#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qcd n MET 223 N 0.00 0.96 -2.40 0.00 0.00 -1.26 -4.88 117.12 109.54 2qcd n MET 223 Ca 0.00 0.35 -0.42 0.00 -0.00 0.00 0.00 57.70 57.63 2qcd n MET 223 Cb 0.00 -1.98 -0.03 0.00 0.00 0.00 0.00 33.22 31.21 2qcd n MET 223 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 2qcd s GLU 224 N 1.56 4.42 0.09 2.12 2.56 -1.26 -5.04 118.70 123.14 2qcd s GLU 224 Ca 0.91 1.80 -0.02 0.00 0.00 0.00 0.00 54.97 57.65 2qcd s GLU 224 Cb -1.06 -3.34 -0.05 0.00 2.00 0.00 0.00 34.13 31.69 2qcd s GLU 224 CO 0.56 -0.27 0.27 -0.51 -0.56 0.00 0.00 175.26 174.75 2qcd s LEU 225 N 1.05 4.33 0.92 2.70 1.43 -1.26 -5.00 118.68 122.84 2qcd s LEU 225 Ca 0.59 0.41 -0.11 0.00 -1.03 0.00 0.00 54.13 53.99 2qcd s LEU 225 Cb -0.30 -3.07 0.14 0.00 0.03 0.00 0.00 46.19 43.00 2qcd s LEU 225 CO 0.29 0.13 1.10 -0.94 0.23 0.00 0.00 176.35 177.17 2qcd s SER 226 N -2.42 3.08 0.22 2.29 1.04 -1.26 -4.79 113.70 111.86 2qcd s SER 226 Ca 0.37 1.82 -0.09 0.00 0.48 0.00 0.00 55.95 58.52 2qcd s SER 226 Cb -0.13 -2.41 0.19 0.00 0.10 0.00 0.00 66.02 63.78 2qcd s SER 226 CO 0.26 -2.94 1.89 -0.26 0.98 0.00 0.00 173.24 173.17 2qcd h PHE 227 N -1.75 1.01 -0.99 5.02 0.05 -1.99 -0.20 116.94 118.09 2qcd h PHE 227 Ca -0.48 0.02 0.04 0.00 3.82 0.00 0.00 57.97 61.38 2qcd h PHE 227 Cb 1.27 -0.34 -0.06 0.00 2.00 0.00 0.00 35.95 38.83 2qcd h PHE 227 CO 0.46 0.63 0.65 0.78 -0.18 0.00 0.00 178.31 180.64 2qcd h GLY 228 N 1.08 1.46 1.25 -1.45 0.00 -1.92 -1.63 103.07 101.86 2qcd h GLY 228 Ca 0.30 -0.49 -0.23 0.00 0.00 0.00 0.00 47.33 46.91 2qcd h GLY 228 CO -0.08 0.41 -0.85 0.00 0.00 0.00 0.00 176.54 176.03 2qcd h ALA 229 N 1.41 0.30 -0.69 3.60 0.00 -1.83 -3.16 119.26 118.88 2qcd h ALA 229 Ca 0.40 -0.63 0.02 0.00 0.00 0.00 0.00 54.91 54.70 2qcd h ALA 229 Cb 0.02 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 2qcd h ALA 229 CO -0.13 0.70 0.46 0.00 0.00 0.00 0.00 179.25 180.28 2qcd h ARG 230 N 0.47 0.86 0.00 0.00 3.08 -0.80 -1.40 114.38 116.58 2qcd h ARG 230 Ca -0.07 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2qcd h ARG 230 Cb 1.48 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.33 2qcd h ARG 230 CO 0.17 0.57 0.00 0.00 -1.07 0.00 0.00 179.97 179.64 2qcd h ALA 231 N 1.58 1.00 -0.12 0.04 0.00 -1.26 -2.06 119.26 118.44 2qcd h ALA 231 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2qcd h ALA 231 Cb -0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qcd h ALA 231 CO -0.07 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.57 2qcd n GLU 232 N -2.63 1.63 -1.83 0.00 1.02 -0.54 -4.69 120.64 113.60 2qcd n GLU 232 Ca -0.01 -1.67 -0.41 0.00 -0.02 0.00 0.00 57.16 55.05 2qcd n GLU 232 Cb 0.11 -1.34 -0.01 0.00 -0.02 0.00 0.00 31.44 30.17 2qcd n GLU 232 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2qcd s LEU 233 N -1.33 4.34 0.30 -4.62 1.43 -0.78 -4.89 118.68 113.14 2qcd s LEU 233 Ca 0.23 2.96 0.05 0.00 -1.03 0.00 0.00 54.13 56.33 2qcd s LEU 233 Cb 0.15 -3.65 0.81 0.00 0.03 0.00 0.00 46.19 43.53 2qcd s LEU 233 CO 0.22 -0.85 1.62 -0.65 0.23 0.00 0.00 176.35 176.92 2qcd h PRO 234 N 3.95 0.15 -0.43 1.29 0.11 -1.94 -1.67 132.00 133.46 2qcd h PRO 234 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2qcd h PRO 234 Cb 1.23 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2qcd h PRO 234 CO 0.72 0.10 0.00 0.54 -0.21 0.00 0.00 178.00 179.14 2qcd n ARG 235 N -5.27 2.05 -2.00 1.05 1.74 -1.26 -4.97 116.66 108.00 2qcd n ARG 235 Ca 0.24 -1.63 -0.40 0.00 -0.77 0.00 0.00 57.85 55.30 2qcd n ARG 235 Cb 0.78 -1.37 -0.00 0.00 -1.02 0.00 0.00 32.46 30.86 2qcd n ARG 235 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 2qcd s ILE 236 N -1.43 2.50 0.17 0.55 1.10 -0.63 -4.99 121.20 118.47 2qcd s ILE 236 Ca 0.31 0.45 -0.26 0.00 -0.51 0.00 0.00 60.65 60.64 2qcd s ILE 236 Cb 0.16 -3.26 -0.08 0.00 0.15 0.00 0.00 42.46 39.43 2qcd s ILE 236 CO 0.22 0.07 0.81 -2.28 -2.11 0.00 0.00 174.94 171.64 2qcd s HIS 237 N -1.25 3.91 0.36 3.50 5.65 -1.26 -4.91 115.29 121.29 2qcd s HIS 237 Ca 0.58 1.67 0.13 0.00 0.25 0.00 0.00 55.06 57.69 2qcd s HIS 237 Cb -0.39 -2.81 0.94 0.00 -1.18 0.00 0.00 32.58 29.14 2qcd s HIS 237 CO 0.51 0.48 1.80 -1.35 -0.65 0.00 0.00 174.74 175.53 2qcd h PRO 238 N 4.41 0.54 -0.31 2.88 0.11 -1.95 0.14 132.00 137.83 2qcd h PRO 238 Ca -0.46 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.48 2qcd h PRO 238 Cb 1.21 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2qcd h PRO 238 CO 0.67 0.36 -0.34 0.28 -0.21 0.00 0.00 178.00 178.76 2qcd h VAL 239 N 0.56 1.29 -0.79 3.15 2.07 -1.93 -0.54 116.25 120.06 2qcd h VAL 239 Ca 0.55 -1.52 -0.05 0.00 0.82 0.00 0.00 66.70 66.50 2qcd h VAL 239 Cb 1.14 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 32.43 2qcd h VAL 239 CO -0.30 0.49 0.30 0.00 0.02 0.00 0.00 177.57 178.09 2qcd h ALA 240 N 0.71 1.04 -0.41 1.67 0.00 -1.68 -2.25 119.26 118.34 2qcd h ALA 240 Ca 0.04 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 2qcd h ALA 240 Cb 0.92 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2qcd h ALA 240 CO 0.08 0.67 0.14 1.03 0.00 0.00 0.00 179.25 181.18 2qcd h SER 241 N 1.16 0.59 -0.93 0.00 0.87 -0.55 -0.20 113.55 114.48 2qcd h SER 241 Ca 0.26 -0.19 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 2qcd h SER 241 Cb 0.24 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 62.00 2qcd h SER 241 CO -0.02 0.62 0.57 0.50 -0.53 0.00 0.00 176.83 177.97 2qcd h LYS 242 N 0.53 1.26 -0.05 2.24 3.64 -0.95 -1.52 116.57 121.72 2qcd h LYS 242 Ca 0.14 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2qcd h LYS 242 Cb 0.23 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2qcd h LYS 242 CO -0.01 0.88 -0.03 1.25 -2.27 0.00 0.00 179.45 179.27 2qcd h LEU 243 N 1.28 0.12 -1.10 5.20 5.85 -1.17 -2.43 115.31 123.07 2qcd h LEU 243 Ca 0.33 -0.44 0.02 0.00 0.84 0.00 0.00 57.88 58.64 2qcd h LEU 243 Cb -0.06 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 2qcd h LEU 243 CO -0.06 0.53 0.61 -0.07 -0.34 0.00 0.00 178.44 179.11 2qcd h LEU 244 N -0.29 1.03 -0.19 2.25 3.38 -0.89 -0.52 115.31 120.08 2qcd h LEU 244 Ca 0.01 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2qcd h LEU 244 Cb 0.49 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2qcd h LEU 244 CO 0.01 0.73 0.07 0.03 0.09 0.00 0.00 178.44 179.37 2qcd h ARG 245 N 1.21 0.29 -0.03 1.13 3.08 -1.25 -2.08 114.38 116.72 2qcd h ARG 245 Ca 0.35 -0.06 -0.10 0.00 0.07 0.00 0.00 59.98 60.25 2qcd h ARG 245 Cb -0.08 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 2qcd h ARG 245 CO -0.09 0.37 -0.43 1.37 -1.07 0.00 0.00 179.97 180.11 2qcd h LEU 246 N 0.15 0.08 -0.02 3.04 8.10 -1.08 -0.94 115.31 124.64 2qcd h LEU 246 Ca 0.06 -0.03 0.01 0.00 0.11 0.00 0.00 57.88 58.03 2qcd h LEU 246 Cb 0.19 -0.02 -0.01 0.00 -0.44 0.00 0.00 40.66 40.38 2qcd h LEU 246 CO -0.00 0.51 -0.02 0.24 -4.11 0.00 0.00 178.44 175.05 2qcd h MET 247 N 0.06 -0.03 -0.35 0.17 2.86 -0.96 -0.87 114.93 115.82 2qcd h MET 247 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 2qcd h MET 247 Cb 0.80 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.45 2qcd h MET 247 CO 0.06 -0.02 0.17 0.37 1.06 0.00 0.00 176.91 178.55 2qcd h GLN 248 N -0.03 0.51 -0.37 1.72 4.15 -1.19 0.24 115.11 120.13 2qcd h GLN 248 Ca 0.02 -0.07 0.04 0.00 0.77 0.00 0.00 58.65 59.41 2qcd h GLN 248 Cb 0.05 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 27.61 2qcd h GLN 248 CO -0.04 0.46 0.13 -0.22 -1.93 0.00 0.00 178.83 177.23 2qcd h LYS 249 N 0.43 0.28 -0.01 1.69 3.64 -1.10 -3.07 116.57 118.43 2qcd h LYS 249 Ca 0.12 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2qcd h LYS 249 Cb 0.12 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2qcd h LYS 249 CO -0.02 0.19 -0.34 1.63 -2.27 0.00 0.00 179.45 178.65 2qcd n LYS 250 N -5.01 1.02 -3.67 1.90 5.02 -0.34 -4.97 118.16 112.11 2qcd n LYS 250 Ca 0.02 -0.72 -0.21 0.00 -2.02 0.00 0.00 58.31 55.37 2qcd n LYS 250 Cb 0.13 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.69 2qcd n LYS 250 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2qcd n GLU 251 N -0.36 -4.64 -3.72 1.97 1.02 0.78 -5.01 120.64 110.68 2qcd n GLU 251 Ca 0.11 0.63 -0.16 0.00 -0.02 0.00 0.00 57.16 57.72 2qcd n GLU 251 Cb 0.40 -5.16 -0.16 0.00 -0.02 0.00 0.00 31.44 26.50 2qcd n GLU 251 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2qcd s THR 252 N -3.64 -0.10 -0.33 2.62 -1.32 -0.80 -4.87 115.64 107.19 2qcd s THR 252 Ca 0.05 0.28 0.06 0.00 -1.21 0.00 0.00 61.69 60.87 2qcd s THR 252 Cb -0.01 -0.18 0.46 0.00 -1.51 0.00 0.00 72.50 71.26 2qcd s THR 252 CO 0.81 0.11 1.33 -0.46 -2.21 0.00 0.00 174.62 174.21 2qcd n ASN 253 N 4.63 4.72 -4.56 8.08 6.94 -1.26 -4.39 115.26 129.42 2qcd n ASN 253 Ca -0.18 -3.78 -0.34 0.00 -0.02 0.00 0.00 54.58 50.26 2qcd n ASN 253 Cb 0.50 -0.47 -0.11 0.00 -2.36 0.00 0.00 39.78 37.34 2qcd n ASN 253 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2qcd s LEU 254 N -3.56 3.55 -0.24 -4.53 2.96 -1.26 -1.81 118.68 113.79 2qcd s LEU 254 Ca 0.51 -0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 54.33 2qcd s LEU 254 Cb 0.42 -1.89 -0.02 0.00 0.50 0.00 0.00 46.19 45.20 2qcd s LEU 254 CO 0.02 0.15 0.03 0.00 -1.32 0.00 0.00 176.35 175.23 2qcd s LEU 256 N 1.52 4.18 -0.68 0.00 2.96 -0.31 -1.82 118.68 124.52 2qcd s LEU 256 Ca 0.06 1.40 -0.23 0.00 -0.22 0.00 0.00 54.13 55.13 2qcd s LEU 256 Cb -0.15 -3.48 0.07 0.00 0.50 0.00 0.00 46.19 43.13 2qcd s LEU 256 CO 0.01 -0.52 1.02 -0.55 -1.32 0.00 0.00 176.35 174.99 2qcd s SER 257 N 1.15 6.19 -1.28 3.68 0.15 0.06 -0.18 113.70 123.48 2qcd s SER 257 Ca 0.44 -0.98 -0.10 0.00 0.70 0.00 0.00 55.95 56.02 2qcd s SER 257 Cb -0.17 -2.44 0.16 0.00 -1.71 0.00 0.00 66.02 61.87 2qcd s SER 257 CO 0.12 -1.48 1.84 0.00 1.20 0.00 0.00 173.24 174.93 2qcd n ALA 258 N 7.87 5.20 -2.69 5.45 0.00 -0.36 -4.34 120.51 131.63 2qcd n ALA 258 Ca -0.01 -4.30 -0.43 0.00 0.00 0.00 0.00 53.44 48.70 2qcd n ALA 258 Cb 0.46 -3.01 0.00 0.00 0.00 0.00 0.00 19.45 16.91 2qcd n ALA 258 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2qcd n ASP 259 N 4.14 5.14 -4.34 0.00 8.00 -1.26 -4.56 116.55 123.66 2qcd n ASP 259 Ca 0.40 -3.02 -0.18 0.00 0.71 0.00 0.00 54.79 52.70 2qcd n ASP 259 Cb 0.37 -1.55 -0.10 0.00 -0.02 0.00 0.00 41.12 39.82 2qcd n ASP 259 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2qcd s VAL 260 N 1.29 1.46 -1.51 2.53 -7.23 -1.26 -5.06 120.40 110.61 2qcd s VAL 260 Ca 0.42 -2.12 0.19 0.00 -1.81 0.00 0.00 61.98 58.66 2qcd s VAL 260 Cb 0.02 -2.16 -0.07 0.00 0.56 0.00 0.00 36.38 34.73 2qcd s VAL 260 CO 0.01 -0.50 0.93 -1.54 -0.31 0.00 0.00 175.10 173.68 2qcd n SER 261 N -0.40 1.56 -4.22 4.85 3.41 -1.26 -4.39 113.62 113.17 2qcd n SER 261 Ca -0.07 -1.28 -0.29 0.00 -0.26 0.00 0.00 58.87 56.97 2qcd n SER 261 Cb 0.62 0.64 -0.16 0.00 -0.26 0.00 0.00 64.21 65.04 2qcd n SER 261 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2qcd s LEU 262 N -2.47 2.01 0.22 1.04 1.43 -1.26 -0.54 118.68 119.11 2qcd s LEU 262 Ca 0.13 -0.45 -0.11 0.00 -1.03 0.00 0.00 54.13 52.68 2qcd s LEU 262 Cb 0.15 -1.21 0.30 0.00 0.03 0.00 0.00 46.19 45.46 2qcd s LEU 262 CO 0.58 0.21 1.64 0.00 0.23 0.00 0.00 176.35 179.01 2qcd h ALA 263 N 6.11 0.57 -0.80 4.21 0.00 -1.92 -0.47 119.26 126.97 2qcd h ALA 263 Ca -0.32 0.22 0.05 0.00 0.00 0.00 0.00 54.91 54.86 2qcd h ALA 263 Cb 1.17 0.41 -0.05 0.00 0.00 0.00 0.00 17.79 19.32 2qcd h ALA 263 CO 0.47 -0.41 0.49 -0.09 0.00 0.00 0.00 179.25 179.71 2qcd h ARG 264 N 0.06 0.90 -0.34 0.00 2.43 -1.97 0.33 114.38 115.80 2qcd h ARG 264 Ca 0.33 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.40 2qcd h ARG 264 Cb 0.54 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2qcd h ARG 264 CO -0.61 0.59 0.02 0.93 -1.51 0.00 0.00 179.97 179.39 2qcd h GLU 265 N 0.92 0.59 -0.14 0.20 5.08 -1.58 0.15 114.58 119.82 2qcd h GLU 265 Ca 0.34 -0.18 0.04 0.00 -1.00 0.00 0.00 59.36 58.56 2qcd h GLU 265 Cb 0.11 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.26 2qcd h GLU 265 CO -0.15 0.70 -0.12 1.25 -1.00 0.00 0.00 179.01 179.69 2qcd h LEU 266 N 0.41 -0.39 -0.43 1.33 5.85 -0.29 -0.61 115.31 121.18 2qcd h LEU 266 Ca 0.10 0.08 -0.13 0.00 0.84 0.00 0.00 57.88 58.77 2qcd h LEU 266 Cb 0.42 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 2qcd h LEU 266 CO 0.01 -0.16 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.66 2qcd h LEU 267 N -0.14 0.94 -0.24 2.25 3.38 -0.26 -1.58 115.31 119.65 2qcd h LEU 267 Ca 0.09 -0.41 0.04 0.00 0.09 0.00 0.00 57.88 57.69 2qcd h LEU 267 Cb 0.28 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2qcd h LEU 267 CO -0.22 1.14 0.04 1.56 0.09 0.00 0.00 178.44 181.04 2qcd h GLN 268 N 0.74 0.12 -0.39 1.13 4.20 -0.54 -1.75 115.11 118.63 2qcd h GLN 268 Ca 0.10 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 2qcd h GLN 268 Cb 0.79 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 2qcd h GLN 268 CO 0.07 0.08 0.04 -0.07 -0.67 0.00 0.00 178.83 178.28 2qcd h LEU 269 N 0.12 0.63 -0.99 1.46 3.38 -1.01 -0.51 115.31 118.39 2qcd h LEU 269 Ca 0.11 -0.28 0.05 0.00 0.09 0.00 0.00 57.88 57.86 2qcd h LEU 269 Cb 0.12 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.64 2qcd h LEU 269 CO -0.16 0.75 0.64 0.00 0.09 0.00 0.00 178.44 179.77 2qcd h ALA 270 N 0.90 1.35 -0.01 1.53 0.00 -1.19 -0.10 119.26 121.75 2qcd h ALA 270 Ca 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2qcd h ALA 270 Cb 0.40 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2qcd h ALA 270 CO 0.01 0.49 -0.02 0.22 0.00 0.00 0.00 179.25 179.94 2qcd h ASP 271 N 1.21 0.03 -0.60 0.00 3.58 -1.10 -0.88 116.42 118.65 2qcd h ASP 271 Ca 0.41 -0.65 -0.04 0.00 0.42 0.00 0.00 57.03 57.18 2qcd h ASP 271 Cb 0.09 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.10 2qcd h ASP 271 CO -0.15 0.67 0.24 0.00 -2.88 0.00 0.00 179.24 177.13 2qcd h ALA 272 N 0.36 1.23 -0.01 -0.78 0.00 -0.94 -3.18 119.26 115.94 2qcd h ALA 272 Ca -0.00 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2qcd h ALA 272 Cb 0.67 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2qcd h ALA 272 CO 0.00 0.56 -0.36 1.28 0.00 0.00 0.00 179.25 180.74 2qcd n LEU 273 N -4.30 1.38 -0.29 0.00 4.32 -0.06 -4.64 117.00 113.40 2qcd n LEU 273 Ca 0.05 -0.72 0.08 0.00 -0.02 0.00 0.00 56.01 55.40 2qcd n LEU 273 Cb 0.18 0.00 0.20 0.00 -1.62 0.00 0.00 43.42 42.17 2qcd n LEU 273 CO 0.39 0.27 0.81 1.23 -1.22 0.00 0.00 177.39 178.88 2qcd h GLY 274 N 3.13 0.96 2.00 -0.72 0.00 -1.13 0.17 103.07 107.48 2qcd h GLY 274 Ca 0.00 0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 2qcd h GLY 274 CO 0.00 -0.36 -0.01 -2.55 0.00 0.00 0.00 176.54 173.62 2qcd h PRO 275 N 0.08 0.00 -0.00 4.80 0.11 -1.82 -2.80 132.00 132.37 2qcd h PRO 275 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 2qcd h PRO 275 Cb 0.87 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2qcd h PRO 275 CO -0.76 0.01 -0.48 0.43 -0.21 0.00 0.00 178.00 176.99 2qcd n SER 276 N -3.84 0.84 -4.39 -2.05 7.64 0.04 -4.97 113.62 106.89 2qcd n SER 276 Ca -0.03 -0.64 -0.27 0.00 1.01 0.00 0.00 58.87 58.94 2qcd n SER 276 Cb 0.10 0.32 -0.12 0.00 -1.01 0.00 0.00 64.21 63.50 2qcd n SER 276 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2qcd s ILE 277 N -2.80 2.21 -0.95 0.44 -4.36 -1.06 -4.65 121.20 110.03 2qcd s ILE 277 Ca 0.15 -1.86 0.23 0.00 -0.26 0.00 0.00 60.65 58.92 2qcd s ILE 277 Cb 0.18 -2.00 -0.09 0.00 1.25 0.00 0.00 42.46 41.81 2qcd s ILE 277 CO 0.65 -0.04 1.20 0.00 0.24 0.00 0.00 174.94 176.99 2qcd s MET 279 N -3.02 0.67 -0.16 0.00 -2.45 -1.23 -2.25 119.30 110.85 2qcd s MET 279 Ca 0.09 0.55 0.01 0.00 -1.25 0.00 0.00 55.69 55.09 2qcd s MET 279 Cb 0.17 0.32 0.01 0.00 1.25 0.00 0.00 34.83 36.58 2qcd s MET 279 CO 0.77 -0.13 -0.18 -1.17 1.05 0.00 0.00 175.02 175.36 2qcd s LEU 280 N -0.19 2.29 -0.24 4.11 0.20 -0.03 -1.17 118.68 123.66 2qcd s LEU 280 Ca -0.00 -0.56 -0.10 0.00 0.69 0.00 0.00 54.13 54.16 2qcd s LEU 280 Cb -0.03 -1.51 -0.05 0.00 -0.43 0.00 0.00 46.19 44.17 2qcd s LEU 280 CO -0.01 0.05 0.14 -0.75 -0.29 0.00 0.00 176.35 175.49 2qcd s LYS 281 N 1.00 4.01 0.18 1.98 2.20 0.75 -1.06 119.74 128.80 2qcd s LYS 281 Ca -0.02 -0.30 0.05 0.00 -0.36 0.00 0.00 55.97 55.34 2qcd s LYS 281 Cb -0.15 -3.49 -0.04 0.00 -1.51 0.00 0.00 37.83 32.65 2qcd s LYS 281 CO -0.05 0.05 0.15 0.95 -0.36 0.00 0.00 175.35 176.09 2qcd s THR 282 N 1.07 4.49 -0.59 3.43 -4.23 0.11 -1.22 115.64 118.69 2qcd s THR 282 Ca 0.07 -1.13 0.04 0.00 -1.18 0.00 0.00 61.69 59.49 2qcd s THR 282 Cb -0.14 -3.31 0.15 0.00 1.34 0.00 0.00 72.50 70.54 2qcd s THR 282 CO 0.04 -0.15 0.38 -1.00 -0.54 0.00 0.00 174.62 173.36 2qcd s HIS 283 N -1.81 3.00 0.47 3.99 3.76 -1.26 -1.28 115.29 122.16 2qcd s HIS 283 Ca 0.31 -3.07 0.22 0.00 -0.15 0.00 0.00 55.06 52.37 2qcd s HIS 283 Cb -0.10 -2.44 1.23 0.00 1.11 0.00 0.00 32.58 32.38 2qcd s HIS 283 CO 0.24 -0.66 1.92 -0.24 -0.85 0.00 0.00 174.74 175.15 2qcd h VAL 284 N 4.83 0.71 0.00 -0.90 3.04 -1.96 -1.41 116.25 120.56 2qcd h VAL 284 Ca 0.08 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2qcd h VAL 284 Cb 0.83 0.47 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 2qcd h VAL 284 CO 0.64 0.04 0.00 -0.90 -1.01 0.00 0.00 177.57 176.34 2qcd n ASP 285 N -4.42 0.00 -0.20 3.17 5.75 -1.26 -2.15 116.55 117.44 2qcd n ASP 285 Ca 0.15 -0.90 0.08 0.00 -0.01 0.00 0.00 54.79 54.10 2qcd n ASP 285 Cb 0.66 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.71 2qcd n ASP 285 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 2qcd n ILE 286 N -0.95 0.00 -2.33 2.12 5.41 -0.53 -4.94 119.36 118.14 2qcd n ILE 286 Ca 0.17 -0.25 -0.43 0.00 1.00 0.00 0.00 62.75 63.25 2qcd n ILE 286 Cb 0.08 1.11 -0.02 0.00 -0.71 0.00 0.00 39.64 40.09 2qcd n ILE 286 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2qcd s LEU 287 N -2.34 3.58 0.56 1.39 1.43 -0.91 -4.48 118.68 117.91 2qcd s LEU 287 Ca 0.10 0.85 0.23 0.00 -1.03 0.00 0.00 54.13 54.28 2qcd s LEU 287 Cb 0.12 -3.54 1.55 0.00 0.03 0.00 0.00 46.19 44.35 2qcd s LEU 287 CO 0.50 -1.46 2.19 0.78 0.23 0.00 0.00 176.35 178.59 2qcd h ASN 288 N 10.85 0.00 -0.47 2.29 2.35 -1.14 -3.02 115.58 126.44 2qcd h ASN 288 Ca -0.28 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.14 2qcd h ASN 288 Cb 1.11 0.00 -0.36 0.00 0.05 0.00 0.00 38.32 39.12 2qcd h ASN 288 CO 1.08 0.00 -0.90 -0.90 -1.65 0.00 0.00 177.43 175.06 2qcd n ASP 289 N -4.17 2.97 -4.63 5.81 5.75 -1.26 -5.07 116.55 115.95 2qcd n ASP 289 Ca -0.02 -3.01 -0.45 0.00 -0.01 0.00 0.00 54.79 51.30 2qcd n ASP 289 Cb 0.13 -0.41 -0.02 0.00 -1.03 0.00 0.00 41.12 39.79 2qcd n ASP 289 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2qcd n PHE 290 N -0.60 1.68 -3.87 2.11 7.35 -1.14 -4.76 117.46 118.22 2qcd n PHE 290 Ca 0.24 0.60 -0.09 0.00 -0.76 0.00 0.00 57.45 57.44 2qcd n PHE 290 Cb 0.89 -2.34 -0.07 0.00 0.35 0.00 0.00 39.48 38.32 2qcd n PHE 290 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2qcd s THR 291 N -0.61 0.10 0.36 -2.13 -4.23 -1.26 -5.04 115.64 102.84 2qcd s THR 291 Ca 0.64 -1.19 0.21 0.00 -1.18 0.00 0.00 61.69 60.16 2qcd s THR 291 Cb -0.70 -1.53 0.21 0.00 1.34 0.00 0.00 72.50 71.82 2qcd s THR 291 CO 0.56 -0.46 1.94 -0.07 -0.54 0.00 0.00 174.62 176.05 2qcd h LEU 292 N 2.61 0.00 -0.82 4.79 3.38 -1.94 -2.27 115.31 121.07 2qcd h LEU 292 Ca -0.33 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.65 2qcd h LEU 292 Cb 1.22 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.93 2qcd h LEU 292 CO 0.52 0.23 0.54 0.44 0.09 0.00 0.00 178.44 180.25 2qcd h ASP 293 N 0.00 0.92 -0.75 -0.43 3.32 -1.99 0.42 116.42 117.92 2qcd h ASP 293 Ca -0.00 -0.02 0.09 0.00 0.02 0.00 0.00 57.03 57.12 2qcd h ASP 293 Cb 0.51 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.76 2qcd h ASP 293 CO 0.03 0.66 0.39 0.58 -1.72 0.00 0.00 179.24 179.18 2qcd h VAL 294 N 1.09 0.86 -0.41 -1.35 2.07 -1.79 -0.63 116.25 116.10 2qcd h VAL 294 Ca 0.31 -0.23 -0.15 0.00 0.82 0.00 0.00 66.70 67.45 2qcd h VAL 294 Cb -0.10 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.81 2qcd h VAL 294 CO -0.08 0.12 -0.35 0.24 0.02 0.00 0.00 177.57 177.52 2qcd h MET 295 N 0.66 0.95 -0.47 1.57 2.86 -1.26 0.43 114.93 119.66 2qcd h MET 295 Ca 0.37 -0.48 0.08 0.00 -2.06 0.00 0.00 59.70 57.61 2qcd h MET 295 Cb 0.37 0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.97 2qcd h MET 295 CO -0.26 1.14 0.09 -0.22 1.06 0.00 0.00 176.91 178.71 2qcd h LYS 296 N 0.78 0.22 -0.70 1.72 3.64 -0.23 -0.40 116.57 121.60 2qcd h LYS 296 Ca 0.07 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.42 2qcd h LYS 296 Cb 0.94 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.68 2qcd h LYS 296 CO 0.09 0.14 0.35 0.93 -2.27 0.00 0.00 179.45 178.69 2qcd h GLU 297 N 0.22 1.01 -0.72 1.90 4.39 -0.71 -2.37 114.58 118.29 2qcd h GLU 297 Ca 0.23 -0.14 0.04 0.00 0.34 0.00 0.00 59.36 59.83 2qcd h GLU 297 Cb 0.31 -0.19 -0.05 0.00 -0.10 0.00 0.00 28.75 28.73 2qcd h GLU 297 CO -0.31 0.78 0.45 1.25 -1.16 0.00 0.00 179.01 180.02 2qcd h LEU 298 N 0.98 0.73 -1.03 1.33 5.85 -0.14 -2.16 115.31 120.88 2qcd h LEU 298 Ca 0.24 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.94 2qcd h LEU 298 Cb 0.10 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.94 2qcd h LEU 298 CO -0.03 0.50 0.33 0.40 -0.34 0.00 0.00 178.44 179.30 2qcd h ILE 299 N 0.87 1.23 -0.34 4.05 2.04 -0.79 0.10 117.51 124.67 2qcd h ILE 299 Ca 0.30 -0.66 0.02 0.00 1.00 0.00 0.00 64.86 65.51 2qcd h ILE 299 Cb 0.05 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.43 2qcd h ILE 299 CO -0.12 0.28 0.18 0.74 0.00 0.00 0.00 178.15 179.22 2qcd h THR 300 N 1.01 1.00 -0.55 -0.27 2.02 -0.94 0.12 112.91 115.29 2qcd h THR 300 Ca 0.24 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.31 2qcd h THR 300 Cb 0.12 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.11 2qcd h THR 300 CO -0.03 0.07 0.36 -0.07 0.37 0.00 0.00 175.52 176.22 2qcd h LEU 301 N 0.37 0.62 -0.96 2.58 3.38 -0.82 -2.74 115.31 117.73 2qcd h LEU 301 Ca 0.14 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.11 2qcd h LEU 301 Cb 0.04 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.59 2qcd h LEU 301 CO -0.09 0.45 0.63 0.00 0.09 0.00 0.00 178.44 179.53 2qcd h ALA 302 N 1.21 1.22 0.00 1.53 0.00 -0.44 0.18 119.26 122.95 2qcd h ALA 302 Ca 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2qcd h ALA 302 Cb -0.07 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.34 2qcd h ALA 302 CO -0.05 0.60 0.00 1.63 0.00 0.00 0.00 179.25 181.43 2qcd n LYS 303 N -4.42 0.75 0.00 0.00 5.02 0.38 -1.00 118.16 118.88 2qcd n LYS 303 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 2qcd n LYS 303 Cb 0.02 -1.25 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2qcd n LYS 303 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2qcd n HIS 305 N 0.38 0.00 -2.43 2.13 8.25 0.05 -4.90 115.22 118.71 2qcd n HIS 305 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 57.72 57.42 2qcd n HIS 305 Cb 0.29 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.40 2qcd n HIS 305 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2qcd n GLU 306 N -0.04 -1.43 -3.94 -0.41 1.02 -0.17 -4.62 120.64 111.05 2qcd n GLU 306 Ca 0.00 1.49 -0.09 0.00 -0.02 0.00 0.00 57.16 58.54 2qcd n GLU 306 Cb 0.00 -4.30 -0.09 0.00 -0.02 0.00 0.00 31.44 27.04 2qcd n GLU 306 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 2qcd s PHE 307 N -2.28 0.26 0.35 -0.32 -0.12 -0.52 -4.80 117.98 110.55 2qcd s PHE 307 Ca 0.13 -0.66 -0.06 0.00 -0.05 0.00 0.00 56.93 56.29 2qcd s PHE 307 Cb -0.04 -0.17 -0.05 0.00 -0.63 0.00 0.00 43.02 42.13 2qcd s PHE 307 CO 0.51 -0.43 0.65 -0.51 -0.05 0.00 0.00 175.22 175.39 2qcd s LEU 308 N -2.55 3.93 -0.22 -1.99 1.43 -0.96 -4.62 118.68 113.70 2qcd s LEU 308 Ca 0.01 0.84 -0.08 0.00 -1.03 0.00 0.00 54.13 53.87 2qcd s LEU 308 Cb 0.03 -3.70 -0.04 0.00 0.03 0.00 0.00 46.19 42.51 2qcd s LEU 308 CO -0.08 -0.31 0.09 -0.63 0.23 0.00 0.00 176.35 175.65 2qcd s ILE 309 N -2.28 4.79 -0.26 -0.59 1.01 -1.26 -0.85 121.20 121.77 2qcd s ILE 309 Ca 0.46 -0.02 0.03 0.00 0.00 0.00 0.00 60.65 61.12 2qcd s ILE 309 Cb -0.10 -3.21 0.06 0.00 0.01 0.00 0.00 42.46 39.21 2qcd s ILE 309 CO 0.33 0.38 -0.11 0.12 0.00 0.00 0.00 174.94 175.66 2qcd s PHE 310 N 1.02 3.25 -0.29 3.97 5.36 -0.23 -1.26 117.98 129.80 2qcd s PHE 310 Ca 0.05 -2.26 -0.19 0.00 -0.96 0.00 0.00 56.93 53.57 2qcd s PHE 310 Cb -0.14 -1.94 -0.02 0.00 -0.34 0.00 0.00 43.02 40.58 2qcd s PHE 310 CO 0.03 -0.87 0.56 -2.00 -1.46 0.00 0.00 175.22 171.49 2qcd s GLU 311 N 1.12 3.94 -1.28 10.12 2.56 -0.62 0.05 118.70 134.59 2qcd s GLU 311 Ca -0.08 0.25 -0.07 0.00 0.00 0.00 0.00 54.97 55.07 2qcd s GLU 311 Cb -0.20 -3.71 0.16 0.00 2.00 0.00 0.00 34.13 32.39 2qcd s GLU 311 CO -0.05 -0.48 2.10 -3.47 -0.56 0.00 0.00 175.26 172.79 2qcd n ASP 312 N 5.71 6.71 0.16 -1.70 2.03 -0.40 -3.82 116.55 125.24 2qcd n ASP 312 Ca -0.03 -3.17 0.05 0.00 0.52 0.00 0.00 54.79 52.16 2qcd n ASP 312 Cb 0.49 -1.39 0.09 0.00 -0.72 0.00 0.00 41.12 39.59 2qcd n ASP 312 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 2qcd h ARG 313 N 5.10 0.00 -6.19 -0.67 9.65 -1.83 -3.46 114.38 116.97 2qcd h ARG 313 Ca 0.54 0.00 -0.41 0.00 -1.10 0.00 0.00 59.98 59.01 2qcd h ARG 313 Cb 0.45 0.00 0.08 0.00 -1.39 0.00 0.00 29.97 29.12 2qcd h ARG 313 CO 1.52 0.38 -0.89 1.63 2.80 0.00 0.00 179.97 185.41 2qcd n LYS 314 N -3.22 -1.25 -1.75 0.20 5.02 -1.21 -4.90 118.16 111.04 2qcd n LYS 314 Ca 0.02 0.54 -0.42 0.00 -2.02 0.00 0.00 58.31 56.44 2qcd n LYS 314 Cb 0.67 -4.14 -0.01 0.00 -0.02 0.00 0.00 35.03 31.53 2qcd n LYS 314 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2qcd n PHE 315 N -3.93 2.84 -2.28 2.13 3.72 -0.73 -4.50 117.46 114.72 2qcd n PHE 315 Ca -0.10 0.42 -0.05 0.00 -0.05 0.00 0.00 57.45 57.67 2qcd n PHE 315 Cb 0.59 -2.53 0.01 0.00 -0.94 0.00 0.00 39.48 36.61 2qcd n PHE 315 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qcd n ALA 316 N 0.86 3.39 -2.66 4.37 0.00 -1.26 -0.15 120.51 125.05 2qcd n ALA 316 Ca 0.04 -0.90 -0.30 0.00 0.00 0.00 0.00 53.44 52.28 2qcd n ALA 316 Cb 0.38 -0.53 -0.08 0.00 0.00 0.00 0.00 19.45 19.22 2qcd n ALA 316 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qcd s ASP 317 N -1.14 3.59 0.74 0.00 -1.08 -1.26 -4.76 116.67 112.76 2qcd s ASP 317 Ca 0.05 -1.69 -0.14 0.00 -0.52 0.00 0.00 52.55 50.25 2qcd s ASP 317 Cb 0.18 0.58 0.04 0.00 -1.46 0.00 0.00 42.92 42.27 2qcd s ASP 317 CO -0.05 -0.92 1.15 0.27 0.52 0.00 0.00 175.17 176.14 2qcd s ILE 318 N -3.02 2.69 0.23 4.11 -4.36 -1.26 -4.44 121.20 115.16 2qcd s ILE 318 Ca 0.12 0.30 -0.06 0.00 -0.26 0.00 0.00 60.65 60.75 2qcd s ILE 318 Cb 0.01 -2.76 0.19 0.00 1.25 0.00 0.00 42.46 41.15 2qcd s ILE 318 CO 0.07 -0.22 1.77 1.23 0.24 0.00 0.00 174.94 178.03 2qcd h GLY 319 N -0.53 1.12 1.49 6.27 0.00 -1.88 -1.31 103.07 108.24 2qcd h GLY 319 Ca -0.46 -0.21 0.02 0.00 0.00 0.00 0.00 47.33 46.68 2qcd h GLY 319 CO 0.50 0.01 0.30 -0.57 0.00 0.00 0.00 176.54 176.78 2qcd h ASN 320 N 0.57 0.45 0.12 0.19 -0.73 -1.91 -3.00 115.58 111.27 2qcd h ASN 320 Ca 0.38 -0.01 -0.20 0.00 1.87 0.00 0.00 56.30 58.34 2qcd h ASN 320 Cb 0.46 -0.11 0.01 0.00 0.27 0.00 0.00 38.32 38.95 2qcd h ASN 320 CO -0.31 0.32 -0.94 0.74 -0.37 0.00 0.00 177.43 176.87 2qcd h THR 321 N 0.52 1.38 0.00 -3.57 2.02 -1.62 -3.35 112.91 108.29 2qcd h THR 321 Ca 0.18 -2.48 -0.04 0.00 0.77 0.00 0.00 66.41 64.84 2qcd h THR 321 Cb 0.06 3.05 -0.01 0.00 -1.74 0.00 0.00 68.15 69.52 2qcd h THR 321 CO -0.04 0.69 -0.18 -0.37 0.37 0.00 0.00 175.52 175.99 2qcd h VAL 322 N -0.42 0.94 -0.62 3.16 -1.51 -1.28 -2.18 116.25 114.35 2qcd h VAL 322 Ca -0.18 -0.68 -0.09 0.00 -1.23 0.00 0.00 66.70 64.52 2qcd h VAL 322 Cb 1.62 1.39 -0.02 0.00 -2.13 0.00 0.00 31.29 32.15 2qcd h VAL 322 CO 0.11 0.18 0.03 0.07 -1.23 0.00 0.00 177.57 176.73 2qcd h LYS 323 N 0.00 1.07 -0.54 5.19 2.10 -1.66 -1.22 116.57 121.51 2qcd h LYS 323 Ca -0.00 -0.32 -0.08 0.00 -2.00 0.00 0.00 60.65 58.24 2qcd h LYS 323 Cb 0.37 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.58 2qcd h LYS 323 CO 0.02 1.03 0.02 0.87 -2.00 0.00 0.00 179.45 179.39 2qcd h LYS 324 N 0.97 0.95 0.00 0.07 1.57 -1.60 -1.56 116.57 116.97 2qcd h LYS 324 Ca 0.18 -0.29 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 2qcd h LYS 324 Cb 0.53 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.74 2qcd h LYS 324 CO 0.03 0.95 -0.09 1.96 -0.57 0.00 0.00 179.45 181.73 2qcd h GLN 325 N 0.83 0.00 0.11 3.15 4.20 -1.09 0.19 115.11 122.51 2qcd h GLN 325 Ca 0.16 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.58 2qcd h GLN 325 Cb 0.51 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.28 2qcd h GLN 325 CO 0.02 0.09 -1.50 -0.92 -0.67 0.00 0.00 178.83 175.85 2qcd h TYR 326 N 0.00 0.42 0.04 2.96 3.20 -1.07 -3.39 116.97 119.12 2qcd h TYR 326 Ca -0.00 -0.31 -0.26 0.00 3.14 0.00 0.00 58.73 61.30 2qcd h TYR 326 Cb 0.17 -0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.39 2qcd h TYR 326 CO 0.00 1.59 -1.36 1.49 -1.64 0.00 0.00 178.16 178.24 2qcd h GLU 327 N -0.29 0.08 0.00 1.82 4.81 -1.23 -0.74 114.58 119.02 2qcd h GLU 327 Ca -0.33 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 2qcd h GLU 327 Cb 1.77 0.05 0.00 0.00 0.63 0.00 0.00 28.75 31.20 2qcd h GLU 327 CO 0.04 0.90 0.00 0.41 -0.73 0.00 0.00 179.01 179.63 2qcd n GLY 328 N 1.50 5.84 7.00 1.92 0.00 0.67 -4.46 105.19 117.67 2qcd n GLY 328 Ca -0.10 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.01 2qcd n GLY 328 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qcd n GLY 329 N 5.00 0.05 0.20 -0.02 0.00 -1.26 -2.30 105.19 106.86 2qcd n GLY 329 Ca 0.00 -0.93 -0.08 0.00 0.00 0.00 0.00 46.02 45.01 2qcd n GLY 329 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2qcd h ILE 330 N 0.00 1.34 0.00 -0.61 1.08 -1.97 -3.33 117.51 114.02 2qcd h ILE 330 Ca 0.00 -1.84 -0.18 0.00 -0.39 0.00 0.00 64.86 62.45 2qcd h ILE 330 Cb 0.00 1.84 -0.03 0.00 -3.07 0.00 0.00 36.82 35.56 2qcd h ILE 330 CO 0.00 0.56 -0.87 -0.26 -0.69 0.00 0.00 178.15 176.90 2qcd h PHE 331 N 0.36 0.00 -6.92 1.37 0.04 -1.95 -3.46 116.94 106.38 2qcd h PHE 331 Ca 0.00 0.00 -0.59 0.00 2.80 0.00 0.00 57.97 60.19 2qcd h PHE 331 Cb 1.10 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 39.09 2qcd h PHE 331 CO 0.04 0.87 -0.95 1.63 -0.60 0.00 0.00 178.31 179.29 2qcd n LYS 332 N -3.45 -1.48 -0.23 1.51 5.02 -0.97 -4.83 118.16 113.73 2qcd n LYS 332 Ca -0.00 0.17 0.04 0.00 -2.02 0.00 0.00 58.31 56.50 2qcd n LYS 332 Cb 0.84 -3.75 0.15 0.00 -0.02 0.00 0.00 35.03 32.25 2qcd n LYS 332 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2qcd h ILE 333 N -1.86 0.52 0.00 -0.18 2.04 -1.74 0.22 117.51 116.51 2qcd h ILE 333 Ca -0.66 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 2qcd h ILE 333 Cb 1.39 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.74 2qcd h ILE 333 CO 0.67 0.04 -0.01 0.00 0.00 0.00 0.00 178.15 178.86 2qcd h ALA 334 N 1.58 1.04 0.00 1.87 0.00 -1.43 -1.25 119.26 121.08 2qcd h ALA 334 Ca 0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2qcd h ALA 334 Cb 0.64 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2qcd h ALA 334 CO -0.50 0.01 0.00 0.77 0.00 0.00 0.00 179.25 179.53 2qcd h SER 335 N 0.00 0.00 0.00 0.00 0.02 -1.22 -3.37 113.55 108.98 2qcd h SER 335 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2qcd h SER 335 Cb 0.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2qcd h SER 335 CO 0.00 0.00 -0.04 -2.67 -1.14 0.00 0.00 176.83 172.98 2qcd n TRP 336 N -2.48 0.00 -3.33 3.45 4.27 -0.68 -5.06 117.44 113.60 2qcd n TRP 336 Ca 0.03 0.00 -0.39 0.00 -3.89 0.00 0.00 57.50 53.25 2qcd n TRP 336 Cb 0.32 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.19 2qcd n TRP 336 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2qcd s ALA 337 N -0.16 3.57 0.16 -1.67 0.00 -0.56 -4.83 121.76 118.27 2qcd s ALA 337 Ca 0.00 -0.70 -0.14 0.00 0.00 0.00 0.00 51.96 51.12 2qcd s ALA 337 Cb 0.00 -2.76 0.05 0.00 0.00 0.00 0.00 23.12 20.41 2qcd s ALA 337 CO 0.00 -0.64 1.79 -0.44 0.00 0.00 0.00 175.76 176.47 2qcd h ASP 338 N 8.00 0.62 -4.28 0.00 3.32 -1.52 -3.45 116.42 119.12 2qcd h ASP 338 Ca -0.31 -0.07 -0.53 0.00 0.02 0.00 0.00 57.03 56.14 2qcd h ASP 338 Cb 1.15 -0.16 -0.24 0.00 0.22 0.00 0.00 39.33 40.31 2qcd h ASP 338 CO 0.68 0.51 -0.82 -0.76 -1.72 0.00 0.00 179.24 177.13 2qcd s LEU 339 N -10.03 2.21 0.34 1.55 1.43 -0.59 -1.66 118.68 111.94 2qcd s LEU 339 Ca -0.13 -0.56 0.03 0.00 -1.03 0.00 0.00 54.13 52.44 2qcd s LEU 339 Cb 0.12 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.48 2qcd s LEU 339 CO 0.75 0.08 0.11 0.68 0.23 0.00 0.00 176.35 178.21 2qcd s VAL 340 N -0.95 0.69 0.20 -1.59 -7.23 -1.04 -1.59 120.40 108.89 2qcd s VAL 340 Ca 0.05 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.27 2qcd s VAL 340 Cb -0.09 -2.54 -0.05 0.00 0.56 0.00 0.00 36.38 34.26 2qcd s VAL 340 CO 0.02 0.00 -0.07 0.54 -0.31 0.00 0.00 175.10 175.28 2qcd s ASN 341 N -3.49 2.03 -0.01 4.85 4.22 -1.25 -0.51 114.94 120.78 2qcd s ASN 341 Ca 0.31 -1.10 -0.01 0.00 -2.14 0.00 0.00 52.86 49.93 2qcd s ASN 341 Cb 0.05 -0.04 0.00 0.00 1.28 0.00 0.00 41.25 42.55 2qcd s ASN 341 CO 0.15 -0.36 0.02 0.00 -2.04 0.00 0.00 177.10 174.87 2qcd s ALA 342 N -3.27 -0.05 0.46 3.54 0.00 -0.23 -1.78 121.76 120.44 2qcd s ALA 342 Ca 0.23 0.08 -0.22 0.00 0.00 0.00 0.00 51.96 52.04 2qcd s ALA 342 Cb 0.03 -0.05 -0.08 0.00 0.00 0.00 0.00 23.12 23.02 2qcd s ALA 342 CO 0.05 -0.02 1.12 -1.01 0.00 0.00 0.00 175.76 175.91 2qcd s HIS 343 N 0.08 2.95 -1.26 0.00 3.76 0.79 -1.47 115.29 120.13 2qcd s HIS 343 Ca -0.01 1.56 0.25 0.00 -0.15 0.00 0.00 55.06 56.72 2qcd s HIS 343 Cb -0.01 -3.28 0.44 0.00 1.11 0.00 0.00 32.58 30.85 2qcd s HIS 343 CO -0.00 -1.25 1.37 1.33 -0.85 0.00 0.00 174.74 175.33 2qcd n VAL 344 N -0.55 0.00 -0.11 -0.90 0.24 -1.26 -4.49 118.33 111.26 2qcd n VAL 344 Ca 0.08 -0.05 0.18 0.00 -2.04 0.00 0.00 64.34 62.50 2qcd n VAL 344 Cb 0.49 0.45 0.58 0.00 -1.47 0.00 0.00 33.84 33.89 2qcd n VAL 344 CO 0.00 0.00 0.00 1.62 -2.14 0.00 0.00 176.83 176.31 2qcd h VAL 345 N 0.47 0.77 0.00 3.34 3.04 -1.94 -0.71 116.25 121.21 2qcd h VAL 345 Ca 0.00 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.60 2qcd h VAL 345 Cb 0.52 0.49 0.00 0.00 -2.01 0.00 0.00 31.29 30.28 2qcd h VAL 345 CO 0.00 0.05 0.00 -2.65 -1.01 0.00 0.00 177.57 173.96 2qcd n PRO 346 N -4.44 0.25 0.00 4.17 -0.02 -1.26 -5.02 135.00 128.68 2qcd n PRO 346 Ca 0.13 0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2qcd n PRO 346 Cb 0.57 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.55 2qcd n PRO 346 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qcd n GLY 347 N 0.46 -0.75 0.08 -1.23 0.00 -0.27 -4.66 105.19 98.82 2qcd n GLY 347 Ca 0.09 -1.71 0.09 0.00 0.00 0.00 0.00 46.02 44.49 2qcd n GLY 347 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2qcd n SER 348 N -1.16 0.37 0.03 1.61 3.41 -1.26 -1.89 113.62 114.73 2qcd n SER 348 Ca 0.00 0.60 0.20 0.00 -0.26 0.00 0.00 58.87 59.42 2qcd n SER 348 Cb 0.00 -0.68 0.71 0.00 -0.26 0.00 0.00 64.21 63.98 2qcd n SER 348 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2qcd h GLY 349 N 1.95 0.00 1.00 5.00 0.00 -1.96 -0.75 103.07 108.30 2qcd h GLY 349 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2qcd h GLY 349 CO 0.00 0.00 0.31 -0.24 0.00 0.00 0.00 176.54 176.61 2qcd h VAL 350 N 0.00 1.21 -0.17 4.60 3.04 -1.59 -1.79 116.25 121.55 2qcd h VAL 350 Ca 0.23 -0.57 -0.13 0.00 -1.01 0.00 0.00 66.70 65.22 2qcd h VAL 350 Cb 0.99 0.45 0.00 0.00 -2.01 0.00 0.00 31.29 30.72 2qcd h VAL 350 CO -0.00 0.24 -0.41 0.58 -1.01 0.00 0.00 177.57 176.97 2qcd h VAL 351 N 0.85 1.34 -0.66 1.51 2.07 -1.41 -2.63 116.25 117.32 2qcd h VAL 351 Ca 0.22 -1.66 0.00 0.00 0.82 0.00 0.00 66.70 66.08 2qcd h VAL 351 Cb 0.09 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 31.79 2qcd h VAL 351 CO -0.03 0.51 0.43 0.11 0.02 0.00 0.00 177.57 178.61 2qcd h LYS 352 N 0.23 0.87 -0.07 1.57 1.57 -1.20 0.56 116.57 120.11 2qcd h LYS 352 Ca -0.00 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2qcd h LYS 352 Cb 1.02 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 2qcd h LYS 352 CO 0.09 0.58 -0.02 0.78 -0.57 0.00 0.00 179.45 180.31 2qcd h GLY 353 N 0.90 0.14 0.98 3.86 0.00 -1.34 -3.04 103.07 104.57 2qcd h GLY 353 Ca 0.24 -0.12 0.02 0.00 0.00 0.00 0.00 47.33 47.47 2qcd h GLY 353 CO -0.05 0.11 0.62 1.41 0.00 0.00 0.00 176.54 178.63 2qcd h LEU 354 N -0.22 1.07 -1.28 3.11 3.38 -1.07 -2.65 115.31 117.66 2qcd h LEU 354 Ca 0.02 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.06 2qcd h LEU 354 Cb 0.43 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 2qcd h LEU 354 CO 0.01 0.77 0.54 1.56 0.09 0.00 0.00 178.44 181.41 2qcd h GLN 355 N 1.26 0.79 -0.86 1.13 4.20 -0.88 0.22 115.11 120.98 2qcd h GLN 355 Ca 0.35 -0.05 0.13 0.00 0.06 0.00 0.00 58.65 59.14 2qcd h GLN 355 Cb -0.12 -0.18 -0.06 0.00 0.30 0.00 0.00 27.48 27.42 2qcd h GLN 355 CO -0.09 0.52 0.55 0.93 -0.67 0.00 0.00 178.83 180.08 2qcd h GLU 356 N 0.81 0.68 0.09 1.46 5.08 -1.35 -1.87 114.58 119.48 2qcd h GLU 356 Ca 0.38 -0.04 -0.32 0.00 -1.00 0.00 0.00 59.36 58.38 2qcd h GLU 356 Cb 0.41 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 2qcd h GLU 356 CO -0.15 0.45 -1.76 0.28 -1.00 0.00 0.00 179.01 176.83 2qcd h VAL 357 N 0.70 0.73 -0.41 3.13 2.07 -1.15 -3.41 116.25 117.91 2qcd h VAL 357 Ca 0.42 -2.30 -0.15 0.00 0.82 0.00 0.00 66.70 65.49 2qcd h VAL 357 Cb 0.63 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.81 2qcd h VAL 357 CO -0.18 0.72 -0.32 1.23 0.02 0.00 0.00 177.57 179.03 2qcd h GLY 358 N 0.41 1.00 0.83 2.17 0.00 -0.51 -3.26 103.07 103.71 2qcd h GLY 358 Ca -0.40 -0.97 -0.01 0.00 0.00 0.00 0.00 47.33 45.96 2qcd h GLY 358 CO -0.00 0.87 0.03 1.41 0.00 0.00 0.00 176.54 178.86 2qcd h LEU 359 N 0.77 0.16 -1.64 3.11 3.38 -1.58 -0.07 115.31 119.44 2qcd h LEU 359 Ca 0.08 -0.21 0.13 0.00 0.09 0.00 0.00 57.88 57.97 2qcd h LEU 359 Cb 0.90 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.57 2qcd h LEU 359 CO 0.08 0.32 0.45 -0.65 0.09 0.00 0.00 178.44 178.74 2qcd h PRO 360 N -0.02 0.37 -0.46 1.13 0.11 -1.80 -0.90 132.00 130.44 2qcd h PRO 360 Ca 0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.12 2qcd h PRO 360 Cb 0.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.25 2qcd h PRO 360 CO -0.00 0.25 0.00 1.28 -0.21 0.00 0.00 178.00 179.31 2qcd n LEU 361 N -4.47 2.61 -3.11 2.35 4.77 -0.70 -4.94 117.00 113.52 2qcd n LEU 361 Ca 0.12 -1.28 -0.22 0.00 -0.03 0.00 0.00 56.01 54.61 2qcd n LEU 361 Cb 0.47 -0.30 0.05 0.00 -2.33 0.00 0.00 43.42 41.30 2qcd n LEU 361 CO 0.34 0.64 0.10 1.41 -1.33 0.00 0.00 177.39 178.54 2qcd n HIS 362 N 0.92 -2.24 -3.10 -1.77 8.25 -0.16 -4.98 115.22 112.14 2qcd n HIS 362 Ca 0.17 0.70 -0.18 0.00 -0.26 0.00 0.00 57.72 58.14 2qcd n HIS 362 Cb 0.42 -4.55 0.01 0.00 1.12 0.00 0.00 29.99 26.99 2qcd n HIS 362 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2qcd s ARG 363 N -5.90 2.89 0.31 -0.41 1.81 -0.48 -4.81 118.95 112.36 2qcd s ARG 363 Ca 0.40 -1.07 0.05 0.00 -1.72 0.00 0.00 55.73 53.40 2qcd s ARG 363 Cb -0.18 -2.73 -0.06 0.00 -0.45 0.00 0.00 34.95 31.53 2qcd s ARG 363 CO 0.50 -0.23 0.01 0.20 -0.68 0.00 0.00 175.30 175.10 2qcd s GLY 364 N -4.30 1.98 0.02 -3.53 0.00 -0.66 -4.70 107.32 96.12 2qcd s GLY 364 Ca 0.52 -2.00 0.01 0.00 0.00 0.00 0.00 44.72 43.25 2qcd s GLY 364 CO 0.33 -1.84 -0.05 0.00 0.00 0.00 0.00 173.10 171.55 2qcd s LEU 366 N -1.01 2.43 -0.14 0.00 1.43 0.33 -0.60 118.68 121.12 2qcd s LEU 366 Ca -0.07 -0.38 -0.08 0.00 -1.03 0.00 0.00 54.13 52.57 2qcd s LEU 366 Cb -0.07 -1.49 -0.04 0.00 0.03 0.00 0.00 46.19 44.62 2qcd s LEU 366 CO -0.00 0.25 0.15 -0.76 0.23 0.00 0.00 176.35 176.21 2qcd s LEU 367 N -0.15 4.34 -0.64 1.79 1.43 -0.07 -1.07 118.68 124.31 2qcd s LEU 367 Ca -0.02 0.42 -0.25 0.00 -1.03 0.00 0.00 54.13 53.25 2qcd s LEU 367 Cb -0.14 -2.09 0.05 0.00 0.03 0.00 0.00 46.19 44.04 2qcd s LEU 367 CO 0.04 0.34 1.06 -0.63 0.23 0.00 0.00 176.35 177.39 2qcd s ILE 368 N -0.62 4.16 -0.11 -0.59 1.01 -0.54 -1.27 121.20 123.24 2qcd s ILE 368 Ca 0.13 0.14 0.13 0.00 0.00 0.00 0.00 60.65 61.05 2qcd s ILE 368 Cb -0.12 -4.71 -0.24 0.00 0.01 0.00 0.00 42.46 37.41 2qcd s ILE 368 CO 0.03 -1.45 0.42 0.00 0.00 0.00 0.00 174.94 173.93 2qcd n ALA 369 N 8.13 1.47 -2.78 9.38 0.00 -0.36 -4.49 120.51 131.86 2qcd n ALA 369 Ca 0.01 -0.97 -0.10 0.00 0.00 0.00 0.00 53.44 52.38 2qcd n ALA 369 Cb 0.47 -0.59 -0.08 0.00 0.00 0.00 0.00 19.45 19.26 2qcd n ALA 369 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2qcd s GLU 370 N -2.56 0.75 0.20 0.00 2.02 -1.14 -4.16 118.70 113.81 2qcd s GLU 370 Ca -0.08 -0.72 0.10 0.00 0.02 0.00 0.00 54.97 54.29 2qcd s GLU 370 Cb 0.07 0.31 -0.04 0.00 0.10 0.00 0.00 34.13 34.57 2qcd s GLU 370 CO 0.82 -0.23 -0.20 -1.64 0.02 0.00 0.00 175.26 174.03 2qcd s MET 371 N -2.96 1.44 0.00 1.61 -1.94 -1.26 -4.11 119.30 112.08 2qcd s MET 371 Ca -0.02 -1.54 0.27 0.00 -1.71 0.00 0.00 55.69 52.69 2qcd s MET 371 Cb 0.01 -1.57 0.87 0.00 2.01 0.00 0.00 34.83 36.16 2qcd s MET 371 CO -0.06 0.32 1.67 -1.13 -0.01 0.00 0.00 175.02 175.81 2qcd n SER 372 N 0.03 0.26 -4.90 3.03 3.41 -1.26 -4.88 113.62 109.31 2qcd n SER 372 Ca -0.11 0.10 -0.30 0.00 -0.26 0.00 0.00 58.87 58.31 2qcd n SER 372 Cb 0.58 -0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 64.37 2qcd n SER 372 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2qcd s SER 373 N -2.99 6.48 0.25 4.04 1.04 -1.26 -3.05 113.70 118.21 2qcd s SER 373 Ca 0.13 0.66 -0.30 0.00 0.48 0.00 0.00 55.95 56.92 2qcd s SER 373 Cb 0.18 -2.12 -0.10 0.00 0.10 0.00 0.00 66.02 64.08 2qcd s SER 373 CO 0.61 -0.07 1.40 0.42 0.98 0.00 0.00 173.24 176.58 2qcd s THR 374 N -1.87 2.75 0.00 2.02 -4.23 0.81 -1.93 115.64 113.18 2qcd s THR 374 Ca 0.43 0.64 0.00 0.00 -1.18 0.00 0.00 61.69 61.58 2qcd s THR 374 Cb -0.11 -3.41 0.00 0.00 1.34 0.00 0.00 72.50 70.32 2qcd s THR 374 CO 0.27 0.11 0.00 0.61 -0.54 0.00 0.00 174.62 175.06 2qcd n GLY 375 N 2.02 0.72 3.57 3.99 0.00 -1.26 -4.97 105.19 109.26 2qcd n GLY 375 Ca 0.06 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.57 2qcd n GLY 375 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2qcd n SER 376 N 0.00 1.26 -0.76 1.61 2.88 -0.81 -4.87 113.62 112.92 2qcd n SER 376 Ca 0.00 1.13 0.12 0.00 -1.33 0.00 0.00 58.87 58.80 2qcd n SER 376 Cb 0.00 -1.17 0.31 0.00 -0.75 0.00 0.00 64.21 62.60 2qcd n SER 376 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2qcd n LEU 377 N 2.16 2.34 -3.76 2.46 4.77 -1.26 -4.65 117.00 119.06 2qcd n LEU 377 Ca 0.17 -0.85 -0.42 0.00 -0.03 0.00 0.00 56.01 54.88 2qcd n LEU 377 Cb 0.21 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 2qcd n LEU 377 CO 0.61 0.43 2.38 0.00 -1.33 0.00 0.00 177.39 179.47 2qcd n ALA 378 N 0.80 5.62 -2.27 -1.18 0.00 -1.26 -4.83 120.51 117.40 2qcd n ALA 378 Ca 0.17 -4.07 -0.15 0.00 0.00 0.00 0.00 53.44 49.39 2qcd n ALA 378 Cb 0.47 -3.24 -0.10 0.00 0.00 0.00 0.00 19.45 16.58 2qcd n ALA 378 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2qcd s THR 379 N 1.67 0.85 0.00 0.00 -4.23 -1.26 -4.32 115.64 108.35 2qcd s THR 379 Ca 0.45 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 2qcd s THR 379 Cb 0.12 -2.15 0.00 0.00 1.34 0.00 0.00 72.50 71.82 2qcd s THR 379 CO -0.05 -0.47 0.00 0.61 -0.54 0.00 0.00 174.62 174.18 2qcd n GLY 380 N -0.29 3.33 0.26 3.99 0.00 -1.26 -0.94 105.19 110.28 2qcd n GLY 380 Ca -0.07 0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.24 2qcd n GLY 380 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2qcd h ASP 381 N 0.00 0.00 -0.00 1.61 3.32 -1.98 -1.47 116.42 117.90 2qcd h ASP 381 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qcd h ASP 381 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2qcd h ASP 381 CO 0.00 0.10 0.00 0.22 -1.72 0.00 0.00 179.24 177.84 2qcd h TYR 382 N 0.00 0.00 -0.58 4.55 3.20 -1.36 -0.17 116.97 122.61 2qcd h TYR 382 Ca -0.00 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.94 2qcd h TYR 382 Cb 0.26 -0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.46 2qcd h TYR 382 CO 0.00 0.27 0.25 1.15 -1.64 0.00 0.00 178.16 178.19 2qcd h THR 383 N -0.27 0.85 -0.75 1.81 2.02 -1.29 -1.77 112.91 113.50 2qcd h THR 383 Ca 0.00 -0.16 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 2qcd h THR 383 Cb 0.27 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 2qcd h THR 383 CO 0.00 0.08 0.23 0.03 0.37 0.00 0.00 175.52 176.23 2qcd h ARG 384 N 0.46 1.17 -0.95 6.66 3.08 -1.13 -2.01 114.38 121.66 2qcd h ARG 384 Ca 0.28 -0.25 0.06 0.00 0.07 0.00 0.00 59.98 60.14 2qcd h ARG 384 Cb 0.29 -0.17 -0.06 0.00 0.08 0.00 0.00 29.97 30.11 2qcd h ARG 384 CO -0.25 0.99 0.61 0.00 -1.07 0.00 0.00 179.97 180.25 2qcd h ALA 385 N 1.12 1.30 -0.41 0.04 0.00 -0.50 -0.85 119.26 119.96 2qcd h ALA 385 Ca 0.24 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.14 2qcd h ALA 385 Cb 0.32 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2qcd h ALA 385 CO -0.01 0.40 0.26 0.00 0.00 0.00 0.00 179.25 179.89 2qcd h ALA 386 N 1.43 0.52 -0.26 0.00 0.00 -0.72 -0.64 119.26 119.59 2qcd h ALA 386 Ca 0.41 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 2qcd h ALA 386 Cb 0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2qcd h ALA 386 CO -0.17 -0.06 0.09 0.28 0.00 0.00 0.00 179.25 179.39 2qcd h VAL 387 N 0.52 1.19 -0.27 0.00 2.07 -1.02 -1.49 116.25 117.25 2qcd h VAL 387 Ca 0.16 -0.60 0.05 0.00 0.82 0.00 0.00 66.70 67.13 2qcd h VAL 387 Cb -0.02 1.09 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 2qcd h VAL 387 CO -0.06 0.20 -0.03 0.03 0.02 0.00 0.00 177.57 177.73 2qcd h ARG 388 N 0.27 0.04 -0.97 1.57 3.08 -0.96 -1.41 114.38 116.00 2qcd h ARG 388 Ca 0.09 -0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.17 2qcd h ARG 388 Cb 0.22 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 2qcd h ARG 388 CO -0.00 0.03 0.64 1.98 -1.07 0.00 0.00 179.97 181.54 2qcd h MET 389 N 0.04 1.18 -0.36 0.04 4.05 -0.92 -1.29 114.93 117.67 2qcd h MET 389 Ca 0.13 -0.07 -0.07 0.00 -0.28 0.00 0.00 59.70 59.41 2qcd h MET 389 Cb 0.18 -0.27 -0.01 0.00 -0.80 0.00 0.00 31.60 30.71 2qcd h MET 389 CO -0.25 0.78 -0.04 0.00 0.23 0.00 0.00 176.91 177.63 2qcd h ALA 390 N 1.44 0.49 -0.41 0.39 0.00 -0.88 -2.56 119.26 117.73 2qcd h ALA 390 Ca 0.39 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2qcd h ALA 390 Cb 0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2qcd h ALA 390 CO -0.13 0.30 0.20 0.93 0.00 0.00 0.00 179.25 180.56 2qcd h GLU 391 N 0.47 0.56 -0.00 0.00 5.08 -0.60 -2.57 114.58 117.53 2qcd h GLU 391 Ca 0.10 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2qcd h GLU 391 Cb 0.53 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2qcd h GLU 391 CO 0.03 0.44 -0.13 0.39 -1.00 0.00 0.00 179.01 178.73 2qcd n GLU 392 N -4.41 0.54 -2.53 2.33 1.02 -0.55 -3.84 120.64 113.19 2qcd n GLU 392 Ca 0.03 -0.18 -0.14 0.00 -0.02 0.00 0.00 57.16 56.85 2qcd n GLU 392 Cb 0.12 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.07 2qcd n GLU 392 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2qcd n HIS 393 N -1.07 2.03 0.34 -0.32 8.25 -0.98 -4.92 115.22 118.55 2qcd n HIS 393 Ca 0.13 -2.57 0.11 0.00 -0.26 0.00 0.00 57.72 55.13 2qcd n HIS 393 Cb 0.29 -0.26 0.49 0.00 1.12 0.00 0.00 29.99 31.63 2qcd n HIS 393 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2qcd n SER 394 N -0.44 0.59 0.24 0.41 3.41 -1.14 -0.56 113.62 116.13 2qcd n SER 394 Ca 0.23 0.67 0.11 0.00 -0.26 0.00 0.00 58.87 59.62 2qcd n SER 394 Cb 0.81 -0.79 0.62 0.00 -0.26 0.00 0.00 64.21 64.59 2qcd n SER 394 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2qcd h GLU 395 N 0.00 0.00 0.00 4.33 5.08 -1.91 -3.36 114.58 118.72 2qcd h GLU 395 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 2qcd h GLU 395 Cb 0.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 2qcd h GLU 395 CO 0.00 0.17 -1.12 0.34 -1.00 0.00 0.00 179.01 177.40 2qcd n PHE 396 N -3.56 0.00 -2.86 4.33 7.35 -0.68 -5.01 117.46 117.02 2qcd n PHE 396 Ca -0.01 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.26 2qcd n PHE 396 Cb 0.32 -0.08 -0.04 0.00 0.35 0.00 0.00 39.48 40.02 2qcd n PHE 396 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 2qcd s VAL 397 N -2.04 4.83 -1.60 -2.13 1.01 0.28 -1.29 120.40 119.45 2qcd s VAL 397 Ca -0.03 1.65 0.16 0.00 0.00 0.00 0.00 61.98 63.77 2qcd s VAL 397 Cb 0.01 -4.15 0.03 0.00 0.00 0.00 0.00 36.38 32.26 2qcd s VAL 397 CO 0.05 -0.05 0.89 1.33 0.00 0.00 0.00 175.10 177.32 2qcd n VAL 398 N 5.09 0.00 -1.75 2.92 0.24 0.23 -4.54 118.33 120.52 2qcd n VAL 398 Ca 0.06 -0.37 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 2qcd n VAL 398 Cb 0.48 1.22 0.00 0.00 -1.47 0.00 0.00 33.84 34.07 2qcd n VAL 398 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2qcd n GLY 399 N 1.09 -0.51 2.98 7.63 0.00 -1.23 -0.99 105.19 114.18 2qcd n GLY 399 Ca 0.07 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.08 2qcd n GLY 399 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qcd s PHE 400 N -3.55 0.42 -0.22 1.61 0.08 -0.17 -0.89 117.98 115.26 2qcd s PHE 400 Ca 0.00 -0.31 -0.18 0.00 0.12 0.00 0.00 56.93 56.56 2qcd s PHE 400 Cb 0.00 -0.26 -0.03 0.00 -0.57 0.00 0.00 43.02 42.16 2qcd s PHE 400 CO 0.00 -0.07 0.52 0.42 -0.10 0.00 0.00 175.22 175.99 2qcd s ILE 401 N -0.81 5.09 0.22 0.64 -1.09 -0.39 -1.04 121.20 123.81 2qcd s ILE 401 Ca -0.06 0.94 -0.20 0.00 -2.23 0.00 0.00 60.65 59.10 2qcd s ILE 401 Cb -0.06 -3.84 0.03 0.00 -1.58 0.00 0.00 42.46 37.01 2qcd s ILE 401 CO -0.00 0.14 0.60 -0.94 -1.23 0.00 0.00 174.94 173.51 2qcd s SER 402 N 1.29 -0.32 0.00 3.58 1.04 -0.45 -1.23 113.70 117.61 2qcd s SER 402 Ca 0.23 -0.44 0.26 0.00 0.48 0.00 0.00 55.95 56.47 2qcd s SER 402 Cb -0.15 0.63 0.62 0.00 0.10 0.00 0.00 66.02 67.22 2qcd s SER 402 CO 0.09 -1.13 1.48 0.61 0.98 0.00 0.00 173.24 175.27 2qcd n GLY 403 N -0.39 -0.71 3.81 7.32 0.00 -1.26 -3.85 105.19 110.11 2qcd n GLY 403 Ca -0.09 -0.42 -0.08 0.00 0.00 0.00 0.00 46.02 45.43 2qcd n GLY 403 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qcd s SER 404 N -2.62 -0.05 0.16 1.61 1.04 -1.26 -4.89 113.70 107.69 2qcd s SER 404 Ca 0.21 -0.99 -0.32 0.00 0.48 0.00 0.00 55.95 55.33 2qcd s SER 404 Cb 0.19 0.81 -0.10 0.00 0.10 0.00 0.00 66.02 67.01 2qcd s SER 404 CO 0.57 -1.57 1.66 -0.60 0.98 0.00 0.00 173.24 174.28 2qcd s ARG 405 N -2.85 4.17 0.00 4.02 3.52 -0.33 -4.79 118.95 122.70 2qcd s ARG 405 Ca 0.15 2.46 0.00 0.00 -0.13 0.00 0.00 55.73 58.21 2qcd s ARG 405 Cb -0.05 -3.24 0.00 0.00 -1.56 0.00 0.00 34.95 30.10 2qcd s ARG 405 CO 0.10 -0.70 0.00 1.33 -0.81 0.00 0.00 175.30 175.22 2qcd n VAL 406 N 4.17 0.00 -4.89 7.11 0.24 -1.26 -5.01 118.33 118.69 2qcd n VAL 406 Ca 0.15 -0.20 -0.31 0.00 -2.04 0.00 0.00 64.34 61.94 2qcd n VAL 406 Cb 0.38 0.70 -0.14 0.00 -1.47 0.00 0.00 33.84 33.30 2qcd n VAL 406 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2qcd s SER 407 N -1.41 3.40 0.00 -1.34 0.15 -1.26 -4.99 113.70 108.25 2qcd s SER 407 Ca 0.00 -0.50 0.28 0.00 0.70 0.00 0.00 55.95 56.44 2qcd s SER 407 Cb 0.00 -0.43 1.13 0.00 -1.71 0.00 0.00 66.02 65.00 2qcd s SER 407 CO 0.00 0.27 1.79 0.23 1.20 0.00 0.00 173.24 176.73 2qcd n MET 408 N 1.84 1.05 -2.84 5.44 0.00 -1.26 -4.84 117.12 116.51 2qcd n MET 408 Ca -0.17 -0.49 -0.42 0.00 0.00 0.00 0.00 57.70 56.62 2qcd n MET 408 Cb 0.52 -1.49 -0.04 0.00 0.00 0.00 0.00 33.22 32.21 2qcd n MET 408 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2qcd s LYS 409 N -2.29 4.20 0.00 0.03 1.02 -1.26 -4.89 119.74 116.55 2qcd s LYS 409 Ca 0.32 1.04 0.16 0.00 0.02 0.00 0.00 55.97 57.51 2qcd s LYS 409 Cb 0.20 -3.64 0.71 0.00 -0.52 0.00 0.00 37.83 34.58 2qcd s LYS 409 CO 0.43 -0.54 1.50 -0.35 -0.92 0.00 0.00 175.35 175.48 2qcd n PRO 410 N 6.06 0.04 0.25 -1.68 -0.04 -1.26 -2.21 135.00 136.16 2qcd n PRO 410 Ca 0.07 0.21 0.13 0.00 -0.04 0.00 0.00 63.50 63.87 2qcd n PRO 410 Cb 0.47 -1.50 0.59 0.00 -0.04 0.00 0.00 33.50 33.02 2qcd n PRO 410 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2qcd h GLU 411 N 0.00 0.00 -6.24 0.54 3.07 -1.91 -3.44 114.58 106.59 2qcd h GLU 411 Ca 0.00 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 58.30 2qcd h GLU 411 Cb 0.25 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.12 2qcd h GLU 411 CO 0.00 0.12 0.05 -0.06 -1.40 0.00 0.00 179.01 177.72 2qcd s PHE 412 N -3.73 3.77 0.25 4.33 2.99 -0.94 -4.77 117.98 119.88 2qcd s PHE 412 Ca 0.00 1.35 -0.10 0.00 0.00 0.00 0.00 56.93 58.18 2qcd s PHE 412 Cb 0.10 -2.65 -0.07 0.00 0.00 0.00 0.00 43.02 40.40 2qcd s PHE 412 CO 0.59 0.43 0.58 -0.51 -0.00 0.00 0.00 175.22 176.30 2qcd s LEU 413 N -0.56 4.14 -0.16 -0.37 1.43 -0.16 -4.95 118.68 118.05 2qcd s LEU 413 Ca 0.33 0.96 0.01 0.00 -1.03 0.00 0.00 54.13 54.40 2qcd s LEU 413 Cb -0.20 -3.73 0.02 0.00 0.03 0.00 0.00 46.19 42.30 2qcd s LEU 413 CO 0.20 -0.10 -0.19 -1.00 0.23 0.00 0.00 176.35 175.49 2qcd s HIS 414 N -1.86 2.59 -0.10 0.29 3.76 -1.26 -1.00 115.29 117.70 2qcd s HIS 414 Ca 0.48 -1.44 0.02 0.00 -0.15 0.00 0.00 55.06 53.97 2qcd s HIS 414 Cb -0.11 -1.80 -0.01 0.00 1.11 0.00 0.00 32.58 31.76 2qcd s HIS 414 CO 0.21 -0.71 -0.17 -0.51 -0.85 0.00 0.00 174.74 172.72 2qcd s LEU 415 N 1.17 2.53 -0.23 0.89 1.02 -0.21 -1.24 118.68 122.61 2qcd s LEU 415 Ca 0.01 -0.37 0.01 0.00 0.02 0.00 0.00 54.13 53.80 2qcd s LEU 415 Cb -0.14 -1.54 0.05 0.00 0.02 0.00 0.00 46.19 44.59 2qcd s LEU 415 CO -0.09 0.20 -0.08 -0.89 0.02 0.00 0.00 176.35 175.52 2qcd s THR 416 N 0.11 1.69 0.76 5.49 2.01 0.10 -1.34 115.64 124.45 2qcd s THR 416 Ca -0.08 -1.24 -0.04 0.00 0.31 0.00 0.00 61.69 60.64 2qcd s THR 416 Cb -0.15 -1.87 0.13 0.00 0.01 0.00 0.00 72.50 70.62 2qcd s THR 416 CO 0.05 -0.01 1.05 -2.16 -0.69 0.00 0.00 174.62 172.87 2qcd s PRO 417 N 1.34 1.55 -0.29 4.92 0.04 -1.26 -0.60 135.00 140.70 2qcd s PRO 417 Ca -0.05 -0.88 -0.00 0.00 0.04 0.00 0.00 61.00 60.11 2qcd s PRO 417 Cb -0.18 -2.23 -0.00 0.00 0.04 0.00 0.00 34.50 32.13 2qcd s PRO 417 CO -0.07 -1.59 0.24 0.41 0.04 0.00 0.00 177.00 176.03 2qcd n GLY 418 N -3.01 0.26 3.09 0.56 0.00 -1.26 -4.79 105.19 100.04 2qcd n GLY 418 Ca 0.14 -0.33 -0.26 0.00 0.00 0.00 0.00 46.02 45.57 2qcd n GLY 418 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qcd s VAL 419 N -3.09 1.39 0.05 1.61 1.01 -1.26 -1.18 120.40 118.93 2qcd s VAL 419 Ca 0.01 -0.65 -0.16 0.00 0.00 0.00 0.00 61.98 61.17 2qcd s VAL 419 Cb -0.00 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 35.18 2qcd s VAL 419 CO 0.18 0.41 0.37 -1.10 0.00 0.00 0.00 175.10 174.95 2qcd s GLN 420 N 0.40 0.89 0.22 2.72 -0.21 -0.66 -4.74 119.66 118.28 2qcd s GLN 420 Ca -0.12 -0.44 -0.08 0.00 0.02 0.00 0.00 55.36 54.74 2qcd s GLN 420 Cb -0.15 0.39 0.17 0.00 1.00 0.00 0.00 33.01 34.43 2qcd s GLN 420 CO 0.04 -0.30 1.82 -0.07 -2.12 0.00 0.00 175.29 174.66 2qcd h LEU 421 N 3.04 1.07-10.02 2.90 3.38 -1.96 -3.21 115.31 110.50 2qcd h LEU 421 Ca -0.32 -0.13 -0.55 0.00 0.09 0.00 0.00 57.88 56.98 2qcd h LEU 421 Cb 1.21 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 2qcd h LEU 421 CO 0.45 0.90 -0.32 -1.61 0.09 0.00 0.00 178.44 177.95 2qcd s GLU 422 N -5.73 3.56 0.54 1.13 0.41 -1.26 -4.72 118.70 112.62 2qcd s GLU 422 Ca -0.13 -0.24 -0.22 0.00 -0.41 0.00 0.00 54.97 53.98 2qcd s GLU 422 Cb 0.16 -2.83 -0.05 0.00 -1.78 0.00 0.00 34.13 29.63 2qcd s GLU 422 CO 0.83 0.41 1.33 0.00 -0.49 0.00 0.00 175.26 177.34 2qcd s ALA 423 N -1.81 2.82 0.00 5.21 0.00 -1.26 -4.81 121.76 121.91 2qcd s ALA 423 Ca 0.40 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.63 2qcd s ALA 423 Cb -0.11 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2qcd s ALA 423 CO 0.28 -1.28 0.00 0.41 0.00 0.00 0.00 175.76 175.17 2qcd n GLY 424 N 0.69 0.08 0.61 0.00 0.00 -1.26 -5.02 105.19 100.29 2qcd n GLY 424 Ca 0.10 -1.03 0.01 0.00 0.00 0.00 0.00 46.02 45.10 2qcd n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qcd n GLY 425 N 0.00 0.50 1.86 -0.02 0.00 -1.26 -0.86 105.19 105.42 2qcd n GLY 425 Ca 0.00 -0.86 -0.15 0.00 0.00 0.00 0.00 46.02 45.02 2qcd n GLY 425 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qcd n ASP 426 N -0.25 2.30 -0.02 1.61 5.68 -0.88 -4.97 116.55 120.01 2qcd n ASP 426 Ca 0.01 -2.04 0.10 0.00 -0.50 0.00 0.00 54.79 52.36 2qcd n ASP 426 Cb 0.09 0.08 0.56 0.00 -1.14 0.00 0.00 41.12 40.71 2qcd n ASP 426 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 2qcd n ASN 427 N -1.53 0.06 -2.67 -1.12 6.94 -1.26 -3.84 115.26 111.84 2qcd n ASN 427 Ca -0.06 -1.41 -0.06 0.00 -0.02 0.00 0.00 54.58 53.03 2qcd n ASN 427 Cb 0.32 -0.00 0.04 0.00 -2.36 0.00 0.00 39.78 37.77 2qcd n ASN 427 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 2qcd n LEU 428 N -0.76 2.18 0.00 -4.53 4.77 -1.26 -5.00 117.00 112.40 2qcd n LEU 428 Ca 0.14 -3.50 0.00 0.00 -0.03 0.00 0.00 56.01 52.63 2qcd n LEU 428 Cb 0.08 0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 2qcd n LEU 428 CO 0.11 1.34 0.00 0.61 -1.33 0.00 0.00 177.39 178.12 2qcd n GLY 429 N -0.51 0.88 3.77 -0.72 0.00 -1.25 -4.94 105.19 102.41 2qcd n GLY 429 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2qcd n GLY 429 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2qcd s GLN 430 N -0.32 4.40 0.00 1.61 2.00 -1.26 -0.13 119.66 125.96 2qcd s GLN 430 Ca 0.00 1.99 0.05 0.00 -2.00 0.00 0.00 55.36 55.40 2qcd s GLN 430 Cb 0.00 -3.03 -0.02 0.00 0.80 0.00 0.00 33.01 30.76 2qcd s GLN 430 CO 0.00 -0.07 -0.17 -0.65 -0.50 0.00 0.00 175.29 173.91 2qcd s GLN 431 N -1.77 1.26 -0.07 1.67 -0.21 -1.17 -2.07 119.66 117.30 2qcd s GLN 431 Ca 0.49 -0.66 0.02 0.00 0.02 0.00 0.00 55.36 55.23 2qcd s GLN 431 Cb -0.35 -1.25 -0.02 0.00 1.00 0.00 0.00 33.01 32.38 2qcd s GLN 431 CO 0.46 0.34 -0.12 0.71 -2.12 0.00 0.00 175.29 174.55 2qcd s TYR 432 N -0.52 2.77 0.20 0.91 2.02 -0.04 -4.52 117.35 118.18 2qcd s TYR 432 Ca 0.06 -0.20 0.06 0.00 -0.37 0.00 0.00 57.07 56.62 2qcd s TYR 432 Cb -0.07 -1.69 -0.05 0.00 -0.40 0.00 0.00 41.96 39.76 2qcd s TYR 432 CO 0.00 0.15 -0.11 -0.80 -1.57 0.00 0.00 175.55 173.22 2qcd s ASN 433 N -0.55 2.32 0.54 2.29 -0.87 -0.33 -4.17 114.94 114.17 2qcd s ASN 433 Ca 0.08 -1.06 -0.12 0.00 -1.57 0.00 0.00 52.86 50.18 2qcd s ASN 433 Cb -0.12 -0.09 -0.06 0.00 -0.02 0.00 0.00 41.25 40.97 2qcd s ASN 433 CO 0.02 -0.27 0.95 -0.94 -2.57 0.00 0.00 177.10 174.29 2qcd s SER 434 N -3.29 6.41 0.26 -1.22 1.04 -1.21 -1.66 113.70 114.03 2qcd s SER 434 Ca 0.22 1.39 -0.02 0.00 0.48 0.00 0.00 55.95 58.02 2qcd s SER 434 Cb 0.01 -2.44 0.45 0.00 0.10 0.00 0.00 66.02 64.15 2qcd s SER 434 CO 0.06 -0.68 1.82 -0.65 0.98 0.00 0.00 173.24 174.77 2qcd h PRO 435 N 0.39 0.84 -0.67 4.02 0.11 -1.91 -1.11 132.00 133.67 2qcd h PRO 435 Ca -0.46 -0.05 -0.06 0.00 0.11 0.00 0.00 66.00 65.54 2qcd h PRO 435 Cb 1.19 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.08 2qcd h PRO 435 CO 0.62 0.56 0.19 0.37 -0.21 0.00 0.00 178.00 179.53 2qcd h GLN 436 N 0.87 1.04 0.09 1.05 4.15 -1.94 0.96 115.11 121.32 2qcd h GLN 436 Ca 0.43 -0.22 -0.00 0.00 0.77 0.00 0.00 58.65 59.63 2qcd h GLN 436 Cb 0.41 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.95 2qcd h GLN 436 CO -0.26 0.90 -0.04 1.49 -1.93 0.00 0.00 178.83 179.00 2qcd h GLU 437 N 1.00 -0.11 -0.00 1.69 4.57 -1.83 0.47 114.58 120.36 2qcd h GLU 437 Ca 0.22 0.01 -0.11 0.00 -1.18 0.00 0.00 59.36 58.29 2qcd h GLU 437 Cb 0.31 0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.93 2qcd h GLU 437 CO -0.00 0.03 -0.45 0.28 -1.18 0.00 0.00 179.01 177.69 2qcd h VAL 438 N -0.23 1.48 0.00 0.32 2.07 -0.99 0.19 116.25 119.09 2qcd h VAL 438 Ca -0.01 -2.02 -0.02 0.00 0.82 0.00 0.00 66.70 65.47 2qcd h VAL 438 Cb 0.19 2.67 -0.00 0.00 -1.52 0.00 0.00 31.29 32.63 2qcd h VAL 438 CO 0.02 0.57 -0.13 0.40 0.02 0.00 0.00 177.57 178.45 2qcd h ILE 439 N -0.28 1.40 0.36 4.57 1.08 -0.95 -1.52 117.51 122.17 2qcd h ILE 439 Ca -0.05 -2.10 -0.02 0.00 -0.39 0.00 0.00 64.86 62.30 2qcd h ILE 439 Cb 1.18 2.69 0.00 0.00 -3.07 0.00 0.00 36.82 37.62 2qcd h ILE 439 CO 0.09 0.47 -0.17 1.23 -0.69 0.00 0.00 178.15 179.08 2qcd h GLY 440 N -1.00 -0.50 1.16 5.37 0.00 -0.99 -2.67 103.07 104.44 2qcd h GLY 440 Ca -0.03 0.19 -0.31 0.00 0.00 0.00 0.00 47.33 47.18 2qcd h GLY 440 CO -0.02 -0.18 -1.59 0.50 0.00 0.00 0.00 176.54 175.25 2qcd h LYS 441 N -1.06 0.20 -0.01 4.80 1.79 -0.68 -3.37 116.57 118.24 2qcd h LYS 441 Ca -0.05 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.08 2qcd h LYS 441 Cb 0.47 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 31.24 2qcd h LYS 441 CO 0.08 1.02 -0.54 0.54 -1.08 0.00 0.00 179.45 179.47 2qcd n ARG 442 N -3.39 0.70 -1.49 3.15 1.74 0.62 -4.99 116.66 113.01 2qcd n ARG 442 Ca -0.18 -0.53 -0.09 0.00 -0.77 0.00 0.00 57.85 56.29 2qcd n ARG 442 Cb 1.04 -1.49 -0.03 0.00 -1.02 0.00 0.00 32.46 30.96 2qcd n ARG 442 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qcd n GLY 443 N 1.43 0.79 3.82 -0.13 0.00 -0.98 -1.19 105.19 108.93 2qcd n GLY 443 Ca 0.08 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.20 2qcd n GLY 443 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2qcd s SER 444 N -2.83 4.25 -0.22 1.61 0.15 -0.61 -4.26 113.70 111.79 2qcd s SER 444 Ca 0.00 1.12 -0.06 0.00 0.70 0.00 0.00 55.95 57.71 2qcd s SER 444 Cb 0.00 -1.78 -0.19 0.00 -1.71 0.00 0.00 66.02 62.34 2qcd s SER 444 CO 0.00 -2.10 -0.04 0.47 1.20 0.00 0.00 173.24 172.77 2qcd n ASP 445 N -3.49 2.01 -4.05 5.45 8.00 -0.37 -4.49 116.55 119.60 2qcd n ASP 445 Ca 0.07 0.10 -0.21 0.00 0.71 0.00 0.00 54.79 55.46 2qcd n ASP 445 Cb 0.58 -0.66 -0.15 0.00 -0.02 0.00 0.00 41.12 40.86 2qcd n ASP 445 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2qcd s ILE 446 N -2.51 0.91 -0.12 0.53 1.01 -0.62 -4.83 121.20 115.58 2qcd s ILE 446 Ca -0.32 -0.47 -0.10 0.00 0.00 0.00 0.00 60.65 59.76 2qcd s ILE 446 Cb 0.09 -0.78 -0.05 0.00 0.01 0.00 0.00 42.46 41.74 2qcd s ILE 446 CO 0.63 0.27 0.21 0.27 0.00 0.00 0.00 174.94 176.32 2qcd s ILE 447 N -0.12 5.37 -0.23 2.92 -4.36 -0.75 -0.73 121.20 123.30 2qcd s ILE 447 Ca 0.02 0.38 -0.07 0.00 -0.26 0.00 0.00 60.65 60.72 2qcd s ILE 447 Cb -0.06 -3.51 -0.03 0.00 1.25 0.00 0.00 42.46 40.11 2qcd s ILE 447 CO -0.00 0.54 0.07 -0.63 0.24 0.00 0.00 174.94 175.16 2qcd s ILE 448 N -0.56 4.41 -0.05 8.37 1.01 0.23 -0.16 121.20 134.44 2qcd s ILE 448 Ca 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.66 2qcd s ILE 448 Cb -0.13 -3.04 0.02 0.00 0.01 0.00 0.00 42.46 39.32 2qcd s ILE 448 CO 0.05 0.37 -0.03 -0.69 0.00 0.00 0.00 174.94 174.64 2qcd s VAL 449 N 1.33 0.46 0.00 2.92 1.01 -0.76 -4.02 120.40 121.33 2qcd s VAL 449 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2qcd s VAL 449 Cb -0.15 -0.53 0.00 0.00 0.00 0.00 0.00 36.38 35.70 2qcd s VAL 449 CO 0.03 0.23 0.00 0.61 0.00 0.00 0.00 175.10 175.97 2qcd n GLY 450 N 4.40 0.15 0.28 4.51 0.00 -1.26 -0.76 105.19 112.51 2qcd n GLY 450 Ca -0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.85 2qcd n GLY 450 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qcd h ARG 451 N 0.00 0.47 -0.91 1.61 3.08 -1.94 0.12 114.38 116.81 2qcd h ARG 451 Ca 0.00 -0.06 0.25 0.00 0.07 0.00 0.00 59.98 60.24 2qcd h ARG 451 Cb 0.00 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 29.92 2qcd h ARG 451 CO 0.00 0.41 0.65 0.78 -1.07 0.00 0.00 179.97 180.74 2qcd h GLY 452 N 0.66 0.21 0.00 0.04 0.00 -1.89 -1.39 103.07 100.69 2qcd h GLY 452 Ca 0.11 -0.04 -0.31 0.00 0.00 0.00 0.00 47.33 47.09 2qcd h GLY 452 CO -0.01 -0.01 -1.93 1.39 0.00 0.00 0.00 176.54 175.98 2qcd n ILE 453 N -4.32 1.52 -0.13 2.60 5.41 -0.52 -4.49 119.36 119.43 2qcd n ILE 453 Ca 0.19 -0.19 -0.02 0.00 1.00 0.00 0.00 62.75 63.73 2qcd n ILE 453 Cb 0.93 -2.03 0.20 0.00 -0.71 0.00 0.00 39.64 38.03 2qcd n ILE 453 CO 0.00 0.00 0.00 0.40 0.00 0.00 0.00 176.55 176.95 2qcd h ILE 454 N -1.00 1.22 0.00 1.39 1.08 -0.66 -1.58 117.51 117.96 2qcd h ILE 454 Ca -0.47 -0.76 0.00 0.00 -0.39 0.00 0.00 64.86 63.24 2qcd h ILE 454 Cb 1.39 0.63 0.00 0.00 -3.07 0.00 0.00 36.82 35.77 2qcd h ILE 454 CO -0.29 0.29 -0.00 -1.20 -0.69 0.00 0.00 178.15 176.26 2qcd n SER 455 N -4.29 0.30 -4.77 1.72 7.64 -0.54 -4.88 113.62 108.81 2qcd n SER 455 Ca 0.04 0.53 -0.34 0.00 1.01 0.00 0.00 58.87 60.11 2qcd n SER 455 Cb 0.21 -0.61 0.03 0.00 -1.01 0.00 0.00 64.21 62.84 2qcd n SER 455 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qcd s ALA 456 N -3.04 2.52 0.14 -0.43 0.00 -0.59 -4.96 121.76 115.41 2qcd s ALA 456 Ca 0.13 0.68 -0.15 0.00 0.00 0.00 0.00 51.96 52.62 2qcd s ALA 456 Cb 0.17 -3.35 0.01 0.00 0.00 0.00 0.00 23.12 19.95 2qcd s ALA 456 CO 0.55 -1.14 1.69 0.00 0.00 0.00 0.00 175.76 176.86 2qcd h ALA 457 N 0.43 0.57 -3.15 0.00 0.00 -1.89 -3.38 119.26 111.84 2qcd h ALA 457 Ca -0.48 -0.15 -0.69 0.00 0.00 0.00 0.00 54.91 53.59 2qcd h ALA 457 Cb 1.26 -0.17 -0.35 0.00 0.00 0.00 0.00 17.79 18.53 2qcd h ALA 457 CO 0.55 0.18 -0.53 0.34 0.00 0.00 0.00 179.25 179.79 2qcd s ASP 458 N -5.91 5.24 0.32 0.00 -1.08 -1.26 -4.96 116.67 109.02 2qcd s ASP 458 Ca -0.13 -2.16 0.12 0.00 -0.52 0.00 0.00 52.55 49.86 2qcd s ASP 458 Cb 0.11 -1.83 0.54 0.00 -1.46 0.00 0.00 42.92 40.28 2qcd s ASP 458 CO 0.76 -0.51 1.71 0.03 0.52 0.00 0.00 175.17 177.68 2qcd h ARG 459 N 7.88 0.00 -0.29 4.34 -0.00 -1.81 -1.10 114.38 123.39 2qcd h ARG 459 Ca -0.11 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 59.28 2qcd h ARG 459 Cb 1.03 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 31.00 2qcd h ARG 459 CO 0.70 0.49 -0.18 -0.07 0.00 0.00 0.00 179.97 180.91 2qcd h LEU 460 N 0.00 0.67 -0.41 3.04 3.38 -1.93 -0.20 115.31 119.86 2qcd h LEU 460 Ca -0.00 -0.43 -0.07 0.00 0.09 0.00 0.00 57.88 57.47 2qcd h LEU 460 Cb 0.89 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2qcd h LEU 460 CO 0.06 0.95 -0.02 -0.08 0.09 0.00 0.00 178.44 179.44 2qcd h GLU 461 N 0.39 0.73 -0.45 1.13 4.81 -1.97 -2.03 114.58 117.19 2qcd h GLU 461 Ca 0.06 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.03 2qcd h GLU 461 Cb 0.71 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.01 2qcd h GLU 461 CO 0.05 0.83 0.20 0.00 -0.73 0.00 0.00 179.01 179.36 2qcd h ALA 462 N 0.88 0.58 -0.61 2.92 0.00 -1.11 -0.23 119.26 121.70 2qcd h ALA 462 Ca 0.11 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2qcd h ALA 462 Cb 0.51 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 2qcd h ALA 462 CO 0.02 0.17 0.37 0.00 0.00 0.00 0.00 179.25 179.82 2qcd h ALA 463 N 1.04 0.79 -0.69 0.00 0.00 -0.99 -1.41 119.26 118.00 2qcd h ALA 463 Ca 0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 2qcd h ALA 463 Cb 0.15 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2qcd h ALA 463 CO -0.02 0.12 0.26 0.93 0.00 0.00 0.00 179.25 180.54 2qcd h GLU 464 N 0.74 1.03 -0.61 0.00 4.39 -0.85 0.11 114.58 119.39 2qcd h GLU 464 Ca 0.24 -0.19 0.03 0.00 0.34 0.00 0.00 59.36 59.78 2qcd h GLU 464 Cb 0.01 -0.16 -0.04 0.00 -0.10 0.00 0.00 28.75 28.46 2qcd h GLU 464 CO -0.10 0.87 0.37 0.52 -1.16 0.00 0.00 179.01 179.51 2qcd h MET 465 N 0.98 0.71 -0.36 2.33 2.86 -0.60 -0.00 114.93 120.84 2qcd h MET 465 Ca 0.23 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.70 2qcd h MET 465 Cb 0.23 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 2qcd h MET 465 CO -0.02 0.47 -0.28 1.88 1.06 0.00 0.00 176.91 180.02 2qcd h TYR 466 N 0.73 0.97 0.03 -0.22 0.05 -0.89 -1.43 116.97 116.20 2qcd h TYR 466 Ca 0.25 -0.27 0.00 0.00 0.05 0.00 0.00 58.73 58.76 2qcd h TYR 466 Cb 0.04 -0.21 -0.01 0.00 1.01 0.00 0.00 36.73 37.56 2qcd h TYR 466 CO -0.06 1.05 -0.05 -0.09 -1.05 0.00 0.00 178.16 177.96 2qcd h ARG 467 N 0.61 -0.10 -0.44 4.88 2.43 -0.68 -0.36 114.38 120.72 2qcd h ARG 467 Ca 0.07 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2qcd h ARG 467 Cb 0.85 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.40 2qcd h ARG 467 CO 0.07 -0.06 -0.01 0.87 -1.51 0.00 0.00 179.97 179.33 2qcd h LYS 468 N -0.10 0.73 -0.07 0.20 1.57 -0.94 0.79 116.57 118.74 2qcd h LYS 468 Ca 0.01 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.59 2qcd h LYS 468 Cb 0.11 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 2qcd h LYS 468 CO -0.03 0.75 0.02 0.00 -0.57 0.00 0.00 179.45 179.62 2qcd h ALA 469 N 1.31 0.09 -0.41 3.86 0.00 -1.06 -1.80 119.26 121.26 2qcd h ALA 469 Ca 0.13 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 2qcd h ALA 469 Cb 0.44 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2qcd h ALA 469 CO 0.02 -0.30 -0.33 0.00 0.00 0.00 0.00 179.25 178.63 2qcd h ALA 470 N 0.83 0.63 -0.18 0.00 0.00 -0.70 -2.19 119.26 117.65 2qcd h ALA 470 Ca 0.02 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 2qcd h ALA 470 Cb 0.21 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2qcd h ALA 470 CO -0.00 0.68 -0.08 2.35 0.00 0.00 0.00 179.25 182.19 2qcd h TRP 471 N 0.77 0.43 -0.72 0.00 2.91 -0.84 -1.58 115.95 116.92 2qcd h TRP 471 Ca 0.08 -0.11 -0.03 0.00 1.13 0.00 0.00 58.89 59.96 2qcd h TRP 471 Cb 0.92 -0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 29.43 2qcd h TRP 471 CO 0.06 0.68 0.33 1.49 -1.03 0.00 0.00 178.44 179.96 2qcd h GLU 472 N 0.07 1.04 -0.69 2.65 4.57 -1.34 -0.10 114.58 120.77 2qcd h GLU 472 Ca 0.04 -0.15 -0.04 0.00 -1.18 0.00 0.00 59.36 58.03 2qcd h GLU 472 Cb 0.56 -0.19 -0.03 0.00 -0.16 0.00 0.00 28.75 28.93 2qcd h GLU 472 CO 0.03 0.81 0.27 0.00 -1.18 0.00 0.00 179.01 178.94 2qcd h ALA 473 N 1.33 1.17 -0.07 2.92 0.00 -1.27 -1.11 119.26 122.22 2qcd h ALA 473 Ca 0.25 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2qcd h ALA 473 Cb 0.13 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2qcd h ALA 473 CO -0.03 0.60 0.01 -0.92 0.00 0.00 0.00 179.25 178.91 2qcd h TYR 474 N 1.00 0.13 -0.98 0.00 3.20 -0.58 -2.73 116.97 117.01 2qcd h TYR 474 Ca 0.23 -0.02 0.13 0.00 3.14 0.00 0.00 58.73 62.21 2qcd h TYR 474 Cb 0.21 -0.04 -0.08 0.00 1.54 0.00 0.00 36.73 38.36 2qcd h TYR 474 CO 0.02 0.36 0.62 -0.07 -1.64 0.00 0.00 178.16 177.45 2qcd h LEU 475 N -0.13 0.88 -0.49 2.82 3.38 -0.75 -1.91 115.31 119.10 2qcd h LEU 475 Ca 0.02 0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 2qcd h LEU 475 Cb 0.30 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2qcd h LEU 475 CO 0.00 0.46 0.04 0.28 0.09 0.00 0.00 178.44 179.31 2qcd h SER 476 N 0.94 0.81 0.66 -0.43 0.02 -1.09 -1.68 113.55 112.78 2qcd h SER 476 Ca 0.49 -0.29 -0.03 0.00 -0.84 0.00 0.00 61.79 61.12 2qcd h SER 476 Cb 0.53 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 2qcd h SER 476 CO -0.26 0.90 -0.16 -0.09 -1.14 0.00 0.00 176.83 176.08 2qcd h ARG 477 N 0.70 0.00 0.00 3.45 2.43 -1.13 -1.52 114.38 118.31 2qcd h ARG 477 Ca 0.14 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 2qcd h ARG 477 Cb 0.46 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2qcd h ARG 477 CO 0.02 0.16 -0.32 1.25 -1.51 0.00 0.00 179.97 179.57 2qcd h LEU 478 N 0.00 0.00 0.00 3.80 5.85 -0.57 -3.46 115.31 120.93 2qcd h LEU 478 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2qcd h LEU 478 Cb 0.53 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.56 2qcd h LEU 478 CO 0.02 0.32 0.00 0.61 -0.34 0.00 0.00 178.44 179.05