#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rff n PRO 163 N 0.00 0.24 0.00 1.20 -0.04 -1.26 -4.11 135.00 131.04 1rff n PRO 163 Ca 0.00 0.20 -0.22 0.00 -0.04 0.00 0.00 63.50 63.44 1rff n PRO 163 Cb 0.00 -1.78 -0.14 0.00 -0.04 0.00 0.00 33.50 31.54 1rff n PRO 163 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1rff h PHE 164 N 0.00 0.46 -5.98 0.54 0.04 -1.99 -3.48 116.94 106.53 1rff h PHE 164 Ca 0.00 -0.34 -0.44 0.00 2.80 0.00 0.00 57.97 59.99 1rff h PHE 164 Cb 0.72 -0.02 0.03 0.00 2.20 0.00 0.00 35.95 38.88 1rff h PHE 164 CO 0.00 1.71 -0.71 1.04 -0.60 0.00 0.00 178.31 179.75 1rff n GLN 165 N -3.66 -6.26 -3.84 1.51 1.13 -1.26 -4.81 117.38 100.18 1rff n GLN 165 Ca -0.30 0.69 -0.36 0.00 -1.94 0.00 0.00 57.00 55.09 1rff n GLN 165 Cb 0.99 -5.64 -0.11 0.00 0.11 0.00 0.00 30.24 25.59 1rff n GLN 165 CO 0.00 0.00 0.00 0.12 -1.44 0.00 0.00 177.06 175.74 1rff s PHE 166 N -3.28 3.15 0.18 1.08 2.19 -1.26 -1.87 117.98 118.17 1rff s PHE 166 Ca 0.61 -0.19 0.08 0.00 0.33 0.00 0.00 56.93 57.75 1rff s PHE 166 Cb -0.29 -2.20 -0.04 0.00 -1.31 0.00 0.00 43.02 39.18 1rff s PHE 166 CO 0.75 -0.16 -0.16 0.71 1.83 0.00 0.00 175.22 178.19 1rff s TYR 167 N 1.21 1.69 0.20 10.12 1.51 0.13 -4.98 117.35 127.24 1rff s TYR 167 Ca 0.05 -0.54 0.04 0.00 -1.01 0.00 0.00 57.07 55.61 1rff s TYR 167 Cb -0.14 -0.82 -0.03 0.00 -0.11 0.00 0.00 41.96 40.85 1rff s TYR 167 CO 0.04 0.31 0.32 -0.51 -1.11 0.00 0.00 175.55 174.60 1rff s LEU 168 N -2.97 4.29 0.60 -1.29 1.43 -1.26 -0.38 118.68 119.09 1rff s LEU 168 Ca 0.18 0.09 -0.14 0.00 -1.03 0.00 0.00 54.13 53.23 1rff s LEU 168 Cb -0.03 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.31 1rff s LEU 168 CO 0.06 -0.02 1.03 0.42 0.23 0.00 0.00 176.35 178.08 1rff s THR 169 N -1.89 4.22 0.41 5.49 -4.23 -0.92 -1.34 115.64 117.39 1rff s THR 169 Ca 0.34 0.91 -0.26 0.00 -1.18 0.00 0.00 61.69 61.50 1rff s THR 169 Cb -0.10 -3.57 -0.09 0.00 1.34 0.00 0.00 72.50 70.09 1rff s THR 169 CO 0.28 -0.76 1.35 -0.60 -0.54 0.00 0.00 174.62 174.36 1rff s ARG 170 N -4.51 3.92 -0.19 3.99 3.52 -0.96 -4.64 118.95 120.09 1rff s ARG 170 Ca 0.59 2.26 0.01 0.00 -0.13 0.00 0.00 55.73 58.46 1rff s ARG 170 Cb -0.13 -2.76 0.02 0.00 -1.56 0.00 0.00 34.95 30.52 1rff s ARG 170 CO 0.43 -0.56 -0.19 0.08 -0.81 0.00 0.00 175.30 174.24 1rff s VAL 171 N -1.23 2.11 -0.04 7.11 1.01 -1.26 -4.58 120.40 123.52 1rff s VAL 171 Ca 0.57 -0.97 -0.30 0.00 0.00 0.00 0.00 61.98 61.28 1rff s VAL 171 Cb -0.40 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 1rff s VAL 171 CO 0.52 0.50 1.45 -0.44 0.00 0.00 0.00 175.10 177.13 1rff s SER 172 N 1.28 6.82 0.00 3.32 0.01 0.06 -3.47 113.70 121.73 1rff s SER 172 Ca 0.04 2.08 0.00 0.00 1.31 0.00 0.00 55.95 59.38 1rff s SER 172 Cb -0.13 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.55 1rff s SER 172 CO -0.12 -0.78 0.00 0.61 0.41 0.00 0.00 173.24 173.35 1rff n GLY 173 N 3.77 1.63 3.80 3.44 0.00 -1.26 -4.85 105.19 111.72 1rff n GLY 173 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1rff n GLY 173 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1rff s VAL 174 N -1.71 3.69 0.44 1.61 -7.23 -1.23 -5.00 120.40 110.97 1rff s VAL 174 Ca 0.00 0.68 -0.24 0.00 -1.81 0.00 0.00 61.98 60.61 1rff s VAL 174 Cb 0.00 -3.25 -0.10 0.00 0.56 0.00 0.00 36.38 33.59 1rff s VAL 174 CO 0.00 -0.59 1.09 0.29 -0.31 0.00 0.00 175.10 175.58 1rff n LYS 175 N -2.68 1.48 -0.33 4.82 5.02 -1.26 -4.88 118.16 120.33 1rff n LYS 175 Ca 0.09 0.53 0.21 0.00 -2.02 0.00 0.00 58.31 57.12 1rff n LYS 175 Cb 0.53 -2.16 0.47 0.00 -0.02 0.00 0.00 35.03 33.85 1rff n LYS 175 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 1rff h PRO 176 N 1.60 0.44 -0.16 1.97 0.11 -1.98 -0.68 132.00 133.31 1rff h PRO 176 Ca -0.46 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.67 1rff h PRO 176 Cb 1.33 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1rff h PRO 176 CO 0.57 0.29 0.15 1.57 -0.21 0.00 0.00 178.00 180.38 1rff h LYS 177 N 0.46 0.00 -0.00 1.05 2.10 -2.01 0.28 116.57 118.45 1rff h LYS 177 Ca 0.60 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.25 1rff h LYS 177 Cb 1.40 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.73 1rff h LYS 177 CO -0.34 0.00 -0.23 0.66 -2.00 0.00 0.00 179.45 177.55 1rff n TYR 178 N -3.98 0.00 0.32 0.07 4.01 -0.26 -3.72 117.16 113.59 1rff n TYR 178 Ca 0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.78 1rff n TYR 178 Cb 0.27 -0.20 0.01 0.00 -0.31 0.00 0.00 39.34 39.11 1rff n TYR 178 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1rff n ASN 179 N -1.00 1.19 -0.01 7.72 3.02 -0.04 -4.70 115.26 121.44 1rff n ASN 179 Ca 0.11 -1.10 0.01 0.00 -0.03 0.00 0.00 54.58 53.58 1rff n ASN 179 Cb 0.32 0.33 0.34 0.00 -0.61 0.00 0.00 39.78 40.16 1rff n ASN 179 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1rff h SER 180 N 0.99 0.50 -0.41 6.41 4.64 -1.29 -2.31 113.55 122.08 1rff h SER 180 Ca 0.00 -0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.26 1rff h SER 180 Cb 0.26 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1rff h SER 180 CO 0.00 0.48 0.00 0.61 -0.87 0.00 0.00 176.83 177.05 1rff n GLY 181 N -1.13 3.44 3.97 -0.77 0.00 -1.26 -5.01 105.19 104.43 1rff n GLY 181 Ca 0.02 -0.91 -0.19 0.00 0.00 0.00 0.00 46.02 44.94 1rff n GLY 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rff s ALA 182 N -2.46 4.17 -0.04 4.61 0.00 -0.87 -4.64 121.76 122.54 1rff s ALA 182 Ca 0.45 -1.47 0.04 0.00 0.00 0.00 0.00 51.96 50.97 1rff s ALA 182 Cb 0.33 -1.61 -0.00 0.00 0.00 0.00 0.00 23.12 21.84 1rff s ALA 182 CO 0.14 -0.01 -0.15 -0.51 0.00 0.00 0.00 175.76 175.22 1rff s LEU 183 N -4.14 1.89 0.30 0.00 1.43 -0.45 -4.74 118.68 112.98 1rff s LEU 183 Ca 0.44 -0.32 0.03 0.00 -1.03 0.00 0.00 54.13 53.25 1rff s LEU 183 Cb -0.09 -0.88 -0.03 0.00 0.03 0.00 0.00 46.19 45.22 1rff s LEU 183 CO 0.30 0.14 0.47 -2.28 0.23 0.00 0.00 176.35 175.21 1rff s HIS 184 N 0.05 3.45 0.40 0.29 5.65 -1.26 -2.27 115.29 121.60 1rff s HIS 184 Ca -0.03 0.16 0.12 0.00 0.25 0.00 0.00 55.06 55.55 1rff s HIS 184 Cb -0.11 -1.78 0.93 0.00 -1.18 0.00 0.00 32.58 30.45 1rff s HIS 184 CO 0.02 0.23 1.94 0.97 -0.65 0.00 0.00 174.74 177.25 1rff h ILE 185 N 0.92 0.89 -0.48 0.89 2.10 -1.96 -0.33 117.51 119.54 1rff h ILE 185 Ca -0.50 -0.19 0.01 0.00 1.08 0.00 0.00 64.86 65.26 1rff h ILE 185 Cb 1.23 0.30 -0.02 0.00 -1.09 0.00 0.00 36.82 37.23 1rff h ILE 185 CO 0.61 0.10 0.32 0.11 -1.08 0.00 0.00 178.15 178.20 1rff h LYS 186 N 0.54 0.60 -0.34 2.19 1.57 -1.95 -1.68 116.57 117.50 1rff h LYS 186 Ca 0.34 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 59.01 1rff h LYS 186 Cb 0.59 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.76 1rff h LYS 186 CO -0.12 0.39 -0.07 -0.44 -0.57 0.00 0.00 179.45 178.65 1rff h ASP 187 N 0.61 0.65 -0.65 0.86 3.32 -1.42 -2.79 116.42 117.01 1rff h ASP 187 Ca 0.18 -0.36 -0.05 0.00 0.02 0.00 0.00 57.03 56.83 1rff h ASP 187 Cb -0.02 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1rff h ASP 187 CO -0.04 0.86 0.24 0.40 -1.72 0.00 0.00 179.24 178.97 1rff h ILE 188 N 0.44 1.24 -0.01 0.35 2.04 -1.02 -2.65 117.51 117.90 1rff h ILE 188 Ca 0.09 -0.80 0.00 0.00 1.00 0.00 0.00 64.86 65.15 1rff h ILE 188 Cb 0.56 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1rff h ILE 188 CO 0.03 0.31 -0.06 0.18 0.00 0.00 0.00 178.15 178.62 1rff n LEU 189 N -4.28 0.66 -4.78 1.44 4.77 -0.69 -4.77 117.00 109.35 1rff n LEU 189 Ca 0.06 -0.15 -0.34 0.00 -0.03 0.00 0.00 56.01 55.55 1rff n LEU 189 Cb 0.20 -0.08 0.02 0.00 -2.33 0.00 0.00 43.42 41.22 1rff n LEU 189 CO 0.40 0.11 0.76 -0.55 -1.33 0.00 0.00 177.39 176.78 1rff s SER 190 N -2.22 5.56 0.64 -1.43 0.15 -1.00 -4.55 113.70 110.86 1rff s SER 190 Ca 0.36 2.07 0.36 0.00 0.70 0.00 0.00 55.95 59.44 1rff s SER 190 Cb 0.21 -2.57 2.01 0.00 -1.71 0.00 0.00 66.02 63.97 1rff s SER 190 CO 0.41 -1.32 2.20 1.55 1.20 0.00 0.00 173.24 177.27 1rff h PRO 191 N 0.76 0.00 -0.07 5.44 0.13 -1.91 0.26 132.00 136.61 1rff h PRO 191 Ca -0.49 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.67 1rff h PRO 191 Cb 1.25 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.38 1rff h PRO 191 CO 0.56 0.00 0.06 -0.07 -0.23 0.00 0.00 178.00 178.32 1rff h LEU 192 N 0.00 0.00 0.00 1.56 3.38 -1.91 -2.32 115.31 116.02 1rff h LEU 192 Ca 0.02 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1rff h LEU 192 Cb 0.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1rff h LEU 192 CO -0.00 0.00 -0.46 -0.26 0.09 0.00 0.00 178.44 177.81 1rff h PHE 193 N 0.00 0.00 0.00 1.13 -1.00 -1.23 -3.49 116.94 112.36 1rff h PHE 193 Ca 0.04 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.82 1rff h PHE 193 Cb 0.15 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.71 1rff h PHE 193 CO 0.00 0.09 0.00 0.41 -1.61 0.00 0.00 178.31 177.20 1rff n GLY 194 N 1.16 2.88 3.43 -1.45 0.00 -0.87 -5.04 105.19 105.30 1rff n GLY 194 Ca 0.02 -1.07 -0.44 0.00 0.00 0.00 0.00 46.02 44.53 1rff n GLY 194 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rff s THR 195 N -2.00 4.54 0.19 2.61 2.01 -1.26 -4.37 115.64 117.35 1rff s THR 195 Ca 0.00 -0.54 -0.33 0.00 0.31 0.00 0.00 61.69 61.14 1rff s THR 195 Cb 0.00 -4.58 -0.13 0.00 0.01 0.00 0.00 72.50 67.81 1rff s THR 195 CO 0.00 -1.27 1.69 -0.11 -0.69 0.00 0.00 174.62 174.24 1rff n LEU 196 N 7.11 3.74 -0.10 4.42 7.94 -1.26 -0.81 117.00 138.05 1rff n LEU 196 Ca -0.06 1.06 -0.14 0.00 -1.11 0.00 0.00 56.01 55.76 1rff n LEU 196 Cb 0.45 -1.53 -0.10 0.00 0.53 0.00 0.00 43.42 42.77 1rff n LEU 196 CO 0.61 0.05 -1.18 0.52 -1.11 0.00 0.00 177.39 176.28 1rff n VAL 197 N 3.85 1.20 -3.50 1.96 0.31 0.54 -4.82 118.33 117.87 1rff n VAL 197 Ca 0.16 -0.46 -0.12 0.00 -0.01 0.00 0.00 64.34 63.91 1rff n VAL 197 Cb 0.33 -1.23 -0.03 0.00 -0.91 0.00 0.00 33.84 32.00 1rff n VAL 197 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1rff s SER 198 N -6.01 -0.48 0.03 4.52 0.15 -1.15 -4.21 113.70 106.56 1rff s SER 198 Ca -0.28 0.24 -0.09 0.00 0.70 0.00 0.00 55.95 56.52 1rff s SER 198 Cb 0.07 0.45 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 1rff s SER 198 CO 0.49 -0.64 0.19 -0.94 1.20 0.00 0.00 173.24 173.53 1rff s SER 199 N -1.99 0.03 -0.08 5.45 1.04 -0.60 -1.07 113.70 116.49 1rff s SER 199 Ca -0.01 -0.34 0.03 0.00 0.48 0.00 0.00 55.95 56.12 1rff s SER 199 Cb -0.01 0.28 0.00 0.00 0.10 0.00 0.00 66.02 66.40 1rff s SER 199 CO -0.04 -0.53 -0.18 0.00 0.98 0.00 0.00 173.24 173.47 1rff s ALA 200 N -2.39 1.71 -0.28 5.32 0.00 -0.19 -0.54 121.76 125.39 1rff s ALA 200 Ca -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.19 1rff s ALA 200 Cb -0.02 -0.66 0.05 0.00 0.00 0.00 0.00 23.12 22.49 1rff s ALA 200 CO -0.03 0.22 -0.05 -0.65 0.00 0.00 0.00 175.76 175.25 1rff s GLN 201 N 0.41 2.39 -0.23 0.00 -1.52 0.10 -1.08 119.66 119.73 1rff s GLN 201 Ca -0.14 -1.27 -0.17 0.00 -1.95 0.00 0.00 55.36 51.82 1rff s GLN 201 Cb -0.16 -3.04 -0.03 0.00 -0.22 0.00 0.00 33.01 29.56 1rff s GLN 201 CO 0.06 -0.58 0.48 -0.06 -0.25 0.00 0.00 175.29 174.93 1rff s PHE 202 N 1.20 3.31 0.13 0.91 0.40 0.30 -0.95 117.98 123.28 1rff s PHE 202 Ca -0.06 0.64 -0.05 0.00 -0.60 0.00 0.00 56.93 56.86 1rff s PHE 202 Cb -0.20 -2.65 0.02 0.00 0.51 0.00 0.00 43.02 40.71 1rff s PHE 202 CO -0.03 -0.17 0.28 -1.71 0.70 0.00 0.00 175.22 174.29 1rff n ASN 203 N 5.09 -0.78 -0.02 1.36 2.85 -0.83 -1.80 115.26 121.12 1rff n ASN 203 Ca -0.06 -1.53 -0.03 0.00 -0.11 0.00 0.00 54.58 52.85 1rff n ASN 203 Cb 0.50 1.29 -0.01 0.00 1.24 0.00 0.00 39.78 42.81 1rff n ASN 203 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1rff n TYR 204 N -0.19 0.00 -3.64 1.20 9.36 -1.24 -4.45 117.16 118.20 1rff n TYR 204 Ca -0.03 0.00 -0.37 0.00 3.32 0.00 0.00 57.90 60.82 1rff n TYR 204 Cb 0.21 -0.18 -0.06 0.00 -0.63 0.00 0.00 39.34 38.68 1rff n TYR 204 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1rff s PHE 206 N -1.09 0.50 -0.37 0.00 0.40 -1.26 -1.16 117.98 115.01 1rff s PHE 206 Ca 0.21 -0.10 -0.01 0.00 -0.60 0.00 0.00 56.93 56.44 1rff s PHE 206 Cb -0.15 -0.40 0.10 0.00 0.51 0.00 0.00 43.02 43.08 1rff s PHE 206 CO 0.11 -0.07 0.12 0.34 0.70 0.00 0.00 175.22 176.42 1rff s ASP 207 N 0.31 5.05 0.14 1.36 -1.08 -0.06 -4.96 116.67 117.43 1rff s ASP 207 Ca -0.03 -1.91 -0.13 0.00 -0.52 0.00 0.00 52.55 49.95 1rff s ASP 207 Cb -0.07 -1.75 0.01 0.00 -1.46 0.00 0.00 42.92 39.65 1rff s ASP 207 CO -0.00 -0.44 1.60 0.58 0.52 0.00 0.00 175.17 177.42 1rff h VAL 208 N 6.45 1.26 -0.51 1.11 2.07 -1.90 0.11 116.25 124.85 1rff h VAL 208 Ca -0.12 -1.03 0.06 0.00 0.82 0.00 0.00 66.70 66.43 1rff h VAL 208 Cb 1.04 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.77 1rff h VAL 208 CO 0.62 0.36 0.22 0.44 0.02 0.00 0.00 177.57 179.23 1rff h ASP 209 N 0.67 0.27 -0.27 0.57 3.45 -1.95 -1.26 116.42 117.90 1rff h ASP 209 Ca 0.13 0.05 -0.03 0.00 0.43 0.00 0.00 57.03 57.62 1rff h ASP 209 Cb 0.48 0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 39.25 1rff h ASP 209 CO 0.02 0.19 0.07 -0.25 -1.57 0.00 0.00 179.24 177.70 1rff h TRP 210 N 0.43 0.45 -0.38 4.55 7.01 -1.83 -3.11 115.95 123.08 1rff h TRP 210 Ca 0.24 -0.05 0.04 0.00 2.11 0.00 0.00 58.89 61.23 1rff h TRP 210 Cb 0.21 -0.13 -0.04 0.00 -2.10 0.00 0.00 29.16 27.11 1rff h TRP 210 CO -0.13 0.50 0.15 1.25 -2.79 0.00 0.00 178.44 177.42 1rff h LEU 211 N 0.27 0.19 -1.29 0.65 5.85 -0.42 -2.14 115.31 118.42 1rff h LEU 211 Ca 0.09 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1rff h LEU 211 Cb 0.27 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1rff h LEU 211 CO 0.00 0.14 0.25 0.58 -0.34 0.00 0.00 178.44 179.07 1rff h VAL 212 N 0.32 1.18 0.00 1.05 2.07 -1.26 -0.39 116.25 119.21 1rff h VAL 212 Ca 0.17 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1rff h VAL 212 Cb 0.13 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1rff h VAL 212 CO -0.16 0.21 0.00 0.11 0.02 0.00 0.00 177.57 177.75 1rff h LYS 213 N 0.74 0.00 0.00 1.57 1.57 -1.32 -2.43 116.57 116.70 1rff h LYS 213 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 1rff h LYS 213 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1rff h LYS 213 CO -0.02 0.00 -0.07 1.96 -0.57 0.00 0.00 179.45 180.75 1rff h GLN 214 N 0.00 0.00 -6.93 3.15 1.08 -0.80 -3.45 115.11 108.16 1rff h GLN 214 Ca 0.00 0.00 -0.48 0.00 -1.45 0.00 0.00 58.65 56.72 1rff h GLN 214 Cb 0.28 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.71 1rff h GLN 214 CO 0.00 0.00 0.39 0.71 -0.95 0.00 0.00 178.83 178.98 1rff s TYR 215 N -3.19 3.42 0.56 2.96 1.51 -0.92 -4.42 117.35 117.27 1rff s TYR 215 Ca 0.07 1.69 -0.20 0.00 -1.01 0.00 0.00 57.07 57.62 1rff s TYR 215 Cb 0.07 -3.06 -0.04 0.00 -0.11 0.00 0.00 41.96 38.81 1rff s TYR 215 CO 0.66 -0.35 1.25 -2.14 -1.11 0.00 0.00 175.55 173.86 1rff s PRO 216 N -2.33 3.13 0.31 -1.71 0.02 -1.26 -4.76 135.00 128.41 1rff s PRO 216 Ca 0.55 1.94 0.09 0.00 0.02 0.00 0.00 61.00 63.60 1rff s PRO 216 Cb -0.21 -2.10 0.87 0.00 0.02 0.00 0.00 34.50 33.09 1rff s PRO 216 CO 0.27 -1.11 1.71 -1.35 -0.33 0.00 0.00 177.00 176.18 1rff h PRO 217 N 1.23 0.47 0.00 5.54 0.11 -1.93 0.16 132.00 137.57 1rff h PRO 217 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 1rff h PRO 217 Cb 1.29 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1rff h PRO 217 CO 0.56 0.31 0.00 1.05 -0.21 0.00 0.00 178.00 179.72 1rff h GLU 218 N 0.48 0.00 -0.04 1.05 9.09 -2.02 -2.85 114.58 120.29 1rff h GLU 218 Ca 0.64 0.00 0.00 0.00 0.05 0.00 0.00 59.36 60.05 1rff h GLU 218 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 1rff h GLU 218 CO -0.52 0.00 0.00 1.19 0.05 0.00 0.00 179.01 179.73 1rff n PHE 219 N -2.74 0.04 0.28 2.06 3.72 0.50 -4.69 117.46 116.62 1rff n PHE 219 Ca 0.01 -0.04 0.16 0.00 -0.05 0.00 0.00 57.45 57.52 1rff n PHE 219 Cb 0.24 -0.00 0.78 0.00 -0.94 0.00 0.00 39.48 39.56 1rff n PHE 219 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1rff h ARG 220 N 2.21 0.00 -0.17 -1.08 3.08 -1.16 -2.08 114.38 115.16 1rff h ARG 220 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1rff h ARG 220 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1rff h ARG 220 CO 0.00 0.00 0.00 1.63 -1.07 0.00 0.00 179.97 180.53 1rff n LYS 221 N -2.63 1.80 -2.08 0.04 5.02 -1.26 -4.98 118.16 114.07 1rff n LYS 221 Ca -0.01 -1.77 -0.36 0.00 -2.02 0.00 0.00 58.31 54.15 1rff n LYS 221 Cb 0.12 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 33.80 1rff n LYS 221 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1rff s LYS 222 N -1.30 3.13 0.27 1.97 -0.14 -0.79 -4.76 119.74 118.12 1rff s LYS 222 Ca 0.25 1.80 -0.31 0.00 -1.36 0.00 0.00 55.97 56.35 1rff s LYS 222 Cb 0.16 -2.00 -0.12 0.00 -1.68 0.00 0.00 37.83 34.18 1rff s LYS 222 CO 0.22 -1.07 1.60 -2.30 -0.76 0.00 0.00 175.35 173.04 1rff n PRO 223 N -1.40 2.62 -4.96 -1.68 -0.02 -1.26 -4.85 135.00 123.45 1rff n PRO 223 Ca 0.12 0.93 -0.28 0.00 -2.02 0.00 0.00 63.50 62.25 1rff n PRO 223 Cb 0.49 -2.71 -0.17 0.00 -0.02 0.00 0.00 33.50 31.10 1rff n PRO 223 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1rff s ILE 224 N 0.24 1.65 -0.17 4.25 1.01 -0.66 -1.56 121.20 125.96 1rff s ILE 224 Ca 0.67 -0.80 -0.04 0.00 0.00 0.00 0.00 60.65 60.48 1rff s ILE 224 Cb -0.52 -1.43 -0.03 0.00 0.01 0.00 0.00 42.46 40.49 1rff s ILE 224 CO 0.45 0.47 -0.02 -0.22 0.00 0.00 0.00 174.94 175.62 1rff s LEU 225 N 0.29 3.33 -0.30 2.97 2.96 0.30 -1.34 118.68 126.88 1rff s LEU 225 Ca -0.12 -0.11 -0.10 0.00 -0.22 0.00 0.00 54.13 53.58 1rff s LEU 225 Cb -0.15 -1.82 -0.02 0.00 0.50 0.00 0.00 46.19 44.70 1rff s LEU 225 CO 0.05 0.15 0.16 -0.76 -1.32 0.00 0.00 176.35 174.63 1rff s LEU 226 N 0.49 4.06 -0.32 -0.68 1.43 0.23 0.03 118.68 123.92 1rff s LEU 226 Ca -0.02 -0.37 -0.11 0.00 -1.03 0.00 0.00 54.13 52.59 1rff s LEU 226 Cb -0.14 -2.03 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 1rff s LEU 226 CO 0.02 -0.15 0.20 -0.69 0.23 0.00 0.00 176.35 175.96 1rff s VAL 227 N 1.66 5.02 0.31 -1.59 1.01 -0.13 -0.32 120.40 126.36 1rff s VAL 227 Ca 0.06 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 61.87 1rff s VAL 227 Cb -0.17 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1rff s VAL 227 CO 0.07 0.07 0.27 -1.38 0.00 0.00 0.00 175.10 174.14 1rff s HIS 228 N 1.69 1.62 -0.02 5.22 -0.00 -0.41 -1.97 115.29 121.41 1rff s HIS 228 Ca 0.06 -1.59 0.04 0.00 -0.00 0.00 0.00 55.06 53.56 1rff s HIS 228 Cb -0.17 -0.64 0.05 0.00 -0.00 0.00 0.00 32.58 31.82 1rff s HIS 228 CO 0.09 -0.86 1.01 0.41 -0.00 0.00 0.00 174.74 175.38 1rff n GLY 229 N -0.57 3.06 3.77 -1.38 0.00 -1.26 0.06 105.19 108.86 1rff n GLY 229 Ca 0.06 -0.21 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 1rff n GLY 229 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1rff s ASP 230 N -1.31 6.20 0.25 1.61 1.11 -1.26 -4.83 116.67 118.44 1rff s ASP 230 Ca 0.06 2.54 0.08 0.00 0.18 0.00 0.00 52.55 55.42 1rff s ASP 230 Cb 0.05 -2.63 -0.05 0.00 1.07 0.00 0.00 42.92 41.36 1rff s ASP 230 CO 0.01 -0.91 -0.12 -0.54 1.18 0.00 0.00 175.17 174.78 1rff s LYS 231 N -2.41 1.48 4.60 8.23 1.02 -1.26 -4.47 119.74 126.92 1rff s LYS 231 Ca 0.60 -1.70 0.00 0.00 0.02 0.00 0.00 55.97 54.89 1rff s LYS 231 Cb -0.35 -1.26 0.00 0.00 -0.52 0.00 0.00 37.83 35.70 1rff s LYS 231 CO 0.44 0.16 0.00 0.54 -0.92 0.00 0.00 175.35 175.57 1rff n ARG 232 N -0.50 0.00 -0.30 1.68 1.74 -1.26 -1.85 116.66 116.17 1rff n ARG 232 Ca -0.07 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 56.97 1rff n ARG 232 Cb 0.61 0.00 0.07 0.00 -1.02 0.00 0.00 32.46 32.12 1rff n ARG 232 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1rff h GLU 233 N 0.00 1.14 -0.55 5.56 3.07 -1.99 -0.76 114.58 121.04 1rff h GLU 233 Ca 0.00 -0.14 0.00 0.00 -0.50 0.00 0.00 59.36 58.72 1rff h GLU 233 Cb 0.00 -0.22 -0.03 0.00 -0.84 0.00 0.00 28.75 27.66 1rff h GLU 233 CO 0.00 0.85 0.35 0.00 -1.40 0.00 0.00 179.01 178.80 1rff h ALA 234 N 1.23 0.71 -0.55 3.43 0.00 -1.82 -0.28 119.26 121.97 1rff h ALA 234 Ca 0.28 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1rff h ALA 234 Cb 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1rff h ALA 234 CO -0.04 0.17 0.34 -0.22 0.00 0.00 0.00 179.25 179.50 1rff h LYS 235 N 0.75 0.74 -0.90 0.00 3.64 -0.68 -1.71 116.57 118.41 1rff h LYS 235 Ca 0.20 -0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1rff h LYS 235 Cb -0.04 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 31.57 1rff h LYS 235 CO -0.04 0.53 0.60 0.00 -2.27 0.00 0.00 179.45 178.26 1rff h ALA 236 N 1.18 1.39 -0.50 5.00 0.00 -0.63 -1.03 119.26 124.68 1rff h ALA 236 Ca 0.20 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1rff h ALA 236 Cb -0.03 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 1rff h ALA 236 CO -0.04 0.54 -0.02 0.45 0.00 0.00 0.00 179.25 180.18 1rff h HIS 237 N 1.18 0.91 -0.38 0.00 3.86 -0.58 -1.34 115.15 118.80 1rff h HIS 237 Ca 0.35 -0.14 -0.15 0.00 -1.16 0.00 0.00 60.37 59.26 1rff h HIS 237 Cb -0.06 -0.24 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 1rff h HIS 237 CO -0.00 0.85 -0.35 1.25 0.86 0.00 0.00 177.93 180.53 1rff h LEU 238 N 0.78 0.96 -0.71 2.43 5.85 -0.85 -1.62 115.31 122.16 1rff h LEU 238 Ca 0.15 -0.46 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 1rff h LEU 238 Cb 0.50 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.23 1rff h LEU 238 CO 0.03 1.22 0.43 0.45 -0.34 0.00 0.00 178.44 180.23 1rff h HIS 239 N 0.72 0.93 -0.87 1.25 3.86 -1.10 -2.33 115.15 117.61 1rff h HIS 239 Ca 0.06 -0.00 0.03 0.00 -1.16 0.00 0.00 60.37 59.30 1rff h HIS 239 Cb 0.94 -0.31 -0.05 0.00 1.06 0.00 0.00 27.41 29.06 1rff h HIS 239 CO 0.06 0.63 0.57 0.00 0.86 0.00 0.00 177.93 180.06 1rff h ALA 240 N 1.22 1.43 -0.53 2.45 0.00 -1.00 0.35 119.26 123.18 1rff h ALA 240 Ca 0.25 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 1rff h ALA 240 Cb -0.03 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1rff h ALA 240 CO -0.05 0.50 0.01 1.96 0.00 0.00 0.00 179.25 181.67 1rff h GLN 241 N 1.12 0.90 0.00 0.00 4.20 -0.94 -3.06 115.11 117.33 1rff h GLN 241 Ca 0.34 -0.25 -0.07 0.00 0.06 0.00 0.00 58.65 58.72 1rff h GLN 241 Cb -0.03 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.64 1rff h GLN 241 CO -0.09 0.89 -0.67 0.00 -0.67 0.00 0.00 178.83 178.29 1rff h ALA 242 N 1.17 0.72 -0.90 3.87 0.00 -0.91 -3.39 119.26 119.83 1rff h ALA 242 Ca 0.16 -0.33 0.16 0.00 0.00 0.00 0.00 54.91 54.90 1rff h ALA 242 Cb 0.48 0.03 -0.10 0.00 0.00 0.00 0.00 17.79 18.20 1rff h ALA 242 CO 0.02 0.41 0.48 -0.22 0.00 0.00 0.00 179.25 179.94 1rff h LYS 243 N 0.00 0.64 -0.08 0.00 3.11 -0.83 0.03 116.57 119.44 1rff h LYS 243 Ca -0.04 -0.04 0.02 0.00 -2.81 0.00 0.00 60.65 57.79 1rff h LYS 243 Cb 1.26 -0.14 -0.00 0.00 -1.00 0.00 0.00 32.23 32.34 1rff h LYS 243 CO 0.03 0.42 0.08 -1.35 -2.81 0.00 0.00 179.45 175.83 1rff h PRO 244 N 0.66 0.00 -4.44 1.90 0.11 -1.76 -3.39 132.00 125.08 1rff h PRO 244 Ca 0.50 0.00 -0.73 0.00 0.11 0.00 0.00 66.00 65.88 1rff h PRO 244 Cb 0.73 0.00 -0.21 0.00 0.11 0.00 0.00 31.00 31.62 1rff h PRO 244 CO -0.37 0.00 -0.25 0.71 -0.21 0.00 0.00 178.00 177.88 1rff s TYR 245 N -4.69 3.20 -0.04 0.65 2.02 -0.00 -4.94 117.35 113.54 1rff s TYR 245 Ca -0.05 -0.84 0.30 0.00 -0.37 0.00 0.00 57.07 56.11 1rff s TYR 245 Cb 0.15 -3.25 1.40 0.00 -0.40 0.00 0.00 41.96 39.86 1rff s TYR 245 CO 0.57 -0.85 1.91 1.49 -1.57 0.00 0.00 175.55 177.10 1rff h GLU 246 N 8.81 0.00 -0.07 -0.62 4.81 -1.81 -2.25 114.58 123.45 1rff h GLU 246 Ca -0.28 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.95 1rff h GLU 246 Cb 1.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1rff h GLU 246 CO 0.90 0.00 0.00 0.27 -0.73 0.00 0.00 179.01 179.45 1rff n ASN 247 N -2.67 1.51 -4.73 1.04 6.94 -1.26 -4.85 115.26 111.23 1rff n ASN 247 Ca 0.00 -1.56 -0.35 0.00 -0.02 0.00 0.00 54.58 52.65 1rff n ASN 247 Cb 0.20 -0.04 -0.08 0.00 -2.36 0.00 0.00 39.78 37.49 1rff n ASN 247 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1rff s ILE 248 N -1.92 5.41 0.30 1.53 1.01 -0.85 -1.65 121.20 125.03 1rff s ILE 248 Ca 0.36 0.19 0.10 0.00 0.00 0.00 0.00 60.65 61.30 1rff s ILE 248 Cb 0.20 -3.47 -0.05 0.00 0.01 0.00 0.00 42.46 39.15 1rff s ILE 248 CO 0.31 0.44 -0.09 -0.44 0.00 0.00 0.00 174.94 175.16 1rff s SER 249 N 0.36 3.99 0.03 3.58 0.01 -0.45 -4.98 113.70 116.24 1rff s SER 249 Ca 0.08 -0.94 0.07 0.00 1.31 0.00 0.00 55.95 56.48 1rff s SER 249 Cb -0.11 -0.50 -0.02 0.00 0.21 0.00 0.00 66.02 65.59 1rff s SER 249 CO -0.02 -0.06 -0.21 -0.76 0.41 0.00 0.00 173.24 172.60 1rff s LEU 250 N -3.61 2.13 -0.20 2.44 1.02 -1.26 -0.61 118.68 118.59 1rff s LEU 250 Ca 0.32 -0.49 0.01 0.00 0.02 0.00 0.00 54.13 53.99 1rff s LEU 250 Cb -0.04 -1.02 0.04 0.00 0.02 0.00 0.00 46.19 45.20 1rff s LEU 250 CO 0.17 0.19 -0.10 0.00 0.02 0.00 0.00 176.35 176.64 1rff s GLN 252 N 1.41 3.86 0.06 0.00 0.74 -1.26 -1.29 119.66 123.17 1rff s GLN 252 Ca -0.02 0.55 -0.31 0.00 0.05 0.00 0.00 55.36 55.64 1rff s GLN 252 Cb -0.16 -3.79 -0.05 0.00 1.10 0.00 0.00 33.01 30.11 1rff s GLN 252 CO -0.08 -0.87 1.18 0.00 -0.55 0.00 0.00 175.29 174.97 1rff s ALA 253 N 3.30 3.37 0.24 1.58 0.00 0.11 -4.96 121.76 125.40 1rff s ALA 253 Ca 0.36 0.82 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 1rff s ALA 253 Cb -0.13 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.46 1rff s ALA 253 CO 0.17 -0.41 1.44 -1.59 0.00 0.00 0.00 175.76 175.37 1rff s LYS 254 N 1.03 4.27 -0.49 0.00 -2.85 -1.26 -4.70 119.74 115.74 1rff s LYS 254 Ca 0.58 2.30 0.03 0.00 -1.00 0.00 0.00 55.97 57.88 1rff s LYS 254 Cb -0.29 -3.12 0.14 0.00 -2.06 0.00 0.00 37.83 32.51 1rff s LYS 254 CO 0.29 -0.43 0.30 -0.51 0.10 0.00 0.00 175.35 175.10 1rff s LEU 255 N -0.27 3.08 0.00 2.77 1.43 -1.26 -4.93 118.68 119.50 1rff s LEU 255 Ca 0.60 -2.94 0.27 0.00 -1.03 0.00 0.00 54.13 51.03 1rff s LEU 255 Cb -0.42 -1.13 0.97 0.00 0.03 0.00 0.00 46.19 45.65 1rff s LEU 255 CO 0.42 -0.22 1.70 0.47 0.23 0.00 0.00 176.35 178.95 1rff n ASP 256 N 3.14 1.60 -4.47 2.29 10.43 -1.26 -4.76 116.55 123.51 1rff n ASP 256 Ca 0.13 -1.55 -0.33 0.00 2.57 0.00 0.00 54.79 55.60 1rff n ASP 256 Cb 0.36 -0.01 -0.13 0.00 1.84 0.00 0.00 41.12 43.18 1rff n ASP 256 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 1rff s ILE 257 N -1.97 3.50 0.42 0.53 1.01 -1.26 -5.09 121.20 118.33 1rff s ILE 257 Ca 0.37 -0.52 -0.26 0.00 0.00 0.00 0.00 60.65 60.25 1rff s ILE 257 Cb 0.21 -2.48 -0.10 0.00 0.01 0.00 0.00 42.46 40.10 1rff s ILE 257 CO 0.32 0.53 1.32 0.00 0.00 0.00 0.00 174.94 177.11 1rff n ALA 258 N 3.18 1.51 -1.21 9.38 0.00 -1.26 -2.74 120.51 129.38 1rff n ALA 258 Ca -0.18 0.27 -0.07 0.00 0.00 0.00 0.00 53.44 53.46 1rff n ALA 258 Cb 0.53 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.65 1rff n ALA 258 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1rff n PHE 259 N -0.15 0.00 -3.04 0.00 3.01 -1.26 -4.99 117.46 111.03 1rff n PHE 259 Ca 0.06 0.00 -0.30 0.00 1.01 0.00 0.00 57.45 58.22 1rff n PHE 259 Cb 0.40 -1.62 -0.03 0.00 -0.01 0.00 0.00 39.48 38.21 1rff n PHE 259 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1rff s GLY 260 N -2.66 1.94 0.12 1.37 0.00 -1.11 -4.90 107.32 102.08 1rff s GLY 260 Ca 0.00 -0.31 0.05 0.00 0.00 0.00 0.00 44.72 44.46 1rff s GLY 260 CO 0.00 -0.15 -0.12 -0.51 0.00 0.00 0.00 173.10 172.32 1rff s THR 261 N -2.24 1.17 -0.77 0.90 -4.23 -1.26 -4.96 115.64 104.25 1rff s THR 261 Ca 0.49 -1.78 -0.20 0.00 -1.18 0.00 0.00 61.69 59.02 1rff s THR 261 Cb -0.10 -1.55 0.11 0.00 1.34 0.00 0.00 72.50 72.29 1rff s THR 261 CO 0.30 -0.54 0.97 -2.28 -0.54 0.00 0.00 174.62 172.53 1rff s HIS 262 N -2.52 2.99 -0.44 3.99 2.46 -1.26 -1.57 115.29 118.93 1rff s HIS 262 Ca 0.10 -1.08 0.17 0.00 0.47 0.00 0.00 55.06 54.72 1rff s HIS 262 Cb -0.02 -4.21 -0.22 0.00 -0.13 0.00 0.00 32.58 28.00 1rff s HIS 262 CO 0.02 -1.47 0.55 1.58 -2.47 0.00 0.00 174.74 172.95 1rff n HIS 263 N 6.73 0.00 -1.64 3.88 -0.00 -0.30 -3.61 115.22 120.27 1rff n HIS 263 Ca 0.08 0.00 -0.47 0.00 -0.00 0.00 0.00 57.72 57.33 1rff n HIS 263 Cb 0.47 -0.18 -0.04 0.00 -0.00 0.00 0.00 29.99 30.24 1rff n HIS 263 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.34 178.75 1rff n THR 264 N -1.71 0.60 -3.91 3.57 -1.04 -0.87 -4.55 114.28 106.38 1rff n THR 264 Ca 0.00 -0.15 -0.35 0.00 -2.04 0.00 0.00 64.05 61.52 1rff n THR 264 Cb 0.34 -1.27 -0.14 0.00 -1.82 0.00 0.00 70.33 67.44 1rff n THR 264 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1rff s LYS 265 N 0.01 2.33 -0.08 -2.82 3.01 -1.26 -2.78 119.74 118.16 1rff s LYS 265 Ca 0.74 -1.36 -0.09 0.00 -1.01 0.00 0.00 55.97 54.24 1rff s LYS 265 Cb -0.74 -3.21 0.02 0.00 -1.01 0.00 0.00 37.83 32.90 1rff s LYS 265 CO 0.47 -0.68 0.25 1.41 0.51 0.00 0.00 175.35 177.31 1rff s MET 266 N 1.22 0.36 -0.10 1.68 1.75 -0.75 -1.47 119.30 121.99 1rff s MET 266 Ca -0.03 0.22 0.02 0.00 -1.25 0.00 0.00 55.69 54.65 1rff s MET 266 Cb -0.20 0.17 -0.01 0.00 2.84 0.00 0.00 34.83 37.62 1rff s MET 266 CO -0.02 -0.06 -0.17 -1.64 -0.65 0.00 0.00 175.02 172.48 1rff s MET 267 N -0.19 3.02 -0.23 4.11 -1.94 0.06 -0.54 119.30 123.60 1rff s MET 267 Ca -0.03 -0.75 -0.06 0.00 -1.71 0.00 0.00 55.69 53.14 1rff s MET 267 Cb -0.03 -2.46 -0.02 0.00 2.01 0.00 0.00 34.83 34.33 1rff s MET 267 CO 0.01 0.32 0.04 -0.51 -0.01 0.00 0.00 175.02 174.87 1rff s LEU 268 N 0.04 3.32 -0.29 -0.03 1.43 -0.24 -1.30 118.68 121.61 1rff s LEU 268 Ca -0.06 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 52.84 1rff s LEU 268 Cb -0.15 -1.87 0.07 0.00 0.03 0.00 0.00 46.19 44.27 1rff s LEU 268 CO 0.05 -0.00 -0.04 -0.76 0.23 0.00 0.00 176.35 175.82 1rff s LEU 269 N 1.42 3.97 -0.15 1.79 1.43 -0.28 -1.02 118.68 125.84 1rff s LEU 269 Ca 0.05 -1.68 -0.17 0.00 -1.03 0.00 0.00 54.13 51.30 1rff s LEU 269 Cb -0.15 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 1rff s LEU 269 CO 0.02 -0.27 0.43 -0.22 0.23 0.00 0.00 176.35 176.55 1rff s LEU 270 N 1.03 4.23 0.37 1.79 2.96 -0.23 -0.97 118.68 127.86 1rff s LEU 270 Ca -0.01 0.69 0.08 0.00 -0.22 0.00 0.00 54.13 54.67 1rff s LEU 270 Cb -0.20 -2.60 -0.07 0.00 0.50 0.00 0.00 46.19 43.82 1rff s LEU 270 CO -0.06 -0.01 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.60 1rff s TYR 271 N 0.82 2.42 0.43 5.38 2.02 0.12 -0.34 117.35 128.20 1rff s TYR 271 Ca 0.23 -0.58 0.11 0.00 -0.37 0.00 0.00 57.07 56.46 1rff s TYR 271 Cb -0.15 -1.51 0.98 0.00 -0.40 0.00 0.00 41.96 40.88 1rff s TYR 271 CO 0.08 0.51 2.02 0.93 -1.57 0.00 0.00 175.55 177.53 1rff h GLU 272 N 1.94 0.43 0.00 -0.62 5.08 -1.29 -3.08 114.58 117.04 1rff h GLU 272 Ca -0.43 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1rff h GLU 272 Cb 1.25 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1rff h GLU 272 CO 0.74 0.28 -0.81 0.39 -1.00 0.00 0.00 179.01 178.61 1rff n GLU 273 N -4.48 0.11 -0.64 2.33 4.71 -1.26 -5.05 120.64 116.36 1rff n GLU 273 Ca 0.06 -0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.21 1rff n GLU 273 Cb 0.22 -1.54 0.00 0.00 -1.01 0.00 0.00 31.44 29.12 1rff n GLU 273 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1rff n GLY 274 N 1.45 -0.33 3.09 0.62 0.00 -1.17 -4.64 105.19 104.21 1rff n GLY 274 Ca 0.04 -0.95 -0.21 0.00 0.00 0.00 0.00 46.02 44.91 1rff n GLY 274 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rff s LEU 275 N 0.00 2.05 0.05 0.99 2.96 0.11 0.14 118.68 124.98 1rff s LEU 275 Ca 0.00 -0.26 0.06 0.00 -0.22 0.00 0.00 54.13 53.71 1rff s LEU 275 Cb 0.00 -0.61 -0.02 0.00 0.50 0.00 0.00 46.19 46.05 1rff s LEU 275 CO 0.00 0.13 -0.17 -0.60 -1.32 0.00 0.00 176.35 174.38 1rff s ARG 276 N -0.44 1.14 -0.11 1.98 3.52 -0.14 -0.44 118.95 124.45 1rff s ARG 276 Ca 0.04 -0.87 0.03 0.00 -0.13 0.00 0.00 55.73 54.80 1rff s ARG 276 Cb -0.05 -1.21 -0.00 0.00 -1.56 0.00 0.00 34.95 32.12 1rff s ARG 276 CO -0.00 0.30 -0.21 0.08 -0.81 0.00 0.00 175.30 174.66 1rff s VAL 277 N -0.86 2.36 -0.17 7.11 1.01 -1.26 -1.13 120.40 127.46 1rff s VAL 277 Ca 0.04 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.13 1rff s VAL 277 Cb -0.08 -1.93 0.02 0.00 0.00 0.00 0.00 36.38 34.38 1rff s VAL 277 CO 0.02 0.55 -0.20 -0.69 0.00 0.00 0.00 175.10 174.77 1rff s VAL 278 N 0.35 2.08 -0.14 2.92 1.01 -0.42 -1.40 120.40 124.80 1rff s VAL 278 Ca -0.16 -0.94 0.00 0.00 0.00 0.00 0.00 61.98 60.88 1rff s VAL 278 Cb -0.17 -1.86 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 1rff s VAL 278 CO 0.08 0.54 -0.15 -0.63 0.00 0.00 0.00 175.10 174.94 1rff s ILE 279 N 1.17 2.83 0.10 2.22 1.01 -0.66 -0.76 121.20 127.11 1rff s ILE 279 Ca 0.02 -0.73 -0.01 0.00 0.00 0.00 0.00 60.65 59.93 1rff s ILE 279 Cb -0.14 -2.18 0.00 0.00 0.01 0.00 0.00 42.46 40.15 1rff s ILE 279 CO -0.10 0.52 0.14 0.00 0.00 0.00 0.00 174.94 175.50 1rff n HIS 280 N 3.73 -0.73 0.05 3.97 1.44 -0.54 -0.51 115.22 122.63 1rff n HIS 280 Ca -0.19 -0.68 0.01 0.00 -2.01 0.00 0.00 57.72 54.85 1rff n HIS 280 Cb 0.52 0.16 0.01 0.00 0.12 0.00 0.00 29.99 30.80 1rff n HIS 280 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1rff n THR 281 N -0.17 0.13 -3.84 0.61 -2.24 -0.76 -4.33 114.28 103.69 1rff n THR 281 Ca 0.00 -0.57 -0.36 0.00 -2.27 0.00 0.00 64.05 60.85 1rff n THR 281 Cb 0.17 0.96 -0.07 0.00 -2.10 0.00 0.00 70.33 69.29 1rff n THR 281 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1rff s SER 282 N -0.23 6.30 0.82 3.42 0.01 -1.26 -4.77 113.70 117.99 1rff s SER 282 Ca 0.02 0.38 -0.11 0.00 1.31 0.00 0.00 55.95 57.55 1rff s SER 282 Cb 0.01 -2.06 0.09 0.00 0.21 0.00 0.00 66.02 64.26 1rff s SER 282 CO 0.02 0.33 1.13 0.20 0.41 0.00 0.00 173.24 175.33 1rff s ASN 283 N -0.55 3.86 -1.27 2.44 0.01 -1.26 -4.91 114.94 113.26 1rff s ASN 283 Ca 0.12 2.05 -0.06 0.00 -0.71 0.00 0.00 52.86 54.26 1rff s ASN 283 Cb -0.12 -2.55 0.17 0.00 0.41 0.00 0.00 41.25 39.16 1rff s ASN 283 CO 0.02 -2.47 2.11 0.18 -1.51 0.00 0.00 177.10 175.43 1rff n LEU 284 N -3.64 7.44 -4.12 0.60 4.77 -0.31 -4.69 117.00 117.05 1rff n LEU 284 Ca 0.11 -4.88 -0.13 0.00 -0.03 0.00 0.00 56.01 51.08 1rff n LEU 284 Cb 0.52 -1.37 -0.11 0.00 -2.33 0.00 0.00 43.42 40.13 1rff n LEU 284 CO 0.51 1.82 -0.40 0.27 -1.33 0.00 0.00 177.39 178.26 1rff s ILE 285 N -1.07 0.67 0.23 -0.08 -4.36 -1.26 -0.89 121.20 114.44 1rff s ILE 285 Ca 0.46 -1.47 -0.06 0.00 -0.26 0.00 0.00 60.65 59.32 1rff s ILE 285 Cb 0.15 -1.11 0.18 0.00 1.25 0.00 0.00 42.46 42.92 1rff s ILE 285 CO -0.05 -0.58 1.77 -0.74 0.24 0.00 0.00 174.94 175.58 1rff h HIS 286 N 3.81 0.60 -0.60 1.37 -0.00 -1.94 -2.48 115.15 115.91 1rff h HIS 286 Ca -0.36 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 60.05 1rff h HIS 286 Cb 1.19 -0.16 -0.03 0.00 -0.00 0.00 0.00 27.41 28.41 1rff h HIS 286 CO 0.62 0.19 0.40 0.00 -0.00 0.00 0.00 177.93 179.14 1rff h ALA 287 N 1.45 1.58 0.00 5.26 0.00 -1.97 -2.01 119.26 123.58 1rff h ALA 287 Ca 0.36 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1rff h ALA 287 Cb 0.43 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1rff h ALA 287 CO -0.30 0.38 0.00 -0.44 0.00 0.00 0.00 179.25 178.89 1rff h ASP 288 N 0.80 0.00 -0.22 0.00 3.45 -1.72 -3.07 116.42 115.66 1rff h ASP 288 Ca 0.22 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.68 1rff h ASP 288 Cb -0.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.69 1rff h ASP 288 CO -0.05 0.00 0.00 0.79 -1.57 0.00 0.00 179.24 178.41 1rff n TRP 289 N -2.67 0.29 -0.03 4.55 7.02 -0.78 -4.54 117.44 121.28 1rff n TRP 289 Ca 0.02 -0.40 -0.02 0.00 -1.02 0.00 0.00 57.50 56.07 1rff n TRP 289 Cb 0.28 -0.03 -0.01 0.00 -2.42 0.00 0.00 31.31 29.14 1rff n TRP 289 CO 0.00 0.00 0.00 1.58 -2.02 0.00 0.00 177.69 177.25 1rff n HIS 290 N 0.32 0.27 -2.13 -5.99 -0.00 -1.06 -4.72 115.22 101.91 1rff n HIS 290 Ca 0.08 0.12 0.04 0.00 0.46 0.00 0.00 57.72 58.42 1rff n HIS 290 Cb 0.35 -0.38 0.07 0.00 -0.12 0.00 0.00 29.99 29.91 1rff n HIS 290 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 1rff n GLN 291 N -3.12 0.46 -4.03 1.57 6.02 -1.26 -0.76 117.38 116.26 1rff n GLN 291 Ca -0.03 -2.22 -0.22 0.00 -0.01 0.00 0.00 57.00 54.52 1rff n GLN 291 Cb 0.11 -0.55 -0.03 0.00 1.02 0.00 0.00 30.24 30.79 1rff n GLN 291 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1rff s LYS 292 N -0.95 3.21 -0.36 -1.09 1.02 -1.26 -3.68 119.74 116.63 1rff s LYS 292 Ca 0.30 -0.85 -0.23 0.00 0.02 0.00 0.00 55.97 55.21 1rff s LYS 292 Cb 0.33 -2.76 0.01 0.00 -0.52 0.00 0.00 37.83 34.88 1rff s LYS 292 CO -0.11 0.44 0.80 0.99 -0.92 0.00 0.00 175.35 176.54 1rff s THR 293 N -1.98 4.73 0.07 2.17 2.01 0.09 -4.81 115.64 117.92 1rff s THR 293 Ca 0.33 0.93 0.03 0.00 0.31 0.00 0.00 61.69 63.30 1rff s THR 293 Cb -0.09 -4.21 -0.03 0.00 0.01 0.00 0.00 72.50 68.17 1rff s THR 293 CO 0.27 -0.43 -0.10 -1.10 -0.69 0.00 0.00 174.62 172.57 1rff s GLN 294 N 3.12 0.72 0.15 4.92 -1.52 -1.26 -0.70 119.66 125.09 1rff s GLN 294 Ca 0.32 -0.99 0.09 0.00 -1.95 0.00 0.00 55.36 52.83 1rff s GLN 294 Cb -0.13 -0.48 -0.04 0.00 -0.22 0.00 0.00 33.01 32.14 1rff s GLN 294 CO 0.17 0.08 -0.15 0.20 -0.25 0.00 0.00 175.29 175.34 1rff s GLY 295 N -2.04 1.72 -0.02 3.09 0.00 -1.26 -2.17 107.32 106.64 1rff s GLY 295 Ca -0.01 -1.42 0.00 0.00 0.00 0.00 0.00 44.72 43.30 1rff s GLY 295 CO 0.00 -1.41 0.00 -0.42 0.00 0.00 0.00 173.10 171.27 1rff s ILE 296 N -1.40 0.10 -0.18 0.90 1.01 0.48 -1.83 121.20 120.29 1rff s ILE 296 Ca 0.21 0.07 -0.03 0.00 0.00 0.00 0.00 60.65 60.90 1rff s ILE 296 Cb -0.10 -0.18 -0.02 0.00 0.01 0.00 0.00 42.46 42.18 1rff s ILE 296 CO 0.12 0.10 -0.04 0.86 0.00 0.00 0.00 174.94 175.98 1rff s TRP 297 N 0.73 2.97 -0.24 3.97 -0.00 0.34 -0.69 118.94 126.02 1rff s TRP 297 Ca -0.07 -0.56 -0.07 0.00 -0.00 0.00 0.00 56.10 55.39 1rff s TRP 297 Cb -0.10 -2.01 -0.03 0.00 -0.00 0.00 0.00 33.47 31.33 1rff s TRP 297 CO -0.02 -0.25 0.07 -0.51 -0.00 0.00 0.00 176.95 176.25 1rff s LEU 298 N 0.82 3.50 0.87 5.86 1.43 -0.78 -1.65 118.68 128.73 1rff s LEU 298 Ca -0.01 -0.17 -0.12 0.00 -1.03 0.00 0.00 54.13 52.80 1rff s LEU 298 Cb -0.15 -1.94 0.11 0.00 0.03 0.00 0.00 46.19 44.25 1rff s LEU 298 CO 0.02 -0.01 1.10 -0.94 0.23 0.00 0.00 176.35 176.74 1rff s SER 299 N 1.48 3.78 0.99 2.29 1.04 -0.50 -4.83 113.70 117.96 1rff s SER 299 Ca 0.06 1.37 -0.12 0.00 0.48 0.00 0.00 55.95 57.74 1rff s SER 299 Cb -0.15 -2.06 0.19 0.00 0.10 0.00 0.00 66.02 64.09 1rff s SER 299 CO 0.04 -2.43 1.08 -2.84 0.98 0.00 0.00 173.24 170.07 1rff s PRO 300 N -5.04 0.45 -0.34 4.02 0.02 -1.26 -4.76 135.00 128.10 1rff s PRO 300 Ca 0.63 0.97 -0.29 0.00 0.02 0.00 0.00 61.00 62.33 1rff s PRO 300 Cb -0.17 -1.70 -0.00 0.00 0.02 0.00 0.00 34.50 32.65 1rff s PRO 300 CO 0.56 -2.84 1.49 -1.17 -0.33 0.00 0.00 177.00 174.71 1rff s LEU 301 N -6.64 3.70 -0.22 -5.54 2.96 -1.26 -4.61 118.68 107.05 1rff s LEU 301 Ca 0.66 1.14 -0.22 0.00 -0.22 0.00 0.00 54.13 55.49 1rff s LEU 301 Cb -0.21 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.92 1rff s LEU 301 CO 0.60 -1.37 0.71 -0.31 -1.32 0.00 0.00 176.35 174.66 1rff s TYR 302 N 5.39 3.34 0.68 5.38 2.02 0.41 -4.88 117.35 129.69 1rff s TYR 302 Ca 0.65 0.99 -0.11 0.00 -0.37 0.00 0.00 57.07 58.24 1rff s TYR 302 Cb -0.18 -2.91 -0.00 0.00 -0.40 0.00 0.00 41.96 38.47 1rff s TYR 302 CO 0.30 -0.29 1.06 -1.25 -1.57 0.00 0.00 175.55 173.80 1rff s PRO 303 N 2.37 3.08 0.49 -1.71 0.04 -1.26 -0.71 135.00 137.31 1rff s PRO 303 Ca 0.31 0.81 -0.22 0.00 0.04 0.00 0.00 61.00 61.94 1rff s PRO 303 Cb -0.16 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.30 1rff s PRO 303 CO 0.09 -0.96 1.18 1.03 0.04 0.00 0.00 177.00 178.39 1rff s ARG 304 N -5.13 3.57 0.15 4.56 0.52 -1.26 -0.58 118.95 120.78 1rff s ARG 304 Ca 0.57 1.80 -0.30 0.00 -0.52 0.00 0.00 55.73 57.28 1rff s ARG 304 Cb -0.13 -2.29 -0.07 0.00 0.52 0.00 0.00 34.95 32.98 1rff s ARG 304 CO 0.54 -0.72 1.15 0.42 0.02 0.00 0.00 175.30 176.71 1rff s ILE 305 N -1.56 3.84 0.51 1.52 1.01 0.09 -4.70 121.20 121.90 1rff s ILE 305 Ca 0.67 1.50 -0.23 0.00 0.00 0.00 0.00 60.65 62.59 1rff s ILE 305 Cb -0.29 -3.96 -0.06 0.00 0.01 0.00 0.00 42.46 38.16 1rff s ILE 305 CO 0.35 0.22 1.39 0.00 0.00 0.00 0.00 174.94 176.89 1rff s ALA 306 N 0.13 2.97 -0.20 9.38 0.00 -1.26 -4.86 121.76 127.92 1rff s ALA 306 Ca 0.53 1.39 -0.42 0.00 0.00 0.00 0.00 51.96 53.45 1rff s ALA 306 Cb -0.30 -3.58 -0.19 0.00 0.00 0.00 0.00 23.12 19.04 1rff s ALA 306 CO 0.34 -1.32 1.33 -0.25 0.00 0.00 0.00 175.76 175.86 1rff n ASP 307 N -0.73 0.73 -1.88 0.00 8.00 -1.26 -1.71 116.55 119.70 1rff n ASP 307 Ca 0.08 1.16 -0.09 0.00 0.71 0.00 0.00 54.79 56.65 1rff n ASP 307 Cb 0.44 -0.94 -0.02 0.00 -0.02 0.00 0.00 41.12 40.57 1rff n ASP 307 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rff n GLY 308 N 2.68 0.16 3.89 0.44 0.00 -1.26 -4.96 105.19 106.14 1rff n GLY 308 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 1rff n GLY 308 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1rff s THR 309 N -2.14 4.81 -0.89 2.61 -1.32 -0.69 -5.03 115.64 112.99 1rff s THR 309 Ca 0.00 0.52 -0.01 0.00 -1.21 0.00 0.00 61.69 60.99 1rff s THR 309 Cb 0.00 -3.80 0.22 0.00 -1.51 0.00 0.00 72.50 67.41 1rff s THR 309 CO 0.00 -0.74 0.79 1.41 -2.21 0.00 0.00 174.62 173.86 1rff n HIS 310 N -1.88 4.14 -4.68 9.09 -0.00 -1.26 -4.94 115.22 115.69 1rff n HIS 310 Ca 0.02 -4.12 -0.26 0.00 -0.00 0.00 0.00 57.72 53.37 1rff n HIS 310 Cb 0.54 -1.10 -0.14 0.00 -0.00 0.00 0.00 29.99 29.29 1rff n HIS 310 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 1rff s LYS 311 N -1.45 1.41 0.16 -0.41 1.02 -1.26 -5.02 119.74 114.18 1rff s LYS 311 Ca 0.28 -0.90 0.04 0.00 0.02 0.00 0.00 55.97 55.40 1rff s LYS 311 Cb -0.06 -1.50 -0.05 0.00 -0.52 0.00 0.00 37.83 35.70 1rff s LYS 311 CO -0.12 0.39 1.35 0.66 -0.92 0.00 0.00 175.35 176.70 1rff h SER 312 N 4.98 0.19 -0.21 2.83 4.64 -1.98 -3.47 113.55 120.53 1rff h SER 312 Ca -0.42 -0.16 -0.09 0.00 -0.47 0.00 0.00 61.79 60.65 1rff h SER 312 Cb 1.16 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 63.15 1rff h SER 312 CO 0.44 1.00 -0.08 0.61 -0.87 0.00 0.00 176.83 177.94 1rff n GLY 313 N 0.99 0.67 3.86 -0.77 0.00 -1.26 -4.89 105.19 103.78 1rff n GLY 313 Ca -0.03 -0.29 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 1rff n GLY 313 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rff s GLU 314 N -1.79 3.92 0.34 1.61 2.56 -1.26 -0.28 118.70 123.79 1rff s GLU 314 Ca 0.00 0.46 0.03 0.00 0.00 0.00 0.00 54.97 55.46 1rff s GLU 314 Cb 0.00 -2.66 -0.02 0.00 2.00 0.00 0.00 34.13 33.45 1rff s GLU 314 CO 0.00 0.31 0.51 0.45 -0.56 0.00 0.00 175.26 175.97 1rff s SER 315 N -2.17 6.13 0.44 -1.70 0.15 -1.26 -4.22 113.70 111.06 1rff s SER 315 Ca 0.47 0.17 0.30 0.00 0.70 0.00 0.00 55.95 57.59 1rff s SER 315 Cb -0.12 -1.70 1.57 0.00 -1.71 0.00 0.00 66.02 64.06 1rff s SER 315 CO 0.20 -0.36 1.91 1.55 1.20 0.00 0.00 173.24 177.74 1rff h PRO 316 N 0.81 0.00 -0.01 5.44 0.13 -1.82 -1.20 132.00 135.36 1rff h PRO 316 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1rff h PRO 316 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1rff h PRO 316 CO 0.58 0.00 -0.04 0.25 -0.23 0.00 0.00 178.00 178.56 1rff n THR 317 N -2.56 0.00 -1.59 1.56 -2.24 -1.26 -4.93 114.28 103.26 1rff n THR 317 Ca -0.02 -0.24 -0.15 0.00 -2.27 0.00 0.00 64.05 61.38 1rff n THR 317 Cb 0.08 0.52 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 1rff n THR 317 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1rff n HIS 318 N 0.07 -0.13 -0.31 4.78 8.25 -0.45 -4.74 115.22 122.69 1rff n HIS 318 Ca 0.18 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.75 1rff n HIS 318 Cb 0.36 -2.69 0.28 0.00 1.12 0.00 0.00 29.99 29.06 1rff n HIS 318 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1rff h PHE 319 N 0.00 0.75 -0.01 4.41 3.57 -1.83 -0.41 116.94 123.43 1rff h PHE 319 Ca -0.31 0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.23 1rff h PHE 319 Cb 1.01 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.56 1rff h PHE 319 CO 0.41 0.08 0.00 -0.22 -2.23 0.00 0.00 178.31 176.34 1rff h LYS 320 N 0.53 0.02 -0.64 1.11 3.64 -1.88 0.58 116.57 119.92 1rff h LYS 320 Ca 0.53 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.89 1rff h LYS 320 Cb 0.89 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.68 1rff h LYS 320 CO -0.45 0.28 0.34 0.00 -2.27 0.00 0.00 179.45 177.36 1rff h ALA 321 N 0.73 0.83 -0.65 5.00 0.00 -1.88 -0.92 119.26 122.37 1rff h ALA 321 Ca 0.00 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1rff h ALA 321 Cb 0.28 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1rff h ALA 321 CO 0.00 0.35 0.09 -0.91 0.00 0.00 0.00 179.25 178.78 1rff h ASN 322 N 0.88 1.05 -0.54 0.00 -0.26 -0.95 0.21 115.58 115.96 1rff h ASN 322 Ca 0.23 -0.26 -0.11 0.00 -0.56 0.00 0.00 56.30 55.60 1rff h ASN 322 Cb 0.06 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.02 1rff h ASN 322 CO -0.03 1.05 -0.09 0.25 -1.06 0.00 0.00 177.43 177.54 1rff h LEU 323 N 1.02 1.03 -0.72 1.61 5.85 -0.64 -0.80 115.31 122.66 1rff h LEU 323 Ca 0.20 -0.33 -0.11 0.00 0.84 0.00 0.00 57.88 58.48 1rff h LEU 323 Cb 0.45 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1rff h LEU 323 CO 0.02 1.13 -0.17 0.40 -0.34 0.00 0.00 178.44 179.47 1rff h ILE 324 N 0.92 1.27 -0.44 4.05 2.04 -0.88 -1.42 117.51 123.05 1rff h ILE 324 Ca 0.15 -1.27 -0.01 0.00 1.00 0.00 0.00 64.86 64.72 1rff h ILE 324 Cb 0.65 1.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 1rff h ILE 324 CO 0.05 0.43 0.22 0.28 0.00 0.00 0.00 178.15 179.13 1rff h SER 325 N 0.71 0.57 -0.30 1.72 0.02 -0.72 0.71 113.55 116.27 1rff h SER 325 Ca 0.11 -0.12 0.06 0.00 -0.84 0.00 0.00 61.79 61.00 1rff h SER 325 Cb 0.68 -0.15 -0.06 0.00 0.14 0.00 0.00 62.40 63.02 1rff h SER 325 CO 0.05 0.53 -0.08 0.22 -1.14 0.00 0.00 176.83 176.41 1rff h TYR 326 N 0.58 -0.16 -0.26 3.45 3.20 -0.96 -2.19 116.97 120.63 1rff h TYR 326 Ca 0.15 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.93 1rff h TYR 326 Cb 0.10 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1rff h TYR 326 CO -0.01 -0.13 -0.35 -0.07 -1.64 0.00 0.00 178.16 175.96 1rff h LEU 327 N -0.00 0.59 -1.73 2.82 3.38 -0.87 -2.84 115.31 116.65 1rff h LEU 327 Ca 0.14 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 1rff h LEU 327 Cb 0.22 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1rff h LEU 327 CO -0.31 0.89 0.14 0.74 0.09 0.00 0.00 178.44 180.00 1rff h THR 328 N 0.48 1.07 0.00 0.22 2.02 -0.65 -2.45 112.91 113.59 1rff h THR 328 Ca 0.05 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1rff h THR 328 Cb 0.83 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1rff h THR 328 CO 0.07 0.07 -0.03 0.00 0.37 0.00 0.00 175.52 176.01 1rff h ALA 329 N 1.83 1.13 0.00 6.16 0.00 -1.14 -1.48 119.26 125.77 1rff h ALA 329 Ca 0.09 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1rff h ALA 329 Cb -0.01 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1rff h ALA 329 CO -0.02 0.03 -0.27 1.88 0.00 0.00 0.00 179.25 180.87 1rff h TYR 330 N 0.00 0.00 -6.24 0.00 -1.99 -1.57 -3.47 116.97 103.69 1rff h TYR 330 Ca -0.00 0.00 -0.45 0.00 2.00 0.00 0.00 58.73 60.28 1rff h TYR 330 Cb 0.17 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.90 1rff h TYR 330 CO 0.00 0.27 -0.82 -1.71 -0.00 0.00 0.00 178.16 175.90 1rff n ASN 331 N -3.56 -1.92 -4.19 3.88 4.05 -0.56 -4.72 115.26 108.24 1rff n ASN 331 Ca -0.01 -0.85 -0.30 0.00 0.45 0.00 0.00 54.58 53.87 1rff n ASN 331 Cb 0.41 -3.77 -0.17 0.00 1.23 0.00 0.00 39.78 37.49 1rff n ASN 331 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1rff s ALA 332 N -3.63 1.97 0.28 5.20 0.00 -1.26 -5.04 121.76 119.27 1rff s ALA 332 Ca 0.19 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 51.24 1rff s ALA 332 Cb -0.09 -0.72 0.37 0.00 0.00 0.00 0.00 23.12 22.68 1rff s ALA 332 CO 0.84 0.29 1.94 -1.00 0.00 0.00 0.00 175.76 177.83 1rff h PRO 333 N 6.58 1.19 0.00 0.00 0.13 -2.00 -1.75 132.00 136.15 1rff h PRO 333 Ca -0.25 -0.07 -0.03 0.00 -0.87 0.00 0.00 66.00 64.78 1rff h PRO 333 Cb 1.21 -0.27 -0.00 0.00 0.13 0.00 0.00 31.00 32.07 1rff h PRO 333 CO 0.47 0.79 -0.16 0.66 -0.23 0.00 0.00 178.00 179.54 1rff h SER 334 N 1.23 0.00 1.44 1.44 4.64 -1.97 -2.07 113.55 118.26 1rff h SER 334 Ca 0.35 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.65 1rff h SER 334 Cb -0.10 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1rff h SER 334 CO -0.08 0.16 -0.57 -0.07 -0.87 0.00 0.00 176.83 175.39 1rff h LEU 335 N 0.00 0.00 -0.88 5.97 3.38 -1.73 -3.26 115.31 118.78 1rff h LEU 335 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1rff h LEU 335 Cb 0.50 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 1rff h LEU 335 CO 0.02 0.05 -0.29 0.50 0.09 0.00 0.00 178.44 178.81 1rff h LYS 336 N 0.00 0.49 -0.54 1.13 1.63 -0.89 -0.08 116.57 118.31 1rff h LYS 336 Ca -0.01 -0.20 -0.00 0.00 -0.85 0.00 0.00 60.65 59.59 1rff h LYS 336 Cb 1.04 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.62 1rff h LYS 336 CO 0.00 0.73 0.33 0.93 -3.45 0.00 0.00 179.45 177.99 1rff h GLU 337 N 0.43 0.72 -0.10 1.90 3.07 -1.59 -0.58 114.58 118.42 1rff h GLU 337 Ca 0.06 -0.06 -0.19 0.00 -0.50 0.00 0.00 59.36 58.67 1rff h GLU 337 Cb 0.72 -0.16 -0.00 0.00 -0.84 0.00 0.00 28.75 28.47 1rff h GLU 337 CO 0.06 0.50 -0.72 -1.49 -1.40 0.00 0.00 179.01 175.95 1rff h TRP 338 N 0.74 0.66 -0.37 4.33 4.06 -1.36 -1.92 115.95 122.09 1rff h TRP 338 Ca 0.20 -0.28 0.00 0.00 2.06 0.00 0.00 58.89 60.86 1rff h TRP 338 Cb -0.04 -0.10 -0.02 0.00 -1.00 0.00 0.00 29.16 28.00 1rff h TRP 338 CO 0.00 1.05 0.24 0.82 -3.56 0.00 0.00 178.44 177.00 1rff h ILE 339 N 0.34 1.10 -0.57 1.49 2.04 -0.60 -0.08 117.51 121.24 1rff h ILE 339 Ca -0.03 -0.19 -0.05 0.00 1.00 0.00 0.00 64.86 65.59 1rff h ILE 339 Cb 1.31 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 1rff h ILE 339 CO 0.13 0.10 0.17 0.44 0.00 0.00 0.00 178.15 178.98 1rff h ASP 340 N 0.50 0.79 -0.22 1.72 3.45 -1.02 0.13 116.42 121.78 1rff h ASP 340 Ca 0.14 -0.13 0.02 0.00 0.43 0.00 0.00 57.03 57.49 1rff h ASP 340 Cb -0.05 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.49 1rff h ASP 340 CO -0.03 0.76 0.08 0.58 -1.57 0.00 0.00 179.24 179.06 1rff h VAL 341 N 0.83 0.95 -0.66 -1.35 2.07 -0.91 -2.71 116.25 114.48 1rff h VAL 341 Ca 0.19 -0.06 -0.03 0.00 0.82 0.00 0.00 66.70 67.61 1rff h VAL 341 Cb 0.26 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 1rff h VAL 341 CO -0.01 0.03 0.28 0.40 0.02 0.00 0.00 177.57 178.29 1rff h ILE 342 N 0.18 1.23 -0.98 4.57 2.04 -0.37 -2.22 117.51 121.97 1rff h ILE 342 Ca 0.09 -0.72 0.17 0.00 1.00 0.00 0.00 64.86 65.40 1rff h ILE 342 Cb 0.06 0.48 -0.09 0.00 -0.74 0.00 0.00 36.82 36.53 1rff h ILE 342 CO -0.09 0.29 0.61 0.45 0.00 0.00 0.00 178.15 179.41 1rff h HIS 343 N 0.92 0.98 0.00 1.37 3.86 -0.83 -1.33 115.15 120.12 1rff h HIS 343 Ca 0.22 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.46 1rff h HIS 343 Cb 0.18 -0.30 0.00 0.00 1.06 0.00 0.00 27.41 28.35 1rff h HIS 343 CO 0.01 0.29 0.00 1.63 0.86 0.00 0.00 177.93 180.72 1rff n LYS 344 N -4.66 0.82 -4.28 2.45 4.01 -0.84 -4.86 118.16 110.80 1rff n LYS 344 Ca 0.21 0.00 -0.23 0.00 -0.51 0.00 0.00 58.31 57.78 1rff n LYS 344 Cb 0.52 -1.50 -0.07 0.00 -0.51 0.00 0.00 35.03 33.47 1rff n LYS 344 CO 0.00 0.00 0.00 -1.01 -1.11 0.00 0.00 177.40 175.28 1rff s HIS 345 N -2.17 2.73 -0.48 2.13 4.02 -0.50 -0.74 115.29 120.28 1rff s HIS 345 Ca 0.42 -0.21 -0.16 0.00 1.02 0.00 0.00 55.06 56.12 1rff s HIS 345 Cb 0.21 -1.22 0.07 0.00 -1.02 0.00 0.00 32.58 30.62 1rff s HIS 345 CO 0.39 0.61 0.45 0.34 1.02 0.00 0.00 174.74 177.55 1rff s ASP 346 N -3.63 6.17 -0.13 1.40 2.15 0.25 -4.70 116.67 118.17 1rff s ASP 346 Ca 0.31 -1.22 0.17 0.00 0.43 0.00 0.00 52.55 52.24 1rff s ASP 346 Cb -0.07 -2.21 0.66 0.00 -0.30 0.00 0.00 42.92 41.01 1rff s ASP 346 CO 0.20 -0.70 1.58 0.18 -0.17 0.00 0.00 175.17 176.26 1rff n LEU 347 N 5.44 4.60 0.32 -1.34 4.32 0.61 -4.07 117.00 126.88 1rff n LEU 347 Ca -0.11 -2.58 0.19 0.00 -0.02 0.00 0.00 56.01 53.49 1rff n LEU 347 Cb 0.44 -0.55 1.07 0.00 -1.62 0.00 0.00 43.42 42.75 1rff n LEU 347 CO 0.49 0.75 1.15 0.77 -1.22 0.00 0.00 177.39 179.33 1rff h SER 348 N 3.46 0.00 0.39 -1.43 4.64 -1.57 -2.05 113.55 116.99 1rff h SER 348 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rff h SER 348 Cb 1.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1rff h SER 348 CO 0.25 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.60 1rff n GLU 349 N -3.43 0.55 -1.92 4.77 -0.58 -1.26 -4.39 120.64 114.37 1rff n GLU 349 Ca -0.03 0.01 -0.42 0.00 -0.42 0.00 0.00 57.16 56.31 1rff n GLU 349 Cb 0.09 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.43 1rff n GLU 349 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1rff s THR 350 N -2.42 2.52 -0.19 2.62 2.01 -0.77 -4.91 115.64 114.50 1rff s THR 350 Ca 0.32 0.39 0.11 0.00 0.31 0.00 0.00 61.69 62.82 1rff s THR 350 Cb 0.19 -3.25 0.22 0.00 0.01 0.00 0.00 72.50 69.68 1rff s THR 350 CO 0.41 0.04 1.15 -0.46 -0.69 0.00 0.00 174.62 175.07 1rff n ASN 351 N 3.38 2.51 -4.55 3.53 0.23 -1.26 -4.54 115.26 114.56 1rff n ASN 351 Ca 0.12 -2.56 -0.25 0.00 -0.53 0.00 0.00 54.58 51.36 1rff n ASN 351 Cb 0.38 -0.27 -0.09 0.00 -2.08 0.00 0.00 39.78 37.72 1rff n ASN 351 CO 0.00 0.00 0.00 0.68 -0.93 0.00 0.00 177.26 177.01 1rff s VAL 352 N -1.97 2.97 -0.12 3.53 -7.23 -1.26 -4.74 120.40 111.59 1rff s VAL 352 Ca 0.21 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.30 1rff s VAL 352 Cb 0.17 -2.53 -0.04 0.00 0.56 0.00 0.00 36.38 34.53 1rff s VAL 352 CO 0.04 -0.28 0.17 -0.31 -0.31 0.00 0.00 175.10 174.41 1rff s TYR 353 N -2.13 3.59 -0.03 2.82 1.51 -0.65 -4.66 117.35 117.81 1rff s TYR 353 Ca 0.28 0.56 -0.24 0.00 -1.01 0.00 0.00 57.07 56.65 1rff s TYR 353 Cb -0.07 -2.01 -0.04 0.00 -0.11 0.00 0.00 41.96 39.73 1rff s TYR 353 CO 0.16 0.66 0.74 -1.17 -1.11 0.00 0.00 175.55 174.83 1rff s LEU 354 N -0.83 4.36 -0.29 -1.29 2.96 -1.26 -0.39 118.68 121.93 1rff s LEU 354 Ca 0.15 1.30 0.03 0.00 -0.22 0.00 0.00 54.13 55.40 1rff s LEU 354 Cb -0.12 -3.16 0.08 0.00 0.50 0.00 0.00 46.19 43.48 1rff s LEU 354 CO 0.04 -0.08 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.32 1rff s ILE 355 N 0.54 2.22 0.15 6.68 1.01 -0.44 -4.95 121.20 126.41 1rff s ILE 355 Ca 0.39 -1.93 0.06 0.00 0.00 0.00 0.00 60.65 59.16 1rff s ILE 355 Cb -0.19 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.79 1rff s ILE 355 CO 0.20 -0.27 0.05 -0.83 0.00 0.00 0.00 174.94 174.10 1rff s GLY 356 N 1.02 1.79 -0.03 6.18 0.00 -1.26 -0.74 107.32 114.28 1rff s GLY 356 Ca -0.01 -1.24 0.06 0.00 0.00 0.00 0.00 44.72 43.54 1rff s GLY 356 CO -0.06 -1.24 -0.22 -0.56 0.00 0.00 0.00 173.10 171.02 1rff s SER 357 N -2.82 3.43 0.02 1.64 0.01 -0.04 -1.25 113.70 114.69 1rff s SER 357 Ca 0.28 -0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1rff s SER 357 Cb -0.10 -0.53 -0.02 0.00 0.21 0.00 0.00 66.02 65.58 1rff s SER 357 CO 0.20 0.33 -0.03 0.28 0.41 0.00 0.00 173.24 174.43 1rff s THR 358 N -0.67 0.12 0.24 1.44 -1.32 -1.18 -1.77 115.64 112.50 1rff s THR 358 Ca 0.11 -0.85 -0.30 0.00 -1.21 0.00 0.00 61.69 59.44 1rff s THR 358 Cb -0.10 -0.26 -0.10 0.00 -1.51 0.00 0.00 72.50 70.53 1rff s THR 358 CO -0.00 -0.46 1.38 -2.84 -2.21 0.00 0.00 174.62 170.49 1rff s PRO 359 N -1.35 4.32 0.00 7.08 0.02 -1.21 -4.67 135.00 139.19 1rff s PRO 359 Ca -0.14 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.07 1rff s PRO 359 Cb -0.09 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.29 1rff s PRO 359 CO -0.01 -0.33 0.00 0.41 -0.33 0.00 0.00 177.00 176.74 1rff n GLY 360 N 2.10 -0.93 2.94 0.52 0.00 -0.38 -4.97 105.19 104.47 1rff n GLY 360 Ca 0.06 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.57 1rff n GLY 360 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rff s ARG 361 N -2.00 1.76 -0.18 1.61 0.52 -1.26 -1.15 118.95 118.25 1rff s ARG 361 Ca 0.00 -0.58 -0.01 0.00 -0.52 0.00 0.00 55.73 54.62 1rff s ARG 361 Cb 0.00 -2.08 -0.00 0.00 0.52 0.00 0.00 34.95 33.39 1rff s ARG 361 CO 0.00 -0.37 -0.12 -0.06 0.02 0.00 0.00 175.30 174.77 1rff s PHE 362 N 1.55 2.85 0.29 -0.53 0.08 0.25 -4.91 117.98 117.56 1rff s PHE 362 Ca 0.01 -1.07 0.05 0.00 0.12 0.00 0.00 56.93 56.05 1rff s PHE 362 Cb -0.15 -1.97 -0.06 0.00 -0.57 0.00 0.00 43.02 40.28 1rff s PHE 362 CO -0.08 -0.53 -0.02 -0.65 -0.10 0.00 0.00 175.22 173.84 1rff s GLN 363 N 1.08 1.55 7.50 0.44 -0.21 -1.26 -0.98 119.66 127.77 1rff s GLN 363 Ca 0.00 -1.81 0.00 0.00 0.02 0.00 0.00 55.36 53.57 1rff s GLN 363 Cb -0.15 -0.99 0.00 0.00 1.00 0.00 0.00 33.01 32.88 1rff s GLN 363 CO -0.03 -0.05 0.00 0.41 -2.12 0.00 0.00 175.29 173.50 1rff n GLY 364 N -0.59 3.00 0.25 3.09 0.00 -1.26 -1.58 105.19 108.10 1rff n GLY 364 Ca -0.05 -0.22 0.15 0.00 0.00 0.00 0.00 46.02 45.90 1rff n GLY 364 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1rff h SER 365 N 0.72 0.00 1.34 1.61 4.64 -2.00 -2.86 113.55 117.01 1rff h SER 365 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1rff h SER 365 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1rff h SER 365 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1rff n GLN 366 N -3.03 0.25 0.02 4.77 6.02 -0.61 -3.69 117.38 121.10 1rff n GLN 366 Ca 0.02 0.25 0.09 0.00 -0.01 0.00 0.00 57.00 57.36 1rff n GLN 366 Cb 0.38 -1.82 0.52 0.00 1.02 0.00 0.00 30.24 30.34 1rff n GLN 366 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1rff h LYS 367 N 0.00 0.33 -0.01 -1.09 3.64 -1.44 -2.07 116.57 115.93 1rff h LYS 367 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1rff h LYS 367 Cb 0.67 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1rff h LYS 367 CO 0.00 0.22 -0.03 -0.25 -2.27 0.00 0.00 179.45 177.12 1rff n ASP 368 N -4.48 1.13 0.13 4.20 8.00 -1.24 -4.21 116.55 120.08 1rff n ASP 368 Ca 0.05 -1.29 -0.01 0.00 0.71 0.00 0.00 54.79 54.25 1rff n ASP 368 Cb 0.24 0.01 0.11 0.00 -0.02 0.00 0.00 41.12 41.46 1rff n ASP 368 CO 0.00 0.00 0.00 0.78 -0.39 0.00 0.00 177.20 177.59 1rff h ASN 369 N 1.72 0.00 -5.29 -2.24 2.35 -1.59 -3.25 115.58 107.28 1rff h ASN 369 Ca 0.00 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.62 1rff h ASN 369 Cb 0.41 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 38.63 1rff h ASN 369 CO 0.00 0.66 -0.58 0.26 -1.65 0.00 0.00 177.43 176.12 1rff s TRP 370 N -3.32 0.55 0.00 1.19 0.52 -1.26 -4.71 118.94 111.92 1rff s TRP 370 Ca 0.00 -1.01 0.00 0.00 0.02 0.00 0.00 56.10 55.11 1rff s TRP 370 Cb 0.11 -0.33 0.00 0.00 -1.15 0.00 0.00 33.47 32.11 1rff s TRP 370 CO 0.76 -0.49 0.00 0.41 0.02 0.00 0.00 176.95 177.65 1rff n GLY 371 N -0.02 1.67 0.22 0.98 0.00 -0.38 -2.30 105.19 105.36 1rff n GLY 371 Ca -0.11 -0.52 0.10 0.00 0.00 0.00 0.00 46.02 45.49 1rff n GLY 371 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1rff h HIS 372 N 0.00 0.00 0.00 1.61 2.07 -1.51 -2.11 115.15 115.21 1rff h HIS 372 Ca 0.00 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.40 1rff h HIS 372 Cb 0.00 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 29.96 1rff h HIS 372 CO 0.00 0.24 -0.59 0.74 -3.07 0.00 0.00 177.93 175.24 1rff h PHE 373 N 0.00 0.00 -0.04 6.12 -1.00 -1.82 -0.03 116.94 120.17 1rff h PHE 373 Ca -0.00 0.00 -0.00 0.00 2.81 0.00 0.00 57.97 60.78 1rff h PHE 373 Cb 0.72 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 40.28 1rff h PHE 373 CO 0.00 0.59 0.02 -0.09 -1.61 0.00 0.00 178.31 177.23 1rff h ARG 374 N 0.00 0.06 -0.24 1.51 9.65 -0.96 -0.90 114.38 123.49 1rff h ARG 374 Ca -0.01 -0.01 0.04 0.00 -1.10 0.00 0.00 59.98 58.91 1rff h ARG 374 Cb 1.07 -0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 29.60 1rff h ARG 374 CO 0.08 0.10 0.02 1.25 2.80 0.00 0.00 179.97 184.21 1rff h LEU 375 N 0.00 -0.06 -0.40 3.80 5.85 -1.24 -1.69 115.31 121.57 1rff h LEU 375 Ca 0.01 0.05 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1rff h LEU 375 Cb 0.05 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 1rff h LEU 375 CO -0.00 0.00 0.08 0.50 -0.34 0.00 0.00 178.44 178.68 1rff h LYS 376 N 0.10 0.20 -0.81 1.25 3.64 -0.84 -0.93 116.57 119.18 1rff h LYS 376 Ca 0.11 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1rff h LYS 376 Cb 0.13 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.87 1rff h LYS 376 CO -0.18 0.13 0.45 -0.22 -2.27 0.00 0.00 179.45 177.36 1rff h LYS 377 N 0.21 1.13 -0.60 1.90 1.63 -0.82 -0.15 116.57 119.88 1rff h LYS 377 Ca 0.19 -0.13 -0.09 0.00 -0.85 0.00 0.00 60.65 59.77 1rff h LYS 377 Cb 0.23 -0.22 -0.02 0.00 -0.60 0.00 0.00 32.23 31.62 1rff h LYS 377 CO -0.26 0.84 0.01 -0.07 -3.45 0.00 0.00 179.45 176.52 1rff h LEU 378 N 1.13 1.02 -0.61 5.20 3.38 -0.83 -1.65 115.31 122.94 1rff h LEU 378 Ca 0.29 -0.28 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 1rff h LEU 378 Cb 0.03 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1rff h LEU 378 CO -0.05 1.06 -0.54 -0.07 0.09 0.00 0.00 178.44 178.94 1rff h LEU 379 N 0.95 0.48 -0.58 1.67 3.38 -0.80 0.87 115.31 121.28 1rff h LEU 379 Ca 0.17 -0.25 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1rff h LEU 379 Cb 0.54 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 1rff h LEU 379 CO 0.03 0.93 0.06 0.50 0.09 0.00 0.00 178.44 180.05 1rff h LYS 380 N 0.34 0.98 0.05 1.13 3.64 -0.86 -1.06 116.57 120.79 1rff h LYS 380 Ca 0.01 -0.28 -0.29 0.00 -1.27 0.00 0.00 60.65 58.82 1rff h LYS 380 Cb 1.05 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.74 1rff h LYS 380 CO 0.09 0.95 -1.53 -0.44 -2.27 0.00 0.00 179.45 176.25 1rff h ASP 381 N 0.88 0.17 0.00 4.20 3.32 -1.13 -3.32 116.42 120.54 1rff h ASP 381 Ca 0.17 -0.27 0.00 0.00 0.02 0.00 0.00 57.03 56.96 1rff h ASP 381 Cb 0.46 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1rff h ASP 381 CO 0.02 1.23 0.00 1.41 -1.72 0.00 0.00 179.24 180.17 1rff n HIS 382 N -3.28 0.00 -4.38 4.55 8.25 0.28 -4.99 115.22 115.65 1rff n HIS 382 Ca -0.15 -0.20 -0.25 0.00 -0.26 0.00 0.00 57.72 56.86 1rff n HIS 382 Cb 1.03 -0.02 -0.10 0.00 1.12 0.00 0.00 29.99 32.02 1rff n HIS 382 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1rff s ALA 383 N -0.41 2.84 0.05 -1.41 0.00 -1.06 -4.49 121.76 117.28 1rff s ALA 383 Ca 0.00 -1.69 0.07 0.00 0.00 0.00 0.00 51.96 50.35 1rff s ALA 383 Cb 0.00 -0.49 -0.03 0.00 0.00 0.00 0.00 23.12 22.60 1rff s ALA 383 CO 0.00 0.35 -0.21 -1.54 0.00 0.00 0.00 175.76 174.36 1rff s SER 384 N -3.21 2.51 0.14 0.00 1.04 -1.26 -2.47 113.70 110.44 1rff s SER 384 Ca 0.27 -0.55 -0.30 0.00 0.48 0.00 0.00 55.95 55.85 1rff s SER 384 Cb -0.07 -0.20 -0.07 0.00 0.10 0.00 0.00 66.02 65.79 1rff s SER 384 CO 0.15 0.15 1.07 -0.55 0.98 0.00 0.00 173.24 175.04 1rff s SER 385 N -1.29 7.31 0.30 7.02 0.15 -1.24 -4.72 113.70 121.23 1rff s SER 385 Ca 0.07 1.98 0.06 0.00 0.70 0.00 0.00 55.95 58.77 1rff s SER 385 Cb -0.09 -2.60 -0.02 0.00 -1.71 0.00 0.00 66.02 61.60 1rff s SER 385 CO 0.02 -0.21 0.37 0.00 1.20 0.00 0.00 173.24 174.62 1rff s MET 386 N -0.05 3.10 0.23 5.44 0.23 -1.26 -5.06 119.30 121.93 1rff s MET 386 Ca 0.50 -1.01 -0.31 0.00 -1.03 0.00 0.00 55.69 53.84 1rff s MET 386 Cb -0.27 -2.74 -0.11 0.00 -1.53 0.00 0.00 34.83 30.18 1rff s MET 386 CO 0.33 0.22 1.57 -2.14 -2.03 0.00 0.00 175.02 172.97 1rff s PRO 387 N -4.04 4.18 -0.40 3.16 0.02 -1.26 -2.64 135.00 134.02 1rff s PRO 387 Ca 0.40 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.87 1rff s PRO 387 Cb -0.08 -3.09 0.00 0.00 0.02 0.00 0.00 34.50 31.35 1rff s PRO 387 CO 0.29 -0.60 0.00 0.09 -0.33 0.00 0.00 177.00 176.45 1rff n ASN 388 N 3.05 -3.12 -0.31 2.53 5.03 -1.26 -4.93 115.26 116.25 1rff n ASN 388 Ca 0.11 0.07 0.27 0.00 0.87 0.00 0.00 54.58 55.90 1rff n ASN 388 Cb 0.38 -1.33 0.60 0.00 -1.02 0.00 0.00 39.78 38.41 1rff n ASN 388 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1rff h ALA 389 N 0.04 2.54 0.00 5.41 0.00 -1.91 -0.35 119.26 124.98 1rff h ALA 389 Ca -0.08 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1rff h ALA 389 Cb 0.44 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1rff h ALA 389 CO 0.12 -0.91 0.03 0.93 0.00 0.00 0.00 179.25 179.42 1rff h GLU 390 N 0.25 0.00 -0.18 0.00 3.07 -1.92 -0.49 114.58 115.31 1rff h GLU 390 Ca 0.57 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.43 1rff h GLU 390 Cb 1.73 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.64 1rff h GLU 390 CO -0.19 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.29 1rff n SER 391 N -2.70 2.65 -4.63 1.42 3.41 -0.14 -3.64 113.62 109.99 1rff n SER 391 Ca -0.02 -1.77 -0.43 0.00 -0.26 0.00 0.00 58.87 56.39 1rff n SER 391 Cb 0.08 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 63.89 1rff n SER 391 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1rff s TRP 392 N -1.19 3.12 1.01 7.33 0.52 -0.19 -4.04 118.94 125.51 1rff s TRP 392 Ca 0.23 1.05 -0.12 0.00 0.02 0.00 0.00 56.10 57.28 1rff s TRP 392 Cb 0.14 -3.67 0.20 0.00 -1.15 0.00 0.00 33.47 28.99 1rff s TRP 392 CO 0.20 -0.79 1.08 -2.14 0.02 0.00 0.00 176.95 175.33 1rff s PRO 393 N 3.59 0.29 -0.02 4.98 0.02 -1.17 -4.67 135.00 138.01 1rff s PRO 393 Ca 0.43 0.89 0.04 0.00 0.02 0.00 0.00 61.00 62.38 1rff s PRO 393 Cb -0.12 -1.69 -0.03 0.00 0.02 0.00 0.00 34.50 32.68 1rff s PRO 393 CO 0.17 -2.92 -0.11 0.08 -0.33 0.00 0.00 177.00 173.88 1rff s VAL 394 N -2.72 3.31 -0.07 3.83 1.01 -0.35 -3.39 120.40 122.01 1rff s VAL 394 Ca 0.66 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.89 1rff s VAL 394 Cb -0.21 -2.37 0.01 0.00 0.00 0.00 0.00 36.38 33.81 1rff s VAL 394 CO 0.60 0.49 -0.14 -0.69 0.00 0.00 0.00 175.10 175.36 1rff s VAL 395 N -0.86 1.26 -0.01 2.92 1.01 -0.55 -0.51 120.40 123.66 1rff s VAL 395 Ca 0.14 -0.55 0.06 0.00 0.00 0.00 0.00 61.98 61.63 1rff s VAL 395 Cb -0.11 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.11 1rff s VAL 395 CO 0.04 0.38 -0.19 -0.83 0.00 0.00 0.00 175.10 174.50 1rff s GLY 396 N 0.66 0.95 -0.05 4.51 0.00 -0.05 -1.47 107.32 111.87 1rff s GLY 396 Ca -0.14 -0.84 -0.02 0.00 0.00 0.00 0.00 44.72 43.72 1rff s GLY 396 CO 0.04 -0.70 0.09 1.62 0.00 0.00 0.00 173.10 174.15 1rff s GLN 397 N -0.47 0.01 0.30 2.90 -0.44 0.33 -0.32 119.66 121.96 1rff s GLN 397 Ca 0.07 0.32 -0.20 0.00 -2.50 0.00 0.00 55.36 53.06 1rff s GLN 397 Cb -0.07 -0.27 0.03 0.00 -1.64 0.00 0.00 33.01 31.06 1rff s GLN 397 CO -0.01 -0.21 0.75 -0.59 0.50 0.00 0.00 175.29 175.74 1rff s PHE 398 N 1.42 -0.11 0.00 1.67 -0.71 -1.13 -0.83 117.98 118.28 1rff s PHE 398 Ca -0.06 -0.40 0.00 0.00 -1.04 0.00 0.00 56.93 55.43 1rff s PHE 398 Cb -0.12 0.74 0.00 0.00 -1.21 0.00 0.00 43.02 42.43 1rff s PHE 398 CO -0.04 -1.30 0.46 -1.13 -1.34 0.00 0.00 175.22 171.86 1rff n SER 399 N -0.71 0.88 -3.92 1.98 3.41 -1.26 -4.67 113.62 109.33 1rff n SER 399 Ca -0.05 -1.11 -0.11 0.00 -0.26 0.00 0.00 58.87 57.34 1rff n SER 399 Cb 0.59 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.42 1rff n SER 399 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1rff s SER 400 N -0.11 0.10 -0.09 4.04 0.15 -1.26 -3.93 113.70 112.60 1rff s SER 400 Ca 0.00 -0.23 0.02 0.00 0.70 0.00 0.00 55.95 56.43 1rff s SER 400 Cb 0.00 0.09 0.02 0.00 -1.71 0.00 0.00 66.02 64.42 1rff s SER 400 CO 0.00 -0.18 -0.13 -0.69 1.20 0.00 0.00 173.24 173.44 1rff s VAL 401 N -0.82 1.26 0.78 4.45 1.01 -1.26 -2.36 120.40 123.45 1rff s VAL 401 Ca -0.09 -0.51 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 1rff s VAL 401 Cb -0.06 -1.17 0.13 0.00 0.00 0.00 0.00 36.38 35.28 1rff s VAL 401 CO -0.00 0.39 1.08 -0.83 0.00 0.00 0.00 175.10 175.74 1rff s GLY 402 N 0.95 1.75 -0.33 4.51 0.00 -0.17 -4.85 107.32 109.19 1rff s GLY 402 Ca -0.09 -1.37 -0.29 0.00 0.00 0.00 0.00 44.72 42.97 1rff s GLY 402 CO -0.00 -0.80 1.25 -0.45 0.00 0.00 0.00 173.10 173.10 1rff s SER 403 N -4.72 6.69 0.00 1.64 0.15 -1.26 -4.92 113.70 111.29 1rff s SER 403 Ca 0.67 1.07 0.19 0.00 0.70 0.00 0.00 55.95 58.58 1rff s SER 403 Cb -0.06 -2.54 -0.18 0.00 -1.71 0.00 0.00 66.02 61.53 1rff s SER 403 CO 0.47 -1.09 0.84 0.18 1.20 0.00 0.00 173.24 174.84 1rff n LEU 404 N 7.60 1.06 0.00 3.45 4.77 -1.26 -4.73 117.00 127.89 1rff n LEU 404 Ca 0.14 -0.54 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 1rff n LEU 404 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1rff n LEU 404 CO 0.64 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 177.55 1rff n GLY 405 N 1.43 2.44 0.28 -0.72 0.00 -1.26 -4.16 105.19 103.20 1rff n GLY 405 Ca 0.04 -2.11 0.17 0.00 0.00 0.00 0.00 46.02 44.12 1rff n GLY 405 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rff h ALA 406 N 0.00 1.02 -2.95 4.61 0.00 -1.98 -3.44 119.26 116.51 1rff h ALA 406 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 1rff h ALA 406 Cb 0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 1rff h ALA 406 CO 0.00 0.03 0.02 0.16 0.00 0.00 0.00 179.25 179.46 1rff s ASP 407 N -5.70 0.37 0.45 0.00 -4.77 -1.26 -4.92 116.67 100.85 1rff s ASP 407 Ca 0.00 -1.23 0.31 0.00 -3.30 0.00 0.00 52.55 48.33 1rff s ASP 407 Cb 0.10 0.73 1.49 0.00 -1.09 0.00 0.00 42.92 44.14 1rff s ASP 407 CO 0.54 -1.43 1.94 1.05 0.70 0.00 0.00 175.17 177.97 1rff h GLU 408 N 2.08 0.00 0.00 2.11 4.11 -1.93 -2.72 114.58 118.23 1rff h GLU 408 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.14 1rff h GLU 408 Cb 1.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1rff h GLU 408 CO 0.38 0.00 -0.26 -1.13 0.07 0.00 0.00 179.01 178.07 1rff n SER 409 N -2.68 0.36 -0.02 3.06 3.41 -1.26 -0.27 113.62 116.22 1rff n SER 409 Ca -0.00 0.20 -0.09 0.00 -0.26 0.00 0.00 58.87 58.71 1rff n SER 409 Cb 0.16 -0.18 0.07 0.00 -0.26 0.00 0.00 64.21 64.00 1rff n SER 409 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1rff h LYS 410 N 0.00 0.62 0.00 4.33 1.79 -1.78 -3.39 116.57 118.13 1rff h LYS 410 Ca 0.00 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.13 1rff h LYS 410 Cb 0.56 0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.23 1rff h LYS 410 CO 0.00 0.94 0.00 1.87 -1.08 0.00 0.00 179.45 181.18 1rff n TRP 411 N -4.01 -1.55 0.22 -1.35 -0.00 -1.26 -4.81 117.44 104.68 1rff n TRP 411 Ca -0.02 0.00 -0.15 0.00 -0.00 0.00 0.00 57.50 57.33 1rff n TRP 411 Cb 0.55 0.37 -0.08 0.00 -0.00 0.00 0.00 31.31 32.16 1rff n TRP 411 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 177.69 178.94 1rff h LEU 412 N 0.00 -0.42 -2.59 5.87 5.85 -1.80 -1.02 115.31 121.21 1rff h LEU 412 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1rff h LEU 412 Cb 0.00 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1rff h LEU 412 CO 0.00 -0.30 0.00 0.00 -0.34 0.00 0.00 178.44 177.80 1rff n SER 414 N 1.30 0.00 0.07 0.00 3.41 -1.18 -4.70 113.62 112.53 1rff n SER 414 Ca 0.19 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.58 1rff n SER 414 Cb 0.56 -0.06 -0.15 0.00 -0.26 0.00 0.00 64.21 64.30 1rff n SER 414 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1rff h GLU 415 N 0.00 0.37 0.63 4.33 4.11 -1.70 -3.04 114.58 119.28 1rff h GLU 415 Ca 0.00 -0.63 -0.03 0.00 0.07 0.00 0.00 59.36 58.77 1rff h GLU 415 Cb 0.00 0.24 0.01 0.00 0.50 0.00 0.00 28.75 29.49 1rff h GLU 415 CO 0.00 1.30 -0.30 0.35 0.07 0.00 0.00 179.01 180.43 1rff h PHE 416 N -0.17 -0.78 -0.74 2.06 3.57 -1.30 -1.98 116.94 117.59 1rff h PHE 416 Ca -0.22 -0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.30 1rff h PHE 416 Cb 1.86 0.26 -0.04 0.00 2.79 0.00 0.00 35.95 40.82 1rff h PHE 416 CO 0.16 -0.44 0.49 -0.22 -2.23 0.00 0.00 178.31 176.06 1rff h LYS 417 N -1.10 0.84 -0.84 1.11 3.64 -1.00 -1.84 116.57 117.38 1rff h LYS 417 Ca -0.09 -0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1rff h LYS 417 Cb 0.69 -0.19 -0.06 0.00 -0.41 0.00 0.00 32.23 32.26 1rff h LYS 417 CO 0.14 0.55 0.51 0.93 -2.27 0.00 0.00 179.45 179.31 1rff h GLU 418 N 0.86 0.89 -0.30 1.90 4.39 -1.48 0.13 114.58 120.97 1rff h GLU 418 Ca 0.31 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.91 1rff h GLU 418 Cb 0.13 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 1rff h GLU 418 CO -0.09 0.59 0.00 0.77 -1.16 0.00 0.00 179.01 179.12 1rff h SER 419 N 0.91 0.51 1.06 1.42 0.02 -0.91 -3.15 113.55 113.42 1rff h SER 419 Ca 0.37 -0.30 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 1rff h SER 419 Cb 0.20 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.61 1rff h SER 419 CO -0.19 0.69 -0.08 0.24 -1.14 0.00 0.00 176.83 176.36 1rff h MET 420 N 0.32 0.00 -0.02 3.45 2.86 -0.72 -2.75 114.93 118.07 1rff h MET 420 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1rff h MET 420 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1rff h MET 420 CO 0.01 0.08 -0.21 1.47 1.06 0.00 0.00 176.91 179.32 1rff n LEU 421 N -3.19 1.72 -4.70 1.22 -0.00 0.41 -4.93 117.00 107.53 1rff n LEU 421 Ca 0.01 -0.57 -0.43 0.00 -0.00 0.00 0.00 56.01 55.01 1rff n LEU 421 Cb 0.36 -0.04 -0.03 0.00 -0.00 0.00 0.00 43.42 43.72 1rff n LEU 421 CO 0.30 0.30 1.18 0.41 -0.00 0.00 0.00 177.39 179.58 1rff n THR 422 N 0.04 0.69 -3.39 1.47 -1.04 -1.04 -5.00 114.28 106.01 1rff n THR 422 Ca 0.13 -0.17 -0.12 0.00 -2.04 0.00 0.00 64.05 61.85 1rff n THR 422 Cb 0.42 -1.73 -0.09 0.00 -1.82 0.00 0.00 70.33 67.11 1rff n THR 422 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1rff s LEU 423 N 0.18 -0.48 0.00 -4.42 1.43 -1.26 -4.71 118.68 109.43 1rff s LEU 423 Ca 0.69 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.76 1rff s LEU 423 Cb -0.58 0.87 0.00 0.00 0.03 0.00 0.00 46.19 46.51 1rff s LEU 423 CO 0.45 -0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.32 1rff n GLY 424 N 5.35 0.73 4.38 -3.19 0.00 -0.43 -3.72 105.19 108.31 1rff n GLY 424 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1rff n GLY 424 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1rff n SER 434 N 0.59 0.00 -4.71 1.61 2.88 -1.26 -4.50 113.62 108.22 1rff n SER 434 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 1rff n SER 434 Cb 0.00 -0.47 -0.03 0.00 -0.75 0.00 0.00 64.21 62.96 1rff n SER 434 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 1rff s VAL 435 N -0.12 2.30 0.32 2.46 1.01 -1.24 -4.92 120.40 120.21 1rff s VAL 435 Ca 0.00 0.15 -0.29 0.00 0.00 0.00 0.00 61.98 61.85 1rff s VAL 435 Cb 0.00 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.18 1rff s VAL 435 CO 0.00 0.01 1.21 -2.84 0.00 0.00 0.00 175.10 173.47 1rff s PRO 436 N 1.49 4.43 -0.17 2.72 0.02 -1.26 -4.89 135.00 137.34 1rff s PRO 436 Ca 0.75 2.00 0.01 0.00 0.02 0.00 0.00 61.00 63.78 1rff s PRO 436 Cb -0.47 -3.07 0.02 0.00 0.02 0.00 0.00 34.50 31.00 1rff s PRO 436 CO 0.32 -0.04 -0.19 -1.17 -0.33 0.00 0.00 177.00 175.59 1rff s LEU 437 N -1.75 2.19 -0.20 -5.54 2.96 -1.26 -1.22 118.68 113.87 1rff s LEU 437 Ca 0.48 -0.62 -0.05 0.00 -0.22 0.00 0.00 54.13 53.73 1rff s LEU 437 Cb -0.35 -1.49 -0.02 0.00 0.50 0.00 0.00 46.19 44.82 1rff s LEU 437 CO 0.46 0.02 -0.01 -0.31 -1.32 0.00 0.00 176.35 175.19 1rff s TYR 438 N 1.19 3.01 -0.14 5.38 1.51 0.34 -4.93 117.35 123.71 1rff s TYR 438 Ca 0.02 -0.57 -0.03 0.00 -1.01 0.00 0.00 57.07 55.48 1rff s TYR 438 Cb -0.14 -2.08 -0.03 0.00 -0.11 0.00 0.00 41.96 39.61 1rff s TYR 438 CO -0.10 -0.31 -0.04 -0.51 -1.11 0.00 0.00 175.55 173.48 1rff s LEU 439 N 1.09 3.27 -0.24 -1.29 1.43 -0.83 -0.87 118.68 121.23 1rff s LEU 439 Ca 0.02 -0.09 -0.04 0.00 -1.03 0.00 0.00 54.13 52.99 1rff s LEU 439 Cb -0.14 -1.77 -0.00 0.00 0.03 0.00 0.00 46.19 44.30 1rff s LEU 439 CO 0.01 0.22 -0.02 -0.63 0.23 0.00 0.00 176.35 176.16 1rff s ILE 440 N 0.07 3.42 -0.16 -0.59 1.01 0.56 0.60 121.20 126.12 1rff s ILE 440 Ca -0.00 -0.61 -0.11 0.00 0.00 0.00 0.00 60.65 59.93 1rff s ILE 440 Cb -0.13 -2.63 0.05 0.00 0.01 0.00 0.00 42.46 39.76 1rff s ILE 440 CO 0.03 0.32 0.40 -0.47 0.00 0.00 0.00 174.94 175.22 1rff s TYR 441 N 1.46 -0.53 0.24 3.97 6.14 -0.77 -2.84 117.35 125.02 1rff s TYR 441 Ca 0.04 1.19 -0.31 0.00 0.64 0.00 0.00 57.07 58.63 1rff s TYR 441 Cb -0.15 0.21 -0.12 0.00 0.42 0.00 0.00 41.96 42.32 1rff s TYR 441 CO -0.02 -0.29 1.62 -2.30 0.64 0.00 0.00 175.55 175.20 1rff n PRO 442 N 3.77 2.59 -1.52 4.97 -0.02 -1.26 -4.43 135.00 139.10 1rff n PRO 442 Ca -0.20 0.93 -0.29 0.00 -2.02 0.00 0.00 63.50 61.92 1rff n PRO 442 Cb 0.56 -2.72 0.12 0.00 -0.02 0.00 0.00 33.50 31.44 1rff n PRO 442 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1rff s SER 443 N 0.77 3.79 0.24 2.55 1.04 -1.26 -1.58 113.70 119.25 1rff s SER 443 Ca 0.70 1.09 -0.05 0.00 0.48 0.00 0.00 55.95 58.18 1rff s SER 443 Cb -0.54 -1.73 0.37 0.00 0.10 0.00 0.00 66.02 64.23 1rff s SER 443 CO 0.41 -2.39 1.82 0.58 0.98 0.00 0.00 173.24 174.64 1rff h VAL 444 N -1.38 0.95 -0.41 5.02 2.07 -0.96 -2.34 116.25 119.20 1rff h VAL 444 Ca -0.50 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 66.66 1rff h VAL 444 Cb 1.31 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1rff h VAL 444 CO 0.61 0.15 -0.05 -0.08 0.02 0.00 0.00 177.57 178.22 1rff h GLU 445 N 0.84 0.69 -0.52 1.57 4.57 -1.93 -0.41 114.58 119.39 1rff h GLU 445 Ca 0.39 -0.19 0.05 0.00 -1.18 0.00 0.00 59.36 58.43 1rff h GLU 445 Cb 0.30 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 28.76 1rff h GLU 445 CO -0.22 0.74 0.25 -0.91 -1.18 0.00 0.00 179.01 177.69 1rff h ASN 446 N 0.64 0.35 -0.06 1.04 -0.26 -1.79 -2.37 115.58 113.12 1rff h ASN 446 Ca 0.12 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.88 1rff h ASN 446 Cb 0.47 -0.03 -0.00 0.00 -1.06 0.00 0.00 38.32 37.70 1rff h ASN 446 CO 0.02 0.24 -0.02 0.58 -1.06 0.00 0.00 177.43 177.19 1rff h VAL 447 N 0.48 1.29 -0.84 2.81 2.07 -1.07 -2.85 116.25 118.15 1rff h VAL 447 Ca 0.23 -0.93 0.11 0.00 0.82 0.00 0.00 66.70 66.93 1rff h VAL 447 Cb 0.16 1.79 -0.08 0.00 -1.52 0.00 0.00 31.29 31.64 1rff h VAL 447 CO -0.18 0.26 0.48 -0.09 0.02 0.00 0.00 177.57 178.06 1rff h ARG 448 N -0.22 0.75 -0.57 1.57 2.43 -0.99 -1.55 114.38 115.81 1rff h ARG 448 Ca 0.02 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1rff h ARG 448 Cb 0.41 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1rff h ARG 448 CO 0.01 0.50 0.00 0.25 -1.51 0.00 0.00 179.97 179.21 1rff n THR 449 N -4.76 0.92 -1.72 0.20 -2.24 -0.90 -2.55 114.28 103.23 1rff n THR 449 Ca 0.15 -0.78 -0.29 0.00 -2.27 0.00 0.00 64.05 60.85 1rff n THR 449 Cb 0.31 0.27 0.12 0.00 -2.10 0.00 0.00 70.33 68.94 1rff n THR 449 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1rff s SER 450 N -0.94 3.86 0.36 3.42 1.04 -0.58 -4.91 113.70 115.95 1rff s SER 450 Ca 0.38 0.83 0.07 0.00 0.48 0.00 0.00 55.95 57.70 1rff s SER 450 Cb 0.21 -1.32 0.75 0.00 0.10 0.00 0.00 66.02 65.76 1rff s SER 450 CO 0.23 -2.31 1.93 -0.07 0.98 0.00 0.00 173.24 174.00 1rff h LEU 451 N -1.34 0.67 0.00 2.42 3.38 -1.10 -2.32 115.31 117.02 1rff h LEU 451 Ca -0.48 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1rff h LEU 451 Cb 1.32 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1rff h LEU 451 CO 0.61 0.41 -1.03 -0.62 0.09 0.00 0.00 178.44 177.90 1rff n GLU 452 N -4.50 0.43 0.00 1.13 1.02 -1.26 -4.94 120.64 112.52 1rff n GLU 452 Ca 0.13 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1rff n GLU 452 Cb 0.30 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 30.03 1rff n GLU 452 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rff n GLY 453 N 1.29 -0.22 0.36 0.62 0.00 -0.87 -4.03 105.19 102.34 1rff n GLY 453 Ca 0.01 -1.03 0.07 0.00 0.00 0.00 0.00 46.02 45.08 1rff n GLY 453 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1rff h TYR 454 N 0.00 0.91 -0.04 1.61 0.05 -1.80 -1.14 116.97 116.56 1rff h TYR 454 Ca 0.00 0.02 0.01 0.00 0.05 0.00 0.00 58.73 58.82 1rff h TYR 454 Cb 0.00 -0.29 -0.00 0.00 1.01 0.00 0.00 36.73 37.44 1rff h TYR 454 CO 0.00 0.43 0.25 -1.35 -1.05 0.00 0.00 178.16 176.43 1rff h PRO 455 N 0.85 0.00 -0.69 4.88 0.11 -1.92 0.35 132.00 135.58 1rff h PRO 455 Ca 0.40 0.00 0.18 0.00 0.11 0.00 0.00 66.00 66.69 1rff h PRO 455 Cb 0.40 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.47 1rff h PRO 455 CO -0.16 0.00 0.49 0.00 -0.21 0.00 0.00 178.00 178.11 1rff h ALA 456 N 1.54 2.49 0.00 -0.75 0.00 -1.41 -1.38 119.26 119.75 1rff h ALA 456 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1rff h ALA 456 Cb 0.51 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1rff h ALA 456 CO -0.00 -0.68 0.00 0.41 0.00 0.00 0.00 179.25 178.98 1rff n GLY 457 N -1.63 -0.95 0.04 0.00 0.00 0.12 -1.80 105.19 100.97 1rff n GLY 457 Ca 0.14 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.19 1rff n GLY 457 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rff n GLY 458 N -0.09 -1.03 0.38 -0.02 0.00 -0.52 -2.12 105.19 101.79 1rff n GLY 458 Ca 0.04 -0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.11 1rff n GLY 458 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rff n SER 459 N -1.72 2.76 -3.40 1.61 7.64 -0.75 -4.74 113.62 115.02 1rff n SER 459 Ca 0.03 -2.52 -0.26 0.00 1.01 0.00 0.00 58.87 57.12 1rff n SER 459 Cb 0.17 -0.30 -0.08 0.00 -1.01 0.00 0.00 64.21 62.99 1rff n SER 459 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1rff n LEU 460 N -0.51 2.16 -1.87 -3.43 4.77 -0.90 -4.85 117.00 112.37 1rff n LEU 460 Ca 0.12 -5.08 -0.10 0.00 -0.03 0.00 0.00 56.01 50.91 1rff n LEU 460 Cb 0.55 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 1rff n LEU 460 CO 0.06 2.01 1.33 -0.81 -1.33 0.00 0.00 177.39 178.65 1rff n PRO 461 N 1.33 1.66 -2.52 3.23 -0.04 -1.25 -4.27 135.00 133.14 1rff n PRO 461 Ca 0.26 -0.90 -0.43 0.00 -0.04 0.00 0.00 63.50 62.39 1rff n PRO 461 Cb 0.45 -1.60 -0.02 0.00 -0.04 0.00 0.00 33.50 32.28 1rff n PRO 461 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1rff s TYR 462 N -0.12 3.07 0.14 0.54 5.04 -1.26 -4.85 117.35 119.90 1rff s TYR 462 Ca 0.37 1.20 0.00 0.00 -2.44 0.00 0.00 57.07 56.20 1rff s TYR 462 Cb 0.20 -3.41 -0.04 0.00 0.35 0.00 0.00 41.96 39.07 1rff s TYR 462 CO -0.03 -1.20 0.30 -1.54 -1.34 0.00 0.00 175.55 171.75 1rff s SER 463 N 1.64 6.37 0.25 4.32 1.04 -1.26 -0.95 113.70 125.11 1rff s SER 463 Ca 0.51 0.30 -0.05 0.00 0.48 0.00 0.00 55.95 57.19 1rff s SER 463 Cb -0.19 -1.97 0.28 0.00 0.10 0.00 0.00 66.02 64.24 1rff s SER 463 CO 0.12 0.06 1.82 -0.29 0.98 0.00 0.00 173.24 175.93 1rff h ILE 464 N 1.77 1.24 -1.01 -1.02 6.09 -1.93 -1.15 117.51 121.50 1rff h ILE 464 Ca -0.47 -0.78 0.23 0.00 -1.37 0.00 0.00 64.86 62.47 1rff h ILE 464 Cb 1.18 0.41 -0.12 0.00 0.47 0.00 0.00 36.82 38.76 1rff h ILE 464 CO 0.71 0.31 0.60 1.56 -3.07 0.00 0.00 178.15 178.26 1rff h GLN 465 N 1.03 0.61 0.10 2.19 7.50 -1.98 -0.32 115.11 124.24 1rff h GLN 465 Ca 0.24 -0.04 -0.23 0.00 0.50 0.00 0.00 58.65 59.12 1rff h GLN 465 Cb 0.21 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.60 1rff h GLN 465 CO -0.02 0.40 -1.13 1.15 -1.50 0.00 0.00 178.83 177.73 1rff h THR 466 N 0.63 1.21 -0.97 -0.54 2.02 -1.80 -3.37 112.91 110.09 1rff h THR 466 Ca 0.63 -2.41 0.05 0.00 0.77 0.00 0.00 66.41 65.44 1rff h THR 466 Cb 1.14 2.85 -0.06 0.00 -1.74 0.00 0.00 68.15 70.35 1rff h THR 466 CO -0.45 0.67 0.63 0.00 0.37 0.00 0.00 175.52 176.74 1rff h ALA 467 N -0.05 1.31 0.00 6.16 0.00 -0.80 -2.21 119.26 123.67 1rff h ALA 467 Ca -0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1rff h ALA 467 Cb 1.63 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1rff h ALA 467 CO 0.06 0.47 0.00 1.05 0.00 0.00 0.00 179.25 180.83 1rff h GLU 468 N 1.18 0.00 0.00 0.00 4.11 -1.23 -1.93 114.58 116.71 1rff h GLU 468 Ca 0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.83 1rff h GLU 468 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1rff h GLU 468 CO -0.14 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.57 1rff n LYS 469 N -2.66 0.03 -2.75 1.06 5.02 -0.83 -4.42 118.16 113.61 1rff n LYS 469 Ca 0.01 0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.22 1rff n LYS 469 Cb 0.24 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.82 1rff n LYS 469 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rff n GLN 470 N -1.49 1.13 0.25 1.97 10.64 -0.73 -4.63 117.38 124.52 1rff n GLN 470 Ca 0.07 -2.54 0.12 0.00 -1.83 0.00 0.00 57.00 52.82 1rff n GLN 470 Cb 0.32 -0.81 0.75 0.00 -0.86 0.00 0.00 30.24 29.65 1rff n GLN 470 CO 0.00 0.00 0.00 -0.91 -1.83 0.00 0.00 177.06 174.32 1rff h ASN 471 N 2.62 0.00 -0.64 2.61 2.35 -1.76 -1.75 115.58 119.01 1rff h ASN 471 Ca -0.14 0.00 0.18 0.00 -0.55 0.00 0.00 56.30 55.79 1rff h ASN 471 Cb 1.19 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.53 1rff h ASN 471 CO 0.23 0.00 0.46 4.11 -1.65 0.00 0.00 177.43 180.58 1rff h TRP 472 N 0.00 0.00 -0.08 1.19 5.08 -1.91 -2.18 115.95 118.04 1rff h TRP 472 Ca 0.03 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 59.92 1rff h TRP 472 Cb 0.12 -0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.27 1rff h TRP 472 CO 0.00 0.00 -0.28 1.25 -1.28 0.00 0.00 178.44 178.13 1rff h LEU 473 N 0.00 0.15 -0.51 0.11 5.85 -1.71 -3.04 115.31 116.16 1rff h LEU 473 Ca 0.30 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1rff h LEU 473 Cb 1.22 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.20 1rff h LEU 473 CO -0.00 0.44 0.00 1.41 -0.34 0.00 0.00 178.44 179.95 1rff n HIS 474 N -4.15 0.85 0.65 1.25 8.25 -0.82 -1.19 115.22 120.05 1rff n HIS 474 Ca -0.01 0.31 0.10 0.00 -0.26 0.00 0.00 57.72 57.85 1rff n HIS 474 Cb 0.37 -1.00 0.42 0.00 1.12 0.00 0.00 29.99 30.90 1rff n HIS 474 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1rff n SER 475 N -2.25 0.05 -0.15 0.41 3.41 -1.15 -1.97 113.62 111.98 1rff n SER 475 Ca 0.03 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.27 1rff n SER 475 Cb 0.28 -0.52 0.15 0.00 -0.26 0.00 0.00 64.21 63.86 1rff n SER 475 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1rff n TYR 476 N -1.56 0.00 -2.79 7.33 4.01 -0.34 -4.98 117.16 118.83 1rff n TYR 476 Ca 0.05 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.38 1rff n TYR 476 Cb 0.23 -0.11 -0.05 0.00 -0.31 0.00 0.00 39.34 39.10 1rff n TYR 476 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1rff s PHE 477 N -2.78 3.88 0.12 -0.72 2.99 -0.83 -1.96 117.98 118.67 1rff s PHE 477 Ca 0.15 1.79 0.08 0.00 0.00 0.00 0.00 56.93 58.95 1rff s PHE 477 Cb 0.18 -2.97 -0.04 0.00 0.00 0.00 0.00 43.02 40.19 1rff s PHE 477 CO 0.67 0.33 -0.20 -1.01 -0.00 0.00 0.00 175.22 175.02 1rff s HIS 478 N -0.54 1.75 0.66 0.36 3.76 0.20 -2.30 115.29 119.19 1rff s HIS 478 Ca 0.43 -0.44 -0.15 0.00 -0.15 0.00 0.00 55.06 54.75 1rff s HIS 478 Cb -0.24 -0.94 0.00 0.00 1.11 0.00 0.00 32.58 32.51 1rff s HIS 478 CO 0.29 0.22 1.11 0.15 -0.85 0.00 0.00 174.74 175.67 1rff s LYS 479 N -2.12 2.79 -0.12 1.40 1.02 0.22 -1.85 119.74 121.08 1rff s LYS 479 Ca 0.08 1.37 -0.30 0.00 0.02 0.00 0.00 55.97 57.15 1rff s LYS 479 Cb -0.09 -1.95 -0.02 0.00 -0.52 0.00 0.00 37.83 35.26 1rff s LYS 479 CO 0.05 -1.26 1.12 -0.46 -0.92 0.00 0.00 175.35 173.88 1rff s TRP 480 N -2.38 3.26 -0.06 3.18 -0.11 -1.26 -4.51 118.94 117.07 1rff s TRP 480 Ca 0.66 1.34 -0.03 0.00 1.22 0.00 0.00 56.10 59.30 1rff s TRP 480 Cb -0.20 -3.34 0.03 0.00 -1.50 0.00 0.00 33.47 28.46 1rff s TRP 480 CO 0.42 -0.89 0.13 0.45 -4.62 0.00 0.00 176.95 172.44 1rff s SER 481 N 1.39 -0.11 -0.34 5.86 0.15 -1.26 -4.97 113.70 114.42 1rff s SER 481 Ca 0.51 0.27 0.15 0.00 0.70 0.00 0.00 55.95 57.59 1rff s SER 481 Cb -0.20 0.20 0.44 0.00 -1.71 0.00 0.00 66.02 64.75 1rff s SER 481 CO 0.17 -0.11 1.21 0.00 1.20 0.00 0.00 173.24 175.71 1rff n ALA 482 N 3.73 2.49 -0.35 5.45 0.00 -1.26 -1.09 120.51 129.49 1rff n ALA 482 Ca -0.21 -2.13 0.14 0.00 0.00 0.00 0.00 53.44 51.24 1rff n ALA 482 Cb 0.55 -0.93 0.34 0.00 0.00 0.00 0.00 19.45 19.41 1rff n ALA 482 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1rff h GLU 483 N 2.29 0.70 -0.93 0.00 4.39 -1.91 -0.54 114.58 118.58 1rff h GLU 483 Ca -0.22 -0.04 0.21 0.00 0.34 0.00 0.00 59.36 59.64 1rff h GLU 483 Cb 1.25 -0.16 -0.07 0.00 -0.10 0.00 0.00 28.75 29.67 1rff h GLU 483 CO 0.15 0.46 0.61 0.00 -1.16 0.00 0.00 179.01 179.07 1rff h THR 484 N 0.72 0.67 -0.16 1.13 1.03 -1.87 -1.92 112.91 112.51 1rff h THR 484 Ca 0.58 -0.15 0.00 0.00 -0.01 0.00 0.00 66.41 66.83 1rff h THR 484 Cb 0.96 0.18 0.00 0.00 -1.07 0.00 0.00 68.15 68.23 1rff h THR 484 CO -0.38 0.08 0.00 -1.54 -0.01 0.00 0.00 175.52 173.67 1rff n SER 485 N -4.54 3.06 -1.72 0.00 3.41 -0.74 -2.11 113.62 110.98 1rff n SER 485 Ca 0.20 -2.80 -0.19 0.00 -0.26 0.00 0.00 58.87 55.82 1rff n SER 485 Cb 0.70 -0.41 -0.06 0.00 -0.26 0.00 0.00 64.21 64.18 1rff n SER 485 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rff n GLY 486 N -0.68 1.03 0.29 5.00 0.00 -0.72 -4.89 105.19 105.22 1rff n GLY 486 Ca 0.16 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.17 1rff n GLY 486 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rff n ARG 487 N -2.59 1.30 0.20 1.61 1.74 -0.29 -4.69 116.66 113.95 1rff n ARG 487 Ca -0.20 -2.74 0.07 0.00 -0.77 0.00 0.00 57.85 54.20 1rff n ARG 487 Cb 0.64 -1.47 0.59 0.00 -1.02 0.00 0.00 32.46 31.20 1rff n ARG 487 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1rff h SER 488 N 0.34 0.10 -0.40 0.55 0.02 -1.90 -1.68 113.55 110.58 1rff h SER 488 Ca -0.00 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1rff h SER 488 Cb 1.03 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.55 1rff h SER 488 CO 0.00 0.09 0.00 0.59 -1.14 0.00 0.00 176.83 176.37 1rff n ASN 489 N -4.51 2.99 -4.28 3.07 5.03 -1.26 -4.77 115.26 111.53 1rff n ASN 489 Ca -0.02 -1.94 -0.43 0.00 0.87 0.00 0.00 54.58 53.07 1rff n ASN 489 Cb 0.09 -0.26 -0.07 0.00 -1.02 0.00 0.00 39.78 38.52 1rff n ASN 489 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1rff s ALA 490 N -1.47 3.49 0.42 5.41 0.00 -0.63 -0.50 121.76 128.47 1rff s ALA 490 Ca 0.38 -2.41 -0.26 0.00 0.00 0.00 0.00 51.96 49.66 1rff s ALA 490 Cb 0.21 -2.99 -0.09 0.00 0.00 0.00 0.00 23.12 20.26 1rff s ALA 490 CO 0.29 -1.88 1.35 -1.64 0.00 0.00 0.00 175.76 173.89 1rff s MET 491 N 1.49 3.89 0.05 0.00 -1.94 -1.24 -3.36 119.30 118.19 1rff s MET 491 Ca 0.04 2.26 -0.31 0.00 -1.71 0.00 0.00 55.69 55.97 1rff s MET 491 Cb -0.27 -2.74 -0.06 0.00 2.01 0.00 0.00 34.83 33.77 1rff s MET 491 CO 0.02 -0.59 1.35 -1.25 -0.01 0.00 0.00 175.02 174.54 1rff s PRO 492 N -2.29 4.33 0.00 2.03 0.04 -1.26 -0.73 135.00 137.11 1rff s PRO 492 Ca 0.58 1.96 0.01 0.00 0.04 0.00 0.00 61.00 63.58 1rff s PRO 492 Cb -0.40 -3.42 -0.00 0.00 0.04 0.00 0.00 34.50 30.72 1rff s PRO 492 CO 0.52 -0.46 0.22 1.58 0.04 0.00 0.00 177.00 178.90 1rff n HIS 493 N 4.61 0.00 -1.37 0.56 -0.00 0.13 -4.70 115.22 114.45 1rff n HIS 493 Ca 0.12 0.00 -0.34 0.00 0.46 0.00 0.00 57.72 57.96 1rff n HIS 493 Cb 0.44 0.00 0.10 0.00 -0.12 0.00 0.00 29.99 30.41 1rff n HIS 493 CO 0.00 0.00 0.00 -1.50 0.46 0.00 0.00 176.34 175.30 1rff s ILE 494 N -0.64 2.31 -0.05 3.57 2.07 -0.17 -4.82 121.20 123.46 1rff s ILE 494 Ca 0.00 0.15 0.02 0.00 -1.41 0.00 0.00 60.65 59.41 1rff s ILE 494 Cb 0.00 -2.67 0.01 0.00 0.13 0.00 0.00 42.46 39.93 1rff s ILE 494 CO 0.01 -0.09 -0.11 -0.54 -1.91 0.00 0.00 174.94 172.31 1rff s LYS 495 N -3.99 1.44 0.03 3.50 3.01 -1.25 -4.41 119.74 118.07 1rff s LYS 495 Ca 0.73 -0.37 -0.05 0.00 -1.01 0.00 0.00 55.97 55.28 1rff s LYS 495 Cb -0.28 -1.24 -0.01 0.00 -1.01 0.00 0.00 37.83 35.28 1rff s LYS 495 CO 0.47 0.05 0.08 0.95 0.51 0.00 0.00 175.35 177.40 1rff s THR 496 N 0.55 0.13 0.00 2.17 -4.23 -0.01 -2.05 115.64 112.19 1rff s THR 496 Ca -0.11 -1.04 -0.00 0.00 -1.18 0.00 0.00 61.69 59.35 1rff s THR 496 Cb -0.14 -0.76 -0.00 0.00 1.34 0.00 0.00 72.50 72.94 1rff s THR 496 CO 0.02 -0.58 -0.00 -0.31 -0.54 0.00 0.00 174.62 173.22 1rff s TYR 497 N -2.32 0.02 0.28 3.99 2.02 -0.60 -0.52 117.35 120.22 1rff s TYR 497 Ca -0.07 -0.04 -0.20 0.00 -0.37 0.00 0.00 57.07 56.38 1rff s TYR 497 Cb -0.03 -0.02 0.02 0.00 -0.40 0.00 0.00 41.96 41.53 1rff s TYR 497 CO -0.03 -0.02 0.70 0.00 -1.57 0.00 0.00 175.55 174.63 1rff s MET 498 N -0.14 1.79 -0.51 -0.62 0.23 -0.54 -0.56 119.30 118.94 1rff s MET 498 Ca -0.02 -1.04 0.03 0.00 -1.03 0.00 0.00 55.69 53.64 1rff s MET 498 Cb -0.01 0.60 0.15 0.00 -1.53 0.00 0.00 34.83 34.03 1rff s MET 498 CO -0.00 -0.81 0.31 0.50 -2.03 0.00 0.00 175.02 172.99 1rff s ARG 499 N -3.86 1.63 0.70 3.16 6.06 -1.13 -1.49 118.95 124.03 1rff s ARG 499 Ca 0.12 -2.44 -0.11 0.00 -2.50 0.00 0.00 55.73 50.80 1rff s ARG 499 Cb -0.05 -2.65 0.01 0.00 0.06 0.00 0.00 34.95 32.32 1rff s ARG 499 CO 0.07 -1.21 1.06 -2.14 -2.50 0.00 0.00 175.30 170.59 1rff s PRO 500 N -0.22 2.89 0.93 5.12 0.02 -1.22 -0.74 135.00 141.79 1rff s PRO 500 Ca 0.21 0.80 -0.12 0.00 0.02 0.00 0.00 61.00 61.91 1rff s PRO 500 Cb -0.16 -2.00 0.15 0.00 0.02 0.00 0.00 34.50 32.51 1rff s PRO 500 CO -0.06 -1.09 1.10 -1.54 -0.33 0.00 0.00 177.00 175.08 1rff s SER 501 N -3.95 3.25 0.53 2.53 1.04 -0.02 -3.06 113.70 114.02 1rff s SER 501 Ca 0.58 1.22 0.23 0.00 0.48 0.00 0.00 55.95 58.46 1rff s SER 501 Cb -0.13 -1.88 1.38 0.00 0.10 0.00 0.00 66.02 65.49 1rff s SER 501 CO 0.54 -2.74 2.06 -0.65 0.98 0.00 0.00 173.24 173.43 1rff h PRO 502 N -1.62 0.00 -0.65 4.02 0.11 -1.92 -0.93 132.00 131.00 1rff h PRO 502 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1rff h PRO 502 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1rff h PRO 502 CO 0.58 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.97 1rff n ASP 503 N -4.37 4.02 -1.12 -2.05 5.75 -1.26 -4.95 116.55 112.58 1rff n ASP 503 Ca 0.05 -2.13 -0.15 0.00 -0.01 0.00 0.00 54.79 52.55 1rff n ASP 503 Cb 0.41 -0.48 -0.06 0.00 -1.03 0.00 0.00 41.12 39.96 1rff n ASP 503 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1rff n PHE 504 N 1.33 0.00 0.22 2.11 3.01 -0.35 -4.84 117.46 118.93 1rff n PHE 504 Ca 0.23 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.80 1rff n PHE 504 Cb 0.67 -2.71 -0.00 0.00 -0.01 0.00 0.00 39.48 37.42 1rff n PHE 504 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1rff n SER 505 N -0.68 0.67 -4.19 4.37 3.41 -1.26 -4.81 113.62 111.11 1rff n SER 505 Ca -0.15 0.16 -0.12 0.00 -0.26 0.00 0.00 58.87 58.51 1rff n SER 505 Cb 0.53 0.71 -0.10 0.00 -0.26 0.00 0.00 64.21 65.08 1rff n SER 505 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 1rff s LYS 506 N -3.34 1.10 0.04 4.33 -2.85 -1.26 -1.39 119.74 116.37 1rff s LYS 506 Ca -0.00 -1.56 0.03 0.00 -1.00 0.00 0.00 55.97 53.44 1rff s LYS 506 Cb 0.11 0.17 -0.02 0.00 -2.06 0.00 0.00 37.83 36.03 1rff s LYS 506 CO 0.80 -0.31 -0.10 0.96 0.10 0.00 0.00 175.35 176.80 1rff s ILE 507 N -4.04 0.78 -0.34 3.79 -4.36 0.38 -0.84 121.20 116.58 1rff s ILE 507 Ca 0.32 -0.95 0.21 0.00 -0.26 0.00 0.00 60.65 59.97 1rff s ILE 507 Cb 0.07 -0.76 0.22 0.00 1.25 0.00 0.00 42.46 43.25 1rff s ILE 507 CO 0.07 -0.16 1.48 0.00 0.24 0.00 0.00 174.94 176.58 1rff h ALA 508 N 4.85 0.86 -1.45 2.27 0.00 -1.25 -1.40 119.26 123.13 1rff h ALA 508 Ca -0.36 -0.14 0.28 0.00 0.00 0.00 0.00 54.91 54.70 1rff h ALA 508 Cb 1.19 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.81 1rff h ALA 508 CO 0.43 0.18 0.82 1.67 0.00 0.00 0.00 179.25 182.35 1rff s TRP 509 N -3.16 -0.09 -0.07 0.00 1.48 -1.26 -4.23 118.94 111.61 1rff s TRP 509 Ca 0.05 0.02 -0.09 0.00 -1.06 0.00 0.00 56.10 55.03 1rff s TRP 509 Cb 0.06 0.53 0.02 0.00 -1.16 0.00 0.00 33.47 32.92 1rff s TRP 509 CO 0.71 -0.22 0.23 0.12 -4.06 0.00 0.00 176.95 173.72 1rff s PHE 510 N -2.41 -0.21 -0.05 1.66 5.36 -0.89 -2.83 117.98 118.62 1rff s PHE 510 Ca 0.11 0.49 0.02 0.00 -0.96 0.00 0.00 56.93 56.59 1rff s PHE 510 Cb 0.01 0.07 0.01 0.00 -0.34 0.00 0.00 43.02 42.78 1rff s PHE 510 CO -0.04 -0.17 -0.10 -1.17 -1.46 0.00 0.00 175.22 172.28 1rff s LEU 511 N -0.23 1.58 -0.10 6.12 2.96 0.28 -0.70 118.68 128.59 1rff s LEU 511 Ca -0.03 -0.23 0.02 0.00 -0.22 0.00 0.00 54.13 53.66 1rff s LEU 511 Cb -0.03 -0.68 -0.02 0.00 0.50 0.00 0.00 46.19 45.96 1rff s LEU 511 CO 0.01 0.02 -0.14 0.54 -1.32 0.00 0.00 176.35 175.45 1rff s VAL 512 N 0.65 2.99 0.20 1.68 0.11 -0.94 -1.56 120.40 123.53 1rff s VAL 512 Ca -0.12 -0.71 -0.16 0.00 -2.93 0.00 0.00 61.98 58.06 1rff s VAL 512 Cb -0.14 -2.22 0.02 0.00 -1.53 0.00 0.00 36.38 32.51 1rff s VAL 512 CO 0.02 0.55 0.50 0.28 -3.33 0.00 0.00 175.10 173.12 1rff s THR 513 N -0.05 0.03 -0.94 5.04 -1.32 -0.87 -0.57 115.64 116.95 1rff s THR 513 Ca -0.03 -0.92 0.28 0.00 -1.21 0.00 0.00 61.69 59.81 1rff s THR 513 Cb -0.14 -1.69 0.22 0.00 -1.51 0.00 0.00 72.50 69.38 1rff s THR 513 CO 0.04 -0.12 1.82 -1.54 -2.21 0.00 0.00 174.62 172.61 1rff n SER 514 N -0.34 0.23 -4.64 8.08 3.41 -0.66 -3.75 113.62 115.95 1rff n SER 514 Ca -0.09 0.42 -0.43 0.00 -0.26 0.00 0.00 58.87 58.52 1rff n SER 514 Cb 0.62 -0.45 -0.02 0.00 -0.26 0.00 0.00 64.21 64.10 1rff n SER 514 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rff s ALA 515 N -3.02 3.46 0.95 7.33 0.00 -1.26 -4.94 121.76 124.28 1rff s ALA 515 Ca 0.13 0.47 -0.08 0.00 0.00 0.00 0.00 51.96 52.47 1rff s ALA 515 Cb 0.17 -3.75 0.12 0.00 0.00 0.00 0.00 23.12 19.66 1rff s ALA 515 CO 0.57 -1.59 0.70 0.09 0.00 0.00 0.00 175.76 175.53 1rff n ASN 516 N 7.51 0.13 -4.36 0.00 3.02 -1.26 -4.85 115.26 115.45 1rff n ASN 516 Ca 0.16 -1.30 -0.43 0.00 -0.03 0.00 0.00 54.58 52.98 1rff n ASN 516 Cb 0.45 -0.53 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 1rff n ASN 516 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1rff n LEU 517 N 0.00 5.47 -3.90 3.41 7.94 -1.00 -4.73 117.00 124.19 1rff n LEU 517 Ca 0.09 -4.27 -0.10 0.00 -1.11 0.00 0.00 56.01 50.62 1rff n LEU 517 Cb 0.31 -1.65 -0.10 0.00 0.53 0.00 0.00 43.42 42.52 1rff n LEU 517 CO 0.23 0.65 -0.20 -0.94 -1.11 0.00 0.00 177.39 176.01 1rff s SER 518 N 3.08 0.10 0.39 1.96 1.04 -1.26 -1.00 113.70 118.02 1rff s SER 518 Ca 0.47 -0.35 0.09 0.00 0.48 0.00 0.00 55.95 56.63 1rff s SER 518 Cb 0.03 0.20 0.81 0.00 0.10 0.00 0.00 66.02 67.16 1rff s SER 518 CO 0.02 -0.41 1.95 0.11 0.98 0.00 0.00 173.24 175.89 1rff h LYS 519 N 4.10 0.31 -0.55 4.02 1.57 -1.86 -1.80 116.57 122.35 1rff h LYS 519 Ca -0.32 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 58.46 1rff h LYS 519 Cb 1.19 -0.05 -0.05 0.00 0.08 0.00 0.00 32.23 33.41 1rff h LYS 519 CO 0.44 0.37 0.28 0.00 -0.57 0.00 0.00 179.45 179.97 1rff h ALA 520 N 1.67 0.71 0.12 3.86 0.00 -1.90 0.28 119.26 123.99 1rff h ALA 520 Ca 0.07 0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.77 1rff h ALA 520 Cb 0.27 -0.08 0.02 0.00 0.00 0.00 0.00 17.79 18.01 1rff h ALA 520 CO 0.01 -0.06 -0.96 0.00 0.00 0.00 0.00 179.25 178.24 1rff h ALA 521 N 1.30 -0.05 0.00 0.00 0.00 -1.85 -1.89 119.26 116.77 1rff h ALA 521 Ca 0.24 -0.71 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1rff h ALA 521 Cb 0.15 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1rff h ALA 521 CO -0.17 0.48 -1.67 0.91 0.00 0.00 0.00 179.25 178.81 1rff n TRP 522 N -4.01 0.33 0.00 0.00 7.02 -0.69 -4.78 117.44 115.30 1rff n TRP 522 Ca -0.13 0.10 0.00 0.00 -1.02 0.00 0.00 57.50 56.44 1rff n TRP 522 Cb 0.87 -0.66 0.00 0.00 -2.42 0.00 0.00 31.31 29.10 1rff n TRP 522 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1rff n GLY 523 N 1.24 2.28 2.92 6.99 0.00 0.97 -1.25 105.19 118.34 1rff n GLY 523 Ca -0.03 -1.68 -0.19 0.00 0.00 0.00 0.00 46.02 44.13 1rff n GLY 523 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rff s ALA 524 N -1.66 0.60 0.28 4.61 0.00 -0.30 -4.79 121.76 120.51 1rff s ALA 524 Ca 0.00 -0.11 -0.29 0.00 0.00 0.00 0.00 51.96 51.56 1rff s ALA 524 Cb 0.00 -0.31 -0.10 0.00 0.00 0.00 0.00 23.12 22.71 1rff s ALA 524 CO 0.00 0.04 1.36 -0.51 0.00 0.00 0.00 175.76 176.65 1rff s LEU 525 N 0.55 4.41 0.34 0.00 1.43 -1.26 -0.72 118.68 123.43 1rff s LEU 525 Ca -0.07 2.64 0.03 0.00 -1.03 0.00 0.00 54.13 55.71 1rff s LEU 525 Cb -0.11 -3.63 -0.04 0.00 0.03 0.00 0.00 46.19 42.44 1rff s LEU 525 CO -0.00 -0.61 0.13 -1.61 0.23 0.00 0.00 176.35 174.49 1rff s GLU 526 N -0.96 1.71 -1.24 1.70 2.02 0.23 -4.80 118.70 117.35 1rff s GLU 526 Ca 0.54 -1.99 -0.07 0.00 0.02 0.00 0.00 54.97 53.47 1rff s GLU 526 Cb -0.40 -0.39 -0.01 0.00 0.10 0.00 0.00 34.13 33.42 1rff s GLU 526 CO 0.47 -0.41 0.72 1.63 0.02 0.00 0.00 175.26 177.69 1rff n LYS 527 N -0.70 -3.37 -3.64 1.61 5.02 -1.26 -2.13 118.16 113.69 1rff n LYS 527 Ca -0.02 0.58 -0.20 0.00 -2.02 0.00 0.00 58.31 56.65 1rff n LYS 527 Cb 0.65 -4.89 0.04 0.00 -0.02 0.00 0.00 35.03 30.82 1rff n LYS 527 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1rff n ASN 528 N -2.96 -1.39 -0.03 4.39 4.05 -1.26 -2.57 115.26 115.50 1rff n ASN 528 Ca -0.22 -0.78 -0.00 0.00 0.45 0.00 0.00 54.58 54.03 1rff n ASN 528 Cb 0.65 -4.28 -0.00 0.00 1.23 0.00 0.00 39.78 37.38 1rff n ASN 528 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1rff n GLY 529 N -1.48 0.38 0.33 8.20 0.00 -1.09 -4.89 105.19 106.63 1rff n GLY 529 Ca -0.30 -0.04 0.08 0.00 0.00 0.00 0.00 46.02 45.76 1rff n GLY 529 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rff n THR 530 N -2.70 0.00 -3.81 2.61 -2.24 -1.03 -4.91 114.28 102.20 1rff n THR 530 Ca -0.00 -0.28 -0.16 0.00 -2.27 0.00 0.00 64.05 61.33 1rff n THR 530 Cb 0.16 1.17 -0.16 0.00 -2.10 0.00 0.00 70.33 69.39 1rff n THR 530 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1rff s GLN 531 N -2.10 0.07 -0.31 -0.78 0.74 -0.90 -4.34 119.66 112.04 1rff s GLN 531 Ca 0.13 0.18 -0.14 0.00 0.05 0.00 0.00 55.36 55.57 1rff s GLN 531 Cb 0.14 -0.36 -0.03 0.00 1.10 0.00 0.00 33.01 33.86 1rff s GLN 531 CO 0.48 -0.18 0.34 -1.17 -0.55 0.00 0.00 175.29 174.20 1rff s LEU 532 N 1.20 4.22 -0.24 3.68 2.96 -0.16 0.75 118.68 131.09 1rff s LEU 532 Ca -0.07 -0.01 -0.12 0.00 -0.22 0.00 0.00 54.13 53.71 1rff s LEU 532 Cb -0.13 -2.33 -0.05 0.00 0.50 0.00 0.00 46.19 44.18 1rff s LEU 532 CO -0.03 -0.23 0.23 -0.32 -1.32 0.00 0.00 176.35 174.68 1rff s MET 533 N 1.99 4.07 -0.02 1.98 -2.45 0.10 -0.59 119.30 124.38 1rff s MET 533 Ca 0.12 -0.16 0.08 0.00 -1.25 0.00 0.00 55.69 54.47 1rff s MET 533 Cb -0.16 -3.57 -0.02 0.00 1.25 0.00 0.00 34.83 32.33 1rff s MET 533 CO 0.11 -0.03 -0.26 0.42 1.05 0.00 0.00 175.02 176.32 1rff s ILE 534 N 1.30 2.04 -0.10 10.11 1.01 -0.30 -1.15 121.20 134.12 1rff s ILE 534 Ca 0.10 -1.10 0.21 0.00 0.00 0.00 0.00 60.65 59.86 1rff s ILE 534 Cb -0.14 -1.69 -0.26 0.00 0.01 0.00 0.00 42.46 40.38 1rff s ILE 534 CO 0.07 0.58 0.51 0.54 0.00 0.00 0.00 174.94 176.63 1rff n ARG 535 N 2.48 0.65 -4.39 2.79 1.74 -0.74 -1.25 116.66 117.94 1rff n ARG 535 Ca -0.16 -0.07 -0.20 0.00 -0.77 0.00 0.00 57.85 56.65 1rff n ARG 535 Cb 0.51 -1.59 -0.10 0.00 -1.02 0.00 0.00 32.46 30.26 1rff n ARG 535 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1rff s SER 536 N -4.96 2.50 -0.15 0.55 0.01 -1.03 -4.07 113.70 106.54 1rff s SER 536 Ca -0.07 -1.18 -0.18 0.00 1.31 0.00 0.00 55.95 55.84 1rff s SER 536 Cb 0.11 -0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.18 1rff s SER 536 CO 0.87 -0.37 0.47 -0.31 0.41 0.00 0.00 173.24 174.31 1rff s TYR 537 N -3.11 3.45 0.07 2.43 1.51 -0.61 -3.13 117.35 117.96 1rff s TYR 537 Ca 0.28 0.80 -0.01 0.00 -1.01 0.00 0.00 57.07 57.14 1rff s TYR 537 Cb 0.04 -2.57 -0.04 0.00 -0.11 0.00 0.00 41.96 39.28 1rff s TYR 537 CO 0.10 0.08 -0.02 -1.21 -1.11 0.00 0.00 175.55 173.39 1rff s GLU 538 N 0.98 0.68 -0.19 -0.62 0.41 -0.73 -1.15 118.70 118.08 1rff s GLU 538 Ca 0.24 -1.27 -0.17 0.00 -0.41 0.00 0.00 54.97 53.36 1rff s GLU 538 Cb -0.15 0.17 0.05 0.00 -1.78 0.00 0.00 34.13 32.43 1rff s GLU 538 CO 0.09 -0.13 0.51 -1.17 -0.49 0.00 0.00 175.26 174.08 1rff s LEU 539 N -2.95 0.01 0.28 1.80 2.96 -1.26 -0.86 118.68 118.66 1rff s LEU 539 Ca 0.10 1.04 -0.09 0.00 -0.22 0.00 0.00 54.13 54.95 1rff s LEU 539 Cb 0.08 1.75 -0.00 0.00 0.50 0.00 0.00 46.19 48.52 1rff s LEU 539 CO -0.08 -0.18 0.48 -0.83 -1.32 0.00 0.00 176.35 174.42 1rff s GLY 540 N 0.38 0.84 -0.03 7.98 0.00 0.08 -1.65 107.32 114.91 1rff s GLY 540 Ca -0.01 -1.09 0.03 0.00 0.00 0.00 0.00 44.72 43.65 1rff s GLY 540 CO -0.01 -0.75 -0.13 -1.34 0.00 0.00 0.00 173.10 170.87 1rff s VAL 541 N -3.63 1.11 -0.20 1.40 -7.23 0.26 -1.33 120.40 110.79 1rff s VAL 541 Ca 0.25 -0.54 -0.07 0.00 -1.81 0.00 0.00 61.98 59.81 1rff s VAL 541 Cb -0.00 -0.97 -0.04 0.00 0.56 0.00 0.00 36.38 35.93 1rff s VAL 541 CO 0.13 0.33 0.06 -0.22 -0.31 0.00 0.00 175.10 175.09 1rff s LEU 542 N 0.12 3.69 -0.39 1.32 2.96 0.47 -2.21 118.68 124.65 1rff s LEU 542 Ca -0.03 -0.01 -0.16 0.00 -0.22 0.00 0.00 54.13 53.71 1rff s LEU 542 Cb -0.10 -1.95 0.01 0.00 0.50 0.00 0.00 46.19 44.65 1rff s LEU 542 CO 0.01 0.12 0.35 -0.36 -1.32 0.00 0.00 176.35 175.15 1rff s PHE 543 N 0.71 3.21 -0.11 5.38 0.40 0.12 -1.63 117.98 126.06 1rff s PHE 543 Ca 0.03 -0.33 0.01 0.00 -0.60 0.00 0.00 56.93 56.04 1rff s PHE 543 Cb -0.13 -2.70 -0.02 0.00 0.51 0.00 0.00 43.02 40.68 1rff s PHE 543 CO 0.02 -0.56 -0.14 -0.51 0.70 0.00 0.00 175.22 174.73 1rff s LEU 544 N 1.92 2.71 0.35 -0.37 1.43 -1.26 -2.09 118.68 121.36 1rff s LEU 544 Ca 0.09 -0.30 0.12 0.00 -1.03 0.00 0.00 54.13 53.02 1rff s LEU 544 Cb -0.18 -1.59 0.94 0.00 0.03 0.00 0.00 46.19 45.39 1rff s LEU 544 CO 0.12 0.21 1.78 -0.65 0.23 0.00 0.00 176.35 178.04 1rff h PRO 545 N 6.35 0.54 -0.00 1.29 0.11 -1.81 -1.42 132.00 137.07 1rff h PRO 545 Ca -0.31 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.74 1rff h PRO 545 Cb 1.20 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1rff h PRO 545 CO 0.54 0.36 -0.14 0.66 -0.21 0.00 0.00 178.00 179.21 1rff h SER 546 N 0.56 0.00 0.60 -2.05 4.64 -1.72 0.11 113.55 115.70 1rff h SER 546 Ca 0.58 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.90 1rff h SER 546 Cb 1.19 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1rff h SER 546 CO -0.34 0.14 0.00 0.00 -0.87 0.00 0.00 176.83 175.76 1rff n ALA 547 N -2.51 1.57 -0.20 5.18 0.00 -0.53 -1.67 120.51 122.34 1rff n ALA 547 Ca -0.03 0.08 0.05 0.00 0.00 0.00 0.00 53.44 53.55 1rff n ALA 547 Cb 0.21 -1.35 0.14 0.00 0.00 0.00 0.00 19.45 18.45 1rff n ALA 547 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1rff n LEU 548 N -2.15 2.87 -0.29 0.00 4.77 -0.01 -4.96 117.00 117.23 1rff n LEU 548 Ca 0.02 -2.06 -0.04 0.00 -0.03 0.00 0.00 56.01 53.90 1rff n LEU 548 Cb 0.19 -0.22 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 1rff n LEU 548 CO 0.17 0.70 -0.04 0.61 -1.33 0.00 0.00 177.39 177.51 1rff n GLY 549 N 0.34 0.67 3.82 -0.72 0.00 -0.67 -5.04 105.19 103.60 1rff n GLY 549 Ca 0.11 -0.74 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 1rff n GLY 549 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rff s LEU 550 N -0.86 3.29 -0.17 0.99 1.43 0.19 -4.94 118.68 118.60 1rff s LEU 550 Ca 0.00 -0.87 0.18 0.00 -1.03 0.00 0.00 54.13 52.41 1rff s LEU 550 Cb 0.00 -1.82 -0.25 0.00 0.03 0.00 0.00 46.19 44.14 1rff s LEU 550 CO 0.00 -0.61 0.11 0.47 0.23 0.00 0.00 176.35 176.56 1rff n ASP 551 N -1.43 0.17 -3.77 2.29 10.43 -1.26 -2.55 116.55 120.43 1rff n ASP 551 Ca 0.02 0.00 -0.10 0.00 2.57 0.00 0.00 54.79 57.28 1rff n ASP 551 Cb 0.63 1.10 -0.05 0.00 1.84 0.00 0.00 41.12 44.64 1rff n ASP 551 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 1rff s SER 552 N -5.29 -0.18 -0.11 -2.24 1.04 -1.26 -4.82 113.70 100.84 1rff s SER 552 Ca -0.09 -0.54 -0.03 0.00 0.48 0.00 0.00 55.95 55.77 1rff s SER 552 Cb 0.07 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.67 1rff s SER 552 CO 0.81 -0.97 0.02 -0.36 0.98 0.00 0.00 173.24 173.72 1rff s PHE 553 N -3.88 3.19 0.31 5.02 2.99 -0.53 -4.93 117.98 120.14 1rff s PHE 553 Ca 0.10 0.15 -0.29 0.00 0.00 0.00 0.00 56.93 56.88 1rff s PHE 553 Cb 0.01 -1.86 -0.10 0.00 0.00 0.00 0.00 43.02 41.07 1rff s PHE 553 CO -0.04 0.39 1.23 0.21 -0.00 0.00 0.00 175.22 177.01 1rff s LYS 554 N -0.58 4.46 -0.06 0.44 2.20 -1.26 -0.47 119.74 124.47 1rff s LYS 554 Ca 0.10 2.06 -0.30 0.00 -0.36 0.00 0.00 55.97 57.47 1rff s LYS 554 Cb -0.12 -3.12 -0.03 0.00 -1.51 0.00 0.00 37.83 33.06 1rff s LYS 554 CO 0.02 -0.05 1.10 0.08 -0.36 0.00 0.00 175.35 176.15 1rff s VAL 555 N -1.08 4.51 -0.18 4.02 1.01 -0.49 -0.28 120.40 127.90 1rff s VAL 555 Ca 0.48 1.80 -0.29 0.00 0.00 0.00 0.00 61.98 63.96 1rff s VAL 555 Cb -0.37 -4.16 -0.02 0.00 0.00 0.00 0.00 36.38 31.83 1rff s VAL 555 CO 0.48 0.02 1.40 -0.75 0.00 0.00 0.00 175.10 176.25 1rff s LYS 556 N 1.95 4.09 0.23 2.72 2.20 -0.03 -4.83 119.74 126.08 1rff s LYS 556 Ca 0.53 1.68 -0.02 0.00 -0.36 0.00 0.00 55.97 57.79 1rff s LYS 556 Cb -0.22 -3.87 0.25 0.00 -1.51 0.00 0.00 37.83 32.48 1rff s LYS 556 CO 0.21 -0.91 1.66 -0.56 -0.36 0.00 0.00 175.35 175.40 1rff h GLN 557 N 9.08 0.70 -4.95 4.03 -0.00 -1.94 -3.40 115.11 118.64 1rff h GLN 557 Ca -0.30 -0.27 -0.65 0.00 -0.00 0.00 0.00 58.65 57.43 1rff h GLN 557 Cb 1.12 -0.04 -0.35 0.00 -0.00 0.00 0.00 27.48 28.21 1rff h GLN 557 CO 0.98 0.86 -0.85 -1.59 -0.00 0.00 0.00 178.83 178.23 1rff s LYS 558 N -4.62 2.77 0.36 0.06 0.00 -1.26 -4.82 119.74 112.23 1rff s LYS 558 Ca -0.09 -0.79 0.04 0.00 0.00 0.00 0.00 55.97 55.14 1rff s LYS 558 Cb 0.13 -2.47 0.71 0.00 0.00 0.00 0.00 37.83 36.20 1rff s LYS 558 CO 0.82 -0.24 2.00 0.35 0.00 0.00 0.00 175.35 178.28 1rff h PHE 559 N 7.96 0.74 -2.47 1.78 3.57 -1.65 -3.50 116.94 123.36 1rff h PHE 559 Ca -0.42 0.02 -0.74 0.00 3.53 0.00 0.00 57.97 60.36 1rff h PHE 559 Cb 1.13 -0.25 -0.32 0.00 2.79 0.00 0.00 35.95 39.30 1rff h PHE 559 CO 0.48 0.44 0.40 1.19 -2.23 0.00 0.00 178.31 178.59 1rff n PHE 560 N -4.46 2.94 -1.47 0.41 3.72 -1.26 -4.96 117.46 112.39 1rff n PHE 560 Ca 0.08 -3.07 0.00 0.00 -0.05 0.00 0.00 57.45 54.40 1rff n PHE 560 Cb 0.12 -0.99 0.00 0.00 -0.94 0.00 0.00 39.48 37.66 1rff n PHE 560 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1rff n THR 569 N 0.54 -4.81 -3.15 4.37 -2.24 -1.26 -5.08 114.28 102.65 1rff n THR 569 Ca 0.34 2.12 -0.39 0.00 -2.27 0.00 0.00 64.05 63.85 1rff n THR 569 Cb 0.33 -2.95 -0.05 0.00 -2.10 0.00 0.00 70.33 65.56 1rff n THR 569 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1rff s PHE 570 N -2.22 3.63 -1.20 4.78 5.36 0.61 -4.65 117.98 124.29 1rff s PHE 570 Ca 0.00 1.19 -0.19 0.00 -0.96 0.00 0.00 56.93 56.97 1rff s PHE 570 Cb 0.00 -2.68 0.07 0.00 -0.34 0.00 0.00 43.02 40.07 1rff s PHE 570 CO 0.00 0.23 1.62 -1.25 -1.46 0.00 0.00 175.22 174.36 1rff s PRO 571 N 0.27 3.87 0.00 10.12 0.04 -1.26 -0.85 135.00 147.19 1rff s PRO 571 Ca 0.33 -1.76 -0.30 0.00 0.04 0.00 0.00 61.00 59.31 1rff s PRO 571 Cb -0.18 -5.45 -0.06 0.00 0.04 0.00 0.00 34.50 28.86 1rff s PRO 571 CO 0.17 -2.21 1.47 0.08 0.04 0.00 0.00 177.00 176.55 1rff s VAL 572 N 4.28 3.59 -1.06 -0.36 1.01 -1.26 -4.92 120.40 121.69 1rff s VAL 572 Ca 0.51 0.96 0.29 0.00 0.00 0.00 0.00 61.98 63.73 1rff s VAL 572 Cb 0.02 -3.62 0.28 0.00 0.00 0.00 0.00 36.38 33.06 1rff s VAL 572 CO 0.02 -0.01 1.94 -0.81 0.00 0.00 0.00 175.10 176.24 1rff n PRO 573 N 5.64 0.06 -4.47 2.72 -0.04 -1.26 -4.75 135.00 132.90 1rff n PRO 573 Ca 0.14 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.38 1rff n PRO 573 Cb 0.43 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.29 1rff n PRO 573 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1rff s TYR 574 N -2.94 1.89 0.43 0.54 1.13 -1.26 -4.26 117.35 112.87 1rff s TYR 574 Ca 0.16 -1.06 -0.20 0.00 -1.41 0.00 0.00 57.07 54.56 1rff s TYR 574 Cb 0.19 -1.24 -0.10 0.00 -1.10 0.00 0.00 41.96 39.71 1rff s TYR 574 CO 0.52 -0.09 0.93 -0.51 -2.51 0.00 0.00 175.55 173.89 1rff s ASP 575 N -3.52 6.89 0.08 -0.18 -0.00 -0.25 -4.90 116.67 114.78 1rff s ASP 575 Ca 0.32 1.63 0.08 0.00 -0.00 0.00 0.00 52.55 54.58 1rff s ASP 575 Cb 0.07 -2.52 -0.03 0.00 -0.00 0.00 0.00 42.92 40.44 1rff s ASP 575 CO 0.15 -0.37 -0.20 -0.76 -0.00 0.00 0.00 175.17 173.98 1rff s LEU 576 N -3.27 2.26 0.77 1.23 1.43 -1.26 -3.94 118.68 115.90 1rff s LEU 576 Ca 0.61 -0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 52.97 1rff s LEU 576 Cb -0.09 -0.89 0.05 0.00 0.03 0.00 0.00 46.19 45.29 1rff s LEU 576 CO 0.16 0.08 1.08 -2.16 0.23 0.00 0.00 176.35 175.74 1rff s PRO 577 N -1.69 2.32 0.51 1.29 0.04 -1.26 -5.09 135.00 131.11 1rff s PRO 577 Ca 0.06 1.08 -0.22 0.00 0.04 0.00 0.00 61.00 61.97 1rff s PRO 577 Cb -0.10 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.47 1rff s PRO 577 CO 0.03 -1.58 1.22 -2.14 0.04 0.00 0.00 177.00 174.58 1rff s PRO 578 N -4.94 3.46 -0.23 0.56 0.02 -1.25 -5.00 135.00 127.62 1rff s PRO 578 Ca 0.61 1.88 -0.12 0.00 0.02 0.00 0.00 61.00 63.39 1rff s PRO 578 Cb -0.16 -2.27 -0.05 0.00 0.02 0.00 0.00 34.50 32.04 1rff s PRO 578 CO 0.56 -0.82 0.22 -2.00 -0.33 0.00 0.00 177.00 174.63 1rff s GLU 579 N -2.88 4.09 0.42 5.54 2.12 -1.26 -4.98 118.70 121.74 1rff s GLU 579 Ca 0.68 -0.15 -0.26 0.00 0.36 0.00 0.00 54.97 55.60 1rff s GLU 579 Cb -0.31 -3.54 -0.09 0.00 0.26 0.00 0.00 34.13 30.44 1rff s GLU 579 CO 0.37 0.03 1.41 -1.17 -0.54 0.00 0.00 175.26 175.36 1rff s LEU 580 N 1.14 4.20 0.35 2.70 2.96 -1.26 -0.61 118.68 128.17 1rff s LEU 580 Ca 0.11 2.89 -0.26 0.00 -0.22 0.00 0.00 54.13 56.65 1rff s LEU 580 Cb -0.14 -3.85 -0.13 0.00 0.50 0.00 0.00 46.19 42.58 1rff s LEU 580 CO 0.05 -1.00 0.89 -1.22 -1.32 0.00 0.00 176.35 173.75 1rff n TYR 581 N 0.09 0.79 -1.58 5.38 4.02 -0.97 -4.71 117.16 120.18 1rff n TYR 581 Ca 0.03 0.65 -0.29 0.00 -0.01 0.00 0.00 57.90 58.29 1rff n TYR 581 Cb 0.41 -2.18 0.14 0.00 -0.02 0.00 0.00 39.34 37.70 1rff n TYR 581 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 1rff s GLY 582 N -0.72 1.59 0.38 2.72 0.00 -1.26 -4.93 107.32 105.10 1rff s GLY 582 Ca 0.61 -0.62 0.08 0.00 0.00 0.00 0.00 44.72 44.79 1rff s GLY 582 CO 0.58 -0.03 1.94 1.76 0.00 0.00 0.00 173.10 177.35 1rff h SER 583 N -1.53 0.60 0.05 1.64 0.02 -2.05 -1.78 113.55 110.50 1rff h SER 583 Ca -0.49 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.47 1rff h SER 583 Cb 1.32 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 63.75 1rff h SER 583 CO 0.59 0.36 -0.13 2.29 -1.14 0.00 0.00 176.83 178.80 1rff n LYS 584 N -4.49 1.52 -2.70 3.45 0.00 -1.26 -4.94 118.16 109.73 1rff n LYS 584 Ca 0.12 -1.03 -0.35 0.00 -0.00 0.00 0.00 58.31 57.06 1rff n LYS 584 Cb 0.32 -1.48 -0.06 0.00 -0.00 0.00 0.00 35.03 33.82 1rff n LYS 584 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 1rff s ASP 585 N -2.19 6.83 0.05 -5.58 1.01 -0.67 -5.07 116.67 111.05 1rff s ASP 585 Ca 0.30 1.84 0.03 0.00 0.71 0.00 0.00 52.55 55.43 1rff s ASP 585 Cb 0.20 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.54 1rff s ASP 585 CO 0.41 -0.44 -0.10 -0.13 0.21 0.00 0.00 175.17 175.12 1rff s ARG 586 N -2.88 0.64 0.37 8.23 0.52 -1.26 -4.85 118.95 119.71 1rff s ARG 586 Ca 0.61 -0.85 -0.27 0.00 -0.52 0.00 0.00 55.73 54.69 1rff s ARG 586 Cb -0.15 -0.45 -0.09 0.00 0.52 0.00 0.00 34.95 34.78 1rff s ARG 586 CO 0.19 0.09 1.30 -1.25 0.02 0.00 0.00 175.30 175.64 1rff s PRO 587 N -1.76 4.15 0.09 3.54 0.04 -1.26 -0.42 135.00 139.38 1rff s PRO 587 Ca -0.06 2.16 -0.32 0.00 0.04 0.00 0.00 61.00 62.82 1rff s PRO 587 Cb -0.09 -2.90 -0.12 0.00 0.04 0.00 0.00 34.50 31.44 1rff s PRO 587 CO 0.01 -0.34 1.79 1.87 0.04 0.00 0.00 177.00 180.37 1rff n TRP 588 N 0.43 2.48 -4.01 0.56 -0.00 -0.61 -4.47 117.44 111.82 1rff n TRP 588 Ca 0.02 -0.03 -0.28 0.00 -0.00 0.00 0.00 57.50 57.21 1rff n TRP 588 Cb 0.43 -2.68 -0.17 0.00 -0.00 0.00 0.00 31.31 28.90 1rff n TRP 588 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 1rff s ILE 589 N 2.60 1.24 -0.62 5.87 1.01 -1.26 -4.55 121.20 125.49 1rff s ILE 589 Ca 0.83 -0.44 0.25 0.00 0.00 0.00 0.00 60.65 61.30 1rff s ILE 589 Cb -0.57 -1.21 0.25 0.00 0.01 0.00 0.00 42.46 40.94 1rff s ILE 589 CO 0.40 0.40 1.63 4.11 0.00 0.00 0.00 174.94 181.49 1rff h TRP 590 N 8.03 0.00 -0.30 3.97 5.08 -1.22 -3.33 115.95 128.17 1rff h TRP 590 Ca -0.33 0.00 -0.13 0.00 1.08 0.00 0.00 58.89 59.51 1rff h TRP 590 Cb 1.14 0.00 -0.08 0.00 -3.00 0.00 0.00 29.16 27.22 1rff h TRP 590 CO 0.47 0.00 -0.09 0.27 -1.28 0.00 0.00 178.44 177.82 1rff n ASN 591 N -2.46 2.64 -4.34 0.11 6.94 -1.26 -4.84 115.26 112.06 1rff n ASN 591 Ca 0.05 -3.64 -0.18 0.00 -0.02 0.00 0.00 54.58 50.79 1rff n ASN 591 Cb 0.46 -0.61 -0.10 0.00 -2.36 0.00 0.00 39.78 37.17 1rff n ASN 591 CO 0.00 0.00 0.00 0.27 -1.03 0.00 0.00 177.26 176.50 1rff s ILE 592 N -3.17 1.69 0.38 1.53 -4.36 -1.25 -4.89 121.20 111.14 1rff s ILE 592 Ca 0.43 -2.17 -0.24 0.00 -0.26 0.00 0.00 60.65 58.42 1rff s ILE 592 Cb 0.39 -2.00 -0.10 0.00 1.25 0.00 0.00 42.46 42.00 1rff s ILE 592 CO 0.01 -0.58 0.97 -2.84 0.24 0.00 0.00 174.94 172.74 1rff s PRO 593 N -3.57 4.34 -0.25 0.37 0.02 -1.26 -4.65 135.00 130.00 1rff s PRO 593 Ca 0.21 1.30 0.01 0.00 0.02 0.00 0.00 61.00 62.54 1rff s PRO 593 Cb -0.01 -2.50 0.06 0.00 0.02 0.00 0.00 34.50 32.07 1rff s PRO 593 CO 0.06 0.05 -0.06 0.71 -0.33 0.00 0.00 177.00 177.44 1rff s TYR 594 N -1.83 2.61 0.00 6.54 2.02 0.22 -4.97 117.35 121.93 1rff s TYR 594 Ca 0.57 -1.92 0.00 0.00 -0.37 0.00 0.00 57.07 55.35 1rff s TYR 594 Cb -0.16 -1.71 0.00 0.00 -0.40 0.00 0.00 41.96 39.69 1rff s TYR 594 CO 0.21 -0.81 0.45 1.33 -1.57 0.00 0.00 175.55 175.16 1rff n VAL 595 N 4.61 0.19 0.07 0.71 0.24 -1.26 -1.05 118.33 121.84 1rff n VAL 595 Ca -0.11 -0.38 -0.19 0.00 -2.04 0.00 0.00 64.34 61.61 1rff n VAL 595 Cb 0.43 1.19 -0.10 0.00 -1.47 0.00 0.00 33.84 33.89 1rff n VAL 595 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 1rff h LYS 596 N 0.00 0.55 -3.37 7.34 1.79 -1.99 -3.46 116.57 117.43 1rff h LYS 596 Ca 0.00 -0.67 -0.17 0.00 -2.18 0.00 0.00 60.65 57.63 1rff h LYS 596 Cb 0.37 0.21 -0.25 0.00 -1.58 0.00 0.00 32.23 30.98 1rff h LYS 596 CO 0.00 1.28 -0.51 0.00 -1.08 0.00 0.00 179.45 179.14 1rff s ALA 597 N -3.11 -0.40 0.60 3.86 0.00 -1.26 -5.16 121.76 116.29 1rff s ALA 597 Ca -0.08 0.31 -0.13 0.00 0.00 0.00 0.00 51.96 52.06 1rff s ALA 597 Cb 0.07 -0.17 -0.04 0.00 0.00 0.00 0.00 23.12 22.98 1rff s ALA 597 CO 0.91 -0.12 1.03 -1.25 0.00 0.00 0.00 175.76 176.33 1rff s PRO 598 N -0.33 3.55 0.33 0.00 0.04 -1.26 -4.85 135.00 132.48 1rff s PRO 598 Ca -0.04 0.90 -0.02 0.00 0.04 0.00 0.00 61.00 61.88 1rff s PRO 598 Cb -0.03 -2.08 0.07 0.00 0.04 0.00 0.00 34.50 32.50 1rff s PRO 598 CO 0.01 -0.60 0.45 -0.40 0.04 0.00 0.00 177.00 176.49 1rff n ASP 599 N -2.38 0.36 0.00 6.66 3.85 0.15 -4.85 116.55 120.35 1rff n ASP 599 Ca 0.07 -1.36 0.06 0.00 -0.71 0.00 0.00 54.79 52.85 1rff n ASP 599 Cb 0.54 -0.31 0.28 0.00 -1.35 0.00 0.00 41.12 40.28 1rff n ASP 599 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.20 176.54 1rff n THR 600 N -2.25 1.00 0.38 2.12 -2.24 -1.06 -1.44 114.28 110.80 1rff n THR 600 Ca 0.07 0.25 0.09 0.00 -2.27 0.00 0.00 64.05 62.19 1rff n THR 600 Cb 0.24 -1.04 0.14 0.00 -2.10 0.00 0.00 70.33 67.57 1rff n THR 600 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1rff n HIS 601 N -1.44 0.29 -0.49 4.78 8.25 -1.26 -4.96 115.22 120.38 1rff n HIS 601 Ca 0.04 -0.18 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 1rff n HIS 601 Cb 0.13 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.24 1rff n HIS 601 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rff n GLY 602 N 1.11 0.75 3.68 -1.41 0.00 -0.52 -5.07 105.19 103.73 1rff n GLY 602 Ca 0.14 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.91 1rff n GLY 602 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rff s ASN 603 N -2.01 4.76 0.57 1.61 0.01 -1.26 -4.72 114.94 113.90 1rff s ASN 603 Ca 0.00 -0.50 0.09 0.00 -0.71 0.00 0.00 52.86 51.74 1rff s ASN 603 Cb 0.00 -0.98 0.08 0.00 0.41 0.00 0.00 41.25 40.76 1rff s ASN 603 CO 0.00 0.03 0.74 -0.04 -1.51 0.00 0.00 177.10 176.32 1rff s MET 604 N -3.44 2.30 -0.22 -0.60 -1.94 -1.26 -0.67 119.30 113.46 1rff s MET 604 Ca 0.30 -1.70 0.01 0.00 -1.71 0.00 0.00 55.69 52.59 1rff s MET 604 Cb -0.08 -2.58 0.05 0.00 2.01 0.00 0.00 34.83 34.24 1rff s MET 604 CO 0.20 -0.83 -0.07 -0.46 -0.01 0.00 0.00 175.02 173.85 1rff s TRP 605 N -2.68 2.35 -0.42 -0.03 -0.11 -0.22 -4.97 118.94 112.86 1rff s TRP 605 Ca 0.58 -1.65 0.02 0.00 1.22 0.00 0.00 56.10 56.27 1rff s TRP 605 Cb -0.05 -1.58 0.13 0.00 -1.50 0.00 0.00 33.47 30.47 1rff s TRP 605 CO 0.37 -0.75 0.22 0.08 -4.62 0.00 0.00 176.95 172.25 1rff s VAL 606 N 1.41 1.24 -2.00 5.86 1.01 -1.26 -0.61 120.40 126.05 1rff s VAL 606 Ca -0.04 -2.37 0.30 0.00 0.00 0.00 0.00 61.98 59.88 1rff s VAL 606 Cb -0.18 -1.87 0.86 0.00 0.00 0.00 0.00 36.38 35.19 1rff s VAL 606 CO -0.07 -0.88 2.14 -0.81 0.00 0.00 0.00 175.10 175.48