#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 0.09 -0.01 1.20 -0.04 -1.26 -4.08 135.00 130.90 1rff n PRO 163 Ca 0.00 0.05 -0.18 0.00 -0.04 0.00 0.00 63.50 63.33 1rff n PRO 163 Cb 0.00 -1.58 -0.14 0.00 -0.04 0.00 0.00 33.50 31.74 1rff n PRO 163 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1rff n PHE 164 N -1.73 1.15 -3.98 0.54 3.72 -1.26 -4.96 117.46 110.95 1rff n PHE 164 Ca 0.06 0.27 -0.31 0.00 -0.05 0.00 0.00 57.45 57.42 1rff n PHE 164 Cb 0.37 -1.16 0.01 0.00 -0.94 0.00 0.00 39.48 37.76 1rff n PHE 164 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1rff n GLN 165 N -3.38 -4.84 -4.01 -1.08 1.13 -1.26 -4.82 117.38 99.12 1rff n GLN 165 Ca -0.29 0.54 -0.35 0.00 -1.94 0.00 0.00 57.00 54.95 1rff n GLN 165 Cb 1.05 -5.34 -0.12 0.00 0.11 0.00 0.00 30.24 25.94 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 -3.35 3.10 0.11 1.08 2.19 -1.26 -1.74 117.98 118.12 1rff s PHE 166 Ca 0.62 -0.28 0.05 0.00 0.33 0.00 0.00 56.93 57.65 1rff s PHE 166 Cb -0.32 -2.11 -0.04 0.00 -1.31 0.00 0.00 43.02 39.24 1rff s PHE 166 CO 0.86 -0.14 -0.13 0.71 1.83 0.00 0.00 175.22 178.35 1rff s TYR 167 N 0.93 1.29 0.20 10.12 1.51 0.08 -4.98 117.35 126.50 1rff s TYR 167 Ca 0.02 -0.59 0.02 0.00 -1.01 0.00 0.00 57.07 55.51 1rff s TYR 167 Cb -0.14 -0.68 -0.04 0.00 -0.11 0.00 0.00 41.96 40.99 1rff s TYR 167 CO 0.02 0.10 0.36 -0.51 -1.11 0.00 0.00 175.55 174.41 1rff s LEU 168 N -2.45 4.27 0.62 -1.29 1.43 -1.26 -0.20 118.68 119.79 1rff s LEU 168 Ca 0.08 0.26 -0.13 0.00 -1.03 0.00 0.00 54.13 53.30 1rff s LEU 168 Cb -0.04 -3.03 -0.03 0.00 0.03 0.00 0.00 46.19 43.12 1rff s LEU 168 CO 0.02 -0.03 1.04 0.42 0.23 0.00 0.00 176.35 178.03 1rff s THR 169 N -1.87 4.22 0.30 5.49 -4.23 -0.94 -1.07 115.64 117.53 1rff s THR 169 Ca 0.36 0.86 -0.29 0.00 -1.18 0.00 0.00 61.69 61.44 1rff s THR 169 Cb -0.11 -3.56 -0.10 0.00 1.34 0.00 0.00 72.50 70.07 1rff s THR 169 CO 0.29 -0.81 1.35 -0.60 -0.54 0.00 0.00 174.62 174.31 1rff s ARG 170 N -4.66 4.33 -0.18 3.99 3.52 -0.83 -4.63 118.95 120.49 1rff s ARG 170 Ca 0.59 2.24 -0.01 0.00 -0.13 0.00 0.00 55.73 58.42 1rff s ARG 170 Cb -0.13 -3.09 -0.00 0.00 -1.56 0.00 0.00 34.95 30.17 1rff s ARG 170 CO 0.46 -0.27 -0.11 0.08 -0.81 0.00 0.00 175.30 174.65 1rff s VAL 171 N -0.75 2.91 0.18 7.11 1.01 -1.26 -4.60 120.40 125.01 1rff s VAL 171 Ca 0.52 -0.67 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 1rff s VAL 171 Cb -0.40 -2.27 -0.08 0.00 0.00 0.00 0.00 36.38 33.63 1rff s VAL 171 CO 0.50 0.49 1.16 -0.44 0.00 0.00 0.00 175.10 176.80 1rff s SER 172 N 1.05 7.15 0.00 3.32 0.01 -0.15 -3.84 113.70 121.25 1rff s SER 172 Ca -0.00 2.18 0.00 0.00 1.31 0.00 0.00 55.95 59.43 1rff s SER 172 Cb -0.15 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.48 1rff s SER 172 CO -0.02 -0.32 0.00 0.61 0.41 0.00 0.00 173.24 173.92 1rff n GLY 173 N 2.13 0.84 3.77 3.44 0.00 -1.26 -4.79 105.19 109.32 1rff n GLY 173 Ca 0.04 0.00 -0.22 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 -2.08 3.70 0.47 1.61 -7.23 -1.25 -5.09 120.40 110.52 1rff s VAL 174 Ca 0.00 -1.56 -0.24 0.00 -1.81 0.00 0.00 61.98 58.37 1rff s VAL 174 Cb 0.00 -3.14 -0.08 0.00 0.56 0.00 0.00 36.38 33.72 1rff s VAL 174 CO 0.00 -0.27 1.29 0.29 -0.31 0.00 0.00 175.10 176.09 1rff n LYS 175 N -1.16 1.83 -0.21 4.82 5.02 -1.26 -4.88 118.16 122.31 1rff n LYS 175 Ca -0.05 0.66 0.21 0.00 -2.02 0.00 0.00 58.31 57.11 1rff n LYS 175 Cb 0.59 -2.44 0.57 0.00 -0.02 0.00 0.00 35.03 33.73 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 1.83 0.29 0.00 1.97 0.11 -1.98 -0.27 132.00 133.94 1rff h PRO 176 Ca -0.49 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1rff h PRO 176 Cb 1.30 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1rff h PRO 176 CO 0.59 0.19 -0.05 1.57 -0.21 0.00 0.00 178.00 180.08 1rff h LYS 177 N 0.30 0.00 -0.00 1.05 2.10 -2.02 -1.23 116.57 116.77 1rff h LYS 177 Ca 0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.10 1rff h LYS 177 Cb 1.27 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.60 1rff h LYS 177 CO -0.13 0.05 -0.09 0.66 -2.00 0.00 0.00 179.45 177.94 1rff n TYR 178 N -3.72 0.00 0.19 0.07 4.01 -0.11 -3.36 117.16 114.23 1rff n TYR 178 Ca -0.02 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.77 1rff n TYR 178 Cb 0.15 -0.31 0.10 0.00 -0.31 0.00 0.00 39.34 38.97 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 -1.27 2.41 -0.14 7.72 3.02 -0.48 -4.73 115.26 121.78 1rff n ASN 179 Ca 0.11 -1.71 -0.10 0.00 -0.03 0.00 0.00 54.58 52.85 1rff n ASN 179 Cb 0.29 -0.11 -0.01 0.00 -0.61 0.00 0.00 39.78 39.34 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 2.20 0.72 -0.49 6.41 4.64 -1.53 -1.75 113.55 123.75 1rff h SER 180 Ca 0.00 -0.31 0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1rff h SER 180 Cb 0.60 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 1rff h SER 180 CO 0.00 0.86 0.00 0.61 -0.87 0.00 0.00 176.83 177.43 1rff n GLY 181 N -0.34 2.00 3.95 -0.77 0.00 -1.26 -4.98 105.19 103.78 1rff n GLY 181 Ca -0.01 -0.62 -0.23 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.73 3.77 -0.03 4.61 0.00 -0.66 -4.60 121.76 123.11 1rff s ALA 182 Ca 0.38 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 51.37 1rff s ALA 182 Cb 0.24 -1.99 -0.00 0.00 0.00 0.00 0.00 23.12 21.37 1rff s ALA 182 CO 0.19 0.06 -0.16 -0.51 0.00 0.00 0.00 175.76 175.33 1rff s LEU 183 N -4.21 1.93 0.19 0.00 1.43 -0.24 -4.74 118.68 113.04 1rff s LEU 183 Ca 0.38 -0.33 0.05 0.00 -1.03 0.00 0.00 54.13 53.20 1rff s LEU 183 Cb -0.09 -0.91 -0.04 0.00 0.03 0.00 0.00 46.19 45.18 1rff s LEU 183 CO 0.34 0.16 0.24 -2.28 0.23 0.00 0.00 176.35 175.03 1rff s HIS 184 N -0.04 3.30 0.42 0.29 5.65 -1.26 -1.96 115.29 121.69 1rff s HIS 184 Ca -0.02 0.00 0.15 0.00 0.25 0.00 0.00 55.06 55.44 1rff s HIS 184 Cb -0.10 -1.55 1.02 0.00 -1.18 0.00 0.00 32.58 30.77 1rff s HIS 184 CO 0.01 0.50 1.92 0.97 -0.65 0.00 0.00 174.74 177.49 1rff h ILE 185 N 1.63 0.81 -0.59 0.89 2.10 -1.96 -0.01 117.51 120.37 1rff h ILE 185 Ca -0.49 -0.16 -0.02 0.00 1.08 0.00 0.00 64.86 65.27 1rff h ILE 185 Cb 1.21 0.31 -0.03 0.00 -1.09 0.00 0.00 36.82 37.23 1rff h ILE 185 CO 0.64 0.08 0.28 0.11 -1.08 0.00 0.00 178.15 178.19 1rff h LYS 186 N 0.45 0.83 -0.32 2.19 1.57 -1.95 -1.88 116.57 117.47 1rff h LYS 186 Ca 0.37 -0.10 0.02 0.00 -1.87 0.00 0.00 60.65 59.07 1rff h LYS 186 Cb 0.81 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.94 1rff h LYS 186 CO -0.13 0.65 0.17 -0.44 -0.57 0.00 0.00 179.45 179.13 1rff h ASP 187 N 0.83 0.26 -0.78 0.86 3.32 -1.36 -2.35 116.42 117.21 1rff h ASP 187 Ca 0.21 0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.28 1rff h ASP 187 Cb 0.09 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.55 1rff h ASP 187 CO -0.03 0.19 0.52 0.40 -1.72 0.00 0.00 179.24 178.60 1rff h ILE 188 N 0.35 1.17 -0.11 0.35 2.04 -1.02 -2.56 117.51 117.74 1rff h ILE 188 Ca 0.13 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1rff h ILE 188 Cb 0.03 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.17 1rff h ILE 188 CO -0.08 0.19 0.00 0.18 0.00 0.00 0.00 178.15 178.44 1rff n LEU 189 N -4.43 2.13 -4.76 1.44 4.77 -0.75 -4.82 117.00 110.59 1rff n LEU 189 Ca 0.09 -0.79 -0.33 0.00 -0.03 0.00 0.00 56.01 54.95 1rff n LEU 189 Cb 0.06 -0.06 0.07 0.00 -2.33 0.00 0.00 43.42 41.15 1rff n LEU 189 CO 0.36 0.40 0.74 -0.55 -1.33 0.00 0.00 177.39 177.01 1rff s SER 190 N -1.81 4.74 0.57 -1.43 0.15 -0.89 -4.51 113.70 110.51 1rff s SER 190 Ca 0.34 2.06 0.33 0.00 0.70 0.00 0.00 55.95 59.39 1rff s SER 190 Cb 0.20 -2.56 1.68 0.00 -1.71 0.00 0.00 66.02 63.64 1rff s SER 190 CO 0.31 -1.88 2.13 -0.65 1.20 0.00 0.00 173.24 174.34 1rff h PRO 191 N -0.27 0.00 0.00 5.44 0.11 -1.89 -1.35 132.00 134.04 1rff h PRO 191 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1rff h PRO 191 Cb 1.26 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1rff h PRO 191 CO 0.52 0.06 -0.03 -0.07 -0.21 0.00 0.00 178.00 178.27 1rff h LEU 192 N 0.00 0.00 0.00 2.35 3.38 -1.91 -2.59 115.31 116.54 1rff h LEU 192 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rff h LEU 192 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1rff h LEU 192 CO 0.01 0.03 -0.39 0.49 0.09 0.00 0.00 178.44 178.67 1rff n PHE 193 N -3.68 0.06 0.00 1.13 3.01 -0.51 -5.01 117.46 112.47 1rff n PHE 193 Ca -0.03 0.02 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1rff n PHE 193 Cb 0.12 -0.35 0.00 0.00 -0.01 0.00 0.00 39.48 39.24 1rff n PHE 193 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1rff n GLY 194 N 1.48 4.19 3.48 1.37 0.00 -0.98 -5.04 105.19 109.70 1rff n GLY 194 Ca 0.06 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.46 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 4.24 0.23 2.61 2.01 -1.26 -4.45 115.64 117.02 1rff s THR 195 Ca 0.00 -0.41 -0.30 0.00 0.31 0.00 0.00 61.69 61.29 1rff s THR 195 Cb 0.00 -4.76 -0.10 0.00 0.01 0.00 0.00 72.50 67.65 1rff s THR 195 CO 0.00 -1.57 1.41 -0.22 -0.69 0.00 0.00 174.62 173.55 1rff s LEU 196 N 4.24 4.39 -0.11 4.42 2.96 -1.26 -1.02 118.68 132.30 1rff s LEU 196 Ca 0.27 2.58 0.02 0.00 -0.22 0.00 0.00 54.13 56.79 1rff s LEU 196 Cb -0.13 -3.62 -0.08 0.00 0.50 0.00 0.00 46.19 42.87 1rff s LEU 196 CO 0.07 -0.66 -0.09 0.52 -1.32 0.00 0.00 176.35 174.87 1rff n VAL 197 N 2.57 0.66 -3.50 1.68 0.31 0.94 -4.85 118.33 116.14 1rff n VAL 197 Ca 0.07 -0.27 -0.11 0.00 -0.01 0.00 0.00 64.34 64.02 1rff n VAL 197 Cb 0.41 -0.90 -0.03 0.00 -0.91 0.00 0.00 33.84 32.41 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 -5.01 -0.45 0.01 4.52 0.15 -1.01 -4.20 113.70 107.70 1rff s SER 198 Ca -0.14 0.18 -0.17 0.00 0.70 0.00 0.00 55.95 56.52 1rff s SER 198 Cb 0.04 0.44 0.03 0.00 -1.71 0.00 0.00 66.02 64.82 1rff s SER 198 CO 0.28 -0.64 0.36 -0.94 1.20 0.00 0.00 173.24 173.50 1rff s SER 199 N -2.10 -0.24 -0.06 5.45 1.04 -0.86 -0.82 113.70 116.12 1rff s SER 199 Ca 0.01 0.06 0.04 0.00 0.48 0.00 0.00 55.95 56.54 1rff s SER 199 Cb -0.01 0.37 -0.00 0.00 0.10 0.00 0.00 66.02 66.48 1rff s SER 199 CO -0.05 -0.55 -0.19 0.00 0.98 0.00 0.00 173.24 173.43 1rff s ALA 200 N -1.84 1.74 -0.28 5.32 0.00 0.35 -0.97 121.76 126.08 1rff s ALA 200 Ca -0.10 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1rff s ALA 200 Cb -0.03 -0.62 0.07 0.00 0.00 0.00 0.00 23.12 22.54 1rff s ALA 200 CO 0.02 0.27 -0.06 -0.65 0.00 0.00 0.00 175.76 175.34 1rff s GLN 201 N 0.20 2.15 -0.15 0.00 -1.52 0.46 -0.53 119.66 120.26 1rff s GLN 201 Ca -0.10 -1.43 -0.16 0.00 -1.95 0.00 0.00 55.36 51.72 1rff s GLN 201 Cb -0.14 -3.00 -0.04 0.00 -0.22 0.00 0.00 33.01 29.60 1rff s GLN 201 CO 0.04 -0.65 0.40 -0.06 -0.25 0.00 0.00 175.29 174.77 1rff s PHE 202 N 1.09 3.46 0.10 0.91 0.40 0.13 -0.82 117.98 123.26 1rff s PHE 202 Ca -0.05 0.72 -0.08 0.00 -0.60 0.00 0.00 56.93 56.93 1rff s PHE 202 Cb -0.20 -2.48 0.03 0.00 0.51 0.00 0.00 43.02 40.88 1rff s PHE 202 CO -0.05 0.14 0.38 -1.71 0.70 0.00 0.00 175.22 174.68 1rff n ASN 203 N 3.86 -0.76 -0.03 1.36 2.85 -0.77 -1.95 115.26 119.82 1rff n ASN 203 Ca -0.09 -1.45 -0.03 0.00 -0.11 0.00 0.00 54.58 52.90 1rff n ASN 203 Cb 0.52 1.25 -0.01 0.00 1.24 0.00 0.00 39.78 42.78 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 -0.26 0.00 -4.07 1.20 9.36 -1.24 -4.43 117.16 117.72 1rff n TYR 204 Ca -0.02 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 60.85 1rff n TYR 204 Cb 0.23 -0.16 -0.07 0.00 -0.63 0.00 0.00 39.34 38.71 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 -1.06 0.56 -0.32 0.00 0.40 -1.26 -1.55 117.98 114.76 1rff s PHE 206 Ca 0.17 -0.11 0.04 0.00 -0.60 0.00 0.00 56.93 56.44 1rff s PHE 206 Cb -0.12 -0.36 0.09 0.00 0.51 0.00 0.00 43.02 43.14 1rff s PHE 206 CO 0.07 -0.01 0.01 0.34 0.70 0.00 0.00 175.22 176.33 1rff s ASP 207 N -0.14 4.69 0.11 1.36 -1.08 -0.20 -4.97 116.67 116.45 1rff s ASP 207 Ca 0.02 -1.97 -0.16 0.00 -0.52 0.00 0.00 52.55 49.92 1rff s ASP 207 Cb -0.02 -1.61 -0.03 0.00 -1.46 0.00 0.00 42.92 39.79 1rff s ASP 207 CO -0.00 -0.33 1.57 0.58 0.52 0.00 0.00 175.17 177.51 1rff h VAL 208 N 6.65 1.25 -0.54 1.11 2.07 -1.91 0.62 116.25 125.50 1rff h VAL 208 Ca -0.08 -0.93 0.06 0.00 0.82 0.00 0.00 66.70 66.57 1rff h VAL 208 Cb 1.03 1.15 -0.05 0.00 -1.52 0.00 0.00 31.29 31.89 1rff h VAL 208 CO 0.51 0.31 0.25 0.44 0.02 0.00 0.00 177.57 179.10 1rff h ASP 209 N 0.44 0.34 -0.10 0.57 3.45 -1.96 -0.22 116.42 118.95 1rff h ASP 209 Ca 0.11 0.04 -0.00 0.00 0.43 0.00 0.00 57.03 57.60 1rff h ASP 209 Cb 0.42 -0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 39.17 1rff h ASP 209 CO 0.01 0.23 0.06 -0.25 -1.57 0.00 0.00 179.24 177.72 1rff h TRP 210 N 0.48 0.14 -0.36 4.55 7.01 -1.85 -2.97 115.95 122.95 1rff h TRP 210 Ca 0.25 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.30 1rff h TRP 210 Cb 0.20 -0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 27.16 1rff h TRP 210 CO -0.12 0.16 0.07 1.25 -2.79 0.00 0.00 178.44 177.01 1rff h LEU 211 N 0.07 0.01 -1.35 0.65 5.85 -0.09 -1.55 115.31 118.91 1rff h LEU 211 Ca 0.04 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.85 1rff h LEU 211 Cb 0.07 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1rff h LEU 211 CO -0.01 0.04 0.46 0.58 -0.34 0.00 0.00 178.44 179.18 1rff h VAL 212 N 0.20 1.11 0.00 1.05 2.07 -1.03 -0.64 116.25 119.00 1rff h VAL 212 Ca 0.17 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1rff h VAL 212 Cb 0.19 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.15 1rff h VAL 212 CO -0.22 0.15 0.00 0.11 0.02 0.00 0.00 177.57 177.63 1rff h LYS 213 N 0.85 0.00 0.00 1.57 6.56 -1.13 -2.57 116.57 121.85 1rff h LYS 213 Ca 0.28 0.00 -0.07 0.00 -1.06 0.00 0.00 60.65 59.79 1rff h LYS 213 Cb 0.05 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.70 1rff h LYS 213 CO -0.08 0.00 -0.34 1.96 -2.06 0.00 0.00 179.45 178.93 1rff h GLN 214 N 0.00 0.00 -6.91 3.15 1.08 -0.82 -3.44 115.11 108.18 1rff h GLN 214 Ca 0.00 0.00 -0.50 0.00 -1.45 0.00 0.00 58.65 56.70 1rff h GLN 214 Cb 0.33 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 27.79 1rff h GLN 214 CO 0.00 0.34 0.46 0.71 -0.95 0.00 0.00 178.83 179.39 1rff s TYR 215 N -3.04 3.32 0.51 2.96 1.51 -0.97 -4.40 117.35 117.25 1rff s TYR 215 Ca 0.05 1.64 -0.22 0.00 -1.01 0.00 0.00 57.07 57.53 1rff s TYR 215 Cb 0.07 -3.25 -0.06 0.00 -0.11 0.00 0.00 41.96 38.61 1rff s TYR 215 CO 0.72 -0.78 1.26 -2.14 -1.11 0.00 0.00 175.55 173.51 1rff s PRO 216 N -2.10 3.38 0.24 -1.71 0.02 -1.26 -4.75 135.00 128.82 1rff s PRO 216 Ca 0.53 2.01 -0.05 0.00 0.02 0.00 0.00 61.00 63.50 1rff s PRO 216 Cb -0.27 -2.29 0.45 0.00 0.02 0.00 0.00 34.50 32.40 1rff s PRO 216 CO 0.35 -0.93 1.68 -1.35 -0.33 0.00 0.00 177.00 176.42 1rff h PRO 217 N 1.65 0.24 0.00 5.54 0.11 -1.93 0.11 132.00 137.73 1rff h PRO 217 Ca -0.50 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 1rff h PRO 217 Cb 1.28 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1rff h PRO 217 CO 0.58 0.16 -0.01 1.05 -0.21 0.00 0.00 178.00 179.58 1rff h GLU 218 N 0.25 0.00 -0.02 1.05 9.09 -2.03 -2.35 114.58 120.58 1rff h GLU 218 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.82 1rff h GLU 218 Cb 0.70 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.80 1rff h GLU 218 CO -0.52 0.01 -0.22 1.19 0.05 0.00 0.00 179.01 179.52 1rff n PHE 219 N -3.42 0.00 0.29 2.06 3.72 0.32 -4.64 117.46 115.80 1rff n PHE 219 Ca -0.03 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.50 1rff n PHE 219 Cb 0.09 0.00 0.60 0.00 -0.94 0.00 0.00 39.48 39.23 1rff n PHE 219 CO 0.00 0.00 0.00 -0.09 -0.05 0.00 0.00 176.76 176.62 1rff h ARG 220 N 2.76 0.00 -0.17 -1.08 2.43 -0.77 -2.31 114.38 115.25 1rff h ARG 220 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1rff h ARG 220 Cb 0.70 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.25 1rff h ARG 220 CO 0.00 0.00 0.00 1.63 -1.51 0.00 0.00 179.97 180.09 1rff n LYS 221 N -2.38 1.82 -2.21 0.20 5.02 -1.26 -4.98 118.16 114.36 1rff n LYS 221 Ca 0.00 -1.78 -0.36 0.00 -2.02 0.00 0.00 58.31 54.15 1rff n LYS 221 Cb 0.15 -1.36 0.00 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 -1.32 3.50 0.33 1.97 -0.14 -0.87 -4.79 119.74 118.41 1rff s LYS 222 Ca 0.25 1.74 -0.28 0.00 -1.36 0.00 0.00 55.97 56.31 1rff s LYS 222 Cb 0.16 -2.20 -0.12 0.00 -1.68 0.00 0.00 37.83 33.99 1rff s LYS 222 CO 0.23 -0.76 1.34 -2.30 -0.76 0.00 0.00 175.35 173.09 1rff n PRO 223 N -0.93 2.20 -4.44 -1.68 -0.02 -1.26 -4.85 135.00 124.02 1rff n PRO 223 Ca 0.10 0.77 -0.23 0.00 -2.02 0.00 0.00 63.50 62.12 1rff n PRO 223 Cb 0.49 -2.39 -0.16 0.00 -0.02 0.00 0.00 33.50 31.42 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 -0.94 0.92 -0.21 4.25 1.01 -0.11 -2.03 121.20 124.08 1rff s ILE 224 Ca 0.57 -0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.80 1rff s ILE 224 Cb -0.56 -0.86 -0.03 0.00 0.01 0.00 0.00 42.46 41.01 1rff s ILE 224 CO 0.61 0.31 0.04 -0.22 0.00 0.00 0.00 174.94 175.68 1rff s LEU 225 N 0.72 3.49 -0.31 2.97 2.96 -0.14 -0.96 118.68 127.40 1rff s LEU 225 Ca -0.13 -0.12 -0.12 0.00 -0.22 0.00 0.00 54.13 53.53 1rff s LEU 225 Cb -0.15 -1.90 -0.03 0.00 0.50 0.00 0.00 46.19 44.61 1rff s LEU 225 CO 0.02 0.06 0.24 -0.76 -1.32 0.00 0.00 176.35 174.60 1rff s LEU 226 N 1.02 4.30 -0.37 -0.68 1.43 0.77 -0.40 118.68 124.75 1rff s LEU 226 Ca 0.03 -0.21 -0.11 0.00 -1.03 0.00 0.00 54.13 52.81 1rff s LEU 226 Cb -0.14 -2.16 0.02 0.00 0.03 0.00 0.00 46.19 43.94 1rff s LEU 226 CO 0.03 -0.17 0.21 -0.69 0.23 0.00 0.00 176.35 175.96 1rff s VAL 227 N 1.78 4.68 0.30 -1.59 1.01 0.00 -0.18 120.40 126.41 1rff s VAL 227 Ca 0.07 -0.77 0.03 0.00 0.00 0.00 0.00 61.98 61.31 1rff s VAL 227 Cb -0.17 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1rff s VAL 227 CO 0.11 -0.21 0.12 -1.38 0.00 0.00 0.00 175.10 173.74 1rff s HIS 228 N 1.58 1.63 -0.33 5.22 -0.00 -0.63 -1.86 115.29 120.90 1rff s HIS 228 Ca 0.03 -1.25 0.04 0.00 -0.00 0.00 0.00 55.06 53.88 1rff s HIS 228 Cb -0.19 -0.95 0.12 0.00 -0.00 0.00 0.00 32.58 31.57 1rff s HIS 228 CO 0.07 -0.38 1.10 0.41 -0.00 0.00 0.00 174.74 175.94 1rff n GLY 229 N -0.58 2.98 3.77 -1.38 0.00 -1.26 -0.35 105.19 108.36 1rff n GLY 229 Ca -0.00 -0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.06 6.08 0.17 1.61 1.01 -1.26 -4.85 116.67 118.36 1rff s ASP 230 Ca 0.10 2.49 0.06 0.00 0.71 0.00 0.00 52.55 55.91 1rff s ASP 230 Cb 0.05 -2.62 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 1rff s ASP 230 CO 0.06 -1.00 -0.13 -0.54 0.21 0.00 0.00 175.17 173.77 1rff s LYS 231 N -2.57 1.17 5.29 8.23 1.02 -1.26 -4.50 119.74 127.13 1rff s LYS 231 Ca 0.63 -1.46 0.00 0.00 0.02 0.00 0.00 55.97 55.16 1rff s LYS 231 Cb -0.34 -0.93 0.00 0.00 -0.52 0.00 0.00 37.83 36.04 1rff s LYS 231 CO 0.41 0.15 0.00 0.54 -0.92 0.00 0.00 175.35 175.54 1rff n ARG 232 N -0.08 0.00 -0.16 1.68 1.74 -1.26 -2.35 116.66 116.23 1rff n ARG 232 Ca -0.11 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.89 1rff n ARG 232 Cb 0.59 0.00 0.01 0.00 -1.02 0.00 0.00 32.46 32.04 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 0.71 -0.82 5.56 3.07 -1.99 -1.05 114.58 120.06 1rff h GLU 233 Ca 0.00 -0.13 0.01 0.00 -0.50 0.00 0.00 59.36 58.74 1rff h GLU 233 Cb 0.00 -0.11 -0.04 0.00 -0.84 0.00 0.00 28.75 27.76 1rff h GLU 233 CO 0.00 0.65 0.54 0.00 -1.40 0.00 0.00 179.01 178.79 1rff h ALA 234 N 1.03 1.04 -0.39 3.43 0.00 -1.87 0.21 119.26 122.71 1rff h ALA 234 Ca 0.16 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1rff h ALA 234 Cb 0.21 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1rff h ALA 234 CO -0.01 0.42 0.23 -0.22 0.00 0.00 0.00 179.25 179.67 1rff h LYS 235 N 1.08 0.54 -0.60 0.00 3.64 -1.20 -1.39 116.57 118.63 1rff h LYS 235 Ca 0.31 -0.05 0.08 0.00 -1.27 0.00 0.00 60.65 59.71 1rff h LYS 235 Cb -0.09 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 31.56 1rff h LYS 235 CO -0.08 0.41 0.26 0.00 -2.27 0.00 0.00 179.45 177.78 1rff h ALA 236 N 1.09 0.78 -0.71 5.00 0.00 -0.69 -1.52 119.26 123.21 1rff h ALA 236 Ca 0.14 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1rff h ALA 236 Cb 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1rff h ALA 236 CO -0.02 -0.12 0.25 0.45 0.00 0.00 0.00 179.25 179.80 1rff h HIS 237 N 0.48 1.11 -0.58 0.00 3.86 -0.54 -1.67 115.15 117.81 1rff h HIS 237 Ca 0.29 -0.09 -0.07 0.00 -1.16 0.00 0.00 60.37 59.33 1rff h HIS 237 Cb 0.29 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.41 1rff h HIS 237 CO -0.13 0.87 0.09 1.25 0.86 0.00 0.00 177.93 180.87 1rff h LEU 238 N 1.05 0.92 -0.78 2.43 5.85 -0.94 -1.73 115.31 122.12 1rff h LEU 238 Ca 0.24 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 1rff h LEU 238 Cb 0.26 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1rff h LEU 238 CO -0.01 0.95 0.45 0.45 -0.34 0.00 0.00 178.44 179.94 1rff h HIS 239 N 0.86 1.04 -0.52 1.25 3.86 -1.05 -1.50 115.15 119.09 1rff h HIS 239 Ca 0.18 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.36 1rff h HIS 239 Cb 0.42 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.53 1rff h HIS 239 CO 0.03 0.71 0.28 0.00 0.86 0.00 0.00 177.93 179.82 1rff h ALA 240 N 1.24 0.66 -0.27 2.45 0.00 -1.12 0.19 119.26 122.41 1rff h ALA 240 Ca 0.28 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1rff h ALA 240 Cb -0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1rff h ALA 240 CO -0.05 0.19 0.02 1.96 0.00 0.00 0.00 179.25 181.37 1rff h GLN 241 N 0.69 0.40 0.20 0.00 4.20 -1.00 -3.16 115.11 116.44 1rff h GLN 241 Ca 0.18 -0.07 -0.31 0.00 0.06 0.00 0.00 58.65 58.52 1rff h GLN 241 Cb 0.05 -0.07 0.02 0.00 0.30 0.00 0.00 27.48 27.79 1rff h GLN 241 CO -0.03 0.41 -1.37 0.00 -0.67 0.00 0.00 178.83 177.17 1rff h ALA 242 N 1.64 -0.05 -0.77 3.87 0.00 -0.58 -3.39 119.26 119.99 1rff h ALA 242 Ca 0.09 -0.87 0.20 0.00 0.00 0.00 0.00 54.91 54.33 1rff h ALA 242 Cb 0.23 0.10 -0.14 0.00 0.00 0.00 0.00 17.79 17.98 1rff h ALA 242 CO 0.00 0.82 -0.04 1.17 0.00 0.00 0.00 179.25 181.20 1rff n LYS 243 N -3.64 -0.06 0.26 0.00 4.81 0.59 0.19 118.16 120.31 1rff n LYS 243 Ca -0.13 1.17 0.18 0.00 -0.87 0.00 0.00 58.31 58.66 1rff n LYS 243 Cb 1.07 -1.82 0.90 0.00 0.02 0.00 0.00 35.03 35.19 1rff n LYS 243 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1rff h PRO 244 N 0.00 0.00 -4.17 1.64 0.11 -1.76 -3.37 132.00 124.45 1rff h PRO 244 Ca 0.44 0.00 -0.74 0.00 0.11 0.00 0.00 66.00 65.82 1rff h PRO 244 Cb 0.86 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.68 1rff h PRO 244 CO -0.74 0.00 -0.32 0.71 -0.21 0.00 0.00 178.00 177.44 1rff s TYR 245 N -4.38 3.42 0.46 0.65 2.02 0.13 -4.94 117.35 114.71 1rff s TYR 245 Ca -0.04 -1.84 0.12 0.00 -0.37 0.00 0.00 57.07 54.93 1rff s TYR 245 Cb 0.13 -3.56 1.05 0.00 -0.40 0.00 0.00 41.96 39.18 1rff s TYR 245 CO 0.44 -0.99 2.08 1.05 -1.57 0.00 0.00 175.55 176.56 1rff h GLU 246 N 8.37 0.31 0.00 -0.62 4.11 -1.81 -1.71 114.58 123.22 1rff h GLU 246 Ca -0.18 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.23 1rff h GLU 246 Cb 1.07 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1rff h GLU 246 CO 0.87 0.20 0.00 0.27 0.07 0.00 0.00 179.01 180.43 1rff n ASN 247 N -4.49 0.00 -4.62 3.06 6.94 -1.26 -4.78 115.26 110.10 1rff n ASN 247 Ca 0.02 -0.54 -0.36 0.00 -0.02 0.00 0.00 54.58 53.69 1rff n ASN 247 Cb 0.13 -0.08 -0.10 0.00 -2.36 0.00 0.00 39.78 37.37 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 -2.16 4.97 0.29 1.53 1.01 -0.65 -0.93 121.20 125.27 1rff s ILE 248 Ca 0.31 0.04 0.10 0.00 0.00 0.00 0.00 60.65 61.11 1rff s ILE 248 Cb 0.16 -3.29 -0.05 0.00 0.01 0.00 0.00 42.46 39.29 1rff s ILE 248 CO 0.29 0.39 -0.07 -0.44 0.00 0.00 0.00 174.94 175.11 1rff s SER 249 N 0.88 4.08 0.06 3.58 0.01 -0.14 -4.94 113.70 117.24 1rff s SER 249 Ca 0.06 -0.90 0.07 0.00 1.31 0.00 0.00 55.95 56.49 1rff s SER 249 Cb -0.13 -0.55 -0.03 0.00 0.21 0.00 0.00 66.02 65.52 1rff s SER 249 CO 0.03 -0.06 -0.19 -0.76 0.41 0.00 0.00 173.24 172.66 1rff s LEU 250 N -3.63 2.22 -0.15 2.44 1.02 -1.26 -0.16 118.68 119.16 1rff s LEU 250 Ca 0.32 -0.57 -0.00 0.00 0.02 0.00 0.00 54.13 53.89 1rff s LEU 250 Cb -0.04 -0.85 0.03 0.00 0.02 0.00 0.00 46.19 45.35 1rff s LEU 250 CO 0.18 0.09 -0.09 0.00 0.02 0.00 0.00 176.35 176.55 1rff s GLN 252 N 1.58 3.68 0.04 0.00 0.74 -1.26 -1.61 119.66 122.84 1rff s GLN 252 Ca 0.03 0.06 -0.30 0.00 0.05 0.00 0.00 55.36 55.19 1rff s GLN 252 Cb -0.14 -3.81 -0.05 0.00 1.10 0.00 0.00 33.01 30.11 1rff s GLN 252 CO -0.09 -0.74 1.16 0.00 -0.55 0.00 0.00 175.29 175.07 1rff s ALA 253 N 2.72 3.36 0.23 1.58 0.00 0.52 -4.97 121.76 125.20 1rff s ALA 253 Ca 0.25 0.78 -0.31 0.00 0.00 0.00 0.00 51.96 52.68 1rff s ALA 253 Cb -0.14 -3.43 -0.10 0.00 0.00 0.00 0.00 23.12 19.44 1rff s ALA 253 CO 0.15 -0.42 1.51 -1.59 0.00 0.00 0.00 175.76 175.41 1rff s LYS 254 N 1.14 4.22 -0.61 0.00 -2.85 -1.26 -4.67 119.74 115.70 1rff s LYS 254 Ca 0.57 2.38 0.05 0.00 -1.00 0.00 0.00 55.97 57.97 1rff s LYS 254 Cb -0.28 -3.11 0.19 0.00 -2.06 0.00 0.00 37.83 32.58 1rff s LYS 254 CO 0.28 -0.52 0.51 1.28 0.10 0.00 0.00 175.35 177.00 1rff n LEU 255 N 2.84 2.23 0.04 2.77 4.77 -1.26 -4.93 117.00 123.46 1rff n LEU 255 Ca 0.09 -5.04 0.11 0.00 -0.03 0.00 0.00 56.01 51.14 1rff n LEU 255 Cb 0.39 -0.38 0.44 0.00 -2.33 0.00 0.00 43.42 41.54 1rff n LEU 255 CO 0.61 1.85 0.84 0.47 -1.33 0.00 0.00 177.39 179.83 1rff n ASP 256 N 1.91 0.24 -4.57 -1.43 10.43 -1.26 -4.71 116.55 117.16 1rff n ASP 256 Ca 0.24 0.54 -0.34 0.00 2.57 0.00 0.00 54.79 57.80 1rff n ASP 256 Cb 0.40 -0.60 -0.11 0.00 1.84 0.00 0.00 41.12 42.65 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 -3.08 4.05 0.45 0.53 1.01 -1.26 -5.08 121.20 117.82 1rff s ILE 257 Ca 0.09 -0.32 -0.24 0.00 0.00 0.00 0.00 60.65 60.17 1rff s ILE 257 Cb 0.12 -2.74 -0.09 0.00 0.01 0.00 0.00 42.46 39.76 1rff s ILE 257 CO 0.40 0.53 1.26 0.00 0.00 0.00 0.00 174.94 177.13 1rff n ALA 258 N 3.00 1.24 -1.09 9.38 0.00 -1.26 -2.45 120.51 129.33 1rff n ALA 258 Ca -0.18 0.22 -0.03 0.00 0.00 0.00 0.00 53.44 53.45 1rff n ALA 258 Cb 0.53 -2.27 -0.01 0.00 0.00 0.00 0.00 19.45 17.70 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 -0.45 0.00 -2.73 0.00 3.01 -1.26 -4.97 117.46 111.07 1rff n PHE 259 Ca 0.08 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.22 1rff n PHE 259 Cb 0.41 -1.39 -0.04 0.00 -0.01 0.00 0.00 39.48 38.45 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 -2.25 2.13 0.08 1.37 0.00 -1.02 -4.92 107.32 102.71 1rff s GLY 260 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 44.72 44.83 1rff s GLY 260 CO 0.00 0.32 -0.10 -0.51 0.00 0.00 0.00 173.10 172.81 1rff s THR 261 N -2.37 0.83 -0.80 0.90 -4.23 -1.26 -4.97 115.64 103.74 1rff s THR 261 Ca 0.56 -1.49 -0.22 0.00 -1.18 0.00 0.00 61.69 59.37 1rff s THR 261 Cb -0.10 -1.17 0.09 0.00 1.34 0.00 0.00 72.50 72.66 1rff s THR 261 CO 0.26 -0.51 1.10 -2.28 -0.54 0.00 0.00 174.62 172.65 1rff s HIS 262 N -2.17 2.79 -0.57 3.99 2.46 -1.26 -1.46 115.29 119.06 1rff s HIS 262 Ca 0.01 -0.85 0.16 0.00 0.47 0.00 0.00 55.06 54.85 1rff s HIS 262 Cb -0.05 -4.36 -0.19 0.00 -0.13 0.00 0.00 32.58 27.86 1rff s HIS 262 CO -0.00 -1.65 0.60 1.58 -2.47 0.00 0.00 174.74 172.79 1rff n HIS 263 N 7.54 0.00 -1.63 3.88 -0.00 -0.29 -3.61 115.22 121.11 1rff n HIS 263 Ca 0.11 0.00 -0.47 0.00 -0.00 0.00 0.00 57.72 57.36 1rff n HIS 263 Cb 0.48 -0.09 -0.03 0.00 -0.00 0.00 0.00 29.99 30.34 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 -1.54 0.77 -3.95 3.57 -1.04 -1.00 -4.58 114.28 106.51 1rff n THR 264 Ca 0.02 -0.19 -0.34 0.00 -2.04 0.00 0.00 64.05 61.49 1rff n THR 264 Cb 0.29 -1.23 -0.14 0.00 -1.82 0.00 0.00 70.33 67.43 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 -0.20 2.38 -0.10 -2.82 3.01 -1.26 -2.73 119.74 118.02 1rff s LYS 265 Ca 0.72 -1.29 -0.13 0.00 -1.01 0.00 0.00 55.97 54.26 1rff s LYS 265 Cb -0.74 -3.11 0.03 0.00 -1.01 0.00 0.00 37.83 33.00 1rff s LYS 265 CO 0.49 -0.61 0.34 1.41 0.51 0.00 0.00 175.35 177.49 1rff s MET 266 N 1.22 0.47 -0.10 1.68 1.75 -0.82 -1.61 119.30 121.90 1rff s MET 266 Ca -0.06 0.32 0.02 0.00 -1.25 0.00 0.00 55.69 54.72 1rff s MET 266 Cb -0.20 0.22 -0.02 0.00 2.84 0.00 0.00 34.83 37.68 1rff s MET 266 CO -0.02 -0.08 -0.15 -1.64 -0.65 0.00 0.00 175.02 172.47 1rff s MET 267 N -0.19 3.02 -0.23 4.11 -1.94 0.44 -0.69 119.30 123.82 1rff s MET 267 Ca -0.03 -0.72 -0.05 0.00 -1.71 0.00 0.00 55.69 53.17 1rff s MET 267 Cb -0.03 -2.49 -0.02 0.00 2.01 0.00 0.00 34.83 34.30 1rff s MET 267 CO 0.01 0.35 0.01 -0.51 -0.01 0.00 0.00 175.02 174.87 1rff s LEU 268 N -0.03 3.16 -0.31 -0.03 1.43 0.31 -1.23 118.68 121.99 1rff s LEU 268 Ca -0.04 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 1rff s LEU 268 Cb -0.14 -1.82 0.08 0.00 0.03 0.00 0.00 46.19 44.33 1rff s LEU 268 CO 0.04 -0.01 0.00 -0.76 0.23 0.00 0.00 176.35 175.85 1rff s LEU 269 N 1.45 4.18 -0.19 1.79 1.43 -0.11 -0.50 118.68 126.73 1rff s LEU 269 Ca 0.05 -1.70 -0.18 0.00 -1.03 0.00 0.00 54.13 51.28 1rff s LEU 269 Cb -0.15 -1.64 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 1rff s LEU 269 CO 0.00 -0.31 0.47 -0.22 0.23 0.00 0.00 176.35 176.53 1rff s LEU 270 N 1.07 4.17 0.43 1.79 2.96 0.00 -1.29 118.68 127.81 1rff s LEU 270 Ca 0.00 0.65 0.06 0.00 -0.22 0.00 0.00 54.13 54.62 1rff s LEU 270 Cb -0.20 -2.65 -0.06 0.00 0.50 0.00 0.00 46.19 43.79 1rff s LEU 270 CO -0.05 -0.12 0.08 -0.31 -1.32 0.00 0.00 176.35 174.63 1rff s TYR 271 N 1.38 2.42 0.39 5.38 2.02 0.77 -0.04 117.35 129.67 1rff s TYR 271 Ca 0.23 -0.69 0.11 0.00 -0.37 0.00 0.00 57.07 56.35 1rff s TYR 271 Cb -0.15 -1.82 0.79 0.00 -0.40 0.00 0.00 41.96 40.38 1rff s TYR 271 CO 0.09 0.29 1.89 0.93 -1.57 0.00 0.00 175.55 177.18 1rff h GLU 272 N 1.56 0.11 -0.01 -0.62 5.08 -1.41 -3.13 114.58 116.16 1rff h GLU 272 Ca -0.43 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1rff h GLU 272 Cb 1.26 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1rff h GLU 272 CO 0.76 0.35 -0.54 0.39 -1.00 0.00 0.00 179.01 178.96 1rff n GLU 273 N -4.21 0.52 0.00 2.33 4.71 -1.26 -5.04 120.64 117.69 1rff n GLU 273 Ca -0.02 -0.37 0.00 0.00 -0.01 0.00 0.00 57.16 56.76 1rff n GLU 273 Cb 0.32 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.26 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 1.44 -0.04 2.91 0.62 0.00 -1.18 -4.60 105.19 104.34 1rff n GLY 274 Ca 0.08 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 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 2.03 0.03 0.99 2.96 0.05 -0.16 118.68 124.57 1rff s LEU 275 Ca 0.00 -0.08 0.05 0.00 -0.22 0.00 0.00 54.13 53.88 1rff s LEU 275 Cb 0.00 -0.08 -0.02 0.00 0.50 0.00 0.00 46.19 46.59 1rff s LEU 275 CO 0.00 -0.01 -0.16 -0.60 -1.32 0.00 0.00 176.35 174.27 1rff s ARG 276 N -0.20 1.07 -0.11 1.98 3.52 -0.41 -0.32 118.95 124.48 1rff s ARG 276 Ca -0.01 -0.76 0.03 0.00 -0.13 0.00 0.00 55.73 54.86 1rff s ARG 276 Cb -0.02 -1.09 -0.01 0.00 -1.56 0.00 0.00 34.95 32.27 1rff s ARG 276 CO -0.00 0.28 -0.21 0.08 -0.81 0.00 0.00 175.30 174.64 1rff s VAL 277 N -0.75 2.37 -0.16 7.11 1.01 -1.26 -0.94 120.40 127.78 1rff s VAL 277 Ca 0.03 -0.91 0.01 0.00 0.00 0.00 0.00 61.98 61.12 1rff s VAL 277 Cb -0.08 -1.93 0.01 0.00 0.00 0.00 0.00 36.38 34.38 1rff s VAL 277 CO 0.01 0.55 -0.20 -0.69 0.00 0.00 0.00 175.10 174.77 1rff s VAL 278 N 0.29 2.20 -0.13 2.92 1.01 -0.37 -1.00 120.40 125.33 1rff s VAL 278 Ca -0.15 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 60.93 1rff s VAL 278 Cb -0.17 -1.91 -0.00 0.00 0.00 0.00 0.00 36.38 34.30 1rff s VAL 278 CO 0.08 0.54 -0.19 -0.63 0.00 0.00 0.00 175.10 174.89 1rff s ILE 279 N 0.99 2.41 0.00 2.22 1.01 -0.80 -0.42 121.20 126.61 1rff s ILE 279 Ca -0.02 -0.88 -0.00 0.00 0.00 0.00 0.00 60.65 59.75 1rff s ILE 279 Cb -0.15 -1.98 0.00 0.00 0.01 0.00 0.00 42.46 40.35 1rff s ILE 279 CO -0.05 0.54 0.00 0.00 0.00 0.00 0.00 174.94 175.43 1rff n HIS 280 N 3.78 -0.39 -0.17 3.97 1.44 -0.63 -0.11 115.22 123.11 1rff n HIS 280 Ca -0.19 -0.01 0.00 0.00 -2.01 0.00 0.00 57.72 55.51 1rff n HIS 280 Cb 0.52 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.64 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 -0.00 0.02 -3.74 0.61 -2.24 -0.74 -4.36 114.28 103.83 1rff n THR 281 Ca 0.00 -0.43 -0.37 0.00 -2.27 0.00 0.00 64.05 60.99 1rff n THR 281 Cb 0.00 1.15 -0.07 0.00 -2.10 0.00 0.00 70.33 69.32 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 -0.02 6.43 0.81 3.42 0.01 -1.26 -4.77 113.70 118.31 1rff s SER 282 Ca 0.00 0.51 -0.11 0.00 1.31 0.00 0.00 55.95 57.67 1rff s SER 282 Cb 0.00 -2.12 0.08 0.00 0.21 0.00 0.00 66.02 64.19 1rff s SER 282 CO 0.00 0.31 1.11 0.20 0.41 0.00 0.00 173.24 175.27 1rff s ASN 283 N -0.58 4.05 -1.26 2.44 0.01 -1.26 -4.92 114.94 113.43 1rff s ASN 283 Ca 0.15 1.96 -0.07 0.00 -0.71 0.00 0.00 52.86 54.20 1rff s ASN 283 Cb -0.13 -2.54 0.18 0.00 0.41 0.00 0.00 41.25 39.17 1rff s ASN 283 CO 0.04 -2.34 1.99 0.18 -1.51 0.00 0.00 177.10 175.46 1rff n LEU 284 N -3.64 7.10 -3.88 0.60 4.77 -0.59 -4.72 117.00 116.64 1rff n LEU 284 Ca 0.10 -4.82 -0.11 0.00 -0.03 0.00 0.00 56.01 51.15 1rff n LEU 284 Cb 0.53 -1.40 -0.10 0.00 -2.33 0.00 0.00 43.42 40.11 1rff n LEU 284 CO 0.52 1.66 -0.18 0.27 -1.33 0.00 0.00 177.39 178.33 1rff s ILE 285 N -0.68 0.09 0.24 -0.08 -4.36 -1.26 -1.04 121.20 114.12 1rff s ILE 285 Ca 0.43 -0.76 -0.06 0.00 -0.26 0.00 0.00 60.65 60.00 1rff s ILE 285 Cb 0.12 -0.51 0.21 0.00 1.25 0.00 0.00 42.46 43.53 1rff s ILE 285 CO -0.02 -0.42 1.86 -0.74 0.24 0.00 0.00 174.94 175.86 1rff h HIS 286 N 4.16 0.99 0.00 1.37 -0.00 -1.94 -2.56 115.15 117.17 1rff h HIS 286 Ca -0.31 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.06 1rff h HIS 286 Cb 1.19 -0.32 -0.00 0.00 -0.00 0.00 0.00 27.41 28.28 1rff h HIS 286 CO 0.58 0.52 -0.11 0.00 -0.00 0.00 0.00 177.93 178.93 1rff h ALA 287 N 1.39 1.12 0.00 5.26 0.00 -1.97 -1.90 119.26 123.15 1rff h ALA 287 Ca 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1rff h ALA 287 Cb 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1rff h ALA 287 CO -0.15 0.13 0.00 -0.44 0.00 0.00 0.00 179.25 178.79 1rff h ASP 288 N 0.00 0.00 -0.21 0.00 3.45 -1.74 -3.19 116.42 114.72 1rff h ASP 288 Ca -0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 1rff h ASP 288 Cb 0.45 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.22 1rff h ASP 288 CO 0.01 0.00 0.00 0.79 -1.57 0.00 0.00 179.24 178.47 1rff n TRP 289 N -2.62 0.28 -0.02 4.55 7.02 -0.74 -4.57 117.44 121.34 1rff n TRP 289 Ca 0.03 -0.47 -0.02 0.00 -1.02 0.00 0.00 57.50 56.02 1rff n TRP 289 Cb 0.37 -0.03 -0.01 0.00 -2.42 0.00 0.00 31.31 29.22 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 0.17 0.14 -2.14 -5.99 -0.00 -1.09 -4.76 115.22 101.56 1rff n HIS 290 Ca 0.07 0.06 0.03 0.00 0.46 0.00 0.00 57.72 58.35 1rff n HIS 290 Cb 0.35 -0.28 0.10 0.00 -0.12 0.00 0.00 29.99 30.04 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 -3.02 0.95 -4.15 1.57 6.02 -1.26 -0.97 117.38 116.51 1rff n GLN 291 Ca -0.03 -2.74 -0.23 0.00 -0.01 0.00 0.00 57.00 53.99 1rff n GLN 291 Cb 0.12 -0.88 -0.05 0.00 1.02 0.00 0.00 30.24 30.45 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 -1.75 2.79 -0.33 -1.09 1.02 -1.26 -3.67 119.74 115.45 1rff s LYS 292 Ca 0.36 -1.09 -0.23 0.00 0.02 0.00 0.00 55.97 55.03 1rff s LYS 292 Cb 0.38 -2.50 0.00 0.00 -0.52 0.00 0.00 37.83 35.20 1rff s LYS 292 CO -0.11 0.41 0.79 0.99 -0.92 0.00 0.00 175.35 176.51 1rff s THR 293 N -2.08 4.77 0.09 2.17 2.01 0.12 -4.79 115.64 117.92 1rff s THR 293 Ca 0.32 1.05 0.04 0.00 0.31 0.00 0.00 61.69 63.41 1rff s THR 293 Cb -0.08 -4.17 -0.03 0.00 0.01 0.00 0.00 72.50 68.22 1rff s THR 293 CO 0.23 -0.33 -0.11 -1.10 -0.69 0.00 0.00 174.62 172.62 1rff s GLN 294 N 3.02 0.83 0.14 4.92 -1.52 -1.26 -0.44 119.66 125.35 1rff s GLN 294 Ca 0.32 -1.07 0.08 0.00 -1.95 0.00 0.00 55.36 52.74 1rff s GLN 294 Cb -0.14 -0.64 -0.04 0.00 -0.22 0.00 0.00 33.01 31.98 1rff s GLN 294 CO 0.14 0.12 -0.10 0.20 -0.25 0.00 0.00 175.29 175.40 1rff s GLY 295 N -2.15 1.75 -0.03 3.09 0.00 -1.26 -2.22 107.32 106.50 1rff s GLY 295 Ca 0.02 -1.35 0.01 0.00 0.00 0.00 0.00 44.72 43.40 1rff s GLY 295 CO 0.01 -1.35 -0.05 -0.42 0.00 0.00 0.00 173.10 171.29 1rff s ILE 296 N -1.42 0.48 -0.16 0.90 1.01 0.72 -1.79 121.20 120.94 1rff s ILE 296 Ca 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 60.65 60.69 1rff s ILE 296 Cb -0.10 -0.47 -0.02 0.00 0.01 0.00 0.00 42.46 41.88 1rff s ILE 296 CO 0.14 0.18 -0.06 0.86 0.00 0.00 0.00 174.94 176.06 1rff s TRP 297 N 0.47 2.96 -0.25 3.97 -0.00 0.84 -0.74 118.94 126.20 1rff s TRP 297 Ca -0.06 -0.46 -0.07 0.00 -0.00 0.00 0.00 56.10 55.50 1rff s TRP 297 Cb -0.09 -1.95 -0.03 0.00 -0.00 0.00 0.00 33.47 31.39 1rff s TRP 297 CO -0.00 -0.15 0.08 -0.51 -0.00 0.00 0.00 176.95 176.37 1rff s LEU 298 N 0.52 3.47 0.96 5.86 1.43 -0.71 -1.91 118.68 128.29 1rff s LEU 298 Ca -0.04 -0.20 -0.11 0.00 -1.03 0.00 0.00 54.13 52.75 1rff s LEU 298 Cb -0.15 -1.93 0.17 0.00 0.03 0.00 0.00 46.19 44.31 1rff s LEU 298 CO 0.03 -0.03 1.09 -0.94 0.23 0.00 0.00 176.35 176.73 1rff s SER 299 N 1.61 2.80 1.00 2.29 1.04 -0.17 -4.81 113.70 117.46 1rff s SER 299 Ca 0.06 1.69 -0.12 0.00 0.48 0.00 0.00 55.95 58.06 1rff s SER 299 Cb -0.15 -2.32 0.19 0.00 0.10 0.00 0.00 66.02 63.83 1rff s SER 299 CO 0.04 -3.09 1.08 -2.84 0.98 0.00 0.00 173.24 169.41 1rff s PRO 300 N -4.75 0.44 -0.36 4.02 0.02 -1.26 -4.77 135.00 128.34 1rff s PRO 300 Ca 0.65 0.76 -0.29 0.00 0.02 0.00 0.00 61.00 62.14 1rff s PRO 300 Cb -0.21 -1.72 -0.00 0.00 0.02 0.00 0.00 34.50 32.59 1rff s PRO 300 CO 0.59 -2.78 1.49 -1.17 -0.33 0.00 0.00 177.00 174.80 1rff s LEU 301 N -6.56 3.64 -0.23 -5.54 2.96 -1.26 -4.60 118.68 107.09 1rff s LEU 301 Ca 0.65 1.04 -0.23 0.00 -0.22 0.00 0.00 54.13 55.38 1rff s LEU 301 Cb -0.20 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 42.94 1rff s LEU 301 CO 0.59 -1.42 0.74 -0.31 -1.32 0.00 0.00 176.35 174.62 1rff s TYR 302 N 5.55 3.33 0.66 5.38 2.02 0.56 -4.87 117.35 129.98 1rff s TYR 302 Ca 0.65 1.02 -0.11 0.00 -0.37 0.00 0.00 57.07 58.26 1rff s TYR 302 Cb -0.17 -2.94 -0.01 0.00 -0.40 0.00 0.00 41.96 38.44 1rff s TYR 302 CO 0.31 -0.32 1.05 -1.25 -1.57 0.00 0.00 175.55 173.77 1rff s PRO 303 N 2.49 3.22 0.35 -1.71 0.04 -1.26 -0.78 135.00 137.36 1rff s PRO 303 Ca 0.32 0.90 -0.27 0.00 0.04 0.00 0.00 61.00 61.98 1rff s PRO 303 Cb -0.16 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 1rff s PRO 303 CO 0.09 -0.87 1.20 1.03 0.04 0.00 0.00 177.00 178.49 1rff s ARG 304 N -5.00 4.31 0.11 4.56 0.52 -1.26 -0.58 118.95 121.61 1rff s ARG 304 Ca 0.57 1.96 -0.31 0.00 -0.52 0.00 0.00 55.73 57.43 1rff s ARG 304 Cb -0.13 -2.94 -0.07 0.00 0.52 0.00 0.00 34.95 32.33 1rff s ARG 304 CO 0.53 -0.14 1.26 0.42 0.02 0.00 0.00 175.30 177.39 1rff s ILE 305 N -1.26 3.68 0.35 1.52 1.01 -0.13 -4.76 121.20 121.61 1rff s ILE 305 Ca 0.51 1.26 -0.26 0.00 0.00 0.00 0.00 60.65 62.16 1rff s ILE 305 Cb -0.34 -3.81 -0.13 0.00 0.01 0.00 0.00 42.46 38.19 1rff s ILE 305 CO 0.44 0.13 0.93 0.00 0.00 0.00 0.00 174.94 176.43 1rff n ALA 306 N 3.54 -0.37 -0.24 9.38 0.00 -1.26 -4.84 120.51 126.72 1rff n ALA 306 Ca 0.08 0.31 0.31 0.00 0.00 0.00 0.00 53.44 54.14 1rff n ALA 306 Cb 0.45 -1.99 0.72 0.00 0.00 0.00 0.00 19.45 18.62 1rff n ALA 306 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1rff h ASP 307 N 1.64 0.03 -0.26 0.00 3.32 -2.00 -2.37 116.42 116.78 1rff h ASP 307 Ca -0.41 0.01 -0.20 0.00 0.02 0.00 0.00 57.03 56.44 1rff h ASP 307 Cb 1.35 -0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.70 1rff h ASP 307 CO 0.58 0.01 -0.69 0.61 -1.72 0.00 0.00 179.24 178.03 1rff n GLY 308 N -1.72 4.93 3.37 2.75 0.00 -1.26 -5.07 105.19 108.20 1rff n GLY 308 Ca 0.21 -1.68 -0.24 0.00 0.00 0.00 0.00 46.02 44.32 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 -3.38 2.07 -0.76 2.61 -1.32 -0.89 -5.09 115.64 108.87 1rff s THR 309 Ca 0.41 -1.95 -0.01 0.00 -1.21 0.00 0.00 61.69 58.94 1rff s THR 309 Cb 0.38 -1.96 0.19 0.00 -1.51 0.00 0.00 72.50 69.60 1rff s THR 309 CO -0.04 -0.20 0.60 -1.00 -2.21 0.00 0.00 174.62 171.77 1rff s HIS 310 N -1.81 3.66 0.11 9.09 4.02 -1.26 -4.89 115.29 124.20 1rff s HIS 310 Ca 0.17 -3.00 0.05 0.00 1.02 0.00 0.00 55.06 53.30 1rff s HIS 310 Cb -0.07 -3.11 -0.04 0.00 -1.02 0.00 0.00 32.58 28.34 1rff s HIS 310 CO 0.08 -0.73 -0.12 -1.59 1.02 0.00 0.00 174.74 173.39 1rff s LYS 311 N -0.95 0.92 0.17 1.40 -2.85 -1.26 -5.04 119.74 112.13 1rff s LYS 311 Ca 0.23 -1.17 0.09 0.00 -1.00 0.00 0.00 55.97 54.13 1rff s LYS 311 Cb -0.11 -0.74 -0.12 0.00 -2.06 0.00 0.00 37.83 34.80 1rff s LYS 311 CO -0.10 0.14 1.34 0.66 0.10 0.00 0.00 175.35 177.48 1rff h SER 312 N 3.64 0.00 -0.59 0.03 4.64 -1.97 -3.47 113.55 115.82 1rff h SER 312 Ca -0.39 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.68 1rff h SER 312 Cb 1.19 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.18 1rff h SER 312 CO 0.50 0.86 -0.23 0.61 -0.87 0.00 0.00 176.83 177.70 1rff n GLY 313 N 1.28 1.34 3.86 -0.77 0.00 -1.26 -4.90 105.19 104.74 1rff n GLY 313 Ca 0.00 -0.44 -0.34 0.00 0.00 0.00 0.00 46.02 45.25 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 -3.06 3.83 0.39 1.61 2.56 -1.26 -0.54 118.70 122.23 1rff s GLU 314 Ca 0.00 0.29 0.03 0.00 0.00 0.00 0.00 54.97 55.29 1rff s GLU 314 Cb 0.00 -2.87 -0.01 0.00 2.00 0.00 0.00 34.13 33.26 1rff s GLU 314 CO 0.00 0.46 0.57 -1.54 -0.56 0.00 0.00 175.26 174.18 1rff s SER 315 N -1.97 5.92 0.55 -1.70 1.04 -1.26 -4.32 113.70 111.96 1rff s SER 315 Ca 0.39 0.07 0.37 0.00 0.48 0.00 0.00 55.95 57.26 1rff s SER 315 Cb -0.13 -1.43 1.99 0.00 0.10 0.00 0.00 66.02 66.55 1rff s SER 315 CO 0.20 -0.55 2.12 1.55 0.98 0.00 0.00 173.24 177.54 1rff h PRO 316 N 0.65 0.00 -0.08 4.02 0.13 -1.81 -0.99 132.00 133.93 1rff h PRO 316 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1rff h PRO 316 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1rff h PRO 316 CO 0.56 0.00 0.00 0.25 -0.23 0.00 0.00 178.00 178.58 1rff n THR 317 N -2.79 0.08 -2.02 1.56 -2.24 -1.26 -4.92 114.28 102.68 1rff n THR 317 Ca -0.02 -0.32 -0.17 0.00 -2.27 0.00 0.00 64.05 61.27 1rff n THR 317 Cb 0.06 0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 68.82 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 0.37 -0.51 -0.32 4.78 8.25 -0.37 -4.75 115.22 122.66 1rff n HIS 318 Ca 0.18 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.60 1rff n HIS 318 Cb 0.38 -3.23 0.08 0.00 1.12 0.00 0.00 29.99 28.34 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 1.13 0.30 4.41 3.57 -1.84 -1.17 116.94 123.33 1rff h PHE 319 Ca -0.38 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.11 1rff h PHE 319 Cb 1.23 -0.38 0.00 0.00 2.79 0.00 0.00 35.95 39.59 1rff h PHE 319 CO 0.46 0.73 -0.14 -0.22 -2.23 0.00 0.00 178.31 176.90 1rff h LYS 320 N 1.19 -0.39 -0.62 1.11 3.64 -1.88 -0.72 116.57 118.91 1rff h LYS 320 Ca 0.32 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.80 1rff h LYS 320 Cb -0.09 0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.75 1rff h LYS 320 CO -0.06 -0.16 0.29 0.00 -2.27 0.00 0.00 179.45 177.25 1rff h ALA 321 N 0.09 0.82 -0.53 5.00 0.00 -1.93 -1.53 119.26 121.18 1rff h ALA 321 Ca -0.04 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 1rff h ALA 321 Cb 0.41 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1rff h ALA 321 CO 0.07 -0.09 0.08 -0.91 0.00 0.00 0.00 179.25 178.40 1rff h ASN 322 N 0.53 0.79 -0.28 0.00 -0.26 -1.10 0.09 115.58 115.36 1rff h ASN 322 Ca 0.29 -0.17 -0.17 0.00 -0.56 0.00 0.00 56.30 55.70 1rff h ASN 322 Cb 0.28 -0.21 -0.00 0.00 -1.06 0.00 0.00 38.32 37.33 1rff h ASN 322 CO -0.24 0.81 -0.49 0.25 -1.06 0.00 0.00 177.43 176.71 1rff h LEU 323 N 0.80 0.92 -0.84 1.61 5.85 -0.90 -1.03 115.31 121.71 1rff h LEU 323 Ca 0.17 -0.53 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 1rff h LEU 323 Cb 0.37 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1rff h LEU 323 CO 0.01 1.27 0.35 0.40 -0.34 0.00 0.00 178.44 180.13 1rff h ILE 324 N 0.60 1.26 -0.59 4.05 2.04 -1.01 -0.88 117.51 122.98 1rff h ILE 324 Ca 0.02 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.06 1rff h ILE 324 Cb 1.09 0.25 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 1rff h ILE 324 CO 0.11 0.33 0.24 0.28 0.00 0.00 0.00 178.15 179.11 1rff h SER 325 N 1.18 0.81 -0.24 1.72 0.02 -0.83 0.21 113.55 116.43 1rff h SER 325 Ca 0.28 -0.17 0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1rff h SER 325 Cb 0.17 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 1rff h SER 325 CO -0.03 0.76 0.14 0.22 -1.14 0.00 0.00 176.83 176.78 1rff h TYR 326 N 0.82 0.26 -0.24 3.45 3.20 -0.89 -2.43 116.97 121.15 1rff h TYR 326 Ca 0.20 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.98 1rff h TYR 326 Cb 0.19 -0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.37 1rff h TYR 326 CO 0.01 0.16 -0.25 -0.07 -1.64 0.00 0.00 178.16 176.36 1rff h LEU 327 N 0.29 0.45 -1.62 2.82 3.38 -0.91 -2.92 115.31 116.80 1rff h LEU 327 Ca 0.09 -0.15 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1rff h LEU 327 Cb -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1rff h LEU 327 CO -0.04 0.71 -0.20 0.74 0.09 0.00 0.00 178.44 179.73 1rff h THR 328 N 0.40 1.09 0.00 0.22 2.02 -0.28 -2.09 112.91 114.27 1rff h THR 328 Ca 0.06 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.54 1rff h THR 328 Cb 0.66 1.38 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1rff h THR 328 CO 0.05 0.20 0.00 0.00 0.37 0.00 0.00 175.52 176.13 1rff h ALA 329 N 1.80 1.00 0.00 6.16 0.00 -1.24 -2.13 119.26 124.86 1rff h ALA 329 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1rff h ALA 329 Cb 0.37 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 1rff h ALA 329 CO 0.03 0.00 -0.16 1.88 0.00 0.00 0.00 179.25 180.99 1rff h TYR 330 N 0.00 0.00 -6.34 0.00 -1.99 -1.50 -3.47 116.97 103.66 1rff h TYR 330 Ca 0.00 0.00 -0.47 0.00 2.00 0.00 0.00 58.73 60.26 1rff h TYR 330 Cb 0.31 0.00 -0.03 0.00 2.00 0.00 0.00 36.73 39.01 1rff h TYR 330 CO 0.00 0.16 -0.84 -1.71 -0.00 0.00 0.00 178.16 175.77 1rff n ASN 331 N -3.28 -1.60 -4.22 3.88 5.15 -0.80 -4.70 115.26 109.69 1rff n ASN 331 Ca 0.01 -0.90 -0.32 0.00 -0.60 0.00 0.00 54.58 52.77 1rff n ASN 331 Cb 0.43 -3.51 -0.17 0.00 -0.53 0.00 0.00 39.78 35.99 1rff n ASN 331 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1rff s ALA 332 N -3.69 2.14 0.26 5.20 0.00 -1.26 -5.04 121.76 119.37 1rff s ALA 332 Ca 0.18 -0.97 -0.03 0.00 0.00 0.00 0.00 51.96 51.15 1rff s ALA 332 Cb -0.09 -0.78 0.43 0.00 0.00 0.00 0.00 23.12 22.67 1rff s ALA 332 CO 0.86 0.30 1.84 -1.00 0.00 0.00 0.00 175.76 177.76 1rff h PRO 333 N 6.63 0.96 0.00 0.00 0.13 -2.00 -2.17 132.00 135.54 1rff h PRO 333 Ca -0.21 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1rff h PRO 333 Cb 1.23 -0.22 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1rff h PRO 333 CO 0.47 0.63 0.00 0.66 -0.23 0.00 0.00 178.00 179.53 1rff h SER 334 N 0.99 0.00 1.06 1.44 4.64 -1.96 -2.45 113.55 117.27 1rff h SER 334 Ca 0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.75 1rff h SER 334 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1rff h SER 334 CO -0.22 0.00 -0.55 -0.07 -0.87 0.00 0.00 176.83 175.13 1rff h LEU 335 N 0.00 0.00 -0.96 5.97 3.38 -1.80 -3.30 115.31 118.61 1rff h LEU 335 Ca 0.00 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1rff h LEU 335 Cb 0.64 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1rff h LEU 335 CO 0.00 0.07 -0.29 0.50 0.09 0.00 0.00 178.44 178.80 1rff h LYS 336 N 0.00 0.40 -0.35 1.13 1.63 -1.16 0.14 116.57 118.36 1rff h LYS 336 Ca 0.00 -0.16 -0.06 0.00 -0.85 0.00 0.00 60.65 59.58 1rff h LYS 336 Cb 0.80 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.40 1rff h LYS 336 CO 0.00 0.66 -0.05 0.93 -3.45 0.00 0.00 179.45 177.54 1rff h GLU 337 N 0.35 0.57 -0.05 1.90 4.39 -1.64 -0.41 114.58 119.69 1rff h GLU 337 Ca 0.05 -0.15 -0.23 0.00 0.34 0.00 0.00 59.36 59.37 1rff h GLU 337 Cb 0.70 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.29 1rff h GLU 337 CO 0.05 0.63 -0.90 -1.49 -1.16 0.00 0.00 179.01 176.15 1rff h TRP 338 N 0.54 0.86 -0.45 4.33 4.06 -1.43 -1.91 115.95 121.95 1rff h TRP 338 Ca 0.11 -0.43 0.04 0.00 2.06 0.00 0.00 58.89 60.67 1rff h TRP 338 Cb 0.42 -0.11 -0.04 0.00 -1.00 0.00 0.00 29.16 28.43 1rff h TRP 338 CO 0.02 1.25 0.20 0.82 -3.56 0.00 0.00 178.44 177.17 1rff h ILE 339 N 0.37 0.93 -0.34 1.49 2.04 -0.51 -0.56 117.51 120.93 1rff h ILE 339 Ca -0.08 -0.14 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 1rff h ILE 339 Cb 1.53 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 38.08 1rff h ILE 339 CO 0.17 0.07 0.07 0.44 0.00 0.00 0.00 178.15 178.91 1rff h ASP 340 N 0.40 0.46 -0.21 1.72 3.45 -0.99 -0.99 116.42 120.27 1rff h ASP 340 Ca 0.20 -0.06 -0.04 0.00 0.43 0.00 0.00 57.03 57.56 1rff h ASP 340 Cb 0.14 -0.12 -0.01 0.00 -0.56 0.00 0.00 39.33 38.78 1rff h ASP 340 CO -0.16 0.47 -0.01 0.58 -1.57 0.00 0.00 179.24 178.56 1rff h VAL 341 N 0.49 1.26 -0.71 -1.35 2.07 -0.87 -2.91 116.25 114.24 1rff h VAL 341 Ca 0.12 -0.90 0.01 0.00 0.82 0.00 0.00 66.70 66.74 1rff h VAL 341 Cb 0.21 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 1rff h VAL 341 CO -0.00 0.28 0.46 0.40 0.02 0.00 0.00 177.57 178.73 1rff h ILE 342 N 0.14 1.18 -0.96 4.57 2.04 -0.57 -1.49 117.51 122.43 1rff h ILE 342 Ca 0.06 -0.35 0.23 0.00 1.00 0.00 0.00 64.86 65.81 1rff h ILE 342 Cb 0.41 0.15 -0.07 0.00 -0.74 0.00 0.00 36.82 36.57 1rff h ILE 342 CO 0.01 0.18 0.64 0.45 0.00 0.00 0.00 178.15 179.43 1rff h HIS 343 N 0.96 0.51 -0.00 1.37 3.86 -1.09 -1.10 115.15 119.66 1rff h HIS 343 Ca 0.26 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.48 1rff h HIS 343 Cb -0.10 -0.15 0.00 0.00 1.06 0.00 0.00 27.41 28.22 1rff h HIS 343 CO -0.02 0.10 -0.08 1.63 0.86 0.00 0.00 177.93 180.42 1rff n LYS 344 N -4.51 0.41 -4.25 2.45 5.02 -0.57 -4.88 118.16 111.84 1rff n LYS 344 Ca 0.21 -0.09 -0.23 0.00 -2.02 0.00 0.00 58.31 56.19 1rff n LYS 344 Cb 0.80 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.24 1rff n LYS 344 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1rff s HIS 345 N -2.65 2.80 -0.50 2.13 3.76 -0.42 -0.95 115.29 119.45 1rff s HIS 345 Ca 0.24 -0.19 -0.18 0.00 -0.15 0.00 0.00 55.06 54.79 1rff s HIS 345 Cb 0.20 -1.26 0.07 0.00 1.11 0.00 0.00 32.58 32.70 1rff s HIS 345 CO 0.50 0.59 0.54 0.34 -0.85 0.00 0.00 174.74 175.86 1rff s ASP 346 N -3.63 6.19 -0.18 1.40 -1.08 0.25 -4.69 116.67 114.93 1rff s ASP 346 Ca 0.31 -1.14 0.16 0.00 -0.52 0.00 0.00 52.55 51.36 1rff s ASP 346 Cb -0.07 -2.25 0.74 0.00 -1.46 0.00 0.00 42.92 39.88 1rff s ASP 346 CO 0.21 -0.82 1.65 0.18 0.52 0.00 0.00 175.17 176.91 1rff n LEU 347 N 5.80 5.08 0.25 -1.34 4.32 0.30 -4.05 117.00 127.36 1rff n LEU 347 Ca -0.09 -2.74 0.10 0.00 -0.02 0.00 0.00 56.01 53.25 1rff n LEU 347 Cb 0.44 -0.62 0.65 0.00 -1.62 0.00 0.00 43.42 42.27 1rff n LEU 347 CO 0.52 0.71 0.94 0.77 -1.22 0.00 0.00 177.39 179.11 1rff h SER 348 N 3.69 0.00 0.48 -1.43 4.64 -1.69 -2.33 113.55 116.92 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 1.69 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.78 1rff h SER 348 CO 0.35 0.15 0.00 -0.62 -0.87 0.00 0.00 176.83 175.84 1rff n GLU 349 N -3.84 0.11 -1.86 4.77 -0.58 -1.26 -4.35 120.64 113.62 1rff n GLU 349 Ca -0.02 0.17 -0.42 0.00 -0.42 0.00 0.00 57.16 56.47 1rff n GLU 349 Cb 0.25 -1.50 -0.03 0.00 -0.57 0.00 0.00 31.44 29.59 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 -2.82 2.62 -0.39 2.62 2.01 -0.87 -4.92 115.64 113.89 1rff s THR 350 Ca 0.12 0.32 0.10 0.00 0.31 0.00 0.00 61.69 62.54 1rff s THR 350 Cb 0.12 -3.21 0.27 0.00 0.01 0.00 0.00 72.50 69.69 1rff s THR 350 CO 0.30 0.01 1.21 -0.46 -0.69 0.00 0.00 174.62 174.99 1rff n ASN 351 N 4.70 2.80 -4.63 3.53 2.04 -1.26 -4.52 115.26 117.92 1rff n ASN 351 Ca 0.15 -2.39 -0.24 0.00 -0.44 0.00 0.00 54.58 51.66 1rff n ASN 351 Cb 0.38 -0.27 -0.08 0.00 -2.53 0.00 0.00 39.78 37.29 1rff n ASN 351 CO 0.00 0.00 0.00 0.68 -0.44 0.00 0.00 177.26 177.50 1rff s VAL 352 N -1.70 3.42 -0.14 3.53 -7.23 -1.26 -4.73 120.40 112.30 1rff s VAL 352 Ca 0.22 -1.87 -0.07 0.00 -1.81 0.00 0.00 61.98 58.45 1rff s VAL 352 Cb 0.16 -2.81 -0.04 0.00 0.56 0.00 0.00 36.38 34.25 1rff s VAL 352 CO 0.08 -0.33 0.13 -0.31 -0.31 0.00 0.00 175.10 174.35 1rff s TYR 353 N -2.23 3.53 -0.03 2.82 1.51 -0.55 -4.71 117.35 117.68 1rff s TYR 353 Ca 0.30 0.46 -0.28 0.00 -1.01 0.00 0.00 57.07 56.54 1rff s TYR 353 Cb -0.07 -1.98 -0.03 0.00 -0.11 0.00 0.00 41.96 39.77 1rff s TYR 353 CO 0.19 0.62 0.91 -1.17 -1.11 0.00 0.00 175.55 174.98 1rff s LEU 354 N -0.70 4.34 -0.21 -1.29 2.96 -1.26 -0.06 118.68 122.46 1rff s LEU 354 Ca 0.13 1.51 0.02 0.00 -0.22 0.00 0.00 54.13 55.57 1rff s LEU 354 Cb -0.12 -3.43 0.04 0.00 0.50 0.00 0.00 46.19 43.17 1rff s LEU 354 CO 0.03 -0.25 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.02 1rff s ILE 355 N 1.10 2.05 0.23 6.68 1.01 0.02 -4.94 121.20 127.34 1rff s ILE 355 Ca 0.47 -1.19 0.12 0.00 0.00 0.00 0.00 60.65 60.05 1rff s ILE 355 Cb -0.20 -1.99 -0.05 0.00 0.01 0.00 0.00 42.46 40.24 1rff s ILE 355 CO 0.24 0.30 -0.22 -0.83 0.00 0.00 0.00 174.94 174.43 1rff s GLY 356 N 1.24 1.79 0.02 6.18 0.00 -1.26 -0.38 107.32 114.90 1rff s GLY 356 Ca -0.01 -1.75 0.08 0.00 0.00 0.00 0.00 44.72 43.05 1rff s GLY 356 CO -0.10 -1.80 -0.24 -0.56 0.00 0.00 0.00 173.10 170.40 1rff s SER 357 N -3.05 2.87 0.05 1.64 0.01 -0.28 -0.99 113.70 113.96 1rff s SER 357 Ca 0.25 -0.51 0.01 0.00 1.31 0.00 0.00 55.95 57.02 1rff s SER 357 Cb -0.07 -0.28 -0.03 0.00 0.21 0.00 0.00 66.02 65.85 1rff s SER 357 CO 0.12 0.26 -0.06 0.42 0.41 0.00 0.00 173.24 174.39 1rff s THR 358 N -0.69 0.44 0.25 1.44 -4.23 -1.18 -1.94 115.64 109.73 1rff s THR 358 Ca 0.10 -1.33 -0.30 0.00 -1.18 0.00 0.00 61.69 58.98 1rff s THR 358 Cb -0.09 -0.89 -0.10 0.00 1.34 0.00 0.00 72.50 72.76 1rff s THR 358 CO 0.01 -0.60 1.39 -2.84 -0.54 0.00 0.00 174.62 172.04 1rff s PRO 359 N -2.36 4.31 0.00 3.99 0.02 -1.21 -4.66 135.00 135.08 1rff s PRO 359 Ca -0.04 2.24 0.00 0.00 0.02 0.00 0.00 61.00 63.22 1rff s PRO 359 Cb -0.04 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.36 1rff s PRO 359 CO -0.02 -0.35 0.00 0.41 -0.33 0.00 0.00 177.00 176.71 1rff n GLY 360 N 2.00 -2.60 3.07 0.52 0.00 -0.27 -4.97 105.19 102.93 1rff n GLY 360 Ca 0.05 -1.27 -0.32 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.98 2.59 -0.14 1.61 0.52 -1.26 -1.47 118.95 118.81 1rff s ARG 361 Ca 0.00 -0.81 -0.01 0.00 -0.52 0.00 0.00 55.73 54.39 1rff s ARG 361 Cb 0.00 -2.45 -0.02 0.00 0.52 0.00 0.00 34.95 33.00 1rff s ARG 361 CO 0.00 -0.28 -0.11 -0.06 0.02 0.00 0.00 175.30 174.87 1rff s PHE 362 N 1.34 2.86 0.10 -0.53 0.08 -0.17 -4.90 117.98 116.77 1rff s PHE 362 Ca 0.03 -0.62 0.10 0.00 0.12 0.00 0.00 56.93 56.56 1rff s PHE 362 Cb -0.14 -1.89 -0.04 0.00 -0.57 0.00 0.00 43.02 40.38 1rff s PHE 362 CO -0.11 -0.22 -0.25 -0.65 -0.10 0.00 0.00 175.22 173.90 1rff s GLN 363 N 0.47 1.60 7.00 0.44 -0.21 -1.26 -1.10 119.66 126.60 1rff s GLN 363 Ca -0.08 -1.24 0.00 0.00 0.02 0.00 0.00 55.36 54.06 1rff s GLN 363 Cb -0.15 -1.98 0.00 0.00 1.00 0.00 0.00 33.01 31.88 1rff s GLN 363 CO 0.04 0.48 0.00 0.41 -2.12 0.00 0.00 175.29 174.10 1rff n GLY 364 N 1.13 3.49 0.32 3.09 0.00 -1.25 -1.91 105.19 110.06 1rff n GLY 364 Ca -0.17 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 45.87 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 0.00 0.21 0.14 1.61 4.64 -1.98 -2.25 113.55 115.92 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 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1rff h SER 365 CO 0.00 0.13 -0.01 1.56 -0.87 0.00 0.00 176.83 177.65 1rff h GLN 366 N 0.24 0.00 -0.95 4.77 4.20 -1.75 -2.86 115.11 118.77 1rff h GLN 366 Ca 0.17 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.89 1rff h GLN 366 Cb 0.37 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.10 1rff h GLN 366 CO -0.03 0.01 0.63 0.87 -0.67 0.00 0.00 178.83 179.63 1rff h LYS 367 N 0.00 1.22 0.00 1.46 1.57 -1.53 -2.58 116.57 116.72 1rff h LYS 367 Ca -0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1rff h LYS 367 Cb 0.08 -0.28 0.00 0.00 0.08 0.00 0.00 32.23 32.11 1rff h LYS 367 CO 0.00 0.81 0.00 -0.25 -0.57 0.00 0.00 179.45 179.44 1rff n ASP 368 N -4.40 0.00 0.10 0.86 8.00 -1.08 -3.57 116.55 116.45 1rff n ASP 368 Ca 0.11 0.40 -0.04 0.00 0.71 0.00 0.00 54.79 55.97 1rff n ASP 368 Cb 0.04 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.70 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 0.00 0.00 -4.94 -2.24 -0.26 -1.66 -3.27 115.58 103.21 1rff h ASN 369 Ca 0.00 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.56 1rff h ASN 369 Cb 0.16 0.00 -0.16 0.00 -1.06 0.00 0.00 38.32 37.26 1rff h ASN 369 CO 0.00 0.81 -0.69 0.26 -1.06 0.00 0.00 177.43 176.74 1rff s TRP 370 N -3.04 0.63 0.00 1.19 0.52 -1.23 -4.69 118.94 112.32 1rff s TRP 370 Ca 0.01 -0.90 0.00 0.00 0.02 0.00 0.00 56.10 55.23 1rff s TRP 370 Cb 0.11 -0.41 0.00 0.00 -1.15 0.00 0.00 33.47 32.01 1rff s TRP 370 CO 0.79 -0.25 0.00 0.41 0.02 0.00 0.00 176.95 177.92 1rff n GLY 371 N 0.36 1.04 0.23 0.98 0.00 -0.16 -2.22 105.19 105.42 1rff n GLY 371 Ca -0.15 -0.64 0.10 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.02 1.61 2.07 -1.38 -1.91 115.15 115.52 1rff h HIS 372 Ca 0.00 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 57.42 1rff h HIS 372 Cb 0.00 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.97 1rff h HIS 372 CO 0.00 0.22 -0.47 0.74 -3.07 0.00 0.00 177.93 175.35 1rff h PHE 373 N 0.00 0.06 -0.26 6.12 -1.00 -1.81 -0.21 116.94 119.85 1rff h PHE 373 Ca -0.00 -0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.73 1rff h PHE 373 Cb 0.70 -0.01 -0.01 0.00 3.61 0.00 0.00 35.95 40.23 1rff h PHE 373 CO 0.00 0.51 0.06 -0.09 -1.61 0.00 0.00 178.31 177.18 1rff h ARG 374 N 0.04 0.42 -0.45 1.51 9.65 -0.87 -1.04 114.38 123.63 1rff h ARG 374 Ca -0.00 -0.10 0.01 0.00 -1.10 0.00 0.00 59.98 58.79 1rff h ARG 374 Cb 0.85 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.35 1rff h ARG 374 CO 0.06 0.52 0.28 1.25 2.80 0.00 0.00 179.97 184.89 1rff h LEU 375 N 0.25 0.47 -0.49 3.80 5.85 -1.26 -1.85 115.31 122.07 1rff h LEU 375 Ca 0.08 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1rff h LEU 375 Cb 0.30 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1rff h LEU 375 CO 0.00 0.34 0.26 0.50 -0.34 0.00 0.00 178.44 179.20 1rff h LYS 376 N 0.57 0.50 -0.81 1.25 3.64 -0.87 -1.04 116.57 119.81 1rff h LYS 376 Ca 0.17 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1rff h LYS 376 Cb -0.03 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.64 1rff h LYS 376 CO -0.06 0.33 0.54 -0.22 -2.27 0.00 0.00 179.45 177.76 1rff h LYS 377 N 0.51 1.06 -0.29 1.90 1.63 -0.96 -1.00 116.57 119.44 1rff h LYS 377 Ca 0.21 -0.06 -0.12 0.00 -0.85 0.00 0.00 60.65 59.82 1rff h LYS 377 Cb 0.10 -0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 31.47 1rff h LYS 377 CO -0.13 0.70 -0.33 -0.07 -3.45 0.00 0.00 179.45 176.17 1rff h LEU 378 N 1.09 0.64 -0.37 5.20 3.38 -0.72 -1.99 115.31 122.53 1rff h LEU 378 Ca 0.30 -0.25 -0.19 0.00 0.09 0.00 0.00 57.88 57.82 1rff h LEU 378 Cb -0.12 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 1rff h LEU 378 CO -0.07 0.92 -0.76 -0.07 0.09 0.00 0.00 178.44 178.55 1rff h LEU 379 N 0.52 0.48 -0.18 1.67 3.38 -0.93 -0.45 115.31 119.80 1rff h LEU 379 Ca 0.06 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1rff h LEU 379 Cb 0.82 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1rff h LEU 379 CO 0.07 1.07 0.08 0.50 0.09 0.00 0.00 178.44 180.25 1rff h LYS 380 N 0.27 0.27 0.00 1.13 3.64 -1.10 -1.80 116.57 118.98 1rff h LYS 380 Ca -0.04 -0.05 -0.20 0.00 -1.27 0.00 0.00 60.65 59.10 1rff h LYS 380 Cb 1.34 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 33.09 1rff h LYS 380 CO 0.13 0.34 -0.97 -0.44 -2.27 0.00 0.00 179.45 176.24 1rff h ASP 381 N 0.15 0.00 0.00 4.20 3.32 -1.24 -3.29 116.42 119.56 1rff h ASP 381 Ca 0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.11 1rff h ASP 381 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 1rff h ASP 381 CO -0.01 0.92 -0.03 1.41 -1.72 0.00 0.00 179.24 179.81 1rff n HIS 382 N -3.31 0.00 -4.38 4.55 8.25 -0.19 -5.02 115.22 115.13 1rff n HIS 382 Ca -0.01 -0.30 -0.25 0.00 -0.26 0.00 0.00 57.72 56.91 1rff n HIS 382 Cb 0.91 -0.04 -0.12 0.00 1.12 0.00 0.00 29.99 31.87 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 -0.65 2.28 0.09 -1.41 0.00 -1.09 -4.52 121.76 116.47 1rff s ALA 383 Ca 0.02 -1.56 0.06 0.00 0.00 0.00 0.00 51.96 50.49 1rff s ALA 383 Cb 0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1rff s ALA 383 CO 0.00 0.35 -0.09 -1.12 0.00 0.00 0.00 175.76 174.90 1rff s SER 384 N -2.62 4.45 0.47 0.00 0.01 -1.26 -1.88 113.70 112.87 1rff s SER 384 Ca 0.18 -0.35 -0.07 0.00 1.31 0.00 0.00 55.95 57.02 1rff s SER 384 Cb -0.07 -0.89 -0.04 0.00 0.21 0.00 0.00 66.02 65.23 1rff s SER 384 CO 0.08 0.19 0.80 -0.55 0.41 0.00 0.00 173.24 174.17 1rff s SER 385 N -2.11 6.33 0.11 2.44 0.15 -1.26 -4.64 113.70 114.72 1rff s SER 385 Ca 0.21 1.02 0.00 0.00 0.70 0.00 0.00 55.95 57.88 1rff s SER 385 Cb -0.11 -2.28 0.00 0.00 -1.71 0.00 0.00 66.02 61.92 1rff s SER 385 CO 0.13 -0.55 0.00 1.15 1.20 0.00 0.00 173.24 175.17 1rff n MET 386 N -2.02 0.00 0.00 5.44 0.00 -1.26 -5.05 117.12 114.23 1rff n MET 386 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.71 1rff n MET 386 Cb 0.55 -0.28 0.00 0.00 0.00 0.00 0.00 33.22 33.49 1rff n MET 386 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1rff n SER 391 N -3.23 0.00 -4.64 3.17 2.88 -1.26 -5.25 113.62 105.28 1rff n SER 391 Ca 0.00 0.00 -0.43 0.00 -1.33 0.00 0.00 58.87 57.11 1rff n SER 391 Cb 0.00 -0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 1rff n SER 391 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1rff s TRP 392 N -0.53 3.27 0.96 0.66 0.52 -1.26 -4.24 118.94 118.31 1rff s TRP 392 Ca 0.00 1.24 -0.12 0.00 0.02 0.00 0.00 56.10 57.25 1rff s TRP 392 Cb 0.00 -3.32 0.17 0.00 -1.15 0.00 0.00 33.47 29.17 1rff s TRP 392 CO 0.00 -0.55 1.09 -2.14 0.02 0.00 0.00 176.95 175.37 1rff s PRO 393 N 3.20 0.73 -0.09 4.98 0.02 -1.17 -4.71 135.00 137.96 1rff s PRO 393 Ca 0.41 0.76 0.02 0.00 0.02 0.00 0.00 61.00 62.20 1rff s PRO 393 Cb -0.14 -1.75 -0.02 0.00 0.02 0.00 0.00 34.50 32.61 1rff s PRO 393 CO 0.09 -2.58 -0.14 0.08 -0.33 0.00 0.00 177.00 174.12 1rff s VAL 394 N -2.88 2.99 -0.08 3.83 1.01 -0.59 -3.38 120.40 121.30 1rff s VAL 394 Ca 0.65 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.95 1rff s VAL 394 Cb -0.19 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 33.97 1rff s VAL 394 CO 0.58 0.56 -0.22 -0.69 0.00 0.00 0.00 175.10 175.33 1rff s VAL 395 N -0.15 2.30 -0.02 2.92 1.01 -0.13 -0.86 120.40 125.48 1rff s VAL 395 Ca -0.01 -0.96 0.04 0.00 0.00 0.00 0.00 61.98 61.06 1rff s VAL 395 Cb -0.14 -1.88 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 1rff s VAL 395 CO 0.03 0.56 -0.15 -0.83 0.00 0.00 0.00 175.10 174.71 1rff s GLY 396 N 0.05 0.75 -0.12 4.51 0.00 -0.08 -1.07 107.32 111.36 1rff s GLY 396 Ca -0.09 -0.64 -0.05 0.00 0.00 0.00 0.00 44.72 43.95 1rff s GLY 396 CO 0.06 -0.49 0.25 1.62 0.00 0.00 0.00 173.10 174.53 1rff s GLN 397 N -0.27 0.16 0.34 2.90 -0.44 0.01 -0.12 119.66 122.24 1rff s GLN 397 Ca 0.04 0.64 -0.17 0.00 -2.50 0.00 0.00 55.36 53.38 1rff s GLN 397 Cb -0.07 -0.09 0.04 0.00 -1.64 0.00 0.00 33.01 31.25 1rff s GLN 397 CO -0.00 -0.24 0.74 -0.59 0.50 0.00 0.00 175.29 175.70 1rff s PHE 398 N 1.94 0.08 0.00 1.67 -0.71 -1.16 -0.72 117.98 119.08 1rff s PHE 398 Ca -0.03 -0.66 0.00 0.00 -1.04 0.00 0.00 56.93 55.20 1rff s PHE 398 Cb -0.11 0.72 0.00 0.00 -1.21 0.00 0.00 43.02 42.42 1rff s PHE 398 CO -0.08 -1.42 0.23 -1.13 -1.34 0.00 0.00 175.22 171.47 1rff n SER 399 N -1.07 0.46 -4.01 1.98 3.41 -1.26 -4.67 113.62 108.46 1rff n SER 399 Ca -0.06 -0.88 -0.10 0.00 -0.26 0.00 0.00 58.87 57.56 1rff n SER 399 Cb 0.60 0.09 -0.11 0.00 -0.26 0.00 0.00 64.21 64.52 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 -0.09 0.44 -0.10 4.04 0.15 -1.26 -3.88 113.70 113.00 1rff s SER 400 Ca 0.00 -0.51 -0.01 0.00 0.70 0.00 0.00 55.95 56.13 1rff s SER 400 Cb 0.00 0.08 0.03 0.00 -1.71 0.00 0.00 66.02 64.42 1rff s SER 400 CO 0.00 -0.27 -0.04 -0.69 1.20 0.00 0.00 173.24 173.45 1rff s VAL 401 N -1.42 0.74 1.01 4.45 1.01 -1.26 -2.18 120.40 122.75 1rff s VAL 401 Ca -0.14 -0.16 -0.17 0.00 0.00 0.00 0.00 61.98 61.51 1rff s VAL 401 Cb -0.10 -0.86 0.23 0.00 0.00 0.00 0.00 36.38 35.66 1rff s VAL 401 CO -0.01 0.27 1.35 -0.83 0.00 0.00 0.00 175.10 175.89 1rff s GLY 402 N 1.82 1.82 -0.52 4.51 0.00 0.36 -4.84 107.32 110.47 1rff s GLY 402 Ca 0.04 -1.33 -0.29 0.00 0.00 0.00 0.00 44.72 43.15 1rff s GLY 402 CO -0.07 -0.49 1.16 -0.45 0.00 0.00 0.00 173.10 173.25 1rff s SER 403 N -4.94 6.56 0.00 1.64 0.15 -1.26 -4.91 113.70 110.93 1rff s SER 403 Ca 0.77 0.32 0.25 0.00 0.70 0.00 0.00 55.95 57.99 1rff s SER 403 Cb -0.02 -2.55 0.45 0.00 -1.71 0.00 0.00 66.02 62.18 1rff s SER 403 CO 0.54 -1.34 1.37 0.18 1.20 0.00 0.00 173.24 175.19 1rff n LEU 404 N 8.08 1.49 0.00 3.45 4.77 -1.26 -4.77 117.00 128.76 1rff n LEU 404 Ca 0.11 -0.49 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1rff n LEU 404 Cb 0.49 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1rff n LEU 404 CO 0.72 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.66 1rff n GLY 405 N 1.37 2.30 0.29 -0.72 0.00 -1.26 -4.24 105.19 102.93 1rff n GLY 405 Ca 0.11 -2.04 0.15 0.00 0.00 0.00 0.00 46.02 44.25 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 1.30 -2.89 4.61 0.00 -1.97 -3.44 119.26 116.87 1rff h ALA 406 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1rff h ALA 406 Cb 0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.70 1rff h ALA 406 CO 0.00 0.07 0.01 0.16 0.00 0.00 0.00 179.25 179.49 1rff s ASP 407 N -5.99 -0.16 0.62 0.00 -4.77 -1.26 -4.92 116.67 100.19 1rff s ASP 407 Ca -0.04 -0.78 0.33 0.00 -3.30 0.00 0.00 52.55 48.76 1rff s ASP 407 Cb 0.13 0.63 1.84 0.00 -1.09 0.00 0.00 42.92 44.44 1rff s ASP 407 CO 0.55 -1.20 2.13 1.05 0.70 0.00 0.00 175.17 178.40 1rff h GLU 408 N 2.17 0.00 -0.00 2.11 4.11 -1.92 -1.90 114.58 119.15 1rff h GLU 408 Ca -0.24 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.19 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 0.32 0.00 -0.14 -1.13 0.07 0.00 0.00 179.01 178.13 1rff n SER 409 N -3.44 0.22 0.10 3.06 3.41 -1.26 -0.40 113.62 115.30 1rff n SER 409 Ca -0.00 0.03 -0.03 0.00 -0.26 0.00 0.00 58.87 58.61 1rff n SER 409 Cb 0.27 -0.21 0.01 0.00 -0.26 0.00 0.00 64.21 64.02 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 0.12 0.00 0.00 4.33 1.79 -1.64 -3.39 116.57 117.78 1rff h LYS 410 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1rff h LYS 410 Cb 0.45 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 1rff h LYS 410 CO 0.00 0.78 0.00 1.87 -1.08 0.00 0.00 179.45 181.02 1rff n TRP 411 N -3.46 -2.52 0.24 -1.35 -0.00 -1.26 -4.83 117.44 104.25 1rff n TRP 411 Ca -0.00 0.13 -0.16 0.00 -0.00 0.00 0.00 57.50 57.48 1rff n TRP 411 Cb 0.79 0.79 -0.08 0.00 -0.00 0.00 0.00 31.31 32.82 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 -0.81 0.00 5.87 5.85 -1.80 -0.70 115.31 123.72 1rff h LEU 412 Ca 0.00 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1rff h LEU 412 Cb 0.00 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1rff h LEU 412 CO 0.00 -0.46 -0.68 0.00 -0.34 0.00 0.00 178.44 176.96 1rff n SER 414 N -1.73 0.00 0.08 0.00 3.41 -1.17 -4.34 113.62 109.87 1rff n SER 414 Ca 0.04 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.53 1rff n SER 414 Cb 0.38 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.20 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 0.15 0.16 4.33 4.11 -1.72 -2.90 114.58 118.71 1rff h GLU 415 Ca 0.00 -0.25 -0.01 0.00 0.07 0.00 0.00 59.36 59.17 1rff h GLU 415 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1rff h GLU 415 CO 0.00 1.11 -0.08 0.35 0.07 0.00 0.00 179.01 180.46 1rff h PHE 416 N 0.04 -0.20 -0.48 2.06 3.57 -1.22 -2.52 116.94 118.19 1rff h PHE 416 Ca -0.09 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.42 1rff h PHE 416 Cb 1.88 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 40.67 1rff h PHE 416 CO 0.03 0.14 0.32 -0.22 -2.23 0.00 0.00 178.31 176.36 1rff h LYS 417 N -0.97 0.61 -0.96 1.11 3.64 -0.67 -2.20 116.57 117.13 1rff h LYS 417 Ca -0.02 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1rff h LYS 417 Cb 0.43 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 1rff h LYS 417 CO 0.04 0.40 0.62 0.93 -2.27 0.00 0.00 179.45 179.17 1rff h GLU 418 N 0.63 1.27 -0.25 1.90 4.39 -1.53 -0.47 114.58 120.51 1rff h GLU 418 Ca 0.18 -0.09 -0.07 0.00 0.34 0.00 0.00 59.36 59.73 1rff h GLU 418 Cb -0.03 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 28.34 1rff h GLU 418 CO -0.04 0.85 -0.11 0.77 -1.16 0.00 0.00 179.01 179.33 1rff h SER 419 N 1.30 0.52 0.55 1.42 0.02 -0.97 -3.21 113.55 113.18 1rff h SER 419 Ca 0.35 -0.40 -0.04 0.00 -0.84 0.00 0.00 61.79 60.85 1rff h SER 419 Cb -0.12 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1rff h SER 419 CO -0.07 0.81 -0.21 0.24 -1.14 0.00 0.00 176.83 176.45 1rff h MET 420 N 0.23 0.00 -0.01 3.45 2.86 -0.77 -2.82 114.93 117.86 1rff h MET 420 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1rff h MET 420 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 1rff h MET 420 CO 0.03 0.21 -0.27 1.47 1.06 0.00 0.00 176.91 179.42 1rff n LEU 421 N -3.64 1.68 -4.69 1.22 -0.00 -0.26 -4.93 117.00 106.38 1rff n LEU 421 Ca -0.01 -0.56 -0.44 0.00 -0.00 0.00 0.00 56.01 55.00 1rff n LEU 421 Cb 0.34 -0.05 -0.02 0.00 -0.00 0.00 0.00 43.42 43.69 1rff n LEU 421 CO 0.33 0.30 1.08 0.41 -0.00 0.00 0.00 177.39 179.51 1rff n THR 422 N -0.08 0.95 -3.70 1.47 -1.04 -1.07 -5.02 114.28 105.80 1rff n THR 422 Ca 0.12 -0.24 -0.13 0.00 -2.04 0.00 0.00 64.05 61.77 1rff n THR 422 Cb 0.42 -1.61 -0.13 0.00 -1.82 0.00 0.00 70.33 67.20 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 -0.03 0.15 0.00 -4.42 1.43 -1.26 -4.70 118.68 109.86 1rff s LEU 423 Ca 0.67 0.56 0.00 0.00 -1.03 0.00 0.00 54.13 54.33 1rff s LEU 423 Cb -0.61 0.74 0.00 0.00 0.03 0.00 0.00 46.19 46.35 1rff s LEU 423 CO 0.49 -0.19 0.00 0.61 0.23 0.00 0.00 176.35 177.49 1rff n GLY 424 N 4.61 0.00 0.00 -3.19 0.00 -0.70 -4.32 105.19 101.60 1rff n GLY 424 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1rff n GLY 424 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1rff n VAL 435 N 0.00 0.00 -2.04 1.61 0.31 -1.26 -4.44 118.33 112.50 1rff n VAL 435 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 64.34 63.92 1rff n VAL 435 Cb 0.00 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 32.91 1rff n VAL 435 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 1rff s PRO 436 N -1.34 4.29 -0.20 5.55 0.02 -1.26 -4.91 135.00 137.16 1rff s PRO 436 Ca 0.00 2.29 -0.01 0.00 0.02 0.00 0.00 61.00 63.30 1rff s PRO 436 Cb 0.00 -3.08 0.01 0.00 0.02 0.00 0.00 34.50 31.46 1rff s PRO 436 CO 0.00 -0.32 -0.15 -1.17 -0.33 0.00 0.00 177.00 175.04 1rff s LEU 437 N -1.28 2.41 -0.21 -5.54 2.96 -1.26 -1.55 118.68 114.22 1rff s LEU 437 Ca 0.53 -0.59 -0.05 0.00 -0.22 0.00 0.00 54.13 53.80 1rff s LEU 437 Cb -0.41 -1.57 -0.02 0.00 0.50 0.00 0.00 46.19 44.69 1rff s LEU 437 CO 0.50 -0.01 0.01 -0.31 -1.32 0.00 0.00 176.35 175.22 1rff s TYR 438 N 1.35 3.04 -0.15 5.38 1.51 -0.04 -4.93 117.35 123.52 1rff s TYR 438 Ca 0.05 -0.49 -0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1rff s TYR 438 Cb -0.14 -2.11 -0.02 0.00 -0.11 0.00 0.00 41.96 39.58 1rff s TYR 438 CO -0.10 -0.29 -0.06 -0.51 -1.11 0.00 0.00 175.55 173.48 1rff s LEU 439 N 1.15 3.11 -0.23 -1.29 1.43 -0.71 -0.91 118.68 121.24 1rff s LEU 439 Ca 0.03 -0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 1rff s LEU 439 Cb -0.14 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.33 1rff s LEU 439 CO 0.02 0.17 -0.02 -0.63 0.23 0.00 0.00 176.35 176.12 1rff s ILE 440 N 0.35 3.61 -0.19 -0.59 1.01 0.83 0.43 121.20 126.65 1rff s ILE 440 Ca -0.06 -0.41 -0.10 0.00 0.00 0.00 0.00 60.65 60.08 1rff s ILE 440 Cb -0.15 -2.66 0.07 0.00 0.01 0.00 0.00 42.46 39.74 1rff s ILE 440 CO 0.04 0.40 0.46 -0.47 0.00 0.00 0.00 174.94 175.38 1rff s TYR 441 N 1.48 -0.72 0.18 3.97 6.14 -0.72 -2.97 117.35 124.71 1rff s TYR 441 Ca 0.06 1.48 -0.33 0.00 0.64 0.00 0.00 57.07 58.92 1rff s TYR 441 Cb -0.14 0.35 -0.14 0.00 0.42 0.00 0.00 41.96 42.44 1rff s TYR 441 CO -0.01 -0.40 1.41 -2.30 0.64 0.00 0.00 175.55 174.89 1rff n PRO 442 N 4.41 1.80 -1.65 4.97 -0.02 -1.26 -4.44 135.00 138.81 1rff n PRO 442 Ca -0.21 0.64 -0.29 0.00 -2.02 0.00 0.00 63.50 61.62 1rff n PRO 442 Cb 0.55 -2.31 0.13 0.00 -0.02 0.00 0.00 33.50 31.86 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 0.47 3.58 0.20 2.55 1.04 -1.26 -1.24 113.70 119.04 1rff s SER 443 Ca 0.75 0.82 -0.10 0.00 0.48 0.00 0.00 55.95 57.90 1rff s SER 443 Cb -0.74 -1.30 0.14 0.00 0.10 0.00 0.00 66.02 64.22 1rff s SER 443 CO 0.46 -2.49 1.80 0.58 0.98 0.00 0.00 173.24 174.57 1rff h VAL 444 N -1.46 1.23 -0.70 5.02 2.07 -1.38 -2.51 116.25 118.52 1rff h VAL 444 Ca -0.48 -0.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.38 1rff h VAL 444 Cb 1.32 0.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.35 1rff h VAL 444 CO 0.59 0.27 0.34 -0.33 0.02 0.00 0.00 177.57 178.46 1rff h GLU 445 N 1.03 0.99 -0.29 1.57 4.39 -1.94 0.22 114.58 120.56 1rff h GLU 445 Ca 0.26 -0.13 0.03 0.00 0.34 0.00 0.00 59.36 59.85 1rff h GLU 445 Cb 0.09 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.52 1rff h GLU 445 CO -0.04 0.77 0.11 -0.91 -1.16 0.00 0.00 179.01 177.78 1rff h ASN 446 N 0.99 0.14 -0.04 1.42 -0.26 -1.83 -2.16 115.58 113.83 1rff h ASN 446 Ca 0.24 0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 56.00 1rff h ASN 446 Cb 0.10 0.01 -0.00 0.00 -1.06 0.00 0.00 38.32 37.36 1rff h ASN 446 CO -0.03 0.11 -0.01 0.58 -1.06 0.00 0.00 177.43 177.03 1rff h VAL 447 N 0.24 1.27 -0.84 2.81 2.07 -1.12 -2.85 116.25 117.84 1rff h VAL 447 Ca 0.12 -0.84 0.15 0.00 0.82 0.00 0.00 66.70 66.95 1rff h VAL 447 Cb 0.08 1.76 -0.09 0.00 -1.52 0.00 0.00 31.29 31.51 1rff h VAL 447 CO -0.12 0.23 0.42 -0.09 0.02 0.00 0.00 177.57 178.03 1rff h ARG 448 N -0.25 0.58 -0.57 1.57 2.43 -0.47 -1.78 114.38 115.89 1rff h ARG 448 Ca 0.01 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1rff h ARG 448 Cb 0.37 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 1rff h ARG 448 CO 0.00 0.38 0.02 0.25 -1.51 0.00 0.00 179.97 179.11 1rff n THR 449 N -4.89 2.77 -1.64 0.20 -2.24 -0.82 -2.07 114.28 105.59 1rff n THR 449 Ca 0.17 -1.45 -0.30 0.00 -2.27 0.00 0.00 64.05 60.20 1rff n THR 449 Cb 0.44 -0.28 0.18 0.00 -2.10 0.00 0.00 70.33 68.57 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 -0.86 2.72 0.29 3.42 1.04 -0.67 -4.90 113.70 114.74 1rff s SER 450 Ca 0.54 0.52 -0.02 0.00 0.48 0.00 0.00 55.95 57.48 1rff s SER 450 Cb 0.42 -0.75 0.42 0.00 0.10 0.00 0.00 66.02 66.21 1rff s SER 450 CO 0.15 -3.00 1.88 -0.07 0.98 0.00 0.00 173.24 173.19 1rff h LEU 451 N -1.82 0.85 0.00 2.42 3.38 -0.99 -2.81 115.31 116.34 1rff h LEU 451 Ca -0.46 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.34 1rff h LEU 451 Cb 1.27 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1rff h LEU 451 CO 0.43 0.73 -0.95 -0.33 0.09 0.00 0.00 178.44 178.42 1rff h GLU 452 N 0.93 0.00 0.00 1.13 5.08 -1.88 -3.48 114.58 116.36 1rff h GLU 452 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1rff h GLU 452 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1rff h GLU 452 CO -0.03 0.18 0.00 0.41 -1.00 0.00 0.00 179.01 178.57 1rff n GLY 453 N 1.25 -0.43 0.38 -3.84 0.00 -1.06 -4.13 105.19 97.36 1rff n GLY 453 Ca -0.03 -1.08 0.15 0.00 0.00 0.00 0.00 46.02 45.06 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 0.79 0.00 1.61 0.05 -1.79 -0.96 116.97 116.68 1rff h TYR 454 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 1rff h TYR 454 Cb 0.00 -0.24 0.00 0.00 1.01 0.00 0.00 36.73 37.50 1rff h TYR 454 CO 0.00 0.23 0.00 -1.35 -1.05 0.00 0.00 178.16 175.99 1rff h PRO 455 N 0.62 0.00 -0.45 4.88 0.11 -1.92 0.27 132.00 135.50 1rff h PRO 455 Ca 0.49 0.00 0.13 0.00 0.11 0.00 0.00 66.00 66.73 1rff h PRO 455 Cb 0.93 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.02 1rff h PRO 455 CO -0.24 0.00 0.34 0.00 -0.21 0.00 0.00 178.00 177.89 1rff h ALA 456 N 2.01 2.37 0.00 -0.75 0.00 -1.39 -0.76 119.26 120.74 1rff h ALA 456 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1rff h ALA 456 Cb 0.02 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1rff h ALA 456 CO 0.00 -0.57 0.00 0.78 0.00 0.00 0.00 179.25 179.46 1rff h GLY 457 N 0.00 0.00 2.00 0.00 0.00 -0.64 -2.08 103.07 102.35 1rff h GLY 457 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1rff h GLY 457 CO -0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1rff n GLY 458 N -0.49 -0.97 0.31 4.60 0.00 -0.29 -2.09 105.19 106.26 1rff n GLY 458 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.97 2.43 -3.53 1.61 7.64 -0.78 -4.73 113.62 114.29 1rff n SER 459 Ca 0.01 -1.99 -0.27 0.00 1.01 0.00 0.00 58.87 57.63 1rff n SER 459 Cb 0.12 -0.11 -0.09 0.00 -1.01 0.00 0.00 64.21 63.12 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 -0.00 2.81 -1.96 -3.43 4.77 -0.89 -4.84 117.00 113.46 1rff n LEU 460 Ca 0.06 -5.21 -0.14 0.00 -0.03 0.00 0.00 56.01 50.68 1rff n LEU 460 Cb 0.33 -0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 40.94 1rff n LEU 460 CO 0.04 1.96 1.34 -0.81 -1.33 0.00 0.00 177.39 178.58 1rff n PRO 461 N 1.37 1.79 -2.46 3.23 -0.04 -1.25 -4.17 135.00 133.48 1rff n PRO 461 Ca 0.26 -1.25 -0.43 0.00 -0.04 0.00 0.00 63.50 62.04 1rff n PRO 461 Cb 0.41 -1.67 -0.02 0.00 -0.04 0.00 0.00 33.50 32.18 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 -0.77 2.98 0.10 0.54 5.04 -1.26 -4.86 117.35 119.12 1rff s TYR 462 Ca 0.38 1.10 -0.02 0.00 -2.44 0.00 0.00 57.07 56.09 1rff s TYR 462 Cb 0.23 -3.46 -0.05 0.00 0.35 0.00 0.00 41.96 39.04 1rff s TYR 462 CO -0.05 -1.48 0.28 -1.54 -1.34 0.00 0.00 175.55 171.41 1rff s SER 463 N 1.78 6.41 0.43 4.32 1.04 -1.26 -0.96 113.70 125.46 1rff s SER 463 Ca 0.54 0.39 0.09 0.00 0.48 0.00 0.00 55.95 57.45 1rff s SER 463 Cb -0.22 -2.01 0.94 0.00 0.10 0.00 0.00 66.02 64.83 1rff s SER 463 CO 0.16 0.12 2.06 -0.29 0.98 0.00 0.00 173.24 176.26 1rff h ILE 464 N 2.04 1.09 -0.91 -1.02 6.09 -1.93 0.32 117.51 123.20 1rff h ILE 464 Ca -0.45 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 62.81 1rff h ILE 464 Cb 1.16 0.71 -0.04 0.00 0.47 0.00 0.00 36.82 39.12 1rff h ILE 464 CO 0.74 0.10 0.58 1.56 -3.07 0.00 0.00 178.15 178.06 1rff h GLN 465 N 0.39 1.22 0.01 2.19 7.50 -1.99 -0.33 115.11 124.10 1rff h GLN 465 Ca 0.10 -0.09 -0.00 0.00 0.50 0.00 0.00 58.65 59.16 1rff h GLN 465 Cb 0.01 -0.27 0.00 0.00 0.05 0.00 0.00 27.48 27.28 1rff h GLN 465 CO -0.02 0.83 -0.00 1.15 -1.50 0.00 0.00 178.83 179.29 1rff h THR 466 N 1.24 1.56 -0.86 -0.54 2.02 -1.76 -3.36 112.91 111.21 1rff h THR 466 Ca 0.33 -1.71 0.05 0.00 0.77 0.00 0.00 66.41 65.85 1rff h THR 466 Cb -0.10 2.72 -0.05 0.00 -1.74 0.00 0.00 68.15 68.97 1rff h THR 466 CO -0.07 0.44 0.56 0.00 0.37 0.00 0.00 175.52 176.83 1rff h ALA 467 N 0.24 1.51 0.00 6.16 0.00 -0.80 -2.15 119.26 124.22 1rff h ALA 467 Ca -0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rff h ALA 467 Cb 0.73 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1rff h ALA 467 CO 0.00 0.38 0.00 1.05 0.00 0.00 0.00 179.25 180.68 1rff h GLU 468 N 1.02 0.00 0.00 0.00 4.11 -1.20 -2.51 114.58 116.00 1rff h GLU 468 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.79 1rff h GLU 468 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 1rff h GLU 468 CO -0.12 0.00 -0.04 0.87 0.07 0.00 0.00 179.01 179.79 1rff h LYS 469 N 0.00 0.00 -0.66 1.06 1.57 -1.52 -3.39 116.57 113.63 1rff h LYS 469 Ca 0.00 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.47 1rff h LYS 469 Cb 0.48 0.00 -0.32 0.00 0.08 0.00 0.00 32.23 32.47 1rff h LYS 469 CO 0.00 0.00 -0.92 0.00 -0.57 0.00 0.00 179.45 177.96 1rff n GLN 470 N -2.35 1.19 0.30 3.15 10.64 -0.95 -4.64 117.38 124.72 1rff n GLN 470 Ca 0.05 -2.79 0.19 0.00 -1.83 0.00 0.00 57.00 52.62 1rff n GLN 470 Cb 0.44 -0.86 1.02 0.00 -0.86 0.00 0.00 30.24 29.98 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 2.65 0.00 -0.42 2.61 4.21 -1.75 -1.62 115.58 121.26 1rff h ASN 471 Ca -0.16 0.00 0.02 0.00 1.21 0.00 0.00 56.30 57.36 1rff h ASN 471 Cb 1.22 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.40 1rff h ASN 471 CO 0.30 0.00 0.28 4.11 -1.29 0.00 0.00 177.43 180.83 1rff h TRP 472 N 0.00 0.49 -0.49 1.19 5.08 -1.91 -2.44 115.95 117.87 1rff h TRP 472 Ca 0.02 0.01 0.07 0.00 1.08 0.00 0.00 58.89 60.06 1rff h TRP 472 Cb 0.14 -0.16 -0.03 0.00 -3.00 0.00 0.00 29.16 26.11 1rff h TRP 472 CO 0.00 0.30 0.33 1.25 -1.28 0.00 0.00 178.44 179.04 1rff h LEU 473 N 0.52 0.34 -0.32 0.11 5.85 -1.69 -2.98 115.31 117.13 1rff h LEU 473 Ca 0.16 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1rff h LEU 473 Cb 0.01 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.97 1rff h LEU 473 CO -0.04 0.22 0.00 1.41 -0.34 0.00 0.00 178.44 179.69 1rff n HIS 474 N -4.47 0.48 0.29 1.25 8.25 -0.92 -1.55 115.22 118.55 1rff n HIS 474 Ca 0.07 0.18 0.17 0.00 -0.26 0.00 0.00 57.72 57.88 1rff n HIS 474 Cb 0.27 -0.79 0.70 0.00 1.12 0.00 0.00 29.99 31.30 1rff n HIS 474 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 1rff h SER 475 N 0.00 0.00 0.14 0.41 0.02 -1.70 -2.63 113.55 109.78 1rff h SER 475 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1rff h SER 475 Cb 0.38 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1rff h SER 475 CO 0.00 0.00 -0.18 -1.22 -1.14 0.00 0.00 176.83 174.29 1rff n TYR 476 N -3.00 0.00 -2.72 3.45 4.01 -0.60 -4.97 117.16 113.34 1rff n TYR 476 Ca 0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.33 1rff n TYR 476 Cb 0.28 -0.07 -0.04 0.00 -0.31 0.00 0.00 39.34 39.19 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 -2.32 3.81 0.10 -0.72 2.99 -0.99 -1.73 117.98 119.10 1rff s PHE 477 Ca 0.29 1.80 0.08 0.00 0.00 0.00 0.00 56.93 59.10 1rff s PHE 477 Cb 0.20 -3.06 -0.03 0.00 0.00 0.00 0.00 43.02 40.12 1rff s PHE 477 CO 0.46 0.18 -0.22 -1.01 -0.00 0.00 0.00 175.22 174.63 1rff s HIS 478 N -0.06 1.88 0.67 0.36 3.76 0.17 -2.47 115.29 119.59 1rff s HIS 478 Ca 0.47 -0.41 -0.17 0.00 -0.15 0.00 0.00 55.06 54.80 1rff s HIS 478 Cb -0.24 -1.04 0.00 0.00 1.11 0.00 0.00 32.58 32.41 1rff s HIS 478 CO 0.30 0.20 1.22 0.15 -0.85 0.00 0.00 174.74 175.77 1rff s LYS 479 N -1.79 2.50 -0.08 1.40 1.02 0.05 -1.76 119.74 121.08 1rff s LYS 479 Ca 0.08 1.84 -0.30 0.00 0.02 0.00 0.00 55.97 57.61 1rff s LYS 479 Cb -0.10 -1.87 -0.02 0.00 -0.52 0.00 0.00 37.83 35.32 1rff s LYS 479 CO 0.04 -1.57 1.12 -0.46 -0.92 0.00 0.00 175.35 173.56 1rff s TRP 480 N -1.74 3.31 -0.12 3.18 -0.11 -1.26 -4.54 118.94 117.66 1rff s TRP 480 Ca 0.77 1.36 -0.05 0.00 1.22 0.00 0.00 56.10 59.40 1rff s TRP 480 Cb -0.31 -3.33 0.05 0.00 -1.50 0.00 0.00 33.47 28.38 1rff s TRP 480 CO 0.40 -0.89 0.26 0.45 -4.62 0.00 0.00 176.95 172.56 1rff s SER 481 N 1.34 -0.13 -0.33 5.86 0.15 -1.26 -4.97 113.70 114.37 1rff s SER 481 Ca 0.52 0.57 0.17 0.00 0.70 0.00 0.00 55.95 57.91 1rff s SER 481 Cb -0.22 0.50 0.45 0.00 -1.71 0.00 0.00 66.02 65.05 1rff s SER 481 CO 0.20 -0.19 1.07 0.00 1.20 0.00 0.00 173.24 175.52 1rff n ALA 482 N 4.51 2.87 -0.13 5.45 0.00 -1.26 -1.15 120.51 130.81 1rff n ALA 482 Ca -0.21 -2.65 0.01 0.00 0.00 0.00 0.00 53.44 50.60 1rff n ALA 482 Cb 0.52 -0.94 0.29 0.00 0.00 0.00 0.00 19.45 19.33 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 2.68 0.80 -0.92 0.00 4.39 -1.92 0.57 114.58 120.18 1rff h GLU 483 Ca -0.15 -0.07 0.22 0.00 0.34 0.00 0.00 59.36 59.69 1rff h GLU 483 Cb 1.22 -0.17 -0.07 0.00 -0.10 0.00 0.00 28.75 29.64 1rff h GLU 483 CO 0.32 0.58 0.61 0.00 -1.16 0.00 0.00 179.01 179.36 1rff h THR 484 N 0.82 0.64 -0.11 1.13 1.03 -1.88 -1.79 112.91 112.75 1rff h THR 484 Ca 0.21 -0.12 0.00 0.00 -0.01 0.00 0.00 66.41 66.49 1rff h THR 484 Cb -0.01 0.26 0.00 0.00 -1.07 0.00 0.00 68.15 67.33 1rff h THR 484 CO -0.04 0.06 0.00 -1.54 -0.01 0.00 0.00 175.52 174.00 1rff n SER 485 N -4.49 2.45 -1.34 0.00 3.41 -0.57 -2.37 113.62 110.70 1rff n SER 485 Ca 0.20 -2.28 -0.13 0.00 -0.26 0.00 0.00 58.87 56.39 1rff n SER 485 Cb 0.76 -0.18 -0.02 0.00 -0.26 0.00 0.00 64.21 64.51 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 -0.43 0.32 0.21 5.00 0.00 -0.17 -4.91 105.19 105.23 1rff n GLY 486 Ca 0.08 -0.36 0.09 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.38 1.23 0.28 1.61 1.74 0.01 -4.70 116.66 114.46 1rff n ARG 487 Ca -0.15 -2.59 0.12 0.00 -0.77 0.00 0.00 57.85 54.46 1rff n ARG 487 Cb 0.56 -1.43 0.81 0.00 -1.02 0.00 0.00 32.46 31.38 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 0.19 0.00 -0.48 0.55 0.02 -1.91 -1.37 113.55 110.56 1rff h SER 488 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1rff h SER 488 Cb 1.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.58 1rff h SER 488 CO 0.00 0.01 0.00 0.59 -1.14 0.00 0.00 176.83 176.29 1rff n ASN 489 N -4.08 3.61 -4.25 3.07 3.02 -1.26 -4.77 115.26 110.60 1rff n ASN 489 Ca -0.03 -2.00 -0.41 0.00 -0.03 0.00 0.00 54.58 52.12 1rff n ASN 489 Cb 0.09 -0.31 -0.09 0.00 -0.61 0.00 0.00 39.78 38.86 1rff n ASN 489 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rff s ALA 490 N -1.37 3.36 0.40 5.41 0.00 -0.52 -0.31 121.76 128.74 1rff s ALA 490 Ca 0.41 -2.34 -0.26 0.00 0.00 0.00 0.00 51.96 49.77 1rff s ALA 490 Cb 0.24 -2.76 -0.09 0.00 0.00 0.00 0.00 23.12 20.50 1rff s ALA 490 CO 0.32 -1.78 1.35 -1.64 0.00 0.00 0.00 175.76 174.01 1rff s MET 491 N 1.40 3.97 0.08 0.00 -1.94 -1.24 -3.43 119.30 118.14 1rff s MET 491 Ca 0.04 2.28 -0.31 0.00 -1.71 0.00 0.00 55.69 55.99 1rff s MET 491 Cb -0.25 -2.80 -0.06 0.00 2.01 0.00 0.00 34.83 33.73 1rff s MET 491 CO 0.01 -0.54 1.20 -1.25 -0.01 0.00 0.00 175.02 174.44 1rff s PRO 492 N -2.22 4.44 0.00 2.03 0.04 -1.26 -0.70 135.00 137.33 1rff s PRO 492 Ca 0.56 1.79 0.01 0.00 0.04 0.00 0.00 61.00 63.41 1rff s PRO 492 Cb -0.41 -3.33 -0.01 0.00 0.04 0.00 0.00 34.50 30.80 1rff s PRO 492 CO 0.53 -0.23 0.18 1.58 0.04 0.00 0.00 177.00 179.10 1rff n HIS 493 N 3.70 0.00 -1.54 0.56 -0.00 0.42 -4.75 115.22 113.61 1rff n HIS 493 Ca 0.08 0.00 -0.35 0.00 0.46 0.00 0.00 57.72 57.91 1rff n HIS 493 Cb 0.46 0.00 0.09 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 -0.90 2.14 -0.06 3.57 2.07 -0.24 -4.83 121.20 122.96 1rff s ILE 494 Ca 0.01 0.08 0.03 0.00 -1.41 0.00 0.00 60.65 59.35 1rff s ILE 494 Cb 0.01 -2.82 0.01 0.00 0.13 0.00 0.00 42.46 39.79 1rff s ILE 494 CO 0.05 -0.03 -0.14 -0.54 -1.91 0.00 0.00 174.94 172.37 1rff s LYS 495 N -3.67 1.73 0.00 3.50 3.01 -1.25 -4.39 119.74 118.66 1rff s LYS 495 Ca 0.78 -0.47 -0.06 0.00 -1.01 0.00 0.00 55.97 55.21 1rff s LYS 495 Cb -0.33 -1.44 -0.00 0.00 -1.01 0.00 0.00 37.83 35.05 1rff s LYS 495 CO 0.43 0.09 0.11 0.95 0.51 0.00 0.00 175.35 177.45 1rff s THR 496 N 0.46 0.08 0.00 2.17 -4.23 0.10 -2.03 115.64 112.19 1rff s THR 496 Ca -0.11 -0.66 0.01 0.00 -1.18 0.00 0.00 61.69 59.75 1rff s THR 496 Cb -0.14 -0.39 -0.01 0.00 1.34 0.00 0.00 72.50 73.30 1rff s THR 496 CO 0.03 -0.36 -0.04 -0.31 -0.54 0.00 0.00 174.62 173.40 1rff s TYR 497 N -1.26 0.35 0.29 3.99 2.02 -0.66 -0.81 117.35 121.26 1rff s TYR 497 Ca -0.14 -0.14 -0.20 0.00 -0.37 0.00 0.00 57.07 56.22 1rff s TYR 497 Cb -0.07 -0.22 0.04 0.00 -0.40 0.00 0.00 41.96 41.31 1rff s TYR 497 CO 0.01 -0.03 0.80 0.00 -1.57 0.00 0.00 175.55 174.76 1rff s MET 498 N -0.36 1.82 -0.47 -0.62 0.23 -0.23 -0.72 119.30 118.96 1rff s MET 498 Ca -0.01 -1.08 0.03 0.00 -1.03 0.00 0.00 55.69 53.60 1rff s MET 498 Cb -0.03 0.57 0.15 0.00 -1.53 0.00 0.00 34.83 34.00 1rff s MET 498 CO -0.00 -0.84 0.32 0.50 -2.03 0.00 0.00 175.02 172.96 1rff s ARG 499 N -3.19 1.28 0.58 3.16 6.06 -1.12 -0.96 118.95 124.76 1rff s ARG 499 Ca 0.13 -2.20 -0.13 0.00 -2.50 0.00 0.00 55.73 51.03 1rff s ARG 499 Cb -0.05 -2.09 -0.05 0.00 0.06 0.00 0.00 34.95 32.81 1rff s ARG 499 CO 0.08 -1.27 1.01 -2.14 -2.50 0.00 0.00 175.30 170.48 1rff s PRO 500 N 0.01 3.73 0.99 5.12 0.02 -1.22 -0.68 135.00 142.98 1rff s PRO 500 Ca 0.24 0.82 -0.12 0.00 0.02 0.00 0.00 61.00 61.96 1rff s PRO 500 Cb -0.11 -2.11 0.18 0.00 0.02 0.00 0.00 34.50 32.49 1rff s PRO 500 CO -0.09 -0.45 1.08 -1.54 -0.33 0.00 0.00 177.00 175.67 1rff s SER 501 N -3.75 2.62 0.54 2.53 1.04 -0.40 -3.06 113.70 113.22 1rff s SER 501 Ca 0.56 1.42 0.23 0.00 0.48 0.00 0.00 55.95 58.64 1rff s SER 501 Cb -0.11 -2.10 1.40 0.00 0.10 0.00 0.00 66.02 65.32 1rff s SER 501 CO 0.45 -3.16 2.07 -0.65 0.98 0.00 0.00 173.24 172.93 1rff h PRO 502 N -1.91 0.00 -0.54 4.02 0.11 -1.92 -0.16 132.00 131.59 1rff h PRO 502 Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 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 0.54 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.93 1rff n ASP 503 N -4.33 3.46 -1.18 -2.05 5.75 -1.26 -4.96 116.55 111.97 1rff n ASP 503 Ca 0.04 -1.98 -0.15 0.00 -0.01 0.00 0.00 54.79 52.68 1rff n ASP 503 Cb 0.38 -0.36 -0.07 0.00 -1.03 0.00 0.00 41.12 40.04 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 1.43 0.00 0.46 2.11 3.01 -0.07 -4.85 117.46 119.54 1rff n PHE 504 Ca 0.21 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.79 1rff n PHE 504 Cb 0.57 -2.95 0.07 0.00 -0.01 0.00 0.00 39.48 37.16 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 -1.03 0.67 -4.05 4.37 3.41 -1.26 -4.83 113.62 110.89 1rff n SER 505 Ca -0.15 0.02 -0.13 0.00 -0.26 0.00 0.00 58.87 58.34 1rff n SER 505 Cb 0.59 0.54 -0.09 0.00 -0.26 0.00 0.00 64.21 64.98 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 -3.23 1.31 0.04 4.33 -2.85 -1.26 -1.44 119.74 116.63 1rff s LYS 506 Ca 0.03 -1.67 0.02 0.00 -1.00 0.00 0.00 55.97 53.35 1rff s LYS 506 Cb 0.13 0.29 -0.02 0.00 -2.06 0.00 0.00 37.83 36.17 1rff s LYS 506 CO 0.77 -0.44 -0.07 0.96 0.10 0.00 0.00 175.35 176.66 1rff s ILE 507 N -4.03 0.52 -0.29 3.79 -4.36 0.22 -1.28 121.20 115.76 1rff s ILE 507 Ca 0.38 -1.09 0.21 0.00 -0.26 0.00 0.00 60.65 59.90 1rff s ILE 507 Cb 0.06 -0.61 0.13 0.00 1.25 0.00 0.00 42.46 43.29 1rff s ILE 507 CO 0.14 -0.40 1.30 0.00 0.24 0.00 0.00 174.94 176.23 1rff h ALA 508 N 4.48 0.74 -1.35 2.27 0.00 -1.21 -1.27 119.26 122.91 1rff h ALA 508 Ca -0.36 -0.17 0.30 0.00 0.00 0.00 0.00 54.91 54.69 1rff h ALA 508 Cb 1.20 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.84 1rff h ALA 508 CO 0.41 0.20 0.86 1.67 0.00 0.00 0.00 179.25 182.40 1rff s TRP 509 N -3.19 -0.07 -0.04 0.00 1.48 -1.26 -4.33 118.94 111.53 1rff s TRP 509 Ca 0.03 0.02 -0.06 0.00 -1.06 0.00 0.00 56.10 55.03 1rff s TRP 509 Cb 0.07 0.52 0.01 0.00 -1.16 0.00 0.00 33.47 32.91 1rff s TRP 509 CO 0.74 -0.17 0.16 0.12 -4.06 0.00 0.00 176.95 173.73 1rff s PHE 510 N -2.31 -0.12 -0.08 1.66 5.36 -0.91 -2.77 117.98 118.81 1rff s PHE 510 Ca 0.12 0.28 0.01 0.00 -0.96 0.00 0.00 56.93 56.37 1rff s PHE 510 Cb 0.01 0.03 0.02 0.00 -0.34 0.00 0.00 43.02 42.74 1rff s PHE 510 CO -0.04 -0.14 -0.09 -1.17 -1.46 0.00 0.00 175.22 172.32 1rff s LEU 511 N -0.32 1.39 -0.12 6.12 2.96 0.11 -0.41 118.68 128.41 1rff s LEU 511 Ca -0.04 -0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1rff s LEU 511 Cb -0.03 -0.76 -0.03 0.00 0.50 0.00 0.00 46.19 45.87 1rff s LEU 511 CO 0.01 -0.04 -0.07 0.54 -1.32 0.00 0.00 176.35 175.46 1rff s VAL 512 N 1.13 3.63 0.21 1.68 0.11 -0.94 -1.66 120.40 124.57 1rff s VAL 512 Ca -0.06 -0.47 -0.16 0.00 -2.93 0.00 0.00 61.98 58.35 1rff s VAL 512 Cb -0.14 -2.53 0.02 0.00 -1.53 0.00 0.00 36.38 32.19 1rff s VAL 512 CO -0.02 0.54 0.52 0.28 -3.33 0.00 0.00 175.10 173.09 1rff s THR 513 N -0.08 0.02 -0.91 5.04 -1.32 -0.86 -0.85 115.64 116.68 1rff s THR 513 Ca 0.01 -0.99 0.27 0.00 -1.21 0.00 0.00 61.69 59.77 1rff s THR 513 Cb -0.13 -1.78 0.20 0.00 -1.51 0.00 0.00 72.50 69.28 1rff s THR 513 CO 0.03 -0.09 1.77 -1.54 -2.21 0.00 0.00 174.62 172.58 1rff n SER 514 N -0.35 0.33 -4.65 8.08 3.41 -0.80 -3.74 113.62 115.88 1rff n SER 514 Ca -0.07 0.38 -0.43 0.00 -0.26 0.00 0.00 58.87 58.49 1rff n SER 514 Cb 0.62 -0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.13 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 -3.04 3.57 0.93 7.33 0.00 -1.26 -4.94 121.76 124.36 1rff s ALA 515 Ca 0.12 0.41 -0.09 0.00 0.00 0.00 0.00 51.96 52.40 1rff s ALA 515 Cb 0.17 -3.68 0.13 0.00 0.00 0.00 0.00 23.12 19.74 1rff s ALA 515 CO 0.59 -1.37 0.80 0.09 0.00 0.00 0.00 175.76 175.87 1rff n ASN 516 N 6.98 0.19 -4.34 0.00 3.02 -1.26 -4.85 115.26 115.00 1rff n ASN 516 Ca 0.15 -1.37 -0.43 0.00 -0.03 0.00 0.00 54.58 52.89 1rff n ASN 516 Cb 0.45 -0.60 0.00 0.00 -0.61 0.00 0.00 39.78 39.02 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 5.50 -3.89 3.41 7.94 -0.92 -4.73 117.00 124.31 1rff n LEU 517 Ca 0.10 -4.34 -0.11 0.00 -1.11 0.00 0.00 56.01 50.56 1rff n LEU 517 Cb 0.36 -1.63 -0.10 0.00 0.53 0.00 0.00 43.42 42.58 1rff n LEU 517 CO 0.26 0.72 -0.20 -0.94 -1.11 0.00 0.00 177.39 176.13 1rff s SER 518 N 2.86 0.06 0.39 1.96 1.04 -1.26 -0.49 113.70 118.26 1rff s SER 518 Ca 0.45 -0.27 0.11 0.00 0.48 0.00 0.00 55.95 56.72 1rff s SER 518 Cb 0.02 0.19 0.81 0.00 0.10 0.00 0.00 66.02 67.14 1rff s SER 518 CO 0.02 -0.37 1.91 0.11 0.98 0.00 0.00 173.24 175.89 1rff h LYS 519 N 4.27 0.16 -0.83 4.02 1.57 -1.86 -1.75 116.57 122.15 1rff h LYS 519 Ca -0.31 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.49 1rff h LYS 519 Cb 1.19 -0.02 -0.06 0.00 0.08 0.00 0.00 32.23 33.43 1rff h LYS 519 CO 0.41 0.34 0.51 0.00 -0.57 0.00 0.00 179.45 180.15 1rff h ALA 520 N 1.67 1.13 0.19 3.86 0.00 -1.90 0.89 119.26 125.10 1rff h ALA 520 Ca 0.03 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.62 1rff h ALA 520 Cb 0.41 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 17.99 1rff h ALA 520 CO 0.03 0.26 -1.50 0.00 0.00 0.00 0.00 179.25 178.03 1rff h ALA 521 N 1.39 0.02 0.00 0.00 0.00 -1.84 -1.72 119.26 117.11 1rff h ALA 521 Ca 0.36 -0.99 -0.16 0.00 0.00 0.00 0.00 54.91 54.12 1rff h ALA 521 Cb 0.15 0.33 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1rff h ALA 521 CO -0.17 0.81 -2.03 0.91 0.00 0.00 0.00 179.25 178.77 1rff n TRP 522 N -3.75 0.17 0.00 0.00 7.02 -0.67 -4.79 117.44 115.42 1rff n TRP 522 Ca -0.21 0.06 0.00 0.00 -1.02 0.00 0.00 57.50 56.32 1rff n TRP 522 Cb 1.03 -0.78 0.00 0.00 -2.42 0.00 0.00 31.31 29.13 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 1.46 2.47 3.05 6.99 0.00 0.30 -0.95 105.19 118.51 1rff n GLY 523 Ca -0.15 -1.67 -0.17 0.00 0.00 0.00 0.00 46.02 44.02 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 -1.59 0.77 0.18 4.61 0.00 -0.31 -4.78 121.76 120.65 1rff s ALA 524 Ca 0.00 -0.54 -0.30 0.00 0.00 0.00 0.00 51.96 51.12 1rff s ALA 524 Cb 0.00 -0.13 -0.08 0.00 0.00 0.00 0.00 23.12 22.91 1rff s ALA 524 CO 0.00 0.14 1.09 -0.51 0.00 0.00 0.00 175.76 176.48 1rff s LEU 525 N -0.68 4.50 0.31 0.00 1.43 -1.26 -0.39 118.68 122.60 1rff s LEU 525 Ca 0.00 2.08 0.03 0.00 -1.03 0.00 0.00 54.13 55.22 1rff s LEU 525 Cb -0.05 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.50 1rff s LEU 525 CO 0.00 -0.19 0.07 -1.61 0.23 0.00 0.00 176.35 174.85 1rff s GLU 526 N -0.47 1.61 -0.92 1.70 2.02 0.27 -4.78 118.70 118.14 1rff s GLU 526 Ca 0.48 -1.89 -0.08 0.00 0.02 0.00 0.00 54.97 53.50 1rff s GLU 526 Cb -0.29 -0.75 0.01 0.00 0.10 0.00 0.00 34.13 33.20 1rff s GLU 526 CO 0.35 -0.21 0.65 1.63 0.02 0.00 0.00 175.26 177.70 1rff n LYS 527 N -0.65 -1.25 -2.14 1.61 5.02 -1.26 -1.33 118.16 118.16 1rff n LYS 527 Ca -0.02 0.71 -0.15 0.00 -2.02 0.00 0.00 58.31 56.84 1rff n LYS 527 Cb 0.67 -3.04 -0.02 0.00 -0.02 0.00 0.00 35.03 32.62 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 -2.43 -4.29 -0.01 4.39 5.15 -1.26 -2.42 115.26 114.39 1rff n ASN 528 Ca -0.21 0.20 -0.00 0.00 -0.60 0.00 0.00 54.58 53.97 1rff n ASN 528 Cb 0.63 -3.71 -0.00 0.00 -0.53 0.00 0.00 39.78 36.18 1rff n ASN 528 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1rff n GLY 529 N -0.69 0.38 0.46 8.20 0.00 -0.44 -4.92 105.19 108.18 1rff n GLY 529 Ca -0.17 -1.05 0.09 0.00 0.00 0.00 0.00 46.02 44.89 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 -3.22 0.00 -4.26 2.61 -2.24 -1.02 -4.90 114.28 101.25 1rff n THR 530 Ca -0.00 -0.34 -0.21 0.00 -2.27 0.00 0.00 64.05 61.22 1rff n THR 530 Cb 0.11 1.24 -0.16 0.00 -2.10 0.00 0.00 70.33 69.42 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 -1.99 1.07 -0.30 -0.78 0.74 -1.07 -3.93 119.66 113.38 1rff s GLN 531 Ca 0.16 -0.18 -0.11 0.00 0.05 0.00 0.00 55.36 55.28 1rff s GLN 531 Cb 0.15 -1.01 -0.02 0.00 1.10 0.00 0.00 33.01 33.23 1rff s GLN 531 CO 0.42 -0.06 0.18 -1.17 -0.55 0.00 0.00 175.29 174.11 1rff s LEU 532 N 0.89 4.13 -0.27 3.68 2.96 -0.26 0.97 118.68 130.78 1rff s LEU 532 Ca -0.11 -0.33 -0.10 0.00 -0.22 0.00 0.00 54.13 53.37 1rff s LEU 532 Cb -0.15 -2.06 -0.05 0.00 0.50 0.00 0.00 46.19 44.43 1rff s LEU 532 CO 0.01 -0.15 0.16 -0.32 -1.32 0.00 0.00 176.35 174.73 1rff s MET 533 N 1.68 3.91 -0.08 1.98 -2.45 0.48 -1.00 119.30 123.82 1rff s MET 533 Ca 0.06 -0.34 0.04 0.00 -1.25 0.00 0.00 55.69 54.19 1rff s MET 533 Cb -0.17 -3.58 -0.01 0.00 1.25 0.00 0.00 34.83 32.32 1rff s MET 533 CO 0.08 -0.15 -0.21 0.42 1.05 0.00 0.00 175.02 176.21 1rff s ILE 534 N 1.64 2.40 -0.11 10.11 1.01 -0.54 -1.16 121.20 134.56 1rff s ILE 534 Ca 0.07 -0.93 0.15 0.00 0.00 0.00 0.00 60.65 59.95 1rff s ILE 534 Cb -0.16 -1.92 -0.12 0.00 0.01 0.00 0.00 42.46 40.28 1rff s ILE 534 CO 0.09 0.56 0.94 0.03 0.00 0.00 0.00 174.94 176.56 1rff h ARG 535 N 6.22 0.00 -5.20 2.79 3.08 -1.56 -0.71 114.38 119.00 1rff h ARG 535 Ca -0.30 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.32 1rff h ARG 535 Cb 1.19 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 31.10 1rff h ARG 535 CO 0.49 0.39 -0.64 -1.12 -1.07 0.00 0.00 179.97 178.02 1rff s SER 536 N -5.98 2.14 -0.14 7.04 0.01 -1.04 -4.18 113.70 111.55 1rff s SER 536 Ca -0.02 -1.27 -0.17 0.00 1.31 0.00 0.00 55.95 55.80 1rff s SER 536 Cb 0.08 -0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.23 1rff s SER 536 CO 0.80 -0.52 0.44 -0.31 0.41 0.00 0.00 173.24 174.06 1rff s TYR 537 N -3.32 3.48 0.04 2.43 1.51 -0.54 -3.08 117.35 117.88 1rff s TYR 537 Ca 0.32 0.81 -0.01 0.00 -1.01 0.00 0.00 57.07 57.18 1rff s TYR 537 Cb 0.06 -2.52 -0.03 0.00 -0.11 0.00 0.00 41.96 39.36 1rff s TYR 537 CO 0.12 0.15 -0.03 -1.21 -1.11 0.00 0.00 175.55 173.47 1rff s GLU 538 N 0.70 0.53 -0.17 -0.62 0.41 -0.82 -1.13 118.70 117.60 1rff s GLU 538 Ca 0.24 -1.04 -0.12 0.00 -0.41 0.00 0.00 54.97 53.63 1rff s GLU 538 Cb -0.15 0.18 0.05 0.00 -1.78 0.00 0.00 34.13 32.44 1rff s GLU 538 CO 0.09 -0.09 0.43 -1.17 -0.49 0.00 0.00 175.26 174.03 1rff s LEU 539 N -2.50 0.04 0.26 1.80 2.96 -1.26 -1.13 118.68 118.86 1rff s LEU 539 Ca 0.00 0.92 -0.04 0.00 -0.22 0.00 0.00 54.13 54.79 1rff s LEU 539 Cb 0.03 1.46 -0.02 0.00 0.50 0.00 0.00 46.19 48.16 1rff s LEU 539 CO -0.07 -0.18 0.32 -0.83 -1.32 0.00 0.00 176.35 174.27 1rff s GLY 540 N 0.92 1.31 -0.06 7.98 0.00 0.49 -1.91 107.32 116.05 1rff s GLY 540 Ca -0.06 -1.48 0.04 0.00 0.00 0.00 0.00 44.72 43.22 1rff s GLY 540 CO -0.07 -1.10 -0.17 -1.34 0.00 0.00 0.00 173.10 170.42 1rff s VAL 541 N -3.79 1.43 -0.21 1.40 -7.23 -0.03 -0.80 120.40 111.17 1rff s VAL 541 Ca 0.33 -0.68 -0.09 0.00 -1.81 0.00 0.00 61.98 59.73 1rff s VAL 541 Cb 0.03 -1.25 -0.04 0.00 0.56 0.00 0.00 36.38 35.67 1rff s VAL 541 CO 0.15 0.42 0.10 -0.22 -0.31 0.00 0.00 175.10 175.24 1rff s LEU 542 N 0.30 3.95 -0.39 1.32 2.96 0.92 -2.21 118.68 125.52 1rff s LEU 542 Ca -0.10 0.10 -0.15 0.00 -0.22 0.00 0.00 54.13 53.76 1rff s LEU 542 Cb -0.14 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.54 1rff s LEU 542 CO 0.04 0.13 0.30 -0.36 -1.32 0.00 0.00 176.35 175.14 1rff s PHE 543 N 0.64 3.23 -0.14 5.38 0.40 0.45 -1.48 117.98 126.47 1rff s PHE 543 Ca 0.05 -0.44 -0.01 0.00 -0.60 0.00 0.00 56.93 55.93 1rff s PHE 543 Cb -0.13 -2.60 -0.02 0.00 0.51 0.00 0.00 43.02 40.79 1rff s PHE 543 CO 0.01 -0.54 -0.10 -0.51 0.70 0.00 0.00 175.22 174.78 1rff s LEU 544 N 1.76 2.90 0.29 -0.37 1.43 -1.26 -2.14 118.68 121.28 1rff s LEU 544 Ca 0.06 -0.26 0.03 0.00 -1.03 0.00 0.00 54.13 52.94 1rff s LEU 544 Cb -0.18 -1.67 0.73 0.00 0.03 0.00 0.00 46.19 45.10 1rff s LEU 544 CO 0.11 0.17 1.68 -0.65 0.23 0.00 0.00 176.35 177.89 1rff h PRO 545 N 6.66 0.34 -0.59 1.29 0.11 -1.83 -0.98 132.00 137.01 1rff h PRO 545 Ca -0.28 -0.02 0.16 0.00 0.11 0.00 0.00 66.00 65.97 1rff h PRO 545 Cb 1.20 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 1rff h PRO 545 CO 0.58 0.22 0.42 0.66 -0.21 0.00 0.00 178.00 179.67 1rff h SER 546 N 0.35 0.06 0.85 -2.05 4.64 -1.74 0.97 113.55 116.63 1rff h SER 546 Ca 0.56 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 1rff h SER 546 Cb 1.08 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1rff h SER 546 CO -0.56 0.03 0.00 0.00 -0.87 0.00 0.00 176.83 175.44 1rff h ALA 547 N 1.71 1.00 -0.20 5.18 0.00 -1.48 -2.11 119.26 123.35 1rff h ALA 547 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1rff h ALA 547 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1rff h ALA 547 CO -0.02 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.51 1rff n LEU 548 N -2.61 2.52 0.00 0.00 4.77 0.17 -4.97 117.00 116.89 1rff n LEU 548 Ca 0.01 -1.50 0.00 0.00 -0.03 0.00 0.00 56.01 54.50 1rff n LEU 548 Cb 0.26 -0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1rff n LEU 548 CO 0.23 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.46 1rff n GLY 549 N 0.66 0.51 3.84 -0.72 0.00 -0.79 -5.06 105.19 103.63 1rff n GLY 549 Ca 0.10 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 45.11 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 0.00 3.14 -0.15 0.99 1.43 -0.22 -4.95 118.68 118.90 1rff s LEU 550 Ca 0.00 -0.98 0.17 0.00 -1.03 0.00 0.00 54.13 52.29 1rff s LEU 550 Cb 0.00 -1.64 -0.24 0.00 0.03 0.00 0.00 46.19 44.33 1rff s LEU 550 CO 0.00 -0.72 0.14 0.47 0.23 0.00 0.00 176.35 176.46 1rff n ASP 551 N -1.49 0.44 -3.65 2.29 10.43 -1.26 -2.72 116.55 120.58 1rff n ASP 551 Ca 0.01 0.00 -0.09 0.00 2.57 0.00 0.00 54.79 57.28 1rff n ASP 551 Cb 0.63 1.14 -0.02 0.00 1.84 0.00 0.00 41.12 44.71 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 -5.09 -0.39 -0.06 -2.24 1.04 -1.26 -4.84 113.70 100.86 1rff s SER 552 Ca -0.09 -0.31 -0.00 0.00 0.48 0.00 0.00 55.95 56.03 1rff s SER 552 Cb 0.07 0.64 -0.03 0.00 0.10 0.00 0.00 66.02 66.80 1rff s SER 552 CO 0.77 -1.13 -0.02 -0.36 0.98 0.00 0.00 173.24 173.49 1rff s PHE 553 N -3.77 3.08 0.30 5.02 2.99 -0.48 -4.91 117.98 120.21 1rff s PHE 553 Ca 0.07 0.12 -0.27 0.00 0.00 0.00 0.00 56.93 56.85 1rff s PHE 553 Cb -0.03 -1.73 -0.10 0.00 0.00 0.00 0.00 43.02 41.16 1rff s PHE 553 CO -0.03 0.43 0.94 0.21 -0.00 0.00 0.00 175.22 176.77 1rff s LYS 554 N -1.06 4.63 -0.03 0.44 2.20 -0.99 -0.61 119.74 124.31 1rff s LYS 554 Ca 0.15 1.35 -0.28 0.00 -0.36 0.00 0.00 55.97 56.82 1rff s LYS 554 Cb -0.11 -2.89 -0.03 0.00 -1.51 0.00 0.00 37.83 33.29 1rff s LYS 554 CO 0.04 0.33 0.92 0.08 -0.36 0.00 0.00 175.35 176.36 1rff s VAL 555 N -1.53 4.89 -0.41 4.02 1.01 -0.52 0.31 120.40 128.16 1rff s VAL 555 Ca 0.48 1.92 -0.28 0.00 0.00 0.00 0.00 61.98 64.10 1rff s VAL 555 Cb -0.20 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 31.92 1rff s VAL 555 CO 0.25 0.15 1.63 -0.75 0.00 0.00 0.00 175.10 176.38 1rff s LYS 556 N 1.16 3.33 0.53 2.72 2.20 -0.36 -4.81 119.74 124.51 1rff s LYS 556 Ca 0.48 1.06 0.24 0.00 -0.36 0.00 0.00 55.97 57.40 1rff s LYS 556 Cb -0.20 -4.15 1.48 0.00 -1.51 0.00 0.00 37.83 33.45 1rff s LYS 556 CO 0.24 -1.87 2.13 -0.56 -0.36 0.00 0.00 175.35 174.94 1rff h GLN 557 N 12.18 0.00 -4.09 4.03 -0.00 -1.94 -3.39 115.11 121.90 1rff h GLN 557 Ca -0.30 0.00 -0.56 0.00 -0.00 0.00 0.00 58.65 57.79 1rff h GLN 557 Cb 1.14 0.00 -0.38 0.00 -0.00 0.00 0.00 27.48 28.23 1rff h GLN 557 CO 1.09 0.07 -0.78 -1.59 -0.00 0.00 0.00 178.83 177.62 1rff s LYS 558 N -4.54 1.32 -0.46 0.06 0.00 -1.26 -4.84 119.74 110.02 1rff s LYS 558 Ca -0.04 -0.66 -0.34 0.00 0.00 0.00 0.00 55.97 54.94 1rff s LYS 558 Cb 0.15 -2.23 -0.12 0.00 0.00 0.00 0.00 37.83 35.62 1rff s LYS 558 CO 0.60 -0.54 2.29 0.34 0.00 0.00 0.00 175.35 178.04 1rff n PHE 559 N 4.84 1.42 0.00 1.78 7.35 -1.00 -5.05 117.46 126.81 1rff n PHE 559 Ca -0.11 0.28 0.00 0.00 -0.76 0.00 0.00 57.45 56.86 1rff n PHE 559 Cb 0.46 -2.52 0.00 0.00 0.35 0.00 0.00 39.48 37.77 1rff n PHE 559 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1rff n ALA 568 N 10.75 0.00 -3.63 3.13 0.00 -1.26 -5.01 120.51 124.49 1rff n ALA 568 Ca 0.44 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.54 1rff n ALA 568 Cb 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.55 1rff n ALA 568 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1rff s THR 569 N 0.00 3.07 -0.11 0.00 2.01 -1.26 -2.35 115.64 116.99 1rff s THR 569 Ca 0.00 -0.96 -0.21 0.00 0.31 0.00 0.00 61.69 60.83 1rff s THR 569 Cb 0.00 -2.56 -0.04 0.00 0.01 0.00 0.00 72.50 69.92 1rff s THR 569 CO 0.00 0.19 0.61 0.12 -0.69 0.00 0.00 174.62 174.84 1rff s PHE 570 N 1.36 3.51 -1.14 4.92 5.36 0.15 -4.64 117.98 127.49 1rff s PHE 570 Ca 0.01 1.05 -0.21 0.00 -0.96 0.00 0.00 56.93 56.82 1rff s PHE 570 Cb -0.17 -2.72 0.02 0.00 -0.34 0.00 0.00 43.02 39.82 1rff s PHE 570 CO -0.03 0.05 1.70 -1.25 -1.46 0.00 0.00 175.22 174.23 1rff s PRO 571 N 1.00 3.45 0.01 10.12 0.04 -1.26 -1.22 135.00 147.13 1rff s PRO 571 Ca 0.32 -1.38 -0.30 0.00 0.04 0.00 0.00 61.00 59.67 1rff s PRO 571 Cb -0.16 -5.38 -0.06 0.00 0.04 0.00 0.00 34.50 28.94 1rff s PRO 571 CO 0.14 -2.65 1.49 0.08 0.04 0.00 0.00 177.00 176.09 1rff s VAL 572 N 6.25 3.54 -0.97 -0.36 1.01 -1.26 -4.92 120.40 123.69 1rff s VAL 572 Ca 0.56 0.91 0.28 0.00 0.00 0.00 0.00 61.98 63.72 1rff s VAL 572 Cb 0.01 -3.58 0.24 0.00 0.00 0.00 0.00 36.38 33.05 1rff s VAL 572 CO 0.02 -0.01 1.90 -0.81 0.00 0.00 0.00 175.10 176.19 1rff n PRO 573 N 5.69 0.03 -4.50 2.72 -0.04 -1.26 -4.71 135.00 132.92 1rff n PRO 573 Ca 0.14 0.03 -0.24 0.00 -0.04 0.00 0.00 63.50 63.40 1rff n PRO 573 Cb 0.43 -1.53 -0.11 0.00 -0.04 0.00 0.00 33.50 32.25 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 -3.01 2.15 0.42 0.54 1.13 -1.26 -4.18 117.35 113.13 1rff s TYR 574 Ca 0.13 -0.79 -0.22 0.00 -1.41 0.00 0.00 57.07 54.78 1rff s TYR 574 Cb 0.18 -1.39 -0.10 0.00 -1.10 0.00 0.00 41.96 39.55 1rff s TYR 574 CO 0.53 0.23 0.99 -0.51 -2.51 0.00 0.00 175.55 174.28 1rff s ASP 575 N -3.55 6.84 0.08 -0.18 -0.00 -0.30 -4.92 116.67 114.64 1rff s ASP 575 Ca 0.34 1.83 0.06 0.00 -0.00 0.00 0.00 52.55 54.79 1rff s ASP 575 Cb 0.08 -2.56 -0.03 0.00 -0.00 0.00 0.00 42.92 40.41 1rff s ASP 575 CO 0.15 -0.43 -0.17 -0.76 -0.00 0.00 0.00 175.17 173.97 1rff s LEU 576 N -2.95 2.27 0.75 1.23 1.43 -1.26 -3.94 118.68 116.21 1rff s LEU 576 Ca 0.60 -0.62 -0.11 0.00 -1.03 0.00 0.00 54.13 52.97 1rff s LEU 576 Cb -0.15 -0.69 0.04 0.00 0.03 0.00 0.00 46.19 45.42 1rff s LEU 576 CO 0.19 -0.00 1.08 -2.16 0.23 0.00 0.00 176.35 175.69 1rff s PRO 577 N -1.72 2.45 0.52 1.29 0.04 -1.26 -5.09 135.00 131.22 1rff s PRO 577 Ca 0.02 0.93 -0.21 0.00 0.04 0.00 0.00 61.00 61.78 1rff s PRO 577 Cb -0.10 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 1rff s PRO 577 CO 0.03 -1.44 1.22 -2.14 0.04 0.00 0.00 177.00 174.71 1rff s PRO 578 N -5.02 3.39 -0.19 0.56 0.02 -1.25 -5.00 135.00 127.50 1rff s PRO 578 Ca 0.60 1.89 -0.13 0.00 0.02 0.00 0.00 61.00 63.39 1rff s PRO 578 Cb -0.15 -2.23 -0.05 0.00 0.02 0.00 0.00 34.50 32.09 1rff s PRO 578 CO 0.55 -0.89 0.25 -2.00 -0.33 0.00 0.00 177.00 174.58 1rff s GLU 579 N -2.94 4.20 0.51 5.54 2.12 -1.26 -4.99 118.70 121.87 1rff s GLU 579 Ca 0.69 -0.03 -0.23 0.00 0.36 0.00 0.00 54.97 55.76 1rff s GLU 579 Cb -0.32 -3.46 -0.06 0.00 0.26 0.00 0.00 34.13 30.55 1rff s GLU 579 CO 0.37 0.18 1.39 -1.17 -0.54 0.00 0.00 175.26 175.49 1rff s LEU 580 N 0.67 3.96 0.28 2.70 2.96 -1.26 -0.77 118.68 127.22 1rff s LEU 580 Ca 0.13 2.83 -0.29 0.00 -0.22 0.00 0.00 54.13 56.57 1rff s LEU 580 Cb -0.13 -4.13 -0.14 0.00 0.50 0.00 0.00 46.19 42.29 1rff s LEU 580 CO 0.03 -1.40 1.19 -1.22 -1.32 0.00 0.00 176.35 173.63 1rff n TYR 581 N -0.68 1.74 -1.29 5.38 4.02 -1.03 -4.66 117.16 120.64 1rff n TYR 581 Ca 0.08 0.60 -0.29 0.00 -0.01 0.00 0.00 57.90 58.28 1rff n TYR 581 Cb 0.44 -2.34 0.14 0.00 -0.02 0.00 0.00 39.34 37.55 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 -0.23 1.60 0.54 2.72 0.00 -1.26 -4.92 107.32 105.77 1rff s GLY 582 Ca 0.62 -0.21 0.24 0.00 0.00 0.00 0.00 44.72 45.37 1rff s GLY 582 CO 0.57 0.31 2.16 1.48 0.00 0.00 0.00 173.10 177.62 1rff h SER 583 N -1.55 0.00 0.03 1.64 4.64 -2.05 -1.41 113.55 114.86 1rff h SER 583 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1rff h SER 583 Cb 1.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.39 1rff h SER 583 CO 0.57 0.05 -0.12 2.29 -0.87 0.00 0.00 176.83 178.74 1rff n LYS 584 N -4.03 1.61 -2.66 4.77 2.85 -1.26 -4.96 118.16 114.49 1rff n LYS 584 Ca -0.03 -1.14 -0.34 0.00 -1.05 0.00 0.00 58.31 55.76 1rff n LYS 584 Cb 0.14 -1.48 -0.05 0.00 -0.65 0.00 0.00 35.03 32.99 1rff n LYS 584 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1rff s ASP 585 N -2.17 6.64 0.09 -5.58 1.01 -0.53 -5.07 116.67 111.05 1rff s ASP 585 Ca 0.30 1.85 0.04 0.00 0.71 0.00 0.00 52.55 55.44 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 0.40 -0.57 -0.11 -0.13 0.21 0.00 0.00 175.17 174.97 1rff s ARG 586 N -3.10 0.84 0.48 8.23 0.52 -1.26 -4.89 118.95 119.77 1rff s ARG 586 Ca 0.64 -1.08 -0.23 0.00 -0.52 0.00 0.00 55.73 54.53 1rff s ARG 586 Cb -0.14 -0.64 -0.07 0.00 0.52 0.00 0.00 34.95 34.62 1rff s ARG 586 CO 0.18 0.12 1.26 -1.25 0.02 0.00 0.00 175.30 175.62 1rff s PRO 587 N -2.40 3.59 0.11 3.54 0.04 -1.26 -1.20 135.00 137.42 1rff s PRO 587 Ca 0.03 2.00 -0.31 0.00 0.04 0.00 0.00 61.00 62.76 1rff s PRO 587 Cb -0.06 -2.43 -0.09 0.00 0.04 0.00 0.00 34.50 31.96 1rff s PRO 587 CO 0.01 -0.75 1.70 -0.46 0.04 0.00 0.00 177.00 177.54 1rff s TRP 588 N -1.41 2.45 -0.15 0.56 -0.11 -0.37 -4.49 118.94 115.42 1rff s TRP 588 Ca 0.65 0.26 0.01 0.00 1.22 0.00 0.00 56.10 58.23 1rff s TRP 588 Cb -0.34 -4.03 0.02 0.00 -1.50 0.00 0.00 33.47 27.61 1rff s TRP 588 CO 0.42 -4.14 -0.16 0.42 -4.62 0.00 0.00 176.95 168.87 1rff s ILE 589 N 2.39 1.69 -0.71 5.86 1.01 -1.26 -4.58 121.20 125.60 1rff s ILE 589 Ca 0.76 -0.72 0.26 0.00 0.00 0.00 0.00 60.65 60.94 1rff s ILE 589 Cb -0.43 -1.55 0.25 0.00 0.01 0.00 0.00 42.46 40.74 1rff s ILE 589 CO 0.33 0.48 1.69 -2.67 0.00 0.00 0.00 174.94 174.77 1rff n TRP 590 N 4.57 0.90 -1.39 3.97 4.27 -0.13 -3.79 117.44 125.84 1rff n TRP 590 Ca -0.18 0.26 0.00 0.00 -3.89 0.00 0.00 57.50 53.69 1rff n TRP 590 Cb 0.50 -0.91 0.20 0.00 -1.36 0.00 0.00 31.31 29.75 1rff n TRP 590 CO 0.00 0.00 0.00 0.27 -2.29 0.00 0.00 177.69 175.67 1rff n ASN 591 N -2.27 2.50 -4.40 -0.67 6.94 -1.26 -4.84 115.26 111.26 1rff n ASN 591 Ca 0.05 -3.65 -0.24 0.00 -0.02 0.00 0.00 54.58 50.72 1rff n ASN 591 Cb 0.44 -0.59 -0.11 0.00 -2.36 0.00 0.00 39.78 37.16 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 -3.16 2.17 0.40 1.53 -4.36 -1.25 -4.89 121.20 111.63 1rff s ILE 592 Ca 0.42 -2.09 -0.23 0.00 -0.26 0.00 0.00 60.65 58.49 1rff s ILE 592 Cb 0.38 -2.07 -0.10 0.00 1.25 0.00 0.00 42.46 41.93 1rff s ILE 592 CO -0.00 -0.27 0.98 -2.16 0.24 0.00 0.00 174.94 173.73 1rff s PRO 593 N -2.95 4.27 -0.27 0.37 0.04 -1.26 -4.66 135.00 130.54 1rff s PRO 593 Ca 0.21 1.29 0.01 0.00 0.04 0.00 0.00 61.00 62.56 1rff s PRO 593 Cb -0.06 -2.43 0.07 0.00 0.04 0.00 0.00 34.50 32.12 1rff s PRO 593 CO 0.10 -0.01 -0.02 0.71 0.04 0.00 0.00 177.00 177.82 1rff s TYR 594 N -1.88 2.67 0.00 0.56 2.02 0.46 -4.98 117.35 116.20 1rff s TYR 594 Ca 0.58 -2.07 0.00 0.00 -0.37 0.00 0.00 57.07 55.21 1rff s TYR 594 Cb -0.15 -1.91 0.00 0.00 -0.40 0.00 0.00 41.96 39.49 1rff s TYR 594 CO 0.20 -0.84 0.53 1.33 -1.57 0.00 0.00 175.55 175.20 1rff n VAL 595 N 4.59 0.27 -0.01 0.71 0.24 -1.26 -1.63 118.33 121.23 1rff n VAL 595 Ca -0.07 -0.35 -0.06 0.00 -2.04 0.00 0.00 64.34 61.82 1rff n VAL 595 Cb 0.43 1.08 -0.12 0.00 -1.47 0.00 0.00 33.84 33.76 1rff n VAL 595 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1rff n LYS 596 N -0.13 0.63 -4.20 7.34 5.02 -1.26 -4.89 118.16 120.67 1rff n LYS 596 Ca 0.00 0.24 -0.18 0.00 -2.02 0.00 0.00 58.31 56.35 1rff n LYS 596 Cb 0.30 -1.77 -0.15 0.00 -0.02 0.00 0.00 35.03 33.39 1rff n LYS 596 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rff s ALA 597 N -2.70 0.58 0.72 7.82 0.00 -1.26 -5.15 121.76 121.76 1rff s ALA 597 Ca -0.05 -0.18 -0.11 0.00 0.00 0.00 0.00 51.96 51.62 1rff s ALA 597 Cb 0.08 -0.24 0.02 0.00 0.00 0.00 0.00 23.12 22.98 1rff s ALA 597 CO 0.82 0.08 1.07 -1.25 0.00 0.00 0.00 175.76 176.48 1rff s PRO 598 N 0.26 2.75 0.00 0.00 0.04 -1.26 -4.85 135.00 131.94 1rff s PRO 598 Ca -0.03 0.88 0.00 0.00 0.04 0.00 0.00 61.00 61.89 1rff s PRO 598 Cb -0.07 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.49 1rff s PRO 598 CO -0.00 -1.21 0.00 -0.40 0.04 0.00 0.00 177.00 175.42 1rff n ASP 599 N -3.20 0.00 -0.31 6.66 3.85 -0.33 -4.85 116.55 118.37 1rff n ASP 599 Ca 0.07 -0.75 0.31 0.00 -0.71 0.00 0.00 54.79 53.71 1rff n ASP 599 Cb 0.54 0.00 0.67 0.00 -1.35 0.00 0.00 41.12 40.98 1rff n ASP 599 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.20 176.93 1rff h THR 600 N -0.13 0.45 -0.47 2.12 2.02 -1.68 -1.77 112.91 113.46 1rff h THR 600 Ca 0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1rff h THR 600 Cb 0.00 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 66.73 1rff h THR 600 CO 0.00 0.02 0.00 1.41 0.37 0.00 0.00 175.52 177.32 1rff n HIS 601 N -4.34 0.89 -0.99 3.16 8.25 -1.26 -4.94 115.22 115.99 1rff n HIS 601 Ca 0.25 -0.59 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 1rff n HIS 601 Cb 1.10 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 32.09 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 0.67 0.42 3.72 -1.41 0.00 -0.67 -5.05 105.19 102.88 1rff n GLY 602 Ca 0.19 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 45.17 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 -2.74 4.98 0.57 1.61 0.01 -1.26 -4.72 114.94 113.40 1rff s ASN 603 Ca 0.00 -0.45 0.09 0.00 -0.71 0.00 0.00 52.86 51.79 1rff s ASN 603 Cb 0.00 -1.10 0.08 0.00 0.41 0.00 0.00 41.25 40.64 1rff s ASN 603 CO 0.00 -0.00 0.71 -0.04 -1.51 0.00 0.00 177.10 176.26 1rff s MET 604 N -3.64 2.27 -0.20 -0.60 -1.94 -1.26 -1.19 119.30 112.74 1rff s MET 604 Ca 0.32 -1.75 -0.01 0.00 -1.71 0.00 0.00 55.69 52.54 1rff s MET 604 Cb -0.07 -2.52 0.05 0.00 2.01 0.00 0.00 34.83 34.30 1rff s MET 604 CO 0.22 -0.83 -0.03 -0.46 -0.01 0.00 0.00 175.02 173.90 1rff s TRP 605 N -2.71 1.82 -0.42 -0.03 -0.11 -0.65 -4.99 118.94 111.86 1rff s TRP 605 Ca 0.56 -1.30 0.02 0.00 1.22 0.00 0.00 56.10 56.60 1rff s TRP 605 Cb -0.05 -1.35 0.14 0.00 -1.50 0.00 0.00 33.47 30.71 1rff s TRP 605 CO 0.35 -0.68 0.26 0.08 -4.62 0.00 0.00 176.95 172.34 1rff s VAL 606 N 1.59 0.88 0.48 5.86 1.01 -1.26 -0.40 120.40 128.55 1rff s VAL 606 Ca -0.02 -2.35 -0.23 0.00 0.00 0.00 0.00 61.98 59.37 1rff s VAL 606 Cb -0.17 -1.62 -0.07 0.00 0.00 0.00 0.00 36.38 34.53 1rff s VAL 606 CO -0.07 -0.98 1.30 -2.16 0.00 0.00 0.00 175.10 173.19 1rff s PRO 607 N 0.48 3.55 0.00 2.72 0.04 -1.26 -5.05 135.00 135.48 1rff s PRO 607 Ca 0.20 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.36 1rff s PRO 607 Cb -0.19 -2.46 0.00 0.00 0.04 0.00 0.00 34.50 31.90 1rff s PRO 607 CO -0.03 -0.82 0.00 0.43 0.04 0.00 0.00 177.00 176.62