#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 4.48 0.00 1.61 3.84 -1.26 -4.91 114.94 118.70 1qzq s ASN 162 Ca 0.00 -2.97 0.16 0.00 0.21 0.00 0.00 52.86 50.26 1qzq s ASN 162 Cb 0.00 -1.68 0.69 0.00 -0.55 0.00 0.00 41.25 39.72 1qzq s ASN 162 CO 0.00 -0.26 1.49 -0.81 -2.79 0.00 0.00 177.10 174.74 1qzq n PRO 163 N 3.20 0.04 0.03 0.43 -0.04 -1.26 -2.62 135.00 134.78 1qzq n PRO 163 Ca 0.05 0.21 -0.05 0.00 -0.04 0.00 0.00 63.50 63.68 1qzq n PRO 163 Cb 0.33 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.19 1qzq n PRO 163 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1qzq h PHE 164 N 0.00 0.00 -5.97 0.54 0.04 -1.98 -3.49 116.94 106.08 1qzq h PHE 164 Ca 0.00 0.00 -0.45 0.00 2.80 0.00 0.00 57.97 60.32 1qzq h PHE 164 Cb 0.25 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1qzq h PHE 164 CO 0.00 0.84 -0.71 1.04 -0.60 0.00 0.00 178.31 178.88 1qzq n GLN 165 N -3.11 -5.61 -3.83 1.51 1.13 -1.08 -4.82 117.38 101.57 1qzq n GLN 165 Ca -0.08 0.65 -0.36 0.00 -1.94 0.00 0.00 57.00 55.26 1qzq n GLN 165 Cb 0.93 -5.55 -0.12 0.00 0.11 0.00 0.00 30.24 25.62 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 -3.25 3.14 0.22 1.08 2.19 -1.26 -1.69 117.98 118.41 1qzq s PHE 166 Ca 0.60 -0.21 0.04 0.00 0.33 0.00 0.00 56.93 57.69 1qzq s PHE 166 Cb -0.29 -2.20 -0.05 0.00 -1.31 0.00 0.00 43.02 39.16 1qzq s PHE 166 CO 0.74 -0.18 -0.04 0.71 1.83 0.00 0.00 175.22 178.27 1qzq s TYR 167 N 1.25 1.55 0.22 10.12 1.51 0.25 -4.97 117.35 127.28 1qzq s TYR 167 Ca 0.05 -0.84 0.08 0.00 -1.01 0.00 0.00 57.07 55.35 1qzq s TYR 167 Cb -0.14 -0.87 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 1qzq s TYR 167 CO 0.04 0.05 0.04 -0.51 -1.11 0.00 0.00 175.55 174.06 1qzq s LEU 168 N -3.29 3.38 0.58 -1.29 1.43 -1.26 0.10 118.68 118.33 1qzq s LEU 168 Ca 0.26 -0.44 -0.10 0.00 -1.03 0.00 0.00 54.13 52.81 1qzq s LEU 168 Cb 0.04 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 1qzq s LEU 168 CO 0.07 0.04 0.97 0.42 0.23 0.00 0.00 176.35 178.08 1qzq s THR 169 N -2.00 4.73 0.44 5.49 -4.23 -1.07 -1.40 115.64 117.60 1qzq s THR 169 Ca 0.30 0.78 -0.25 0.00 -1.18 0.00 0.00 61.69 61.34 1qzq s THR 169 Cb -0.08 -3.85 -0.08 0.00 1.34 0.00 0.00 72.50 69.83 1qzq s THR 169 CO 0.20 -1.03 1.27 -0.13 -0.54 0.00 0.00 174.62 174.40 1qzq s ARG 170 N -4.95 3.81 -0.17 3.99 0.52 -0.58 -4.62 118.95 116.96 1qzq s ARG 170 Ca 0.54 2.07 0.01 0.00 -0.52 0.00 0.00 55.73 57.83 1qzq s ARG 170 Cb -0.11 -2.61 0.01 0.00 0.52 0.00 0.00 34.95 32.77 1qzq s ARG 170 CO 0.49 -0.59 -0.20 0.08 0.02 0.00 0.00 175.30 175.10 1qzq s VAL 171 N -1.33 2.14 -0.29 3.52 1.01 -1.26 -4.62 120.40 119.56 1qzq s VAL 171 Ca 0.60 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 1qzq s VAL 171 Cb -0.36 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.14 1qzq s VAL 171 CO 0.45 0.54 1.27 -0.55 0.00 0.00 0.00 175.10 176.81 1qzq s SER 172 N 1.09 6.72 0.00 3.32 0.15 -0.55 -3.25 113.70 121.18 1qzq s SER 172 Ca 0.00 1.22 0.00 0.00 0.70 0.00 0.00 55.95 57.87 1qzq s SER 172 Cb -0.14 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 1qzq s SER 172 CO -0.08 -1.04 0.00 0.61 1.20 0.00 0.00 173.24 173.93 1qzq n GLY 173 N 4.22 1.60 3.88 9.45 0.00 -1.26 -4.82 105.19 118.27 1qzq n GLY 173 Ca 0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.58 4.15 0.37 1.61 -7.23 -1.20 -4.99 120.40 111.53 1qzq s VAL 174 Ca 0.00 0.58 -0.28 0.00 -1.81 0.00 0.00 61.98 60.47 1qzq s VAL 174 Cb 0.00 -3.68 -0.11 0.00 0.56 0.00 0.00 36.38 33.15 1qzq s VAL 174 CO 0.00 -0.85 1.45 0.29 -0.31 0.00 0.00 175.10 175.68 1qzq n LYS 175 N -2.79 2.57 -0.14 4.82 4.76 -1.26 -4.86 118.16 121.25 1qzq n LYS 175 Ca 0.06 0.90 0.28 0.00 -2.87 0.00 0.00 58.31 56.68 1qzq n LYS 175 Cb 0.56 -2.61 0.70 0.00 -1.84 0.00 0.00 35.03 31.84 1qzq n LYS 175 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1qzq h PRO 176 N 2.86 0.00 0.00 1.97 0.13 -1.97 0.27 132.00 135.26 1qzq h PRO 176 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1qzq h PRO 176 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1qzq h PRO 176 CO 0.64 0.00 0.00 0.36 -0.23 0.00 0.00 178.00 178.77 1qzq n LYS 177 N -3.90 0.12 0.00 0.86 2.85 -1.26 -1.97 118.16 114.87 1qzq n LYS 177 Ca 0.18 0.31 0.13 0.00 -1.05 0.00 0.00 58.31 57.88 1qzq n LYS 177 Cb 1.03 -1.71 0.27 0.00 -0.65 0.00 0.00 35.03 33.97 1qzq n LYS 177 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1qzq n TYR 178 N -1.93 0.00 0.27 5.58 4.01 0.96 -3.83 117.16 122.22 1qzq n TYR 178 Ca 0.03 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.81 1qzq n TYR 178 Cb 0.23 -0.03 -0.05 0.00 -0.31 0.00 0.00 39.34 39.19 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 0.17 0.99 -4.58 7.72 3.02 -0.93 -4.72 115.26 116.94 1qzq n ASN 179 Ca 0.14 -0.53 -0.41 0.00 -0.03 0.00 0.00 54.58 53.75 1qzq n ASN 179 Cb 0.43 1.08 -0.03 0.00 -0.61 0.00 0.00 39.78 40.66 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 -1.97 5.98 0.00 6.41 1.04 -0.83 -1.03 113.70 123.30 1qzq s SER 180 Ca 0.02 0.45 0.00 0.00 0.48 0.00 0.00 55.95 56.90 1qzq s SER 180 Cb 0.05 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.63 1qzq s SER 180 CO 0.31 -1.80 0.00 0.61 0.98 0.00 0.00 173.24 173.34 1qzq n GLY 181 N 5.34 0.89 3.81 7.32 0.00 -1.26 -5.01 105.19 116.28 1qzq n GLY 181 Ca 0.15 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 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 3.55 0.01 4.61 0.00 -0.20 -4.60 121.76 123.13 1qzq s ALA 182 Ca 0.00 -1.41 0.07 0.00 0.00 0.00 0.00 51.96 50.62 1qzq s ALA 182 Cb 0.00 -1.27 -0.02 0.00 0.00 0.00 0.00 23.12 21.83 1qzq s ALA 182 CO 0.00 0.28 -0.22 -0.51 0.00 0.00 0.00 175.76 175.31 1qzq s LEU 183 N -3.74 2.09 0.21 0.00 1.43 -0.49 -4.71 118.68 113.46 1qzq s LEU 183 Ca 0.32 -0.45 0.06 0.00 -1.03 0.00 0.00 54.13 53.04 1qzq s LEU 183 Cb -0.08 -1.09 -0.04 0.00 0.03 0.00 0.00 46.19 45.02 1qzq s LEU 183 CO 0.24 0.23 0.15 -2.28 0.23 0.00 0.00 176.35 174.92 1qzq s HIS 184 N -0.63 3.09 0.35 0.29 5.65 -1.26 -1.53 115.29 121.25 1qzq s HIS 184 Ca 0.08 -0.07 0.05 0.00 0.25 0.00 0.00 55.06 55.37 1qzq s HIS 184 Cb -0.09 -1.44 0.70 0.00 -1.18 0.00 0.00 32.58 30.57 1qzq s HIS 184 CO 0.00 0.52 1.94 0.97 -0.65 0.00 0.00 174.74 177.53 1qzq h ILE 185 N 1.84 1.02 -0.47 0.89 2.10 -1.95 0.96 117.51 121.88 1qzq h ILE 185 Ca -0.48 -0.28 0.03 0.00 1.08 0.00 0.00 64.86 65.21 1qzq h ILE 185 Cb 1.22 0.13 -0.03 0.00 -1.09 0.00 0.00 36.82 37.05 1qzq h ILE 185 CO 0.62 0.15 0.32 0.11 -1.08 0.00 0.00 178.15 178.26 1qzq h LYS 186 N 0.81 0.54 -0.36 2.19 1.57 -1.96 -1.07 116.57 118.31 1qzq h LYS 186 Ca 0.34 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.99 1qzq h LYS 186 Cb 0.29 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 1qzq h LYS 186 CO -0.12 0.36 -0.19 -0.44 -0.57 0.00 0.00 179.45 178.49 1qzq h ASP 187 N 0.56 0.78 -0.39 0.86 3.32 -1.17 -2.05 116.42 118.32 1qzq h ASP 187 Ca 0.19 -0.41 -0.04 0.00 0.02 0.00 0.00 57.03 56.78 1qzq h ASP 187 Cb 0.07 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1qzq h ASP 187 CO -0.05 1.02 0.10 0.40 -1.72 0.00 0.00 179.24 179.00 1qzq h ILE 188 N 0.54 1.20 -0.01 0.35 2.04 -0.65 -2.86 117.51 118.12 1qzq h ILE 188 Ca 0.08 -0.74 0.00 0.00 1.00 0.00 0.00 64.86 65.20 1qzq h ILE 188 Cb 0.73 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1qzq h ILE 188 CO 0.06 0.27 -0.16 0.18 0.00 0.00 0.00 178.15 178.49 1qzq n LEU 189 N -4.30 1.40 -4.76 1.44 4.77 -0.49 -4.82 117.00 110.25 1qzq n LEU 189 Ca 0.03 -0.43 -0.36 0.00 -0.03 0.00 0.00 56.01 55.22 1qzq n LEU 189 Cb 0.21 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 1qzq n LEU 189 CO 0.39 0.25 0.83 -0.94 -1.33 0.00 0.00 177.39 176.59 1qzq s SER 190 N -2.28 5.44 0.58 -1.43 1.04 -0.78 -4.44 113.70 111.84 1qzq s SER 190 Ca 0.29 2.33 0.31 0.00 0.48 0.00 0.00 55.95 59.36 1qzq s SER 190 Cb 0.20 -2.60 1.35 0.00 0.10 0.00 0.00 66.02 65.07 1qzq s SER 190 CO 0.44 -1.42 1.69 -0.65 0.98 0.00 0.00 173.24 174.28 1qzq h PRO 191 N 1.11 0.00 -0.25 4.02 0.11 -1.91 0.23 132.00 135.31 1qzq h PRO 191 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1qzq h PRO 191 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 1qzq h PRO 191 CO 0.56 0.00 0.16 -0.07 -0.21 0.00 0.00 178.00 178.45 1qzq h LEU 192 N 0.00 0.28 -0.37 2.35 4.07 -1.91 -1.43 115.31 118.31 1qzq h LEU 192 Ca 0.40 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.35 1qzq h LEU 192 Cb 2.02 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 43.69 1qzq h LEU 192 CO -0.00 0.21 -0.14 0.49 -1.08 0.00 0.00 178.44 177.91 1qzq n PHE 193 N -4.50 0.00 0.00 1.13 3.01 0.07 -5.00 117.46 112.17 1qzq n PHE 193 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1qzq n PHE 193 Cb 0.07 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 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 1.28 4.24 3.45 1.37 0.00 -0.54 -5.03 105.19 109.96 1qzq n GLY 194 Ca 0.14 -1.39 -0.43 0.00 0.00 0.00 0.00 46.02 44.34 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 -2.00 4.41 0.25 2.61 2.01 -1.26 -4.33 115.64 117.33 1qzq s THR 195 Ca 0.00 -0.57 -0.31 0.00 0.31 0.00 0.00 61.69 61.12 1qzq s THR 195 Cb 0.00 -4.69 -0.13 0.00 0.01 0.00 0.00 72.50 67.69 1qzq s THR 195 CO 0.00 -1.45 1.46 -0.11 -0.69 0.00 0.00 174.62 173.83 1qzq n LEU 196 N 7.47 3.40 -0.04 4.42 7.94 -1.26 -1.94 117.00 136.99 1qzq n LEU 196 Ca -0.00 1.14 -0.05 0.00 -1.11 0.00 0.00 56.01 55.99 1qzq n LEU 196 Cb 0.46 -1.47 -0.03 0.00 0.53 0.00 0.00 43.42 42.91 1qzq n LEU 196 CO 0.62 -0.34 -0.74 0.52 -1.11 0.00 0.00 177.39 176.35 1qzq n VAL 197 N 2.00 0.42 -3.56 1.96 0.31 0.14 -4.87 118.33 114.72 1qzq n VAL 197 Ca 0.11 -0.17 -0.06 0.00 -0.01 0.00 0.00 64.34 64.21 1qzq n VAL 197 Cb 0.33 -0.76 -0.02 0.00 -0.91 0.00 0.00 33.84 32.47 1qzq n VAL 197 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1qzq s SER 198 N -4.65 -0.23 0.11 4.52 1.04 -1.11 -4.13 113.70 109.25 1qzq s SER 198 Ca -0.09 0.02 -0.08 0.00 0.48 0.00 0.00 55.95 56.27 1qzq s SER 198 Cb 0.02 0.24 -0.01 0.00 0.10 0.00 0.00 66.02 66.38 1qzq s SER 198 CO 0.17 -0.38 0.20 -0.94 0.98 0.00 0.00 173.24 173.27 1qzq s SER 199 N -2.24 0.12 -0.07 7.02 1.04 -0.90 -0.84 113.70 117.84 1qzq s SER 199 Ca 0.07 -0.74 0.04 0.00 0.48 0.00 0.00 55.95 55.80 1qzq s SER 199 Cb -0.01 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.47 1qzq s SER 199 CO -0.06 -0.77 -0.19 0.00 0.98 0.00 0.00 173.24 173.20 1qzq s ALA 200 N -3.90 1.73 -0.31 5.32 0.00 -0.13 -1.36 121.76 123.11 1qzq s ALA 200 Ca 0.09 -0.75 0.00 0.00 0.00 0.00 0.00 51.96 51.30 1qzq s ALA 200 Cb 0.05 -0.63 0.07 0.00 0.00 0.00 0.00 23.12 22.61 1qzq s ALA 200 CO -0.07 0.26 0.01 -0.65 0.00 0.00 0.00 175.76 175.31 1qzq s GLN 201 N 0.24 2.19 -0.20 0.00 -1.52 0.22 -1.24 119.66 119.35 1qzq s GLN 201 Ca -0.11 -1.45 -0.17 0.00 -1.95 0.00 0.00 55.36 51.69 1qzq s GLN 201 Cb -0.15 -3.17 -0.04 0.00 -0.22 0.00 0.00 33.01 29.44 1qzq s GLN 201 CO 0.05 -0.72 0.46 -0.06 -0.25 0.00 0.00 175.29 174.77 1qzq s PHE 202 N 1.15 3.37 0.34 0.91 0.40 0.90 -0.97 117.98 124.09 1qzq s PHE 202 Ca -0.02 0.68 -0.15 0.00 -0.60 0.00 0.00 56.93 56.84 1qzq s PHE 202 Cb -0.20 -2.60 0.06 0.00 0.51 0.00 0.00 43.02 40.79 1qzq s PHE 202 CO -0.03 -0.07 0.81 -1.71 0.70 0.00 0.00 175.22 174.92 1qzq n ASN 203 N 4.67 -2.12 -0.10 1.36 2.85 -0.85 -1.65 115.26 119.42 1qzq n ASN 203 Ca -0.07 -2.41 -0.21 0.00 -0.11 0.00 0.00 54.58 51.78 1qzq n ASN 203 Cb 0.51 3.52 -0.07 0.00 1.24 0.00 0.00 39.78 44.98 1qzq n ASN 203 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1qzq n TYR 204 N -0.55 0.00 -5.09 1.20 9.36 -1.24 -4.45 117.16 116.39 1qzq n TYR 204 Ca -0.07 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.83 1qzq n TYR 204 Cb 0.57 -0.72 -0.15 0.00 -0.63 0.00 0.00 39.34 38.41 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 -0.45 1.07 -0.39 0.00 0.40 -1.26 -1.06 117.98 116.28 1qzq s PHE 206 Ca 0.05 -0.24 0.02 0.00 -0.60 0.00 0.00 56.93 56.16 1qzq s PHE 206 Cb -0.12 -0.67 0.12 0.00 0.51 0.00 0.00 43.02 42.86 1qzq s PHE 206 CO 0.01 -0.01 0.15 0.34 0.70 0.00 0.00 175.22 176.42 1qzq s ASP 207 N -0.51 4.10 0.17 1.36 -1.08 -0.41 -4.97 116.67 115.32 1qzq s ASP 207 Ca 0.03 -2.26 -0.15 0.00 -0.52 0.00 0.00 52.55 49.66 1qzq s ASP 207 Cb -0.05 -1.19 0.07 0.00 -1.46 0.00 0.00 42.92 40.29 1qzq s ASP 207 CO -0.00 -0.33 1.81 0.58 0.52 0.00 0.00 175.17 177.74 1qzq h VAL 208 N 5.98 1.05 -0.47 1.11 2.07 -1.89 0.58 116.25 124.68 1qzq h VAL 208 Ca -0.07 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.28 1qzq h VAL 208 Cb 0.97 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1qzq h VAL 208 CO 0.51 0.10 0.30 0.44 0.02 0.00 0.00 177.57 178.94 1qzq h ASP 209 N 0.55 0.50 0.17 0.57 3.45 -1.96 0.32 116.42 120.02 1qzq h ASP 209 Ca 0.18 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.63 1qzq h ASP 209 Cb 0.01 -0.11 0.00 0.00 -0.56 0.00 0.00 39.33 38.67 1qzq h ASP 209 CO -0.08 0.36 -0.08 -0.25 -1.57 0.00 0.00 179.24 177.61 1qzq h TRP 210 N 0.60 -0.21 -0.57 4.55 7.01 -1.89 -2.91 115.95 122.53 1qzq h TRP 210 Ca 0.18 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.24 1qzq h TRP 210 Cb -0.03 0.07 -0.06 0.00 -2.10 0.00 0.00 29.16 27.04 1qzq h TRP 210 CO -0.05 -0.06 0.26 1.25 -2.79 0.00 0.00 178.44 177.05 1qzq h LEU 211 N -0.32 0.34 -1.36 0.65 5.85 -0.32 -1.36 115.31 118.78 1qzq h LEU 211 Ca -0.02 0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.78 1qzq h LEU 211 Cb 0.25 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1qzq h LEU 211 CO 0.04 0.23 0.45 0.58 -0.34 0.00 0.00 178.44 179.40 1qzq h VAL 212 N 0.49 1.10 0.00 1.05 2.07 -0.96 -0.89 116.25 119.12 1qzq h VAL 212 Ca 0.26 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1qzq h VAL 212 Cb 0.23 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1qzq h VAL 212 CO -0.21 0.15 0.00 0.29 0.02 0.00 0.00 177.57 177.82 1qzq n LYS 213 N -4.46 0.19 0.18 1.57 5.02 -0.53 -2.57 118.16 117.55 1qzq n LYS 213 Ca 0.09 0.41 0.12 0.00 -2.02 0.00 0.00 58.31 56.91 1qzq n LYS 213 Cb 0.12 -1.86 0.21 0.00 -0.02 0.00 0.00 35.03 33.49 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 -7.17 1.97 1.08 -0.92 -3.45 115.11 106.62 1qzq h GLN 214 Ca 0.00 0.00 -0.47 0.00 -1.45 0.00 0.00 58.65 56.73 1qzq h GLN 214 Cb 0.37 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.81 1qzq h GLN 214 CO 0.00 0.00 0.37 0.71 -0.95 0.00 0.00 178.83 178.96 1qzq s TYR 215 N -3.19 3.42 0.42 2.96 1.51 -1.06 -4.32 117.35 117.09 1qzq s TYR 215 Ca 0.07 1.49 -0.25 0.00 -1.01 0.00 0.00 57.07 57.38 1qzq s TYR 215 Cb 0.07 -2.80 -0.08 0.00 -0.11 0.00 0.00 41.96 39.04 1qzq s TYR 215 CO 0.66 -0.32 1.19 -2.14 -1.11 0.00 0.00 175.55 173.83 1qzq s PRO 216 N -3.90 3.94 0.27 -1.71 0.02 -1.26 -4.78 135.00 127.59 1qzq s PRO 216 Ca 0.59 1.87 -0.08 0.00 0.02 0.00 0.00 61.00 63.40 1qzq s PRO 216 Cb -0.10 -2.60 0.45 0.00 0.02 0.00 0.00 34.50 32.27 1qzq s PRO 216 CO 0.28 -0.42 1.53 -2.30 -0.33 0.00 0.00 177.00 175.76 1qzq n PRO 217 N -0.10 -0.09 0.09 5.54 -0.02 -1.26 0.10 135.00 139.27 1qzq n PRO 217 Ca 0.05 1.53 0.10 0.00 -2.02 0.00 0.00 63.50 63.16 1qzq n PRO 217 Cb 0.47 -2.28 0.42 0.00 -0.02 0.00 0.00 33.50 32.08 1qzq n PRO 217 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1qzq n GLU 218 N -5.60 0.12 -0.03 -0.52 0.00 -1.26 -2.51 120.64 110.84 1qzq n GLU 218 Ca 0.16 0.41 0.06 0.00 0.00 0.00 0.00 57.16 57.78 1qzq n GLU 218 Cb 0.49 -1.76 0.07 0.00 0.00 0.00 0.00 31.44 30.24 1qzq n GLU 218 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1qzq n PHE 219 N -1.99 0.08 0.38 -1.84 3.72 0.29 -4.69 117.46 113.40 1qzq n PHE 219 Ca 0.02 -0.08 0.06 0.00 -0.05 0.00 0.00 57.45 57.39 1qzq n PHE 219 Cb 0.17 -0.00 0.25 0.00 -0.94 0.00 0.00 39.48 38.97 1qzq n PHE 219 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1qzq n ARG 220 N 0.66 0.01 -0.06 -1.08 1.74 -0.83 -2.70 116.66 114.41 1qzq n ARG 220 Ca 0.08 0.32 0.06 0.00 -0.77 0.00 0.00 57.85 57.54 1qzq n ARG 220 Cb 0.32 -1.53 0.09 0.00 -1.02 0.00 0.00 32.46 30.33 1qzq n ARG 220 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1qzq n LYS 221 N -1.55 1.37 -2.36 5.56 5.02 -1.26 -4.97 118.16 119.97 1qzq n LYS 221 Ca 0.03 -1.51 -0.35 0.00 -2.02 0.00 0.00 58.31 54.46 1qzq n LYS 221 Cb 0.13 -1.26 -0.01 0.00 -0.02 0.00 0.00 35.03 33.87 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 -1.04 3.51 0.43 1.97 -0.14 -1.10 -4.75 119.74 118.63 1qzq s LYS 222 Ca 0.18 1.52 -0.25 0.00 -1.36 0.00 0.00 55.97 56.06 1qzq s LYS 222 Cb 0.12 -2.04 -0.10 0.00 -1.68 0.00 0.00 37.83 34.13 1qzq s LYS 222 CO 0.16 -0.70 1.16 -2.30 -0.76 0.00 0.00 175.35 172.91 1qzq n PRO 223 N -1.20 1.65 -3.78 -1.68 -0.02 -1.26 -4.86 135.00 123.86 1qzq n PRO 223 Ca 0.11 0.59 -0.15 0.00 -2.02 0.00 0.00 63.50 62.03 1qzq n PRO 223 Cb 0.52 -2.24 -0.16 0.00 -0.02 0.00 0.00 33.50 31.59 1qzq n PRO 223 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1qzq s ILE 224 N -1.24 -0.06 -0.18 4.25 1.01 -0.50 -2.11 121.20 122.37 1qzq s ILE 224 Ca 0.63 0.20 -0.02 0.00 0.00 0.00 0.00 60.65 61.46 1qzq s ILE 224 Cb -0.52 -0.08 -0.01 0.00 0.01 0.00 0.00 42.46 41.86 1qzq s ILE 224 CO 0.57 0.08 -0.08 -0.22 0.00 0.00 0.00 174.94 175.29 1qzq s LEU 225 N 1.00 2.83 -0.29 2.97 2.96 -0.46 -0.72 118.68 126.97 1qzq s LEU 225 Ca -0.08 -0.35 -0.12 0.00 -0.22 0.00 0.00 54.13 53.36 1qzq s LEU 225 Cb -0.12 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.85 1qzq s LEU 225 CO -0.03 0.08 0.24 -0.76 -1.32 0.00 0.00 176.35 174.56 1qzq s LEU 226 N 0.89 4.12 -0.28 -0.68 1.43 -0.33 0.73 118.68 124.56 1qzq s LEU 226 Ca -0.02 -0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 52.97 1qzq s LEU 226 Cb -0.15 -2.20 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 1qzq s LEU 226 CO 0.00 -0.12 0.12 -0.69 0.23 0.00 0.00 176.35 175.89 1qzq s VAL 227 N 1.83 4.47 0.32 -1.59 1.01 -0.14 -0.02 120.40 126.29 1qzq s VAL 227 Ca 0.09 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 61.81 1qzq s VAL 227 Cb -0.16 -3.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.98 1qzq s VAL 227 CO 0.11 0.18 0.25 -1.38 0.00 0.00 0.00 175.10 174.26 1qzq s HIS 228 N 1.61 1.70 -0.03 5.22 -0.00 -0.35 -2.01 115.29 121.43 1qzq s HIS 228 Ca 0.05 -1.61 0.04 0.00 -0.00 0.00 0.00 55.06 53.55 1qzq s HIS 228 Cb -0.16 -0.73 0.06 0.00 -0.00 0.00 0.00 32.58 31.75 1qzq s HIS 228 CO 0.05 -0.80 0.97 0.41 -0.00 0.00 0.00 174.74 175.37 1qzq n GLY 229 N -0.60 2.54 3.77 -1.38 0.00 -1.26 0.14 105.19 108.39 1qzq n GLY 229 Ca 0.06 -0.24 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.28 6.11 0.28 1.61 1.01 -1.26 -4.82 116.67 118.31 1qzq s ASP 230 Ca 0.07 2.64 0.08 0.00 0.71 0.00 0.00 52.55 56.05 1qzq s ASP 230 Cb 0.06 -2.63 -0.06 0.00 1.01 0.00 0.00 42.92 41.30 1qzq s ASP 230 CO 0.01 -0.99 -0.10 -0.54 0.21 0.00 0.00 175.17 173.76 1qzq s LYS 231 N -2.42 1.57 2.96 8.23 1.02 -1.26 -4.44 119.74 125.40 1qzq s LYS 231 Ca 0.60 -1.77 0.00 0.00 0.02 0.00 0.00 55.97 54.82 1qzq s LYS 231 Cb -0.37 -1.31 0.00 0.00 -0.52 0.00 0.00 37.83 35.62 1qzq s LYS 231 CO 0.47 0.12 0.00 0.54 -0.92 0.00 0.00 175.35 175.56 1qzq n ARG 232 N -0.58 0.00 -0.07 1.68 1.74 -1.26 -2.09 116.66 116.08 1qzq n ARG 232 Ca -0.06 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.92 1qzq n ARG 232 Cb 0.62 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 32.03 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 0.34 -0.80 5.56 3.07 -1.99 -1.33 114.58 119.44 1qzq h GLU 233 Ca 0.00 -0.04 0.10 0.00 -0.50 0.00 0.00 59.36 58.92 1qzq h GLU 233 Cb 0.00 -0.07 -0.08 0.00 -0.84 0.00 0.00 28.75 27.77 1qzq h GLU 233 CO 0.00 0.30 0.43 0.00 -1.40 0.00 0.00 179.01 178.34 1qzq h ALA 234 N 1.02 1.13 -0.69 3.43 0.00 -1.83 0.10 119.26 122.43 1qzq h ALA 234 Ca 0.09 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1qzq h ALA 234 Cb 0.05 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1qzq h ALA 234 CO -0.01 0.03 0.37 -0.22 0.00 0.00 0.00 179.25 179.42 1qzq h LYS 235 N 0.71 0.96 -0.74 0.00 3.64 -0.96 -1.89 116.57 118.29 1qzq h LYS 235 Ca 0.39 -0.11 -0.06 0.00 -1.27 0.00 0.00 60.65 59.60 1qzq h LYS 235 Cb 0.41 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1qzq h LYS 235 CO -0.27 0.72 0.24 0.00 -2.27 0.00 0.00 179.45 177.87 1qzq h ALA 236 N 1.19 0.96 -0.52 5.00 0.00 0.01 -1.07 119.26 124.83 1qzq h ALA 236 Ca 0.24 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1qzq h ALA 236 Cb 0.04 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1qzq h ALA 236 CO -0.04 0.64 0.34 1.25 0.00 0.00 0.00 179.25 181.44 1qzq h HIS 237 N 1.09 0.66 -0.29 0.00 -0.00 -0.53 -0.41 115.15 115.67 1qzq h HIS 237 Ca 0.24 0.01 -0.02 0.00 -0.00 0.00 0.00 60.37 60.60 1qzq h HIS 237 Cb 0.30 -0.22 -0.01 0.00 -0.00 0.00 0.00 27.41 27.48 1qzq h HIS 237 CO 0.02 0.43 0.11 1.25 -0.00 0.00 0.00 177.93 179.74 1qzq h LEU 238 N 0.70 0.41 -1.16 0.26 5.85 -1.00 -1.00 115.31 119.36 1qzq h LEU 238 Ca 0.19 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.80 1qzq h LEU 238 Cb -0.06 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.80 1qzq h LEU 238 CO -0.04 0.47 0.58 0.45 -0.34 0.00 0.00 178.44 179.57 1qzq h HIS 239 N 0.31 1.03 -0.53 1.25 3.86 -0.77 -1.37 115.15 118.93 1qzq h HIS 239 Ca 0.10 0.03 -0.09 0.00 -1.16 0.00 0.00 60.37 59.24 1qzq h HIS 239 Cb 0.20 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.31 1qzq h HIS 239 CO -0.00 0.53 -0.03 0.00 0.86 0.00 0.00 177.93 179.29 1qzq h ALA 240 N 1.52 0.95 -0.81 2.45 0.00 -0.59 -0.19 119.26 122.59 1qzq h ALA 240 Ca 0.39 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1qzq h ALA 240 Cb 0.24 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1qzq h ALA 240 CO -0.15 0.63 0.46 1.96 0.00 0.00 0.00 179.25 182.15 1qzq h GLN 241 N 0.85 1.12 0.00 0.00 4.20 -0.11 -3.10 115.11 118.08 1qzq h GLN 241 Ca 0.15 -0.12 -0.15 0.00 0.06 0.00 0.00 58.65 58.59 1qzq h GLN 241 Cb 0.54 -0.23 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1qzq h GLN 241 CO 0.03 0.82 -0.93 0.00 -0.67 0.00 0.00 178.83 178.07 1qzq h ALA 242 N 1.24 0.63 -0.81 3.87 0.00 -1.22 -3.39 119.26 119.59 1qzq h ALA 242 Ca 0.29 -0.68 0.20 0.00 0.00 0.00 0.00 54.91 54.71 1qzq h ALA 242 Cb 0.01 0.06 -0.15 0.00 0.00 0.00 0.00 17.79 17.71 1qzq h ALA 242 CO -0.05 0.84 -0.06 1.17 0.00 0.00 0.00 179.25 181.14 1qzq n LYS 243 N -3.11 -0.07 0.32 0.00 3.00 -0.10 0.17 118.16 118.37 1qzq n LYS 243 Ca -0.03 1.23 0.20 0.00 -0.00 0.00 0.00 58.31 59.71 1qzq n LYS 243 Cb 0.81 -1.91 1.09 0.00 0.00 0.00 0.00 35.03 35.02 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 0.00 -4.52 1.64 0.11 -1.76 -3.40 132.00 124.07 1qzq h PRO 244 Ca 0.45 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.85 1qzq h PRO 244 Cb 0.85 0.00 -0.25 0.00 0.11 0.00 0.00 31.00 31.72 1qzq h PRO 244 CO -0.79 0.01 -0.47 0.71 -0.21 0.00 0.00 178.00 177.25 1qzq s TYR 245 N -4.22 3.26 0.44 0.65 2.02 0.13 -4.97 117.35 114.66 1qzq s TYR 245 Ca -0.04 -1.04 0.11 0.00 -0.37 0.00 0.00 57.07 55.72 1qzq s TYR 245 Cb 0.13 -2.64 0.97 0.00 -0.40 0.00 0.00 41.96 40.02 1qzq s TYR 245 CO 0.46 -0.70 2.05 0.93 -1.57 0.00 0.00 175.55 176.71 1qzq h GLU 246 N 8.49 0.28 -0.01 -0.62 5.08 -1.82 -2.79 114.58 123.19 1qzq h GLU 246 Ca -0.25 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1qzq h GLU 246 Cb 1.10 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1qzq h GLU 246 CO 0.72 0.25 0.00 0.27 -1.00 0.00 0.00 179.01 179.25 1qzq n ASN 247 N -4.44 0.14 -4.64 1.42 6.94 -1.26 -4.82 115.26 108.60 1qzq n ASN 247 Ca 0.00 -1.32 -0.35 0.00 -0.02 0.00 0.00 54.58 52.89 1qzq n ASN 247 Cb 0.13 -0.01 -0.10 0.00 -2.36 0.00 0.00 39.78 37.45 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 -1.99 4.95 0.25 1.53 1.01 -1.05 -1.41 121.20 124.49 1qzq s ILE 248 Ca 0.34 0.03 0.10 0.00 0.00 0.00 0.00 60.65 61.12 1qzq s ILE 248 Cb 0.16 -3.26 -0.04 0.00 0.01 0.00 0.00 42.46 39.32 1qzq s ILE 248 CO 0.27 0.42 -0.08 -0.44 0.00 0.00 0.00 174.94 175.11 1qzq s SER 249 N 0.62 4.21 0.04 3.58 0.01 0.10 -4.98 113.70 117.28 1qzq s SER 249 Ca 0.05 -0.74 0.07 0.00 1.31 0.00 0.00 55.95 56.64 1qzq s SER 249 Cb -0.13 -0.66 -0.02 0.00 0.21 0.00 0.00 66.02 65.42 1qzq s SER 249 CO 0.01 0.03 -0.21 -0.76 0.41 0.00 0.00 173.24 172.72 1qzq s LEU 250 N -3.46 2.16 -0.16 2.44 1.02 -1.26 -1.19 118.68 118.23 1qzq s LEU 250 Ca 0.30 -0.52 -0.00 0.00 0.02 0.00 0.00 54.13 53.92 1qzq s LEU 250 Cb -0.06 -1.00 0.04 0.00 0.02 0.00 0.00 46.19 45.18 1qzq s LEU 250 CO 0.17 0.17 -0.07 0.00 0.02 0.00 0.00 176.35 176.65 1qzq s GLN 252 N 1.60 3.28 0.17 0.00 0.74 -1.26 -1.21 119.66 122.98 1qzq s GLN 252 Ca 0.01 -0.41 -0.31 0.00 0.05 0.00 0.00 55.36 54.70 1qzq s GLN 252 Cb -0.15 -4.02 -0.10 0.00 1.10 0.00 0.00 33.01 29.84 1qzq s GLN 252 CO -0.08 -1.25 1.51 0.00 -0.55 0.00 0.00 175.29 174.91 1qzq s ALA 253 N 3.26 3.71 0.23 1.58 0.00 0.37 -4.95 121.76 125.97 1qzq s ALA 253 Ca 0.25 1.31 -0.30 0.00 0.00 0.00 0.00 51.96 53.22 1qzq s ALA 253 Cb -0.14 -3.59 -0.09 0.00 0.00 0.00 0.00 23.12 19.29 1qzq s ALA 253 CO 0.18 -0.74 1.28 -1.59 0.00 0.00 0.00 175.76 174.90 1qzq s LYS 254 N 0.87 4.41 -0.56 0.00 -2.85 -1.26 -4.64 119.74 115.71 1qzq s LYS 254 Ca 0.67 2.05 0.05 0.00 -1.00 0.00 0.00 55.97 57.74 1qzq s LYS 254 Cb -0.42 -3.17 0.18 0.00 -2.06 0.00 0.00 37.83 32.36 1qzq s LYS 254 CO 0.33 -0.18 0.45 1.28 0.10 0.00 0.00 175.35 177.33 1qzq n LEU 255 N 2.12 1.44 0.00 2.77 4.77 -1.26 -4.94 117.00 121.89 1qzq n LEU 255 Ca 0.04 -4.85 0.15 0.00 -0.03 0.00 0.00 56.01 51.33 1qzq n LEU 255 Cb 0.43 -0.12 0.85 0.00 -2.33 0.00 0.00 43.42 42.25 1qzq n LEU 255 CO 0.58 1.84 1.06 0.47 -1.33 0.00 0.00 177.39 180.00 1qzq n ASP 256 N 2.21 0.00 -4.51 -1.43 10.43 -1.26 -4.73 116.55 117.26 1qzq n ASP 256 Ca 0.25 -0.63 -0.34 0.00 2.57 0.00 0.00 54.79 56.64 1qzq n ASP 256 Cb 0.42 -0.12 -0.12 0.00 1.84 0.00 0.00 41.12 43.14 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 -2.23 3.55 0.37 0.53 1.01 -1.26 -5.08 121.20 118.09 1qzq s ILE 257 Ca 0.39 -0.52 -0.27 0.00 0.00 0.00 0.00 60.65 60.25 1qzq s ILE 257 Cb 0.21 -2.47 -0.11 0.00 0.01 0.00 0.00 42.46 40.09 1qzq s ILE 257 CO 0.40 0.56 1.35 0.00 0.00 0.00 0.00 174.94 177.25 1qzq n ALA 258 N 2.74 1.64 -2.01 9.38 0.00 -1.26 -3.06 120.51 127.95 1qzq n ALA 258 Ca -0.18 0.33 -0.15 0.00 0.00 0.00 0.00 53.44 53.44 1qzq n ALA 258 Cb 0.53 -2.31 -0.03 0.00 0.00 0.00 0.00 19.45 17.64 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 0.22 -0.48 -3.27 0.00 3.72 -1.26 -4.97 117.46 111.43 1qzq n PHE 259 Ca 0.04 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.23 1qzq n PHE 259 Cb 0.38 -2.96 0.00 0.00 -0.94 0.00 0.00 39.48 35.96 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 -2.49 1.56 0.05 1.37 0.00 -1.17 -4.87 107.32 101.77 1qzq s GLY 260 Ca 0.00 -1.26 -0.06 0.00 0.00 0.00 0.00 44.72 43.40 1qzq s GLY 260 CO 0.00 -1.14 0.10 -0.51 0.00 0.00 0.00 173.10 171.55 1qzq s THR 261 N -2.34 0.15 -0.84 0.90 -4.23 -1.26 -4.94 115.64 103.08 1qzq s THR 261 Ca 0.46 -1.25 -0.16 0.00 -1.18 0.00 0.00 61.69 59.56 1qzq s THR 261 Cb -0.10 -1.14 0.18 0.00 1.34 0.00 0.00 72.50 72.78 1qzq s THR 261 CO 0.34 -0.69 0.89 -2.28 -0.54 0.00 0.00 174.62 172.34 1qzq s HIS 262 N -3.22 3.48 -0.68 3.99 2.46 -1.26 -0.61 115.29 119.45 1qzq s HIS 262 Ca 0.00 -1.70 0.23 0.00 0.47 0.00 0.00 55.06 54.06 1qzq s HIS 262 Cb 0.02 -4.00 0.05 0.00 -0.13 0.00 0.00 32.58 28.52 1qzq s HIS 262 CO -0.07 -1.19 1.03 1.58 -2.47 0.00 0.00 174.74 173.62 1qzq n HIS 263 N 5.05 0.19 -1.64 3.88 -0.00 -0.32 -3.72 115.22 118.67 1qzq n HIS 263 Ca 0.16 0.06 -0.45 0.00 0.46 0.00 0.00 57.72 57.94 1qzq n HIS 263 Cb 0.47 -0.36 -0.03 0.00 -0.12 0.00 0.00 29.99 29.96 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 -1.86 1.27 -3.91 3.57 -1.04 -0.88 -4.63 114.28 106.79 1qzq n THR 264 Ca 0.02 -0.32 -0.30 0.00 -2.04 0.00 0.00 64.05 61.41 1qzq n THR 264 Cb 0.42 -1.25 -0.15 0.00 -1.82 0.00 0.00 70.33 67.52 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 -0.81 1.42 -0.03 -2.82 1.02 -1.26 -2.95 119.74 114.31 1qzq s LYS 265 Ca 0.66 -1.12 -0.15 0.00 0.02 0.00 0.00 55.97 55.37 1qzq s LYS 265 Cb -0.70 -2.57 0.03 0.00 -0.52 0.00 0.00 37.83 34.07 1qzq s LYS 265 CO 0.54 -0.72 0.33 1.41 -0.92 0.00 0.00 175.35 176.00 1qzq s MET 266 N 1.37 0.66 -0.08 1.68 1.75 -0.66 -1.47 119.30 122.55 1qzq s MET 266 Ca -0.00 -0.09 0.03 0.00 -1.25 0.00 0.00 55.69 54.38 1qzq s MET 266 Cb -0.19 0.30 0.01 0.00 2.84 0.00 0.00 34.83 37.79 1qzq s MET 266 CO -0.10 -0.17 -0.18 -1.64 -0.65 0.00 0.00 175.02 172.28 1qzq s MET 267 N -1.14 2.33 -0.23 4.11 -1.94 0.15 -0.07 119.30 122.52 1qzq s MET 267 Ca -0.12 -0.64 -0.06 0.00 -1.71 0.00 0.00 55.69 53.16 1qzq s MET 267 Cb -0.05 -1.83 -0.03 0.00 2.01 0.00 0.00 34.83 34.94 1qzq s MET 267 CO 0.04 0.11 0.04 -0.51 -0.01 0.00 0.00 175.02 174.69 1qzq s LEU 268 N 0.48 3.37 -0.23 -0.03 1.43 -0.38 -0.21 118.68 123.12 1qzq s LEU 268 Ca -0.16 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 52.76 1qzq s LEU 268 Cb -0.17 -1.89 0.05 0.00 0.03 0.00 0.00 46.19 44.21 1qzq s LEU 268 CO 0.06 0.01 -0.13 -0.76 0.23 0.00 0.00 176.35 175.76 1qzq s LEU 269 N 1.36 2.89 -0.25 1.79 1.43 -0.10 -0.96 118.68 124.84 1qzq s LEU 269 Ca 0.05 -1.12 -0.12 0.00 -1.03 0.00 0.00 54.13 51.92 1qzq s LEU 269 Cb -0.15 -1.47 -0.05 0.00 0.03 0.00 0.00 46.19 44.55 1qzq s LEU 269 CO 0.02 -0.13 0.21 -0.22 0.23 0.00 0.00 176.35 176.46 1qzq s LEU 270 N 1.20 4.09 0.00 1.79 2.96 -0.02 -1.12 118.68 127.59 1qzq s LEU 270 Ca -0.04 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 54.02 1qzq s LEU 270 Cb -0.18 -2.18 0.01 0.00 0.50 0.00 0.00 46.19 44.34 1qzq s LEU 270 CO -0.08 -0.00 0.09 -1.22 -1.32 0.00 0.00 176.35 173.82 1qzq n TYR 271 N 4.59 0.63 0.07 5.38 4.01 0.59 0.27 117.16 132.70 1qzq n TYR 271 Ca -0.13 -2.17 -0.14 0.00 -0.16 0.00 0.00 57.90 55.29 1qzq n TYR 271 Cb 0.52 -0.32 -0.07 0.00 -0.31 0.00 0.00 39.34 39.16 1qzq n TYR 271 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1qzq h GLU 272 N 0.00 0.40 0.00 -0.72 5.08 -1.73 -3.25 114.58 114.37 1qzq h GLU 272 Ca -0.36 -0.47 0.00 0.00 -1.00 0.00 0.00 59.36 57.53 1qzq h GLU 272 Cb 1.12 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1qzq h GLU 272 CO 0.58 1.14 -0.04 0.39 -1.00 0.00 0.00 179.01 180.09 1qzq n GLU 273 N -3.72 0.05 -0.19 2.33 4.71 -1.26 -5.02 120.64 117.55 1qzq n GLU 273 Ca -0.07 0.04 0.00 0.00 -0.01 0.00 0.00 57.16 57.11 1qzq n GLU 273 Cb 0.87 -1.56 0.00 0.00 -1.01 0.00 0.00 31.44 29.75 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 1.46 -0.20 3.04 0.62 0.00 -1.23 -4.59 105.19 104.30 1qzq n GLY 274 Ca 0.07 -0.99 -0.19 0.00 0.00 0.00 0.00 46.02 44.90 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 2.02 0.00 0.99 2.96 0.53 -0.30 118.68 124.89 1qzq s LEU 275 Ca 0.00 -0.19 0.05 0.00 -0.22 0.00 0.00 54.13 53.77 1qzq s LEU 275 Cb 0.00 -0.52 -0.01 0.00 0.50 0.00 0.00 46.19 46.16 1qzq s LEU 275 CO 0.00 0.12 -0.15 -0.60 -1.32 0.00 0.00 176.35 174.40 1qzq s ARG 276 N -0.26 1.15 -0.10 1.98 3.52 -0.27 0.05 118.95 125.02 1qzq s ARG 276 Ca 0.04 -0.60 0.02 0.00 -0.13 0.00 0.00 55.73 55.05 1qzq s ARG 276 Cb -0.04 -1.13 -0.02 0.00 -1.56 0.00 0.00 34.95 32.20 1qzq s ARG 276 CO -0.00 0.30 -0.15 0.08 -0.81 0.00 0.00 175.30 174.72 1qzq s VAL 277 N -0.48 2.88 -0.17 7.11 1.01 -1.26 -0.93 120.40 128.55 1qzq s VAL 277 Ca 0.05 -0.74 0.00 0.00 0.00 0.00 0.00 61.98 61.29 1qzq s VAL 277 Cb -0.06 -2.17 0.04 0.00 0.00 0.00 0.00 36.38 34.18 1qzq s VAL 277 CO -0.00 0.55 -0.10 -0.69 0.00 0.00 0.00 175.10 174.86 1qzq s VAL 278 N 0.06 1.49 -0.21 2.92 1.01 0.71 -1.43 120.40 124.95 1qzq s VAL 278 Ca -0.06 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.09 1qzq s VAL 278 Cb -0.15 -1.53 -0.00 0.00 0.00 0.00 0.00 36.38 34.69 1qzq s VAL 278 CO 0.05 0.25 -0.07 -0.63 0.00 0.00 0.00 175.10 174.69 1qzq s ILE 279 N 1.48 3.15 0.00 2.22 1.01 -0.99 0.33 121.20 128.41 1qzq s ILE 279 Ca 0.01 -0.57 0.00 0.00 0.00 0.00 0.00 60.65 60.09 1qzq s ILE 279 Cb -0.15 -2.41 0.00 0.00 0.01 0.00 0.00 42.46 39.91 1qzq s ILE 279 CO -0.09 0.45 0.00 0.00 0.00 0.00 0.00 174.94 175.30 1qzq n HIS 280 N 4.65 -0.03 0.00 3.97 1.44 -0.54 -0.71 115.22 124.00 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 0.00 -3.23 0.61 -2.24 -0.90 -4.30 114.28 104.23 1qzq n THR 281 Ca 0.00 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 60.91 1qzq n THR 281 Cb 0.00 1.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.17 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 -0.52 7.02 0.59 3.42 0.01 -1.26 -4.82 113.70 118.13 1qzq s SER 282 Ca 0.00 1.28 -0.15 0.00 1.31 0.00 0.00 55.95 58.39 1qzq s SER 282 Cb 0.00 -2.37 -0.04 0.00 0.21 0.00 0.00 66.02 63.82 1qzq s SER 282 CO 0.00 0.15 1.04 0.20 0.41 0.00 0.00 173.24 175.05 1qzq s ASN 283 N -1.44 5.94 -1.38 2.44 0.01 -1.26 -4.93 114.94 114.32 1qzq s ASN 283 Ca 0.36 1.73 -0.10 0.00 -0.71 0.00 0.00 52.86 54.14 1qzq s ASN 283 Cb -0.18 -2.52 0.09 0.00 0.41 0.00 0.00 41.25 39.05 1qzq s ASN 283 CO 0.20 -1.06 2.23 0.18 -1.51 0.00 0.00 177.10 177.15 1qzq n LEU 284 N -2.07 7.35 -3.95 0.60 4.77 -0.23 -4.72 117.00 118.75 1qzq n LEU 284 Ca 0.08 -4.55 -0.10 0.00 -0.03 0.00 0.00 56.01 51.41 1qzq n LEU 284 Cb 0.53 -1.50 -0.11 0.00 -2.33 0.00 0.00 43.42 40.01 1qzq n LEU 284 CO 0.48 1.59 -0.31 0.27 -1.33 0.00 0.00 177.39 178.09 1qzq s ILE 285 N 0.89 0.10 0.24 -0.08 -4.36 -1.26 -1.29 121.20 115.44 1qzq s ILE 285 Ca 0.49 -0.85 -0.07 0.00 -0.26 0.00 0.00 60.65 59.97 1qzq s ILE 285 Cb 0.14 -0.31 0.23 0.00 1.25 0.00 0.00 42.46 43.77 1qzq s ILE 285 CO -0.05 -0.46 1.68 -0.74 0.24 0.00 0.00 174.94 175.60 1qzq h HIS 286 N 4.55 0.17 -0.12 1.37 -0.00 -1.94 -2.22 115.15 116.97 1qzq h HIS 286 Ca -0.32 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.08 1qzq h HIS 286 Cb 1.21 0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 28.64 1qzq h HIS 286 CO 0.64 -0.12 0.01 0.00 -0.00 0.00 0.00 177.93 178.46 1qzq h ALA 287 N 1.60 1.81 0.00 5.26 0.00 -1.98 -2.32 119.26 123.63 1qzq h ALA 287 Ca 0.39 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1qzq h ALA 287 Cb 0.66 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1qzq h ALA 287 CO -0.53 0.15 0.00 -0.25 0.00 0.00 0.00 179.25 178.63 1qzq n ASP 288 N -4.45 0.58 -0.20 0.00 10.43 -0.83 -2.55 116.55 119.52 1qzq n ASP 288 Ca -0.01 0.64 0.02 0.00 2.57 0.00 0.00 54.79 58.00 1qzq n ASP 288 Cb 0.14 -0.76 0.04 0.00 1.84 0.00 0.00 41.12 42.38 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 -2.14 0.13 -0.01 1.24 7.02 -0.90 -4.57 117.44 118.20 1qzq n TRP 289 Ca 0.03 -0.40 -0.01 0.00 -1.02 0.00 0.00 57.50 56.10 1qzq n TRP 289 Cb 0.24 -0.03 -0.00 0.00 -2.42 0.00 0.00 31.31 29.09 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 -0.08 0.11 -2.27 -5.99 -0.00 -1.03 -4.74 115.22 101.22 1qzq n HIS 290 Ca 0.04 0.05 -0.07 0.00 0.46 0.00 0.00 57.72 58.19 1qzq n HIS 290 Cb 0.27 -0.27 0.06 0.00 -0.12 0.00 0.00 29.99 29.93 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 -2.64 2.16 -4.32 1.57 6.02 -1.25 -1.48 117.38 117.43 1qzq n GLN 291 Ca -0.01 -3.50 -0.25 0.00 -0.01 0.00 0.00 57.00 53.22 1qzq n GLN 291 Cb 0.05 -1.63 -0.09 0.00 1.02 0.00 0.00 30.24 29.59 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 -3.08 2.06 -0.32 -1.09 1.02 -1.26 -3.80 119.74 113.26 1qzq s LYS 292 Ca 0.39 -1.40 -0.21 0.00 0.02 0.00 0.00 55.97 54.77 1qzq s LYS 292 Cb 0.37 -2.09 -0.00 0.00 -0.52 0.00 0.00 37.83 35.59 1qzq s LYS 292 CO -0.03 0.40 0.66 0.99 -0.92 0.00 0.00 175.35 176.44 1qzq s THR 293 N -2.01 4.90 0.12 2.17 2.01 0.42 -4.81 115.64 118.44 1qzq s THR 293 Ca 0.27 0.82 0.06 0.00 0.31 0.00 0.00 61.69 63.15 1qzq s THR 293 Cb -0.07 -4.05 -0.04 0.00 0.01 0.00 0.00 72.50 68.35 1qzq s THR 293 CO 0.16 -0.22 -0.14 -1.10 -0.69 0.00 0.00 174.62 172.63 1qzq s GLN 294 N 2.71 1.03 0.12 4.92 -1.52 -1.26 -0.99 119.66 124.67 1qzq s GLN 294 Ca 0.26 -1.25 0.07 0.00 -1.95 0.00 0.00 55.36 52.50 1qzq s GLN 294 Cb -0.15 -0.91 -0.04 0.00 -0.22 0.00 0.00 33.01 31.70 1qzq s GLN 294 CO 0.13 0.17 -0.10 0.20 -0.25 0.00 0.00 175.29 175.44 1qzq s GLY 295 N -2.48 1.78 -0.01 3.09 0.00 -1.26 -2.59 107.32 105.85 1qzq s GLY 295 Ca 0.09 -1.28 0.01 0.00 0.00 0.00 0.00 44.72 43.54 1qzq s GLY 295 CO 0.03 -1.27 -0.01 -0.42 0.00 0.00 0.00 173.10 171.43 1qzq s ILE 296 N -1.28 0.17 -0.16 0.90 1.01 0.29 -2.11 121.20 120.02 1qzq s ILE 296 Ca 0.22 -0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.85 1qzq s ILE 296 Cb -0.11 -0.19 0.01 0.00 0.01 0.00 0.00 42.46 42.18 1qzq s ILE 296 CO 0.14 0.08 -0.18 0.86 0.00 0.00 0.00 174.94 175.84 1qzq s TRP 297 N 0.32 2.75 -0.25 3.97 -0.00 0.11 -0.58 118.94 125.25 1qzq s TRP 297 Ca -0.03 -1.24 -0.08 0.00 -0.00 0.00 0.00 56.10 54.76 1qzq s TRP 297 Cb -0.05 -1.88 -0.03 0.00 -0.00 0.00 0.00 33.47 31.50 1qzq s TRP 297 CO -0.01 -0.58 0.09 -1.17 -0.00 0.00 0.00 176.95 175.29 1qzq s LEU 298 N 0.92 3.58 0.70 5.86 2.96 -0.68 -2.34 118.68 129.68 1qzq s LEU 298 Ca -0.04 -0.15 -0.11 0.00 -0.22 0.00 0.00 54.13 53.61 1qzq s LEU 298 Cb -0.15 -1.97 0.01 0.00 0.50 0.00 0.00 46.19 44.58 1qzq s LEU 298 CO -0.03 -0.02 1.06 -0.94 -1.32 0.00 0.00 176.35 175.10 1qzq s SER 299 N 1.56 5.44 1.02 3.68 1.04 -0.52 -4.81 113.70 121.11 1qzq s SER 299 Ca 0.06 1.46 -0.15 0.00 0.48 0.00 0.00 55.95 57.80 1qzq s SER 299 Cb -0.15 -2.35 0.20 0.00 0.10 0.00 0.00 66.02 63.82 1qzq s SER 299 CO 0.05 -1.38 1.15 -2.16 0.98 0.00 0.00 173.24 171.88 1qzq s PRO 300 N -5.13 0.24 -0.33 4.02 0.04 -1.26 -4.72 135.00 127.87 1qzq s PRO 300 Ca 0.58 0.10 -0.29 0.00 0.04 0.00 0.00 61.00 61.43 1qzq s PRO 300 Cb -0.13 -1.75 0.01 0.00 0.04 0.00 0.00 34.50 32.67 1qzq s PRO 300 CO 0.54 -2.77 1.16 -1.17 0.04 0.00 0.00 177.00 174.81 1qzq s LEU 301 N -6.35 3.89 -0.25 -3.56 2.96 -1.26 -4.60 118.68 109.51 1qzq s LEU 301 Ca 0.68 1.05 -0.20 0.00 -0.22 0.00 0.00 54.13 55.44 1qzq s LEU 301 Cb -0.12 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 1qzq s LEU 301 CO 0.55 -0.99 0.63 -0.31 -1.32 0.00 0.00 176.35 174.91 1qzq s TYR 302 N 3.98 3.29 0.59 5.38 2.02 0.11 -4.88 117.35 127.84 1qzq s TYR 302 Ca 0.49 0.83 -0.15 0.00 -0.37 0.00 0.00 57.07 57.87 1qzq s TYR 302 Cb -0.13 -2.83 -0.04 0.00 -0.40 0.00 0.00 41.96 38.56 1qzq s TYR 302 CO 0.20 -0.31 1.04 -1.25 -1.57 0.00 0.00 175.55 173.66 1qzq s PRO 303 N 2.43 3.41 0.32 -1.71 0.04 -1.25 -0.35 135.00 137.88 1qzq s PRO 303 Ca 0.26 1.11 -0.29 0.00 0.04 0.00 0.00 61.00 62.13 1qzq s PRO 303 Cb -0.16 -2.05 -0.10 0.00 0.04 0.00 0.00 34.50 32.24 1qzq s PRO 303 CO 0.09 -0.73 1.18 1.03 0.04 0.00 0.00 177.00 178.61 1qzq s ARG 304 N -4.23 4.45 0.19 4.56 1.81 -1.26 -0.62 118.95 123.86 1qzq s ARG 304 Ca 0.62 1.96 -0.27 0.00 -1.72 0.00 0.00 55.73 56.31 1qzq s ARG 304 Cb -0.14 -3.07 -0.08 0.00 -0.45 0.00 0.00 34.95 31.21 1qzq s ARG 304 CO 0.39 -0.01 0.83 0.42 -0.68 0.00 0.00 175.30 176.25 1qzq s ILE 305 N -1.20 4.27 0.01 1.52 1.01 -0.13 -4.79 121.20 121.90 1qzq s ILE 305 Ca 0.48 1.82 -0.31 0.00 0.00 0.00 0.00 60.65 62.65 1qzq s ILE 305 Cb -0.34 -4.19 -0.10 0.00 0.01 0.00 0.00 42.46 37.84 1qzq s ILE 305 CO 0.45 0.50 1.96 0.00 0.00 0.00 0.00 174.94 177.85 1qzq n ALA 306 N 1.52 1.46 -0.33 9.38 0.00 -1.26 -4.86 120.51 126.42 1qzq n ALA 306 Ca -0.04 0.23 0.04 0.00 0.00 0.00 0.00 53.44 53.66 1qzq n ALA 306 Cb 0.48 -2.65 0.11 0.00 0.00 0.00 0.00 19.45 17.39 1qzq n ALA 306 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1qzq n ASP 307 N 7.34 -0.39 0.29 0.00 9.92 -1.26 0.17 116.55 132.62 1qzq n ASP 307 Ca 0.21 1.57 0.18 0.00 -0.53 0.00 0.00 54.79 56.21 1qzq n ASP 307 Cb 0.39 -0.45 0.85 0.00 -0.64 0.00 0.00 41.12 41.26 1qzq n ASP 307 CO 0.00 0.00 0.00 1.23 0.13 0.00 0.00 177.20 178.56 1qzq h GLY 308 N 0.00 0.00 -1.67 0.44 0.00 -2.04 -3.44 103.07 96.35 1qzq h GLY 308 Ca 0.41 0.00 -0.49 0.00 0.00 0.00 0.00 47.33 47.25 1qzq h GLY 308 CO -0.93 0.00 0.38 -1.59 0.00 0.00 0.00 176.54 174.40 1qzq s THR 309 N -3.93 4.17 -0.40 4.70 2.01 0.44 -5.05 115.64 117.58 1qzq s THR 309 Ca -0.02 0.98 0.01 0.00 0.31 0.00 0.00 61.69 62.97 1qzq s THR 309 Cb 0.11 -3.55 0.13 0.00 0.01 0.00 0.00 72.50 69.20 1qzq s THR 309 CO 0.52 -0.66 0.21 -1.00 -0.69 0.00 0.00 174.62 173.00 1qzq s HIS 310 N -2.63 1.73 0.13 4.92 3.76 -1.26 -4.85 115.29 117.09 1qzq s HIS 310 Ca 0.61 -2.17 0.05 0.00 -0.15 0.00 0.00 55.06 53.40 1qzq s HIS 310 Cb -0.13 -1.70 -0.04 0.00 1.11 0.00 0.00 32.58 31.82 1qzq s HIS 310 CO 0.38 -0.81 -0.12 0.15 -0.85 0.00 0.00 174.74 173.49 1qzq s LYS 311 N 0.70 1.01 0.10 1.40 1.02 -1.26 -5.07 119.74 117.65 1qzq s LYS 311 Ca 0.16 -1.29 -0.12 0.00 0.02 0.00 0.00 55.97 54.75 1qzq s LYS 311 Cb -0.23 -0.77 -0.16 0.00 -0.52 0.00 0.00 37.83 36.14 1qzq s LYS 311 CO -0.04 0.13 1.27 0.66 -0.92 0.00 0.00 175.35 176.46 1qzq h SER 312 N 3.31 0.88 -0.36 2.83 4.64 -1.98 -3.47 113.55 119.39 1qzq h SER 312 Ca -0.38 -0.63 -0.14 0.00 -0.47 0.00 0.00 61.79 60.16 1qzq h SER 312 Cb 1.19 -0.26 -0.05 0.00 -0.31 0.00 0.00 62.40 62.97 1qzq h SER 312 CO 0.55 1.43 -0.13 0.61 -0.87 0.00 0.00 176.83 178.41 1qzq n GLY 313 N 0.85 0.88 3.90 -0.77 0.00 -1.26 -4.90 105.19 103.88 1qzq n GLY 313 Ca -0.08 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.66 3.68 0.33 1.61 2.56 -1.26 -1.28 118.70 121.68 1qzq s GLU 314 Ca 0.00 0.09 0.08 0.00 0.00 0.00 0.00 54.97 55.14 1qzq s GLU 314 Cb 0.00 -2.64 -0.04 0.00 2.00 0.00 0.00 34.13 33.45 1qzq s GLU 314 CO 0.00 0.24 0.20 -1.54 -0.56 0.00 0.00 175.26 173.60 1qzq s SER 315 N -2.93 4.97 0.63 -1.70 1.04 -1.26 -4.05 113.70 110.40 1qzq s SER 315 Ca 0.45 -0.63 0.36 0.00 0.48 0.00 0.00 55.95 56.61 1qzq s SER 315 Cb -0.11 -0.87 2.04 0.00 0.10 0.00 0.00 66.02 67.18 1qzq s SER 315 CO 0.28 -0.30 2.25 -0.65 0.98 0.00 0.00 173.24 175.80 1qzq h PRO 316 N 1.43 0.00 -0.05 4.02 0.11 -1.80 0.76 132.00 136.46 1qzq h PRO 316 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1qzq h PRO 316 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1qzq h PRO 316 CO 0.61 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.65 1qzq n THR 317 N -3.43 0.05 -2.41 -1.15 -2.24 -1.26 -4.94 114.28 98.91 1qzq n THR 317 Ca -0.02 -0.29 -0.19 0.00 -2.27 0.00 0.00 64.05 61.28 1qzq n THR 317 Cb 0.14 0.52 -0.01 0.00 -2.10 0.00 0.00 70.33 68.89 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 0.28 -1.10 -0.16 4.78 8.25 0.26 -4.74 115.22 122.79 1qzq n HIS 318 Ca 0.18 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.67 1qzq n HIS 318 Cb 0.36 -3.69 0.31 0.00 1.12 0.00 0.00 29.99 28.09 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 0.81 0.21 4.41 3.57 -1.84 -0.79 116.94 123.32 1qzq h PHE 319 Ca -0.45 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.06 1qzq h PHE 319 Cb 1.33 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 39.80 1qzq h PHE 319 CO 0.59 0.49 -0.10 -0.22 -2.23 0.00 0.00 178.31 176.84 1qzq h LYS 320 N 0.85 -0.28 -0.70 1.11 3.64 -1.88 0.15 116.57 119.46 1qzq h LYS 320 Ca 0.26 0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1qzq h LYS 320 Cb -0.00 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1qzq h LYS 320 CO -0.07 0.05 0.42 0.00 -2.27 0.00 0.00 179.45 177.58 1qzq h ALA 321 N 0.05 0.89 -0.52 5.00 0.00 -1.93 -1.22 119.26 121.54 1qzq h ALA 321 Ca -0.03 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1qzq h ALA 321 Cb 0.45 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1qzq h ALA 321 CO 0.05 0.37 0.05 -0.44 0.00 0.00 0.00 179.25 179.28 1qzq h ASP 322 N 0.96 0.79 0.01 0.00 3.45 -1.05 0.06 116.42 120.63 1qzq h ASP 322 Ca 0.25 -0.17 -0.18 0.00 0.43 0.00 0.00 57.03 57.36 1qzq h ASP 322 Cb -0.02 -0.21 -0.00 0.00 -0.56 0.00 0.00 39.33 38.54 1qzq h ASP 322 CO -0.05 0.83 -0.62 0.25 -1.57 0.00 0.00 179.24 178.08 1qzq h LEU 323 N 0.79 0.68 -0.57 1.55 5.85 -0.43 -2.11 115.31 121.08 1qzq h LEU 323 Ca 0.16 -0.39 -0.08 0.00 0.84 0.00 0.00 57.88 58.41 1qzq h LEU 323 Cb 0.40 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 1qzq h LEU 323 CO 0.01 1.14 0.04 0.40 -0.34 0.00 0.00 178.44 179.69 1qzq h ILE 324 N 0.44 1.26 -0.56 4.05 2.04 -0.85 -1.46 117.51 122.44 1qzq h ILE 324 Ca -0.01 -1.06 -0.01 0.00 1.00 0.00 0.00 64.86 64.77 1qzq h ILE 324 Cb 1.19 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 38.08 1qzq h ILE 324 CO 0.12 0.38 0.29 0.28 0.00 0.00 0.00 178.15 179.23 1qzq h SER 325 N 0.87 0.71 -0.07 1.72 0.02 -0.92 0.45 113.55 116.32 1qzq h SER 325 Ca 0.17 -0.11 0.04 0.00 -0.84 0.00 0.00 61.79 61.05 1qzq h SER 325 Cb 0.49 -0.18 -0.04 0.00 0.14 0.00 0.00 62.40 62.81 1qzq h SER 325 CO 0.02 0.61 -0.18 0.22 -1.14 0.00 0.00 176.83 176.36 1qzq h TYR 326 N 0.75 -0.47 -0.76 3.45 3.20 -1.07 -1.93 116.97 120.14 1qzq h TYR 326 Ca 0.19 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.04 1qzq h TYR 326 Cb 0.07 0.22 -0.03 0.00 1.54 0.00 0.00 36.73 38.53 1qzq h TYR 326 CO -0.01 -0.26 0.31 -0.07 -1.64 0.00 0.00 178.16 176.49 1qzq h LEU 327 N -0.26 1.03 -1.22 2.82 3.38 -1.01 -2.72 115.31 117.33 1qzq h LEU 327 Ca 0.08 -0.15 0.12 0.00 0.09 0.00 0.00 57.88 58.01 1qzq h LEU 327 Cb 0.37 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 1qzq h LEU 327 CO -0.22 0.91 0.58 0.24 0.09 0.00 0.00 178.44 180.04 1qzq h MET 328 N 1.10 0.79 0.00 1.13 2.86 -0.31 -1.41 114.93 119.09 1qzq h MET 328 Ca 0.25 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1qzq h MET 328 Cb 0.20 -0.18 0.00 0.00 0.06 0.00 0.00 31.60 31.68 1qzq h MET 328 CO -0.02 0.52 0.00 0.00 1.06 0.00 0.00 176.91 178.47 1qzq h ALA 329 N 1.57 1.00 0.00 6.32 0.00 -1.03 -0.73 119.26 126.39 1qzq h ALA 329 Ca 0.43 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.19 1qzq h ALA 329 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1qzq h ALA 329 CO -0.20 0.00 -0.73 1.88 0.00 0.00 0.00 179.25 180.20 1qzq h TYR 330 N 0.00 0.00 -6.18 0.00 -1.99 -1.39 -3.47 116.97 103.94 1qzq h TYR 330 Ca 0.00 0.00 -0.45 0.00 2.00 0.00 0.00 58.73 60.28 1qzq h TYR 330 Cb 0.01 0.00 0.01 0.00 2.00 0.00 0.00 36.73 38.75 1qzq h TYR 330 CO 0.00 0.73 -0.77 -1.71 -0.00 0.00 0.00 178.16 176.41 1qzq n ASN 331 N -3.61 -3.93 -4.53 3.88 4.05 -0.28 -4.72 115.26 106.11 1qzq n ASN 331 Ca -0.01 -0.76 -0.33 0.00 0.45 0.00 0.00 54.58 53.93 1qzq n ASN 331 Cb 0.73 -4.09 -0.12 0.00 1.23 0.00 0.00 39.78 37.53 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 -3.41 2.85 0.11 5.20 0.00 -1.26 -5.04 121.76 120.21 1qzq s ALA 332 Ca 0.46 -0.92 -0.25 0.00 0.00 0.00 0.00 51.96 51.26 1qzq s ALA 332 Cb -0.23 -1.15 -0.09 0.00 0.00 0.00 0.00 23.12 21.64 1qzq s ALA 332 CO 0.81 0.53 1.68 -1.35 0.00 0.00 0.00 175.76 177.43 1qzq h PRO 333 N 5.44 -0.27 0.00 0.00 0.11 -2.00 -1.92 132.00 133.36 1qzq h PRO 333 Ca -0.46 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 1qzq h PRO 333 Cb 1.17 0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1qzq h PRO 333 CO 0.52 -0.18 -0.04 0.66 -0.21 0.00 0.00 178.00 178.75 1qzq h SER 334 N -0.28 0.00 1.25 -2.05 4.64 -1.98 -0.94 113.55 114.19 1qzq h SER 334 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1qzq h SER 334 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1qzq h SER 334 CO -0.09 0.04 -0.33 -0.07 -0.87 0.00 0.00 176.83 175.51 1qzq h LEU 335 N 0.00 0.00 -0.76 5.97 3.38 -1.83 -3.18 115.31 118.90 1qzq h LEU 335 Ca -0.00 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 1qzq h LEU 335 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1qzq h LEU 335 CO 0.01 0.04 -0.41 0.50 0.09 0.00 0.00 178.44 178.67 1qzq h LYS 336 N 0.00 0.46 -0.44 1.13 1.63 -0.41 -0.44 116.57 118.50 1qzq h LYS 336 Ca 0.00 -0.23 -0.03 0.00 -0.85 0.00 0.00 60.65 59.54 1qzq h LYS 336 Cb 0.79 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.40 1qzq h LYS 336 CO 0.00 0.79 0.17 1.49 -3.45 0.00 0.00 179.45 178.45 1qzq h GLU 337 N 0.38 0.66 -0.25 1.90 4.81 -1.51 -1.41 114.58 119.16 1qzq h GLU 337 Ca 0.03 -0.13 -0.06 0.00 -0.13 0.00 0.00 59.36 59.08 1qzq h GLU 337 Cb 0.88 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.14 1qzq h GLU 337 CO 0.07 0.62 -0.09 -1.49 -0.73 0.00 0.00 179.01 177.39 1qzq h TRP 338 N 0.57 0.42 -0.65 0.92 4.06 -1.52 -0.91 115.95 118.83 1qzq h TRP 338 Ca 0.15 -0.05 -0.04 0.00 2.06 0.00 0.00 58.89 61.00 1qzq h TRP 338 Cb 0.21 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.22 1qzq h TRP 338 CO 0.00 0.49 0.23 0.82 -3.56 0.00 0.00 178.44 176.43 1qzq h ILE 339 N 0.38 1.23 -0.12 1.49 2.04 -0.61 -0.61 117.51 121.31 1qzq h ILE 339 Ca 0.08 -0.77 -0.14 0.00 1.00 0.00 0.00 64.86 65.03 1qzq h ILE 339 Cb 0.40 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1qzq h ILE 339 CO 0.02 0.30 -0.52 0.44 0.00 0.00 0.00 178.15 178.39 1qzq h ASP 340 N 0.95 0.36 -0.55 1.72 3.45 -0.43 -0.77 116.42 121.14 1qzq h ASP 340 Ca 0.22 -0.18 -0.11 0.00 0.43 0.00 0.00 57.03 57.39 1qzq h ASP 340 Cb 0.23 -0.10 -0.02 0.00 -0.56 0.00 0.00 39.33 38.87 1qzq h ASP 340 CO -0.01 0.82 -0.06 0.58 -1.57 0.00 0.00 179.24 178.99 1qzq h VAL 341 N 0.25 1.27 -0.30 -1.35 2.07 -0.68 -2.74 116.25 114.77 1qzq h VAL 341 Ca 0.01 -1.21 -0.12 0.00 0.82 0.00 0.00 66.70 66.20 1qzq h VAL 341 Cb 1.01 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 1qzq h VAL 341 CO 0.09 0.43 -0.31 0.40 0.02 0.00 0.00 177.57 178.20 1qzq h ILE 342 N 0.93 1.28 -0.96 4.57 2.04 -0.80 -2.83 117.51 121.74 1qzq h ILE 342 Ca 0.15 -1.42 0.04 0.00 1.00 0.00 0.00 64.86 64.63 1qzq h ILE 342 Cb 0.62 1.38 -0.06 0.00 -0.74 0.00 0.00 36.82 38.02 1qzq h ILE 342 CO 0.04 0.46 0.62 0.45 0.00 0.00 0.00 178.15 179.72 1qzq h HIS 343 N 0.54 1.16 0.00 1.37 3.86 -0.92 -1.98 115.15 119.19 1qzq h HIS 343 Ca 0.06 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1qzq h HIS 343 Cb 0.80 -0.38 0.00 0.00 1.06 0.00 0.00 27.41 28.88 1qzq h HIS 343 CO 0.03 0.65 0.00 1.63 0.86 0.00 0.00 177.93 181.10 1qzq n LYS 344 N -4.49 0.77 -4.29 2.45 5.02 -1.05 -4.85 118.16 111.70 1qzq n LYS 344 Ca 0.13 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.19 1qzq n LYS 344 Cb 0.12 -1.45 -0.07 0.00 -0.02 0.00 0.00 35.03 33.60 1qzq n LYS 344 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1qzq s HIS 345 N -2.00 2.69 -0.47 2.13 3.76 -0.74 -0.95 115.29 119.71 1qzq s HIS 345 Ca 0.33 -0.22 -0.16 0.00 -0.15 0.00 0.00 55.06 54.86 1qzq s HIS 345 Cb 0.15 -1.20 0.06 0.00 1.11 0.00 0.00 32.58 32.70 1qzq s HIS 345 CO 0.26 0.61 0.41 0.34 -0.85 0.00 0.00 174.74 175.51 1qzq s ASP 346 N -3.61 6.15 -0.10 1.40 -1.08 0.21 -4.72 116.67 114.93 1qzq s ASP 346 Ca 0.31 -1.20 0.16 0.00 -0.52 0.00 0.00 52.55 51.30 1qzq s ASP 346 Cb -0.07 -2.20 0.57 0.00 -1.46 0.00 0.00 42.92 39.77 1qzq s ASP 346 CO 0.20 -0.65 1.48 0.18 0.52 0.00 0.00 175.17 176.90 1qzq n LEU 347 N 5.33 4.09 0.26 -1.34 4.32 -0.40 -3.92 117.00 125.34 1qzq n LEU 347 Ca -0.11 -2.48 0.14 0.00 -0.02 0.00 0.00 56.01 53.54 1qzq n LEU 347 Cb 0.44 -0.48 0.75 0.00 -1.62 0.00 0.00 43.42 42.51 1qzq n LEU 347 CO 0.47 0.76 1.00 0.77 -1.22 0.00 0.00 177.39 179.17 1qzq h SER 348 N 2.99 0.00 1.77 -1.43 4.64 -1.58 -1.54 113.55 118.39 1qzq h SER 348 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qzq h SER 348 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1qzq h SER 348 CO 0.17 0.00 0.00 -0.33 -0.87 0.00 0.00 176.83 175.80 1qzq h GLU 349 N 0.00 0.00 -6.27 4.77 4.39 -1.87 -3.40 114.58 112.20 1qzq h GLU 349 Ca 0.00 0.00 -0.68 0.00 0.34 0.00 0.00 59.36 59.02 1qzq h GLU 349 Cb 0.38 0.00 0.04 0.00 -0.10 0.00 0.00 28.75 29.07 1qzq h GLU 349 CO 0.00 0.00 0.69 2.41 -1.16 0.00 0.00 179.01 180.95 1qzq n THR 350 N -3.05 0.15 -0.12 1.13 -1.04 -0.58 -4.88 114.28 105.89 1qzq n THR 350 Ca 0.03 -0.03 0.05 0.00 -2.04 0.00 0.00 64.05 62.07 1qzq n THR 350 Cb 0.48 -1.14 0.13 0.00 -1.82 0.00 0.00 70.33 67.98 1qzq n THR 350 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1qzq n ASN 351 N 3.87 2.77 -4.50 8.00 0.23 -1.26 -4.54 115.26 119.83 1qzq n ASN 351 Ca 0.21 -1.96 -0.27 0.00 -0.53 0.00 0.00 54.58 52.03 1qzq n ASN 351 Cb 0.20 -0.20 -0.11 0.00 -2.08 0.00 0.00 39.78 37.60 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 -0.99 2.82 0.01 3.53 -7.23 -1.26 -4.77 120.40 112.51 1qzq s VAL 352 Ca 0.20 -1.78 -0.11 0.00 -1.81 0.00 0.00 61.98 58.48 1qzq s VAL 352 Cb 0.11 -2.36 -0.05 0.00 0.56 0.00 0.00 36.38 34.63 1qzq s VAL 352 CO 0.14 -0.08 0.36 -0.31 -0.31 0.00 0.00 175.10 174.90 1qzq s TYR 353 N -1.60 3.65 -0.03 2.82 1.51 -0.82 -4.70 117.35 118.18 1qzq s TYR 353 Ca 0.22 0.82 -0.21 0.00 -1.01 0.00 0.00 57.07 56.90 1qzq s TYR 353 Cb -0.09 -2.17 -0.05 0.00 -0.11 0.00 0.00 41.96 39.54 1qzq s TYR 353 CO 0.12 0.61 0.61 -1.17 -1.11 0.00 0.00 175.55 174.61 1qzq s LEU 354 N -1.43 4.38 -0.28 -1.29 2.96 -1.26 -0.39 118.68 121.36 1qzq s LEU 354 Ca 0.26 1.13 0.02 0.00 -0.22 0.00 0.00 54.13 55.32 1qzq s LEU 354 Cb -0.15 -2.94 0.08 0.00 0.50 0.00 0.00 46.19 43.68 1qzq s LEU 354 CO 0.14 0.04 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.57 1qzq s ILE 355 N 0.15 1.76 0.29 6.68 1.01 -0.59 -4.93 121.20 125.57 1qzq s ILE 355 Ca 0.32 -1.65 0.10 0.00 0.00 0.00 0.00 60.65 59.42 1qzq s ILE 355 Cb -0.18 -2.12 -0.05 0.00 0.01 0.00 0.00 42.46 40.12 1qzq s ILE 355 CO 0.17 -0.32 -0.07 -0.83 0.00 0.00 0.00 174.94 173.88 1qzq s GLY 356 N 1.23 1.87 -0.03 6.18 0.00 -1.26 -1.21 107.32 114.10 1qzq s GLY 356 Ca 0.01 -1.83 0.06 0.00 0.00 0.00 0.00 44.72 42.96 1qzq s GLY 356 CO -0.09 -1.87 -0.20 -0.56 0.00 0.00 0.00 173.10 170.38 1qzq s SER 357 N -3.63 2.41 -0.01 1.64 0.01 0.12 -1.96 113.70 112.28 1qzq s SER 357 Ca 0.32 -0.38 -0.01 0.00 1.31 0.00 0.00 55.95 57.19 1qzq s SER 357 Cb -0.04 -0.39 0.00 0.00 0.21 0.00 0.00 66.02 65.81 1qzq s SER 357 CO 0.18 0.23 0.03 0.28 0.41 0.00 0.00 173.24 174.37 1qzq s THR 358 N -0.34 -0.00 0.26 1.44 -1.32 -1.19 -1.41 115.64 113.07 1qzq s THR 358 Ca 0.04 0.00 -0.31 0.00 -1.21 0.00 0.00 61.69 60.22 1qzq s THR 358 Cb -0.09 -0.05 -0.13 0.00 -1.51 0.00 0.00 72.50 70.72 1qzq s THR 358 CO 0.00 0.00 1.50 -2.65 -2.21 0.00 0.00 174.62 171.26 1qzq n PRO 359 N 3.09 2.34 -2.94 7.08 -0.02 -1.19 -4.63 135.00 138.73 1qzq n PRO 359 Ca -0.12 0.83 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1qzq n PRO 359 Cb 0.60 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1qzq n PRO 359 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qzq n GLY 360 N 2.22 -1.58 2.87 -1.23 0.00 0.15 -4.95 105.19 102.66 1qzq n GLY 360 Ca 0.10 -1.47 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 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 -1.81 1.26 -0.19 1.61 0.52 -1.26 -0.75 118.95 118.33 1qzq s ARG 361 Ca 0.00 -0.89 -0.06 0.00 -0.52 0.00 0.00 55.73 54.26 1qzq s ARG 361 Cb 0.00 -2.43 -0.03 0.00 0.52 0.00 0.00 34.95 33.01 1qzq s ARG 361 CO 0.00 -0.67 0.03 -0.06 0.02 0.00 0.00 175.30 174.62 1qzq s PHE 362 N 1.52 3.13 0.26 -0.53 0.08 0.34 -4.88 117.98 117.90 1qzq s PHE 362 Ca -0.02 -0.18 0.03 0.00 0.12 0.00 0.00 56.93 56.88 1qzq s PHE 362 Cb -0.18 -2.07 -0.05 0.00 -0.57 0.00 0.00 43.02 40.14 1qzq s PHE 362 CO -0.09 -0.04 0.02 -0.65 -0.10 0.00 0.00 175.22 174.37 1qzq s GLN 363 N 0.66 1.43 7.83 0.44 -0.21 -1.26 0.02 119.66 128.57 1qzq s GLN 363 Ca 0.01 -1.75 0.00 0.00 0.02 0.00 0.00 55.36 53.64 1qzq s GLN 363 Cb -0.14 -0.64 0.00 0.00 1.00 0.00 0.00 33.01 33.23 1qzq s GLN 363 CO 0.02 -0.14 0.00 0.41 -2.12 0.00 0.00 175.29 173.46 1qzq n GLY 364 N -0.50 3.42 0.16 3.09 0.00 -1.26 -2.93 105.19 107.17 1qzq n GLY 364 Ca -0.04 -0.12 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 0.46 -0.11 1.61 4.64 -1.99 -2.97 113.55 115.18 1qzq h SER 365 Ca 0.00 -0.34 0.03 0.00 -0.47 0.00 0.00 61.79 61.01 1qzq h SER 365 Cb 0.00 -0.13 -0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1qzq h SER 365 CO 0.00 0.69 0.16 1.56 -0.87 0.00 0.00 176.83 178.37 1qzq h GLN 366 N 0.22 0.00 -1.04 4.77 4.20 -1.92 -3.06 115.11 118.29 1qzq h GLN 366 Ca 0.07 0.00 0.28 0.00 0.06 0.00 0.00 58.65 59.06 1qzq h GLN 366 Cb 0.48 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 28.14 1qzq h GLN 366 CO 0.02 0.00 0.63 -0.22 -0.67 0.00 0.00 178.83 178.59 1qzq h LYS 367 N 0.00 0.43 -0.32 1.46 3.64 -1.49 0.16 116.57 120.45 1qzq h LYS 367 Ca 0.05 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1qzq h LYS 367 Cb 0.37 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 1qzq h LYS 367 CO -0.00 0.29 0.00 -0.25 -2.27 0.00 0.00 179.45 177.21 1qzq n ASP 368 N -4.83 2.31 0.12 4.20 8.00 -1.15 -4.37 116.55 120.81 1qzq n ASP 368 Ca 0.28 -1.88 -0.03 0.00 0.71 0.00 0.00 54.79 53.88 1qzq n ASP 368 Cb 0.88 -0.21 0.14 0.00 -0.02 0.00 0.00 41.12 41.91 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 2.83 0.10 -5.54 -2.24 2.35 -0.87 -3.29 115.58 108.92 1qzq h ASN 369 Ca 0.00 -0.06 -0.45 0.00 -0.55 0.00 0.00 56.30 55.24 1qzq h ASN 369 Cb 0.63 -0.03 -0.13 0.00 0.05 0.00 0.00 38.32 38.84 1qzq h ASN 369 CO 0.00 0.70 -0.51 0.26 -1.65 0.00 0.00 177.43 176.23 1qzq s TRP 370 N -3.63 1.68 0.00 1.19 0.52 -1.26 -4.74 118.94 112.70 1qzq s TRP 370 Ca -0.02 -1.58 0.00 0.00 0.02 0.00 0.00 56.10 54.52 1qzq s TRP 370 Cb 0.12 -0.75 0.00 0.00 -1.15 0.00 0.00 33.47 31.70 1qzq s TRP 370 CO 0.78 -0.77 0.00 0.41 0.02 0.00 0.00 176.95 177.38 1qzq n GLY 371 N -0.61 1.22 0.26 0.98 0.00 -0.83 -1.55 105.19 104.67 1qzq n GLY 371 Ca 0.05 -0.56 0.17 0.00 0.00 0.00 0.00 46.02 45.68 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 0.00 1.61 2.07 -1.45 -1.88 115.15 115.49 1qzq h HIS 372 Ca 0.00 0.00 -0.16 0.00 -2.85 0.00 0.00 60.37 57.36 1qzq h HIS 372 Cb 0.00 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 29.96 1qzq h HIS 372 CO 0.00 0.00 -0.75 0.74 -3.07 0.00 0.00 177.93 174.85 1qzq h PHE 373 N 0.00 0.00 -0.27 6.12 -1.00 -1.79 -1.30 116.94 118.70 1qzq h PHE 373 Ca 0.00 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.75 1qzq h PHE 373 Cb 0.47 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 40.02 1qzq h PHE 373 CO 0.00 0.75 0.04 -0.09 -1.61 0.00 0.00 178.31 177.40 1qzq h ARG 374 N 0.00 0.45 -0.04 1.51 9.65 -0.44 -0.80 114.38 124.71 1qzq h ARG 374 Ca -0.01 -0.12 -0.00 0.00 -1.10 0.00 0.00 59.98 58.75 1qzq h ARG 374 Cb 1.38 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.91 1qzq h ARG 374 CO 0.10 0.57 0.03 1.25 2.80 0.00 0.00 179.97 184.71 1qzq h LEU 375 N 0.26 0.05 -0.48 3.80 5.85 -1.42 -1.80 115.31 121.58 1qzq h LEU 375 Ca 0.08 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 58.85 1qzq h LEU 375 Cb 0.34 -0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.27 1qzq h LEU 375 CO 0.01 0.08 -0.09 0.50 -0.34 0.00 0.00 178.44 178.60 1qzq h LYS 376 N 0.02 0.03 -0.12 1.25 3.64 -1.14 0.27 116.57 120.52 1qzq h LYS 376 Ca 0.02 -0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1qzq h LYS 376 Cb 0.04 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1qzq h LYS 376 CO -0.00 0.02 -0.04 -0.22 -2.27 0.00 0.00 179.45 176.94 1qzq h LYS 377 N 0.03 -0.01 -0.73 1.90 1.63 -0.84 0.54 116.57 119.09 1qzq h LYS 377 Ca 0.23 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 60.01 1qzq h LYS 377 Cb 0.36 0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.96 1qzq h LYS 377 CO -0.47 -0.01 0.36 -0.07 -3.45 0.00 0.00 179.45 175.82 1qzq h LEU 378 N -0.01 0.94 -0.94 5.20 3.38 -0.58 -0.89 115.31 122.42 1qzq h LEU 378 Ca 0.06 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1qzq h LEU 378 Cb 0.10 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1qzq h LEU 378 CO -0.13 0.80 -0.17 -0.07 0.09 0.00 0.00 178.44 178.96 1qzq h LEU 379 N 1.02 0.57 -0.27 1.67 3.38 -0.71 0.17 115.31 121.14 1qzq h LEU 379 Ca 0.25 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.96 1qzq h LEU 379 Cb 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1qzq h LEU 379 CO -0.03 0.76 -0.16 0.50 0.09 0.00 0.00 178.44 179.60 1qzq h LYS 380 N 0.52 0.59 0.00 1.13 3.64 -0.43 -2.71 116.57 119.31 1qzq h LYS 380 Ca 0.09 -0.27 -0.17 0.00 -1.27 0.00 0.00 60.65 59.03 1qzq h LYS 380 Cb 0.60 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 1qzq h LYS 380 CO 0.04 0.85 -1.09 -0.44 -2.27 0.00 0.00 179.45 176.54 1qzq h ASP 381 N 0.33 0.00 0.00 4.20 3.32 -0.90 -2.91 116.42 120.45 1qzq h ASP 381 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1qzq h ASP 381 Cb 0.68 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.23 1qzq h ASP 381 CO 0.05 0.67 0.00 1.41 -1.72 0.00 0.00 179.24 179.64 1qzq n HIS 382 N -3.09 0.00 -4.30 4.55 8.25 0.58 -5.00 115.22 116.21 1qzq n HIS 382 Ca -0.05 -0.42 -0.25 0.00 -0.26 0.00 0.00 57.72 56.75 1qzq n HIS 382 Cb 0.85 -0.04 -0.13 0.00 1.12 0.00 0.00 29.99 31.79 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 -0.84 1.89 -0.07 -1.41 0.00 -1.14 -4.56 121.76 115.62 1qzq s ALA 383 Ca 0.00 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 50.68 1qzq s ALA 383 Cb 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 1qzq s ALA 383 CO 0.00 0.38 -0.08 -1.12 0.00 0.00 0.00 175.76 174.95 1qzq s SER 384 N -1.95 4.58 0.45 0.00 0.01 -1.26 -1.95 113.70 113.58 1qzq s SER 384 Ca 0.08 -0.05 -0.21 0.00 1.31 0.00 0.00 55.95 57.08 1qzq s SER 384 Cb -0.10 -1.18 -0.10 0.00 0.21 0.00 0.00 66.02 64.85 1qzq s SER 384 CO 0.05 0.35 0.99 -0.55 0.41 0.00 0.00 173.24 174.49 1qzq s SER 385 N -0.72 6.67 0.33 2.44 0.15 -1.26 -4.67 113.70 116.64 1qzq s SER 385 Ca 0.11 1.81 0.08 0.00 0.70 0.00 0.00 55.95 58.65 1qzq s SER 385 Cb -0.11 -2.55 -0.06 0.00 -1.71 0.00 0.00 66.02 61.58 1qzq s SER 385 CO 0.01 -0.55 -0.06 0.00 1.20 0.00 0.00 173.24 173.84 1qzq s MET 386 N -3.16 1.74 0.44 5.44 0.23 -1.26 -5.00 119.30 117.73 1qzq s MET 386 Ca 0.64 -1.91 -0.24 0.00 -1.03 0.00 0.00 55.69 53.15 1qzq s MET 386 Cb -0.13 -1.48 -0.08 0.00 -1.53 0.00 0.00 34.83 31.62 1qzq s MET 386 CO 0.17 0.07 1.22 -2.14 -2.03 0.00 0.00 175.02 172.30 1qzq s PRO 387 N -3.67 3.81 -1.40 3.16 0.02 -1.26 -2.00 135.00 133.66 1qzq s PRO 387 Ca 0.32 1.92 0.00 0.00 0.02 0.00 0.00 61.00 63.26 1qzq s PRO 387 Cb 0.04 -2.53 0.00 0.00 0.02 0.00 0.00 34.50 32.03 1qzq s PRO 387 CO 0.15 -0.55 0.00 -1.71 -0.33 0.00 0.00 177.00 174.56 1qzq n ASN 388 N -0.27 -4.71 -0.18 2.53 4.05 -1.26 -4.87 115.26 110.55 1qzq n ASN 388 Ca 0.06 0.07 0.07 0.00 0.45 0.00 0.00 54.58 55.23 1qzq n ASN 388 Cb 0.46 -3.78 0.36 0.00 1.23 0.00 0.00 39.78 38.05 1qzq n ASN 388 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1qzq h ALA 389 N 0.59 1.72 0.00 5.20 0.00 -1.82 -1.39 119.26 123.56 1qzq h ALA 389 Ca -0.36 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1qzq h ALA 389 Cb 1.22 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1qzq h ALA 389 CO 0.44 0.15 0.08 1.05 0.00 0.00 0.00 179.25 180.97 1qzq h GLU 390 N 0.73 0.00 -0.23 0.00 9.09 -1.89 0.40 114.58 122.68 1qzq h GLU 390 Ca 0.32 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.73 1qzq h GLU 390 Cb 0.29 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.39 1qzq h GLU 390 CO -0.11 0.00 0.00 -1.13 0.05 0.00 0.00 179.01 177.82 1qzq n SER 391 N -2.54 3.07 -4.58 3.06 3.41 -0.52 -3.82 113.62 111.70 1qzq n SER 391 Ca -0.02 -1.95 -0.42 0.00 -0.26 0.00 0.00 58.87 56.22 1qzq n SER 391 Cb 0.12 -0.14 -0.06 0.00 -0.26 0.00 0.00 64.21 63.87 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 -1.72 3.15 1.10 7.33 0.52 0.13 -3.93 118.94 125.52 1qzq s TRP 392 Ca 0.35 0.46 -0.17 0.00 0.02 0.00 0.00 56.10 56.76 1qzq s TRP 392 Cb 0.21 -3.22 0.24 0.00 -1.15 0.00 0.00 33.47 29.56 1qzq s TRP 392 CO 0.31 -0.65 1.15 -1.25 0.02 0.00 0.00 176.95 176.53 1qzq s PRO 393 N 2.85 -0.45 -0.06 4.98 0.04 -1.15 -4.72 135.00 136.49 1qzq s PRO 393 Ca 0.27 -0.04 0.05 0.00 0.04 0.00 0.00 61.00 61.32 1qzq s PRO 393 Cb -0.14 -1.69 -0.01 0.00 0.04 0.00 0.00 34.50 32.71 1qzq s PRO 393 CO 0.15 -3.20 -0.22 0.08 0.04 0.00 0.00 177.00 173.85 1qzq s VAL 394 N -3.21 1.82 -0.04 -0.36 1.01 -0.54 -3.54 120.40 115.55 1qzq s VAL 394 Ca 0.70 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.82 1qzq s VAL 394 Cb -0.10 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.71 1qzq s VAL 394 CO 0.55 0.51 -0.24 -0.69 0.00 0.00 0.00 175.10 175.23 1qzq s VAL 395 N -0.03 1.96 -0.05 2.92 1.01 -0.63 -0.89 120.40 124.70 1qzq s VAL 395 Ca -0.05 -1.04 -0.01 0.00 0.00 0.00 0.00 61.98 60.88 1qzq s VAL 395 Cb -0.13 -1.65 0.03 0.00 0.00 0.00 0.00 36.38 34.63 1qzq s VAL 395 CO 0.04 0.55 0.00 -0.83 0.00 0.00 0.00 175.10 174.86 1qzq s GLY 396 N -0.34 0.37 -0.06 4.51 0.00 -0.29 -1.99 107.32 109.53 1qzq s GLY 396 Ca 0.02 0.00 0.04 0.00 0.00 0.00 0.00 44.72 44.78 1qzq s GLY 396 CO 0.01 0.95 -0.17 -0.86 0.00 0.00 0.00 173.10 173.03 1qzq s GLN 397 N 1.62 1.98 0.36 2.90 1.03 -0.19 0.14 119.66 127.49 1qzq s GLN 397 Ca -0.01 -0.60 -0.01 0.00 0.04 0.00 0.00 55.36 54.78 1qzq s GLN 397 Cb -0.13 -1.64 0.00 0.00 0.03 0.00 0.00 33.01 31.28 1qzq s GLN 397 CO -0.03 0.17 0.48 -0.59 -2.54 0.00 0.00 175.29 172.77 1qzq s PHE 398 N 0.28 1.16 -0.04 9.60 -0.71 -0.98 -1.11 117.98 126.18 1qzq s PHE 398 Ca -0.10 -1.36 0.00 0.00 -1.04 0.00 0.00 56.93 54.43 1qzq s PHE 398 Cb -0.14 -0.12 0.00 0.00 -1.21 0.00 0.00 43.02 41.55 1qzq s PHE 398 CO 0.04 -1.16 0.60 -1.13 -1.34 0.00 0.00 175.22 172.24 1qzq n SER 399 N -1.56 1.22 -3.61 1.98 3.41 -1.26 -4.62 113.62 109.17 1qzq n SER 399 Ca 0.01 -1.20 -0.16 0.00 -0.26 0.00 0.00 58.87 57.26 1qzq n SER 399 Cb 0.61 -0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.49 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 -0.21 -0.51 -0.03 4.04 0.15 -1.26 -3.89 113.70 111.99 1qzq s SER 400 Ca 0.00 0.55 0.06 0.00 0.70 0.00 0.00 55.95 57.26 1qzq s SER 400 Cb 0.00 0.51 -0.01 0.00 -1.71 0.00 0.00 66.02 64.81 1qzq s SER 400 CO 0.00 -0.53 -0.20 -0.69 1.20 0.00 0.00 173.24 173.02 1qzq s VAL 401 N -1.13 1.64 0.28 4.45 1.01 -1.26 -2.79 120.40 122.59 1qzq s VAL 401 Ca -0.11 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.04 1qzq s VAL 401 Cb -0.02 -1.38 0.04 0.00 0.00 0.00 0.00 36.38 35.03 1qzq s VAL 401 CO 0.08 0.46 0.35 0.61 0.00 0.00 0.00 175.10 176.60 1qzq n GLY 402 N 2.76 2.12 3.65 4.51 0.00 -0.36 -4.84 105.19 113.03 1qzq n GLY 402 Ca -0.16 -2.19 -0.43 0.00 0.00 0.00 0.00 46.02 43.24 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 -2.71 6.94 0.00 1.61 0.01 -1.26 -4.89 113.70 113.39 1qzq s SER 403 Ca 0.27 1.28 0.19 0.00 1.31 0.00 0.00 55.95 59.00 1qzq s SER 403 Cb -0.02 -2.54 -0.09 0.00 0.21 0.00 0.00 66.02 63.58 1qzq s SER 403 CO 0.17 -0.84 0.89 0.18 0.41 0.00 0.00 173.24 174.06 1qzq n LEU 404 N 6.80 1.43 0.00 2.44 4.77 -1.26 -4.66 117.00 126.52 1qzq n LEU 404 Ca 0.13 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.46 1qzq n LEU 404 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 1qzq n LEU 404 CO 0.57 0.29 0.00 0.61 -1.33 0.00 0.00 177.39 177.53 1qzq n GLY 405 N 1.36 2.31 0.24 -0.72 0.00 -1.26 -3.90 105.19 103.21 1qzq n GLY 405 Ca 0.06 -2.15 0.09 0.00 0.00 0.00 0.00 46.02 44.02 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 1.50 -2.82 4.61 0.00 -1.99 -3.44 119.26 117.13 1qzq h ALA 406 Ca 0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1qzq h ALA 406 Cb 0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 17.67 1qzq h ALA 406 CO 0.00 0.18 -0.17 0.16 0.00 0.00 0.00 179.25 179.42 1qzq s ASP 407 N -6.59 0.06 0.61 0.00 -4.77 -1.26 -4.91 116.67 99.82 1qzq s ASP 407 Ca -0.04 -1.05 0.36 0.00 -3.30 0.00 0.00 52.55 48.52 1qzq s ASP 407 Cb 0.15 0.58 2.03 0.00 -1.09 0.00 0.00 42.92 44.58 1qzq s ASP 407 CO 0.64 -1.14 2.28 1.05 0.70 0.00 0.00 175.17 178.69 1qzq h GLU 408 N 2.27 0.00 0.00 2.11 4.11 -1.93 -2.63 114.58 118.51 1qzq h GLU 408 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.16 1qzq h GLU 408 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1qzq h GLU 408 CO 0.38 0.01 -0.07 -1.13 0.07 0.00 0.00 179.01 178.27 1qzq n SER 409 N -3.47 0.53 -0.16 3.06 3.41 -1.26 -0.90 113.62 114.83 1qzq n SER 409 Ca -0.03 0.48 -0.08 0.00 -0.26 0.00 0.00 58.87 58.98 1qzq n SER 409 Cb 0.10 -0.58 0.01 0.00 -0.26 0.00 0.00 64.21 63.49 1qzq n SER 409 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1qzq h LYS 410 N 0.00 0.69 0.00 4.33 1.79 -1.75 -3.39 116.57 118.24 1qzq h LYS 410 Ca 0.00 -0.10 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 1qzq h LYS 410 Cb 0.65 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.18 1qzq h LYS 410 CO 0.00 0.58 0.00 1.87 -1.08 0.00 0.00 179.45 180.82 1qzq n TRP 411 N -4.63 -0.92 0.05 -1.35 -0.00 -1.25 -4.82 117.44 104.52 1qzq n TRP 411 Ca 0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 57.50 57.45 1qzq n TRP 411 Cb 0.12 0.39 -0.04 0.00 -0.00 0.00 0.00 31.31 31.78 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 -0.59 -0.91 5.87 5.85 -1.80 -1.86 115.31 121.88 1qzq h LEU 412 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1qzq h LEU 412 Cb 0.00 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1qzq h LEU 412 CO 0.00 -0.21 0.00 0.00 -0.34 0.00 0.00 178.44 177.89 1qzq n SER 414 N 0.14 0.00 0.09 0.00 7.64 -1.05 -4.62 113.62 115.81 1qzq n SER 414 Ca 0.14 0.00 -0.21 0.00 1.01 0.00 0.00 58.87 59.82 1qzq n SER 414 Cb 0.27 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.35 1qzq n SER 414 CO 0.00 0.00 0.00 1.05 -3.01 0.00 0.00 175.04 173.08 1qzq h GLU 415 N 0.00 0.58 0.74 1.43 4.11 -1.66 -2.89 114.58 116.89 1qzq h GLU 415 Ca 0.00 -0.75 -0.04 0.00 0.07 0.00 0.00 59.36 58.64 1qzq h GLU 415 Cb 0.00 0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.50 1qzq h GLU 415 CO 0.00 1.33 -0.35 0.35 0.07 0.00 0.00 179.01 180.41 1qzq h PHE 416 N 0.27 -0.92 -1.00 2.06 3.57 -1.42 -2.40 116.94 117.09 1qzq h PHE 416 Ca -0.17 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.36 1qzq h PHE 416 Cb 1.86 0.30 -0.06 0.00 2.79 0.00 0.00 35.95 40.85 1qzq h PHE 416 CO 0.10 -0.55 0.65 -0.22 -2.23 0.00 0.00 178.31 176.06 1qzq h LYS 417 N -1.10 1.18 -0.85 1.11 3.64 -1.07 -1.54 116.57 117.93 1qzq h LYS 417 Ca -0.10 -0.07 0.07 0.00 -1.27 0.00 0.00 60.65 59.28 1qzq h LYS 417 Cb 0.78 -0.27 -0.06 0.00 -0.41 0.00 0.00 32.23 32.28 1qzq h LYS 417 CO 0.17 0.78 0.55 0.93 -2.27 0.00 0.00 179.45 179.61 1qzq h GLU 418 N 1.21 0.89 -0.06 1.90 4.39 -1.40 -0.01 114.58 121.51 1qzq h GLU 418 Ca 0.42 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 60.03 1qzq h GLU 418 Cb 0.09 -0.20 -0.00 0.00 -0.10 0.00 0.00 28.75 28.54 1qzq h GLU 418 CO -0.15 0.59 -0.08 0.77 -1.16 0.00 0.00 179.01 178.98 1qzq h SER 419 N 0.92 0.17 0.18 1.42 0.02 -0.79 -3.22 113.55 112.24 1qzq h SER 419 Ca 0.37 -0.52 -0.02 0.00 -0.84 0.00 0.00 61.79 60.78 1qzq h SER 419 Cb 0.26 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.75 1qzq h SER 419 CO -0.14 0.66 -0.07 0.24 -1.14 0.00 0.00 176.83 176.38 1qzq h MET 420 N -0.32 0.00 -0.58 3.45 2.86 -0.65 -2.52 114.93 117.17 1qzq h MET 420 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 1qzq h MET 420 Cb 0.62 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.28 1qzq h MET 420 CO 0.02 0.07 0.00 1.47 1.06 0.00 0.00 176.91 179.53 1qzq n LEU 421 N -3.85 3.57 -4.75 1.22 -0.00 -0.08 -4.94 117.00 108.17 1qzq n LEU 421 Ca -0.02 -1.70 -0.41 0.00 -0.00 0.00 0.00 56.01 53.87 1qzq n LEU 421 Cb 0.17 -0.38 -0.03 0.00 -0.00 0.00 0.00 43.42 43.18 1qzq n LEU 421 CO 0.30 0.85 0.99 -0.89 -0.00 0.00 0.00 177.39 178.64 1qzq s THR 422 N -1.23 2.99 -0.20 1.47 2.01 -0.95 -5.02 115.64 114.72 1qzq s THR 422 Ca 0.44 0.88 -0.07 0.00 0.31 0.00 0.00 61.69 63.24 1qzq s THR 422 Cb 0.24 -3.56 0.09 0.00 0.01 0.00 0.00 72.50 69.27 1qzq s THR 422 CO 0.32 0.16 0.43 -0.76 -0.69 0.00 0.00 174.62 174.07 1qzq s LEU 423 N -0.72 -0.61 0.08 4.42 1.43 -1.26 -4.69 118.68 117.33 1qzq s LEU 423 Ca 0.54 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 54.65 1qzq s LEU 423 Cb -0.38 1.39 0.00 0.00 0.03 0.00 0.00 46.19 47.23 1qzq s LEU 423 CO 0.43 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 177.40 1qzq n GLY 424 N 5.28 -2.06 0.01 -3.19 0.00 -0.82 -4.10 105.19 100.30 1qzq n GLY 424 Ca -0.10 -1.43 0.13 0.00 0.00 0.00 0.00 46.02 44.62 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 -2.79 0.02 -1.57 1.61 5.02 -1.10 -4.48 118.16 114.86 1qzq n LYS 425 Ca -0.01 0.01 -0.30 0.00 -2.02 0.00 0.00 58.31 56.00 1qzq n LYS 425 Cb 0.11 -1.52 0.21 0.00 -0.02 0.00 0.00 35.03 33.81 1qzq n LYS 425 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1qzq s GLU 426 N -3.01 -0.22 -0.27 1.97 2.02 -1.26 -5.09 118.70 112.83 1qzq s GLU 426 Ca 0.13 -0.29 -0.02 0.00 0.02 0.00 0.00 54.97 54.80 1qzq s GLU 426 Cb 0.18 -1.73 0.16 0.00 0.10 0.00 0.00 34.13 32.83 1qzq s GLU 426 CO 0.60 -3.01 0.47 -1.54 0.02 0.00 0.00 175.26 171.81 1qzq s SER 427 N -4.49 -0.46 -0.16 -0.19 1.04 -1.26 -4.93 113.70 103.25 1qzq s SER 427 Ca 0.73 0.47 -0.03 0.00 0.48 0.00 0.00 55.95 57.60 1qzq s SER 427 Cb -0.06 1.57 0.05 0.00 0.10 0.00 0.00 66.02 67.68 1qzq s SER 427 CO 0.54 -0.29 0.05 -0.54 0.98 0.00 0.00 173.24 173.99 1qzq s LYS 428 N 2.68 0.36 0.00 4.02 1.02 -1.26 -4.99 119.74 121.57 1qzq s LYS 428 Ca 0.16 -0.16 0.00 0.00 0.02 0.00 0.00 55.97 55.99 1qzq s LYS 428 Cb -0.15 -1.73 0.00 0.00 -0.52 0.00 0.00 37.83 35.43 1qzq s LYS 428 CO -0.19 -0.59 0.00 2.41 -0.92 0.00 0.00 175.35 176.07 1qzq n THR 429 N 5.17 0.00 -0.90 2.17 -1.04 -1.26 -4.70 114.28 113.73 1qzq n THR 429 Ca -0.07 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.71 1qzq n THR 429 Cb 0.48 -0.41 -0.10 0.00 -1.82 0.00 0.00 70.33 68.49 1qzq n THR 429 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1qzq n PRO 430 N -1.81 0.00 -3.70 -2.82 -0.02 -1.26 -1.09 135.00 124.30 1qzq n PRO 430 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.21 1qzq n PRO 430 Cb 0.29 -0.85 0.02 0.00 -0.02 0.00 0.00 33.50 32.94 1qzq n PRO 430 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qzq n GLY 431 N 3.80 -1.11 1.33 -1.23 0.00 -1.26 -4.88 105.19 101.83 1qzq n GLY 431 Ca 0.40 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.90 1qzq n GLY 431 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1qzq n LYS 432 N -3.46 0.00 -2.96 1.61 3.00 -0.25 -5.12 118.16 110.97 1qzq n LYS 432 Ca -0.16 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.73 1qzq n LYS 432 Cb 0.61 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.59 1qzq n LYS 432 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1qzq s SER 433 N -1.40 6.67 -0.38 3.14 1.04 -1.25 -4.91 113.70 116.62 1qzq s SER 433 Ca 0.00 0.72 0.11 0.00 0.48 0.00 0.00 55.95 57.26 1qzq s SER 433 Cb 0.00 -2.40 0.32 0.00 0.10 0.00 0.00 66.02 64.04 1qzq s SER 433 CO 0.00 -0.56 0.69 -0.24 0.98 0.00 0.00 173.24 174.11 1qzq n SER 434 N 6.09 0.45 -4.72 7.02 2.88 -1.26 -5.08 113.62 119.01 1qzq n SER 434 Ca 0.03 -2.95 -0.43 0.00 -1.33 0.00 0.00 58.87 54.19 1qzq n SER 434 Cb 0.48 -0.48 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1qzq n SER 434 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1qzq n VAL 435 N 0.63 1.11 -2.33 2.46 0.31 -1.25 -4.97 118.33 114.28 1qzq n VAL 435 Ca 0.23 -0.28 -0.40 0.00 -0.01 0.00 0.00 64.34 63.88 1qzq n VAL 435 Cb 0.62 -1.76 -0.03 0.00 -0.91 0.00 0.00 33.84 31.76 1qzq n VAL 435 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1qzq s PRO 436 N -0.64 4.47 -0.22 5.55 0.02 -1.26 -4.92 135.00 138.01 1qzq s PRO 436 Ca 0.64 1.94 0.02 0.00 0.02 0.00 0.00 61.00 63.62 1qzq s PRO 436 Cb -0.55 -3.08 0.04 0.00 0.02 0.00 0.00 34.50 30.93 1qzq s PRO 436 CO 0.51 0.01 -0.12 -1.17 -0.33 0.00 0.00 177.00 175.89 1qzq s LEU 437 N -1.71 2.62 -0.23 -5.54 2.96 -1.26 -1.46 118.68 114.06 1qzq s LEU 437 Ca 0.48 -1.01 -0.08 0.00 -0.22 0.00 0.00 54.13 53.29 1qzq s LEU 437 Cb -0.34 -1.37 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 1qzq s LEU 437 CO 0.45 -0.14 0.10 -0.31 -1.32 0.00 0.00 176.35 175.13 1qzq s TYR 438 N 1.29 3.21 -0.16 5.38 1.51 -0.07 -4.93 117.35 123.58 1qzq s TYR 438 Ca -0.03 -0.02 -0.02 0.00 -1.01 0.00 0.00 57.07 56.00 1qzq s TYR 438 Cb -0.17 -2.20 -0.01 0.00 -0.11 0.00 0.00 41.96 39.47 1qzq s TYR 438 CO -0.08 -0.05 -0.10 -0.51 -1.11 0.00 0.00 175.55 173.71 1qzq s LEU 439 N 1.04 2.82 -0.25 -1.29 1.43 -0.93 -1.13 118.68 120.37 1qzq s LEU 439 Ca 0.05 -0.32 -0.07 0.00 -1.03 0.00 0.00 54.13 52.76 1qzq s LEU 439 Cb -0.14 -1.66 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 1qzq s LEU 439 CO 0.04 0.12 0.06 -0.63 0.23 0.00 0.00 176.35 176.16 1qzq s ILE 440 N 0.64 4.18 -0.16 -0.59 1.01 0.12 0.54 121.20 126.95 1qzq s ILE 440 Ca -0.06 -0.25 -0.09 0.00 0.00 0.00 0.00 60.65 60.25 1qzq s ILE 440 Cb -0.15 -2.97 0.05 0.00 0.01 0.00 0.00 42.46 39.40 1qzq s ILE 440 CO 0.03 0.32 0.39 -0.47 0.00 0.00 0.00 174.94 175.20 1qzq s TYR 441 N 1.59 -0.54 0.16 3.97 6.14 -0.84 -2.33 117.35 125.51 1qzq s TYR 441 Ca 0.06 1.18 -0.34 0.00 0.64 0.00 0.00 57.07 58.61 1qzq s TYR 441 Cb -0.15 0.22 -0.14 0.00 0.42 0.00 0.00 41.96 42.30 1qzq s TYR 441 CO 0.03 -0.31 1.48 -2.30 0.64 0.00 0.00 175.55 175.10 1qzq n PRO 442 N 4.01 1.89 -2.28 4.97 -0.02 -1.26 -4.46 135.00 137.85 1qzq n PRO 442 Ca -0.22 0.68 -0.28 0.00 -2.02 0.00 0.00 63.50 61.66 1qzq n PRO 442 Cb 0.55 -2.39 0.02 0.00 -0.02 0.00 0.00 33.50 31.66 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 0.68 5.80 0.24 2.55 1.04 -1.26 -2.15 113.70 120.60 1qzq s SER 443 Ca 0.78 0.94 -0.04 0.00 0.48 0.00 0.00 55.95 58.11 1qzq s SER 443 Cb -0.73 -1.98 0.45 0.00 0.10 0.00 0.00 66.02 63.86 1qzq s SER 443 CO 0.42 -0.98 1.74 0.58 0.98 0.00 0.00 173.24 175.98 1qzq h VAL 444 N -0.20 0.70 -0.14 5.02 2.07 -1.35 -0.11 116.25 122.24 1qzq h VAL 444 Ca -0.45 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 1qzq h VAL 444 Cb 1.23 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1qzq h VAL 444 CO 0.62 0.09 -0.18 -0.08 0.02 0.00 0.00 177.57 178.04 1qzq h GLU 445 N 0.49 0.22 -0.37 1.57 4.57 -1.93 0.68 114.58 119.81 1qzq h GLU 445 Ca 0.41 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 58.53 1qzq h GLU 445 Cb 0.59 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.14 1qzq h GLU 445 CO -0.38 0.40 0.23 -0.91 -1.18 0.00 0.00 179.01 177.18 1qzq h ASN 446 N 0.21 0.44 -0.24 1.04 -0.26 -1.39 -2.49 115.58 112.89 1qzq h ASN 446 Ca 0.04 -0.05 -0.12 0.00 -0.56 0.00 0.00 56.30 55.61 1qzq h ASN 446 Cb 0.44 -0.11 -0.00 0.00 -1.06 0.00 0.00 38.32 37.59 1qzq h ASN 446 CO 0.03 0.36 -0.32 0.58 -1.06 0.00 0.00 177.43 177.02 1qzq h VAL 447 N 0.49 1.31 -0.67 2.81 2.07 -0.98 -2.70 116.25 118.58 1qzq h VAL 447 Ca 0.13 -1.51 0.03 0.00 0.82 0.00 0.00 66.70 66.17 1qzq h VAL 447 Cb -0.00 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 1qzq h VAL 447 CO -0.03 0.48 0.41 -0.09 0.02 0.00 0.00 177.57 178.36 1qzq h ARG 448 N 0.36 0.78 -0.20 1.57 2.43 -0.83 -2.23 114.38 116.25 1qzq h ARG 448 Ca 0.03 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1qzq h ARG 448 Cb 0.90 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.28 1qzq h ARG 448 CO 0.08 0.51 0.00 0.25 -1.51 0.00 0.00 179.97 179.30 1qzq n THR 449 N -4.70 0.26 -1.26 0.20 -2.24 -0.94 -2.99 114.28 102.60 1qzq n THR 449 Ca 0.07 -0.36 -0.30 0.00 -2.27 0.00 0.00 64.05 61.20 1qzq n THR 449 Cb 0.10 0.30 0.13 0.00 -2.10 0.00 0.00 70.33 68.75 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 -1.42 3.74 0.35 3.42 1.04 -0.84 -4.88 113.70 115.11 1qzq s SER 450 Ca 0.29 1.49 0.06 0.00 0.48 0.00 0.00 55.95 58.28 1qzq s SER 450 Cb 0.16 -2.19 0.73 0.00 0.10 0.00 0.00 66.02 64.82 1qzq s SER 450 CO 0.23 -2.47 1.91 -0.07 0.98 0.00 0.00 173.24 173.82 1qzq h LEU 451 N -1.43 0.70 0.00 2.42 3.38 -1.31 -2.13 115.31 116.94 1qzq h LEU 451 Ca -0.48 0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.41 1qzq h LEU 451 Cb 1.28 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 1qzq h LEU 451 CO 0.55 0.42 -0.93 -0.33 0.09 0.00 0.00 178.44 178.23 1qzq h GLU 452 N 0.78 0.00 0.00 1.13 5.08 -1.88 -3.48 114.58 116.21 1qzq h GLU 452 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1qzq h GLU 452 Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.68 1qzq h GLU 452 CO -0.15 0.26 0.00 0.41 -1.00 0.00 0.00 179.01 178.53 1qzq n GLY 453 N 1.27 -1.28 0.39 -3.84 0.00 -0.80 -3.97 105.19 96.97 1qzq n GLY 453 Ca -0.03 -1.36 0.18 0.00 0.00 0.00 0.00 46.02 44.81 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 0.33 -0.25 1.61 0.05 -1.81 -1.79 116.97 115.11 1qzq h TYR 454 Ca 0.00 0.01 0.07 0.00 0.05 0.00 0.00 58.73 58.86 1qzq h TYR 454 Cb 0.00 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 1qzq h TYR 454 CO 0.00 0.12 0.35 -1.35 -1.05 0.00 0.00 178.16 176.22 1qzq h PRO 455 N 0.28 0.00 0.00 4.88 0.11 -1.91 0.52 132.00 135.87 1qzq h PRO 455 Ca 0.36 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.43 1qzq h PRO 455 Cb 1.00 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 1qzq h PRO 455 CO -0.09 0.00 -0.16 0.00 -0.21 0.00 0.00 178.00 177.54 1qzq h ALA 456 N 1.55 1.71 0.00 -0.75 0.00 -1.54 -0.24 119.26 119.98 1qzq h ALA 456 Ca 0.12 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1qzq h ALA 456 Cb 0.81 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1qzq h ALA 456 CO -0.00 0.20 0.00 0.41 0.00 0.00 0.00 179.25 179.86 1qzq n GLY 457 N -1.05 -1.01 0.30 0.00 0.00 0.18 -1.25 105.19 102.36 1qzq n GLY 457 Ca -0.02 0.10 0.20 0.00 0.00 0.00 0.00 46.02 46.29 1qzq n GLY 457 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1qzq h GLY 458 N 1.26 0.00 -1.99 -0.02 0.00 -1.14 -2.60 103.07 98.58 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 4.13 -3.38 0.19 7.64 -0.38 -4.57 113.62 114.19 1qzq n SER 459 Ca -0.01 -2.83 -0.26 0.00 1.01 0.00 0.00 58.87 56.78 1qzq n SER 459 Cb 0.20 -0.53 -0.09 0.00 -1.01 0.00 0.00 64.21 62.79 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 -0.07 1.25 -2.37 -3.43 4.77 -0.98 -4.86 117.00 111.31 1qzq n LEU 460 Ca 0.21 -4.87 -0.11 0.00 -0.03 0.00 0.00 56.01 51.22 1qzq n LEU 460 Cb 0.88 0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 42.01 1qzq n LEU 460 CO 0.18 1.98 1.48 -0.81 -1.33 0.00 0.00 177.39 178.89 1qzq n PRO 461 N 1.66 1.50 -3.00 3.23 -0.04 -1.25 -4.10 135.00 133.00 1qzq n PRO 461 Ca 0.25 -0.83 -0.42 0.00 -0.04 0.00 0.00 63.50 62.46 1qzq n PRO 461 Cb 0.47 -1.95 -0.06 0.00 -0.04 0.00 0.00 33.50 31.92 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 1.99 3.14 0.19 0.54 5.04 -1.26 -4.79 117.35 122.19 1qzq s TYR 462 Ca 0.44 0.54 -0.13 0.00 -2.44 0.00 0.00 57.07 55.47 1qzq s TYR 462 Cb 0.19 -3.28 -0.07 0.00 0.35 0.00 0.00 41.96 39.14 1qzq s TYR 462 CO -0.01 -0.67 0.58 -1.54 -1.34 0.00 0.00 175.55 172.58 1qzq s SER 463 N 1.79 6.78 0.38 4.32 1.04 -1.26 -0.75 113.70 126.00 1qzq s SER 463 Ca 0.29 1.08 0.08 0.00 0.48 0.00 0.00 55.95 57.88 1qzq s SER 463 Cb -0.14 -2.29 0.83 0.00 0.10 0.00 0.00 66.02 64.52 1qzq s SER 463 CO 0.15 0.02 1.96 -0.29 0.98 0.00 0.00 173.24 176.07 1qzq h ILE 464 N 2.50 0.98 -0.46 -1.02 6.09 -1.92 -1.10 117.51 122.59 1qzq h ILE 464 Ca -0.48 -0.22 0.05 0.00 -1.37 0.00 0.00 64.86 62.83 1qzq h ILE 464 Cb 1.18 0.27 -0.04 0.00 0.47 0.00 0.00 36.82 38.70 1qzq h ILE 464 CO 0.67 0.12 0.20 1.56 -3.07 0.00 0.00 178.15 177.63 1qzq h GLN 465 N 0.65 0.39 -0.07 2.19 7.50 -1.98 -0.19 115.11 123.60 1qzq h GLN 465 Ca 0.30 -0.02 -0.03 0.00 0.50 0.00 0.00 58.65 59.39 1qzq h GLN 465 Cb 0.34 -0.09 -0.00 0.00 0.05 0.00 0.00 27.48 27.78 1qzq h GLN 465 CO -0.10 0.26 -0.09 1.15 -1.50 0.00 0.00 178.83 178.55 1qzq h THR 466 N 0.40 1.39 0.10 -0.54 2.02 -1.78 -3.35 112.91 111.15 1qzq h THR 466 Ca 0.21 -1.32 0.00 0.00 0.77 0.00 0.00 66.41 66.07 1qzq h THR 466 Cb 0.15 2.11 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 1qzq h THR 466 CO -0.17 0.36 -0.08 0.00 0.37 0.00 0.00 175.52 176.00 1qzq h ALA 467 N 0.52 -0.17 -0.21 6.16 0.00 -0.96 -2.87 119.26 121.74 1qzq h ALA 467 Ca 0.01 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1qzq h ALA 467 Cb 0.63 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1qzq h ALA 467 CO 0.02 -0.61 0.36 1.05 0.00 0.00 0.00 179.25 180.08 1qzq h GLU 468 N -0.20 0.00 -0.15 0.00 4.11 -1.18 0.26 114.58 117.43 1qzq h GLU 468 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1qzq h GLU 468 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1qzq h GLU 468 CO -0.02 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.69 1qzq n LYS 469 N -3.37 1.68 -2.70 1.06 4.76 -1.08 -4.30 118.16 114.20 1qzq n LYS 469 Ca 0.03 -1.02 -0.05 0.00 -2.87 0.00 0.00 58.31 54.40 1qzq n LYS 469 Cb 0.48 -1.39 0.10 0.00 -1.84 0.00 0.00 35.03 32.37 1qzq n LYS 469 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1qzq n GLN 470 N 0.25 1.31 0.24 1.97 10.64 0.07 -4.57 117.38 127.29 1qzq n GLN 470 Ca 0.16 -2.13 0.14 0.00 -1.83 0.00 0.00 57.00 53.34 1qzq n GLN 470 Cb 0.31 -0.33 0.75 0.00 -0.86 0.00 0.00 30.24 30.11 1qzq n GLN 470 CO 0.00 0.00 0.00 -0.91 -1.83 0.00 0.00 177.06 174.32 1qzq h ASN 471 N 1.96 0.00 0.02 2.61 2.35 -1.72 -0.78 115.58 120.02 1qzq h ASN 471 Ca -0.28 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.45 1qzq h ASN 471 Cb 1.27 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.64 1qzq h ASN 471 CO 0.03 0.00 -0.07 4.11 -1.65 0.00 0.00 177.43 179.85 1qzq h TRP 472 N 0.00 0.12 -0.33 1.19 5.08 -1.91 -2.80 115.95 117.30 1qzq h TRP 472 Ca 0.00 -0.01 -0.04 0.00 1.08 0.00 0.00 58.89 59.93 1qzq h TRP 472 Cb 0.22 -0.04 -0.02 0.00 -3.00 0.00 0.00 29.16 26.33 1qzq h TRP 472 CO 0.00 0.19 0.04 1.25 -1.28 0.00 0.00 178.44 178.65 1qzq h LEU 473 N 0.12 0.45 -0.08 0.11 5.85 -1.54 -3.04 115.31 117.18 1qzq h LEU 473 Ca 0.03 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1qzq h LEU 473 Cb 0.20 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1qzq h LEU 473 CO 0.01 0.48 0.00 1.41 -0.34 0.00 0.00 178.44 180.00 1qzq n HIS 474 N -4.33 0.08 0.58 1.25 8.25 -1.06 -1.70 115.22 118.29 1qzq n HIS 474 Ca 0.01 0.03 0.11 0.00 -0.26 0.00 0.00 57.72 57.62 1qzq n HIS 474 Cb 0.20 -0.55 0.45 0.00 1.12 0.00 0.00 29.99 31.21 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 -1.57 0.41 0.00 0.41 7.64 -1.15 -2.49 113.62 116.86 1qzq n SER 475 Ca 0.03 0.57 0.10 0.00 1.01 0.00 0.00 58.87 60.59 1qzq n SER 475 Cb 0.15 -0.67 -0.07 0.00 -1.01 0.00 0.00 64.21 62.62 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 -1.92 0.02 -2.30 1.43 4.01 -0.69 -5.00 117.16 112.71 1qzq n TYR 476 Ca 0.04 0.01 -0.41 0.00 -0.16 0.00 0.00 57.90 57.38 1qzq n TYR 476 Cb 0.28 -0.10 -0.03 0.00 -0.31 0.00 0.00 39.34 39.17 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 -3.05 3.33 0.08 -0.72 2.99 -1.04 -2.18 117.98 117.39 1qzq s PHE 477 Ca 0.07 1.47 0.07 0.00 0.00 0.00 0.00 56.93 58.53 1qzq s PHE 477 Cb 0.16 -3.49 -0.03 0.00 0.00 0.00 0.00 43.02 39.66 1qzq s PHE 477 CO 0.85 -1.32 -0.18 -1.01 -0.00 0.00 0.00 175.22 173.55 1qzq s HIS 478 N -0.68 1.58 0.75 0.36 3.76 0.19 -2.29 115.29 118.97 1qzq s HIS 478 Ca 0.50 -0.41 -0.11 0.00 -0.15 0.00 0.00 55.06 54.89 1qzq s HIS 478 Cb -0.35 -0.89 0.05 0.00 1.11 0.00 0.00 32.58 32.49 1qzq s HIS 478 CO 0.43 0.13 1.10 0.15 -0.85 0.00 0.00 174.74 175.69 1qzq s LYS 479 N -1.62 2.34 -0.10 1.40 1.02 0.14 -1.98 119.74 120.94 1qzq s LYS 479 Ca 0.04 1.22 -0.26 0.00 0.02 0.00 0.00 55.97 56.99 1qzq s LYS 479 Cb -0.09 -1.90 -0.02 0.00 -0.52 0.00 0.00 37.83 35.29 1qzq s LYS 479 CO 0.03 -1.59 0.83 -0.46 -0.92 0.00 0.00 175.35 173.24 1qzq s TRP 480 N -2.79 3.52 -0.08 3.18 -0.11 -1.26 -4.50 118.94 116.90 1qzq s TRP 480 Ca 0.62 1.36 -0.04 0.00 1.22 0.00 0.00 56.10 59.26 1qzq s TRP 480 Cb -0.18 -2.98 0.04 0.00 -1.50 0.00 0.00 33.47 28.85 1qzq s TRP 480 CO 0.53 -0.10 0.19 0.45 -4.62 0.00 0.00 176.95 173.40 1qzq s SER 481 N 1.02 -0.18 -0.36 5.86 0.15 -1.26 -4.95 113.70 113.97 1qzq s SER 481 Ca 0.41 0.39 0.14 0.00 0.70 0.00 0.00 55.95 57.59 1qzq s SER 481 Cb -0.18 0.29 0.43 0.00 -1.71 0.00 0.00 66.02 64.85 1qzq s SER 481 CO 0.17 -0.14 1.19 0.00 1.20 0.00 0.00 173.24 175.66 1qzq n ALA 482 N 4.06 2.28 -0.19 5.45 0.00 -1.26 -1.22 120.51 129.63 1qzq n ALA 482 Ca -0.24 -2.09 -0.00 0.00 0.00 0.00 0.00 53.44 51.11 1qzq n ALA 482 Cb 0.53 -0.96 0.23 0.00 0.00 0.00 0.00 19.45 19.26 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 2.37 0.94 -0.76 0.00 4.39 -1.91 0.25 114.58 119.86 1qzq h GLU 483 Ca -0.21 -0.09 0.19 0.00 0.34 0.00 0.00 59.36 59.59 1qzq h GLU 483 Cb 1.25 -0.20 -0.04 0.00 -0.10 0.00 0.00 28.75 29.66 1qzq h GLU 483 CO 0.16 0.67 0.53 0.00 -1.16 0.00 0.00 179.01 179.21 1qzq h THR 484 N 0.96 0.70 -0.14 1.13 1.03 -1.90 -0.04 112.91 114.64 1qzq h THR 484 Ca 0.25 -0.07 0.00 0.00 -0.01 0.00 0.00 66.41 66.57 1qzq h THR 484 Cb -0.01 0.47 0.00 0.00 -1.07 0.00 0.00 68.15 67.53 1qzq h THR 484 CO -0.04 0.04 0.00 -1.54 -0.01 0.00 0.00 175.52 173.96 1qzq n SER 485 N -4.41 2.68 -2.67 0.00 3.41 -0.73 -4.75 113.62 107.14 1qzq n SER 485 Ca 0.15 -2.44 -0.21 0.00 -0.26 0.00 0.00 58.87 56.11 1qzq n SER 485 Cb 0.69 -0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.39 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 -0.45 -0.51 0.57 5.00 0.00 -0.03 -4.89 105.19 104.88 1qzq n GLY 486 Ca 0.11 0.06 0.06 0.00 0.00 0.00 0.00 46.02 46.25 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 -3.45 1.38 0.28 1.61 1.74 0.72 -4.74 116.66 114.20 1qzq n ARG 487 Ca -0.19 -3.03 0.12 0.00 -0.77 0.00 0.00 57.85 53.97 1qzq n ARG 487 Cb 0.66 -1.46 0.78 0.00 -1.02 0.00 0.00 32.46 31.42 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 0.80 0.00 -0.13 0.55 0.02 -1.91 -2.15 113.55 110.73 1qzq h SER 488 Ca -0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1qzq h SER 488 Cb 1.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.61 1qzq h SER 488 CO 0.01 0.02 0.00 0.59 -1.14 0.00 0.00 176.83 176.31 1qzq n ASN 489 N -4.12 3.04 -4.27 3.07 3.02 -1.26 -4.75 115.26 109.99 1qzq n ASN 489 Ca -0.03 -1.95 -0.44 0.00 -0.03 0.00 0.00 54.58 52.13 1qzq n ASN 489 Cb 0.11 -0.07 -0.06 0.00 -0.61 0.00 0.00 39.78 39.14 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 -1.76 3.59 0.25 5.41 0.00 -0.81 -0.83 121.76 127.60 1qzq s ALA 490 Ca 0.30 -2.64 -0.30 0.00 0.00 0.00 0.00 51.96 49.31 1qzq s ALA 490 Cb 0.20 -3.10 -0.14 0.00 0.00 0.00 0.00 23.12 20.08 1qzq s ALA 490 CO 0.29 -2.00 1.25 -1.33 0.00 0.00 0.00 175.76 173.96 1qzq n MET 491 N 4.93 1.70 -2.46 0.00 2.81 -1.25 -3.42 117.12 119.43 1qzq n MET 491 Ca -0.08 0.60 -0.42 0.00 -1.81 0.00 0.00 57.70 55.99 1qzq n MET 491 Cb 0.41 -2.15 -0.03 0.00 -0.71 0.00 0.00 33.22 30.74 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 -0.88 4.37 0.00 0.03 0.04 -1.26 -0.44 135.00 136.86 1qzq s PRO 492 Ca 0.65 1.69 0.00 0.00 0.04 0.00 0.00 61.00 63.38 1qzq s PRO 492 Cb -0.69 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 30.33 1qzq s PRO 492 CO 0.54 -0.40 0.16 1.58 0.04 0.00 0.00 177.00 178.92 1qzq n HIS 493 N 4.93 0.00 -2.07 0.56 -0.00 -0.16 -4.62 115.22 113.86 1qzq n HIS 493 Ca 0.10 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.96 1qzq n HIS 493 Cb 0.46 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.33 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 -0.64 4.18 -0.02 3.57 2.07 -0.82 -4.84 121.20 124.70 1qzq s ILE 494 Ca 0.00 0.95 0.04 0.00 -1.41 0.00 0.00 60.65 60.23 1qzq s ILE 494 Cb 0.00 -3.55 -0.01 0.00 0.13 0.00 0.00 42.46 39.03 1qzq s ILE 494 CO 0.00 -0.69 -0.14 -0.54 -1.91 0.00 0.00 174.94 171.66 1qzq s LYS 495 N -4.35 1.32 0.05 3.50 3.01 -1.22 -4.50 119.74 117.55 1qzq s LYS 495 Ca 0.60 -0.50 -0.08 0.00 -1.01 0.00 0.00 55.97 54.98 1qzq s LYS 495 Cb -0.13 -1.22 -0.00 0.00 -1.01 0.00 0.00 37.83 35.47 1qzq s LYS 495 CO 0.40 0.25 0.16 0.95 0.51 0.00 0.00 175.35 177.62 1qzq s THR 496 N -0.10 0.13 -0.03 2.17 -4.23 -0.27 -1.76 115.64 111.56 1qzq s THR 496 Ca 0.01 -1.03 -0.02 0.00 -1.18 0.00 0.00 61.69 59.46 1qzq s THR 496 Cb -0.08 -1.02 0.01 0.00 1.34 0.00 0.00 72.50 72.75 1qzq s THR 496 CO 0.01 -0.57 0.08 -0.31 -0.54 0.00 0.00 174.62 173.28 1qzq s TYR 497 N -2.90 -0.08 0.26 3.99 2.02 -0.42 -1.02 117.35 119.20 1qzq s TYR 497 Ca -0.02 0.21 -0.16 0.00 -0.37 0.00 0.00 57.07 56.73 1qzq s TYR 497 Cb 0.01 0.01 0.00 0.00 -0.40 0.00 0.00 41.96 41.58 1qzq s TYR 497 CO -0.06 -0.05 0.57 0.00 -1.57 0.00 0.00 175.55 174.44 1qzq s MET 498 N 0.17 1.63 -0.56 -0.62 0.23 -0.84 0.32 119.30 119.62 1qzq s MET 498 Ca -0.01 -1.15 0.04 0.00 -1.03 0.00 0.00 55.69 53.54 1qzq s MET 498 Cb -0.02 0.52 0.16 0.00 -1.53 0.00 0.00 34.83 33.97 1qzq s MET 498 CO -0.00 -0.71 0.40 0.50 -2.03 0.00 0.00 175.02 173.18 1qzq s ARG 499 N -3.98 1.74 0.78 3.16 6.06 -1.07 -1.60 118.95 124.04 1qzq s ARG 499 Ca 0.18 -2.73 -0.11 0.00 -2.50 0.00 0.00 55.73 50.57 1qzq s ARG 499 Cb -0.03 -2.55 0.06 0.00 0.06 0.00 0.00 34.95 32.49 1qzq s ARG 499 CO 0.08 -1.31 1.10 -1.25 -2.50 0.00 0.00 175.30 171.42 1qzq s PRO 500 N -0.67 2.23 0.88 5.12 0.04 -1.23 -0.37 135.00 140.99 1qzq s PRO 500 Ca 0.27 0.60 -0.12 0.00 0.04 0.00 0.00 61.00 61.79 1qzq s PRO 500 Cb -0.04 -1.94 0.12 0.00 0.04 0.00 0.00 34.50 32.68 1qzq s PRO 500 CO -0.16 -1.51 1.14 -1.54 0.04 0.00 0.00 177.00 174.97 1qzq s SER 501 N -4.00 3.79 0.55 6.66 1.04 0.15 -2.94 113.70 118.95 1qzq s SER 501 Ca 0.60 0.95 0.26 0.00 0.48 0.00 0.00 55.95 58.25 1qzq s SER 501 Cb -0.14 -1.52 1.46 0.00 0.10 0.00 0.00 66.02 65.92 1qzq s SER 501 CO 0.54 -2.37 2.00 -0.65 0.98 0.00 0.00 173.24 173.73 1qzq h PRO 502 N -1.38 0.00 -0.44 4.02 0.11 -1.91 -0.45 132.00 131.95 1qzq h PRO 502 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1qzq h PRO 502 Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.44 1qzq h PRO 502 CO 0.63 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.02 1qzq n ASP 503 N -4.16 3.26 -0.54 -2.05 5.75 -1.26 -4.97 116.55 112.57 1qzq n ASP 503 Ca 0.08 -1.95 -0.07 0.00 -0.01 0.00 0.00 54.79 52.84 1qzq n ASP 503 Cb 0.57 -0.29 -0.03 0.00 -1.03 0.00 0.00 41.12 40.34 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 1.07 0.00 0.78 2.11 3.01 -0.18 -4.83 117.46 119.42 1qzq n PHE 504 Ca 0.17 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.76 1qzq n PHE 504 Cb 0.51 -2.35 0.41 0.00 -0.01 0.00 0.00 39.48 38.04 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 -0.98 0.49 -3.90 4.37 3.41 -1.26 -4.77 113.62 110.98 1qzq n SER 505 Ca -0.07 0.35 -0.09 0.00 -0.26 0.00 0.00 58.87 58.80 1qzq n SER 505 Cb 0.52 -0.38 -0.07 0.00 -0.26 0.00 0.00 64.21 64.03 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 -3.07 1.11 0.04 4.33 -2.85 -1.26 -1.74 119.74 116.30 1qzq s LYS 506 Ca 0.11 -1.07 0.03 0.00 -1.00 0.00 0.00 55.97 54.04 1qzq s LYS 506 Cb 0.15 0.39 -0.02 0.00 -2.06 0.00 0.00 37.83 36.29 1qzq s LYS 506 CO 0.61 -0.41 -0.09 0.96 0.10 0.00 0.00 175.35 176.52 1qzq s ILE 507 N -3.93 0.69 -0.46 3.79 -4.36 -0.39 0.32 121.20 116.86 1qzq s ILE 507 Ca 0.13 -0.97 0.24 0.00 -0.26 0.00 0.00 60.65 59.79 1qzq s ILE 507 Cb 0.03 -0.69 0.13 0.00 1.25 0.00 0.00 42.46 43.17 1qzq s ILE 507 CO -0.03 -0.22 1.35 0.00 0.24 0.00 0.00 174.94 176.27 1qzq h ALA 508 N 4.77 0.70 -1.07 2.27 0.00 -1.03 -1.80 119.26 123.10 1qzq h ALA 508 Ca -0.36 0.00 0.34 0.00 0.00 0.00 0.00 54.91 54.89 1qzq h ALA 508 Cb 1.20 0.00 -0.19 0.00 0.00 0.00 0.00 17.79 18.79 1qzq h ALA 508 CO 0.43 0.00 0.97 1.67 0.00 0.00 0.00 179.25 182.32 1qzq s TRP 509 N -3.24 -0.02 -0.06 0.00 1.48 -1.26 -4.34 118.94 111.50 1qzq s TRP 509 Ca 0.05 0.01 -0.05 0.00 -1.06 0.00 0.00 56.10 55.04 1qzq s TRP 509 Cb 0.10 0.50 0.02 0.00 -1.16 0.00 0.00 33.47 32.93 1qzq s TRP 509 CO 0.72 -0.03 0.16 0.12 -4.06 0.00 0.00 176.95 173.86 1qzq s PHE 510 N -2.06 -0.18 -0.06 1.66 5.36 -0.84 -2.60 117.98 119.26 1qzq s PHE 510 Ca 0.12 0.46 0.03 0.00 -0.96 0.00 0.00 56.93 56.58 1qzq s PHE 510 Cb 0.01 0.04 0.00 0.00 -0.34 0.00 0.00 43.02 42.73 1qzq s PHE 510 CO -0.03 -0.11 -0.16 -1.17 -1.46 0.00 0.00 175.22 172.30 1qzq s LEU 511 N 0.32 1.83 -0.07 6.12 2.96 0.15 -0.56 118.68 129.42 1qzq s LEU 511 Ca -0.02 -0.35 0.05 0.00 -0.22 0.00 0.00 54.13 53.59 1qzq s LEU 511 Cb -0.03 -0.95 -0.01 0.00 0.50 0.00 0.00 46.19 45.70 1qzq s LEU 511 CO -0.01 0.10 -0.24 0.54 -1.32 0.00 0.00 176.35 175.42 1qzq s VAL 512 N 0.32 2.13 0.35 1.68 0.11 -1.07 -1.30 120.40 122.61 1qzq s VAL 512 Ca -0.10 -1.03 -0.17 0.00 -2.93 0.00 0.00 61.98 57.76 1qzq s VAL 512 Cb -0.14 -1.79 0.04 0.00 -1.53 0.00 0.00 36.38 32.97 1qzq s VAL 512 CO 0.03 0.57 0.75 0.28 -3.33 0.00 0.00 175.10 173.40 1qzq s THR 513 N -0.01 0.00 -0.90 5.04 -1.32 -0.72 -1.18 115.64 116.55 1qzq s THR 513 Ca -0.08 -1.03 0.25 0.00 -1.21 0.00 0.00 61.69 59.61 1qzq s THR 513 Cb -0.15 -2.57 -0.00 0.00 -1.51 0.00 0.00 72.50 68.27 1qzq s THR 513 CO 0.05 0.00 1.35 -1.54 -2.21 0.00 0.00 174.62 172.27 1qzq n SER 514 N -1.08 0.56 -4.63 8.08 3.41 -0.58 -3.41 113.62 115.97 1qzq n SER 514 Ca -0.06 -0.19 -0.43 0.00 -0.26 0.00 0.00 58.87 57.92 1qzq n SER 514 Cb 0.60 0.30 -0.02 0.00 -0.26 0.00 0.00 64.21 64.83 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 -3.05 3.30 0.96 7.33 0.00 -1.26 -4.94 121.76 124.10 1qzq s ALA 515 Ca 0.09 0.27 -0.15 0.00 0.00 0.00 0.00 51.96 52.18 1qzq s ALA 515 Cb 0.16 -3.82 0.21 0.00 0.00 0.00 0.00 23.12 19.68 1qzq s ALA 515 CO 0.72 -1.89 1.31 -0.80 0.00 0.00 0.00 175.76 175.10 1qzq s ASN 516 N 3.56 3.03 -1.28 0.00 0.01 -1.26 -4.86 114.94 114.15 1qzq s ASN 516 Ca 0.64 0.08 -0.16 0.00 -0.71 0.00 0.00 52.86 52.71 1qzq s ASN 516 Cb -0.21 -0.08 0.10 0.00 0.41 0.00 0.00 41.25 41.47 1qzq s ASN 516 CO 0.26 -2.77 1.67 -0.11 -1.51 0.00 0.00 177.10 174.64 1qzq n LEU 517 N -3.72 5.12 -3.72 0.60 7.94 -1.12 -4.71 117.00 117.38 1qzq n LEU 517 Ca 0.17 -4.10 -0.14 0.00 -1.11 0.00 0.00 56.01 50.82 1qzq n LEU 517 Cb 0.59 -1.70 -0.08 0.00 0.53 0.00 0.00 43.42 42.76 1qzq n LEU 517 CO 0.43 0.38 0.10 -0.94 -1.11 0.00 0.00 177.39 176.25 1qzq s SER 518 N 3.71 -0.27 0.38 1.96 1.04 -1.26 -1.22 113.70 118.04 1qzq s SER 518 Ca 0.50 0.19 0.09 0.00 0.48 0.00 0.00 55.95 57.22 1qzq s SER 518 Cb 0.02 0.35 0.78 0.00 0.10 0.00 0.00 66.02 67.27 1qzq s SER 518 CO 0.05 -0.48 1.91 0.11 0.98 0.00 0.00 173.24 175.81 1qzq h LYS 519 N 3.69 0.24 -0.99 4.02 1.57 -1.87 -2.01 116.57 121.21 1qzq h LYS 519 Ca -0.29 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.46 1qzq h LYS 519 Cb 1.17 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.39 1qzq h LYS 519 CO 0.40 0.38 0.65 0.00 -0.57 0.00 0.00 179.45 180.31 1qzq h ALA 520 N 1.64 1.29 0.09 3.86 0.00 -1.91 0.21 119.26 124.46 1qzq h ALA 520 Ca 0.05 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1qzq h ALA 520 Cb 0.38 -0.37 0.01 0.00 0.00 0.00 0.00 17.79 17.81 1qzq h ALA 520 CO 0.02 0.57 -0.78 0.00 0.00 0.00 0.00 179.25 179.07 1qzq h ALA 521 N 1.39 0.01 0.00 0.00 0.00 -1.77 -2.48 119.26 116.41 1qzq h ALA 521 Ca 0.38 -0.76 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1qzq h ALA 521 Cb -0.05 0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1qzq h ALA 521 CO -0.11 0.40 -1.04 0.91 0.00 0.00 0.00 179.25 179.42 1qzq n TRP 522 N -4.21 0.71 0.00 0.00 7.02 -0.80 -4.76 117.44 115.39 1qzq n TRP 522 Ca -0.16 0.21 0.00 0.00 -1.02 0.00 0.00 57.50 56.52 1qzq n TRP 522 Cb 0.75 -0.79 0.00 0.00 -2.42 0.00 0.00 31.31 28.86 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 1.24 1.71 3.07 6.99 0.00 0.75 -1.12 105.19 117.84 1qzq n GLY 523 Ca 0.00 -1.70 -0.24 0.00 0.00 0.00 0.00 46.02 44.08 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 -2.19 1.30 0.25 4.61 0.00 -0.00 -4.80 121.76 120.92 1qzq s ALA 524 Ca 0.00 -0.52 -0.30 0.00 0.00 0.00 0.00 51.96 51.14 1qzq s ALA 524 Cb 0.00 -0.49 -0.10 0.00 0.00 0.00 0.00 23.12 22.53 1qzq s ALA 524 CO 0.00 0.19 1.41 -0.51 0.00 0.00 0.00 175.76 176.86 1qzq s LEU 525 N 0.28 4.39 0.37 0.00 1.43 -1.26 -0.99 118.68 122.90 1qzq s LEU 525 Ca -0.07 2.64 0.04 0.00 -1.03 0.00 0.00 54.13 55.71 1qzq s LEU 525 Cb -0.12 -3.62 -0.03 0.00 0.03 0.00 0.00 46.19 42.44 1qzq s LEU 525 CO 0.02 -0.67 0.16 -1.61 0.23 0.00 0.00 176.35 174.48 1qzq s GLU 526 N -0.46 1.81 -1.22 1.70 2.02 0.22 -4.82 118.70 117.95 1qzq s GLU 526 Ca 0.58 -2.08 -0.15 0.00 0.02 0.00 0.00 54.97 53.35 1qzq s GLU 526 Cb -0.41 -0.35 -0.00 0.00 0.10 0.00 0.00 34.13 33.47 1qzq s GLU 526 CO 0.43 -0.49 0.68 1.63 0.02 0.00 0.00 175.26 177.54 1qzq n LYS 527 N -0.78 -1.97 -3.75 1.61 4.76 -1.26 -1.92 118.16 114.85 1qzq n LYS 527 Ca -0.02 0.44 -0.26 0.00 -2.87 0.00 0.00 58.31 55.60 1qzq n LYS 527 Cb 0.65 -4.24 0.05 0.00 -1.84 0.00 0.00 35.03 29.64 1qzq n LYS 527 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1qzq n ASN 528 N -2.76 -4.30 0.00 4.39 5.15 -1.26 -1.87 115.26 114.60 1qzq n ASN 528 Ca -0.16 -0.71 0.00 0.00 -0.60 0.00 0.00 54.58 53.11 1qzq n ASN 528 Cb 0.62 -4.34 0.00 0.00 -0.53 0.00 0.00 39.78 35.53 1qzq n ASN 528 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1qzq n GLY 529 N -1.71 0.42 0.02 8.20 0.00 -1.00 -4.90 105.19 106.23 1qzq n GLY 529 Ca -0.06 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.57 0.00 -4.28 2.61 -2.24 -0.78 -4.89 114.28 102.12 1qzq n THR 530 Ca 0.00 -0.01 -0.19 0.00 -2.27 0.00 0.00 64.05 61.58 1qzq n THR 530 Cb 0.12 0.85 -0.15 0.00 -2.10 0.00 0.00 70.33 69.04 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 -2.98 0.78 -0.24 -0.78 0.74 -0.81 -4.33 119.66 112.05 1qzq s GLN 531 Ca 0.09 -0.23 -0.07 0.00 0.05 0.00 0.00 55.36 55.20 1qzq s GLN 531 Cb 0.16 -0.75 -0.03 0.00 1.10 0.00 0.00 33.01 33.49 1qzq s GLN 531 CO 0.82 0.08 0.06 -1.17 -0.55 0.00 0.00 175.29 174.53 1qzq s LEU 532 N 0.25 3.41 -0.20 3.68 2.96 0.10 0.69 118.68 129.58 1qzq s LEU 532 Ca -0.03 -0.21 -0.07 0.00 -0.22 0.00 0.00 54.13 53.60 1qzq s LEU 532 Cb -0.08 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1qzq s LEU 532 CO 0.00 -0.02 0.06 -0.32 -1.32 0.00 0.00 176.35 174.75 1qzq s MET 533 N 1.55 3.88 -0.07 1.98 -2.45 -0.17 -0.50 119.30 123.52 1qzq s MET 533 Ca 0.06 -0.39 0.04 0.00 -1.25 0.00 0.00 55.69 54.15 1qzq s MET 533 Cb -0.15 -3.23 0.00 0.00 1.25 0.00 0.00 34.83 32.70 1qzq s MET 533 CO 0.03 0.15 -0.19 0.42 1.05 0.00 0.00 175.02 176.48 1qzq s ILE 534 N 0.70 1.62 -0.12 10.11 1.01 0.07 -0.82 121.20 133.76 1qzq s ILE 534 Ca 0.03 -0.79 0.12 0.00 0.00 0.00 0.00 60.65 60.02 1qzq s ILE 534 Cb -0.13 -1.41 -0.24 0.00 0.01 0.00 0.00 42.46 40.69 1qzq s ILE 534 CO 0.02 0.46 0.36 0.54 0.00 0.00 0.00 174.94 176.32 1qzq n ARG 535 N 3.41 0.67 -4.11 2.79 1.74 -0.96 -0.67 116.66 119.52 1qzq n ARG 535 Ca -0.20 0.17 -0.26 0.00 -0.77 0.00 0.00 57.85 56.79 1qzq n ARG 535 Cb 0.52 -1.67 -0.05 0.00 -1.02 0.00 0.00 32.46 30.25 1qzq n ARG 535 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1qzq s SER 536 N -5.97 4.49 -0.18 0.55 0.01 -1.03 -4.08 113.70 107.49 1qzq s SER 536 Ca -0.10 -1.22 -0.08 0.00 1.31 0.00 0.00 55.95 55.86 1qzq s SER 536 Cb 0.07 0.02 -0.04 0.00 0.21 0.00 0.00 66.02 66.28 1qzq s SER 536 CO 0.81 -0.81 0.08 -0.31 0.41 0.00 0.00 173.24 173.42 1qzq s TYR 537 N -2.70 3.31 0.04 2.43 1.51 0.22 -3.15 117.35 119.01 1qzq s TYR 537 Ca 0.33 0.17 -0.05 0.00 -1.01 0.00 0.00 57.07 56.51 1qzq s TYR 537 Cb 0.01 -2.08 -0.01 0.00 -0.11 0.00 0.00 41.96 39.77 1qzq s TYR 537 CO 0.19 0.24 0.08 -1.21 -1.11 0.00 0.00 175.55 173.74 1qzq s GLU 538 N 0.23 0.60 -0.12 -0.62 0.41 -0.50 -1.17 118.70 117.52 1qzq s GLU 538 Ca 0.05 -0.83 -0.15 0.00 -0.41 0.00 0.00 54.97 53.64 1qzq s GLU 538 Cb -0.12 0.23 0.04 0.00 -1.78 0.00 0.00 34.13 32.50 1qzq s GLU 538 CO -0.00 -0.15 0.40 -1.17 -0.49 0.00 0.00 175.26 173.85 1qzq s LEU 539 N -2.27 0.49 0.34 1.80 2.96 -1.26 -0.70 118.68 120.04 1qzq s LEU 539 Ca -0.03 0.68 -0.14 0.00 -0.22 0.00 0.00 54.13 54.42 1qzq s LEU 539 Cb 0.00 1.40 0.03 0.00 0.50 0.00 0.00 46.19 48.13 1qzq s LEU 539 CO -0.06 -0.21 0.68 -0.83 -1.32 0.00 0.00 176.35 174.62 1qzq s GLY 540 N -0.10 0.50 -0.01 7.98 0.00 -0.35 -1.52 107.32 113.82 1qzq s GLY 540 Ca -0.03 -0.82 0.04 0.00 0.00 0.00 0.00 44.72 43.91 1qzq s GLY 540 CO 0.02 -0.43 -0.12 -1.34 0.00 0.00 0.00 173.10 171.23 1qzq s VAL 541 N -2.96 0.95 -0.15 1.40 -7.23 -0.32 -1.55 120.40 110.54 1qzq s VAL 541 Ca 0.18 -0.51 -0.06 0.00 -1.81 0.00 0.00 61.98 59.78 1qzq s VAL 541 Cb -0.04 -0.80 -0.04 0.00 0.56 0.00 0.00 36.38 36.06 1qzq s VAL 541 CO 0.12 0.27 0.05 -0.22 -0.31 0.00 0.00 175.10 175.01 1qzq s LEU 542 N -0.24 3.80 -0.34 1.32 2.96 0.47 -2.59 118.68 124.06 1qzq s LEU 542 Ca 0.04 0.13 -0.08 0.00 -0.22 0.00 0.00 54.13 54.00 1qzq s LEU 542 Cb -0.05 -1.93 0.03 0.00 0.50 0.00 0.00 46.19 44.73 1qzq s LEU 542 CO -0.00 0.25 0.14 -0.36 -1.32 0.00 0.00 176.35 175.06 1qzq s PHE 543 N -0.09 3.23 -0.12 5.38 0.40 0.27 -1.94 117.98 125.10 1qzq s PHE 543 Ca 0.06 -1.14 -0.01 0.00 -0.60 0.00 0.00 56.93 55.24 1qzq s PHE 543 Cb -0.12 -2.33 -0.02 0.00 0.51 0.00 0.00 43.02 41.05 1qzq s PHE 543 CO 0.01 -0.66 -0.09 -0.51 0.70 0.00 0.00 175.22 174.67 1qzq s LEU 544 N 1.48 2.94 0.26 -0.37 1.43 -1.26 -1.98 118.68 121.19 1qzq s LEU 544 Ca 0.01 -0.22 -0.02 0.00 -1.03 0.00 0.00 54.13 52.87 1qzq s LEU 544 Cb -0.19 -1.67 0.56 0.00 0.03 0.00 0.00 46.19 44.92 1qzq s LEU 544 CO 0.04 0.20 1.69 -0.65 0.23 0.00 0.00 176.35 177.87 1qzq h PRO 545 N 6.43 0.32 -0.83 1.29 0.11 -1.83 -0.25 132.00 137.24 1qzq h PRO 545 Ca -0.32 -0.02 0.16 0.00 0.11 0.00 0.00 66.00 65.93 1qzq h PRO 545 Cb 1.20 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.18 1qzq h PRO 545 CO 0.57 0.21 0.54 0.66 -0.21 0.00 0.00 178.00 179.78 1qzq h SER 546 N 0.33 0.47 0.67 -2.05 4.64 -1.77 0.43 113.55 116.27 1qzq h SER 546 Ca 0.47 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 1qzq h SER 546 Cb 0.83 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 1qzq h SER 546 CO -0.51 0.23 0.00 0.00 -0.87 0.00 0.00 176.83 175.67 1qzq n ALA 547 N -2.50 1.81 -0.50 5.18 0.00 -0.11 -2.23 120.51 122.17 1qzq n ALA 547 Ca 0.16 -0.04 0.05 0.00 0.00 0.00 0.00 53.44 53.62 1qzq n ALA 547 Cb 0.55 -1.31 0.11 0.00 0.00 0.00 0.00 19.45 18.80 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 -1.65 0.23 -0.93 0.00 3.72 0.13 -4.93 117.46 114.03 1qzq n PHE 548 Ca 0.04 -0.71 0.00 0.00 -0.05 0.00 0.00 57.45 56.73 1qzq n PHE 548 Cb 0.22 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 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 -0.60 0.59 4.01 1.37 0.00 -0.75 -5.00 105.19 104.80 1qzq n GLY 549 Ca 0.10 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 3.61 -0.16 0.99 1.43 -0.15 -4.94 118.68 119.46 1qzq s LEU 550 Ca 0.00 -0.37 0.19 0.00 -1.03 0.00 0.00 54.13 52.91 1qzq s LEU 550 Cb 0.00 -2.68 -0.27 0.00 0.03 0.00 0.00 46.19 43.27 1qzq s LEU 550 CO 0.00 -0.81 0.17 -0.67 0.23 0.00 0.00 176.35 175.27 1qzq n ASP 551 N -1.91 0.02 -3.71 2.29 2.03 -1.26 -2.92 116.55 111.08 1qzq n ASP 551 Ca 0.08 0.01 -0.07 0.00 0.52 0.00 0.00 54.79 55.33 1qzq n ASP 551 Cb 0.59 1.20 -0.02 0.00 -0.72 0.00 0.00 41.12 42.18 1qzq n ASP 551 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1qzq s SER 552 N -5.28 -0.30 -0.04 1.67 1.04 -1.26 -4.86 113.70 104.67 1qzq s SER 552 Ca -0.09 -0.37 -0.01 0.00 0.48 0.00 0.00 55.95 55.95 1qzq s SER 552 Cb 0.08 0.60 -0.04 0.00 0.10 0.00 0.00 66.02 66.76 1qzq s SER 552 CO 0.85 -1.07 0.04 -0.36 0.98 0.00 0.00 173.24 173.68 1qzq s PHE 553 N -3.61 3.21 0.17 5.02 2.99 -0.68 -4.95 117.98 120.14 1qzq s PHE 553 Ca 0.09 0.20 -0.15 0.00 0.00 0.00 0.00 56.93 57.07 1qzq s PHE 553 Cb -0.03 -1.75 -0.07 0.00 0.00 0.00 0.00 43.02 41.16 1qzq s PHE 553 CO 0.00 0.51 0.58 0.15 -0.00 0.00 0.00 175.22 176.47 1qzq s LYS 554 N -1.33 4.01 0.05 0.44 1.02 -1.26 -1.26 119.74 121.40 1qzq s LYS 554 Ca 0.18 0.54 -0.22 0.00 0.02 0.00 0.00 55.97 56.49 1qzq s LYS 554 Cb -0.12 -2.88 -0.06 0.00 -0.52 0.00 0.00 37.83 34.25 1qzq s LYS 554 CO 0.08 0.44 0.66 0.08 -0.92 0.00 0.00 175.35 175.69 1qzq s VAL 555 N -1.52 4.74 -0.38 3.17 1.01 -0.71 0.40 120.40 127.11 1qzq s VAL 555 Ca 0.40 1.41 -0.20 0.00 0.00 0.00 0.00 61.98 63.59 1qzq s VAL 555 Cb -0.15 -4.00 0.01 0.00 0.00 0.00 0.00 36.38 32.24 1qzq s VAL 555 CO 0.19 0.45 0.61 -0.75 0.00 0.00 0.00 175.10 175.60 1qzq s LYS 556 N -0.50 3.53 0.00 2.72 2.20 -0.32 -4.83 119.74 122.54 1qzq s LYS 556 Ca 0.33 -0.15 0.00 0.00 -0.36 0.00 0.00 55.97 55.80 1qzq s LYS 556 Cb -0.20 -3.86 0.00 0.00 -1.51 0.00 0.00 37.83 32.26 1qzq s LYS 556 CO 0.20 -0.81 0.00 1.04 -0.36 0.00 0.00 175.35 175.43 1qzq n GLN 557 N 6.04 1.59 0.04 4.03 1.13 -1.26 -4.28 117.38 124.67 1qzq n GLN 557 Ca -0.02 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.88 1qzq n GLN 557 Cb 0.48 0.00 -0.14 0.00 0.11 0.00 0.00 30.24 30.69 1qzq n GLN 557 CO 0.00 0.00 0.00 -0.22 -1.44 0.00 0.00 177.06 175.40 1qzq h LYS 558 N 0.00 0.21 0.00 -1.09 1.63 -1.94 -3.48 116.57 111.90 1qzq h LYS 558 Ca 0.00 -0.36 0.00 0.00 -0.85 0.00 0.00 60.65 59.44 1qzq h LYS 558 Cb 0.00 0.14 0.00 0.00 -0.60 0.00 0.00 32.23 31.77 1qzq h LYS 558 CO 0.00 1.04 -0.38 0.35 -3.45 0.00 0.00 179.45 177.01 1qzq h PHE 559 N 0.06 0.00 0.00 1.91 3.57 -1.97 -3.49 116.94 117.02 1qzq h PHE 559 Ca -0.26 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.24 1qzq h PHE 559 Cb 2.01 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.75 1qzq h PHE 559 CO 0.05 0.00 0.00 0.25 -2.23 0.00 0.00 178.31 176.38 1qzq n THR 569 N -2.87 0.00 -2.80 4.41 -2.24 -1.26 -5.16 114.28 104.36 1qzq n THR 569 Ca 0.03 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.40 1qzq n THR 569 Cb 0.53 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.71 1qzq n THR 569 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1qzq s PHE 570 N -0.66 3.77 -1.17 4.78 5.36 0.16 -4.73 117.98 125.49 1qzq s PHE 570 Ca 0.00 1.70 -0.19 0.00 -0.96 0.00 0.00 56.93 57.48 1qzq s PHE 570 Cb 0.00 -3.00 0.09 0.00 -0.34 0.00 0.00 43.02 39.77 1qzq s PHE 570 CO 0.00 0.20 1.54 -1.25 -1.46 0.00 0.00 175.22 174.25 1qzq s PRO 571 N 0.09 3.86 -0.04 10.12 0.04 -1.26 -1.17 135.00 146.64 1qzq s PRO 571 Ca 0.45 -1.84 -0.30 0.00 0.04 0.00 0.00 61.00 59.35 1qzq s PRO 571 Cb -0.22 -5.34 -0.04 0.00 0.04 0.00 0.00 34.50 28.94 1qzq s PRO 571 CO 0.28 -2.10 1.29 0.08 0.04 0.00 0.00 177.00 176.58 1qzq s VAL 572 N 3.78 4.03 -0.52 -0.36 1.01 -1.26 -4.92 120.40 122.17 1qzq s VAL 572 Ca 0.47 1.37 0.22 0.00 0.00 0.00 0.00 61.98 64.05 1qzq s VAL 572 Cb 0.01 -3.88 0.23 0.00 0.00 0.00 0.00 36.38 32.73 1qzq s VAL 572 CO -0.00 -0.01 1.67 -0.81 0.00 0.00 0.00 175.10 175.95 1qzq n PRO 573 N 5.40 0.17 -4.44 2.72 -0.04 -1.26 -4.82 135.00 132.72 1qzq n PRO 573 Ca 0.12 0.42 -0.22 0.00 -0.04 0.00 0.00 63.50 63.79 1qzq n PRO 573 Cb 0.45 -1.84 -0.10 0.00 -0.04 0.00 0.00 33.50 31.97 1qzq n PRO 573 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1qzq s TYR 574 N -3.30 1.98 0.40 0.54 1.13 -1.26 -4.28 117.35 112.56 1qzq s TYR 574 Ca 0.04 -0.74 -0.25 0.00 -1.41 0.00 0.00 57.07 54.71 1qzq s TYR 574 Cb 0.09 -1.18 -0.09 0.00 -1.10 0.00 0.00 41.96 39.68 1qzq s TYR 574 CO 0.36 0.24 1.11 -0.51 -2.51 0.00 0.00 175.55 174.24 1qzq s ASP 575 N -3.46 6.62 0.04 -0.18 -0.00 -0.36 -4.92 116.67 114.41 1qzq s ASP 575 Ca 0.31 2.19 0.06 0.00 -0.00 0.00 0.00 52.55 55.12 1qzq s ASP 575 Cb 0.05 -2.60 -0.02 0.00 -0.00 0.00 0.00 42.92 40.35 1qzq s ASP 575 CO 0.13 -0.59 -0.18 -0.76 -0.00 0.00 0.00 175.17 173.76 1qzq s LEU 576 N -2.57 2.16 0.80 1.23 1.43 -1.26 -4.02 118.68 116.45 1qzq s LEU 576 Ca 0.58 -0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 53.07 1qzq s LEU 576 Cb -0.26 -0.84 0.07 0.00 0.03 0.00 0.00 46.19 45.19 1qzq s LEU 576 CO 0.33 0.12 1.11 -2.16 0.23 0.00 0.00 176.35 175.98 1qzq s PRO 577 N -1.12 2.04 0.42 1.29 0.04 -1.26 -5.09 135.00 131.32 1qzq s PRO 577 Ca 0.05 0.49 -0.23 0.00 0.04 0.00 0.00 61.00 61.35 1qzq s PRO 577 Cb -0.08 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 32.44 1qzq s PRO 577 CO 0.01 -1.62 1.06 -2.14 0.04 0.00 0.00 177.00 174.36 1qzq s PRO 578 N -5.26 4.07 -0.19 0.56 0.02 -1.26 -5.02 135.00 127.94 1qzq s PRO 578 Ca 0.61 1.53 -0.14 0.00 0.02 0.00 0.00 61.00 63.02 1qzq s PRO 578 Cb -0.14 -2.48 -0.04 0.00 0.02 0.00 0.00 34.50 31.86 1qzq s PRO 578 CO 0.53 -0.22 0.31 -2.00 -0.33 0.00 0.00 177.00 175.28 1qzq s GLU 579 N -2.60 4.20 0.53 5.54 2.12 -1.26 -4.96 118.70 122.27 1qzq s GLU 579 Ca 0.60 0.07 -0.21 0.00 0.36 0.00 0.00 54.97 55.78 1qzq s GLU 579 Cb -0.22 -3.48 -0.05 0.00 0.26 0.00 0.00 34.13 30.63 1qzq s GLU 579 CO 0.28 0.12 1.26 -1.17 -0.54 0.00 0.00 175.26 175.21 1qzq s LEU 580 N 0.84 3.86 0.52 2.70 2.96 -1.26 0.29 118.68 128.59 1qzq s LEU 580 Ca 0.16 2.54 -0.22 0.00 -0.22 0.00 0.00 54.13 56.39 1qzq s LEU 580 Cb -0.14 -4.33 -0.07 0.00 0.50 0.00 0.00 46.19 42.15 1qzq s LEU 580 CO 0.05 -1.37 1.17 -1.22 -1.32 0.00 0.00 176.35 173.66 1qzq n TYR 581 N -0.98 1.65 -1.98 5.38 4.02 -0.97 -4.66 117.16 119.63 1qzq n TYR 581 Ca 0.10 0.47 -0.29 0.00 -0.01 0.00 0.00 57.90 58.17 1qzq n TYR 581 Cb 0.47 -2.28 0.07 0.00 -0.02 0.00 0.00 39.34 37.58 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 -0.91 1.62 0.57 2.72 0.00 -1.26 -4.91 107.32 105.15 1qzq s GLY 582 Ca 0.69 -0.59 0.27 0.00 0.00 0.00 0.00 44.72 45.10 1qzq s GLY 582 CO 0.51 -0.17 2.23 1.48 0.00 0.00 0.00 173.10 177.16 1qzq h SER 583 N -0.78 0.00 -0.09 1.64 4.64 -2.05 -0.87 113.55 116.04 1qzq h SER 583 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1qzq h SER 583 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1qzq h SER 583 CO 0.64 0.00 0.00 2.29 -0.87 0.00 0.00 176.83 178.89 1qzq n LYS 584 N -3.99 2.34 -2.60 4.77 -0.00 -1.26 -4.95 118.16 112.47 1qzq n LYS 584 Ca -0.03 -1.96 -0.32 0.00 -0.00 0.00 0.00 58.31 56.00 1qzq n LYS 584 Cb 0.09 -1.47 -0.04 0.00 -0.00 0.00 0.00 35.03 33.60 1qzq n LYS 584 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1qzq s ASP 585 N -1.91 6.66 0.03 -5.58 1.01 -0.33 -5.07 116.67 111.48 1qzq s ASP 585 Ca 0.30 1.49 0.01 0.00 0.71 0.00 0.00 52.55 55.05 1qzq s ASP 585 Cb 0.21 -2.47 -0.02 0.00 1.01 0.00 0.00 42.92 41.64 1qzq s ASP 585 CO 0.30 -0.49 -0.04 -0.13 0.21 0.00 0.00 175.17 175.02 1qzq s ARG 586 N -3.81 0.36 0.34 8.23 1.81 -1.26 -4.79 118.95 119.83 1qzq s ARG 586 Ca 0.58 -0.64 -0.28 0.00 -1.72 0.00 0.00 55.73 53.67 1qzq s ARG 586 Cb -0.10 0.02 -0.09 0.00 -0.45 0.00 0.00 34.95 34.32 1qzq s ARG 586 CO 0.27 -0.03 1.21 -1.25 -0.68 0.00 0.00 175.30 174.83 1qzq s PRO 587 N -1.49 4.31 0.07 3.54 0.04 -1.26 -1.08 135.00 139.14 1qzq s PRO 587 Ca -0.15 1.99 -0.31 0.00 0.04 0.00 0.00 61.00 62.58 1qzq s PRO 587 Cb -0.10 -2.96 -0.09 0.00 0.04 0.00 0.00 34.50 31.39 1qzq s PRO 587 CO -0.01 -0.14 1.70 -0.46 0.04 0.00 0.00 177.00 178.13 1qzq s TRP 588 N -1.24 2.30 -0.20 0.56 -0.11 -0.92 -4.58 118.94 114.75 1qzq s TRP 588 Ca 0.51 0.21 0.01 0.00 1.22 0.00 0.00 56.10 58.05 1qzq s TRP 588 Cb -0.35 -4.02 0.04 0.00 -1.50 0.00 0.00 33.47 27.64 1qzq s TRP 588 CO 0.45 -4.14 -0.13 0.42 -4.62 0.00 0.00 176.95 168.93 1qzq s ILE 589 N 2.80 1.87 0.44 5.86 1.01 -1.26 -4.54 121.20 127.38 1qzq s ILE 589 Ca 0.76 -1.11 0.20 0.00 0.00 0.00 0.00 60.65 60.50 1qzq s ILE 589 Cb -0.41 -1.87 0.23 0.00 0.01 0.00 0.00 42.46 40.43 1qzq s ILE 589 CO 0.33 0.24 2.04 4.11 0.00 0.00 0.00 174.94 181.66 1qzq h TRP 590 N 7.92 0.00 -0.90 3.97 5.08 -1.09 -3.31 115.95 127.63 1qzq h TRP 590 Ca -0.31 0.00 -0.60 0.00 1.08 0.00 0.00 58.89 59.06 1qzq h TRP 590 Cb 1.10 0.00 -0.31 0.00 -3.00 0.00 0.00 29.16 26.95 1qzq h TRP 590 CO 0.52 0.15 0.41 0.27 -1.28 0.00 0.00 178.44 178.52 1qzq n ASN 591 N -4.02 6.34 -4.14 0.11 0.23 -1.26 -4.77 115.26 107.75 1qzq n ASN 591 Ca -0.02 -3.76 -0.15 0.00 -0.53 0.00 0.00 54.58 50.12 1qzq n ASN 591 Cb 0.23 -0.80 -0.11 0.00 -2.08 0.00 0.00 39.78 37.02 1qzq n ASN 591 CO 0.00 0.00 0.00 0.27 -0.93 0.00 0.00 177.26 176.60 1qzq s ILE 592 N -4.52 0.83 0.52 1.53 -4.36 -1.25 -4.85 121.20 109.11 1qzq s ILE 592 Ca 0.60 -1.41 -0.10 0.00 -0.26 0.00 0.00 60.65 59.48 1qzq s ILE 592 Cb 0.48 -1.08 -0.05 0.00 1.25 0.00 0.00 42.46 43.06 1qzq s ILE 592 CO 0.01 -0.45 0.89 -2.16 0.24 0.00 0.00 174.94 173.48 1qzq s PRO 593 N -2.24 3.65 -0.23 0.37 0.04 -1.26 -4.57 135.00 130.76 1qzq s PRO 593 Ca -0.01 0.53 -0.01 0.00 0.04 0.00 0.00 61.00 61.55 1qzq s PRO 593 Cb -0.06 -2.24 0.07 0.00 0.04 0.00 0.00 34.50 32.30 1qzq s PRO 593 CO 0.00 -0.31 0.02 0.71 0.04 0.00 0.00 177.00 177.46 1qzq s TYR 594 N -2.82 1.55 0.00 0.56 2.02 0.65 -4.99 117.35 114.32 1qzq s TYR 594 Ca 0.52 -1.29 0.00 0.00 -0.37 0.00 0.00 57.07 55.93 1qzq s TYR 594 Cb -0.10 -1.32 0.00 0.00 -0.40 0.00 0.00 41.96 40.13 1qzq s TYR 594 CO 0.44 -0.71 0.28 1.33 -1.57 0.00 0.00 175.55 175.32 1qzq n VAL 595 N 4.90 0.00 -0.15 0.71 0.24 -1.26 -1.44 118.33 121.34 1qzq n VAL 595 Ca -0.08 -0.31 -0.11 0.00 -2.04 0.00 0.00 64.34 61.80 1qzq n VAL 595 Cb 0.45 1.34 -0.01 0.00 -1.47 0.00 0.00 33.84 34.15 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 0.84 -4.46 7.34 1.57 -1.98 -3.45 116.57 116.43 1qzq h LYS 596 Ca 0.00 -0.32 -0.36 0.00 -1.87 0.00 0.00 60.65 58.10 1qzq h LYS 596 Cb 0.17 -0.05 -0.29 0.00 0.08 0.00 0.00 32.23 32.14 1qzq h LYS 596 CO 0.00 0.95 -0.77 0.00 -0.57 0.00 0.00 179.45 179.06 1qzq s ALA 597 N -4.79 0.58 0.69 3.86 0.00 -1.26 -5.15 121.76 115.68 1qzq s ALA 597 Ca -0.12 -0.28 -0.11 0.00 0.00 0.00 0.00 51.96 51.45 1qzq s ALA 597 Cb 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.07 1qzq s ALA 597 CO 0.83 0.13 1.06 -1.25 0.00 0.00 0.00 175.76 176.53 1qzq s PRO 598 N -0.09 3.04 0.35 0.00 0.04 -1.26 -4.87 135.00 132.20 1qzq s PRO 598 Ca 0.02 0.79 0.00 0.00 0.04 0.00 0.00 61.00 61.85 1qzq s PRO 598 Cb -0.03 -2.01 0.07 0.00 0.04 0.00 0.00 34.50 32.56 1qzq s PRO 598 CO -0.00 -0.99 0.48 -0.40 0.04 0.00 0.00 177.00 176.13 1qzq n ASP 599 N -3.03 0.68 0.00 6.66 3.85 0.21 -4.88 116.55 120.04 1qzq n ASP 599 Ca 0.07 -1.56 0.00 0.00 -0.71 0.00 0.00 54.79 52.59 1qzq n ASP 599 Cb 0.54 -0.31 0.01 0.00 -1.35 0.00 0.00 41.12 40.02 1qzq n ASP 599 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1qzq n THR 600 N -2.06 1.62 -0.08 2.12 -2.24 -1.16 -0.94 114.28 111.54 1qzq n THR 600 Ca 0.08 0.41 0.03 0.00 -2.27 0.00 0.00 64.05 62.30 1qzq n THR 600 Cb 0.29 -1.40 0.09 0.00 -2.10 0.00 0.00 70.33 67.20 1qzq n THR 600 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1qzq n HIS 601 N -1.41 0.26 -0.86 4.78 8.25 -1.26 -4.97 115.22 120.01 1qzq n HIS 601 Ca 0.00 -0.47 0.00 0.00 -0.26 0.00 0.00 57.72 56.99 1qzq n HIS 601 Cb 0.00 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.08 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 0.12 0.70 3.96 -1.41 0.00 -0.12 -5.04 105.19 103.40 1qzq n GLY 602 Ca 0.07 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.90 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 -2.37 5.73 0.52 1.61 0.01 -1.26 -4.70 114.94 114.48 1qzq s ASN 603 Ca 0.00 -0.32 0.04 0.00 -0.71 0.00 0.00 52.86 51.87 1qzq s ASN 603 Cb 0.00 -1.04 0.01 0.00 0.41 0.00 0.00 41.25 40.63 1qzq s ASN 603 CO 0.00 -0.49 0.27 -0.04 -1.51 0.00 0.00 177.10 175.33 1qzq s MET 604 N -4.17 2.24 -0.19 -0.60 -1.94 -1.26 -0.62 119.30 112.76 1qzq s MET 604 Ca 0.46 -2.10 0.01 0.00 -1.71 0.00 0.00 55.69 52.35 1qzq s MET 604 Cb -0.08 -1.93 0.03 0.00 2.01 0.00 0.00 34.83 34.86 1qzq s MET 604 CO 0.30 -0.49 -0.16 -0.46 -0.01 0.00 0.00 175.02 174.21 1qzq s TRP 605 N -2.78 2.72 -0.45 -0.03 -0.11 -0.52 -4.97 118.94 112.81 1qzq s TRP 605 Ca 0.27 -1.71 0.03 0.00 1.22 0.00 0.00 56.10 55.90 1qzq s TRP 605 Cb -0.01 -1.83 0.15 0.00 -1.50 0.00 0.00 33.47 30.29 1qzq s TRP 605 CO 0.16 -0.79 0.30 0.08 -4.62 0.00 0.00 176.95 172.08 1qzq s VAL 606 N 1.30 1.11 0.45 5.86 1.01 -1.26 -0.25 120.40 128.61 1qzq s VAL 606 Ca 0.01 -2.67 0.00 0.00 0.00 0.00 0.00 61.98 59.32 1qzq s VAL 606 Cb -0.15 -1.77 0.00 0.00 0.00 0.00 0.00 36.38 34.46 1qzq s VAL 606 CO -0.10 -1.02 0.00 -2.65 0.00 0.00 0.00 175.10 171.33 1qzq n PRO 607 N 3.23 1.98 0.00 2.72 -0.02 -1.26 -5.02 135.00 136.63 1qzq n PRO 607 Ca 0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1qzq n PRO 607 Cb 0.39 -0.89 0.00 0.00 -0.02 0.00 0.00 33.50 32.97 1qzq n PRO 607 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91