASN 179 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1qzq s SER 180 N -0.73 6.91 0.00 6.41 1.04 -0.86 -1.81 113.70 124.67 1qzq s SER 180 Ca 0.07 1.05 0.00 0.00 0.48 0.00 0.00 55.95 57.55 1qzq s SER 180 Cb 0.06 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.67 1qzq s SER 180 CO 0.11 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.18 1qzq n GLY 181 N 3.80 0.54 3.93 7.32 0.00 -1.26 -5.01 105.19 114.50 1qzq n GLY 181 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1qzq n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qzq s ALA 182 N -2.00 3.76 0.07 4.61 0.00 -0.75 -4.55 121.76 122.89 1qzq s ALA 182 Ca 0.00 -0.85 0.09 0.00 0.00 0.00 0.00 51.96 51.20 1qzq s ALA 182 Cb 0.00 -2.06 -0.03 0.00 0.00 0.00 0.00 23.12 21.03 1qzq s ALA 182 CO 0.00 0.22 -0.25 -0.51 0.00 0.00 0.00 175.76 175.21 1qzq s LEU 183 N -3.79 2.21 0.15 0.00 1.43 -0.20 -4.73 118.68 113.74 1qzq s LEU 183 Ca 0.39 -0.62 0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1qzq s LEU 183 Cb -0.10 -1.19 -0.04 0.00 0.03 0.00 0.00 46.19 44.88 1qzq s LEU 183 CO 0.32 0.21 -0.02 -2.28 0.23 0.00 0.00 176.35 174.81 1qzq s HIS 184 N -0.87 2.84 0.55 0.29 5.65 -1.26 -1.22 115.29 121.27 1qzq s HIS 184 Ca 0.11 -0.13 0.26 0.00 0.25 0.00 0.00 55.06 55.56 1qzq s HIS 184 Cb -0.10 -1.40 1.46 0.00 -1.18 0.00 0.00 32.58 31.36 1qzq s HIS 184 CO 0.03 0.50 2.00 0.97 -0.65 0.00 0.00 174.74 177.59 1qzq h ILE 185 N 2.63 0.62 0.00 0.89 2.10 -1.97 0.24 117.51 122.02 1qzq h ILE 185 Ca -0.47 0.00 -0.09 0.00 1.08 0.00 0.00 64.86 65.37 1qzq h ILE 185 Cb 1.19 0.74 -0.01 0.00 -1.09 0.00 0.00 36.82 37.65 1qzq h ILE 185 CO 0.57 0.00 -0.44 0.11 -1.08 0.00 0.00 178.15 177.31 1qzq h LYS 186 N 0.00 0.00 -0.23 2.19 1.57 -1.95 -1.97 116.57 116.18 1qzq h LYS 186 Ca 0.21 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.80 1qzq h LYS 186 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1qzq h LYS 186 CO -0.00 0.44 -0.59 -0.44 -0.57 0.00 0.00 179.45 178.29 1qzq h ASP 187 N 0.00 0.86 -0.63 0.86 3.32 -0.90 -2.53 116.42 117.41 1qzq h ASP 187 Ca -0.00 -0.48 -0.04 0.00 0.02 0.00 0.00 57.03 56.52 1qzq h ASP 187 Cb 0.83 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.10 1qzq h ASP 187 CO 0.06 1.26 0.22 0.40 -1.72 0.00 0.00 179.24 179.46 1qzq h ILE 188 N 0.58 1.24 -0.00 0.35 2.04 -1.13 -2.88 117.51 117.71 1qzq h ILE 188 Ca 0.00 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 65.07 1qzq h ILE 188 Cb 1.19 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1qzq h ILE 188 CO 0.12 0.31 -0.05 0.18 0.00 0.00 0.00 178.15 178.71 1qzq n LEU 189 N -4.40 0.49 -4.58 1.44 4.77 -0.76 -4.85 117.00 109.11 1qzq n LEU 189 Ca 0.04 -0.07 -0.37 0.00 -0.03 0.00 0.00 56.01 55.58 1qzq n LEU 189 Cb 0.19 -0.10 0.06 0.00 -2.33 0.00 0.00 43.42 41.24 1qzq n LEU 189 CO 0.40 0.09 0.42 -0.24 -1.33 0.00 0.00 177.39 176.72 1qzq n SER 190 N -0.78 0.20 0.29 -1.43 2.88 -0.96 -4.52 113.62 109.30 1qzq n SER 190 Ca 0.18 0.73 0.18 0.00 -1.33 0.00 0.00 58.87 58.63 1qzq n SER 190 Cb 0.24 -1.34 0.82 0.00 -0.75 0.00 0.00 64.21 63.18 1qzq n SER 190 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1qzq h PRO 191 N 0.12 0.00 0.00 -1.46 0.11 -1.91 -1.93 132.00 126.93 1qzq h PRO 191 Ca -0.48 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 1qzq h PRO 191 Cb 1.36 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.47 1qzq h PRO 191 CO 0.48 0.02 -0.10 -0.07 -0.21 0.00 0.00 178.00 178.12 1qzq h LEU 192 N 0.00 0.00 -0.70 2.35 3.38 -1.93 -0.82 115.31 117.59 1qzq h LEU 192 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1qzq h LEU 192 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1qzq h LEU 192 CO 0.00 0.10 0.00 0.49 0.09 0.00 0.00 178.44 179.13 1qzq n PHE 193 N -3.57 0.02 0.00 1.13 3.01 -0.73 -5.01 117.46 112.32 1qzq n PHE 193 Ca -0.02 -0.01 0.00 0.00 1.01 0.00 0.00 57.45 58.43 1qzq n PHE 193 Cb 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.70 1qzq n PHE 193 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1qzq n GLY 194 N 1.11 3.17 3.39 1.37 0.00 -0.31 -5.00 105.19 108.92 1qzq n GLY 194 Ca 0.20 -1.81 -0.45 0.00 0.00 0.00 0.00 46.02 43.96 1qzq n GLY 194 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qzq s THR 195 N -2.03 4.88 0.22 2.61 2.01 -1.26 -4.36 115.64 117.72 1qzq s THR 195 Ca 0.00 -1.33 -0.32 0.00 0.31 0.00 0.00 61.69 60.35 1qzq s THR 195 Cb 0.00 -4.58 -0.14 0.00 0.01 0.00 0.00 72.50 67.79 1qzq s THR 195 CO 0.00 -1.24 1.36 -0.11 -0.69 0.00 0.00 174.62 173.94 1qzq n LEU 196 N 6.12 2.74 -0.01 4.42 7.94 -1.26 -1.90 117.00 135.06 1qzq n LEU 196 Ca 0.03 1.14 -0.01 0.00 -1.11 0.00 0.00 56.01 56.07 1qzq n LEU 196 Cb 0.45 -1.38 -0.01 0.00 0.53 0.00 0.00 43.42 43.02 1qzq n LEU 196 CO 0.53 -0.67 -0.54 0.52 -1.11 0.00 0.00 177.39 176.12 1qzq n VAL 197 N 1.87 0.07 -3.57 1.96 0.31 0.95 -4.87 118.33 115.04 1qzq n VAL 197 Ca 0.13 -0.03 -0.10 0.00 -0.01 0.00 0.00 64.34 64.33 1qzq n VAL 197 Cb 0.30 -0.55 -0.02 0.00 -0.91 0.00 0.00 33.84 32.66 1qzq n VAL 197 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1qzq s SER 198 N -4.12 -0.45 0.16 4.52 0.15 -1.01 -4.34 113.70 108.62 1qzq s SER 198 Ca -0.02 -0.20 -0.21 0.00 0.70 0.00 0.00 55.95 56.22 1qzq s SER 198 Cb 0.00 0.62 0.06 0.00 -1.71 0.00 0.00 66.02 64.99 1qzq s SER 198 CO 0.03 -1.06 0.57 -0.94 1.20 0.00 0.00 173.24 173.04 1qzq s SER 199 N -2.79 -0.47 -0.01 5.45 1.04 -1.07 -0.43 113.70 115.41 1qzq s SER 199 Ca 0.05 -0.12 0.02 0.00 0.48 0.00 0.00 55.95 56.37 1qzq s SER 199 Cb -0.03 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1qzq s SER 199 CO -0.06 -0.98 -0.06 0.00 0.98 0.00 0.00 173.24 173.12 1qzq s ALA 200 N -3.78 0.58 -0.25 5.32 0.00 0.19 -1.79 121.76 122.03 1qzq s ALA 200 Ca 0.02 -0.24 0.02 0.00 0.00 0.00 0.00 51.96 51.77 1qzq s ALA 200 Cb -0.01 -0.19 0.06 0.00 0.00 0.00 0.00 23.12 22.98 1qzq s ALA 200 CO -0.11 0.11 -0.10 -0.65 0.00 0.00 0.00 175.76 175.01 1qzq s GLN 201 N 0.04 2.15 -0.10 0.00 -1.52 0.20 -1.03 119.66 119.41 1qzq s GLN 201 Ca -0.00 -1.23 -0.13 0.00 -1.95 0.00 0.00 55.36 52.05 1qzq s GLN 201 Cb -0.05 -2.79 -0.05 0.00 -0.22 0.00 0.00 33.01 29.90 1qzq s GLN 201 CO -0.00 -0.55 0.32 -0.06 -0.25 0.00 0.00 175.29 174.74 1qzq s PHE 202 N 1.18 3.58 0.13 0.91 0.40 -0.03 -0.78 117.98 123.36 1qzq s PHE 202 Ca -0.07 0.73 -0.24 0.00 -0.60 0.00 0.00 56.93 56.75 1qzq s PHE 202 Cb -0.19 -2.27 0.08 0.00 0.51 0.00 0.00 43.02 41.15 1qzq s PHE 202 CO -0.06 0.46 1.10 1.21 0.70 0.00 0.00 175.22 178.63 1qzq s ASN 203 N -0.30 -0.01 -0.05 1.36 3.84 -0.97 -2.39 114.94 116.42 1qzq s ASN 203 Ca 0.19 -0.53 -0.05 0.00 0.21 0.00 0.00 52.86 52.68 1qzq s ASN 203 Cb -0.14 0.41 -0.02 0.00 -0.55 0.00 0.00 41.25 40.95 1qzq s ASN 203 CO 0.07 -0.80 -0.09 0.00 -2.79 0.00 0.00 177.10 173.49 1qzq n TYR 204 N -0.72 0.10 -4.04 0.43 9.36 -1.24 -4.52 117.16 116.53 1qzq n TYR 204 Ca -0.02 0.05 -0.33 0.00 3.32 0.00 0.00 57.90 60.91 1qzq n TYR 204 Cb 0.59 -0.25 -0.06 0.00 -0.63 0.00 0.00 39.34 38.99 1qzq n TYR 204 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1qzq s PHE 206 N -1.21 0.95 -0.39 0.00 0.40 -1.26 -1.68 117.98 114.80 1qzq s PHE 206 Ca 0.23 -0.53 0.02 0.00 -0.60 0.00 0.00 56.93 56.04 1qzq s PHE 206 Cb -0.12 -0.54 0.15 0.00 0.51 0.00 0.00 43.02 43.02 1qzq s PHE 206 CO 0.14 -0.02 0.26 0.34 0.70 0.00 0.00 175.22 176.64 1qzq s ASP 207 N -1.88 2.58 0.22 1.36 -1.08 -0.88 -4.93 116.67 112.06 1qzq s ASP 207 Ca -0.03 -2.55 -0.08 0.00 -0.52 0.00 0.00 52.55 49.37 1qzq s ASP 207 Cb -0.08 -0.50 0.31 0.00 -1.46 0.00 0.00 42.92 41.20 1qzq s ASP 207 CO 0.01 -0.26 1.76 0.58 0.52 0.00 0.00 175.17 177.78 1qzq h VAL 208 N 4.90 0.80 -0.27 1.11 2.07 -1.90 0.19 116.25 123.16 1qzq h VAL 208 Ca 0.12 -0.17 0.05 0.00 0.82 0.00 0.00 66.70 67.52 1qzq h VAL 208 Cb 0.94 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 1qzq h VAL 208 CO 0.33 0.09 -0.02 0.44 0.02 0.00 0.00 177.57 178.43 1qzq h ASP 209 N 0.50 -0.14 0.23 0.57 3.45 -1.96 0.69 116.42 119.76 1qzq h ASP 209 Ca 0.33 0.07 -0.01 0.00 0.43 0.00 0.00 57.03 57.85 1qzq h ASP 209 Cb 0.39 0.12 0.00 0.00 -0.56 0.00 0.00 39.33 39.28 1qzq h ASP 209 CO -0.29 -0.04 -0.11 -0.25 -1.57 0.00 0.00 179.24 176.98 1qzq h TRP 210 N 0.06 -0.29 -0.22 4.55 7.01 -1.72 -2.81 115.95 122.53 1qzq h TRP 210 Ca 0.13 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.18 1qzq h TRP 210 Cb 0.18 0.09 -0.07 0.00 -2.10 0.00 0.00 29.16 27.26 1qzq h TRP 210 CO -0.22 -0.13 -0.27 1.25 -2.79 0.00 0.00 178.44 176.27 1qzq h LEU 211 N -0.36 -0.87 -1.36 0.65 5.85 -0.24 -0.84 115.31 118.13 1qzq h LEU 211 Ca -0.03 0.15 0.12 0.00 0.84 0.00 0.00 57.88 58.96 1qzq h LEU 211 Cb 0.28 0.40 -0.06 0.00 0.37 0.00 0.00 40.66 41.65 1qzq h LEU 211 CO 0.05 -0.31 0.54 0.58 -0.34 0.00 0.00 178.44 178.96 1qzq h VAL 212 N -0.30 0.88 0.00 1.05 2.07 -0.84 0.15 116.25 119.27 1qzq h VAL 212 Ca 0.13 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1qzq h VAL 212 Cb 0.49 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1qzq h VAL 212 CO -0.39 0.12 0.00 0.29 0.02 0.00 0.00 177.57 177.61 1qzq n LYS 213 N -4.52 0.05 0.09 1.57 5.02 -0.35 -2.38 118.16 117.65 1qzq n LYS 213 Ca 0.15 0.28 -0.01 0.00 -2.02 0.00 0.00 58.31 56.71 1qzq n LYS 213 Cb 0.41 -1.60 -0.04 0.00 -0.02 0.00 0.00 35.03 33.79 1qzq n LYS 213 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 1qzq h GLN 214 N 0.00 0.00 -6.95 1.97 1.08 -0.36 -3.45 115.11 107.39 1qzq h GLN 214 Ca 0.00 0.00 -0.48 0.00 -1.45 0.00 0.00 58.65 56.72 1qzq h GLN 214 Cb 0.30 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 27.75 1qzq h GLN 214 CO 0.00 0.58 0.41 0.71 -0.95 0.00 0.00 178.83 179.58 1qzq s TYR 215 N -2.88 3.30 0.45 2.96 1.51 -1.00 -4.51 117.35 117.18 1qzq s TYR 215 Ca 0.02 1.65 -0.25 0.00 -1.01 0.00 0.00 57.07 57.48 1qzq s TYR 215 Cb 0.08 -3.13 -0.08 0.00 -0.11 0.00 0.00 41.96 38.72 1qzq s TYR 215 CO 0.78 -0.60 1.40 -2.14 -1.11 0.00 0.00 175.55 173.88 1qzq s PRO 216 N -2.41 3.68 0.43 -1.71 0.02 -1.26 -4.72 135.00 129.03 1qzq s PRO 216 Ca 0.57 2.36 0.29 0.00 0.02 0.00 0.00 61.00 64.24 1qzq s PRO 216 Cb -0.23 -2.64 1.41 0.00 0.02 0.00 0.00 34.50 33.07 1qzq s PRO 216 CO 0.28 -0.80 1.62 -1.35 -0.33 0.00 0.00 177.00 176.42 1qzq h PRO 217 N 2.30 0.08 -0.09 5.54 0.11 -1.93 0.21 132.00 138.22 1qzq h PRO 217 Ca -0.51 -0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.44 1qzq h PRO 217 Cb 1.27 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 1qzq h PRO 217 CO 0.61 0.05 -0.64 1.05 -0.21 0.00 0.00 178.00 178.86 1qzq h GLU 218 N 0.08 0.36 -0.00 1.05 9.09 -2.02 -3.16 114.58 119.97 1qzq h GLU 218 Ca 0.83 -0.26 0.00 0.00 0.05 0.00 0.00 59.36 59.98 1qzq h GLU 218 Cb 2.55 0.04 0.00 0.00 -1.65 0.00 0.00 28.75 29.69 1qzq h GLU 218 CO -0.46 0.88 -0.23 1.19 0.05 0.00 0.00 179.01 180.44 1qzq n PHE 219 N -3.87 0.00 0.31 2.06 3.72 0.67 -4.20 117.46 116.15 1qzq n PHE 219 Ca -0.03 0.00 0.21 0.00 -0.05 0.00 0.00 57.45 57.58 1qzq n PHE 219 Cb 0.65 -0.19 1.11 0.00 -0.94 0.00 0.00 39.48 40.11 1qzq n PHE 219 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1qzq h ARG 220 N 0.71 0.00 0.00 -1.08 3.08 -1.34 -2.30 114.38 113.45 1qzq h ARG 220 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1qzq h ARG 220 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1qzq h ARG 220 CO 0.00 0.00 -0.85 1.63 -1.07 0.00 0.00 179.97 179.68 1qzq n LYS 221 N -2.93 0.15 -1.90 0.04 5.02 -1.26 -4.94 118.16 112.33 1qzq n LYS 221 Ca -0.03 0.00 -0.36 0.00 -2.02 0.00 0.00 58.31 55.90 1qzq n LYS 221 Cb 0.07 -1.55 0.05 0.00 -0.02 0.00 0.00 35.03 33.57 1qzq n LYS 221 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1qzq s LYS 222 N -3.10 2.80 0.57 1.97 -0.14 -0.87 -4.77 119.74 116.21 1qzq s LYS 222 Ca 0.07 1.89 -0.21 0.00 -1.36 0.00 0.00 55.97 56.36 1qzq s LYS 222 Cb 0.16 -1.90 -0.04 0.00 -1.68 0.00 0.00 37.83 34.37 1qzq s LYS 222 CO 0.78 -1.35 1.35 -2.14 -0.76 0.00 0.00 175.35 173.22 1qzq s PRO 223 N -3.38 3.00 -0.03 -1.68 0.02 -1.26 -4.86 135.00 126.80 1qzq s PRO 223 Ca 0.79 2.21 -0.00 0.00 0.02 0.00 0.00 61.00 64.02 1qzq s PRO 223 Cb -0.32 -2.16 0.03 0.00 0.02 0.00 0.00 34.50 32.06 1qzq s PRO 223 CO 0.36 -1.29 0.01 0.42 -0.33 0.00 0.00 177.00 176.17 1qzq s ILE 224 N -1.32 0.12 -0.24 2.83 1.01 -0.26 -2.59 121.20 120.75 1qzq s ILE 224 Ca 0.74 0.15 -0.06 0.00 0.00 0.00 0.00 60.65 61.48 1qzq s ILE 224 Cb -0.40 -0.24 -0.02 0.00 0.01 0.00 0.00 42.46 41.80 1qzq s ILE 224 CO 0.46 0.15 0.03 -0.22 0.00 0.00 0.00 174.94 175.36 1qzq s LEU 225 N 1.23 3.25 -0.30 2.97 2.96 -0.74 -0.37 118.68 127.69 1qzq s LEU 225 Ca -0.07 -0.26 -0.12 0.00 -0.22 0.00 0.00 54.13 53.46 1qzq s LEU 225 Cb -0.13 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1qzq s LEU 225 CO -0.02 -0.02 0.22 -0.76 -1.32 0.00 0.00 176.35 174.45 1qzq s LEU 226 N 1.51 4.20 -0.30 -0.68 1.43 -0.16 0.61 118.68 125.28 1qzq s LEU 226 Ca 0.06 -0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 52.95 1qzq s LEU 226 Cb -0.15 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 43.93 1qzq s LEU 226 CO 0.01 -0.13 0.10 -0.69 0.23 0.00 0.00 176.35 175.88 1qzq s VAL 227 N 1.77 4.15 0.35 -1.59 1.01 0.04 -0.18 120.40 125.95 1qzq s VAL 227 Ca 0.07 -0.61 0.05 0.00 0.00 0.00 0.00 61.98 61.50 1qzq s VAL 227 Cb -0.16 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 1qzq s VAL 227 CO 0.11 0.08 0.19 0.00 0.00 0.00 0.00 175.10 175.48 1qzq n HIS 228 N 4.90 -0.27 -1.57 5.22 -0.00 -0.46 -2.41 115.22 120.64 1qzq n HIS 228 Ca -0.14 -2.52 0.05 0.00 -0.00 0.00 0.00 57.72 55.11 1qzq n HIS 228 Cb 0.48 0.12 0.08 0.00 -0.00 0.00 0.00 29.99 30.67 1qzq n HIS 228 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1qzq n GLY 229 N -0.60 2.88 3.76 -1.39 0.00 -1.26 0.28 105.19 108.85 1qzq n GLY 229 Ca 0.00 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 1qzq n GLY 229 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qzq s ASP 230 N -2.08 6.91 0.16 1.61 1.01 -1.26 -4.79 116.67 118.23 1qzq s ASP 230 Ca 0.19 2.53 0.11 0.00 0.71 0.00 0.00 52.55 56.09 1qzq s ASP 230 Cb 0.18 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.43 1qzq s ASP 230 CO -0.00 -0.44 -0.24 -0.54 0.21 0.00 0.00 175.17 174.16 1qzq s LYS 231 N -1.38 1.42 7.95 8.23 1.02 -1.26 -4.32 119.74 131.40 1qzq s LYS 231 Ca 0.49 -1.42 0.00 0.00 0.02 0.00 0.00 55.97 55.06 1qzq s LYS 231 Cb -0.37 -1.77 0.00 0.00 -0.52 0.00 0.00 37.83 35.16 1qzq s LYS 231 CO 0.47 0.40 0.00 0.54 -0.92 0.00 0.00 175.35 175.84 1qzq n ARG 232 N 0.57 0.00 -0.20 1.68 1.74 -1.26 -2.74 116.66 116.46 1qzq n ARG 232 Ca -0.15 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 56.85 1qzq n ARG 232 Cb 0.55 0.00 0.02 0.00 -1.02 0.00 0.00 32.46 32.01 1qzq n ARG 232 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1qzq h GLU 233 N 0.00 0.81 -0.63 5.56 3.07 -1.99 -1.64 114.58 119.76 1qzq h GLU 233 Ca 0.00 -0.12 0.10 0.00 -0.50 0.00 0.00 59.36 58.84 1qzq h GLU 233 Cb 0.00 -0.14 -0.08 0.00 -0.84 0.00 0.00 28.75 27.69 1qzq h GLU 233 CO 0.00 0.66 0.22 0.00 -1.40 0.00 0.00 179.01 178.49 1qzq h ALA 234 N 1.10 0.81 -0.86 3.43 0.00 -1.89 0.36 119.26 122.21 1qzq h ALA 234 Ca 0.19 0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1qzq h ALA 234 Cb 0.12 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1qzq h ALA 234 CO -0.02 -0.21 0.45 -0.22 0.00 0.00 0.00 179.25 179.25 1qzq h LYS 235 N 0.39 1.21 -0.32 0.00 3.64 -1.41 -1.58 116.57 118.49 1qzq h LYS 235 Ca 0.32 -0.15 -0.10 0.00 -1.27 0.00 0.00 60.65 59.46 1qzq h LYS 235 Cb 0.43 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.01 1qzq h LYS 235 CO -0.34 0.90 -0.18 0.00 -2.27 0.00 0.00 179.45 177.56 1qzq h ALA 236 N 1.29 0.45 -0.89 5.00 0.00 -0.14 -1.78 119.26 123.19 1qzq h ALA 236 Ca 0.30 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1qzq h ALA 236 Cb 0.06 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 1qzq h ALA 236 CO -0.05 0.38 0.57 1.25 0.00 0.00 0.00 179.25 181.40 1qzq h HIS 237 N 0.44 1.06 -0.08 0.00 -0.00 -0.04 0.35 115.15 116.88 1qzq h HIS 237 Ca 0.07 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 1qzq h HIS 237 Cb 0.71 -0.34 -0.00 0.00 -0.00 0.00 0.00 27.41 27.78 1qzq h HIS 237 CO 0.06 0.56 0.03 1.25 -0.00 0.00 0.00 177.93 179.83 1qzq h LEU 238 N 1.06 0.12 -1.30 0.26 5.85 -1.07 -1.25 115.31 118.97 1qzq h LEU 238 Ca 0.38 -0.17 0.11 0.00 0.84 0.00 0.00 57.88 59.03 1qzq h LEU 238 Cb 0.12 -0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 1qzq h LEU 238 CO -0.16 0.26 0.54 0.45 -0.34 0.00 0.00 178.44 179.20 1qzq h HIS 239 N -0.03 0.83 -0.61 1.25 3.86 -0.71 -0.81 115.15 118.93 1qzq h HIS 239 Ca 0.03 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 1qzq h HIS 239 Cb 0.18 -0.27 -0.03 0.00 1.06 0.00 0.00 27.41 28.35 1qzq h HIS 239 CO -0.01 0.37 0.31 0.00 0.86 0.00 0.00 177.93 179.45 1qzq h ALA 240 N 1.59 0.78 -0.24 2.45 0.00 -0.30 0.34 119.26 123.88 1qzq h ALA 240 Ca 0.40 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 1qzq h ALA 240 Cb 0.50 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1qzq h ALA 240 CO -0.16 0.33 -0.17 1.96 0.00 0.00 0.00 179.25 181.21 1qzq h GLN 241 N 0.83 0.43 0.02 0.00 4.20 -0.03 -2.97 115.11 117.59 1qzq h GLN 241 Ca 0.21 -0.13 -0.22 0.00 0.06 0.00 0.00 58.65 58.58 1qzq h GLN 241 Cb 0.09 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1qzq h GLN 241 CO -0.03 0.59 -0.95 0.00 -0.67 0.00 0.00 178.83 177.77 1qzq h ALA 242 N 1.43 0.41 -0.57 3.87 0.00 -0.75 -3.38 119.26 120.27 1qzq h ALA 242 Ca 0.07 -0.75 0.08 0.00 0.00 0.00 0.00 54.91 54.31 1qzq h ALA 242 Cb 0.53 -0.05 -0.09 0.00 0.00 0.00 0.00 17.79 18.18 1qzq h ALA 242 CO 0.03 0.91 -0.24 1.17 0.00 0.00 0.00 179.25 181.13 1qzq n LYS 243 N -3.65 -0.15 -0.32 0.00 3.00 0.12 -0.67 118.16 116.49 1qzq n LYS 243 Ca -0.05 0.87 0.06 0.00 -0.00 0.00 0.00 58.31 59.19 1qzq n LYS 243 Cb 0.85 -1.29 0.21 0.00 0.00 0.00 0.00 35.03 34.80 1qzq n LYS 243 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 1qzq h PRO 244 N 0.00 0.81 -5.39 1.64 0.11 -1.77 -3.38 132.00 124.02 1qzq h PRO 244 Ca 0.18 -0.05 -0.65 0.00 0.11 0.00 0.00 66.00 65.59 1qzq h PRO 244 Cb 0.32 -0.18 -0.15 0.00 0.11 0.00 0.00 31.00 31.10 1qzq h PRO 244 CO -0.56 0.53 0.26 0.71 -0.21 0.00 0.00 178.00 178.74 1qzq s TYR 245 N -5.98 2.95 0.18 0.65 2.02 0.16 -4.93 117.35 112.40 1qzq s TYR 245 Ca -0.12 -0.26 0.25 0.00 -0.37 0.00 0.00 57.07 56.58 1qzq s TYR 245 Cb 0.21 -3.72 1.06 0.00 -0.40 0.00 0.00 41.96 39.10 1qzq s TYR 245 CO 0.79 -1.13 1.88 0.93 -1.57 0.00 0.00 175.55 176.45 1qzq h GLU 246 N 9.10 0.00 0.00 -0.62 5.08 -1.80 -2.88 114.58 123.47 1qzq h GLU 246 Ca -0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1qzq h GLU 246 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1qzq h GLU 246 CO 1.00 0.19 0.00 0.27 -1.00 0.00 0.00 179.01 179.47 1qzq n ASN 247 N -3.41 0.00 -4.61 1.42 6.94 -1.26 -4.76 115.26 109.58 1qzq n ASN 247 Ca -0.00 -0.63 -0.36 0.00 -0.02 0.00 0.00 54.58 53.56 1qzq n ASN 247 Cb 0.39 -0.06 -0.10 0.00 -2.36 0.00 0.00 39.78 37.64 1qzq n ASN 247 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1qzq s ILE 248 N -2.12 5.07 0.13 1.53 1.01 -1.09 -1.11 121.20 124.63 1qzq s ILE 248 Ca 0.35 0.08 0.08 0.00 0.00 0.00 0.00 60.65 61.16 1qzq s ILE 248 Cb 0.17 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 1qzq s ILE 248 CO 0.31 0.35 -0.12 -0.44 0.00 0.00 0.00 174.94 175.04 1qzq s SER 249 N 1.10 4.21 0.27 3.58 0.01 0.50 -4.97 113.70 118.40 1qzq s SER 249 Ca 0.06 -0.49 0.11 0.00 1.31 0.00 0.00 55.95 56.94 1qzq s SER 249 Cb -0.14 -0.72 -0.05 0.00 0.21 0.00 0.00 66.02 65.33 1qzq s SER 249 CO 0.04 0.15 -0.11 -0.76 0.41 0.00 0.00 173.24 172.98 1qzq s LEU 250 N -2.38 2.86 -0.19 2.44 1.02 -1.26 -0.99 118.68 120.18 1qzq s LEU 250 Ca 0.21 -0.84 -0.04 0.00 0.02 0.00 0.00 54.13 53.48 1qzq s LEU 250 Cb -0.10 -1.39 0.08 0.00 0.02 0.00 0.00 46.19 44.80 1qzq s LEU 250 CO 0.13 0.03 0.19 0.00 0.02 0.00 0.00 176.35 176.72 1qzq s GLN 252 N 2.28 3.20 0.24 0.00 0.74 -1.26 -1.35 119.66 123.51 1qzq s GLN 252 Ca 0.05 -0.60 -0.31 0.00 0.05 0.00 0.00 55.36 54.55 1qzq s GLN 252 Cb -0.16 -4.15 -0.11 0.00 1.10 0.00 0.00 33.01 29.70 1qzq s GLN 252 CO -0.11 -1.66 1.57 0.00 -0.55 0.00 0.00 175.29 174.54 1qzq s ALA 253 N 3.97 3.76 0.33 1.58 0.00 0.14 -4.93 121.76 126.62 1qzq s ALA 253 Ca 0.25 1.47 -0.28 0.00 0.00 0.00 0.00 51.96 53.40 1qzq s ALA 253 Cb -0.15 -3.63 -0.09 0.00 0.00 0.00 0.00 23.12 19.25 1qzq s ALA 253 CO 0.14 -0.87 1.18 -1.59 0.00 0.00 0.00 175.76 174.62 1qzq s LYS 254 N 0.21 4.37 -0.50 0.00 -2.85 -1.26 -4.61 119.74 115.10 1qzq s LYS 254 Ca 0.66 1.93 0.06 0.00 -1.00 0.00 0.00 55.97 57.61 1qzq s LYS 254 Cb -0.46 -2.98 0.20 0.00 -2.06 0.00 0.00 37.83 32.54 1qzq s LYS 254 CO 0.40 -0.07 0.48 1.28 0.10 0.00 0.00 175.35 177.54 1qzq n LEU 255 N 0.70 1.02 -0.41 2.77 4.77 -1.26 -4.91 117.00 119.68 1qzq n LEU 255 Ca 0.01 -4.79 0.01 0.00 -0.03 0.00 0.00 56.01 51.21 1qzq n LEU 255 Cb 0.45 0.13 0.03 0.00 -2.33 0.00 0.00 43.42 41.70 1qzq n LEU 255 CO 0.54 1.93 0.39 0.47 -1.33 0.00 0.00 177.39 179.39 1qzq n ASP 256 N 1.98 0.96 -4.02 -1.43 10.43 -1.26 -4.71 116.55 118.51 1qzq n ASP 256 Ca 0.26 -2.05 -0.25 0.00 2.57 0.00 0.00 54.79 55.32 1qzq n ASP 256 Cb 0.46 -0.33 -0.17 0.00 1.84 0.00 0.00 41.12 42.92 1qzq n ASP 256 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1qzq s ILE 257 N -1.45 1.17 -0.06 0.53 1.01 -1.26 -5.10 121.20 116.05 1qzq s ILE 257 Ca 0.04 -0.48 -0.40 0.00 0.00 0.00 0.00 60.65 59.81 1qzq s ILE 257 Cb 0.03 -1.08 -0.19 0.00 0.01 0.00 0.00 42.46 41.23 1qzq s ILE 257 CO 0.02 0.37 1.27 0.00 0.00 0.00 0.00 174.94 176.59 1qzq n ALA 258 N 3.95 -2.31 -2.41 9.38 0.00 -1.26 -2.42 120.51 125.44 1qzq n ALA 258 Ca -0.22 0.55 -0.14 0.00 0.00 0.00 0.00 53.44 53.64 1qzq n ALA 258 Cb 0.52 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.06 1qzq n ALA 258 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1qzq n PHE 259 N 2.41 -0.83 -3.88 0.00 3.72 -1.26 -4.96 117.46 112.66 1qzq n PHE 259 Ca 0.21 0.11 -0.27 0.00 -0.05 0.00 0.00 57.45 57.45 1qzq n PHE 259 Cb 0.10 -3.00 -0.03 0.00 -0.94 0.00 0.00 39.48 35.61 1qzq n PHE 259 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1qzq s GLY 260 N -2.54 1.82 0.08 1.37 0.00 -1.02 -4.90 107.32 102.14 1qzq s GLY 260 Ca 0.06 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 43.85 1qzq s GLY 260 CO 0.08 -0.92 -0.06 -0.51 0.00 0.00 0.00 173.10 171.69 1qzq s THR 261 N -1.73 0.53 -0.82 0.90 -4.23 -1.26 -4.96 115.64 104.07 1qzq s THR 261 Ca 0.36 -1.76 -0.16 0.00 -1.18 0.00 0.00 61.69 58.95 1qzq s THR 261 Cb -0.11 -1.46 0.18 0.00 1.34 0.00 0.00 72.50 72.45 1qzq s THR 261 CO 0.28 -0.83 0.84 -2.28 -0.54 0.00 0.00 174.62 172.09 1qzq s HIS 262 N -3.35 3.52 -0.84 3.99 2.46 -1.26 -1.74 115.29 118.07 1qzq s HIS 262 Ca 0.07 -1.73 0.24 0.00 0.47 0.00 0.00 55.06 54.11 1qzq s HIS 262 Cb 0.04 -3.95 0.32 0.00 -0.13 0.00 0.00 32.58 28.86 1qzq s HIS 262 CO -0.05 -1.14 1.27 1.58 -2.47 0.00 0.00 174.74 173.93 1qzq n HIS 263 N 4.86 0.18 -1.68 3.88 -0.00 -0.64 -3.67 115.22 118.14 1qzq n HIS 263 Ca 0.13 0.05 -0.45 0.00 0.46 0.00 0.00 57.72 57.91 1qzq n HIS 263 Cb 0.47 -0.36 -0.04 0.00 -0.12 0.00 0.00 29.99 29.94 1qzq n HIS 263 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 1qzq n THR 264 N -1.73 0.14 -4.03 3.57 -1.04 -0.95 -4.59 114.28 105.64 1qzq n THR 264 Ca 0.04 -0.03 -0.31 0.00 -2.04 0.00 0.00 64.05 61.70 1qzq n THR 264 Cb 0.38 -1.64 -0.15 0.00 -1.82 0.00 0.00 70.33 67.10 1qzq n THR 264 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1qzq s LYS 265 N 0.77 1.83 0.01 -2.82 1.02 -1.26 -2.28 119.74 117.01 1qzq s LYS 265 Ca 0.76 -1.52 -0.14 0.00 0.02 0.00 0.00 55.97 55.09 1qzq s LYS 265 Cb -0.63 -2.96 0.02 0.00 -0.52 0.00 0.00 37.83 33.73 1qzq s LYS 265 CO 0.38 -0.74 0.30 1.41 -0.92 0.00 0.00 175.35 175.78 1qzq s MET 266 N 1.06 0.72 -0.11 1.68 1.75 -1.01 -1.61 119.30 121.79 1qzq s MET 266 Ca -0.00 -0.34 0.02 0.00 -1.25 0.00 0.00 55.69 54.12 1qzq s MET 266 Cb -0.19 0.31 0.01 0.00 2.84 0.00 0.00 34.83 37.80 1qzq s MET 266 CO -0.07 -0.21 -0.18 -1.64 -0.65 0.00 0.00 175.02 172.27 1qzq s MET 267 N -1.87 2.50 -0.26 4.11 -1.94 0.17 -0.85 119.30 121.16 1qzq s MET 267 Ca -0.10 -0.67 -0.08 0.00 -1.71 0.00 0.00 55.69 53.13 1qzq s MET 267 Cb -0.03 -2.03 -0.03 0.00 2.01 0.00 0.00 34.83 34.75 1qzq s MET 267 CO 0.01 0.01 0.09 -0.51 -0.01 0.00 0.00 175.02 174.61 1qzq s LEU 268 N 0.76 3.56 -0.29 -0.03 1.43 -0.20 -0.38 118.68 123.53 1qzq s LEU 268 Ca -0.11 -0.23 0.01 0.00 -1.03 0.00 0.00 54.13 52.78 1qzq s LEU 268 Cb -0.16 -1.95 0.07 0.00 0.03 0.00 0.00 46.19 44.18 1qzq s LEU 268 CO 0.01 -0.05 -0.03 -0.76 0.23 0.00 0.00 176.35 175.75 1qzq s LEU 269 N 1.63 3.90 -0.24 1.79 1.43 -0.24 -0.63 118.68 126.30 1qzq s LEU 269 Ca 0.06 -1.51 -0.20 0.00 -1.03 0.00 0.00 54.13 51.45 1qzq s LEU 269 Cb -0.15 -1.63 -0.02 0.00 0.03 0.00 0.00 46.19 44.42 1qzq s LEU 269 CO 0.04 -0.26 0.62 -0.22 0.23 0.00 0.00 176.35 176.76 1qzq s LEU 270 N 1.12 4.08 0.38 1.79 2.96 0.42 -1.65 118.68 127.78 1qzq s LEU 270 Ca -0.04 0.72 0.08 0.00 -0.22 0.00 0.00 54.13 54.67 1qzq s LEU 270 Cb -0.20 -2.84 -0.05 0.00 0.50 0.00 0.00 46.19 43.59 1qzq s LEU 270 CO -0.04 -0.34 0.11 -0.31 -1.32 0.00 0.00 176.35 174.44 1qzq s TYR 271 N 2.36 2.59 0.23 5.38 2.02 0.94 -0.04 117.35 130.83 1qzq s TYR 271 Ca 0.26 -0.53 0.05 0.00 -0.37 0.00 0.00 57.07 56.48 1qzq s TYR 271 Cb -0.16 -1.77 0.23 0.00 -0.40 0.00 0.00 41.96 39.87 1qzq s TYR 271 CO 0.09 0.32 1.54 0.93 -1.57 0.00 0.00 175.55 176.86 1qzq h GLU 272 N 1.59 0.19 -0.02 -0.62 5.08 -1.72 -3.01 114.58 116.08 1qzq h GLU 272 Ca -0.43 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 57.79 1qzq h GLU 272 Cb 1.25 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1qzq h GLU 272 CO 0.70 0.77 -0.01 0.39 -1.00 0.00 0.00 179.01 179.85 1qzq n GLU 273 N -3.83 1.65 -0.66 2.33 4.71 -1.26 -5.02 120.64 118.56 1qzq n GLU 273 Ca -0.02 -0.97 0.00 0.00 -0.01 0.00 0.00 57.16 56.15 1qzq n GLU 273 Cb 0.64 -1.48 0.00 0.00 -1.01 0.00 0.00 31.44 29.59 1qzq n GLU 273 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1qzq n GLY 274 N 1.19 0.21 3.06 0.62 0.00 -1.14 -4.59 105.19 104.53 1qzq n GLY 274 Ca 0.19 -1.32 -0.16 0.00 0.00 0.00 0.00 46.02 44.72 1qzq n GLY 274 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qzq s LEU 275 N 0.00 2.14 0.05 0.99 2.96 0.16 -0.04 118.68 124.94 1qzq s LEU 275 Ca 0.00 -0.37 0.04 0.00 -0.22 0.00 0.00 54.13 53.58 1qzq s LEU 275 Cb 0.00 -0.36 -0.02 0.00 0.50 0.00 0.00 46.19 46.31 1qzq s LEU 275 CO 0.00 -0.03 -0.13 -0.60 -1.32 0.00 0.00 176.35 174.27 1qzq s ARG 276 N -0.94 0.80 -0.04 1.98 3.52 -0.66 0.64 118.95 124.25 1qzq s ARG 276 Ca -0.02 -0.77 0.05 0.00 -0.13 0.00 0.00 55.73 54.85 1qzq s ARG 276 Cb -0.07 -0.77 -0.01 0.00 -1.56 0.00 0.00 34.95 32.54 1qzq s ARG 276 CO 0.00 0.18 -0.19 0.08 -0.81 0.00 0.00 175.30 174.57 1qzq s VAL 277 N -1.00 1.57 -0.08 7.11 1.01 -1.26 -1.08 120.40 126.67 1qzq s VAL 277 Ca -0.01 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1qzq s VAL 277 Cb -0.08 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 34.97 1qzq s VAL 277 CO 0.01 0.45 -0.12 -0.69 0.00 0.00 0.00 175.10 174.76 1qzq s VAL 278 N -0.07 1.15 -0.14 2.92 1.01 0.49 -1.49 120.40 124.28 1qzq s VAL 278 Ca -0.02 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.52 1qzq s VAL 278 Cb -0.11 -1.08 0.01 0.00 0.00 0.00 0.00 36.38 35.20 1qzq s VAL 278 CO 0.02 0.37 -0.19 -0.63 0.00 0.00 0.00 175.10 174.67 1qzq s ILE 279 N 0.93 1.84 0.00 2.22 1.01 -0.80 0.42 121.20 126.82 1qzq s ILE 279 Ca -0.09 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.72 1qzq s ILE 279 Cb -0.15 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.67 1qzq s ILE 279 CO 0.00 0.51 0.00 0.00 0.00 0.00 0.00 174.94 175.45 1qzq n HIS 280 N 4.26 -0.12 -0.36 3.97 1.44 -0.63 -0.17 115.22 123.61 1qzq n HIS 280 Ca -0.19 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.52 1qzq n HIS 280 Cb 0.51 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.62 1qzq n HIS 280 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1qzq n THR 281 N 0.00 0.31 -3.39 0.61 -2.24 -0.81 -4.39 114.28 104.38 1qzq n THR 281 Ca 0.00 -0.48 -0.38 0.00 -2.27 0.00 0.00 64.05 60.92 1qzq n THR 281 Cb 0.00 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.20 1qzq n THR 281 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1qzq s SER 282 N -0.31 6.80 0.79 3.42 0.01 -1.26 -4.81 113.70 118.34 1qzq s SER 282 Ca 0.00 0.95 -0.11 0.00 1.31 0.00 0.00 55.95 58.10 1qzq s SER 282 Cb 0.00 -2.28 0.07 0.00 0.21 0.00 0.00 66.02 64.02 1qzq s SER 282 CO 0.00 0.19 1.09 0.20 0.41 0.00 0.00 173.24 175.13 1qzq s ASN 283 N -0.40 4.37 -1.12 2.44 0.01 -1.26 -4.91 114.94 114.06 1qzq s ASN 283 Ca 0.25 1.66 -0.04 0.00 -0.71 0.00 0.00 52.86 54.03 1qzq s ASN 283 Cb -0.16 -2.39 0.17 0.00 0.41 0.00 0.00 41.25 39.28 1qzq s ASN 283 CO 0.13 -2.10 2.29 0.18 -1.51 0.00 0.00 177.10 176.09 1qzq n LEU 284 N -3.55 7.67 -4.12 0.60 4.77 -0.67 -4.71 117.00 116.99 1qzq n LEU 284 Ca 0.08 -4.90 -0.18 0.00 -0.03 0.00 0.00 56.01 50.97 1qzq n LEU 284 Cb 0.54 -1.29 -0.13 0.00 -2.33 0.00 0.00 43.42 40.21 1qzq n LEU 284 CO 0.55 2.01 -0.45 0.27 -1.33 0.00 0.00 177.39 178.43 1qzq s ILE 285 N -2.22 0.97 0.32 -0.08 -4.36 -1.26 -2.08 121.20 112.50 1qzq s ILE 285 Ca 0.51 -1.01 0.10 0.00 -0.26 0.00 0.00 60.65 59.99 1qzq s ILE 285 Cb 0.22 -0.91 0.31 0.00 1.25 0.00 0.00 42.46 43.33 1qzq s ILE 285 CO -0.13 -0.09 1.71 -0.74 0.24 0.00 0.00 174.94 175.92 1qzq h HIS 286 N 4.82 0.94 0.00 1.37 -0.00 -1.94 -1.95 115.15 118.38 1qzq h HIS 286 Ca -0.37 0.04 -0.02 0.00 -0.00 0.00 0.00 60.37 60.01 1qzq h HIS 286 Cb 1.19 -0.26 -0.00 0.00 -0.00 0.00 0.00 27.41 28.34 1qzq h HIS 286 CO 0.56 -0.02 -0.09 0.00 -0.00 0.00 0.00 177.93 178.38 1qzq h ALA 287 N 1.76 1.14 0.00 5.26 0.00 -1.97 -2.64 119.26 122.82 1qzq h ALA 287 Ca 0.66 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1qzq h ALA 287 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1qzq h ALA 287 CO -0.52 0.12 -0.10 -0.25 0.00 0.00 0.00 179.25 178.50 1qzq n ASP 288 N -3.40 0.29 -0.33 0.00 10.43 -0.73 -3.30 116.55 119.51 1qzq n ASP 288 Ca -0.01 0.41 0.05 0.00 2.57 0.00 0.00 54.79 57.80 1qzq n ASP 288 Cb 0.26 -0.44 0.11 0.00 1.84 0.00 0.00 41.12 42.89 1qzq n ASP 288 CO 0.00 0.00 0.00 0.79 -1.07 0.00 0.00 177.20 176.92 1qzq n TRP 289 N -1.72 0.28 -0.01 1.24 7.02 -1.01 -4.67 117.44 118.57 1qzq n TRP 289 Ca 0.06 -0.67 -0.01 0.00 -1.02 0.00 0.00 57.50 55.86 1qzq n TRP 289 Cb 0.37 -0.11 -0.00 0.00 -2.42 0.00 0.00 31.31 29.14 1qzq n TRP 289 CO 0.00 0.00 0.00 1.58 -2.02 0.00 0.00 177.69 177.25 1qzq n HIS 290 N -0.44 0.02 -2.49 -5.99 -0.00 -1.10 -4.77 115.22 100.45 1qzq n HIS 290 Ca 0.10 0.01 -0.04 0.00 0.46 0.00 0.00 57.72 58.25 1qzq n HIS 290 Cb 0.49 -0.11 0.05 0.00 -0.12 0.00 0.00 29.99 30.30 1qzq n HIS 290 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1qzq n GLN 291 N -2.72 1.86 -4.42 1.57 6.02 -1.26 -1.54 117.38 116.89 1qzq n GLN 291 Ca -0.02 -3.39 -0.25 0.00 -0.01 0.00 0.00 57.00 53.34 1qzq n GLN 291 Cb 0.06 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.74 1qzq n GLN 291 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1qzq s LYS 292 N -3.06 1.77 -0.25 -1.09 1.02 -1.26 -3.87 119.74 113.00 1qzq s LYS 292 Ca 0.35 -1.62 -0.23 0.00 0.02 0.00 0.00 55.97 54.49 1qzq s LYS 292 Cb 0.36 -1.88 -0.01 0.00 -0.52 0.00 0.00 37.83 35.78 1qzq s LYS 292 CO -0.05 0.36 0.74 0.99 -0.92 0.00 0.00 175.35 176.47 1qzq s THR 293 N -2.23 4.90 0.09 2.17 2.01 0.05 -4.81 115.64 117.81 1qzq s THR 293 Ca 0.28 1.33 0.06 0.00 0.31 0.00 0.00 61.69 63.67 1qzq s THR 293 Cb -0.06 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.38 1qzq s THR 293 CO 0.15 -0.05 -0.15 -1.10 -0.69 0.00 0.00 174.62 172.78 1qzq s GLN 294 N 2.71 0.92 0.04 4.92 -1.52 -1.26 -1.09 119.66 124.38 1qzq s GLN 294 Ca 0.31 -1.08 0.02 0.00 -1.95 0.00 0.00 55.36 52.66 1qzq s GLN 294 Cb -0.15 -0.91 -0.04 0.00 -0.22 0.00 0.00 33.01 31.69 1qzq s GLN 294 CO 0.08 0.19 0.04 0.20 -0.25 0.00 0.00 175.29 175.56 1qzq s GLY 295 N -2.02 1.96 -0.02 3.09 0.00 -1.26 -2.17 107.32 106.90 1qzq s GLY 295 Ca 0.03 -0.98 -0.01 0.00 0.00 0.00 0.00 44.72 43.76 1qzq s GLY 295 CO 0.03 -0.90 0.05 -0.42 0.00 0.00 0.00 173.10 171.86 1qzq s ILE 296 N -1.24 -0.02 -0.12 0.90 1.01 0.26 -1.91 121.20 120.08 1qzq s ILE 296 Ca 0.24 0.08 0.03 0.00 0.00 0.00 0.00 60.65 61.01 1qzq s ILE 296 Cb -0.12 -0.09 0.01 0.00 0.01 0.00 0.00 42.46 42.27 1qzq s ILE 296 CO 0.16 0.03 -0.21 0.86 0.00 0.00 0.00 174.94 175.78 1qzq s TRP 297 N 0.46 2.46 -0.24 3.97 -0.00 0.76 -0.58 118.94 125.77 1qzq s TRP 297 Ca -0.04 -1.13 -0.06 0.00 -0.00 0.00 0.00 56.10 54.87 1qzq s TRP 297 Cb -0.05 -1.68 -0.02 0.00 -0.00 0.00 0.00 33.47 31.72 1qzq s TRP 297 CO -0.02 -0.50 0.03 -0.51 -0.00 0.00 0.00 176.95 175.95 1qzq s LEU 298 N 0.65 3.26 0.76 5.86 1.43 -0.81 -1.90 118.68 127.93 1qzq s LEU 298 Ca -0.12 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 52.60 1qzq s LEU 298 Cb -0.16 -1.86 0.05 0.00 0.03 0.00 0.00 46.19 44.24 1qzq s LEU 298 CO 0.02 -0.03 1.08 -0.94 0.23 0.00 0.00 176.35 176.72 1qzq s SER 299 N 1.55 4.79 0.91 2.29 1.04 -0.56 -4.83 113.70 118.90 1qzq s SER 299 Ca 0.06 1.48 -0.15 0.00 0.48 0.00 0.00 55.95 57.83 1qzq s SER 299 Cb -0.15 -2.27 0.16 0.00 0.10 0.00 0.00 66.02 63.86 1qzq s SER 299 CO 0.01 -1.80 1.28 -2.16 0.98 0.00 0.00 173.24 171.55 1qzq s PRO 300 N -5.08 1.06 -0.26 4.02 0.04 -1.26 -4.68 135.00 128.84 1qzq s PRO 300 Ca 0.60 -0.25 -0.29 0.00 0.04 0.00 0.00 61.00 61.10 1qzq s PRO 300 Cb -0.15 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.50 1qzq s PRO 300 CO 0.55 -2.15 1.40 -1.17 0.04 0.00 0.00 177.00 175.67 1qzq s LEU 301 N -5.79 3.91 -0.18 -3.56 2.96 -1.26 -4.61 118.68 110.15 1qzq s LEU 301 Ca 0.70 1.38 -0.20 0.00 -0.22 0.00 0.00 54.13 55.80 1qzq s LEU 301 Cb -0.06 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.06 1qzq s LEU 301 CO 0.52 -1.11 0.59 -0.31 -1.32 0.00 0.00 176.35 174.71 1qzq s TYR 302 N 4.58 3.40 0.57 5.38 2.02 0.21 -4.87 117.35 128.64 1qzq s TYR 302 Ca 0.61 0.91 -0.15 0.00 -0.37 0.00 0.00 57.07 58.07 1qzq s TYR 302 Cb -0.20 -2.74 -0.05 0.00 -0.40 0.00 0.00 41.96 38.57 1qzq s TYR 302 CO 0.25 -0.10 1.02 -1.25 -1.57 0.00 0.00 175.55 173.89 1qzq s PRO 303 N 1.62 3.65 0.33 -1.71 0.04 -1.26 0.40 135.00 138.07 1qzq s PRO 303 Ca 0.28 0.99 -0.27 0.00 0.04 0.00 0.00 61.00 62.04 1qzq s PRO 303 Cb -0.16 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.20 1qzq s PRO 303 CO 0.11 -0.52 1.09 0.50 0.04 0.00 0.00 177.00 178.22 1qzq s ARG 304 N -4.32 4.42 -0.10 4.56 3.52 -1.26 -1.16 118.95 124.61 1qzq s ARG 304 Ca 0.59 1.72 -0.30 0.00 -0.13 0.00 0.00 55.73 57.62 1qzq s ARG 304 Cb -0.12 -2.93 -0.02 0.00 -1.56 0.00 0.00 34.95 30.32 1qzq s ARG 304 CO 0.38 0.03 1.20 0.42 -0.81 0.00 0.00 175.30 176.52 1qzq s ILE 305 N -1.34 4.32 -0.79 4.11 1.01 0.21 -4.79 121.20 123.92 1qzq s ILE 305 Ca 0.50 1.62 -0.22 0.00 0.00 0.00 0.00 60.65 62.55 1qzq s ILE 305 Cb -0.29 -4.04 -0.19 0.00 0.01 0.00 0.00 42.46 37.95 1qzq s ILE 305 CO 0.37 -0.05 2.08 0.00 0.00 0.00 0.00 174.94 177.33 1qzq n ALA 306 N 5.65 0.33 -1.69 9.38 0.00 -1.26 -4.72 120.51 128.19 1qzq n ALA 306 Ca 0.12 -0.29 -0.58 0.00 0.00 0.00 0.00 53.44 52.69 1qzq n ALA 306 Cb 0.46 -1.82 -0.07 0.00 0.00 0.00 0.00 19.45 18.02 1qzq n ALA 306 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1qzq n ASP 307 N 7.72 2.07 0.00 0.00 2.03 -1.26 0.48 116.55 127.59 1qzq n ASP 307 Ca 0.53 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.93 1qzq n ASP 307 Cb 0.04 -1.11 0.00 0.00 -0.72 0.00 0.00 41.12 39.33 1qzq n ASP 307 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qzq n GLY 308 N 3.87 0.58 3.41 0.27 0.00 -1.26 -5.07 105.19 106.99 1qzq n GLY 308 Ca 0.26 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.95 1qzq n GLY 308 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qzq s THR 309 N -2.05 2.86 -0.17 2.61 2.01 0.18 -5.11 115.64 115.97 1qzq s THR 309 Ca 0.00 -0.78 -0.09 0.00 0.31 0.00 0.00 61.69 61.13 1qzq s THR 309 Cb 0.00 -2.12 -0.05 0.00 0.01 0.00 0.00 72.50 70.34 1qzq s THR 309 CO 0.00 0.57 0.15 -1.00 -0.69 0.00 0.00 174.62 173.65 1qzq s HIS 310 N -0.40 3.48 -0.29 4.92 3.76 -1.26 -4.77 115.29 120.74 1qzq s HIS 310 Ca 0.04 0.43 -0.26 0.00 -0.15 0.00 0.00 55.06 55.12 1qzq s HIS 310 Cb -0.12 -2.10 0.17 0.00 1.11 0.00 0.00 32.58 31.64 1qzq s HIS 310 CO 0.02 0.45 1.33 0.21 -0.85 0.00 0.00 174.74 175.89 1qzq s LYS 311 N -0.13 0.18 0.19 1.40 2.20 -1.26 -5.14 119.74 117.18 1qzq s LYS 311 Ca 0.11 0.17 -0.25 0.00 -0.36 0.00 0.00 55.97 55.64 1qzq s LYS 311 Cb -0.12 0.09 -0.08 0.00 -1.51 0.00 0.00 37.83 36.21 1qzq s LYS 311 CO 0.01 -0.03 0.81 -1.54 -0.36 0.00 0.00 175.35 174.23 1qzq s SER 312 N -0.13 7.39 -0.69 1.43 1.04 -1.26 -4.92 113.70 116.55 1qzq s SER 312 Ca 0.06 1.68 -0.01 0.00 0.48 0.00 0.00 55.95 58.17 1qzq s SER 312 Cb -0.04 -2.51 0.40 0.00 0.10 0.00 0.00 66.02 63.97 1qzq s SER 312 CO -0.12 0.17 1.87 0.61 0.98 0.00 0.00 173.24 176.75 1qzq n GLY 313 N 1.42 5.78 3.88 7.32 0.00 -1.26 -4.96 105.19 117.37 1qzq n GLY 313 Ca -0.04 -2.46 -0.32 0.00 0.00 0.00 0.00 46.02 43.20 1qzq n GLY 313 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qzq s GLU 314 N -3.89 3.80 0.36 1.61 2.56 -1.26 -0.37 118.70 121.51 1qzq s GLU 314 Ca 0.57 0.28 0.08 0.00 0.00 0.00 0.00 54.97 55.89 1qzq s GLU 314 Cb 0.46 -2.63 -0.04 0.00 2.00 0.00 0.00 34.13 33.93 1qzq s GLU 314 CO -0.20 0.29 0.22 -1.54 -0.56 0.00 0.00 175.26 173.47 1qzq s SER 315 N -2.45 4.84 0.57 -1.70 1.04 -1.26 -4.13 113.70 110.61 1qzq s SER 315 Ca 0.48 -0.75 0.27 0.00 0.48 0.00 0.00 55.95 56.43 1qzq s SER 315 Cb -0.11 -0.72 1.58 0.00 0.10 0.00 0.00 66.02 66.87 1qzq s SER 315 CO 0.22 -0.41 2.08 -0.65 0.98 0.00 0.00 173.24 175.46 1qzq h PRO 316 N 1.37 0.00 -0.01 4.02 0.11 -1.80 0.17 132.00 135.86 1qzq h PRO 316 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1qzq h PRO 316 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1qzq h PRO 316 CO 0.62 0.00 -0.07 0.25 -0.21 0.00 0.00 178.00 178.59 1qzq n THR 317 N -3.95 0.00 -2.08 -1.15 -2.24 -1.26 -4.93 114.28 98.66 1qzq n THR 317 Ca 0.03 -0.19 -0.18 0.00 -2.27 0.00 0.00 64.05 61.43 1qzq n THR 317 Cb 0.36 0.36 -0.03 0.00 -2.10 0.00 0.00 70.33 68.93 1qzq n THR 317 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1qzq n HIS 318 N -0.17 -0.58 -0.00 4.78 8.25 0.60 -4.76 115.22 123.33 1qzq n HIS 318 Ca 0.17 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.54 1qzq n HIS 318 Cb 0.33 -3.43 -0.03 0.00 1.12 0.00 0.00 29.99 27.98 1qzq n HIS 318 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1qzq h PHE 319 N 0.00 -0.59 0.09 4.41 3.57 -1.84 -1.27 116.94 121.31 1qzq h PHE 319 Ca -0.41 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.13 1qzq h PHE 319 Cb 1.28 0.28 -0.05 0.00 2.79 0.00 0.00 35.95 40.25 1qzq h PHE 319 CO 0.49 -0.31 -0.50 -0.22 -2.23 0.00 0.00 178.31 175.55 1qzq h LYS 320 N -0.28 -0.67 -0.66 1.11 3.64 -1.87 0.16 116.57 118.00 1qzq h LYS 320 Ca 0.10 0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.60 1qzq h LYS 320 Cb 0.43 0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.35 1qzq h LYS 320 CO -0.30 -0.45 0.34 0.00 -2.27 0.00 0.00 179.45 176.78 1qzq h ALA 321 N -0.59 0.88 -0.16 5.00 0.00 -1.93 -1.35 119.26 121.11 1qzq h ALA 321 Ca -0.00 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1qzq h ALA 321 Cb 0.71 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1qzq h ALA 321 CO -0.28 -0.02 -0.13 -0.44 0.00 0.00 0.00 179.25 178.37 1qzq h ASP 322 N 0.61 0.25 -0.06 0.00 3.32 -0.63 0.47 116.42 120.38 1qzq h ASP 322 Ca 0.31 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 57.25 1qzq h ASP 322 Cb 0.26 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1qzq h ASP 322 CO -0.22 0.41 -0.20 0.25 -1.72 0.00 0.00 179.24 177.76 1qzq h LEU 323 N 0.25 0.27 -0.71 1.55 5.85 -0.23 -1.64 115.31 120.64 1qzq h LEU 323 Ca 0.05 -0.63 0.04 0.00 0.84 0.00 0.00 57.88 58.19 1qzq h LEU 323 Cb 0.39 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 1qzq h LEU 323 CO 0.02 0.85 0.43 0.40 -0.34 0.00 0.00 178.44 179.80 1qzq h ILE 324 N -0.29 1.05 -0.74 4.05 2.04 -1.03 0.66 117.51 123.23 1qzq h ILE 324 Ca -0.01 -0.28 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 1qzq h ILE 324 Cb 0.83 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1qzq h ILE 324 CO 0.04 0.15 0.26 -1.28 0.00 0.00 0.00 178.15 177.32 1qzq h SER 325 N 0.82 1.05 -0.16 1.72 0.87 -0.92 0.02 113.55 116.95 1qzq h SER 325 Ca 0.30 -0.18 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1qzq h SER 325 Cb 0.10 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 1qzq h SER 325 CO -0.14 0.96 0.09 0.22 -0.53 0.00 0.00 176.83 177.43 1qzq h TYR 326 N 1.10 0.22 0.00 2.24 3.20 -0.13 -1.91 116.97 121.70 1qzq h TYR 326 Ca 0.24 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.07 1qzq h TYR 326 Cb 0.26 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 1qzq h TYR 326 CO 0.02 0.22 -0.18 -0.07 -1.64 0.00 0.00 178.16 176.51 1qzq h LEU 327 N 0.16 0.00 -0.67 2.82 3.38 -0.76 -2.81 115.31 117.44 1qzq h LEU 327 Ca 0.06 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1qzq h LEU 327 Cb 0.07 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1qzq h LEU 327 CO -0.01 0.18 0.01 -0.03 0.09 0.00 0.00 178.44 178.68 1qzq h MET 328 N 0.00 1.05 -0.10 1.13 4.05 -0.21 -2.90 114.93 117.95 1qzq h MET 328 Ca -0.00 -0.32 0.03 0.00 -0.28 0.00 0.00 59.70 59.13 1qzq h MET 328 Cb 0.40 -0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.09 1qzq h MET 328 CO 0.02 1.02 0.10 0.00 0.23 0.00 0.00 176.91 178.28 1qzq h ALA 329 N 1.04 1.76 -0.07 0.39 0.00 -1.17 -0.39 119.26 120.82 1qzq h ALA 329 Ca 0.17 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 1qzq h ALA 329 Cb 0.54 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1qzq h ALA 329 CO 0.03 -0.16 -0.42 1.88 0.00 0.00 0.00 179.25 180.58 1qzq h TYR 330 N 0.00 0.19 -5.85 0.00 -1.99 -1.64 -3.47 116.97 104.21 1qzq h TYR 330 Ca 0.05 -0.05 -0.40 0.00 2.00 0.00 0.00 58.73 60.33 1qzq h TYR 330 Cb 0.26 -0.04 0.13 0.00 2.00 0.00 0.00 36.73 39.08 1qzq h TYR 330 CO 0.00 0.56 -0.70 -1.71 -0.00 0.00 0.00 178.16 176.31 1qzq n ASN 331 N -4.02 -5.80 -4.57 3.88 4.05 -0.16 -4.76 115.26 103.87 1qzq n ASN 331 Ca -0.02 -0.56 -0.32 0.00 0.45 0.00 0.00 54.58 54.13 1qzq n ASN 331 Cb 0.47 -4.99 -0.11 0.00 1.23 0.00 0.00 39.78 36.39 1qzq n ASN 331 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1qzq s ALA 332 N -3.33 2.96 0.13 5.20 0.00 -1.26 -5.04 121.76 120.43 1qzq s ALA 332 Ca 0.52 -1.00 -0.25 0.00 0.00 0.00 0.00 51.96 51.23 1qzq s ALA 332 Cb -0.23 -1.11 -0.02 0.00 0.00 0.00 0.00 23.12 21.75 1qzq s ALA 332 CO 0.74 0.60 1.62 -1.35 0.00 0.00 0.00 175.76 177.36 1qzq h PRO 333 N 4.74 -0.37 0.00 0.00 0.11 -2.00 -1.70 132.00 132.79 1qzq h PRO 333 Ca -0.48 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1qzq h PRO 333 Cb 1.17 0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1qzq h PRO 333 CO 0.53 -0.24 -0.06 0.66 -0.21 0.00 0.00 178.00 178.67 1qzq h SER 334 N -0.38 0.00 0.66 -2.05 4.64 -1.97 -2.38 113.55 112.08 1qzq h SER 334 Ca 0.09 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.14 1qzq h SER 334 Cb 0.52 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.57 1qzq h SER 334 CO -0.32 0.06 -1.41 -0.07 -0.87 0.00 0.00 176.83 174.23 1qzq h LEU 335 N 0.00 0.10 -1.68 5.97 3.38 -1.82 -3.21 115.31 118.05 1qzq h LEU 335 Ca -0.00 -0.15 0.12 0.00 0.09 0.00 0.00 57.88 57.93 1qzq h LEU 335 Cb 0.14 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1qzq h LEU 335 CO 0.01 1.13 0.42 0.50 0.09 0.00 0.00 178.44 180.58 1qzq h LYS 336 N 0.02 0.34 -0.59 1.13 1.63 -0.79 0.43 116.57 118.74 1qzq h LYS 336 Ca -0.18 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.50 1qzq h LYS 336 Cb 1.92 -0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 33.46 1qzq h LYS 336 CO 0.12 0.22 -0.03 0.93 -3.45 0.00 0.00 179.45 177.25 1qzq h GLU 337 N 0.35 1.04 -0.10 1.90 4.39 -1.53 -2.43 114.58 118.20 1qzq h GLU 337 Ca 0.29 -0.34 -0.16 0.00 0.34 0.00 0.00 59.36 59.49 1qzq h GLU 337 Cb 0.67 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 1qzq h GLU 337 CO -0.07 1.03 -0.61 -1.49 -1.16 0.00 0.00 179.01 176.71 1qzq h TRP 338 N 0.95 0.44 -0.75 4.33 4.06 -0.38 -2.78 115.95 121.81 1qzq h TRP 338 Ca 0.16 -0.17 0.06 0.00 2.06 0.00 0.00 58.89 61.00 1qzq h TRP 338 Cb 0.58 -0.08 -0.06 0.00 -1.00 0.00 0.00 29.16 28.61 1qzq h TRP 338 CO 0.04 0.86 0.45 0.82 -3.56 0.00 0.00 178.44 177.05 1qzq h ILE 339 N 0.25 1.01 -0.01 1.49 2.04 -0.39 -0.60 117.51 121.31 1qzq h ILE 339 Ca -0.01 -0.28 -0.07 0.00 1.00 0.00 0.00 64.86 65.50 1qzq h ILE 339 Cb 1.14 0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1qzq h ILE 339 CO 0.10 0.15 -0.31 0.44 0.00 0.00 0.00 178.15 178.53 1qzq h ASP 340 N 0.83 0.02 -0.23 1.72 3.45 -1.24 -1.12 116.42 119.85 1qzq h ASP 340 Ca 0.33 -0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.67 1qzq h ASP 340 Cb 0.16 -0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.93 1qzq h ASP 340 CO -0.17 0.32 -0.32 0.58 -1.57 0.00 0.00 179.24 178.08 1qzq h VAL 341 N 0.01 1.32 -0.57 -1.35 2.07 -0.97 -2.84 116.25 113.93 1qzq h VAL 341 Ca -0.00 -1.52 -0.03 0.00 0.82 0.00 0.00 66.70 65.97 1qzq h VAL 341 Cb 0.55 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 1qzq h VAL 341 CO 0.04 0.47 0.24 0.40 0.02 0.00 0.00 177.57 178.75 1qzq h ILE 342 N 0.33 1.22 -0.75 4.57 2.04 -0.72 -2.04 117.51 122.15 1qzq h ILE 342 Ca 0.03 -0.66 0.16 0.00 1.00 0.00 0.00 64.86 65.39 1qzq h ILE 342 Cb 0.90 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 1qzq h ILE 342 CO 0.07 0.26 0.51 0.45 0.00 0.00 0.00 178.15 179.44 1qzq h HIS 343 N 0.77 0.41 -0.00 1.37 3.86 -1.17 0.92 115.15 121.32 1qzq h HIS 343 Ca 0.19 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.41 1qzq h HIS 343 Cb 0.17 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.51 1qzq h HIS 343 CO 0.00 0.15 -0.04 1.17 0.86 0.00 0.00 177.93 180.08 1qzq n LYS 344 N -4.46 0.94 -4.29 2.45 3.00 -0.78 -4.84 118.16 110.19 1qzq n LYS 344 Ca 0.14 -0.24 -0.23 0.00 -0.00 0.00 0.00 58.31 57.98 1qzq n LYS 344 Cb 0.58 -1.49 -0.07 0.00 0.00 0.00 0.00 35.03 34.04 1qzq n LYS 344 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 1qzq s HIS 345 N -2.23 2.68 -0.51 5.64 3.76 0.32 0.66 115.29 125.62 1qzq s HIS 345 Ca 0.38 -0.25 -0.17 0.00 -0.15 0.00 0.00 55.06 54.87 1qzq s HIS 345 Cb 0.21 -1.23 0.08 0.00 1.11 0.00 0.00 32.58 32.75 1qzq s HIS 345 CO 0.41 0.60 0.50 0.34 -0.85 0.00 0.00 174.74 175.74 1qzq s ASP 346 N -3.68 6.18 -0.23 1.40 -1.08 -0.31 -4.46 116.67 114.49 1qzq s ASP 346 Ca 0.32 -1.33 0.14 0.00 -0.52 0.00 0.00 52.55 51.16 1qzq s ASP 346 Cb -0.06 -2.23 0.72 0.00 -1.46 0.00 0.00 42.92 39.89 1qzq s ASP 346 CO 0.20 -0.79 1.65 0.18 0.52 0.00 0.00 175.17 176.93 1qzq n LEU 347 N 5.56 5.18 0.29 -1.34 4.32 0.50 -4.10 117.00 127.41 1qzq n LEU 347 Ca -0.11 -3.03 0.20 0.00 -0.02 0.00 0.00 56.01 53.05 1qzq n LEU 347 Cb 0.43 -0.65 1.00 0.00 -1.62 0.00 0.00 43.42 42.58 1qzq n LEU 347 CO 0.51 0.68 1.08 0.77 -1.22 0.00 0.00 177.39 179.22 1qzq h SER 348 N 3.06 0.00 0.66 -1.43 4.64 -1.59 -2.09 113.55 116.80 1qzq h SER 348 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1qzq h SER 348 Cb 1.86 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.95 1qzq h SER 348 CO 0.44 0.00 0.00 1.21 -0.87 0.00 0.00 176.83 177.61 1qzq n GLU 349 N -2.91 0.27 -1.91 4.77 2.13 -1.26 -4.40 120.64 117.33 1qzq n GLU 349 Ca -0.02 0.02 -0.42 0.00 0.66 0.00 0.00 57.16 57.41 1qzq n GLU 349 Cb 0.11 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.29 1qzq n GLU 349 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1qzq s THR 350 N -2.71 2.58 -0.17 6.31 2.01 -0.79 -4.93 115.64 117.95 1qzq s THR 350 Ca 0.22 0.40 0.11 0.00 0.31 0.00 0.00 61.69 62.73 1qzq s THR 350 Cb 0.18 -3.25 0.22 0.00 0.01 0.00 0.00 72.50 69.66 1qzq s THR 350 CO 0.45 0.03 1.14 -0.46 -0.69 0.00 0.00 174.62 175.09 1qzq n ASN 351 N 4.11 2.48 -4.49 3.53 0.23 -1.26 -4.44 115.26 115.42 1qzq n ASN 351 Ca 0.14 -2.60 -0.25 0.00 -0.53 0.00 0.00 54.58 51.34 1qzq n ASN 351 Cb 0.38 -0.28 -0.10 0.00 -2.08 0.00 0.00 39.78 37.71 1qzq n ASN 351 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1qzq s VAL 352 N -2.05 2.61 -0.14 3.53 -7.23 -1.26 -4.72 120.40 111.14 1qzq s VAL 352 Ca 0.21 -2.23 -0.07 0.00 -1.81 0.00 0.00 61.98 58.08 1qzq s VAL 352 Cb 0.18 -2.35 -0.04 0.00 0.56 0.00 0.00 36.38 34.73 1qzq s VAL 352 CO 0.04 -0.33 0.11 -0.31 -0.31 0.00 0.00 175.10 174.31 1qzq s TYR 353 N -2.28 3.47 -0.01 2.82 1.51 -0.66 -4.70 117.35 117.51 1qzq s TYR 353 Ca 0.28 0.40 -0.29 0.00 -1.01 0.00 0.00 57.07 56.46 1qzq s TYR 353 Cb -0.06 -1.98 -0.03 0.00 -0.11 0.00 0.00 41.96 39.78 1qzq s TYR 353 CO 0.15 0.56 0.92 -1.17 -1.11 0.00 0.00 175.55 174.89 1qzq s LEU 354 N -0.59 4.36 -0.26 -1.29 2.96 -1.26 -0.49 118.68 122.10 1qzq s LEU 354 Ca 0.12 1.56 0.02 0.00 -0.22 0.00 0.00 54.13 55.61 1qzq s LEU 354 Cb -0.12 -3.46 0.07 0.00 0.50 0.00 0.00 46.19 43.18 1qzq s LEU 354 CO 0.02 -0.22 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.17 1qzq s ILE 355 N 0.93 1.70 0.33 6.68 1.01 -0.56 -4.95 121.20 126.34 1qzq s ILE 355 Ca 0.49 -1.50 0.10 0.00 0.00 0.00 0.00 60.65 59.73 1qzq s ILE 355 Cb -0.20 -2.02 -0.06 0.00 0.01 0.00 0.00 42.46 40.19 1qzq s ILE 355 CO 0.26 -0.24 -0.07 -0.83 0.00 0.00 0.00 174.94 174.06 1qzq s GLY 356 N 1.28 2.09 -0.03 6.18 0.00 -1.26 -1.47 107.32 114.11 1qzq s GLY 356 Ca -0.02 -2.00 0.03 0.00 0.00 0.00 0.00 44.72 42.73 1qzq s GLY 356 CO -0.08 -1.97 -0.11 -0.56 0.00 0.00 0.00 173.10 170.38 1qzq s SER 357 N -3.63 1.46 0.09 1.64 0.01 -0.25 -1.93 113.70 111.09 1qzq s SER 357 Ca 0.33 -0.23 0.03 0.00 1.31 0.00 0.00 55.95 57.39 1qzq s SER 357 Cb 0.00 -0.38 -0.03 0.00 0.21 0.00 0.00 66.02 65.82 1qzq s SER 357 CO 0.17 0.09 -0.10 0.42 0.41 0.00 0.00 173.24 174.24 1qzq s THR 358 N 0.12 0.88 0.37 1.44 -4.23 -1.20 -2.12 115.64 110.91 1qzq s THR 358 Ca -0.03 -1.60 -0.26 0.00 -1.18 0.00 0.00 61.69 58.62 1qzq s THR 358 Cb -0.09 -1.30 -0.09 0.00 1.34 0.00 0.00 72.50 72.36 1qzq s THR 358 CO 0.01 -0.56 1.16 -2.84 -0.54 0.00 0.00 174.62 171.85 1qzq s PRO 359 N -2.73 4.20 0.00 3.99 0.02 -1.23 -4.64 135.00 134.60 1qzq s PRO 359 Ca 0.04 1.85 0.00 0.00 0.02 0.00 0.00 61.00 62.91 1qzq s PRO 359 Cb -0.03 -2.80 0.00 0.00 0.02 0.00 0.00 34.50 31.69 1qzq s PRO 359 CO -0.00 -0.20 0.00 0.41 -0.33 0.00 0.00 177.00 176.88 1qzq n GLY 360 N 0.72 0.62 2.98 0.52 0.00 0.31 -4.96 105.19 105.40 1qzq n GLY 360 Ca 0.03 -1.30 -0.31 0.00 0.00 0.00 0.00 46.02 44.44 1qzq n GLY 360 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qzq s ARG 361 N -1.93 1.52 -0.18 1.61 0.52 -1.26 -0.44 118.95 118.78 1qzq s ARG 361 Ca 0.00 -1.58 -0.11 0.00 -0.52 0.00 0.00 55.73 53.51 1qzq s ARG 361 Cb 0.00 -2.92 -0.05 0.00 0.52 0.00 0.00 34.95 32.50 1qzq s ARG 361 CO 0.00 -0.85 0.19 -0.06 0.02 0.00 0.00 175.30 174.60 1qzq s PHE 362 N 1.09 3.43 0.23 -0.53 0.08 0.27 -4.85 117.98 117.70 1qzq s PHE 362 Ca 0.06 0.43 0.11 0.00 0.12 0.00 0.00 56.93 57.64 1qzq s PHE 362 Cb -0.19 -2.22 -0.05 0.00 -0.57 0.00 0.00 43.02 39.99 1qzq s PHE 362 CO -0.10 0.28 -0.20 -0.65 -0.10 0.00 0.00 175.22 174.45 1qzq s GLN 363 N 0.38 1.52 4.74 0.44 -0.21 -1.26 -0.82 119.66 124.45 1qzq s GLN 363 Ca 0.11 -1.63 0.00 0.00 0.02 0.00 0.00 55.36 53.86 1qzq s GLN 363 Cb -0.12 -1.60 0.00 0.00 1.00 0.00 0.00 33.01 32.29 1qzq s GLN 363 CO 0.00 0.31 0.00 0.41 -2.12 0.00 0.00 175.29 173.89 1qzq n GLY 364 N -0.26 1.73 0.36 3.09 0.00 -1.26 -3.00 105.19 105.85 1qzq n GLY 364 Ca -0.08 -0.54 0.16 0.00 0.00 0.00 0.00 46.02 45.56 1qzq n GLY 364 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1qzq h SER 365 N 9.35 0.67 0.00 1.61 4.64 -1.99 0.38 113.55 128.20 1qzq h SER 365 Ca 0.00 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1qzq h SER 365 Cb 0.00 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1qzq h SER 365 CO 0.00 0.18 0.01 1.56 -0.87 0.00 0.00 176.83 177.71 1qzq h GLN 366 N 0.62 0.00 0.00 4.77 4.20 -1.91 -1.50 115.11 121.29 1qzq h GLN 366 Ca 0.60 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 59.30 1qzq h GLN 366 Cb 1.13 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.90 1qzq h GLN 366 CO -0.39 0.00 -0.03 0.87 -0.67 0.00 0.00 178.83 178.61 1qzq h LYS 367 N 0.00 0.00 -0.01 1.46 1.57 -1.02 -2.17 116.57 116.40 1qzq h LYS 367 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1qzq h LYS 367 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1qzq h LYS 367 CO 0.00 0.03 -0.18 -0.25 -0.57 0.00 0.00 179.45 178.48 1qzq n ASP 368 N -3.78 1.09 0.09 0.86 8.00 -0.56 -4.25 116.55 117.99 1qzq n ASP 368 Ca -0.03 -1.01 -0.07 0.00 0.71 0.00 0.00 54.79 54.39 1qzq n ASP 368 Cb 0.12 0.08 0.01 0.00 -0.02 0.00 0.00 41.12 41.31 1qzq n ASP 368 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1qzq h ASN 369 N 1.42 0.19 -4.65 -2.24 2.35 -1.55 -3.32 115.58 107.78 1qzq h ASN 369 Ca 0.00 -0.16 -0.39 0.00 -0.55 0.00 0.00 56.30 55.20 1qzq h ASN 369 Cb 0.49 -0.06 -0.14 0.00 0.05 0.00 0.00 38.32 38.66 1qzq h ASN 369 CO 0.00 0.95 -0.58 0.26 -1.65 0.00 0.00 177.43 176.42 1qzq s TRP 370 N -3.22 1.57 0.00 1.19 0.52 -1.26 -4.68 118.94 113.06 1qzq s TRP 370 Ca -0.02 -1.31 0.00 0.00 0.02 0.00 0.00 56.10 54.78 1qzq s TRP 370 Cb 0.10 -0.87 0.00 0.00 -1.15 0.00 0.00 33.47 31.56 1qzq s TRP 370 CO 0.82 -0.47 0.00 0.41 0.02 0.00 0.00 176.95 177.73 1qzq n GLY 371 N -0.55 0.97 0.29 0.98 0.00 -0.81 -1.51 105.19 104.56 1qzq n GLY 371 Ca 0.01 -0.67 0.18 0.00 0.00 0.00 0.00 46.02 45.54 1qzq n GLY 371 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1qzq h HIS 372 N 0.00 0.00 -0.15 1.61 2.07 -1.53 -1.72 115.15 115.43 1qzq h HIS 372 Ca 0.00 0.00 -0.18 0.00 -2.85 0.00 0.00 60.37 57.34 1qzq h HIS 372 Cb 0.00 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 29.98 1qzq h HIS 372 CO 0.00 0.02 -0.65 0.74 -3.07 0.00 0.00 177.93 174.97 1qzq h PHE 373 N 0.00 0.72 -0.72 6.12 -1.00 -1.80 -1.19 116.94 119.07 1qzq h PHE 373 Ca -0.00 -0.29 -0.06 0.00 2.81 0.00 0.00 57.97 60.43 1qzq h PHE 373 Cb 0.38 -0.12 -0.03 0.00 3.61 0.00 0.00 35.95 39.79 1qzq h PHE 373 CO 0.00 1.05 0.21 -0.09 -1.61 0.00 0.00 178.31 177.87 1qzq h ARG 374 N 0.40 1.14 -0.41 1.51 9.65 -0.37 -1.23 114.38 125.07 1qzq h ARG 374 Ca -0.01 -0.26 -0.00 0.00 -1.10 0.00 0.00 59.98 58.61 1qzq h ARG 374 Cb 1.22 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 29.62 1qzq h ARG 374 CO 0.12 0.98 0.25 1.25 2.80 0.00 0.00 179.97 185.37 1qzq h LEU 375 N 1.08 0.49 -0.57 3.80 5.85 -1.23 -2.58 115.31 122.15 1qzq h LEU 375 Ca 0.23 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.94 1qzq h LEU 375 Cb 0.33 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 1qzq h LEU 375 CO -0.00 0.40 0.32 0.50 -0.34 0.00 0.00 178.44 179.32 1qzq h LYS 376 N 0.54 0.61 -0.40 1.25 3.64 -0.71 -1.56 116.57 119.94 1qzq h LYS 376 Ca 0.15 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1qzq h LYS 376 Cb -0.00 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1qzq h LYS 376 CO -0.03 0.40 0.23 -0.22 -2.27 0.00 0.00 179.45 177.56 1qzq h LYS 377 N 0.63 0.45 -0.59 1.90 1.63 -1.03 -0.76 116.57 118.80 1qzq h LYS 377 Ca 0.24 -0.03 -0.09 0.00 -0.85 0.00 0.00 60.65 59.92 1qzq h LYS 377 Cb 0.09 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.60 1qzq h LYS 377 CO -0.14 0.30 -0.00 -0.07 -3.45 0.00 0.00 179.45 176.09 1qzq h LEU 378 N 0.46 1.00 -0.97 5.20 3.38 -1.11 -1.41 115.31 121.86 1qzq h LEU 378 Ca 0.16 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1qzq h LEU 378 Cb 0.02 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1qzq h LEU 378 CO -0.08 1.06 -0.20 -0.07 0.09 0.00 0.00 178.44 179.24 1qzq h LEU 379 N 0.94 0.00 -0.00 1.67 3.38 -0.97 -0.73 115.31 119.59 1qzq h LEU 379 Ca 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1qzq h LEU 379 Cb 0.55 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1qzq h LEU 379 CO 0.03 0.20 -0.04 0.50 0.09 0.00 0.00 178.44 179.22 1qzq h LYS 380 N 0.00 0.03 0.00 1.13 3.64 -0.80 -1.42 116.57 119.15 1qzq h LYS 380 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1qzq h LYS 380 Cb 0.79 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 1qzq h LYS 380 CO 0.03 0.76 -0.42 -0.44 -2.27 0.00 0.00 179.45 177.10 1qzq h ASP 381 N -0.69 0.00 0.00 4.20 3.32 -1.23 -3.15 116.42 118.87 1qzq h ASP 381 Ca -0.00 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1qzq h ASP 381 Cb 0.77 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1qzq h ASP 381 CO 0.01 0.07 0.00 1.41 -1.72 0.00 0.00 179.24 179.01 1qzq n HIS 382 N -2.19 0.00 -4.40 4.55 8.25 -0.29 -5.04 115.22 116.11 1qzq n HIS 382 Ca 0.04 -0.04 -0.25 0.00 -0.26 0.00 0.00 57.72 57.20 1qzq n HIS 382 Cb 0.44 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.44 1qzq n HIS 382 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1qzq s ALA 383 N -0.09 2.76 0.05 -1.41 0.00 -1.13 -4.64 121.76 117.31 1qzq s ALA 383 Ca 0.00 -1.70 0.09 0.00 0.00 0.00 0.00 51.96 50.35 1qzq s ALA 383 Cb 0.00 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.66 1qzq s ALA 383 CO 0.00 0.36 -0.25 -1.54 0.00 0.00 0.00 175.76 174.33 1qzq s SER 384 N -3.11 3.05 -0.05 0.00 1.04 -1.26 -1.43 113.70 111.93 1qzq s SER 384 Ca 0.26 -0.59 -0.30 0.00 0.48 0.00 0.00 55.95 55.80 1qzq s SER 384 Cb -0.07 -0.27 -0.03 0.00 0.10 0.00 0.00 66.02 65.76 1qzq s SER 384 CO 0.14 0.23 1.12 -0.55 0.98 0.00 0.00 173.24 175.16 1qzq s SER 385 N -1.30 7.14 0.52 7.02 0.15 -1.26 -4.58 113.70 121.40 1qzq s SER 385 Ca 0.11 1.75 0.07 0.00 0.70 0.00 0.00 55.95 58.58 1qzq s SER 385 Cb -0.10 -2.56 0.05 0.00 -1.71 0.00 0.00 66.02 61.70 1qzq s SER 385 CO 0.02 -0.49 0.72 0.00 1.20 0.00 0.00 173.24 174.69 1qzq s MET 386 N 1.87 2.49 0.33 5.44 0.23 -1.26 -5.01 119.30 123.39 1qzq s MET 386 Ca 0.54 -1.29 -0.28 0.00 -1.03 0.00 0.00 55.69 53.62 1qzq s MET 386 Cb -0.23 -2.64 -0.10 0.00 -1.53 0.00 0.00 34.83 30.33 1qzq s MET 386 CO 0.23 -0.66 1.23 -1.25 -2.03 0.00 0.00 175.02 172.54 1qzq s PRO 387 N -4.60 4.36 -1.74 3.16 0.04 -1.26 -2.83 135.00 132.13 1qzq s PRO 387 Ca 0.59 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.67 1qzq s PRO 387 Cb -0.08 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1qzq s PRO 387 CO 0.37 -0.12 0.00 -1.71 0.04 0.00 0.00 177.00 175.58 1qzq n ASN 388 N 0.75 -5.64 -0.18 6.66 5.15 -1.26 -4.84 115.26 115.89 1qzq n ASN 388 Ca 0.01 0.04 0.21 0.00 -0.60 0.00 0.00 54.58 54.23 1qzq n ASN 388 Cb 0.43 -4.70 0.58 0.00 -0.53 0.00 0.00 39.78 35.57 1qzq n ASN 388 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1qzq h ALA 389 N 0.83 2.37 -0.90 5.20 0.00 -1.93 -0.31 119.26 124.52 1qzq h ALA 389 Ca -0.46 -0.00 0.26 0.00 0.00 0.00 0.00 54.91 54.71 1qzq h ALA 389 Cb 1.34 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 1qzq h ALA 389 CO 0.56 -0.61 0.74 1.05 0.00 0.00 0.00 179.25 180.99 1qzq h GLU 390 N 0.27 0.00 -0.01 0.00 4.11 -1.88 0.22 114.58 117.29 1qzq h GLU 390 Ca 0.41 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.84 1qzq h GLU 390 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1qzq h GLU 390 CO -0.11 0.00 -0.32 -1.13 0.07 0.00 0.00 179.01 177.52 1qzq n SER 391 N -3.97 1.36 -4.58 3.06 3.41 -0.13 -4.07 113.62 108.71 1qzq n SER 391 Ca 0.19 -1.11 -0.42 0.00 -0.26 0.00 0.00 58.87 57.27 1qzq n SER 391 Cb 1.05 0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 65.22 1qzq n SER 391 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1qzq s TRP 392 N -2.48 2.46 0.89 7.33 0.52 0.78 -4.23 118.94 124.20 1qzq s TRP 392 Ca 0.23 0.46 -0.11 0.00 0.02 0.00 0.00 56.10 56.69 1qzq s TRP 392 Cb 0.19 -4.45 0.13 0.00 -1.15 0.00 0.00 33.47 28.18 1qzq s TRP 392 CO 0.53 -1.77 1.10 -1.25 0.02 0.00 0.00 176.95 175.57 1qzq s PRO 393 N 5.18 1.30 -0.16 4.98 0.04 -1.21 -4.76 135.00 140.38 1qzq s PRO 393 Ca 0.48 1.08 -0.02 0.00 0.04 0.00 0.00 61.00 62.58 1qzq s PRO 393 Cb -0.09 -1.79 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 1qzq s PRO 393 CO 0.26 -2.29 -0.08 0.08 0.04 0.00 0.00 177.00 175.00 1qzq s VAL 394 N -2.82 3.34 -0.13 -0.36 1.01 -0.28 -3.09 120.40 118.07 1qzq s VAL 394 Ca 0.64 -0.54 -0.02 0.00 0.00 0.00 0.00 61.98 62.05 1qzq s VAL 394 Cb -0.19 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.71 1qzq s VAL 394 CO 0.58 0.49 -0.05 -0.69 0.00 0.00 0.00 175.10 175.43 1qzq s VAL 395 N 0.66 3.81 -0.09 2.92 1.01 0.03 -1.18 120.40 127.55 1qzq s VAL 395 Ca -0.05 -0.40 0.01 0.00 0.00 0.00 0.00 61.98 61.54 1qzq s VAL 395 Cb -0.15 -2.63 0.02 0.00 0.00 0.00 0.00 36.38 33.61 1qzq s VAL 395 CO 0.02 0.53 -0.11 -0.83 0.00 0.00 0.00 175.10 174.71 1qzq s GLY 396 N 0.02 0.85 -0.10 4.51 0.00 0.06 -1.46 107.32 111.20 1qzq s GLY 396 Ca -0.00 -0.52 0.00 0.00 0.00 0.00 0.00 44.72 44.20 1qzq s GLY 396 CO 0.03 0.40 -0.08 1.62 0.00 0.00 0.00 173.10 175.07 1qzq s GLN 397 N 1.12 1.44 0.29 2.90 -0.44 -0.04 0.62 119.66 125.54 1qzq s GLN 397 Ca -0.06 -0.24 -0.02 0.00 -2.50 0.00 0.00 55.36 52.54 1qzq s GLN 397 Cb -0.14 -1.45 -0.02 0.00 -1.64 0.00 0.00 33.01 29.76 1qzq s GLN 397 CO -0.02 -0.20 0.35 -0.59 0.50 0.00 0.00 175.29 175.34 1qzq s PHE 398 N 1.47 1.11 -0.34 1.67 -0.71 -1.05 -0.82 117.98 119.31 1qzq s PHE 398 Ca 0.00 -1.29 0.03 0.00 -1.04 0.00 0.00 56.93 54.63 1qzq s PHE 398 Cb -0.13 -0.28 0.05 0.00 -1.21 0.00 0.00 43.02 41.45 1qzq s PHE 398 CO -0.05 -0.94 0.77 -1.13 -1.34 0.00 0.00 175.22 172.52 1qzq n SER 399 N -0.99 1.61 -3.50 1.98 3.41 -1.26 -4.61 113.62 110.27 1qzq n SER 399 Ca 0.02 -1.44 -0.15 0.00 -0.26 0.00 0.00 58.87 57.04 1qzq n SER 399 Cb 0.63 -0.02 -0.04 0.00 -0.26 0.00 0.00 64.21 64.51 1qzq n SER 399 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1qzq s SER 400 N -0.52 -0.58 -0.01 4.04 0.15 -1.26 -3.75 113.70 111.76 1qzq s SER 400 Ca 0.05 0.34 0.04 0.00 0.70 0.00 0.00 55.95 57.07 1qzq s SER 400 Cb 0.03 0.55 -0.01 0.00 -1.71 0.00 0.00 66.02 64.88 1qzq s SER 400 CO 0.04 -0.76 -0.12 -0.69 1.20 0.00 0.00 173.24 172.91 1qzq s VAL 401 N -2.38 0.95 0.54 4.45 1.01 -1.26 -2.97 120.40 120.74 1qzq s VAL 401 Ca -0.05 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 61.50 1qzq s VAL 401 Cb -0.01 -0.80 0.08 0.00 0.00 0.00 0.00 36.38 35.65 1qzq s VAL 401 CO -0.01 0.27 0.65 0.61 0.00 0.00 0.00 175.10 176.62 1qzq n GLY 402 N 2.89 2.20 3.64 4.51 0.00 -0.51 -4.79 105.19 113.12 1qzq n GLY 402 Ca -0.15 -2.24 -0.43 0.00 0.00 0.00 0.00 46.02 43.20 1qzq n GLY 402 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qzq s SER 403 N -4.28 6.71 0.00 1.61 0.01 -1.26 -4.88 113.70 111.61 1qzq s SER 403 Ca 0.49 1.38 0.23 0.00 1.31 0.00 0.00 55.95 59.36 1qzq s SER 403 Cb -0.04 -2.54 0.09 0.00 0.21 0.00 0.00 66.02 63.75 1qzq s SER 403 CO 0.31 -1.02 1.14 0.18 0.41 0.00 0.00 173.24 174.26 1qzq n LEU 404 N 7.46 1.47 0.00 2.44 4.77 -1.26 -4.74 117.00 127.15 1qzq n LEU 404 Ca 0.15 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1qzq n LEU 404 Cb 0.46 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1qzq n LEU 404 CO 0.61 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.58 1qzq n GLY 405 N 1.44 1.44 0.22 -0.72 0.00 -1.26 -4.12 105.19 102.19 1qzq n GLY 405 Ca 0.08 -2.25 0.08 0.00 0.00 0.00 0.00 46.02 43.93 1qzq n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qzq h ALA 406 N 0.00 1.22 -2.87 4.61 0.00 -1.98 -3.44 119.26 116.80 1qzq h ALA 406 Ca 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1qzq h ALA 406 Cb 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.66 1qzq h ALA 406 CO 0.00 0.32 -0.00 0.16 0.00 0.00 0.00 179.25 179.72 1qzq s ASP 407 N -6.44 -0.18 0.48 0.00 3.84 -1.26 -4.93 116.67 108.18 1qzq s ASP 407 Ca -0.02 -0.70 0.22 0.00 -0.00 0.00 0.00 52.55 52.06 1qzq s ASP 407 Cb 0.13 0.60 1.26 0.00 -1.38 0.00 0.00 42.92 43.53 1qzq s ASP 407 CO 0.65 -1.14 1.94 1.05 -0.00 0.00 0.00 175.17 177.67 1qzq h GLU 408 N 2.20 0.19 0.00 2.11 4.11 -1.92 -1.70 114.58 119.56 1qzq h GLU 408 Ca -0.26 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.16 1qzq h GLU 408 Cb 1.25 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1qzq h GLU 408 CO 0.34 0.12 0.00 0.66 0.07 0.00 0.00 179.01 180.20 1qzq h SER 409 N 0.19 0.00 0.71 3.06 4.64 -1.95 0.29 113.55 120.49 1qzq h SER 409 Ca 0.35 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.58 1qzq h SER 409 Cb 1.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.17 1qzq h SER 409 CO -0.06 0.00 -0.39 0.11 -0.87 0.00 0.00 176.83 175.61 1qzq h LYS 410 N 0.00 0.00 0.00 4.77 1.79 -1.59 -3.41 116.57 118.13 1qzq h LYS 410 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1qzq h LYS 410 Cb 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1qzq h LYS 410 CO 0.00 0.39 0.00 1.87 -1.08 0.00 0.00 179.45 180.63 1qzq n TRP 411 N -3.66 -2.08 0.11 -1.35 -0.00 -1.22 -4.88 117.44 104.37 1qzq n TRP 411 Ca -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 57.50 57.43 1qzq n TRP 411 Cb 0.49 0.42 -0.03 0.00 -0.00 0.00 0.00 31.31 32.18 1qzq n TRP 411 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1qzq h LEU 412 N 0.00 -0.46 -1.07 5.87 5.85 -1.77 -1.36 115.31 122.36 1qzq h LEU 412 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1qzq h LEU 412 Cb 0.00 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.18 1qzq h LEU 412 CO 0.00 -0.23 0.00 0.00 -0.34 0.00 0.00 178.44 177.87 1qzq n SER 414 N 0.10 0.00 -0.08 0.00 2.88 -1.08 -4.75 113.62 110.69 1qzq n SER 414 Ca 0.07 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.55 1qzq n SER 414 Cb 0.29 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 63.89 1qzq n SER 414 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1qzq h GLU 415 N 0.00 0.73 0.37 -1.46 4.11 -1.71 -2.21 114.58 114.40 1qzq h GLU 415 Ca 0.00 -0.25 -0.02 0.00 0.07 0.00 0.00 59.36 59.17 1qzq h GLU 415 Cb 0.00 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1qzq h GLU 415 CO 0.00 0.83 -0.18 0.35 0.07 0.00 0.00 179.01 180.08 1qzq h PHE 416 N 0.66 -0.46 -0.17 2.06 3.57 -1.34 -2.66 116.94 118.59 1qzq h PHE 416 Ca 0.11 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 1qzq h PHE 416 Cb 0.60 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 1qzq h PHE 416 CO 0.03 -0.13 -0.06 -0.22 -2.23 0.00 0.00 178.31 175.69 1qzq h LYS 417 N -0.82 0.26 -0.45 1.11 3.64 -0.91 -1.95 116.57 117.45 1qzq h LYS 417 Ca -0.05 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1qzq h LYS 417 Cb 0.53 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.27 1qzq h LYS 417 CO 0.08 0.34 0.22 0.93 -2.27 0.00 0.00 179.45 178.75 1qzq h GLU 418 N 0.25 0.42 -0.20 1.90 4.39 -1.33 -0.80 114.58 119.21 1qzq h GLU 418 Ca 0.06 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.68 1qzq h GLU 418 Cb 0.28 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 1qzq h GLU 418 CO 0.01 0.28 -0.06 0.77 -1.16 0.00 0.00 179.01 178.85 1qzq h SER 419 N 0.44 0.41 0.02 1.42 0.02 -1.08 -3.01 113.55 111.76 1qzq h SER 419 Ca 0.19 -0.38 -0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1qzq h SER 419 Cb 0.11 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1qzq h SER 419 CO -0.14 0.69 -0.00 0.24 -1.14 0.00 0.00 176.83 176.48 1qzq h MET 420 N 0.11 0.00 -0.25 3.45 2.86 -1.00 -2.41 114.93 117.69 1qzq h MET 420 Ca 0.05 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1qzq h MET 420 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1qzq h MET 420 CO 0.02 0.00 0.00 1.47 1.06 0.00 0.00 176.91 179.47 1qzq n LEU 421 N -3.53 2.94 -4.77 1.22 -0.00 -0.34 -4.96 117.00 107.56 1qzq n LEU 421 Ca -0.03 -1.41 -0.40 0.00 -0.00 0.00 0.00 56.01 54.17 1qzq n LEU 421 Cb 0.08 -0.16 -0.01 0.00 -0.00 0.00 0.00 43.42 43.33 1qzq n LEU 421 CO 0.25 0.62 0.98 -0.89 -0.00 0.00 0.00 177.39 178.35 1qzq s THR 422 N -1.31 2.63 -0.26 1.47 2.01 -0.91 -5.02 115.64 114.26 1qzq s THR 422 Ca 0.28 0.61 -0.12 0.00 0.31 0.00 0.00 61.69 62.77 1qzq s THR 422 Cb 0.17 -3.38 0.09 0.00 0.01 0.00 0.00 72.50 69.39 1qzq s THR 422 CO 0.24 0.13 0.60 -0.76 -0.69 0.00 0.00 174.62 174.14 1qzq s LEU 423 N -2.06 -0.81 0.00 4.42 1.43 -1.26 -4.72 118.68 115.68 1qzq s LEU 423 Ca 0.52 1.36 0.00 0.00 -1.03 0.00 0.00 54.13 54.98 1qzq s LEU 423 Cb -0.40 2.06 0.00 0.00 0.03 0.00 0.00 46.19 47.89 1qzq s LEU 423 CO 0.52 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.49 1qzq n GLY 424 N 4.72 -2.08 0.70 -3.19 0.00 -0.52 -3.99 105.19 100.83 1qzq n GLY 424 Ca -0.17 -1.37 0.09 0.00 0.00 0.00 0.00 46.02 44.58 1qzq n GLY 424 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1qzq n LYS 425 N -2.31 1.63 -0.10 1.61 5.02 -1.19 -4.33 118.16 118.49 1qzq n LYS 425 Ca 0.00 -1.49 0.00 0.00 -2.02 0.00 0.00 58.31 54.80 1qzq n LYS 425 Cb 0.27 -1.36 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 1qzq n LYS 425 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1qzq n GLU 426 N 0.85 1.73 0.00 1.97 1.02 -1.26 -5.14 120.64 119.81 1qzq n GLU 426 Ca 0.10 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 1qzq n GLU 426 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.88 1qzq n GLU 426 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1qzq n SER 427 N -0.58 0.00 0.00 1.62 3.41 -1.26 -5.01 113.62 111.79 1qzq n SER 427 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1qzq n SER 427 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1qzq n SER 427 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1qzq n SER 434 N -1.95 -1.66 -4.72 4.04 3.41 -1.26 -5.20 113.62 106.28 1qzq n SER 434 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1qzq n SER 434 Cb 0.00 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 63.64 1qzq n SER 434 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1qzq s VAL 435 N -2.52 4.07 0.24 -3.33 1.01 -1.26 -4.95 120.40 113.66 1qzq s VAL 435 Ca 0.00 1.62 -0.30 0.00 0.00 0.00 0.00 61.98 63.29 1qzq s VAL 435 Cb 0.00 -4.03 -0.10 0.00 0.00 0.00 0.00 36.38 32.24 1qzq s VAL 435 CO 0.00 0.20 1.52 -2.84 0.00 0.00 0.00 175.10 173.98 1qzq s PRO 436 N 0.39 4.21 -0.27 2.72 0.02 -1.26 -4.87 135.00 135.94 1qzq s PRO 436 Ca 0.53 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.96 1qzq s PRO 436 Cb -0.28 -3.10 0.05 0.00 0.02 0.00 0.00 34.50 31.19 1qzq s PRO 436 CO 0.32 -0.53 -0.07 -1.17 -0.33 0.00 0.00 177.00 175.22 1qzq s LEU 437 N 0.01 3.46 -0.21 -5.54 2.96 -1.26 -1.12 118.68 116.97 1qzq s LEU 437 Ca 0.63 -1.19 -0.09 0.00 -0.22 0.00 0.00 54.13 53.27 1qzq s LEU 437 Cb -0.44 -1.63 -0.05 0.00 0.50 0.00 0.00 46.19 44.58 1qzq s LEU 437 CO 0.41 -0.19 0.11 -0.31 -1.32 0.00 0.00 176.35 175.06 1qzq s TYR 438 N 1.22 3.29 -0.18 5.38 1.51 -0.33 -4.93 117.35 123.31 1qzq s TYR 438 Ca -0.05 0.14 -0.01 0.00 -1.01 0.00 0.00 57.07 56.14 1qzq s TYR 438 Cb -0.19 -2.18 -0.00 0.00 -0.11 0.00 0.00 41.96 39.48 1qzq s TYR 438 CO -0.04 0.10 -0.12 -0.51 -1.11 0.00 0.00 175.55 173.87 1qzq s LEU 439 N 0.75 2.59 -0.32 -1.29 1.43 -0.90 -0.76 118.68 120.18 1qzq s LEU 439 Ca 0.06 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.58 1qzq s LEU 439 Cb -0.13 -1.61 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 1qzq s LEU 439 CO 0.02 0.04 0.21 -0.63 0.23 0.00 0.00 176.35 176.22 1qzq s ILE 440 N 1.08 5.21 -0.10 -0.59 1.01 0.20 0.35 121.20 128.37 1qzq s ILE 440 Ca 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 60.65 60.49 1qzq s ILE 440 Cb -0.15 -3.61 0.05 0.00 0.01 0.00 0.00 42.46 38.76 1qzq s ILE 440 CO -0.03 0.09 0.23 -0.47 0.00 0.00 0.00 174.94 174.76 1qzq s TYR 441 N 1.72 -0.31 0.20 3.97 6.14 -0.85 -2.54 117.35 125.68 1qzq s TYR 441 Ca 0.06 0.76 -0.32 0.00 0.64 0.00 0.00 57.07 58.21 1qzq s TYR 441 Cb -0.17 0.02 -0.15 0.00 0.42 0.00 0.00 41.96 42.08 1qzq s TYR 441 CO 0.10 -0.23 1.22 -2.30 0.64 0.00 0.00 175.55 174.97 1qzq n PRO 442 N 4.31 1.40 -2.28 4.97 -0.02 -1.26 -4.45 135.00 137.67 1qzq n PRO 442 Ca -0.24 0.50 -0.25 0.00 -2.02 0.00 0.00 63.50 61.49 1qzq n PRO 442 Cb 0.53 -2.03 0.06 0.00 -0.02 0.00 0.00 33.50 32.04 1qzq n PRO 442 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1qzq s SER 443 N 0.03 4.94 0.18 2.55 1.04 -1.26 -2.27 113.70 118.91 1qzq s SER 443 Ca 0.71 0.41 -0.13 0.00 0.48 0.00 0.00 55.95 57.42 1qzq s SER 443 Cb -0.79 -1.12 0.13 0.00 0.10 0.00 0.00 66.02 64.34 1qzq s SER 443 CO 0.52 -1.49 1.82 0.58 0.98 0.00 0.00 173.24 175.65 1qzq h VAL 444 N -0.48 1.06 -0.68 5.02 2.07 -1.07 -2.06 116.25 120.11 1qzq h VAL 444 Ca -0.44 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 66.86 1qzq h VAL 444 Cb 1.31 0.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.37 1qzq h VAL 444 CO 0.59 0.12 0.44 -0.08 0.02 0.00 0.00 177.57 178.67 1qzq h GLU 445 N 0.67 0.87 -0.59 1.57 4.57 -1.94 0.29 114.58 120.02 1qzq h GLU 445 Ca 0.23 -0.05 0.09 0.00 -1.18 0.00 0.00 59.36 58.45 1qzq h GLU 445 Cb 0.03 -0.20 -0.07 0.00 -0.16 0.00 0.00 28.75 28.35 1qzq h GLU 445 CO -0.10 0.58 0.21 -0.91 -1.18 0.00 0.00 179.01 177.61 1qzq h ASN 446 N 0.90 0.20 -0.05 1.04 -0.26 -1.76 -1.74 115.58 113.91 1qzq h ASN 446 Ca 0.26 0.08 -0.04 0.00 -0.56 0.00 0.00 56.30 56.04 1qzq h ASN 446 Cb -0.07 0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.26 1qzq h ASN 446 CO -0.07 0.12 -0.12 0.58 -1.06 0.00 0.00 177.43 176.88 1qzq h VAL 447 N 0.39 1.44 -0.71 2.81 2.07 -0.78 -2.82 116.25 118.65 1qzq h VAL 447 Ca 0.30 -1.50 0.15 0.00 0.82 0.00 0.00 66.70 66.47 1qzq h VAL 447 Cb 0.37 2.32 -0.10 0.00 -1.52 0.00 0.00 31.29 32.36 1qzq h VAL 447 CO -0.31 0.41 0.20 -0.09 0.02 0.00 0.00 177.57 177.80 1qzq h ARG 448 N -0.37 0.30 -0.62 1.57 2.43 -0.14 -1.53 114.38 116.02 1qzq h ARG 448 Ca -0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1qzq h ARG 448 Cb 0.73 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1qzq h ARG 448 CO 0.03 0.20 0.00 0.25 -1.51 0.00 0.00 179.97 178.94 1qzq n THR 449 N -5.11 1.37 -1.11 0.20 -2.24 -0.68 -2.33 114.28 104.38 1qzq n THR 449 Ca 0.13 -0.93 -0.30 0.00 -2.27 0.00 0.00 64.05 60.68 1qzq n THR 449 Cb 0.42 0.11 0.24 0.00 -2.10 0.00 0.00 70.33 69.00 1qzq n THR 449 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1qzq s SER 450 N -0.85 1.06 0.32 3.42 1.04 -0.57 -4.87 113.70 113.24 1qzq s SER 450 Ca 0.41 0.65 0.02 0.00 0.48 0.00 0.00 55.95 57.51 1qzq s SER 450 Cb 0.26 -0.91 0.53 0.00 0.10 0.00 0.00 66.02 65.99 1qzq s SER 450 CO 0.21 -4.04 1.87 -0.07 0.98 0.00 0.00 173.24 172.20 1qzq h LEU 451 N -2.52 0.64 0.00 2.42 3.38 -0.77 -2.98 115.31 115.48 1qzq h LEU 451 Ca -0.45 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1qzq h LEU 451 Cb 1.29 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1qzq h LEU 451 CO 0.36 0.64 -1.06 -0.62 0.09 0.00 0.00 178.44 177.84 1qzq n GLU 452 N -4.30 0.43 0.00 1.13 1.02 -1.26 -4.98 120.64 112.68 1qzq n GLU 452 Ca 0.03 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1qzq n GLU 452 Cb 0.21 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.95 1qzq n GLU 452 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qzq n GLY 453 N 1.29 -0.95 0.36 0.62 0.00 -1.13 -4.01 105.19 101.37 1qzq n GLY 453 Ca 0.01 -1.32 0.09 0.00 0.00 0.00 0.00 46.02 44.80 1qzq n GLY 453 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1qzq h TYR 454 N 0.00 0.76 -0.00 1.61 0.05 -1.78 -2.20 116.97 115.41 1qzq h TYR 454 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1qzq h TYR 454 Cb 0.00 -0.25 -0.00 0.00 1.01 0.00 0.00 36.73 37.49 1qzq h TYR 454 CO 0.00 0.35 0.35 -1.35 -1.05 0.00 0.00 178.16 176.46 1qzq h PRO 455 N 0.71 0.00 0.00 4.88 0.11 -1.92 0.68 132.00 136.45 1qzq h PRO 455 Ca 0.36 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.45 1qzq h PRO 455 Cb 0.46 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.57 1qzq h PRO 455 CO -0.14 0.00 -0.12 0.00 -0.21 0.00 0.00 178.00 177.54 1qzq h ALA 456 N 1.31 1.68 0.00 -0.75 0.00 -1.61 0.03 119.26 119.92 1qzq h ALA 456 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1qzq h ALA 456 Cb 0.70 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1qzq h ALA 456 CO -0.00 0.14 0.00 0.78 0.00 0.00 0.00 179.25 180.17 1qzq h GLY 457 N 0.42 0.00 2.00 0.00 0.00 0.19 -1.62 103.07 104.06 1qzq h GLY 457 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qzq h GLY 457 CO 0.02 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.23 1qzq h GLY 458 N 1.42 0.00 -2.18 4.60 0.00 -1.11 -1.58 103.07 104.22 1qzq h GLY 458 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qzq h GLY 458 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.98 1qzq n SER 459 N -3.07 4.39 -3.31 0.19 7.64 -0.61 -4.57 113.62 114.28 1qzq n SER 459 Ca -0.02 -2.92 -0.25 0.00 1.01 0.00 0.00 58.87 56.68 1qzq n SER 459 Cb 0.11 -0.57 -0.08 0.00 -1.01 0.00 0.00 64.21 62.66 1qzq n SER 459 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1qzq n LEU 460 N -0.08 1.27 -2.88 -3.43 4.77 -0.59 -4.86 117.00 111.20 1qzq n LEU 460 Ca 0.23 -4.90 -0.13 0.00 -0.03 0.00 0.00 56.01 51.18 1qzq n LEU 460 Cb 0.95 0.20 -0.03 0.00 -2.33 0.00 0.00 43.42 42.21 1qzq n LEU 460 CO 0.20 2.03 1.70 -0.81 -1.33 0.00 0.00 177.39 179.18 1qzq n PRO 461 N 1.40 1.33 -3.37 3.23 -0.04 -1.25 -4.22 135.00 132.10 1qzq n PRO 461 Ca 0.24 -0.97 -0.42 0.00 -0.04 0.00 0.00 63.50 62.31 1qzq n PRO 461 Cb 0.48 -2.15 -0.09 0.00 -0.04 0.00 0.00 33.50 31.71 1qzq n PRO 461 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1qzq s TYR 462 N 3.33 3.19 0.36 0.54 5.04 -1.26 -4.60 117.35 123.95 1qzq s TYR 462 Ca 0.29 -0.24 -0.11 0.00 -2.44 0.00 0.00 57.07 54.57 1qzq s TYR 462 Cb 0.09 -2.77 -0.07 0.00 0.35 0.00 0.00 41.96 39.56 1qzq s TYR 462 CO -0.02 -0.58 0.72 -1.54 -1.34 0.00 0.00 175.55 172.80 1qzq s SER 463 N 1.77 6.58 0.35 4.32 1.04 -1.26 -1.73 113.70 124.76 1qzq s SER 463 Ca 0.11 1.11 0.06 0.00 0.48 0.00 0.00 55.95 57.70 1qzq s SER 463 Cb -0.17 -2.31 0.65 0.00 0.10 0.00 0.00 66.02 64.29 1qzq s SER 463 CO 0.12 -0.31 1.89 -0.29 0.98 0.00 0.00 173.24 175.64 1qzq h ILE 464 N 1.39 1.19 -0.54 -1.02 6.09 -1.92 -0.10 117.51 122.60 1qzq h ILE 464 Ca -0.47 -0.76 0.01 0.00 -1.37 0.00 0.00 64.86 62.26 1qzq h ILE 464 Cb 1.18 0.99 -0.03 0.00 0.47 0.00 0.00 36.82 39.43 1qzq h ILE 464 CO 0.65 0.26 0.35 1.56 -3.07 0.00 0.00 178.15 177.90 1qzq h GLN 465 N 0.44 0.70 0.09 2.19 7.50 -1.98 -0.11 115.11 123.93 1qzq h GLN 465 Ca 0.10 -0.04 -0.00 0.00 0.50 0.00 0.00 58.65 59.20 1qzq h GLN 465 Cb 0.32 -0.16 0.00 0.00 0.05 0.00 0.00 27.48 27.70 1qzq h GLN 465 CO 0.01 0.46 -0.04 1.15 -1.50 0.00 0.00 178.83 178.91 1qzq h THR 466 N 0.72 1.17 0.12 -0.54 2.02 -1.87 -3.33 112.91 111.20 1qzq h THR 466 Ca 0.20 -1.13 0.02 0.00 0.77 0.00 0.00 66.41 66.26 1qzq h THR 466 Cb -0.08 1.88 -0.04 0.00 -1.74 0.00 0.00 68.15 68.17 1qzq h THR 466 CO -0.05 0.27 -0.30 0.00 0.37 0.00 0.00 175.52 175.81 1qzq h ALA 467 N 0.16 -0.51 -0.05 6.16 0.00 -0.87 -2.50 119.26 121.67 1qzq h ALA 467 Ca -0.01 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1qzq h ALA 467 Cb 0.53 0.49 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1qzq h ALA 467 CO 0.02 -0.84 0.37 1.05 0.00 0.00 0.00 179.25 179.85 1qzq h GLU 468 N -0.52 0.00 -0.01 0.00 4.11 -1.16 0.27 114.58 117.28 1qzq h GLU 468 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 1qzq h GLU 468 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1qzq h GLU 468 CO -0.18 0.00 -0.13 1.63 0.07 0.00 0.00 179.01 180.40 1qzq n LYS 469 N -2.97 1.16 -2.69 1.06 5.02 -0.94 -4.44 118.16 114.37 1qzq n LYS 469 Ca -0.01 -0.65 -0.07 0.00 -2.02 0.00 0.00 58.31 55.56 1qzq n LYS 469 Cb 0.43 -1.49 0.07 0.00 -0.02 0.00 0.00 35.03 34.02 1qzq n LYS 469 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1qzq n GLN 470 N -0.35 1.21 0.00 1.97 10.64 0.96 -4.70 117.38 127.10 1qzq n GLN 470 Ca 0.15 -2.62 0.03 0.00 -1.83 0.00 0.00 57.00 52.74 1qzq n GLN 470 Cb 0.34 -0.72 0.13 0.00 -0.86 0.00 0.00 30.24 29.13 1qzq n GLN 470 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1qzq n ASN 471 N -0.37 0.00 0.11 2.61 3.02 -1.20 -1.84 115.26 117.59 1qzq n ASN 471 Ca 0.03 0.48 0.01 0.00 -0.03 0.00 0.00 54.58 55.07 1qzq n ASN 471 Cb 0.83 -0.49 0.34 0.00 -0.61 0.00 0.00 39.78 39.86 1qzq n ASN 471 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 1qzq h TRP 472 N 0.00 0.26 -0.57 3.10 5.08 -1.91 -3.05 115.95 118.86 1qzq h TRP 472 Ca 0.00 -0.04 -0.05 0.00 1.08 0.00 0.00 58.89 59.88 1qzq h TRP 472 Cb 0.10 -0.07 -0.03 0.00 -3.00 0.00 0.00 29.16 26.17 1qzq h TRP 472 CO 0.00 0.44 0.15 1.25 -1.28 0.00 0.00 178.44 179.00 1qzq h LEU 473 N 0.23 0.81 0.00 0.11 5.85 -1.78 -3.06 115.31 117.47 1qzq h LEU 473 Ca 0.04 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1qzq h LEU 473 Cb 0.49 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1qzq h LEU 473 CO 0.03 0.78 0.00 1.41 -0.34 0.00 0.00 178.44 180.32 1qzq n HIS 474 N -4.28 0.00 1.10 1.25 8.25 -1.15 -1.31 115.22 119.08 1qzq n HIS 474 Ca 0.04 0.00 0.14 0.00 -0.26 0.00 0.00 57.72 57.64 1qzq n HIS 474 Cb 0.22 -0.28 0.64 0.00 1.12 0.00 0.00 29.99 31.69 1qzq n HIS 474 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1qzq n SER 475 N -1.28 0.00 -0.15 0.41 7.64 -1.16 -2.66 113.62 116.42 1qzq n SER 475 Ca 0.03 0.27 0.09 0.00 1.01 0.00 0.00 58.87 60.27 1qzq n SER 475 Cb 0.06 -0.42 -0.06 0.00 -1.01 0.00 0.00 64.21 62.77 1qzq n SER 475 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1qzq n TYR 476 N -1.42 0.00 -2.38 1.43 4.01 -0.43 -5.01 117.16 113.37 1qzq n TYR 476 Ca 0.09 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.42 1qzq n TYR 476 Cb 0.29 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.28 1qzq n TYR 476 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1qzq s PHE 477 N -2.45 3.43 0.11 -0.72 2.99 -1.09 -2.12 117.98 118.13 1qzq s PHE 477 Ca 0.10 1.49 0.08 0.00 0.00 0.00 0.00 56.93 58.60 1qzq s PHE 477 Cb 0.14 -3.42 -0.04 0.00 0.00 0.00 0.00 43.02 39.71 1qzq s PHE 477 CO 0.62 -1.10 -0.21 -1.01 -0.00 0.00 0.00 175.22 173.53 1qzq s HIS 478 N -0.45 1.79 0.68 0.36 3.76 0.16 -2.32 115.29 119.27 1qzq s HIS 478 Ca 0.50 -0.42 -0.15 0.00 -0.15 0.00 0.00 55.06 54.84 1qzq s HIS 478 Cb -0.33 -0.98 0.01 0.00 1.11 0.00 0.00 32.58 32.39 1qzq s HIS 478 CO 0.39 0.21 1.13 0.15 -0.85 0.00 0.00 174.74 175.77 1qzq s LYS 479 N -1.96 2.65 -0.08 1.40 1.02 0.48 -2.00 119.74 121.26 1qzq s LYS 479 Ca 0.07 1.45 -0.24 0.00 0.02 0.00 0.00 55.97 57.26 1qzq s LYS 479 Cb -0.10 -1.93 -0.03 0.00 -0.52 0.00 0.00 37.83 35.25 1qzq s LYS 479 CO 0.04 -1.38 0.75 -0.46 -0.92 0.00 0.00 175.35 173.38 1qzq s TRP 480 N -2.30 3.56 -0.13 3.18 -0.11 -1.26 -4.53 118.94 117.34 1qzq s TRP 480 Ca 0.68 1.29 -0.06 0.00 1.22 0.00 0.00 56.10 59.23 1qzq s TRP 480 Cb -0.22 -2.87 0.06 0.00 -1.50 0.00 0.00 33.47 28.94 1qzq s TRP 480 CO 0.43 0.03 0.30 0.45 -4.62 0.00 0.00 176.95 173.54 1qzq s SER 481 N 0.88 -0.16 -0.38 5.86 0.15 -1.26 -4.97 113.70 113.83 1qzq s SER 481 Ca 0.39 0.66 0.12 0.00 0.70 0.00 0.00 55.95 57.83 1qzq s SER 481 Cb -0.18 0.65 0.38 0.00 -1.71 0.00 0.00 66.02 65.16 1qzq s SER 481 CO 0.18 -0.20 0.92 0.00 1.20 0.00 0.00 173.24 175.35 1qzq n ALA 482 N 4.64 1.76 0.22 5.45 0.00 -1.26 -0.67 120.51 130.64 1qzq n ALA 482 Ca -0.18 -2.75 0.06 0.00 0.00 0.00 0.00 53.44 50.56 1qzq n ALA 482 Cb 0.52 -0.98 0.49 0.00 0.00 0.00 0.00 19.45 19.48 1qzq n ALA 482 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1qzq h GLU 483 N 2.90 0.00 -0.72 0.00 4.39 -1.93 0.72 114.58 119.94 1qzq h GLU 483 Ca -0.03 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.76 1qzq h GLU 483 Cb 1.08 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.69 1qzq h GLU 483 CO 0.37 0.26 0.47 0.00 -1.16 0.00 0.00 179.01 178.95 1qzq h THR 484 N 0.00 0.96 -0.21 1.13 1.03 -1.87 -2.04 112.91 111.91 1qzq h THR 484 Ca -0.00 -0.23 0.00 0.00 -0.01 0.00 0.00 66.41 66.17 1qzq h THR 484 Cb 0.50 0.25 0.00 0.00 -1.07 0.00 0.00 68.15 67.83 1qzq h THR 484 CO 0.03 0.12 0.00 -1.54 -0.01 0.00 0.00 175.52 174.12 1qzq n SER 485 N -4.49 2.50 -1.78 0.00 3.41 -0.94 -3.19 113.62 109.13 1qzq n SER 485 Ca 0.11 -1.88 -0.16 0.00 -0.26 0.00 0.00 58.87 56.68 1qzq n SER 485 Cb 0.30 -0.14 -0.01 0.00 -0.26 0.00 0.00 64.21 64.10 1qzq n SER 485 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qzq n GLY 486 N 0.27 -0.22 0.51 5.00 0.00 -0.04 -4.88 105.19 105.83 1qzq n GLY 486 Ca 0.08 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.94 1qzq n GLY 486 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qzq n ARG 487 N -2.51 1.65 0.31 1.61 1.74 0.04 -4.68 116.66 114.81 1qzq n ARG 487 Ca -0.19 -2.97 0.18 0.00 -0.77 0.00 0.00 57.85 54.11 1qzq n ARG 487 Cb 0.64 -1.63 1.02 0.00 -1.02 0.00 0.00 32.46 31.47 1qzq n ARG 487 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1qzq h SER 488 N 0.70 0.00 -0.02 0.55 0.02 -1.91 -1.43 113.55 111.47 1qzq h SER 488 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1qzq h SER 488 Cb 1.14 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1qzq h SER 488 CO 0.08 0.00 -0.35 0.59 -1.14 0.00 0.00 176.83 176.01 1qzq n ASN 489 N -3.56 2.01 -4.33 3.07 3.02 -1.26 -4.76 115.26 109.45 1qzq n ASN 489 Ca -0.03 -1.50 -0.46 0.00 -0.03 0.00 0.00 54.58 52.56 1qzq n ASN 489 Cb 0.09 0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 39.62 1qzq n ASN 489 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qzq s ALA 490 N -2.15 3.74 0.30 5.41 0.00 -0.54 -0.02 121.76 128.50 1qzq s ALA 490 Ca 0.18 -2.74 -0.28 0.00 0.00 0.00 0.00 51.96 49.12 1qzq s ALA 490 Cb 0.16 -3.41 -0.14 0.00 0.00 0.00 0.00 23.12 19.74 1qzq s ALA 490 CO 0.46 -2.18 1.00 -1.33 0.00 0.00 0.00 175.76 173.71 1qzq n MET 491 N 5.07 1.34 -2.56 0.00 2.81 -1.25 -3.19 117.12 119.33 1qzq n MET 491 Ca -0.04 0.47 -0.41 0.00 -1.81 0.00 0.00 57.70 55.91 1qzq n MET 491 Cb 0.43 -1.85 -0.04 0.00 -0.71 0.00 0.00 33.22 31.05 1qzq n MET 491 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1qzq s PRO 492 N -1.59 4.60 0.00 0.03 0.04 -1.26 -0.77 135.00 136.04 1qzq s PRO 492 Ca 0.59 1.65 0.00 0.00 0.04 0.00 0.00 61.00 63.28 1qzq s PRO 492 Cb -0.69 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 30.54 1qzq s PRO 492 CO 0.60 0.06 0.18 1.58 0.04 0.00 0.00 177.00 179.46 1qzq n HIS 493 N 2.71 0.00 -2.59 0.56 -0.00 -0.25 -4.68 115.22 110.96 1qzq n HIS 493 Ca 0.03 0.00 -0.35 0.00 0.46 0.00 0.00 57.72 57.87 1qzq n HIS 493 Cb 0.47 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.30 1qzq n HIS 493 CO 0.00 0.00 0.00 -1.50 0.46 0.00 0.00 176.34 175.30 1qzq s ILE 494 N -0.44 3.87 -0.09 3.57 2.07 -0.84 -4.85 121.20 124.49 1qzq s ILE 494 Ca 0.00 1.27 0.04 0.00 -1.41 0.00 0.00 60.65 60.55 1qzq s ILE 494 Cb 0.00 -3.58 0.00 0.00 0.13 0.00 0.00 42.46 39.01 1qzq s ILE 494 CO 0.00 -0.15 -0.22 -0.54 -1.91 0.00 0.00 174.94 172.13 1qzq s LYS 495 N -2.91 2.80 0.03 3.50 3.01 -1.21 -4.48 119.74 120.48 1qzq s LYS 495 Ca 0.62 -0.79 -0.01 0.00 -1.01 0.00 0.00 55.97 54.78 1qzq s LYS 495 Cb -0.17 -2.13 -0.03 0.00 -1.01 0.00 0.00 37.83 34.48 1qzq s LYS 495 CO 0.22 0.15 -0.02 0.95 0.51 0.00 0.00 175.35 177.16 1qzq s THR 496 N 0.40 0.16 -0.03 2.17 -4.23 0.00 -1.40 115.64 112.70 1qzq s THR 496 Ca -0.18 -1.30 -0.02 0.00 -1.18 0.00 0.00 61.69 59.01 1qzq s THR 496 Cb -0.18 -0.84 0.02 0.00 1.34 0.00 0.00 72.50 72.84 1qzq s THR 496 CO 0.08 -0.72 0.08 -0.31 -0.54 0.00 0.00 174.62 173.22 1qzq s TYR 497 N -2.58 -0.09 0.23 3.99 2.02 -0.24 -0.86 117.35 119.82 1qzq s TYR 497 Ca -0.06 0.25 -0.16 0.00 -0.37 0.00 0.00 57.07 56.74 1qzq s TYR 497 Cb -0.02 -0.03 0.01 0.00 -0.40 0.00 0.00 41.96 41.53 1qzq s TYR 497 CO -0.05 -0.07 0.52 0.00 -1.57 0.00 0.00 175.55 174.38 1qzq s MET 498 N 0.38 1.51 -0.61 -0.62 0.23 -0.54 0.11 119.30 119.76 1qzq s MET 498 Ca -0.03 -1.07 0.04 0.00 -1.03 0.00 0.00 55.69 53.61 1qzq s MET 498 Cb -0.04 0.51 0.16 0.00 -1.53 0.00 0.00 34.83 33.92 1qzq s MET 498 CO -0.01 -0.64 0.40 0.50 -2.03 0.00 0.00 175.02 173.24 1qzq s ARG 499 N -3.95 2.12 0.69 3.16 6.06 -1.04 -0.79 118.95 125.20 1qzq s ARG 499 Ca 0.15 -2.96 -0.11 0.00 -2.50 0.00 0.00 55.73 50.31 1qzq s ARG 499 Cb -0.01 -3.15 0.00 0.00 0.06 0.00 0.00 34.95 31.85 1qzq s ARG 499 CO 0.04 -1.24 1.06 -1.25 -2.50 0.00 0.00 175.30 171.41 1qzq s PRO 500 N -0.90 3.01 0.88 5.12 0.04 -1.18 -0.44 135.00 141.54 1qzq s PRO 500 Ca 0.23 0.78 -0.12 0.00 0.04 0.00 0.00 61.00 61.93 1qzq s PRO 500 Cb -0.11 -2.01 0.12 0.00 0.04 0.00 0.00 34.50 32.54 1qzq s PRO 500 CO -0.11 -1.00 1.13 -1.54 0.04 0.00 0.00 177.00 175.52 1qzq s SER 501 N -4.00 3.77 0.43 6.66 1.04 0.15 -3.29 113.70 118.45 1qzq s SER 501 Ca 0.57 1.00 0.15 0.00 0.48 0.00 0.00 55.95 58.16 1qzq s SER 501 Cb -0.13 -1.59 1.04 0.00 0.10 0.00 0.00 66.02 65.44 1qzq s SER 501 CO 0.54 -2.39 1.92 -0.65 0.98 0.00 0.00 173.24 173.65 1qzq h PRO 502 N -1.39 0.41 -0.39 4.02 0.11 -1.91 0.93 132.00 133.79 1qzq h PRO 502 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1qzq h PRO 502 Cb 1.32 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1qzq h PRO 502 CO 0.62 0.27 0.00 -0.40 -0.21 0.00 0.00 178.00 178.28 1qzq n ASP 503 N -4.48 3.22 -0.64 -2.05 5.75 -1.26 -4.96 116.55 112.13 1qzq n ASP 503 Ca 0.14 -1.96 -0.08 0.00 -0.01 0.00 0.00 54.79 52.88 1qzq n ASP 503 Cb 0.51 -0.25 -0.04 0.00 -1.03 0.00 0.00 41.12 40.32 1qzq n ASP 503 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1qzq n PHE 504 N 1.32 0.00 0.90 2.11 3.01 0.32 -4.86 117.46 120.26 1qzq n PHE 504 Ca 0.19 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.78 1qzq n PHE 504 Cb 0.56 -2.12 0.42 0.00 -0.01 0.00 0.00 39.48 38.33 1qzq n PHE 504 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1qzq n SER 505 N -0.58 0.35 -3.98 4.37 3.41 -1.26 -4.82 113.62 111.11 1qzq n SER 505 Ca -0.08 0.22 -0.09 0.00 -0.26 0.00 0.00 58.87 58.65 1qzq n SER 505 Cb 0.44 -0.21 -0.06 0.00 -0.26 0.00 0.00 64.21 64.12 1qzq n SER 505 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1qzq s LYS 506 N -3.03 1.45 0.03 4.33 -2.85 -1.26 -1.43 119.74 116.96 1qzq s LYS 506 Ca 0.12 -1.23 0.02 0.00 -1.00 0.00 0.00 55.97 53.88 1qzq s LYS 506 Cb 0.17 0.45 -0.02 0.00 -2.06 0.00 0.00 37.83 36.37 1qzq s LYS 506 CO 0.62 -0.59 -0.08 0.96 0.10 0.00 0.00 175.35 176.37 1qzq s ILE 507 N -4.01 0.56 -0.25 3.79 -4.36 -0.17 0.33 121.20 117.09 1qzq s ILE 507 Ca 0.22 -0.83 0.19 0.00 -0.26 0.00 0.00 60.65 59.97 1qzq s ILE 507 Cb 0.00 -0.57 0.10 0.00 1.25 0.00 0.00 42.46 43.24 1qzq s ILE 507 CO 0.07 -0.20 1.30 0.00 0.24 0.00 0.00 174.94 176.34 1qzq h ALA 508 N 4.97 0.73 -1.62 2.27 0.00 -1.07 -1.55 119.26 122.98 1qzq h ALA 508 Ca -0.34 -0.29 0.21 0.00 0.00 0.00 0.00 54.91 54.50 1qzq h ALA 508 Cb 1.20 0.02 -0.19 0.00 0.00 0.00 0.00 17.79 18.82 1qzq h ALA 508 CO 0.44 0.35 0.74 1.67 0.00 0.00 0.00 179.25 182.44 1qzq s TRP 509 N -3.12 -0.19 -0.02 0.00 1.48 -1.26 -4.25 118.94 111.59 1qzq s TRP 509 Ca 0.03 0.14 -0.01 0.00 -1.06 0.00 0.00 56.10 55.21 1qzq s TRP 509 Cb 0.07 0.51 0.01 0.00 -1.16 0.00 0.00 33.47 32.91 1qzq s TRP 509 CO 0.74 -0.27 0.03 0.12 -4.06 0.00 0.00 176.95 173.51 1qzq s PHE 510 N -2.39 -0.01 -0.09 1.66 5.36 -0.82 -2.49 117.98 119.19 1qzq s PHE 510 Ca 0.08 0.10 0.02 0.00 -0.96 0.00 0.00 56.93 56.17 1qzq s PHE 510 Cb -0.01 -0.09 0.01 0.00 -0.34 0.00 0.00 43.02 42.60 1qzq s PHE 510 CO -0.05 -0.05 -0.14 -1.17 -1.46 0.00 0.00 175.22 172.35 1qzq s LEU 511 N 0.47 1.65 -0.12 6.12 2.96 0.12 0.06 118.68 129.94 1qzq s LEU 511 Ca -0.04 -0.36 0.00 0.00 -0.22 0.00 0.00 54.13 53.51 1qzq s LEU 511 Cb -0.06 -0.96 -0.02 0.00 0.50 0.00 0.00 46.19 45.66 1qzq s LEU 511 CO -0.01 0.02 -0.12 0.54 -1.32 0.00 0.00 176.35 175.45 1qzq s VAL 512 N 0.87 3.16 0.34 1.68 0.11 -1.00 -1.08 120.40 124.47 1qzq s VAL 512 Ca -0.10 -0.63 -0.14 0.00 -2.93 0.00 0.00 61.98 58.18 1qzq s VAL 512 Cb -0.15 -2.32 0.03 0.00 -1.53 0.00 0.00 36.38 32.41 1qzq s VAL 512 CO 0.01 0.53 0.67 0.28 -3.33 0.00 0.00 175.10 173.27 1qzq s THR 513 N 0.15 0.00 -0.95 5.04 -1.32 -0.50 -1.07 115.64 117.00 1qzq s THR 513 Ca -0.06 -1.17 0.23 0.00 -1.21 0.00 0.00 61.69 59.48 1qzq s THR 513 Cb -0.15 -2.55 -0.11 0.00 -1.51 0.00 0.00 72.50 68.18 1qzq s THR 513 CO 0.05 0.00 1.14 -1.54 -2.21 0.00 0.00 174.62 172.06 1qzq n SER 514 N -1.06 0.72 -4.65 8.08 3.41 -0.58 -3.34 113.62 116.19 1qzq n SER 514 Ca -0.05 -0.56 -0.43 0.00 -0.26 0.00 0.00 58.87 57.57 1qzq n SER 514 Cb 0.60 0.65 -0.03 0.00 -0.26 0.00 0.00 64.21 65.17 1qzq n SER 514 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qzq s ALA 515 N -3.03 3.56 0.74 7.33 0.00 -1.26 -4.92 121.76 124.19 1qzq s ALA 515 Ca 0.09 0.70 -0.01 0.00 0.00 0.00 0.00 51.96 52.74 1qzq s ALA 515 Cb 0.16 -3.73 0.01 0.00 0.00 0.00 0.00 23.12 19.57 1qzq s ALA 515 CO 0.79 -1.44 0.09 0.09 0.00 0.00 0.00 175.76 175.28 1qzq n ASN 516 N 7.24 0.05 -4.46 0.00 3.02 -1.26 -4.87 115.26 114.98 1qzq n ASN 516 Ca 0.17 -1.06 -0.44 0.00 -0.03 0.00 0.00 54.58 53.22 1qzq n ASN 516 Cb 0.44 -0.06 -0.01 0.00 -0.61 0.00 0.00 39.78 39.54 1qzq n ASN 516 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1qzq s LEU 517 N 0.00 5.04 0.05 3.41 2.96 -1.16 -4.72 118.68 124.26 1qzq s LEU 517 Ca 0.05 -2.72 -0.23 0.00 -0.22 0.00 0.00 54.13 51.01 1qzq s LEU 517 Cb -0.00 -2.40 0.06 0.00 0.50 0.00 0.00 46.19 44.34 1qzq s LEU 517 CO 0.04 -0.84 0.54 -0.94 -1.32 0.00 0.00 176.35 173.83 1qzq s SER 518 N 3.07 -0.47 0.47 3.68 1.04 -1.26 -1.43 113.70 118.80 1qzq s SER 518 Ca 0.40 0.22 0.26 0.00 0.48 0.00 0.00 55.95 57.31 1qzq s SER 518 Cb -0.03 0.51 1.10 0.00 0.10 0.00 0.00 66.02 67.70 1qzq s SER 518 CO -0.03 -0.73 1.90 0.11 0.98 0.00 0.00 173.24 175.48 1qzq h LYS 519 N 2.74 0.00 -0.25 4.02 1.57 -1.85 -2.23 116.57 120.56 1qzq h LYS 519 Ca -0.31 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.36 1qzq h LYS 519 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 1qzq h LYS 519 CO 0.41 0.18 -0.34 0.00 -0.57 0.00 0.00 179.45 179.13 1qzq h ALA 520 N 1.82 0.94 0.11 3.86 0.00 -1.90 0.53 119.26 124.62 1qzq h ALA 520 Ca -0.00 -0.40 -0.28 0.00 0.00 0.00 0.00 54.91 54.22 1qzq h ALA 520 Cb 0.62 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1qzq h ALA 520 CO 0.02 0.62 -1.46 0.00 0.00 0.00 0.00 179.25 178.42 1qzq h ALA 521 N 1.17 0.20 0.00 0.00 0.00 -1.84 -2.51 119.26 116.30 1qzq h ALA 521 Ca 0.05 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.84 1qzq h ALA 521 Cb 0.81 0.51 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1qzq h ALA 521 CO 0.07 0.87 -1.38 0.91 0.00 0.00 0.00 179.25 179.71 1qzq n TRP 522 N -3.90 0.52 0.00 0.00 7.02 -0.86 -4.77 117.44 115.46 1qzq n TRP 522 Ca -0.26 0.15 0.00 0.00 -1.02 0.00 0.00 57.50 56.37 1qzq n TRP 522 Cb 0.91 -0.73 0.00 0.00 -2.42 0.00 0.00 31.31 29.07 1qzq n TRP 522 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1qzq n GLY 523 N 1.23 2.15 2.97 6.99 0.00 0.19 -1.30 105.19 117.41 1qzq n GLY 523 Ca -0.01 -1.74 -0.18 0.00 0.00 0.00 0.00 46.02 44.09 1qzq n GLY 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qzq s ALA 524 N -2.01 0.66 0.20 4.61 0.00 -0.05 -4.76 121.76 120.42 1qzq s ALA 524 Ca 0.00 -0.24 -0.30 0.00 0.00 0.00 0.00 51.96 51.42 1qzq s ALA 524 Cb 0.00 -0.25 -0.08 0.00 0.00 0.00 0.00 23.12 22.79 1qzq s ALA 524 CO 0.00 0.11 1.18 -0.51 0.00 0.00 0.00 175.76 176.54 1qzq s LEU 525 N 0.18 4.46 0.00 0.00 1.43 -1.26 -0.16 118.68 123.33 1qzq s LEU 525 Ca -0.02 2.23 0.01 0.00 -1.03 0.00 0.00 54.13 55.33 1qzq s LEU 525 Cb -0.07 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 42.54 1qzq s LEU 525 CO -0.00 -0.34 0.05 -0.62 0.23 0.00 0.00 176.35 175.67 1qzq n GLU 526 N 2.30 0.93 -4.05 1.70 1.02 0.28 -4.72 120.64 118.11 1qzq n GLU 526 Ca 0.03 -1.31 -0.36 0.00 -0.02 0.00 0.00 57.16 55.51 1qzq n GLU 526 Cb 0.45 0.65 -0.02 0.00 -0.02 0.00 0.00 31.44 32.49 1qzq n GLU 526 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1qzq n LYS 527 N -0.37 -0.55 -3.44 3.49 5.02 -1.26 -1.30 118.16 119.76 1qzq n LYS 527 Ca -0.03 0.01 -0.19 0.00 -2.02 0.00 0.00 58.31 56.07 1qzq n LYS 527 Cb 0.23 -2.34 0.06 0.00 -0.02 0.00 0.00 35.03 32.96 1qzq n LYS 527 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1qzq n ASN 528 N -1.95 -4.37 -0.33 4.39 2.85 -1.26 -2.34 115.26 112.25 1qzq n ASN 528 Ca -0.16 -0.75 -0.04 0.00 -0.11 0.00 0.00 54.58 53.51 1qzq n ASN 528 Cb 0.52 -4.73 -0.02 0.00 1.24 0.00 0.00 39.78 36.80 1qzq n ASN 528 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1qzq n GLY 529 N -1.33 0.39 0.07 8.20 0.00 -0.42 -4.79 105.19 107.31 1qzq n GLY 529 Ca -0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.97 1qzq n GLY 529 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qzq n THR 530 N -1.98 0.39 -4.81 2.61 -2.24 -0.80 -4.87 114.28 102.58 1qzq n THR 530 Ca -0.04 -0.44 -0.25 0.00 -2.27 0.00 0.00 64.05 61.05 1qzq n THR 530 Cb 0.51 -0.13 -0.15 0.00 -2.10 0.00 0.00 70.33 68.46 1qzq n THR 530 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1qzq s GLN 531 N -3.33 1.46 -0.27 -0.78 0.74 -0.93 -4.31 119.66 112.24 1qzq s GLN 531 Ca 0.00 -0.76 -0.03 0.00 0.05 0.00 0.00 55.36 54.62 1qzq s GLN 531 Cb 0.12 -1.46 0.02 0.00 1.10 0.00 0.00 33.01 32.79 1qzq s GLN 531 CO 0.80 0.39 -0.01 -1.17 -0.55 0.00 0.00 175.29 174.76 1qzq s LEU 532 N -0.70 3.48 -0.23 3.68 2.96 -0.00 0.10 118.68 127.98 1qzq s LEU 532 Ca 0.07 -0.88 -0.11 0.00 -0.22 0.00 0.00 54.13 53.00 1qzq s LEU 532 Cb -0.08 -1.74 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 1qzq s LEU 532 CO 0.00 -0.17 0.16 -0.32 -1.32 0.00 0.00 176.35 174.71 1qzq s MET 533 N 1.37 4.11 -0.10 1.98 -2.45 0.77 -0.57 119.30 124.42 1qzq s MET 533 Ca 0.00 -0.24 0.02 0.00 -1.25 0.00 0.00 55.69 54.23 1qzq s MET 533 Cb -0.17 -3.51 0.01 0.00 1.25 0.00 0.00 34.83 32.41 1qzq s MET 533 CO -0.02 0.12 -0.16 0.42 1.05 0.00 0.00 175.02 176.43 1qzq s ILE 534 N 0.88 1.50 -0.23 10.11 1.01 0.41 -0.87 121.20 134.01 1qzq s ILE 534 Ca 0.08 -0.66 0.20 0.00 0.00 0.00 0.00 60.65 60.27 1qzq s ILE 534 Cb -0.13 -1.35 0.03 0.00 0.01 0.00 0.00 42.46 41.01 1qzq s ILE 534 CO 0.03 0.44 1.13 0.03 0.00 0.00 0.00 174.94 176.57 1qzq h ARG 535 N 7.21 0.00 0.00 2.79 3.08 -1.71 0.91 114.38 126.67 1qzq h ARG 535 Ca -0.29 0.00 -0.14 0.00 0.07 0.00 0.00 59.98 59.62 1qzq h ARG 535 Cb 1.19 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.20 1qzq h ARG 535 CO 0.48 0.15 -0.12 -1.13 -1.07 0.00 0.00 179.97 178.28 1qzq n SER 536 N -2.88 -0.33 -4.75 7.04 3.41 -0.98 -4.05 113.62 111.08 1qzq n SER 536 Ca -0.02 -1.71 -0.37 0.00 -0.26 0.00 0.00 58.87 56.52 1qzq n SER 536 Cb 0.65 0.68 -0.07 0.00 -0.26 0.00 0.00 64.21 65.22 1qzq n SER 536 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 1qzq s TYR 537 N -3.15 3.50 0.04 7.33 1.51 -0.71 -3.22 117.35 122.66 1qzq s TYR 537 Ca 0.12 0.63 -0.06 0.00 -1.01 0.00 0.00 57.07 56.75 1qzq s TYR 537 Cb 0.00 -2.30 -0.01 0.00 -0.11 0.00 0.00 41.96 39.54 1qzq s TYR 537 CO 0.09 0.32 0.12 -1.21 -1.11 0.00 0.00 175.55 173.76 1qzq s GLU 538 N 0.18 0.63 -0.12 -0.62 0.41 -0.90 -1.62 118.70 116.66 1qzq s GLU 538 Ca 0.17 -0.75 -0.19 0.00 -0.41 0.00 0.00 54.97 53.79 1qzq s GLU 538 Cb -0.13 0.25 0.05 0.00 -1.78 0.00 0.00 34.13 32.51 1qzq s GLU 538 CO 0.05 -0.17 0.49 -1.17 -0.49 0.00 0.00 175.26 173.97 1qzq s LEU 539 N -2.18 0.13 0.22 1.80 2.96 -1.26 -1.09 118.68 119.25 1qzq s LEU 539 Ca -0.04 0.72 -0.22 0.00 -0.22 0.00 0.00 54.13 54.37 1qzq s LEU 539 Cb -0.01 1.77 0.05 0.00 0.50 0.00 0.00 46.19 48.51 1qzq s LEU 539 CO -0.05 -0.33 0.87 -0.83 -1.32 0.00 0.00 176.35 174.70 1qzq s GLY 540 N -0.42 -0.09 0.01 7.98 0.00 -0.54 -1.53 107.32 112.73 1qzq s GLY 540 Ca -0.06 -0.15 0.06 0.00 0.00 0.00 0.00 44.72 44.57 1qzq s GLY 540 CO 0.03 0.17 -0.18 -1.34 0.00 0.00 0.00 173.10 171.79 1qzq s VAL 541 N -3.28 1.44 -0.15 1.40 -7.23 -0.23 -1.50 120.40 110.84 1qzq s VAL 541 Ca 0.13 -0.92 -0.05 0.00 -1.81 0.00 0.00 61.98 59.33 1qzq s VAL 541 Cb -0.03 -1.23 -0.03 0.00 0.56 0.00 0.00 36.38 35.65 1qzq s VAL 541 CO 0.05 0.28 0.02 -0.22 -0.31 0.00 0.00 175.10 174.92 1qzq s LEU 542 N -0.75 3.59 -0.33 1.32 2.96 0.35 -2.38 118.68 123.45 1qzq s LEU 542 Ca 0.06 0.03 -0.11 0.00 -0.22 0.00 0.00 54.13 53.90 1qzq s LEU 542 Cb -0.08 -1.88 -0.00 0.00 0.50 0.00 0.00 46.19 44.74 1qzq s LEU 542 CO 0.00 0.22 0.19 -0.36 -1.32 0.00 0.00 176.35 175.08 1qzq s PHE 543 N 0.09 3.20 -0.11 5.38 0.40 0.11 -1.65 117.98 125.41 1qzq s PHE 543 Ca 0.03 -0.57 0.00 0.00 -0.60 0.00 0.00 56.93 55.79 1qzq s PHE 543 Cb -0.13 -2.41 -0.02 0.00 0.51 0.00 0.00 43.02 40.98 1qzq s PHE 543 CO 0.02 -0.48 -0.12 -0.51 0.70 0.00 0.00 175.22 174.83 1qzq s LEU 544 N 1.63 2.81 0.28 -0.37 1.43 -1.26 -1.95 118.68 121.25 1qzq s LEU 544 Ca 0.04 -0.26 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 1qzq s LEU 544 Cb -0.18 -1.62 0.64 0.00 0.03 0.00 0.00 46.19 45.07 1qzq s LEU 544 CO 0.07 0.22 1.76 -0.65 0.23 0.00 0.00 176.35 177.99 1qzq h PRO 545 N 6.31 0.66 -0.02 1.29 0.11 -1.83 -1.36 132.00 137.16 1qzq h PRO 545 Ca -0.32 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.75 1qzq h PRO 545 Cb 1.19 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1qzq h PRO 545 CO 0.55 0.44 0.02 0.66 -0.21 0.00 0.00 178.00 179.45 1qzq h SER 546 N 0.68 0.00 0.91 -2.05 4.64 -1.81 0.16 113.55 116.08 1qzq h SER 546 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 1qzq h SER 546 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1qzq h SER 546 CO -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.58 1qzq n ALA 547 N -2.44 1.89 -0.03 5.18 0.00 -0.51 -2.19 120.51 122.40 1qzq n ALA 547 Ca -0.02 0.01 0.03 0.00 0.00 0.00 0.00 53.44 53.46 1qzq n ALA 547 Cb 0.11 -1.39 0.07 0.00 0.00 0.00 0.00 19.45 18.24 1qzq n ALA 547 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1qzq n PHE 548 N -2.03 0.20 -3.07 0.00 3.72 0.43 -4.92 117.46 111.78 1qzq n PHE 548 Ca 0.04 -0.40 -0.13 0.00 -0.05 0.00 0.00 57.45 56.91 1qzq n PHE 548 Cb 0.28 -0.03 0.07 0.00 -0.94 0.00 0.00 39.48 38.86 1qzq n PHE 548 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1qzq n GLY 549 N 0.10 -0.27 3.15 1.37 0.00 -0.54 -5.04 105.19 103.96 1qzq n GLY 549 Ca 0.06 0.04 -0.08 0.00 0.00 0.00 0.00 46.02 46.04 1qzq n GLY 549 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qzq s LEU 550 N -5.30 1.95 -0.02 0.99 1.43 -0.46 -4.99 118.68 112.29 1qzq s LEU 550 Ca 0.06 -0.84 -0.09 0.00 -1.03 0.00 0.00 54.13 52.23 1qzq s LEU 550 Cb -0.01 0.61 -0.31 0.00 0.03 0.00 0.00 46.19 46.52 1qzq s LEU 550 CO 0.57 -0.67 0.79 0.44 0.23 0.00 0.00 176.35 177.71 1qzq h ASP 551 N 2.95 0.58 -5.19 2.29 3.45 -1.96 -3.14 116.42 115.39 1qzq h ASP 551 Ca -0.34 -0.80 -0.08 0.00 0.43 0.00 0.00 57.03 56.24 1qzq h ASP 551 Cb 1.17 -0.19 -0.05 0.00 -0.56 0.00 0.00 39.33 39.70 1qzq h ASP 551 CO 0.61 1.66 0.06 -0.94 -1.57 0.00 0.00 179.24 179.06 1qzq s SER 552 N -7.24 0.18 -0.10 6.45 1.04 -1.26 -4.83 113.70 107.94 1qzq s SER 552 Ca -0.12 -1.10 -0.02 0.00 0.48 0.00 0.00 55.95 55.19 1qzq s SER 552 Cb 0.06 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.87 1qzq s SER 552 CO 0.87 -1.41 -0.01 -0.36 0.98 0.00 0.00 173.24 173.31 1qzq s PHE 553 N -3.15 3.12 0.14 5.02 2.99 -0.58 -4.94 117.98 120.58 1qzq s PHE 553 Ca 0.20 0.11 -0.19 0.00 0.00 0.00 0.00 56.93 57.05 1qzq s PHE 553 Cb -0.03 -1.82 -0.07 0.00 0.00 0.00 0.00 43.02 41.10 1qzq s PHE 553 CO 0.12 0.37 0.63 0.15 -0.00 0.00 0.00 175.22 176.50 1qzq s LYS 554 N -0.65 4.23 0.09 0.44 1.02 -0.20 -0.99 119.74 123.67 1qzq s LYS 554 Ca 0.10 0.79 -0.28 0.00 0.02 0.00 0.00 55.97 56.60 1qzq s LYS 554 Cb -0.12 -3.10 -0.06 0.00 -0.52 0.00 0.00 37.83 34.04 1qzq s LYS 554 CO 0.02 0.54 0.88 0.08 -0.92 0.00 0.00 175.35 175.95 1qzq s VAL 555 N -1.28 4.57 -0.76 3.17 1.01 -0.52 -0.40 120.40 126.19 1qzq s VAL 555 Ca 0.35 1.90 -0.20 0.00 0.00 0.00 0.00 61.98 64.03 1qzq s VAL 555 Cb -0.18 -4.24 0.11 0.00 0.00 0.00 0.00 36.38 32.07 1qzq s VAL 555 CO 0.21 0.35 0.95 -0.75 0.00 0.00 0.00 175.10 175.85 1qzq s LYS 556 N -0.09 3.32 0.00 2.72 2.20 -0.52 -4.84 119.74 122.53 1qzq s LYS 556 Ca 0.43 -1.42 0.00 0.00 -0.36 0.00 0.00 55.97 54.62 1qzq s LYS 556 Cb -0.22 -4.52 0.00 0.00 -1.51 0.00 0.00 37.83 31.58 1qzq s LYS 556 CO 0.27 -1.70 0.51 0.00 -0.36 0.00 0.00 175.35 174.08 1qzq n GLN 557 N 6.67 0.78 -2.93 4.03 10.64 -1.26 -3.49 117.38 131.82 1qzq n GLN 557 Ca 0.07 0.00 -0.11 0.00 -1.83 0.00 0.00 57.00 55.12 1qzq n GLN 557 Cb 0.46 -1.31 -0.01 0.00 -0.86 0.00 0.00 30.24 28.52 1qzq n GLN 557 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1qzq n LYS 558 N 0.26 0.53 -0.88 2.61 4.76 -1.26 -4.82 118.16 119.35 1qzq n LYS 558 Ca 0.00 -2.32 0.00 0.00 -2.87 0.00 0.00 58.31 53.12 1qzq n LYS 558 Cb 0.26 -1.49 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 1qzq n LYS 558 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1qzq n PHE 559 N 2.52 0.00 -1.72 2.13 7.35 -1.19 -5.05 117.46 121.50 1qzq n PHE 559 Ca 0.19 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.83 1qzq n PHE 559 Cb 0.55 -0.37 0.00 0.00 0.35 0.00 0.00 39.48 40.02 1qzq n PHE 559 CO 0.00 0.00 0.00 -1.91 -0.76 0.00 0.00 176.76 174.09 1qzq n GLU 565 N 3.22 -0.26 0.14 -4.13 4.07 -1.26 -4.89 120.64 117.53 1qzq n GLU 565 Ca 0.00 0.18 -0.05 0.00 -0.06 0.00 0.00 57.16 57.22 1qzq n GLU 565 Cb 0.25 -0.30 -0.03 0.00 -0.06 0.00 0.00 31.44 31.31 1qzq n GLU 565 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1qzq h PRO 566 N 0.44 -0.34 -0.39 5.31 0.13 -2.03 -3.09 132.00 132.03 1qzq h PRO 566 Ca -0.09 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1qzq h PRO 566 Cb 0.21 0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.41 1qzq h PRO 566 CO 0.04 -0.23 0.00 -1.33 -0.23 0.00 0.00 178.00 176.25 1qzq n MET 567 N -3.08 0.05 0.00 0.86 2.81 -1.26 -2.33 117.12 114.16 1qzq n MET 567 Ca -0.04 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.85 1qzq n MET 567 Cb 0.14 -1.10 0.00 0.00 -0.71 0.00 0.00 33.22 31.55 1qzq n MET 567 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1qzq n ALA 568 N 0.57 0.00 -3.04 3.04 0.00 -1.24 -5.06 120.51 114.77 1qzq n ALA 568 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.07 1qzq n ALA 568 Cb 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.34 1qzq n ALA 568 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1qzq s THR 569 N 0.00 4.29 0.09 0.00 -4.23 -0.99 -1.04 115.64 113.77 1qzq s THR 569 Ca 0.00 -0.37 -0.28 0.00 -1.18 0.00 0.00 61.69 59.86 1qzq s THR 569 Cb 0.00 -3.11 -0.06 0.00 1.34 0.00 0.00 72.50 70.68 1qzq s THR 569 CO 0.00 0.20 0.89 0.12 -0.54 0.00 0.00 174.62 175.29 1qzq s PHE 570 N 1.58 3.80 -1.34 3.99 5.36 0.47 -4.69 117.98 127.15 1qzq s PHE 570 Ca 0.05 1.69 -0.17 0.00 -0.96 0.00 0.00 56.93 57.54 1qzq s PHE 570 Cb -0.16 -2.97 0.07 0.00 -0.34 0.00 0.00 43.02 39.62 1qzq s PHE 570 CO 0.04 0.25 1.85 -0.35 -1.46 0.00 0.00 175.22 175.55 1qzq n PRO 571 N 2.71 3.12 -2.07 10.12 -0.04 -1.26 -1.44 135.00 146.15 1qzq n PRO 571 Ca 0.00 -3.13 -0.42 0.00 -0.04 0.00 0.00 63.50 59.91 1qzq n PRO 571 Cb 0.49 -3.44 -0.03 0.00 -0.04 0.00 0.00 33.50 30.49 1qzq n PRO 571 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1qzq s VAL 572 N 3.90 3.68 0.40 0.52 1.01 -1.26 -4.88 120.40 123.77 1qzq s VAL 572 Ca 0.52 0.81 0.35 0.00 0.00 0.00 0.00 61.98 63.66 1qzq s VAL 572 Cb 0.06 -3.54 0.37 0.00 0.00 0.00 0.00 36.38 33.27 1qzq s VAL 572 CO 0.04 -0.09 2.14 1.55 0.00 0.00 0.00 175.10 178.74 1qzq h PRO 573 N 9.49 0.00 -5.71 2.72 0.13 -1.93 -3.44 132.00 133.26 1qzq h PRO 573 Ca -0.37 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.15 1qzq h PRO 573 Cb 1.17 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.19 1qzq h PRO 573 CO 0.96 0.05 -0.54 1.52 -0.23 0.00 0.00 178.00 179.76 1qzq s TYR 574 N -4.03 2.44 0.37 1.56 1.13 -1.26 -4.19 117.35 113.37 1qzq s TYR 574 Ca -0.02 -0.68 -0.24 0.00 -1.41 0.00 0.00 57.07 54.72 1qzq s TYR 574 Cb 0.12 -1.84 -0.10 0.00 -1.10 0.00 0.00 41.96 39.04 1qzq s TYR 574 CO 0.52 0.28 0.95 -0.51 -2.51 0.00 0.00 175.55 174.28 1qzq s ASP 575 N -3.83 7.15 0.00 -0.18 -0.00 0.15 -4.90 116.67 115.06 1qzq s ASP 575 Ca 0.34 1.80 0.04 0.00 -0.00 0.00 0.00 52.55 54.73 1qzq s ASP 575 Cb 0.06 -2.57 -0.01 0.00 -0.00 0.00 0.00 42.92 40.40 1qzq s ASP 575 CO 0.18 -0.21 -0.14 -0.76 -0.00 0.00 0.00 175.17 174.25 1qzq s LEU 576 N -2.51 2.06 0.78 1.23 1.43 -1.26 -4.03 118.68 116.38 1qzq s LEU 576 Ca 0.55 -0.30 -0.12 0.00 -1.03 0.00 0.00 54.13 53.24 1qzq s LEU 576 Cb -0.15 -0.69 0.06 0.00 0.03 0.00 0.00 46.19 45.44 1qzq s LEU 576 CO 0.20 0.14 1.16 -2.16 0.23 0.00 0.00 176.35 175.92 1qzq s PRO 577 N -0.51 2.17 0.38 1.29 0.04 -1.26 -5.10 135.00 132.01 1qzq s PRO 577 Ca 0.05 0.18 -0.25 0.00 0.04 0.00 0.00 61.00 61.01 1qzq s PRO 577 Cb -0.06 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 1qzq s PRO 577 CO -0.00 -1.46 1.12 -2.14 0.04 0.00 0.00 177.00 174.56 1qzq s PRO 578 N -5.52 4.16 -0.10 0.56 0.02 -1.26 -5.02 135.00 127.85 1qzq s PRO 578 Ca 0.61 1.73 -0.16 0.00 0.02 0.00 0.00 61.00 63.19 1qzq s PRO 578 Cb -0.11 -2.70 -0.05 0.00 0.02 0.00 0.00 34.50 31.67 1qzq s PRO 578 CO 0.49 -0.19 0.41 -2.00 -0.33 0.00 0.00 177.00 175.38 1qzq s GLU 579 N -2.25 4.22 0.44 5.54 2.12 -1.26 -4.97 118.70 122.53 1qzq s GLU 579 Ca 0.56 0.35 -0.23 0.00 0.36 0.00 0.00 54.97 56.00 1qzq s GLU 579 Cb -0.28 -3.38 -0.08 0.00 0.26 0.00 0.00 34.13 30.65 1qzq s GLU 579 CO 0.35 0.30 1.13 -1.17 -0.54 0.00 0.00 175.26 175.33 1qzq s LEU 580 N 0.19 4.07 0.30 2.70 2.96 -1.26 -0.38 118.68 127.25 1qzq s LEU 580 Ca 0.23 2.22 -0.29 0.00 -0.22 0.00 0.00 54.13 56.07 1qzq s LEU 580 Cb -0.15 -4.21 -0.13 0.00 0.50 0.00 0.00 46.19 42.20 1qzq s LEU 580 CO 0.09 -0.76 1.24 -1.22 -1.32 0.00 0.00 176.35 174.38 1qzq n TYR 581 N -0.31 1.96 -1.34 5.38 4.02 -0.98 -4.68 117.16 121.22 1qzq n TYR 581 Ca 0.06 0.57 -0.29 0.00 -0.01 0.00 0.00 57.90 58.23 1qzq n TYR 581 Cb 0.48 -2.38 0.19 0.00 -0.02 0.00 0.00 39.34 37.62 1qzq n TYR 581 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1qzq s GLY 582 N -0.24 1.60 0.39 2.72 0.00 -1.26 -4.89 107.32 105.63 1qzq s GLY 582 Ca 0.59 -0.71 0.14 0.00 0.00 0.00 0.00 44.72 44.74 1qzq s GLY 582 CO 0.59 -0.00 1.86 1.48 0.00 0.00 0.00 173.10 177.03 1qzq h SER 583 N -1.99 0.00 0.95 1.64 4.64 -2.04 -2.45 113.55 114.30 1qzq h SER 583 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1qzq h SER 583 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 1qzq h SER 583 CO 0.49 0.33 -0.63 0.07 -0.87 0.00 0.00 176.83 176.22 1qzq h LYS 584 N 0.00 0.00 -7.20 4.77 2.10 -2.03 -3.47 116.57 110.75 1qzq h LYS 584 Ca -0.00 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 58.13 1qzq h LYS 584 Cb 0.60 0.00 0.13 0.00 -0.90 0.00 0.00 32.23 32.05 1qzq h LYS 584 CO 0.04 0.00 0.37 -0.51 -2.00 0.00 0.00 179.45 177.36 1qzq s ASP 585 N -4.45 4.67 -0.01 7.07 1.01 -0.92 -5.06 116.67 118.98 1qzq s ASP 585 Ca 0.06 2.14 -0.08 0.00 0.71 0.00 0.00 52.55 55.38 1qzq s ASP 585 Cb 0.13 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.49 1qzq s ASP 585 CO 0.72 -1.93 0.15 -0.60 0.21 0.00 0.00 175.17 173.72 1qzq s ARG 586 N -4.06 0.46 0.60 8.23 6.06 -1.26 -4.83 118.95 124.15 1qzq s ARG 586 Ca 0.70 -0.31 -0.18 0.00 -2.50 0.00 0.00 55.73 53.44 1qzq s ARG 586 Cb -0.24 0.19 -0.03 0.00 0.06 0.00 0.00 34.95 34.94 1qzq s ARG 586 CO 0.44 -0.11 1.15 -1.25 -2.50 0.00 0.00 175.30 173.03 1qzq s PRO 587 N -1.19 3.01 -0.03 5.12 0.04 -1.26 -0.61 135.00 140.07 1qzq s PRO 587 Ca -0.13 1.62 -0.30 0.00 0.04 0.00 0.00 61.00 62.24 1qzq s PRO 587 Cb -0.07 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1qzq s PRO 587 CO 0.02 -1.13 1.35 -0.46 0.04 0.00 0.00 177.00 176.81 1qzq s TRP 588 N -1.89 2.90 -0.23 0.56 -0.11 -0.96 -4.42 118.94 114.79 1qzq s TRP 588 Ca 0.73 0.91 0.02 0.00 1.22 0.00 0.00 56.10 58.98 1qzq s TRP 588 Cb -0.25 -3.60 0.05 0.00 -1.50 0.00 0.00 33.47 28.17 1qzq s TRP 588 CO 0.34 -2.14 -0.12 0.42 -4.62 0.00 0.00 176.95 170.82 1qzq s ILE 589 N 2.54 1.99 0.04 5.86 1.01 -1.26 -4.52 121.20 126.85 1qzq s ILE 589 Ca 0.61 -1.31 0.33 0.00 0.00 0.00 0.00 60.65 60.28 1qzq s ILE 589 Cb -0.29 -2.03 0.38 0.00 0.01 0.00 0.00 42.46 40.53 1qzq s ILE 589 CO 0.24 0.14 1.96 4.11 0.00 0.00 0.00 174.94 181.39 1qzq h TRP 590 N 7.87 0.00 -0.70 3.97 5.08 -1.51 -3.31 115.95 127.36 1qzq h TRP 590 Ca -0.27 0.00 -0.27 0.00 1.08 0.00 0.00 58.89 59.43 1qzq h TRP 590 Cb 1.08 0.00 -0.16 0.00 -3.00 0.00 0.00 29.16 27.08 1qzq h TRP 590 CO 0.56 0.00 0.29 0.27 -1.28 0.00 0.00 178.44 178.28 1qzq n ASN 591 N -3.01 4.07 -4.23 0.11 6.94 -1.26 -4.79 115.26 113.09 1qzq n ASN 591 Ca 0.01 -3.40 -0.16 0.00 -0.02 0.00 0.00 54.58 51.00 1qzq n ASN 591 Cb 0.30 -0.73 -0.11 0.00 -2.36 0.00 0.00 39.78 36.88 1qzq n ASN 591 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 1qzq s ILE 592 N -3.10 1.23 0.56 1.53 -4.36 -1.25 -4.88 121.20 110.92 1qzq s ILE 592 Ca 0.53 -1.78 -0.14 0.00 -0.26 0.00 0.00 60.65 59.00 1qzq s ILE 592 Cb 0.44 -1.56 -0.06 0.00 1.25 0.00 0.00 42.46 42.52 1qzq s ILE 592 CO 0.10 -0.51 1.00 -2.16 0.24 0.00 0.00 174.94 173.61 1qzq s PRO 593 N -2.92 3.81 -0.29 0.37 0.04 -1.26 -4.66 135.00 130.09 1qzq s PRO 593 Ca 0.10 0.87 -0.01 0.00 0.04 0.00 0.00 61.00 62.00 1qzq s PRO 593 Cb -0.03 -2.11 0.10 0.00 0.04 0.00 0.00 34.50 32.49 1qzq s PRO 593 CO 0.02 -0.39 0.09 0.71 0.04 0.00 0.00 177.00 177.48 1qzq s TYR 594 N -2.84 1.46 0.00 0.56 2.02 0.54 -4.99 117.35 114.11 1qzq s TYR 594 Ca 0.57 -1.53 0.00 0.00 -0.37 0.00 0.00 57.07 55.74 1qzq s TYR 594 Cb -0.10 -1.53 0.00 0.00 -0.40 0.00 0.00 41.96 39.92 1qzq s TYR 594 CO 0.40 -0.84 0.38 1.33 -1.57 0.00 0.00 175.55 175.25 1qzq n VAL 595 N 4.92 0.00 0.03 0.71 0.24 -1.26 -1.13 118.33 121.83 1qzq n VAL 595 Ca -0.03 -0.39 -0.06 0.00 -2.04 0.00 0.00 64.34 61.81 1qzq n VAL 595 Cb 0.43 1.21 -0.11 0.00 -1.47 0.00 0.00 33.84 33.89 1qzq n VAL 595 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1qzq h LYS 596 N 0.00 0.00 -4.40 7.34 1.57 -1.98 -3.45 116.57 115.66 1qzq h LYS 596 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 1qzq h LYS 596 Cb 0.11 0.00 -0.35 0.00 0.08 0.00 0.00 32.23 32.06 1qzq h LYS 596 CO 0.00 0.68 -0.81 0.00 -0.57 0.00 0.00 179.45 178.75 1qzq s ALA 597 N -2.70 1.33 0.55 3.86 0.00 -1.26 -5.13 121.76 118.40 1qzq s ALA 597 Ca -0.02 -0.51 -0.18 0.00 0.00 0.00 0.00 51.96 51.25 1qzq s ALA 597 Cb 0.09 -0.77 -0.06 0.00 0.00 0.00 0.00 23.12 22.38 1qzq s ALA 597 CO 0.82 -0.18 1.07 -1.25 0.00 0.00 0.00 175.76 176.22 1qzq s PRO 598 N 1.23 3.46 0.00 0.00 0.04 -1.26 -4.84 135.00 133.63 1qzq s PRO 598 Ca -0.04 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.39 1qzq s PRO 598 Cb -0.14 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1qzq s PRO 598 CO -0.03 -0.72 0.00 -0.40 0.04 0.00 0.00 177.00 175.89 1qzq n ASP 599 N -1.47 0.00 0.21 6.66 3.85 0.11 -4.82 116.55 121.10 1qzq n ASP 599 Ca 0.10 -0.95 0.15 0.00 -0.71 0.00 0.00 54.79 53.38 1qzq n ASP 599 Cb 0.52 0.00 0.77 0.00 -1.35 0.00 0.00 41.12 41.06 1qzq n ASP 599 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 1qzq h THR 600 N -0.76 0.00 -0.35 2.12 1.35 -1.74 -0.78 112.91 112.75 1qzq h THR 600 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1qzq h THR 600 Cb 0.00 0.68 0.00 0.00 -1.73 0.00 0.00 68.15 67.10 1qzq h THR 600 CO 0.00 0.00 0.00 1.41 -0.25 0.00 0.00 175.52 176.68 1qzq n HIS 601 N -2.51 0.90 -1.10 4.73 8.25 -1.26 -4.95 115.22 119.29 1qzq n HIS 601 Ca -0.02 -0.71 -0.03 0.00 -0.26 0.00 0.00 57.72 56.69 1qzq n HIS 601 Cb 0.06 -0.22 -0.01 0.00 1.12 0.00 0.00 29.99 30.93 1qzq n HIS 601 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1qzq n GLY 602 N 0.07 0.63 3.83 -1.41 0.00 -0.30 -5.02 105.19 103.00 1qzq n GLY 602 Ca 0.19 -0.44 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 1qzq n GLY 602 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1qzq s ASN 603 N -2.53 5.14 0.39 1.61 0.01 -1.26 -4.74 114.94 113.57 1qzq s ASN 603 Ca 0.00 -0.58 0.08 0.00 -0.71 0.00 0.00 52.86 51.65 1qzq s ASN 603 Cb 0.00 -0.88 -0.06 0.00 0.41 0.00 0.00 41.25 40.72 1qzq s ASN 603 CO 0.00 -0.37 0.10 -0.04 -1.51 0.00 0.00 177.10 175.28 1qzq s MET 604 N -3.98 2.14 -0.23 -0.60 -1.94 -1.26 0.09 119.30 113.53 1qzq s MET 604 Ca 0.41 -1.86 -0.02 0.00 -1.71 0.00 0.00 55.69 52.52 1qzq s MET 604 Cb -0.05 -1.91 0.02 0.00 2.01 0.00 0.00 34.83 34.90 1qzq s MET 604 CO 0.26 -0.03 -0.09 -0.46 -0.01 0.00 0.00 175.02 174.69 1qzq s TRP 605 N -2.59 2.98 -0.38 -0.03 -0.11 -0.28 -5.00 118.94 113.53 1qzq s TRP 605 Ca 0.38 -1.44 0.01 0.00 1.22 0.00 0.00 56.10 56.27 1qzq s TRP 605 Cb 0.04 -2.04 0.14 0.00 -1.50 0.00 0.00 33.47 30.10 1qzq s TRP 605 CO 0.21 -0.70 0.21 0.08 -4.62 0.00 0.00 176.95 172.13 1qzq s VAL 606 N 1.35 0.65 0.64 5.86 1.01 -1.26 -0.34 120.40 128.31 1qzq s VAL 606 Ca 0.02 -2.00 -0.17 0.00 0.00 0.00 0.00 61.98 59.83 1qzq s VAL 606 Cb -0.15 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.70 1qzq s VAL 606 CO -0.06 -0.93 0.66 -2.65 0.00 0.00 0.00 175.10 172.12 1qzq n PRO 607 N 3.91 0.52 -0.55 2.72 -0.02 -1.26 -5.04 135.00 135.27 1qzq n PRO 607 Ca 0.10 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1qzq n PRO 607 Cb 0.36 -1.89 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 1qzq n PRO 607 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91