#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ddf s ASP 219 N 0.00 5.41 0.60 2.55 -1.08 -1.26 -4.96 116.67 117.93 2ddf s ASP 219 Ca 0.00 -1.23 0.39 0.00 -0.52 0.00 0.00 52.55 51.19 2ddf s ASP 219 Cb 0.00 -1.90 2.00 0.00 -1.46 0.00 0.00 42.92 41.55 2ddf s ASP 219 CO 0.00 -0.38 2.19 1.55 0.52 0.00 0.00 175.17 179.05 2ddf h PRO 220 N 8.26 0.00 0.00 4.34 0.13 -1.99 0.93 132.00 143.67 2ddf h PRO 220 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 2ddf h PRO 220 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2ddf h PRO 220 CO 0.64 0.00 -0.16 -1.33 -0.23 0.00 0.00 178.00 176.91 2ddf n MET 221 N -3.00 0.05 -3.02 0.86 2.81 -1.26 -4.12 117.12 109.43 2ddf n MET 221 Ca -0.02 0.03 -0.15 0.00 -1.81 0.00 0.00 57.70 55.76 2ddf n MET 221 Cb 0.14 -1.55 -0.01 0.00 -0.71 0.00 0.00 33.22 31.09 2ddf n MET 221 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2ddf n LYS 222 N -1.64 1.02 0.00 0.03 5.02 0.32 -0.87 118.16 122.04 2ddf n LYS 222 Ca 0.06 -3.27 0.00 0.00 -2.02 0.00 0.00 58.31 53.08 2ddf n LYS 222 Cb 0.36 -1.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 2ddf n LYS 222 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2ddf n ASN 223 N 0.18 1.48 -4.00 4.39 2.04 -0.73 -4.49 115.26 114.14 2ddf n ASN 223 Ca 0.20 -1.53 -0.24 0.00 -0.44 0.00 0.00 54.58 52.57 2ddf n ASN 223 Cb 0.71 0.00 -0.17 0.00 -2.53 0.00 0.00 39.78 37.79 2ddf n ASN 223 CO 0.00 0.00 0.00 -0.89 -0.44 0.00 0.00 177.26 175.93 2ddf s THR 224 N -0.53 1.05 -0.45 5.53 2.01 0.20 -1.91 115.64 121.54 2ddf s THR 224 Ca 0.00 -0.42 -0.21 0.00 0.31 0.00 0.00 61.69 61.38 2ddf s THR 224 Cb 0.00 -0.97 0.03 0.00 0.01 0.00 0.00 72.50 71.56 2ddf s THR 224 CO 0.00 0.34 0.66 0.00 -0.69 0.00 0.00 174.62 174.93 2ddf s LYS 226 N 2.87 4.80 -0.01 0.00 -0.14 -1.26 -2.04 119.74 123.95 2ddf s LYS 226 Ca 0.22 1.43 0.04 0.00 -1.36 0.00 0.00 55.97 56.31 2ddf s LYS 226 Cb -0.14 -3.29 -0.03 0.00 -1.68 0.00 0.00 37.83 32.69 2ddf s LYS 226 CO 0.18 0.50 -0.13 -0.51 -0.76 0.00 0.00 175.35 174.63 2ddf s LEU 227 N -1.06 2.83 -0.30 3.17 1.43 0.78 -2.94 118.68 122.58 2ddf s LEU 227 Ca 0.41 -0.24 -0.18 0.00 -1.03 0.00 0.00 54.13 53.09 2ddf s LEU 227 Cb -0.25 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.33 2ddf s LEU 227 CO 0.31 0.31 0.50 -0.22 0.23 0.00 0.00 176.35 177.48 2ddf s LEU 228 N -1.10 4.18 -0.18 1.79 2.96 -0.36 -0.07 118.68 125.90 2ddf s LEU 228 Ca 0.14 0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 54.24 2ddf s LEU 228 Cb -0.11 -2.61 -0.03 0.00 0.50 0.00 0.00 46.19 43.94 2ddf s LEU 228 CO 0.04 -0.37 0.03 -0.69 -1.32 0.00 0.00 176.35 174.04 2ddf s VAL 229 N 2.34 4.38 -0.15 1.68 1.01 -0.14 -0.85 120.40 128.67 2ddf s VAL 229 Ca 0.20 -0.17 -0.00 0.00 0.00 0.00 0.00 61.98 62.00 2ddf s VAL 229 Cb -0.15 -2.97 -0.01 0.00 0.00 0.00 0.00 36.38 33.25 2ddf s VAL 229 CO 0.11 0.45 -0.14 -0.69 0.00 0.00 0.00 175.10 174.83 2ddf s VAL 230 N 0.58 2.84 -0.29 2.92 1.01 0.10 -0.82 120.40 126.74 2ddf s VAL 230 Ca 0.01 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.18 2ddf s VAL 230 Cb -0.13 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 2ddf s VAL 230 CO 0.02 0.51 0.14 0.00 0.00 0.00 0.00 175.10 175.77 2ddf s ALA 231 N 0.69 3.30 0.93 5.51 0.00 0.25 -0.31 121.76 132.13 2ddf s ALA 231 Ca -0.07 -1.24 -0.15 0.00 0.00 0.00 0.00 51.96 50.51 2ddf s ALA 231 Cb -0.15 -2.31 0.18 0.00 0.00 0.00 0.00 23.12 20.84 2ddf s ALA 231 CO 0.02 -0.69 1.29 0.16 0.00 0.00 0.00 175.76 176.53 2ddf s ASP 232 N 1.65 3.35 0.54 0.00 1.47 -1.02 -1.26 116.67 121.40 2ddf s ASP 232 Ca 0.06 0.28 0.24 0.00 1.18 0.00 0.00 52.55 54.31 2ddf s ASP 232 Cb -0.16 -0.40 1.50 0.00 -0.34 0.00 0.00 42.92 43.52 2ddf s ASP 232 CO 0.06 -2.58 2.15 1.12 0.68 0.00 0.00 175.17 176.60 2ddf h HIS 233 N -1.50 0.00 -0.19 2.11 2.07 -1.75 -1.04 115.15 114.85 2ddf h HIS 233 Ca -0.44 0.00 -0.11 0.00 -2.85 0.00 0.00 60.37 56.97 2ddf h HIS 233 Cb 1.25 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.23 2ddf h HIS 233 CO -0.93 0.06 -0.32 0.00 -3.07 0.00 0.00 177.93 173.67 2ddf h ARG 234 N 0.00 0.55 -0.51 5.12 3.08 -1.90 -1.24 114.38 119.48 2ddf h ARG 234 Ca -0.00 -0.34 -0.06 0.00 0.07 0.00 0.00 59.98 59.65 2ddf h ARG 234 Cb 0.14 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 2ddf h ARG 234 CO 0.01 0.95 0.06 0.35 -1.07 0.00 0.00 179.97 180.27 2ddf h PHE 235 N 0.21 0.91 -0.37 3.04 3.57 -1.67 -0.35 116.94 122.27 2ddf h PHE 235 Ca 0.01 -0.13 0.03 0.00 3.53 0.00 0.00 57.97 61.41 2ddf h PHE 235 Cb 0.91 -0.25 -0.03 0.00 2.79 0.00 0.00 35.95 39.37 2ddf h PHE 235 CO 0.09 0.83 0.18 -0.92 -2.23 0.00 0.00 178.31 176.26 2ddf h TYR 236 N 0.72 0.34 0.12 0.41 3.20 -1.15 0.41 116.97 121.03 2ddf h TYR 236 Ca 0.15 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2ddf h TYR 236 Cb 0.42 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.60 2ddf h TYR 236 CO 0.03 0.18 -0.06 -0.09 -1.64 0.00 0.00 178.16 176.58 2ddf h ARG 237 N 0.37 -0.16 0.00 1.82 2.43 -1.04 0.01 114.38 117.81 2ddf h ARG 237 Ca 0.16 0.01 -0.17 0.00 -0.81 0.00 0.00 59.98 59.17 2ddf h ARG 237 Cb 0.07 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 2ddf h ARG 237 CO -0.11 0.21 -1.62 0.66 -1.51 0.00 0.00 179.97 177.60 2ddf n TYR 238 N -4.99 0.70 -0.09 2.20 4.01 -0.16 -2.96 117.16 115.87 2ddf n TYR 238 Ca -0.09 0.23 -0.11 0.00 -0.16 0.00 0.00 57.90 57.78 2ddf n TYR 238 Cb 0.23 -0.99 -0.11 0.00 -0.31 0.00 0.00 39.34 38.16 2ddf n TYR 238 CO 0.00 0.00 0.00 -1.33 -0.46 0.00 0.00 176.86 175.07 2ddf n MET 239 N -2.77 0.96 0.00 -0.72 2.81 0.02 -4.61 117.12 112.81 2ddf n MET 239 Ca -0.12 0.05 0.13 0.00 -1.81 0.00 0.00 57.70 55.96 2ddf n MET 239 Cb 0.83 -1.41 0.46 0.00 -0.71 0.00 0.00 33.22 32.40 2ddf n MET 239 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ddf n GLY 240 N 2.27 -1.04 2.44 3.03 0.00 -0.52 -4.74 105.19 106.64 2ddf n GLY 240 Ca -0.31 -0.29 -0.20 0.00 0.00 0.00 0.00 46.02 45.22 2ddf n GLY 240 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ddf n ARG 241 N -1.12 -1.65 -2.00 1.61 5.12 -0.92 -1.12 116.66 116.58 2ddf n ARG 241 Ca 0.10 1.03 -0.14 0.00 -1.93 0.00 0.00 57.85 56.92 2ddf n ARG 241 Cb 0.32 -5.59 -0.02 0.00 -1.16 0.00 0.00 32.46 26.00 2ddf n ARG 241 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ddf n GLY 242 N -0.78 0.28 3.15 -0.13 0.00 -0.06 -4.99 105.19 102.67 2ddf n GLY 242 Ca -0.22 -0.34 -0.27 0.00 0.00 0.00 0.00 46.02 45.19 2ddf n GLY 242 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ddf s GLU 243 N -4.23 1.93 0.17 1.61 2.02 -0.28 -5.04 118.70 114.89 2ddf s GLU 243 Ca 0.00 -0.64 -0.15 0.00 0.02 0.00 0.00 54.97 54.20 2ddf s GLU 243 Cb 0.00 -1.65 0.06 0.00 0.10 0.00 0.00 34.13 32.64 2ddf s GLU 243 CO 0.00 0.24 1.82 0.93 0.02 0.00 0.00 175.26 178.27 2ddf h GLU 244 N 6.31 0.59 -0.49 1.61 5.08 -1.95 -2.22 114.58 123.50 2ddf h GLU 244 Ca -0.32 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 57.99 2ddf h GLU 244 Cb 1.18 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 2ddf h GLU 244 CO 0.48 0.39 0.23 0.66 -1.00 0.00 0.00 179.01 179.76 2ddf h SER 245 N 0.61 0.65 -0.63 1.42 4.64 -1.96 0.25 113.55 118.52 2ddf h SER 245 Ca 0.18 -0.14 -0.09 0.00 -0.47 0.00 0.00 61.79 61.28 2ddf h SER 245 Cb -0.03 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 2ddf h SER 245 CO -0.06 0.60 0.05 0.74 -0.87 0.00 0.00 176.83 177.28 2ddf h THR 246 N 0.65 1.26 0.01 2.95 2.02 -1.78 -0.03 112.91 117.99 2ddf h THR 246 Ca 0.17 -1.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.24 2ddf h THR 246 Cb 0.13 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 2ddf h THR 246 CO -0.02 0.41 -0.00 0.74 0.37 0.00 0.00 175.52 177.01 2ddf h THR 247 N 0.99 1.21 -0.29 3.16 2.02 -0.97 -2.37 112.91 116.65 2ddf h THR 247 Ca 0.18 -0.65 -0.18 0.00 0.77 0.00 0.00 66.41 66.54 2ddf h THR 247 Cb 0.51 1.65 -0.00 0.00 -1.74 0.00 0.00 68.15 68.57 2ddf h THR 247 CO 0.02 0.17 -0.52 0.71 0.37 0.00 0.00 175.52 176.27 2ddf h THR 248 N -0.29 1.28 -0.56 3.16 1.35 -0.84 -2.87 112.91 114.14 2ddf h THR 248 Ca -0.00 -1.71 0.05 0.00 -0.55 0.00 0.00 66.41 64.20 2ddf h THR 248 Cb 0.28 1.60 -0.05 0.00 -1.73 0.00 0.00 68.15 68.26 2ddf h THR 248 CO 0.00 0.56 0.30 0.78 -0.25 0.00 0.00 175.52 176.91 2ddf h ASN 249 N 0.66 0.44 -0.19 5.36 2.35 -1.03 0.14 115.58 123.30 2ddf h ASN 249 Ca 0.02 0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.83 2ddf h ASN 249 Cb 1.12 -0.06 -0.03 0.00 0.05 0.00 0.00 38.32 39.40 2ddf h ASN 249 CO 0.12 0.30 -0.01 0.22 -1.65 0.00 0.00 177.43 176.40 2ddf h TYR 250 N 0.57 -0.03 -0.36 1.19 5.03 -1.34 -1.18 116.97 120.85 2ddf h TYR 250 Ca 0.25 0.01 -0.13 0.00 2.58 0.00 0.00 58.73 61.44 2ddf h TYR 250 Cb 0.14 0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.46 2ddf h TYR 250 CO -0.09 -0.04 -0.29 -0.07 -1.32 0.00 0.00 178.16 176.35 2ddf h LEU 251 N 0.05 0.88 -0.44 2.82 3.38 -1.22 -1.40 115.31 119.38 2ddf h LEU 251 Ca 0.09 -0.45 0.02 0.00 0.09 0.00 0.00 57.88 57.63 2ddf h LEU 251 Cb 0.12 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2ddf h LEU 251 CO -0.16 1.14 0.26 0.40 0.09 0.00 0.00 178.44 180.17 2ddf h ILE 252 N 0.63 1.04 -0.46 1.22 2.04 -0.64 -1.04 117.51 120.30 2ddf h ILE 252 Ca 0.07 -0.18 -0.14 0.00 1.00 0.00 0.00 64.86 65.61 2ddf h ILE 252 Cb 0.87 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2ddf h ILE 252 CO 0.08 0.09 -0.25 -0.33 0.00 0.00 0.00 178.15 177.74 2ddf h GLU 253 N 0.52 0.97 0.04 2.37 5.08 -1.11 -1.78 114.58 120.66 2ddf h GLU 253 Ca 0.18 -0.43 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 2ddf h GLU 253 Cb 0.02 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ddf h GLU 253 CO -0.09 1.10 -0.02 1.25 -1.00 0.00 0.00 179.01 180.26 2ddf h LEU 254 N 0.83 -0.04 -1.20 1.33 6.46 -1.07 -1.14 115.31 120.48 2ddf h LEU 254 Ca 0.10 -0.15 -0.03 0.00 -0.12 0.00 0.00 57.88 57.67 2ddf h LEU 254 Cb 0.83 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.75 2ddf h LEU 254 CO 0.07 0.13 0.16 0.40 -0.62 0.00 0.00 178.44 178.58 2ddf h ILE 255 N -0.21 1.20 -0.67 4.05 1.08 -1.14 -1.09 117.51 120.72 2ddf h ILE 255 Ca -0.00 -0.66 -0.07 0.00 -0.39 0.00 0.00 64.86 63.74 2ddf h ILE 255 Cb 0.19 0.66 -0.03 0.00 -3.07 0.00 0.00 36.82 34.57 2ddf h ILE 255 CO 0.01 0.25 0.14 -0.78 -0.69 0.00 0.00 178.15 177.08 2ddf h ASP 256 N 0.70 1.04 -0.32 1.72 3.58 -1.03 0.22 116.42 122.33 2ddf h ASP 256 Ca 0.16 -0.24 -0.12 0.00 0.42 0.00 0.00 57.03 57.25 2ddf h ASP 256 Cb 0.20 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 2ddf h ASP 256 CO -0.01 1.01 -0.23 0.03 -2.88 0.00 0.00 179.24 177.16 2ddf h ARG 257 N 1.02 0.81 -0.47 0.28 3.08 -0.50 -1.39 114.38 117.21 2ddf h ARG 257 Ca 0.21 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.88 2ddf h ARG 257 Cb 0.39 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 2ddf h ARG 257 CO 0.01 0.96 0.14 0.28 -1.07 0.00 0.00 179.97 180.29 2ddf h VAL 258 N 0.70 1.23 -0.70 2.04 2.07 -0.96 -2.58 116.25 118.05 2ddf h VAL 258 Ca 0.09 -0.76 0.13 0.00 0.82 0.00 0.00 66.70 66.98 2ddf h VAL 258 Cb 0.76 0.84 -0.09 0.00 -1.52 0.00 0.00 31.29 31.27 2ddf h VAL 258 CO 0.06 0.28 0.24 -0.78 0.02 0.00 0.00 177.57 177.39 2ddf h ASP 259 N 0.62 0.18 -0.95 0.57 3.58 -0.26 -0.70 116.42 119.47 2ddf h ASP 259 Ca 0.15 0.11 0.12 0.00 0.42 0.00 0.00 57.03 57.83 2ddf h ASP 259 Cb 0.28 0.11 -0.08 0.00 1.72 0.00 0.00 39.33 41.36 2ddf h ASP 259 CO -0.00 0.07 0.61 0.44 -2.88 0.00 0.00 179.24 177.48 2ddf h ASP 260 N 0.38 0.85 0.02 2.28 3.32 -0.86 0.23 116.42 122.64 2ddf h ASP 260 Ca 0.38 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.47 2ddf h ASP 260 Cb 0.57 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.99 2ddf h ASP 260 CO -0.41 0.46 -0.01 0.40 -1.72 0.00 0.00 179.24 177.97 2ddf h ILE 261 N 0.91 1.14 -0.06 0.35 2.04 -0.98 -2.88 117.51 118.03 2ddf h ILE 261 Ca 0.46 -0.50 -0.00 0.00 1.00 0.00 0.00 64.86 65.83 2ddf h ILE 261 Cb 0.50 1.47 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2ddf h ILE 261 CO -0.23 0.13 0.03 1.88 0.00 0.00 0.00 178.15 179.96 2ddf h TYR 262 N -0.25 0.09 -0.30 1.37 -1.99 -0.56 -2.98 116.97 112.36 2ddf h TYR 262 Ca -0.00 -0.01 -0.04 0.00 2.00 0.00 0.00 58.73 60.68 2ddf h TYR 262 Cb 0.23 -0.03 -0.02 0.00 2.00 0.00 0.00 36.73 38.92 2ddf h TYR 262 CO -0.00 0.19 -0.01 -0.09 -0.00 0.00 0.00 178.16 178.25 2ddf h ARG 263 N -0.03 0.45 -0.00 4.88 2.43 -0.28 -1.82 114.38 120.00 2ddf h ARG 263 Ca 0.02 -0.09 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2ddf h ARG 263 Cb 0.13 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2ddf h ARG 263 CO -0.00 0.49 -0.10 0.09 -1.51 0.00 0.00 179.97 178.94 2ddf n ASN 264 N -4.30 0.43 -4.69 -3.80 3.02 -1.09 -1.59 115.26 103.23 2ddf n ASN 264 Ca 0.01 -0.54 -0.41 0.00 -0.03 0.00 0.00 54.58 53.61 2ddf n ASN 264 Cb 0.23 -0.09 -0.04 0.00 -0.61 0.00 0.00 39.78 39.27 2ddf n ASN 264 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2ddf s THR 265 N -2.48 4.93 -0.58 3.41 2.01 -0.69 -4.97 115.64 117.28 2ddf s THR 265 Ca 0.29 1.67 -0.20 0.00 0.31 0.00 0.00 61.69 63.76 2ddf s THR 265 Cb 0.20 -4.15 0.08 0.00 0.01 0.00 0.00 72.50 68.65 2ddf s THR 265 CO 0.47 0.12 0.73 0.00 -0.69 0.00 0.00 174.62 175.26 2ddf s ALA 266 N 1.49 3.35 0.44 7.40 0.00 -1.26 -4.25 121.76 128.92 2ddf s ALA 266 Ca 0.41 -1.98 0.40 0.00 0.00 0.00 0.00 51.96 50.79 2ddf s ALA 266 Cb -0.18 -3.54 2.04 0.00 0.00 0.00 0.00 23.12 21.44 2ddf s ALA 266 CO 0.17 -2.32 2.22 -1.49 0.00 0.00 0.00 175.76 174.34 2ddf h TRP 267 N 9.20 0.00 -0.01 0.00 4.06 -1.18 -1.95 115.95 126.07 2ddf h TRP 267 Ca -0.29 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.66 2ddf h TRP 267 Cb 1.09 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.25 2ddf h TRP 267 CO 0.83 0.00 -0.22 -0.40 -3.56 0.00 0.00 178.44 175.09 2ddf n ASP 268 N -3.05 0.99 -1.34 -3.49 5.75 -1.26 -4.36 116.55 109.79 2ddf n ASP 268 Ca -0.02 -0.99 -0.08 0.00 -0.01 0.00 0.00 54.79 53.69 2ddf n ASP 268 Cb 0.15 0.57 0.02 0.00 -1.03 0.00 0.00 41.12 40.83 2ddf n ASP 268 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 2ddf n ASN 269 N -0.46 -3.24 0.00 -1.12 3.02 -0.73 -4.99 115.26 107.74 2ddf n ASN 269 Ca 0.03 -0.14 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 2ddf n ASN 269 Cb 0.17 -1.95 0.00 0.00 -0.61 0.00 0.00 39.78 37.39 2ddf n ASN 269 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ddf n ALA 270 N -2.87 0.00 -0.06 5.41 0.00 -1.26 -5.01 120.51 116.71 2ddf n ALA 270 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.54 2ddf n ALA 270 Cb 0.53 0.00 0.29 0.00 0.00 0.00 0.00 19.45 20.27 2ddf n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ddf n GLY 271 N 0.00 2.11 3.06 0.00 0.00 -1.26 -4.72 105.19 104.38 2ddf n GLY 271 Ca 0.00 -0.75 -0.43 0.00 0.00 0.00 0.00 46.02 44.84 2ddf n GLY 271 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2ddf n PHE 272 N 1.52 3.25 -4.41 1.61 7.35 -1.26 -4.90 117.46 120.63 2ddf n PHE 272 Ca 0.22 -2.94 -0.21 0.00 -0.76 0.00 0.00 57.45 53.77 2ddf n PHE 272 Cb 0.59 -1.66 -0.10 0.00 0.35 0.00 0.00 39.48 38.66 2ddf n PHE 272 CO 0.00 0.00 0.00 -1.59 -0.76 0.00 0.00 176.76 174.41 2ddf s LYS 273 N -1.01 1.65 0.00 -4.13 -2.85 -1.26 -0.56 119.74 111.58 2ddf s LYS 273 Ca 0.35 -1.94 0.00 0.00 -1.00 0.00 0.00 55.97 53.38 2ddf s LYS 273 Cb 0.03 -0.53 0.00 0.00 -2.06 0.00 0.00 37.83 35.28 2ddf s LYS 273 CO 0.03 -0.33 0.00 0.41 0.10 0.00 0.00 175.35 175.57 2ddf n GLY 274 N -0.67 0.78 3.77 0.59 0.00 -0.62 -4.94 105.19 104.10 2ddf n GLY 274 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2ddf n GLY 274 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ddf s TYR 275 N -2.00 3.84 0.00 1.61 1.51 -1.26 -4.86 117.35 116.19 2ddf s TYR 275 Ca 0.00 1.55 0.00 0.00 -1.01 0.00 0.00 57.07 57.61 2ddf s TYR 275 Cb 0.00 -2.77 0.00 0.00 -0.11 0.00 0.00 41.96 39.08 2ddf s TYR 275 CO 0.00 0.42 0.00 0.41 -1.11 0.00 0.00 175.55 175.27 2ddf n GLY 276 N 1.91 3.20 2.95 0.71 0.00 -0.80 -2.53 105.19 110.63 2ddf n GLY 276 Ca -0.05 -0.73 -0.13 0.00 0.00 0.00 0.00 46.02 45.11 2ddf n GLY 276 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2ddf s ILE 277 N -2.48 0.24 -0.00 -0.61 -4.36 -1.26 -0.75 121.20 111.99 2ddf s ILE 277 Ca 0.00 -0.37 -0.04 0.00 -0.26 0.00 0.00 60.65 59.98 2ddf s ILE 277 Cb 0.00 -0.26 -0.00 0.00 1.25 0.00 0.00 42.46 43.45 2ddf s ILE 277 CO 0.00 -0.09 0.07 -1.10 0.24 0.00 0.00 174.94 174.07 2ddf s GLN 278 N -0.49 0.32 -0.07 0.37 -0.21 -0.87 -4.75 119.66 113.96 2ddf s GLN 278 Ca -0.03 -0.31 -0.28 0.00 0.02 0.00 0.00 55.36 54.77 2ddf s GLN 278 Cb -0.04 0.13 -0.02 0.00 1.00 0.00 0.00 33.01 34.08 2ddf s GLN 278 CO -0.00 -0.06 0.90 0.42 -2.12 0.00 0.00 175.29 174.42 2ddf s ILE 279 N -0.98 4.89 -0.13 1.08 1.01 -1.26 -0.16 121.20 125.65 2ddf s ILE 279 Ca -0.11 1.84 -0.12 0.00 0.00 0.00 0.00 60.65 62.27 2ddf s ILE 279 Cb -0.06 -4.22 -0.25 0.00 0.01 0.00 0.00 42.46 37.93 2ddf s ILE 279 CO 0.00 0.11 0.41 -0.08 0.00 0.00 0.00 174.94 175.38 2ddf h GLU 280 N 6.97 0.22 -2.70 2.79 4.81 -0.81 -3.45 114.58 122.41 2ddf h GLU 280 Ca -0.36 -0.37 -0.11 0.00 -0.13 0.00 0.00 59.36 58.38 2ddf h GLU 280 Cb 1.18 0.14 -0.23 0.00 0.63 0.00 0.00 28.75 30.47 2ddf h GLU 280 CO 0.79 1.18 -0.19 -1.14 -0.73 0.00 0.00 179.01 178.93 2ddf s GLN 281 N -2.50 0.58 -0.23 1.92 0.74 -1.13 -5.04 119.66 114.00 2ddf s GLN 281 Ca -0.23 0.42 -0.04 0.00 0.05 0.00 0.00 55.36 55.56 2ddf s GLN 281 Cb 0.06 0.28 -0.01 0.00 1.10 0.00 0.00 33.01 34.44 2ddf s GLN 281 CO 0.74 -0.11 -0.02 0.42 -0.55 0.00 0.00 175.29 175.77 2ddf s ILE 282 N -0.20 3.47 -0.10 -2.34 1.01 -1.26 -0.96 121.20 120.82 2ddf s ILE 282 Ca -0.04 -0.51 -0.20 0.00 0.00 0.00 0.00 60.65 59.91 2ddf s ILE 282 Cb -0.03 -2.61 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 2ddf s ILE 282 CO 0.02 0.38 0.54 -0.60 0.00 0.00 0.00 174.94 175.28 2ddf s ARG 283 N 1.48 4.36 -0.26 2.79 3.52 -0.00 -5.00 118.95 125.85 2ddf s ARG 283 Ca 0.05 0.57 0.02 0.00 -0.13 0.00 0.00 55.73 56.25 2ddf s ARG 283 Cb -0.15 -3.44 0.05 0.00 -1.56 0.00 0.00 34.95 29.86 2ddf s ARG 283 CO -0.02 0.14 -0.11 0.42 -0.81 0.00 0.00 175.30 174.92 2ddf s ILE 284 N 0.64 2.25 -0.51 4.11 1.01 -1.26 -0.58 121.20 126.86 2ddf s ILE 284 Ca 0.29 -1.54 -0.19 0.00 0.00 0.00 0.00 60.65 59.21 2ddf s ILE 284 Cb -0.16 -2.29 0.06 0.00 0.01 0.00 0.00 42.46 40.09 2ddf s ILE 284 CO 0.13 0.02 0.61 -0.76 0.00 0.00 0.00 174.94 174.94 2ddf s LEU 285 N 1.14 5.06 0.32 2.97 1.43 -0.39 -4.93 118.68 124.27 2ddf s LEU 285 Ca -0.07 -0.99 0.17 0.00 -1.03 0.00 0.00 54.13 52.21 2ddf s LEU 285 Cb -0.19 -2.41 0.25 0.00 0.03 0.00 0.00 46.19 43.87 2ddf s LEU 285 CO -0.05 -0.89 1.53 0.11 0.23 0.00 0.00 176.35 177.28 2ddf h LYS 286 N 8.99 0.00 -4.68 1.70 1.57 -1.89 -2.69 116.57 119.57 2ddf h LYS 286 Ca -0.28 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.24 2ddf h LYS 286 Cb 1.10 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.26 2ddf h LYS 286 CO 0.97 0.43 -0.65 -1.54 -0.57 0.00 0.00 179.45 178.09 2ddf s SER 287 N -6.41 0.90 0.61 0.86 1.04 -1.26 -4.85 113.70 104.60 2ddf s SER 287 Ca 0.03 -1.20 -0.18 0.00 0.48 0.00 0.00 55.95 55.08 2ddf s SER 287 Cb 0.08 0.18 -0.03 0.00 0.10 0.00 0.00 66.02 66.36 2ddf s SER 287 CO 0.72 -0.64 1.21 -2.84 0.98 0.00 0.00 173.24 172.67 2ddf s PRO 288 N -3.97 2.87 -0.22 4.02 0.02 -1.26 -4.67 135.00 131.79 2ddf s PRO 288 Ca 0.25 1.80 -0.29 0.00 0.02 0.00 0.00 61.00 62.79 2ddf s PRO 288 Cb 0.07 -1.92 -0.01 0.00 0.02 0.00 0.00 34.50 32.66 2ddf s PRO 288 CO 0.04 -1.28 1.35 -1.14 -0.33 0.00 0.00 177.00 175.64 2ddf s GLN 289 N -3.43 4.05 0.33 5.54 2.00 0.16 -4.91 119.66 123.40 2ddf s GLN 289 Ca 0.77 1.54 -0.28 0.00 -2.00 0.00 0.00 55.36 55.38 2ddf s GLN 289 Cb -0.30 -3.86 -0.10 0.00 0.80 0.00 0.00 33.01 29.56 2ddf s GLN 289 CO 0.35 -0.95 1.24 -1.21 -0.50 0.00 0.00 175.29 174.22 2ddf s GLU 290 N 3.94 4.38 0.12 1.67 2.02 -1.26 -4.23 118.70 125.35 2ddf s GLU 290 Ca 0.58 2.07 0.04 0.00 0.02 0.00 0.00 54.97 57.69 2ddf s GLU 290 Cb -0.21 -3.05 -0.04 0.00 0.10 0.00 0.00 34.13 30.93 2ddf s GLU 290 CO 0.21 -0.11 -0.11 0.14 0.02 0.00 0.00 175.26 175.41 2ddf s VAL 291 N -1.18 1.11 0.60 2.63 -7.23 -1.26 -5.06 120.40 110.01 2ddf s VAL 291 Ca 0.49 -1.85 -0.09 0.00 -1.81 0.00 0.00 61.98 58.72 2ddf s VAL 291 Cb -0.37 -1.62 -0.02 0.00 0.56 0.00 0.00 36.38 34.93 2ddf s VAL 291 CO 0.48 -0.63 0.97 -0.54 -0.31 0.00 0.00 175.10 175.07 2ddf s LYS 292 N -3.22 3.34 0.33 4.82 1.02 -1.26 -4.97 119.74 119.81 2ddf s LYS 292 Ca 0.11 0.45 -0.28 0.00 0.02 0.00 0.00 55.97 56.27 2ddf s LYS 292 Cb -0.01 -2.17 -0.13 0.00 -0.52 0.00 0.00 37.83 35.01 2ddf s LYS 292 CO 0.01 -0.59 1.24 -2.30 -0.92 0.00 0.00 175.35 172.79 2ddf n PRO 293 N -2.66 2.00 0.00 -1.68 -0.02 -1.26 -1.56 135.00 129.83 2ddf n PRO 293 Ca 0.05 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2ddf n PRO 293 Cb 0.55 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 2ddf n PRO 293 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ddf n GLY 294 N 0.84 3.07 3.84 -1.23 0.00 -1.26 -5.01 105.19 105.44 2ddf n GLY 294 Ca 0.05 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 2ddf n GLY 294 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ddf s GLU 295 N -0.14 3.96 0.21 1.61 2.12 -0.60 -5.10 118.70 120.76 2ddf s GLU 295 Ca 0.00 0.46 0.06 0.00 0.36 0.00 0.00 54.97 55.85 2ddf s GLU 295 Cb 0.00 -2.98 -0.05 0.00 0.26 0.00 0.00 34.13 31.37 2ddf s GLU 295 CO 0.00 0.51 -0.10 -1.59 -0.54 0.00 0.00 175.26 173.54 2ddf s LYS 296 N -1.85 1.32 -0.22 4.30 -2.85 -1.26 -4.65 119.74 114.53 2ddf s LYS 296 Ca 0.36 -1.61 -0.23 0.00 -1.00 0.00 0.00 55.97 53.48 2ddf s LYS 296 Cb -0.15 -0.95 0.06 0.00 -2.06 0.00 0.00 37.83 34.73 2ddf s LYS 296 CO 0.19 0.09 0.65 -1.58 0.10 0.00 0.00 175.35 174.80 2ddf s HIS 297 N -3.12 -0.70 0.60 1.78 2.46 -1.26 -5.04 115.29 110.00 2ddf s HIS 297 Ca 0.23 1.64 0.30 0.00 0.47 0.00 0.00 55.06 57.71 2ddf s HIS 297 Cb 0.02 0.26 1.81 0.00 -0.13 0.00 0.00 32.58 34.54 2ddf s HIS 297 CO 0.07 -0.38 2.20 0.10 -2.47 0.00 0.00 174.74 174.26 2ddf h TYR 298 N 4.83 0.00 -0.60 3.88 -0.00 -1.93 -1.32 116.97 121.83 2ddf h TYR 298 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.45 2ddf h TYR 298 Cb 1.16 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.89 2ddf h TYR 298 CO 0.39 0.00 0.00 -1.71 -0.00 0.00 0.00 178.16 176.84 2ddf n ASN 299 N -3.76 4.03 -4.76 0.10 5.15 -1.26 -5.00 115.26 109.77 2ddf n ASN 299 Ca -0.01 -2.27 -0.30 0.00 -0.60 0.00 0.00 54.58 51.40 2ddf n ASN 299 Cb 0.17 -0.51 0.11 0.00 -0.53 0.00 0.00 39.78 39.03 2ddf n ASN 299 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ddf s MET 300 N -1.59 1.68 0.08 1.20 0.23 -0.50 -0.66 119.30 119.74 2ddf s MET 300 Ca 0.45 0.79 -0.19 0.00 -1.03 0.00 0.00 55.69 55.71 2ddf s MET 300 Cb 0.27 -1.86 -0.08 0.00 -1.53 0.00 0.00 34.83 31.63 2ddf s MET 300 CO 0.24 -1.94 1.54 0.00 -2.03 0.00 0.00 175.02 172.84 2ddf h ALA 301 N -1.33 0.32 -2.26 3.16 0.00 -1.90 -3.44 119.26 113.80 2ddf h ALA 301 Ca -0.48 -0.20 -0.46 0.00 0.00 0.00 0.00 54.91 53.77 2ddf h ALA 301 Cb 1.27 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2ddf h ALA 301 CO 0.56 0.02 0.28 -1.59 0.00 0.00 0.00 179.25 178.52 2ddf s LYS 302 N -5.09 4.30 0.58 0.00 0.00 -1.26 -5.07 119.74 113.21 2ddf s LYS 302 Ca -0.14 1.09 -0.17 0.00 0.00 0.00 0.00 55.97 56.75 2ddf s LYS 302 Cb 0.07 -2.47 -0.04 0.00 0.00 0.00 0.00 37.83 35.39 2ddf s LYS 302 CO 0.74 0.13 1.08 -1.12 0.00 0.00 0.00 175.35 176.18 2ddf s SER 303 N -1.97 5.69 -0.01 0.03 0.01 -1.26 -4.98 113.70 111.21 2ddf s SER 303 Ca 0.55 1.94 0.02 0.00 1.31 0.00 0.00 55.95 59.77 2ddf s SER 303 Cb -0.13 -2.55 -0.00 0.00 0.21 0.00 0.00 66.02 63.55 2ddf s SER 303 CO 0.18 -1.23 -0.05 -0.47 0.41 0.00 0.00 173.24 172.07 2ddf s TYR 304 N -2.23 0.53 -2.02 2.43 6.14 -1.26 -3.03 117.35 117.90 2ddf s TYR 304 Ca 0.67 -0.10 0.28 0.00 0.64 0.00 0.00 57.07 58.55 2ddf s TYR 304 Cb -0.19 -0.36 1.04 0.00 0.42 0.00 0.00 41.96 42.87 2ddf s TYR 304 CO 0.34 -0.03 1.74 -0.35 0.64 0.00 0.00 175.55 177.89 2ddf n PRO 305 N 3.07 1.12 -3.85 4.97 -0.04 -1.26 -1.38 135.00 137.63 2ddf n PRO 305 Ca -0.14 -0.58 -0.35 0.00 -0.04 0.00 0.00 63.50 62.39 2ddf n PRO 305 Cb 0.57 -1.49 -0.13 0.00 -0.04 0.00 0.00 33.50 32.42 2ddf n PRO 305 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 2ddf s ASN 306 N -2.28 5.10 0.39 3.54 3.84 -1.26 -4.97 114.94 119.30 2ddf s ASN 306 Ca 0.32 -1.99 0.27 0.00 0.21 0.00 0.00 52.86 51.67 2ddf s ASN 306 Cb 0.20 -1.77 1.37 0.00 -0.55 0.00 0.00 41.25 40.51 2ddf s ASN 306 CO 0.43 -0.48 1.82 1.05 -2.79 0.00 0.00 177.10 177.14 2ddf h GLU 307 N 7.93 0.00 0.00 0.43 4.11 -1.93 -2.11 114.58 123.01 2ddf h GLU 307 Ca -0.11 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.32 2ddf h GLU 307 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 2ddf h GLU 307 CO 0.64 0.00 0.00 0.93 0.07 0.00 0.00 179.01 180.65 2ddf h GLU 308 N 0.00 0.00 -6.77 1.06 4.39 -1.93 -3.41 114.58 107.92 2ddf h GLU 308 Ca 0.00 0.00 -0.50 0.00 0.34 0.00 0.00 59.36 59.20 2ddf h GLU 308 Cb 0.11 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.77 2ddf h GLU 308 CO 0.00 0.00 0.05 0.15 -1.16 0.00 0.00 179.01 178.05 2ddf s LYS 309 N -3.12 3.69 0.44 2.33 3.01 -0.80 -4.99 119.74 120.30 2ddf s LYS 309 Ca 0.10 0.29 0.15 0.00 -1.01 0.00 0.00 55.97 55.51 2ddf s LYS 309 Cb 0.11 -2.45 0.98 0.00 -1.01 0.00 0.00 37.83 35.46 2ddf s LYS 309 CO 0.61 -0.01 1.96 0.22 0.51 0.00 0.00 175.35 178.64 2ddf h ASP 310 N 1.14 0.00 -4.06 2.83 3.58 -1.87 -3.42 116.42 114.63 2ddf h ASP 310 Ca -0.47 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 56.63 2ddf h ASP 310 Cb 1.19 0.00 -0.16 0.00 1.72 0.00 0.00 39.33 42.08 2ddf h ASP 310 CO 0.64 0.22 -0.73 0.00 -2.88 0.00 0.00 179.24 176.49 2ddf s ALA 311 N -4.48 1.40 0.95 -0.78 0.00 -1.26 -4.49 121.76 113.10 2ddf s ALA 311 Ca -0.04 -1.39 -0.11 0.00 0.00 0.00 0.00 51.96 50.43 2ddf s ALA 311 Cb 0.15 0.01 0.16 0.00 0.00 0.00 0.00 23.12 23.45 2ddf s ALA 311 CO 0.69 -0.04 1.10 -1.58 0.00 0.00 0.00 175.76 175.93 2ddf s TRP 312 N -2.87 1.85 0.09 0.00 0.52 -1.26 -4.57 118.94 112.70 2ddf s TRP 312 Ca 0.13 1.51 -0.31 0.00 0.02 0.00 0.00 56.10 57.44 2ddf s TRP 312 Cb -0.00 -3.21 -0.09 0.00 -1.15 0.00 0.00 33.47 29.03 2ddf s TRP 312 CO 0.01 -2.81 1.65 0.34 0.02 0.00 0.00 176.95 176.15 2ddf s ASP 313 N -2.91 6.60 0.23 2.95 2.15 -0.48 -4.77 116.67 120.45 2ddf s ASP 313 Ca 0.66 2.51 -0.06 0.00 0.43 0.00 0.00 52.55 56.09 2ddf s ASP 313 Cb -0.21 -2.57 0.22 0.00 -0.30 0.00 0.00 42.92 40.06 2ddf s ASP 313 CO 0.59 -0.88 1.80 1.62 -0.17 0.00 0.00 175.17 178.13 2ddf h VAL 314 N 4.68 1.25 -0.29 1.11 3.04 -1.93 -0.92 116.25 123.18 2ddf h VAL 314 Ca -0.43 -0.81 -0.02 0.00 -1.01 0.00 0.00 66.70 64.44 2ddf h VAL 314 Cb 1.20 0.37 -0.01 0.00 -2.01 0.00 0.00 31.29 30.84 2ddf h VAL 314 CO 0.93 0.33 0.11 0.50 -1.01 0.00 0.00 177.57 178.43 2ddf h LYS 315 N 1.09 0.45 -0.83 4.17 3.64 -1.99 -1.26 116.57 121.83 2ddf h LYS 315 Ca 0.25 -0.08 0.01 0.00 -1.27 0.00 0.00 60.65 59.55 2ddf h LYS 315 Cb 0.22 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 31.93 2ddf h LYS 315 CO -0.02 0.47 0.55 0.52 -2.27 0.00 0.00 179.45 178.70 2ddf h MET 316 N 0.32 1.09 -0.41 1.90 2.86 -1.85 -2.00 114.93 116.84 2ddf h MET 316 Ca 0.10 -0.07 -0.05 0.00 -2.06 0.00 0.00 59.70 57.63 2ddf h MET 316 Cb 0.20 -0.25 -0.02 0.00 0.06 0.00 0.00 31.60 31.59 2ddf h MET 316 CO -0.01 0.72 0.08 1.25 1.06 0.00 0.00 176.91 180.02 2ddf h LEU 317 N 1.13 0.64 -0.70 1.22 5.85 -0.78 -0.09 115.31 122.57 2ddf h LEU 317 Ca 0.31 -0.25 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 2ddf h LEU 317 Cb -0.12 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 40.70 2ddf h LEU 317 CO -0.07 0.72 0.42 0.25 -0.34 0.00 0.00 178.44 179.43 2ddf h LEU 318 N 0.52 0.84 -0.41 2.25 5.85 -0.91 0.33 115.31 123.78 2ddf h LEU 318 Ca 0.13 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.79 2ddf h LEU 318 Cb 0.35 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 2ddf h LEU 318 CO 0.01 0.65 0.27 -0.33 -0.34 0.00 0.00 178.44 178.69 2ddf h GLU 319 N 0.95 0.53 -0.40 1.25 5.08 -1.22 -1.13 114.58 119.63 2ddf h GLU 319 Ca 0.25 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.52 2ddf h GLU 319 Cb -0.03 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 2ddf h GLU 319 CO -0.05 0.35 0.03 0.37 -1.00 0.00 0.00 179.01 178.71 2ddf h GLN 320 N 0.54 0.69 -0.14 2.33 5.75 -0.62 -0.65 115.11 123.00 2ddf h GLN 320 Ca 0.15 -0.20 0.02 0.00 -0.15 0.00 0.00 58.65 58.47 2ddf h GLN 320 Cb -0.05 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.41 2ddf h GLN 320 CO -0.04 0.76 0.00 0.35 -2.65 0.00 0.00 178.83 177.25 2ddf h PHE 321 N 0.53 -0.00 -0.99 3.99 3.57 -0.83 0.23 116.94 123.43 2ddf h PHE 321 Ca 0.12 0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.68 2ddf h PHE 321 Cb 0.42 0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.12 2ddf h PHE 321 CO 0.03 -0.02 0.64 0.77 -2.23 0.00 0.00 178.31 177.51 2ddf h SER 322 N 0.05 1.05 0.31 0.41 0.02 -0.98 -0.15 113.55 114.26 2ddf h SER 322 Ca 0.07 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 2ddf h SER 322 Cb 0.08 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.40 2ddf h SER 322 CO -0.11 0.69 -0.15 0.15 -1.14 0.00 0.00 176.83 176.27 2ddf h PHE 323 N 1.20 -0.39 0.00 3.45 3.57 -0.59 -2.44 116.94 121.74 2ddf h PHE 323 Ca 0.42 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.83 2ddf h PHE 323 Cb 0.11 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 2ddf h PHE 323 CO -0.00 -0.20 -0.39 -0.44 -2.23 0.00 0.00 178.31 175.05 2ddf h ASP 324 N -0.48 0.00 -0.41 0.41 3.32 -0.38 -2.98 116.42 115.90 2ddf h ASP 324 Ca -0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.01 2ddf h ASP 324 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2ddf h ASP 324 CO 0.07 0.39 0.00 0.00 -1.72 0.00 0.00 179.24 177.98 2ddf n ILE 325 N -4.00 0.53 -0.20 0.35 0.13 -0.12 -4.70 119.36 111.35 2ddf n ILE 325 Ca -0.02 -0.71 0.01 0.00 -1.10 0.00 0.00 62.75 60.93 2ddf n ILE 325 Cb 0.43 0.79 0.11 0.00 -0.84 0.00 0.00 39.64 40.13 2ddf n ILE 325 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 2ddf h ALA 326 N 4.39 0.70 -0.29 1.51 0.00 -1.27 0.22 119.26 124.52 2ddf h ALA 326 Ca 0.00 0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.08 2ddf h ALA 326 Cb 0.89 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2ddf h ALA 326 CO 0.00 -0.33 0.14 1.49 0.00 0.00 0.00 179.25 180.55 2ddf h GLU 327 N 0.22 0.29 -0.52 0.00 4.57 -1.86 -1.63 114.58 115.66 2ddf h GLU 327 Ca 0.32 -0.02 -0.12 0.00 -1.18 0.00 0.00 59.36 58.36 2ddf h GLU 327 Cb 0.49 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 2ddf h GLU 327 CO -0.43 0.19 -0.14 0.93 -1.18 0.00 0.00 179.01 178.37 2ddf h GLU 328 N 0.29 1.01 0.00 1.92 3.07 -1.60 -3.08 114.58 116.18 2ddf h GLU 328 Ca 0.12 -0.39 -0.05 0.00 -0.50 0.00 0.00 59.36 58.54 2ddf h GLU 328 Cb 0.04 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 2ddf h GLU 328 CO -0.09 1.07 -0.25 0.00 -1.40 0.00 0.00 179.01 178.34 2ddf h ALA 329 N 0.94 1.36 0.00 3.43 0.00 -0.24 -2.11 119.26 122.64 2ddf h ALA 329 Ca 0.13 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2ddf h ALA 329 Cb 0.71 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2ddf h ALA 329 CO 0.05 0.32 0.00 0.66 0.00 0.00 0.00 179.25 180.28 2ddf h SER 330 N 0.00 0.00 -0.09 0.00 4.64 -1.21 -2.98 113.55 113.91 2ddf h SER 330 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2ddf h SER 330 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2ddf h SER 330 CO 0.03 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.28 2ddf n LYS 331 N -2.52 1.45 -4.21 4.77 5.02 -0.79 -4.86 118.16 117.02 2ddf n LYS 331 Ca -0.00 -1.57 -0.14 0.00 -2.02 0.00 0.00 58.31 54.57 2ddf n LYS 331 Cb 0.13 -1.32 -0.10 0.00 -0.02 0.00 0.00 35.03 33.72 2ddf n LYS 331 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2ddf s VAL 332 N -1.29 1.05 0.12 -0.18 -7.23 -1.13 -5.06 120.40 106.69 2ddf s VAL 332 Ca 0.21 -1.82 -0.20 0.00 -1.81 0.00 0.00 61.98 58.36 2ddf s VAL 332 Cb 0.14 -1.57 -0.05 0.00 0.56 0.00 0.00 36.38 35.46 2ddf s VAL 332 CO 0.20 -0.63 1.72 0.00 -0.31 0.00 0.00 175.10 176.09 2ddf s LEU 334 N -10.34 1.53 -0.01 0.00 1.43 -1.17 -1.25 118.68 108.88 2ddf s LEU 334 Ca -0.13 -0.23 0.06 0.00 -1.03 0.00 0.00 54.13 52.80 2ddf s LEU 334 Cb 0.10 0.71 -0.03 0.00 0.03 0.00 0.00 46.19 47.00 2ddf s LEU 334 CO 0.68 -0.39 -0.18 0.00 0.23 0.00 0.00 176.35 176.69 2ddf s ALA 335 N -1.53 2.56 -0.03 4.21 0.00 -0.17 -1.23 121.76 125.57 2ddf s ALA 335 Ca -0.14 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2ddf s ALA 335 Cb -0.07 -0.81 0.03 0.00 0.00 0.00 0.00 23.12 22.27 2ddf s ALA 335 CO 0.01 0.56 0.00 -1.58 0.00 0.00 0.00 175.76 174.75 2ddf s HIS 336 N -0.80 0.32 -0.16 0.00 2.46 -0.03 -2.54 115.29 114.54 2ddf s HIS 336 Ca 0.13 0.00 -0.17 0.00 0.47 0.00 0.00 55.06 55.49 2ddf s HIS 336 Cb -0.10 -0.42 -0.04 0.00 -0.13 0.00 0.00 32.58 31.88 2ddf s HIS 336 CO 0.02 -0.14 0.43 -1.17 -2.47 0.00 0.00 174.74 171.41 2ddf s LEU 337 N 1.09 4.21 -0.22 8.88 2.96 -0.61 -0.72 118.68 134.27 2ddf s LEU 337 Ca -0.09 0.65 -0.07 0.00 -0.22 0.00 0.00 54.13 54.41 2ddf s LEU 337 Cb -0.13 -2.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.94 2ddf s LEU 337 CO -0.02 -0.03 0.05 -0.36 -1.32 0.00 0.00 176.35 174.67 2ddf s PHE 338 N 0.96 3.10 0.38 5.38 0.40 0.58 -0.95 117.98 127.83 2ddf s PHE 338 Ca 0.22 -0.33 0.04 0.00 -0.60 0.00 0.00 56.93 56.27 2ddf s PHE 338 Cb -0.15 -2.17 -0.03 0.00 0.51 0.00 0.00 43.02 41.19 2ddf s PHE 338 CO 0.08 -0.22 0.16 -0.08 0.70 0.00 0.00 175.22 175.86 2ddf s THR 339 N 1.20 0.44 -0.38 0.64 -1.32 -0.24 -2.43 115.64 113.55 2ddf s THR 339 Ca 0.04 -2.00 0.02 0.00 -1.21 0.00 0.00 61.69 58.54 2ddf s THR 339 Cb -0.14 -2.39 0.15 0.00 -1.51 0.00 0.00 72.50 68.61 2ddf s THR 339 CO 0.03 0.00 0.31 -0.47 -2.21 0.00 0.00 174.62 172.28 2ddf s TYR 340 N -3.30 0.52 -0.06 9.09 5.04 -1.26 -2.27 117.35 125.11 2ddf s TYR 340 Ca 0.28 -1.64 -0.20 0.00 -2.44 0.00 0.00 57.07 53.08 2ddf s TYR 340 Cb 0.03 -0.75 0.04 0.00 0.35 0.00 0.00 41.96 41.63 2ddf s TYR 340 CO 0.18 -0.88 0.45 1.14 -1.34 0.00 0.00 175.55 175.10 2ddf s GLN 341 N 0.82 0.76 -0.96 4.97 -2.07 -1.26 -4.75 119.66 117.17 2ddf s GLN 341 Ca 0.23 0.12 -0.15 0.00 -1.82 0.00 0.00 55.36 53.74 2ddf s GLN 341 Cb -0.12 0.35 0.18 0.00 -1.09 0.00 0.00 33.01 32.33 2ddf s GLN 341 CO -0.06 -0.20 1.05 0.34 -1.32 0.00 0.00 175.29 175.09 2ddf s ASP 342 N -0.95 6.82 0.36 12.60 -1.08 -1.26 -4.56 116.67 128.60 2ddf s ASP 342 Ca -0.10 -2.58 -0.28 0.00 -0.52 0.00 0.00 52.55 49.07 2ddf s ASP 342 Cb -0.03 -2.31 -0.12 0.00 -1.46 0.00 0.00 42.92 39.00 2ddf s ASP 342 CO 0.05 -0.76 1.36 0.49 0.52 0.00 0.00 175.17 176.83 2ddf n PHE 343 N 5.11 2.54 -1.57 -5.34 3.72 -1.26 -4.28 117.46 116.37 2ddf n PHE 343 Ca 0.22 0.51 -0.43 0.00 -0.05 0.00 0.00 57.45 57.71 2ddf n PHE 343 Cb 0.46 -2.46 0.00 0.00 -0.94 0.00 0.00 39.48 36.55 2ddf n PHE 343 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 2ddf n ASP 344 N 0.62 0.88 -2.53 4.37 4.64 -1.26 -3.43 116.55 119.84 2ddf n ASP 344 Ca 0.03 1.06 -0.21 0.00 -1.38 0.00 0.00 54.79 54.30 2ddf n ASP 344 Cb 0.37 -1.29 -0.00 0.00 -1.04 0.00 0.00 41.12 39.17 2ddf n ASP 344 CO 0.00 0.00 0.00 0.23 -0.82 0.00 0.00 177.20 176.61 2ddf n MET 345 N 0.43 -2.37 -0.63 -0.67 2.81 -1.26 -3.02 117.12 112.41 2ddf n MET 345 Ca 0.10 1.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.99 2ddf n MET 345 Cb 0.36 -5.71 0.00 0.00 -0.71 0.00 0.00 33.22 27.17 2ddf n MET 345 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ddf n GLY 346 N -1.13 0.76 3.75 3.03 0.00 -1.22 -5.03 105.19 105.35 2ddf n GLY 346 Ca -0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.39 2ddf n GLY 346 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ddf s THR 347 N -2.72 2.46 -0.05 2.61 2.01 -1.17 -4.93 115.64 113.86 2ddf s THR 347 Ca 0.00 0.39 0.10 0.00 0.31 0.00 0.00 61.69 62.49 2ddf s THR 347 Cb 0.00 -3.25 -0.14 0.00 0.01 0.00 0.00 72.50 69.12 2ddf s THR 347 CO 0.00 0.07 0.15 0.18 -0.69 0.00 0.00 174.62 174.32 2ddf n LEU 348 N 2.10 0.00 -3.93 4.42 4.77 -1.26 -4.31 117.00 118.80 2ddf n LEU 348 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 2ddf n LEU 348 Cb 0.39 0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.60 2ddf n LEU 348 CO 0.62 0.10 0.97 -0.83 -1.33 0.00 0.00 177.39 176.92 2ddf s GLY 349 N -3.60 -0.04 -0.09 -0.72 0.00 -1.26 -0.64 107.32 100.97 2ddf s GLY 349 Ca -0.04 -0.10 -0.30 0.00 0.00 0.00 0.00 44.72 44.28 2ddf s GLY 349 CO 0.41 3.98 0.82 -2.27 0.00 0.00 0.00 173.10 176.04 2ddf s LEU 350 N -3.59 -0.53 0.07 0.66 2.96 -0.87 -5.00 118.68 112.38 2ddf s LEU 350 Ca 0.25 0.55 -0.17 0.00 -0.22 0.00 0.00 54.13 54.55 2ddf s LEU 350 Cb -0.01 2.24 0.03 0.00 0.50 0.00 0.00 46.19 48.95 2ddf s LEU 350 CO 0.02 -0.50 0.39 0.00 -1.32 0.00 0.00 176.35 174.94 2ddf s ALA 351 N -1.25 -0.93 0.27 5.97 0.00 -1.26 -0.31 121.76 124.24 2ddf s ALA 351 Ca -0.06 0.14 -0.12 0.00 0.00 0.00 0.00 51.96 51.92 2ddf s ALA 351 Cb -0.00 0.46 -0.08 0.00 0.00 0.00 0.00 23.12 23.50 2ddf s ALA 351 CO 0.06 -0.52 0.63 0.71 0.00 0.00 0.00 175.76 176.63 2ddf s TYR 352 N -2.97 3.40 0.00 0.00 2.02 -0.95 -4.95 117.35 113.91 2ddf s TYR 352 Ca -0.02 1.01 0.00 0.00 -0.37 0.00 0.00 57.07 57.69 2ddf s TYR 352 Cb 0.00 -2.37 0.00 0.00 -0.40 0.00 0.00 41.96 39.19 2ddf s TYR 352 CO -0.06 0.19 0.00 0.41 -1.57 0.00 0.00 175.55 174.52 2ddf n GLY 353 N -0.26 2.47 3.28 0.71 0.00 -1.25 -3.40 105.19 106.74 2ddf n GLY 353 Ca 0.02 -1.80 -0.24 0.00 0.00 0.00 0.00 46.02 44.00 2ddf n GLY 353 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddf n GLY 354 N 1.30 -0.52 3.48 -0.02 0.00 -1.15 -4.53 105.19 103.75 2ddf n GLY 354 Ca 0.00 0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2ddf n GLY 354 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ddf s SER 355 N -2.89 4.31 -0.76 1.61 0.15 -1.26 -4.01 113.70 110.85 2ddf s SER 355 Ca 0.41 -0.17 -0.07 0.00 0.70 0.00 0.00 55.95 56.82 2ddf s SER 355 Cb -0.19 -1.29 -0.15 0.00 -1.71 0.00 0.00 66.02 62.67 2ddf s SER 355 CO 0.51 0.27 2.96 -0.81 1.20 0.00 0.00 173.24 177.38 2ddf n PRO 356 N 2.81 2.54 -0.64 5.44 -0.04 -1.26 -5.10 135.00 138.76 2ddf n PRO 356 Ca -0.18 -1.46 0.00 0.00 -0.04 0.00 0.00 63.50 61.82 2ddf n PRO 356 Cb 0.53 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.64 2ddf n PRO 356 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2ddf n HIS 361 N 3.20 0.00 0.00 0.54 -0.00 -1.26 -5.28 115.22 112.42 2ddf n HIS 361 Ca 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.26 2ddf n HIS 361 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.47 2ddf n HIS 361 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2ddf n GLY 362 N 4.23 0.58 0.00 -1.41 0.00 -1.26 -3.99 105.19 103.34 2ddf n GLY 362 Ca 0.00 -2.13 0.00 0.00 0.00 0.00 0.00 46.02 43.89 2ddf n GLY 362 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddf n GLY 363 N 0.00 -0.07 3.74 -0.02 0.00 -0.00 -3.90 105.19 104.94 2ddf n GLY 363 Ca 0.00 -2.01 -0.41 0.00 0.00 0.00 0.00 46.02 43.60 2ddf n GLY 363 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ddf n VAL 364 N 0.00 2.34 -0.77 1.61 0.24 -0.13 -3.83 118.33 117.79 2ddf n VAL 364 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.80 2ddf n VAL 364 Cb 0.00 -1.76 0.00 0.00 -1.47 0.00 0.00 33.84 30.61 2ddf n VAL 364 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ddf s PRO 366 N -2.91 4.18 -0.12 0.00 0.04 -1.26 -4.66 135.00 130.27 2ddf s PRO 366 Ca 0.00 2.47 0.02 0.00 0.04 0.00 0.00 61.00 63.53 2ddf s PRO 366 Cb 0.00 -3.10 0.01 0.00 0.04 0.00 0.00 34.50 31.46 2ddf s PRO 366 CO 0.00 -0.63 -0.17 0.21 0.04 0.00 0.00 177.00 176.45 2ddf s LYS 367 N 0.58 2.43 0.41 4.56 2.20 -1.26 -4.95 119.74 123.71 2ddf s LYS 367 Ca 0.68 -0.64 -0.24 0.00 -0.36 0.00 0.00 55.97 55.42 2ddf s LYS 367 Cb -0.46 -2.04 -0.09 0.00 -1.51 0.00 0.00 37.83 33.73 2ddf s LYS 367 CO 0.37 -0.06 1.05 0.00 -0.36 0.00 0.00 175.35 176.35 2ddf s ALA 368 N 0.97 3.06 -0.06 3.13 0.00 -1.26 -1.38 121.76 126.22 2ddf s ALA 368 Ca -0.06 0.69 -0.01 0.00 0.00 0.00 0.00 51.96 52.59 2ddf s ALA 368 Cb -0.15 -3.27 0.03 0.00 0.00 0.00 0.00 23.12 19.73 2ddf s ALA 368 CO -0.02 -0.23 -0.01 -0.47 0.00 0.00 0.00 175.76 175.02 2ddf s TYR 369 N -1.70 0.71 -0.34 0.00 6.14 -0.01 -4.92 117.35 117.23 2ddf s TYR 369 Ca 0.59 -0.20 -0.28 0.00 0.64 0.00 0.00 57.07 57.83 2ddf s TYR 369 Cb -0.21 -0.77 0.02 0.00 0.42 0.00 0.00 41.96 41.41 2ddf s TYR 369 CO 0.27 -0.29 1.01 -0.47 0.64 0.00 0.00 175.55 176.70 2ddf s TYR 370 N 1.63 3.12 -0.42 4.97 5.04 -1.26 -1.21 117.35 129.22 2ddf s TYR 370 Ca -0.00 1.03 -0.25 0.00 -2.44 0.00 0.00 57.07 55.41 2ddf s TYR 370 Cb -0.13 -3.66 0.02 0.00 0.35 0.00 0.00 41.96 38.55 2ddf s TYR 370 CO -0.04 -0.78 0.89 0.45 -1.34 0.00 0.00 175.55 174.73 2ddf s SER 371 N 1.74 6.54 0.31 4.32 0.15 -0.70 -4.91 113.70 121.15 2ddf s SER 371 Ca 0.42 0.25 0.00 0.00 0.70 0.00 0.00 55.95 57.32 2ddf s SER 371 Cb -0.12 -2.44 0.50 0.00 -1.71 0.00 0.00 66.02 62.25 2ddf s SER 371 CO 0.16 -0.94 1.91 -0.65 1.20 0.00 0.00 173.24 174.92 2ddf h PRO 372 N 8.83 0.85 -0.12 5.44 0.11 -1.94 0.25 132.00 145.42 2ddf h PRO 372 Ca -0.24 -0.11 -0.08 0.00 0.11 0.00 0.00 66.00 65.68 2ddf h PRO 372 Cb 1.08 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.03 2ddf h PRO 372 CO 0.99 0.67 -0.25 0.28 -0.21 0.00 0.00 178.00 179.48 2ddf h VAL 373 N 0.85 1.38 0.00 3.15 2.07 -1.97 -3.28 116.25 118.45 2ddf h VAL 373 Ca 0.21 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.21 2ddf h VAL 373 Cb 0.10 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2ddf h VAL 373 CO -0.03 0.45 0.00 1.23 0.02 0.00 0.00 177.57 179.24 2ddf h GLY 374 N -0.04 0.00 -2.56 2.17 0.00 -1.87 -3.47 103.07 97.31 2ddf h GLY 374 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 47.33 46.93 2ddf h GLY 374 CO 0.05 0.00 -0.49 0.28 0.00 0.00 0.00 176.54 176.38 2ddf n LYS 375 N -2.82 -1.58 -3.79 4.80 4.76 0.86 -4.98 118.16 115.42 2ddf n LYS 375 Ca 0.02 1.02 -0.08 0.00 -2.87 0.00 0.00 58.31 56.40 2ddf n LYS 375 Cb 0.36 -5.60 -0.02 0.00 -1.84 0.00 0.00 35.03 27.93 2ddf n LYS 375 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 2ddf s LYS 376 N -4.79 1.66 0.18 1.97 -2.85 -1.23 -4.99 119.74 109.70 2ddf s LYS 376 Ca 0.00 -0.91 -0.30 0.00 -1.00 0.00 0.00 55.97 53.76 2ddf s LYS 376 Cb 0.00 0.59 -0.08 0.00 -2.06 0.00 0.00 37.83 36.28 2ddf s LYS 376 CO 0.00 -0.75 1.09 -0.80 0.10 0.00 0.00 175.35 174.99 2ddf s ASN 377 N -2.89 7.29 0.38 0.03 0.01 -1.26 -1.72 114.94 116.76 2ddf s ASN 377 Ca 0.10 2.09 0.08 0.00 -0.71 0.00 0.00 52.86 54.42 2ddf s ASN 377 Cb -0.04 -2.60 -0.06 0.00 0.41 0.00 0.00 41.25 38.95 2ddf s ASN 377 CO 0.03 -0.20 0.06 0.27 -1.51 0.00 0.00 177.10 175.75 2ddf s ILE 378 N -0.32 2.38 0.06 0.60 -4.36 -0.35 -4.94 121.20 114.27 2ddf s ILE 378 Ca 0.49 -1.91 0.09 0.00 -0.26 0.00 0.00 60.65 59.06 2ddf s ILE 378 Cb -0.29 -2.89 -0.03 0.00 1.25 0.00 0.00 42.46 40.50 2ddf s ILE 378 CO 0.35 -0.10 -0.25 -0.31 0.24 0.00 0.00 174.94 174.87 2ddf s TYR 379 N -2.59 2.22 -0.34 1.37 1.51 -1.26 -0.83 117.35 117.43 2ddf s TYR 379 Ca 0.37 -0.40 0.11 0.00 -1.01 0.00 0.00 57.07 56.13 2ddf s TYR 379 Cb 0.03 -1.31 0.71 0.00 -0.11 0.00 0.00 41.96 41.28 2ddf s TYR 379 CO 0.20 0.15 1.65 1.28 -1.11 0.00 0.00 175.55 177.72 2ddf n LEU 380 N 1.64 5.42 -3.40 -1.29 4.77 -0.48 -4.61 117.00 119.05 2ddf n LEU 380 Ca -0.17 -2.78 -0.39 0.00 -0.03 0.00 0.00 56.01 52.64 2ddf n LEU 380 Cb 0.52 -0.69 0.01 0.00 -2.33 0.00 0.00 43.42 40.93 2ddf n LEU 380 CO 0.23 0.65 1.77 -0.46 -1.33 0.00 0.00 177.39 178.25 2ddf n ASN 381 N 0.30 7.53 -4.08 -1.43 6.94 -1.25 -0.82 115.26 122.45 2ddf n ASN 381 Ca 0.30 -3.49 -0.10 0.00 -0.02 0.00 0.00 54.58 51.27 2ddf n ASN 381 Cb 1.17 -1.22 -0.09 0.00 -2.36 0.00 0.00 39.78 37.28 2ddf n ASN 381 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 2ddf s SER 382 N -0.62 0.21 0.07 0.53 1.04 -1.26 -1.00 113.70 112.66 2ddf s SER 382 Ca 0.47 -1.08 -0.28 0.00 0.48 0.00 0.00 55.95 55.54 2ddf s SER 382 Cb 0.24 0.35 0.09 0.00 0.10 0.00 0.00 66.02 66.79 2ddf s SER 382 CO -0.16 -0.79 1.10 -0.83 0.98 0.00 0.00 173.24 173.54 2ddf s GLY 383 N -3.02 -0.32 0.08 7.32 0.00 -1.05 -2.24 107.32 108.09 2ddf s GLY 383 Ca 0.21 0.44 -0.11 0.00 0.00 0.00 0.00 44.72 45.26 2ddf s GLY 383 CO 0.01 0.08 0.25 0.48 0.00 0.00 0.00 173.10 173.93 2ddf s LEU 384 N -2.92 1.11 -0.03 0.66 0.05 0.58 -1.57 118.68 116.56 2ddf s LEU 384 Ca 0.13 -0.44 0.01 0.00 0.05 0.00 0.00 54.13 53.87 2ddf s LEU 384 Cb 0.01 1.24 0.02 0.00 -2.05 0.00 0.00 46.19 45.41 2ddf s LEU 384 CO -0.01 -0.70 -0.04 -0.89 -0.55 0.00 0.00 176.35 174.16 2ddf s THR 385 N -3.35 0.42 -0.08 5.48 2.01 -0.12 -2.05 115.64 117.94 2ddf s THR 385 Ca 0.01 -0.11 -0.01 0.00 0.31 0.00 0.00 61.69 61.89 2ddf s THR 385 Cb 0.02 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 72.06 2ddf s THR 385 CO -0.08 0.17 -0.01 -0.55 -0.69 0.00 0.00 174.62 173.46 2ddf s SER 386 N 0.61 5.11 -0.17 3.53 0.15 0.19 -1.08 113.70 122.04 2ddf s SER 386 Ca -0.07 0.11 0.16 0.00 0.70 0.00 0.00 55.95 56.84 2ddf s SER 386 Cb -0.11 -1.41 0.71 0.00 -1.71 0.00 0.00 66.02 63.50 2ddf s SER 386 CO -0.00 0.37 1.63 0.35 1.20 0.00 0.00 173.24 176.79 2ddf n THR 387 N 2.18 2.23 -4.76 6.45 -2.24 -0.96 -4.84 114.28 112.34 2ddf n THR 387 Ca -0.18 -1.39 -0.33 0.00 -2.27 0.00 0.00 64.05 59.88 2ddf n THR 387 Cb 0.53 -0.07 -0.13 0.00 -2.10 0.00 0.00 70.33 68.56 2ddf n THR 387 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2ddf s LYS 388 N -2.32 3.00 -0.22 -0.78 2.20 -1.26 -1.04 119.74 119.32 2ddf s LYS 388 Ca 0.50 -0.65 -0.12 0.00 -0.36 0.00 0.00 55.97 55.33 2ddf s LYS 388 Cb 0.36 -2.56 0.07 0.00 -1.51 0.00 0.00 37.83 34.19 2ddf s LYS 388 CO 0.18 0.43 0.54 1.21 -0.36 0.00 0.00 175.35 177.36 2ddf s ASN 389 N -0.21 -0.72 -1.34 1.43 2.47 -0.47 -4.48 114.94 111.62 2ddf s ASN 389 Ca 0.01 1.20 -0.02 0.00 0.42 0.00 0.00 52.86 54.47 2ddf s ASN 389 Cb -0.13 1.12 0.01 0.00 -1.45 0.00 0.00 41.25 40.81 2ddf s ASN 389 CO 0.03 -0.22 0.75 -1.22 -3.72 0.00 0.00 177.10 172.72 2ddf n TYR 390 N 4.38 -1.99 -1.12 0.43 4.01 -1.26 -2.76 117.16 118.85 2ddf n TYR 390 Ca -0.21 0.85 -0.04 0.00 -0.16 0.00 0.00 57.90 58.34 2ddf n TYR 390 Cb 0.56 -4.36 -0.02 0.00 -0.31 0.00 0.00 39.34 35.21 2ddf n TYR 390 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ddf n GLY 391 N -1.59 0.66 3.29 2.72 0.00 -1.26 -4.99 105.19 104.01 2ddf n GLY 391 Ca -0.25 -0.32 -0.09 0.00 0.00 0.00 0.00 46.02 45.36 2ddf n GLY 391 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ddf s LYS 392 N -1.74 1.04 0.13 1.61 -2.85 -1.11 -5.13 119.74 111.69 2ddf s LYS 392 Ca 0.00 -1.08 -0.31 0.00 -1.00 0.00 0.00 55.97 53.58 2ddf s LYS 392 Cb 0.00 0.37 -0.08 0.00 -2.06 0.00 0.00 37.83 36.06 2ddf s LYS 392 CO 0.00 -0.37 1.39 0.99 0.10 0.00 0.00 175.35 177.46 2ddf s THR 393 N -3.92 3.26 0.73 3.79 2.01 -1.26 -1.37 115.64 118.87 2ddf s THR 393 Ca 0.12 0.92 -0.11 0.00 0.31 0.00 0.00 61.69 62.93 2ddf s THR 393 Cb 0.04 -3.59 0.03 0.00 0.01 0.00 0.00 72.50 68.99 2ddf s THR 393 CO -0.04 0.08 1.07 0.27 -0.69 0.00 0.00 174.62 175.31 2ddf s ILE 394 N 0.96 3.69 0.64 1.82 -4.36 -0.20 -4.93 121.20 118.82 2ddf s ILE 394 Ca 0.64 0.55 -0.17 0.00 -0.26 0.00 0.00 60.65 61.40 2ddf s ILE 394 Cb -0.37 -3.19 -0.01 0.00 1.25 0.00 0.00 42.46 40.13 2ddf s ILE 394 CO 0.32 -0.72 1.20 -0.76 0.24 0.00 0.00 174.94 175.21 2ddf s LEU 395 N -5.71 3.54 0.37 0.37 1.43 -1.26 -4.80 118.68 112.62 2ddf s LEU 395 Ca 0.59 2.33 0.09 0.00 -1.03 0.00 0.00 54.13 56.12 2ddf s LEU 395 Cb -0.15 -4.59 0.84 0.00 0.03 0.00 0.00 46.19 42.32 2ddf s LEU 395 CO 0.55 -1.78 1.91 0.71 0.23 0.00 0.00 176.35 177.98 2ddf h THR 396 N 0.46 0.89 0.00 5.49 1.35 -1.99 0.80 112.91 119.92 2ddf h THR 396 Ca -0.49 -0.22 -0.05 0.00 -0.55 0.00 0.00 66.41 65.09 2ddf h THR 396 Cb 1.29 0.18 -0.01 0.00 -1.73 0.00 0.00 68.15 67.89 2ddf h THR 396 CO 0.54 0.12 -0.23 0.07 -0.25 0.00 0.00 175.52 175.76 2ddf h LYS 397 N 0.65 0.00 0.11 4.72 2.10 -1.97 -1.09 116.57 121.09 2ddf h LYS 397 Ca 0.38 0.00 -0.24 0.00 -2.00 0.00 0.00 60.65 58.80 2ddf h LYS 397 Cb 0.58 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.93 2ddf h LYS 397 CO -0.15 0.23 -0.99 0.93 -2.00 0.00 0.00 179.45 177.47 2ddf h GLU 398 N 0.00 0.47 -0.62 0.07 5.08 -1.56 -3.25 114.58 114.78 2ddf h GLU 398 Ca -0.00 -0.66 0.03 0.00 -1.00 0.00 0.00 59.36 57.73 2ddf h GLU 398 Cb 0.47 0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.90 2ddf h GLU 398 CO 0.03 1.28 0.37 0.00 -1.00 0.00 0.00 179.01 179.69 2ddf h ALA 399 N 0.22 0.80 -0.83 3.43 0.00 -0.37 -1.82 119.26 120.69 2ddf h ALA 399 Ca -0.16 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.84 2ddf h ALA 399 Cb 1.72 -0.17 -0.07 0.00 0.00 0.00 0.00 17.79 19.27 2ddf h ALA 399 CO 0.19 0.10 0.48 -0.44 0.00 0.00 0.00 179.25 179.58 2ddf h ASP 400 N 0.72 0.69 -0.55 0.00 3.32 -1.34 -1.72 116.42 117.55 2ddf h ASP 400 Ca 0.25 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.27 2ddf h ASP 400 Cb 0.05 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.49 2ddf h ASP 400 CO -0.12 0.40 0.04 -0.07 -1.72 0.00 0.00 179.24 177.77 2ddf h LEU 401 N 0.81 0.92 0.45 1.55 3.38 -1.43 -1.03 115.31 119.96 2ddf h LEU 401 Ca 0.40 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 2ddf h LEU 401 Cb 0.36 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2ddf h LEU 401 CO -0.24 0.98 -0.22 0.58 0.09 0.00 0.00 178.44 179.62 2ddf h VAL 402 N 0.83 0.54 -0.47 1.22 2.07 -0.64 -0.57 116.25 119.23 2ddf h VAL 402 Ca 0.16 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.62 2ddf h VAL 402 Cb 0.48 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 2ddf h VAL 402 CO 0.02 0.00 0.06 0.74 0.02 0.00 0.00 177.57 178.41 2ddf h THR 403 N -0.62 1.22 -0.38 2.57 2.02 -1.32 -0.61 112.91 115.80 2ddf h THR 403 Ca -0.06 -0.87 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 2ddf h THR 403 Cb 0.48 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.68 2ddf h THR 403 CO 0.09 0.31 0.18 0.74 0.37 0.00 0.00 175.52 177.21 2ddf h THR 404 N 0.71 1.17 -0.18 3.16 2.02 -1.05 -0.59 112.91 118.15 2ddf h THR 404 Ca 0.15 -0.49 0.02 0.00 0.77 0.00 0.00 66.41 66.86 2ddf h THR 404 Cb 0.35 0.80 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 2ddf h THR 404 CO 0.01 0.18 0.06 -0.74 0.37 0.00 0.00 175.52 175.40 2ddf h HIS 405 N 0.47 0.10 -0.32 3.16 6.17 -0.37 0.15 115.15 124.52 2ddf h HIS 405 Ca 0.13 0.01 -0.06 0.00 0.71 0.00 0.00 60.37 61.15 2ddf h HIS 405 Cb 0.13 -0.02 -0.01 0.00 2.52 0.00 0.00 27.41 30.03 2ddf h HIS 405 CO -0.01 0.05 -0.05 0.93 0.71 0.00 0.00 177.93 179.55 2ddf h GLU 406 N 0.14 0.60 0.00 5.26 4.39 -0.99 -1.56 114.58 122.41 2ddf h GLU 406 Ca 0.08 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.54 2ddf h GLU 406 Cb 0.05 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 2ddf h GLU 406 CO -0.09 0.77 -0.08 -0.07 -1.16 0.00 0.00 179.01 178.38 2ddf h LEU 407 N 0.38 0.00 -0.50 1.33 3.38 -1.06 -1.72 115.31 117.12 2ddf h LEU 407 Ca 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2ddf h LEU 407 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2ddf h LEU 407 CO 0.03 0.08 0.21 1.23 0.09 0.00 0.00 178.44 180.08 2ddf h GLY 408 N 0.27 0.80 0.70 0.83 0.00 0.26 0.62 103.07 106.55 2ddf h GLY 408 Ca -0.00 -0.43 0.04 0.00 0.00 0.00 0.00 47.33 46.94 2ddf h GLY 408 CO 0.01 0.40 0.20 0.45 0.00 0.00 0.00 176.54 177.60 2ddf h HIS 409 N 0.67 0.36 -0.89 5.60 3.86 -0.96 -0.45 115.15 123.34 2ddf h HIS 409 Ca 0.17 0.02 0.09 0.00 -1.16 0.00 0.00 60.37 59.49 2ddf h HIS 409 Cb 0.18 -0.10 -0.07 0.00 1.06 0.00 0.00 27.41 28.48 2ddf h HIS 409 CO 0.00 0.17 0.54 -0.91 0.86 0.00 0.00 177.93 178.59 2ddf h ASN 410 N 0.40 0.80 0.49 2.45 -0.26 -0.62 0.14 115.58 118.99 2ddf h ASN 410 Ca 0.20 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 55.98 2ddf h ASN 410 Cb 0.14 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.28 2ddf h ASN 410 CO -0.17 0.46 0.00 0.49 -1.06 0.00 0.00 177.43 177.16 2ddf n PHE 411 N -4.67 0.00 0.00 1.19 3.01 0.15 -0.96 117.46 116.18 2ddf n PHE 411 Ca 0.15 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.61 2ddf n PHE 411 Cb 0.27 -0.33 0.00 0.00 -0.01 0.00 0.00 39.48 39.42 2ddf n PHE 411 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ddf n GLY 412 N 0.68 0.89 3.75 1.37 0.00 0.49 -4.54 105.19 107.83 2ddf n GLY 412 Ca 0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.72 2ddf n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ddf s ALA 413 N -2.00 3.34 0.65 4.61 0.00 -0.24 -4.38 121.76 123.73 2ddf s ALA 413 Ca 0.00 0.63 0.01 0.00 0.00 0.00 0.00 51.96 52.60 2ddf s ALA 413 Cb 0.00 -3.22 0.09 0.00 0.00 0.00 0.00 23.12 19.99 2ddf s ALA 413 CO 0.00 0.19 0.90 -1.21 0.00 0.00 0.00 175.76 175.63 2ddf s GLU 414 N -1.24 2.05 0.34 0.00 2.02 -1.26 -3.98 118.70 116.63 2ddf s GLU 414 Ca 0.42 -1.04 -0.29 0.00 0.02 0.00 0.00 54.97 54.08 2ddf s GLU 414 Cb -0.26 -2.42 -0.10 0.00 0.10 0.00 0.00 34.13 31.45 2ddf s GLU 414 CO 0.32 -1.13 1.34 -1.01 0.02 0.00 0.00 175.26 174.80 2ddf s HIS 415 N -2.96 2.98 0.14 1.61 3.76 -1.26 -4.85 115.29 114.71 2ddf s HIS 415 Ca 0.63 1.37 -0.31 0.00 -0.15 0.00 0.00 55.06 56.60 2ddf s HIS 415 Cb -0.07 -3.73 -0.10 0.00 1.11 0.00 0.00 32.58 29.79 2ddf s HIS 415 CO 0.42 -2.04 1.58 -0.51 -0.85 0.00 0.00 174.74 173.34 2ddf s ASP 416 N -0.42 6.60 0.05 1.40 1.01 -0.55 -4.98 116.67 119.79 2ddf s ASP 416 Ca 0.50 2.57 -0.15 0.00 0.71 0.00 0.00 52.55 56.18 2ddf s ASP 416 Cb -0.41 -2.59 -0.06 0.00 1.01 0.00 0.00 42.92 40.88 2ddf s ASP 416 CO 0.54 -0.83 0.46 -2.16 0.21 0.00 0.00 175.17 173.39 2ddf s PRO 417 N 1.52 3.95 0.47 8.23 0.04 -1.26 -4.51 135.00 143.43 2ddf s PRO 417 Ca 0.71 0.45 0.20 0.00 0.04 0.00 0.00 61.00 62.40 2ddf s PRO 417 Cb -0.42 -3.13 1.19 0.00 0.04 0.00 0.00 34.50 32.17 2ddf s PRO 417 CO 0.31 0.62 1.93 -0.44 0.04 0.00 0.00 177.00 179.47 2ddf h ASP 418 N 4.30 0.24 0.35 6.66 3.32 -1.95 -2.28 116.42 127.07 2ddf h ASP 418 Ca -0.50 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2ddf h ASP 418 Cb 1.21 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2ddf h ASP 418 CO 0.63 0.12 0.00 0.61 -1.72 0.00 0.00 179.24 178.89 2ddf n GLY 419 N -1.57 -0.85 3.01 2.75 0.00 -1.26 -3.97 105.19 103.29 2ddf n GLY 419 Ca 0.14 -0.07 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 2ddf n GLY 419 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ddf s LEU 420 N -2.70 4.68 0.42 0.99 1.43 -0.86 -4.99 118.68 117.66 2ddf s LEU 420 Ca 0.12 -2.66 0.18 0.00 -1.03 0.00 0.00 54.13 50.75 2ddf s LEU 420 Cb 0.10 -1.69 1.10 0.00 0.03 0.00 0.00 46.19 45.73 2ddf s LEU 420 CO 0.24 -0.32 1.85 0.00 0.23 0.00 0.00 176.35 178.35 2ddf h ALA 421 N 7.04 2.23 -0.74 4.21 0.00 -1.82 0.12 119.26 130.30 2ddf h ALA 421 Ca -0.06 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.90 2ddf h ALA 421 Cb 0.95 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.68 2ddf h ALA 421 CO 0.65 -0.52 0.49 1.49 0.00 0.00 0.00 179.25 181.35 2ddf h GLU 422 N 0.39 0.86 -0.00 0.00 4.81 -1.94 -2.64 114.58 116.05 2ddf h GLU 422 Ca 0.47 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 2ddf h GLU 422 Cb 1.20 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.39 2ddf h GLU 422 CO -0.17 0.57 -0.62 0.00 -0.73 0.00 0.00 179.01 178.05 2ddf n ALA 424 N -1.17 1.51 -1.20 0.00 0.00 -0.77 -4.44 120.51 114.44 2ddf n ALA 424 Ca 0.07 -2.85 -0.31 0.00 0.00 0.00 0.00 53.44 50.34 2ddf n ALA 424 Cb 0.35 -0.94 0.10 0.00 0.00 0.00 0.00 19.45 18.96 2ddf n ALA 424 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2ddf s PRO 425 N -0.56 2.13 0.84 0.00 0.02 -1.09 -4.67 135.00 131.68 2ddf s PRO 425 Ca 0.34 1.21 -0.11 0.00 0.02 0.00 0.00 61.00 62.45 2ddf s PRO 425 Cb 0.16 -1.88 0.10 0.00 0.02 0.00 0.00 34.50 32.90 2ddf s PRO 425 CO -0.15 -1.74 1.10 -0.80 -0.33 0.00 0.00 177.00 175.08 2ddf s ASN 426 N -3.31 4.05 0.53 2.53 0.01 -1.26 -3.97 114.94 113.51 2ddf s ASN 426 Ca 0.62 1.37 0.19 0.00 -0.71 0.00 0.00 52.86 54.33 2ddf s ASN 426 Cb -0.18 -2.08 1.32 0.00 0.41 0.00 0.00 41.25 40.72 2ddf s ASN 426 CO 0.56 -2.26 2.11 1.05 -1.51 0.00 0.00 177.10 177.05 2ddf h GLU 427 N -1.29 0.00 -0.40 -0.60 9.09 -1.93 -0.62 114.58 118.83 2ddf h GLU 427 Ca -0.48 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.93 2ddf h GLU 427 Cb 1.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.38 2ddf h GLU 427 CO 0.57 0.00 0.00 -0.40 0.05 0.00 0.00 179.01 179.23 2ddf n ASP 428 N -4.47 2.19 -0.43 3.06 3.85 -1.26 -3.41 116.55 116.08 2ddf n ASP 428 Ca 0.01 -1.99 0.07 0.00 -0.71 0.00 0.00 54.79 52.17 2ddf n ASP 428 Cb 0.24 -0.27 0.15 0.00 -1.35 0.00 0.00 41.12 39.89 2ddf n ASP 428 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2ddf n GLN 429 N 0.70 1.19 0.00 0.11 6.02 -0.54 -4.95 117.38 119.91 2ddf n GLN 429 Ca 0.14 -2.69 0.00 0.00 -0.01 0.00 0.00 57.00 54.44 2ddf n GLN 429 Cb 0.35 -1.34 0.00 0.00 1.02 0.00 0.00 30.24 30.27 2ddf n GLN 429 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ddf n GLY 430 N -1.03 0.57 7.00 1.08 0.00 -1.20 -4.82 105.19 106.78 2ddf n GLY 430 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2ddf n GLY 430 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ddf n GLY 431 N -1.41 -0.48 3.87 -0.02 0.00 -0.35 -0.16 105.19 106.64 2ddf n GLY 431 Ca 0.00 -1.07 -0.31 0.00 0.00 0.00 0.00 46.02 44.64 2ddf n GLY 431 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ddf s LYS 432 N 0.00 3.74 0.69 1.61 -0.14 -1.25 -3.99 119.74 120.39 2ddf s LYS 432 Ca 0.00 0.71 -0.02 0.00 -1.36 0.00 0.00 55.97 55.30 2ddf s LYS 432 Cb 0.00 -2.18 0.10 0.00 -1.68 0.00 0.00 37.83 34.07 2ddf s LYS 432 CO 0.00 -0.35 0.96 0.71 -0.76 0.00 0.00 175.35 175.91 2ddf s TYR 433 N -2.82 2.11 0.33 3.18 2.02 -1.26 -2.36 117.35 118.55 2ddf s TYR 433 Ca 0.55 -0.07 0.19 0.00 -0.37 0.00 0.00 57.07 57.36 2ddf s TYR 433 Cb -0.10 -3.02 0.92 0.00 -0.40 0.00 0.00 41.96 39.36 2ddf s TYR 433 CO 0.42 -1.50 1.87 -0.24 -1.57 0.00 0.00 175.55 174.53 2ddf h VAL 434 N -0.44 0.95 -0.16 0.71 3.04 -1.19 -2.22 116.25 116.93 2ddf h VAL 434 Ca -0.39 -1.11 0.00 0.00 -1.01 0.00 0.00 66.70 64.19 2ddf h VAL 434 Cb 1.28 1.65 0.00 0.00 -2.01 0.00 0.00 31.29 32.21 2ddf h VAL 434 CO 0.46 0.29 0.00 0.23 -1.01 0.00 0.00 177.57 177.54 2ddf n MET 435 N -3.81 1.46 -1.93 4.17 2.81 -1.26 -4.68 117.12 113.87 2ddf n MET 435 Ca -0.01 -0.62 -0.40 0.00 -1.81 0.00 0.00 57.70 54.85 2ddf n MET 435 Cb 0.38 -1.20 -0.00 0.00 -0.71 0.00 0.00 33.22 31.69 2ddf n MET 435 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 2ddf s TYR 436 N -1.73 2.71 0.29 2.03 5.04 -0.84 -1.48 117.35 123.38 2ddf s TYR 436 Ca 0.11 1.31 0.33 0.00 -2.44 0.00 0.00 57.07 56.38 2ddf s TYR 436 Cb 0.06 -3.83 1.52 0.00 0.35 0.00 0.00 41.96 40.07 2ddf s TYR 436 CO 0.07 -2.50 2.06 -1.00 -1.34 0.00 0.00 175.55 172.84 2ddf h PRO 437 N 2.81 0.00 -5.36 4.97 0.13 -1.90 -3.43 132.00 129.22 2ddf h PRO 437 Ca -0.50 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.01 2ddf h PRO 437 Cb 1.25 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.22 2ddf h PRO 437 CO 0.63 0.06 -0.56 0.42 -0.23 0.00 0.00 178.00 178.32 2ddf s ILE 438 N -3.88 4.80 -0.27 -3.56 -1.09 -1.26 -5.01 121.20 110.92 2ddf s ILE 438 Ca -0.01 -0.04 -0.37 0.00 -2.23 0.00 0.00 60.65 58.00 2ddf s ILE 438 Cb 0.11 -3.15 -0.13 0.00 -1.58 0.00 0.00 42.46 37.71 2ddf s ILE 438 CO 0.54 0.48 1.93 0.00 -1.23 0.00 0.00 174.94 176.66 2ddf n ALA 439 N 3.32 0.46 -2.13 9.38 0.00 -1.26 -4.88 120.51 125.40 2ddf n ALA 439 Ca -0.17 0.22 -0.42 0.00 0.00 0.00 0.00 53.44 53.06 2ddf n ALA 439 Cb 0.52 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 2ddf n ALA 439 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2ddf s VAL 440 N 4.93 3.76 0.21 0.00 -7.23 -1.26 -4.92 120.40 115.90 2ddf s VAL 440 Ca 1.01 0.94 0.28 0.00 -1.81 0.00 0.00 61.98 62.41 2ddf s VAL 440 Cb -0.93 -3.61 0.30 0.00 0.56 0.00 0.00 36.38 32.70 2ddf s VAL 440 CO 0.58 -0.08 1.95 0.77 -0.31 0.00 0.00 175.10 178.00 2ddf h SER 441 N 9.07 0.00 0.00 4.85 4.64 -1.97 -3.47 113.55 126.67 2ddf h SER 441 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 2ddf h SER 441 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2ddf h SER 441 CO 0.96 0.13 0.00 0.61 -0.87 0.00 0.00 176.83 177.66 2ddf n GLY 442 N -0.12 0.56 0.79 -0.77 0.00 -1.26 -4.76 105.19 99.62 2ddf n GLY 442 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 2ddf n GLY 442 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ddf n ASP 443 N 0.00 2.42 -4.93 1.61 3.85 -1.26 -4.89 116.55 113.35 2ddf n ASP 443 Ca 0.00 -1.80 -0.28 0.00 -0.71 0.00 0.00 54.79 51.99 2ddf n ASP 443 Cb 0.00 -0.06 -0.03 0.00 -1.35 0.00 0.00 41.12 39.68 2ddf n ASP 443 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.20 175.19 2ddf s HIS 444 N -1.89 3.50 0.30 2.11 3.76 -1.26 -5.02 115.29 116.79 2ddf s HIS 444 Ca 0.33 0.21 0.05 0.00 -0.15 0.00 0.00 55.06 55.50 2ddf s HIS 444 Cb 0.20 -1.74 0.68 0.00 1.11 0.00 0.00 32.58 32.84 2ddf s HIS 444 CO 0.31 0.52 1.80 1.05 -0.85 0.00 0.00 174.74 177.56 2ddf h GLU 445 N 2.49 0.81 0.00 1.40 9.09 -1.87 -2.25 114.58 124.25 2ddf h GLU 445 Ca -0.47 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 58.89 2ddf h GLU 445 Cb 1.18 -0.18 0.00 0.00 -1.65 0.00 0.00 28.75 28.10 2ddf h GLU 445 CO 0.71 0.54 -0.42 0.09 0.05 0.00 0.00 179.01 179.98 2ddf n ASN 446 N -4.72 0.58 -0.09 3.06 3.02 0.78 -4.35 115.26 113.54 2ddf n ASN 446 Ca 0.22 0.14 0.11 0.00 -0.03 0.00 0.00 54.58 55.02 2ddf n ASN 446 Cb 0.51 -0.04 0.48 0.00 -0.61 0.00 0.00 39.78 40.11 2ddf n ASN 446 CO 0.00 0.00 0.00 0.78 -2.62 0.00 0.00 177.26 175.42 2ddf h ASN 447 N 0.00 0.41 -0.82 6.41 -0.26 -1.01 -1.13 115.58 119.18 2ddf h ASN 447 Ca 0.00 0.01 -0.40 0.00 -0.56 0.00 0.00 56.30 55.35 2ddf h ASN 447 Cb 0.65 -0.08 -0.24 0.00 -1.06 0.00 0.00 38.32 37.59 2ddf h ASN 447 CO 0.00 0.25 0.45 0.29 -1.06 0.00 0.00 177.43 177.36 2ddf n LYS 448 N -4.47 2.39 -4.18 0.81 5.02 -1.26 -3.50 118.16 112.97 2ddf n LYS 448 Ca 0.09 -3.06 -0.14 0.00 -2.02 0.00 0.00 58.31 53.19 2ddf n LYS 448 Cb 0.33 -2.11 -0.11 0.00 -0.02 0.00 0.00 35.03 33.13 2ddf n LYS 448 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2ddf s MET 449 N -3.24 0.85 0.04 1.97 -1.94 -0.43 -4.93 119.30 111.63 2ddf s MET 449 Ca 0.54 -1.19 -0.22 0.00 -1.71 0.00 0.00 55.69 53.11 2ddf s MET 449 Cb 0.46 -0.49 -0.06 0.00 2.01 0.00 0.00 34.83 36.75 2ddf s MET 449 CO 0.09 0.07 0.65 -0.06 -0.01 0.00 0.00 175.02 175.75 2ddf s PHE 450 N -2.65 3.74 0.98 -0.03 0.08 -1.26 -1.20 117.98 117.65 2ddf s PHE 450 Ca 0.07 1.32 -0.12 0.00 0.12 0.00 0.00 56.93 58.32 2ddf s PHE 450 Cb -0.02 -2.65 0.18 0.00 -0.57 0.00 0.00 43.02 39.97 2ddf s PHE 450 CO -0.01 0.40 1.08 -1.54 -0.10 0.00 0.00 175.22 175.06 2ddf s SER 451 N -0.44 2.63 0.43 1.36 1.04 -1.26 -4.83 113.70 112.63 2ddf s SER 451 Ca 0.33 1.54 0.10 0.00 0.48 0.00 0.00 55.95 58.40 2ddf s SER 451 Cb -0.19 -2.21 0.94 0.00 0.10 0.00 0.00 66.02 64.66 2ddf s SER 451 CO 0.20 -3.17 2.03 1.56 0.98 0.00 0.00 173.24 174.83 2ddf h GLN 452 N -1.92 0.29 -0.06 4.02 1.08 -1.92 -1.40 115.11 115.20 2ddf h GLN 452 Ca -0.52 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.64 2ddf h GLN 452 Cb 1.30 -0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 28.67 2ddf h GLN 452 CO 0.52 0.27 0.04 0.00 -0.95 0.00 0.00 178.83 178.71 2ddf h SER 454 N 0.07 0.93 -0.21 0.00 0.02 -1.81 -2.14 113.55 110.42 2ddf h SER 454 Ca 0.02 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2ddf h SER 454 Cb -0.01 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 2ddf h SER 454 CO -0.00 0.66 0.09 0.11 -1.14 0.00 0.00 176.83 176.55 2ddf h LYS 455 N 1.10 0.31 -0.59 3.45 1.57 -0.95 -0.45 116.57 121.02 2ddf h LYS 455 Ca 0.31 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.04 2ddf h LYS 455 Cb -0.09 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 2ddf h LYS 455 CO -0.08 0.36 0.39 0.37 -0.57 0.00 0.00 179.45 179.92 2ddf h GLN 456 N 0.20 0.78 -0.21 3.15 5.75 -1.05 0.26 115.11 123.98 2ddf h GLN 456 Ca 0.07 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.52 2ddf h GLN 456 Cb 0.16 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.52 2ddf h GLN 456 CO -0.01 0.52 0.12 0.77 -2.65 0.00 0.00 178.83 177.58 2ddf h SER 457 N 0.80 0.26 -0.34 -0.69 0.02 -1.18 -2.87 113.55 109.55 2ddf h SER 457 Ca 0.22 -0.08 -0.16 0.00 -0.84 0.00 0.00 61.79 60.93 2ddf h SER 457 Cb -0.09 -0.07 -0.00 0.00 0.14 0.00 0.00 62.40 62.38 2ddf h SER 457 CO -0.05 0.26 -0.41 0.40 -1.14 0.00 0.00 176.83 175.89 2ddf h ILE 458 N 0.24 1.28 -1.00 3.27 2.04 -0.82 -2.97 117.51 119.55 2ddf h ILE 458 Ca 0.07 -1.59 0.19 0.00 1.00 0.00 0.00 64.86 64.54 2ddf h ILE 458 Cb 0.06 1.49 -0.11 0.00 -0.74 0.00 0.00 36.82 37.52 2ddf h ILE 458 CO -0.01 0.52 0.60 0.22 0.00 0.00 0.00 178.15 179.48 2ddf h TYR 459 N 0.67 1.05 -0.78 1.37 3.20 -0.40 1.54 116.97 123.62 2ddf h TYR 459 Ca 0.04 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 2ddf h TYR 459 Cb 1.01 -0.31 -0.04 0.00 1.54 0.00 0.00 36.73 38.93 2ddf h TYR 459 CO 0.07 0.21 0.37 0.87 -1.64 0.00 0.00 178.16 178.04 2ddf h LYS 460 N 0.73 1.13 0.74 1.82 1.79 -1.36 -3.25 116.57 118.18 2ddf h LYS 460 Ca 0.58 -0.17 -0.04 0.00 -2.18 0.00 0.00 60.65 58.85 2ddf h LYS 460 Cb 0.93 -0.20 0.01 0.00 -1.58 0.00 0.00 32.23 31.38 2ddf h LYS 460 CO -0.40 0.88 -0.37 1.15 -1.08 0.00 0.00 179.45 179.64 2ddf h THR 461 N 1.11 0.24 -0.11 -0.16 2.02 0.22 -3.42 112.91 112.81 2ddf h THR 461 Ca 0.27 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.46 2ddf h THR 461 Cb 0.13 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.77 2ddf h THR 461 CO -0.03 0.00 0.02 0.40 0.37 0.00 0.00 175.52 176.27 2ddf h ILE 462 N -1.02 0.95 -0.11 3.11 2.04 -0.70 -2.74 117.51 119.04 2ddf h ILE 462 Ca -0.10 -0.02 -0.04 0.00 1.00 0.00 0.00 64.86 65.70 2ddf h ILE 462 Cb 0.79 0.88 -0.00 0.00 -0.74 0.00 0.00 36.82 37.75 2ddf h ILE 462 CO 0.16 0.01 -0.08 -0.33 0.00 0.00 0.00 178.15 177.91 2ddf h GLU 463 N 0.06 0.25 -0.47 2.37 5.08 -1.80 0.41 114.58 120.49 2ddf h GLU 463 Ca 0.05 -0.12 0.06 0.00 -1.00 0.00 0.00 59.36 58.35 2ddf h GLU 463 Cb 0.04 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.20 2ddf h GLU 463 CO -0.07 0.63 -0.50 0.66 -1.00 0.00 0.00 179.01 178.73 2ddf h SER 464 N -0.12 -1.69 -0.11 1.42 4.64 -1.83 -1.52 113.55 114.34 2ddf h SER 464 Ca 0.02 0.24 -0.09 0.00 -0.47 0.00 0.00 61.79 61.49 2ddf h SER 464 Cb 0.57 0.72 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 2ddf h SER 464 CO 0.02 -0.38 -0.21 0.11 -0.87 0.00 0.00 176.83 175.51 2ddf h LYS 465 N -0.33 0.52 -0.34 4.77 1.79 -1.16 -2.21 116.57 119.61 2ddf h LYS 465 Ca 0.12 -0.18 0.01 0.00 -2.18 0.00 0.00 60.65 58.42 2ddf h LYS 465 Cb 0.58 -0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 31.17 2ddf h LYS 465 CO -0.63 0.70 0.20 0.00 -1.08 0.00 0.00 179.45 178.64 2ddf h ALA 466 N 1.32 0.43 -0.59 3.86 0.00 0.20 0.10 119.26 124.57 2ddf h ALA 466 Ca 0.07 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2ddf h ALA 466 Cb 0.62 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 2ddf h ALA 466 CO 0.04 -0.16 0.28 1.96 0.00 0.00 0.00 179.25 181.38 2ddf h GLN 467 N 0.41 0.83 -0.23 0.00 1.08 -1.06 -0.85 115.11 115.29 2ddf h GLN 467 Ca 0.13 -0.10 -0.05 0.00 -1.45 0.00 0.00 58.65 57.18 2ddf h GLN 467 Cb 0.00 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.27 2ddf h GLN 467 CO -0.06 0.65 -0.07 1.49 -0.95 0.00 0.00 178.83 179.88 2ddf h GLU 468 N 0.83 0.44 0.00 1.46 4.81 -0.58 -3.42 114.58 118.13 2ddf h GLU 468 Ca 0.21 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2ddf h GLU 468 Cb 0.09 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2ddf h GLU 468 CO -0.03 0.69 0.00 0.00 -0.73 0.00 0.00 179.01 178.94 2ddf s PHE 470 N 0.00 3.51 0.42 0.00 0.40 -0.33 -4.56 117.98 117.42 2ddf s PHE 470 Ca 0.00 1.24 0.03 0.00 -0.60 0.00 0.00 56.93 57.61 2ddf s PHE 470 Cb 0.00 -2.63 -0.03 0.00 0.51 0.00 0.00 43.02 40.87 2ddf s PHE 470 CO 0.00 -0.37 0.09 -0.65 0.70 0.00 0.00 175.22 174.99 2ddf s GLN 471 N -4.35 1.94 0.16 0.44 -0.21 0.14 -4.59 119.66 113.19 2ddf s GLN 471 Ca 0.55 -2.18 -0.30 0.00 0.02 0.00 0.00 55.36 53.44 2ddf s GLN 471 Cb -0.10 -0.86 -0.08 0.00 1.00 0.00 0.00 33.01 32.97 2ddf s GLN 471 CO 0.38 -0.40 1.19 -2.00 -2.12 0.00 0.00 175.29 172.34 2ddf s GLU 472 N -3.77 4.49 0.17 2.91 2.12 -0.05 -0.63 118.70 123.95 2ddf s GLU 472 Ca 0.22 1.84 -0.33 0.00 0.36 0.00 0.00 54.97 57.07 2ddf s GLU 472 Cb 0.03 -3.26 -0.13 0.00 0.26 0.00 0.00 34.13 31.04 2ddf s GLU 472 CO 0.12 -0.10 1.67 -2.13 -0.54 0.00 0.00 175.26 174.29 2ddf n ARG 473 N 2.72 2.47 0.00 4.30 0.63 -1.26 -4.88 116.66 120.64 2ddf n ARG 473 Ca 0.05 0.89 0.12 0.00 -0.92 0.00 0.00 57.85 57.98 2ddf n ARG 473 Cb 0.45 -2.70 0.69 0.00 0.45 0.00 0.00 32.46 31.34 2ddf n ARG 473 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55