#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kfc s LEU 220 N 0.00 4.27 0.85 1.08 1.43 -1.26 -5.05 118.68 120.01 3kfc s LEU 220 Ca 0.00 2.12 -0.12 0.00 -1.03 0.00 0.00 54.13 55.10 3kfc s LEU 220 Cb 0.00 -4.01 0.10 0.00 0.03 0.00 0.00 46.19 42.32 3kfc s LEU 220 CO 0.00 -0.39 1.14 0.42 0.23 0.00 0.00 176.35 177.75 3kfc s THR 221 N -1.49 2.29 0.28 5.49 -4.23 -1.26 -4.87 115.64 111.84 3kfc s THR 221 Ca 0.54 0.09 -0.03 0.00 -1.18 0.00 0.00 61.69 61.11 3kfc s THR 221 Cb -0.25 -2.92 0.26 0.00 1.34 0.00 0.00 72.50 70.93 3kfc s THR 221 CO 0.32 -0.12 1.94 0.00 -0.54 0.00 0.00 174.62 176.22 3kfc h ALA 222 N -1.26 1.38 -0.41 3.99 0.00 -1.99 -1.92 119.26 119.04 3kfc h ALA 222 Ca -0.48 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.31 3kfc h ALA 222 Cb 1.32 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3kfc h ALA 222 CO 0.63 0.56 0.01 0.00 0.00 0.00 0.00 179.25 180.45 3kfc h ALA 223 N 1.44 0.55 -0.10 0.00 0.00 -1.99 -1.67 119.26 117.50 3kfc h ALA 223 Ca 0.35 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3kfc h ALA 223 Cb -0.07 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 3kfc h ALA 223 CO -0.09 0.32 0.03 1.96 0.00 0.00 0.00 179.25 181.47 3kfc h GLN 224 N 0.56 0.15 -0.89 0.00 4.20 -1.91 -1.88 115.11 115.34 3kfc h GLN 224 Ca 0.12 -0.03 0.07 0.00 0.06 0.00 0.00 58.65 58.86 3kfc h GLN 224 Cb 0.46 -0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.15 3kfc h GLN 224 CO 0.02 0.30 0.56 0.93 -0.67 0.00 0.00 178.83 179.97 3kfc h GLU 225 N -0.03 0.98 -0.40 1.46 5.08 -1.33 -0.27 114.58 120.07 3kfc h GLU 225 Ca 0.03 -0.06 0.04 0.00 -1.00 0.00 0.00 59.36 58.37 3kfc h GLU 225 Cb 0.21 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 3kfc h GLU 225 CO -0.00 0.65 0.19 1.25 -1.00 0.00 0.00 179.01 180.09 3kfc h LEU 226 N 1.01 0.26 -0.43 1.33 5.85 -1.19 0.26 115.31 122.40 3kfc h LEU 226 Ca 0.39 0.03 0.02 0.00 0.84 0.00 0.00 57.88 59.16 3kfc h LEU 226 Cb 0.19 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3kfc h LEU 226 CO -0.18 0.19 0.25 -0.03 -0.34 0.00 0.00 178.44 178.33 3kfc h MET 227 N 0.38 0.49 -0.00 1.25 4.05 -0.81 -2.04 114.93 118.25 3kfc h MET 227 Ca 0.18 -0.03 -0.00 0.00 -0.28 0.00 0.00 59.70 59.56 3kfc h MET 227 Cb 0.10 -0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 30.79 3kfc h MET 227 CO -0.14 0.32 -0.00 0.82 0.23 0.00 0.00 176.91 178.14 3kfc h ILE 228 N 0.50 1.42 -0.44 1.77 2.04 -0.76 -2.72 117.51 119.32 3kfc h ILE 228 Ca 0.17 -1.25 0.09 0.00 1.00 0.00 0.00 64.86 64.87 3kfc h ILE 228 Cb 0.02 2.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 3kfc h ILE 228 CO -0.08 0.32 0.30 1.56 0.00 0.00 0.00 178.15 180.25 3kfc h GLN 229 N -0.52 0.22 -0.37 2.37 4.20 -0.98 -0.67 115.11 119.37 3kfc h GLN 229 Ca 0.00 -0.01 -0.09 0.00 0.06 0.00 0.00 58.65 58.61 3kfc h GLN 229 Cb 0.53 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 3kfc h GLN 229 CO 0.00 0.14 -0.10 0.37 -0.67 0.00 0.00 178.83 178.57 3kfc h GLN 230 N 0.22 0.72 -0.01 1.46 5.75 -1.28 -0.21 115.11 121.77 3kfc h GLN 230 Ca 0.20 -0.28 -0.00 0.00 -0.15 0.00 0.00 58.65 58.42 3kfc h GLN 230 Cb 0.52 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.03 3kfc h GLN 230 CO -0.04 0.88 -0.01 -0.07 -2.65 0.00 0.00 178.83 176.94 3kfc h LEU 231 N 0.52 0.02 -0.22 -2.39 3.38 -1.00 -1.16 115.31 114.45 3kfc h LEU 231 Ca 0.09 -0.49 0.05 0.00 0.09 0.00 0.00 57.88 57.62 3kfc h LEU 231 Cb 0.62 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 3kfc h LEU 231 CO 0.04 0.50 -0.07 0.58 0.09 0.00 0.00 178.44 179.58 3kfc h VAL 232 N -0.47 0.74 -0.52 1.22 2.07 -1.21 -0.43 116.25 117.65 3kfc h VAL 232 Ca 0.00 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.42 3kfc h VAL 232 Cb 0.50 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3kfc h VAL 232 CO 0.00 0.00 -0.09 0.00 0.02 0.00 0.00 177.57 177.50 3kfc h ALA 233 N 1.19 0.86 -0.21 1.67 0.00 -1.07 -2.32 119.26 119.38 3kfc h ALA 233 Ca 0.11 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 3kfc h ALA 233 Cb 0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3kfc h ALA 233 CO -0.25 0.65 -0.36 0.00 0.00 0.00 0.00 179.25 179.30 3kfc h ALA 234 N 1.03 1.00 -0.06 0.00 0.00 -1.07 -2.12 119.26 118.04 3kfc h ALA 234 Ca 0.14 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3kfc h ALA 234 Cb 0.63 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3kfc h ALA 234 CO 0.04 0.60 0.04 0.37 0.00 0.00 0.00 179.25 180.31 3kfc h GLN 235 N 0.38 0.08 -0.43 0.00 4.15 -0.85 -2.23 115.11 116.21 3kfc h GLN 235 Ca 0.04 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.40 3kfc h GLN 235 Cb 0.81 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 3kfc h GLN 235 CO 0.07 0.06 0.06 1.25 -1.93 0.00 0.00 178.83 178.34 3kfc h LEU 236 N 0.07 0.63 -0.51 -2.39 5.85 -1.25 -2.30 115.31 115.41 3kfc h LEU 236 Ca 0.02 -0.12 -0.16 0.00 0.84 0.00 0.00 57.88 58.46 3kfc h LEU 236 Cb 0.00 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 3kfc h LEU 236 CO -0.00 0.66 -0.59 1.56 -0.34 0.00 0.00 178.44 179.72 3kfc h GLN 237 N 0.64 0.49 0.00 1.25 1.08 -1.27 -2.65 115.11 114.65 3kfc h GLN 237 Ca 0.14 -0.33 -0.04 0.00 -1.45 0.00 0.00 58.65 56.97 3kfc h GLN 237 Cb 0.32 0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.79 3kfc h GLN 237 CO 0.01 0.94 -0.19 0.00 -0.95 0.00 0.00 178.83 178.64 3kfc h ASN 239 N 0.00 0.88 0.41 0.00 -1.24 -1.08 -3.04 115.58 111.50 3kfc h ASN 239 Ca -0.00 -0.47 0.00 0.00 0.71 0.00 0.00 56.30 56.53 3kfc h ASN 239 Cb 0.47 -0.25 0.00 0.00 0.73 0.00 0.00 38.32 39.26 3kfc h ASN 239 CO 0.03 1.25 0.00 0.11 -1.29 0.00 0.00 177.43 177.53 3kfc h LYS 240 N 0.61 0.00 -0.90 6.67 1.57 -1.15 -0.88 116.57 122.49 3kfc h LYS 240 Ca 0.01 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.66 3kfc h LYS 240 Cb 1.14 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.37 3kfc h LYS 240 CO 0.12 0.00 0.17 0.54 -0.57 0.00 0.00 179.45 179.71 3kfc n ARG 241 N -2.85 2.23 -0.11 3.15 1.74 -1.15 -3.28 116.66 116.39 3kfc n ARG 241 Ca -0.01 -1.50 -0.14 0.00 -0.77 0.00 0.00 57.85 55.42 3kfc n ARG 241 Cb 0.16 -1.72 -0.13 0.00 -1.02 0.00 0.00 32.46 29.75 3kfc n ARG 241 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 3kfc n SER 242 N -0.01 1.32 0.08 0.55 7.64 -0.33 -4.43 113.62 118.43 3kfc n SER 242 Ca 0.22 -0.08 0.02 0.00 1.01 0.00 0.00 58.87 60.04 3kfc n SER 242 Cb 0.90 0.13 0.39 0.00 -1.01 0.00 0.00 64.21 64.63 3kfc n SER 242 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 3kfc h PHE 243 N 0.00 0.34 -0.42 1.43 3.57 -1.71 -2.16 116.94 117.99 3kfc h PHE 243 Ca -0.55 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 60.85 3kfc h PHE 243 Cb 2.00 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 40.62 3kfc h PHE 243 CO 0.02 0.37 -0.05 1.03 -2.23 0.00 0.00 178.31 177.44 3kfc h SER 244 N 0.32 0.69 0.43 0.41 0.87 -1.78 -3.33 113.55 111.16 3kfc h SER 244 Ca 0.07 -0.18 -0.30 0.00 -1.23 0.00 0.00 61.79 60.16 3kfc h SER 244 Cb 0.26 -0.18 -0.05 0.00 -0.44 0.00 0.00 62.40 61.99 3kfc h SER 244 CO 0.01 0.79 -1.78 0.47 -0.53 0.00 0.00 176.83 175.79 3kfc n ASP 245 N -4.20 0.80 -0.26 6.23 8.00 -1.05 -4.53 116.55 121.55 3kfc n ASP 245 Ca 0.02 0.37 0.06 0.00 0.71 0.00 0.00 54.79 55.95 3kfc n ASP 245 Cb 0.32 0.04 0.19 0.00 -0.02 0.00 0.00 41.12 41.64 3kfc n ASP 245 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 3kfc h GLN 246 N 0.00 0.20 0.00 -1.24 4.15 -1.50 -0.06 115.11 116.66 3kfc h GLN 246 Ca -0.31 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.09 3kfc h GLN 246 Cb 2.04 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.68 3kfc h GLN 246 CO 0.07 0.13 0.00 -1.35 -1.93 0.00 0.00 178.83 175.76 3kfc h PRO 247 N 0.21 0.00 -3.08 -2.39 0.11 -1.79 -3.29 132.00 121.77 3kfc h PRO 247 Ca 0.43 0.00 -0.70 0.00 0.11 0.00 0.00 66.00 65.84 3kfc h PRO 247 Cb 0.77 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 31.52 3kfc h PRO 247 CO -0.57 0.00 -0.08 1.63 -0.21 0.00 0.00 178.00 178.76 3kfc n LYS 248 N -2.63 2.81 -3.79 1.05 5.02 -0.03 -5.01 118.16 115.58 3kfc n LYS 248 Ca 0.00 -4.52 -0.13 0.00 -2.02 0.00 0.00 58.31 51.65 3kfc n LYS 248 Cb 0.20 -2.39 -0.11 0.00 -0.02 0.00 0.00 35.03 32.71 3kfc n LYS 248 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3kfc s VAL 249 N -1.74 0.01 -0.20 -0.18 1.01 -1.24 -4.95 120.40 113.11 3kfc s VAL 249 Ca 0.30 -0.08 -0.40 0.00 0.00 0.00 0.00 61.98 61.80 3kfc s VAL 249 Cb -0.02 -0.38 -0.17 0.00 0.00 0.00 0.00 36.38 35.82 3kfc s VAL 249 CO -0.08 -0.04 1.59 0.41 0.00 0.00 0.00 175.10 176.97 3kfc n THR 250 N 2.74 0.18 -1.64 3.92 -1.04 -1.26 -4.90 114.28 112.27 3kfc n THR 250 Ca -0.14 -0.03 -0.42 0.00 -2.04 0.00 0.00 64.05 61.42 3kfc n THR 250 Cb 0.58 -0.96 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 3kfc n THR 250 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 3kfc n PRO 251 N 4.29 1.59 -2.86 -2.82 -0.02 -1.26 -4.72 135.00 129.20 3kfc n PRO 251 Ca 0.25 0.57 -0.42 0.00 -2.02 0.00 0.00 63.50 61.87 3kfc n PRO 251 Cb 0.12 -2.11 -0.04 0.00 -0.02 0.00 0.00 33.50 31.44 3kfc n PRO 251 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 3kfc s TRP 252 N -1.19 3.27 0.00 6.00 -0.11 -1.26 -4.82 118.94 120.83 3kfc s TRP 252 Ca 0.60 1.08 0.00 0.00 1.22 0.00 0.00 56.10 59.00 3kfc s TRP 252 Cb -0.58 -3.17 0.00 0.00 -1.50 0.00 0.00 33.47 28.22 3kfc s TRP 252 CO 0.59 -0.49 0.00 -0.35 -4.62 0.00 0.00 176.95 172.08 3kfc n PRO 253 N 6.17 0.00 0.00 5.86 -0.04 -1.26 -5.12 135.00 140.61 3kfc n PRO 253 Ca 0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 3kfc n PRO 253 Cb 0.47 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.93 3kfc n PRO 253 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3kfc n ASP 262 N 0.00 0.00 0.19 3.54 -0.08 -1.26 -5.09 116.55 113.85 3kfc n ASP 262 Ca 0.00 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.32 3kfc n ASP 262 Cb 0.00 0.00 0.38 0.00 2.34 0.00 0.00 41.12 43.84 3kfc n ASP 262 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3kfc h ALA 263 N 0.00 1.26 -0.41 -1.67 0.00 -2.02 -2.83 119.26 113.59 3kfc h ALA 263 Ca 0.00 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.51 3kfc h ALA 263 Cb 0.00 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3kfc h ALA 263 CO 0.00 0.46 -0.02 -0.09 0.00 0.00 0.00 179.25 179.59 3kfc h ARG 264 N 0.00 0.74 -0.27 0.00 2.43 -1.99 -1.81 114.38 113.48 3kfc h ARG 264 Ca -0.00 -0.25 -0.07 0.00 -0.81 0.00 0.00 59.98 58.85 3kfc h ARG 264 Cb 0.70 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.18 3kfc h ARG 264 CO 0.05 0.83 -0.12 1.96 -1.51 0.00 0.00 179.97 181.18 3kfc h GLN 265 N 0.57 0.45 -0.07 0.20 1.08 -1.92 -2.43 115.11 112.99 3kfc h GLN 265 Ca 0.11 -0.12 -0.07 0.00 -1.45 0.00 0.00 58.65 57.12 3kfc h GLN 265 Cb 0.51 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 3kfc h GLN 265 CO 0.03 0.57 -0.29 1.96 -0.95 0.00 0.00 178.83 180.14 3kfc h GLN 266 N 0.42 0.12 -0.03 1.46 4.20 -1.24 -0.61 115.11 119.43 3kfc h GLN 266 Ca 0.08 -0.04 -0.26 0.00 0.06 0.00 0.00 58.65 58.49 3kfc h GLN 266 Cb 0.47 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 28.26 3kfc h GLN 266 CO 0.03 0.41 -0.99 0.00 -0.67 0.00 0.00 178.83 177.60 3kfc h ARG 267 N 0.11 0.72 -0.07 1.46 3.08 -1.12 -1.15 114.38 117.42 3kfc h ARG 267 Ca 0.02 -0.74 0.01 0.00 0.07 0.00 0.00 59.98 59.34 3kfc h ARG 267 Cb 0.58 0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 3kfc h ARG 267 CO 0.04 1.31 0.02 0.35 -1.07 0.00 0.00 179.97 180.62 3kfc h PHE 268 N 0.43 0.03 -0.06 3.04 3.57 -1.34 -1.65 116.94 120.94 3kfc h PHE 268 Ca -0.11 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.42 3kfc h PHE 268 Cb 1.64 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.35 3kfc h PHE 268 CO 0.10 0.01 -0.12 0.00 -2.23 0.00 0.00 178.31 176.08 3kfc h ALA 269 N 1.05 -0.08 -0.75 2.41 0.00 -1.10 0.83 119.26 121.62 3kfc h ALA 269 Ca 0.03 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.09 3kfc h ALA 269 Cb 0.02 0.22 -0.13 0.00 0.00 0.00 0.00 17.79 17.90 3kfc h ALA 269 CO -0.04 -0.59 -0.37 1.25 0.00 0.00 0.00 179.25 179.50 3kfc h HIS 270 N -0.17 -1.05 -0.55 0.00 -0.00 -1.12 -0.03 115.15 112.24 3kfc h HIS 270 Ca 0.06 0.09 -0.08 0.00 -0.00 0.00 0.00 60.37 60.44 3kfc h HIS 270 Cb 0.25 0.57 -0.02 0.00 -0.00 0.00 0.00 27.41 28.21 3kfc h HIS 270 CO -0.21 -0.39 0.03 0.74 -0.00 0.00 0.00 177.93 178.10 3kfc h PHE 271 N -0.10 0.97 -0.05 5.26 -1.00 -0.50 -2.29 116.94 119.22 3kfc h PHE 271 Ca 0.27 -0.14 -0.09 0.00 2.81 0.00 0.00 57.97 60.82 3kfc h PHE 271 Cb 0.57 -0.26 -0.01 0.00 3.61 0.00 0.00 35.95 39.85 3kfc h PHE 271 CO -0.74 0.87 -0.37 1.79 -1.61 0.00 0.00 178.31 178.24 3kfc h THR 272 N 0.85 1.28 -0.30 -1.55 1.35 0.01 -1.84 112.91 112.71 3kfc h THR 272 Ca 0.16 -1.35 -0.17 0.00 -0.55 0.00 0.00 66.41 64.50 3kfc h THR 272 Cb 0.46 1.66 -0.00 0.00 -1.73 0.00 0.00 68.15 68.54 3kfc h THR 272 CO 0.02 0.40 -0.48 -0.33 -0.25 0.00 0.00 175.52 174.87 3kfc h GLU 273 N 0.09 0.80 -0.08 4.72 5.08 -0.78 -0.71 114.58 123.70 3kfc h GLU 273 Ca 0.01 -0.47 0.01 0.00 -1.00 0.00 0.00 59.36 57.92 3kfc h GLU 273 Cb 0.70 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3kfc h GLU 273 CO 0.05 1.10 -0.01 -0.07 -1.00 0.00 0.00 179.01 179.08 3kfc h LEU 274 N 0.63 -0.04 -0.55 1.33 3.38 -1.21 0.14 115.31 118.98 3kfc h LEU 274 Ca 0.03 0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.11 3kfc h LEU 274 Cb 1.06 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.77 3kfc h LEU 274 CO 0.11 -0.01 0.14 0.00 0.09 0.00 0.00 178.44 178.77 3kfc h ALA 275 N 1.07 0.65 -0.66 1.53 0.00 -1.20 -0.36 119.26 120.29 3kfc h ALA 275 Ca 0.04 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 3kfc h ALA 275 Cb 0.05 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3kfc h ALA 275 CO -0.07 -0.27 0.13 0.82 0.00 0.00 0.00 179.25 179.86 3kfc h ILE 276 N 0.29 1.26 -0.57 0.00 2.04 -0.77 0.15 117.51 119.91 3kfc h ILE 276 Ca 0.28 -1.00 0.07 0.00 1.00 0.00 0.00 64.86 65.21 3kfc h ILE 276 Cb 0.37 0.64 -0.06 0.00 -0.74 0.00 0.00 36.82 37.03 3kfc h ILE 276 CO -0.33 0.37 0.26 0.40 0.00 0.00 0.00 178.15 178.85 3kfc h ILE 277 N 0.99 0.88 -0.45 -0.67 2.04 -0.52 -1.61 117.51 118.17 3kfc h ILE 277 Ca 0.20 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.89 3kfc h ILE 277 Cb 0.41 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.82 3kfc h ILE 277 CO 0.01 0.09 0.25 -1.28 0.00 0.00 0.00 178.15 177.22 3kfc h SER 278 N 0.48 0.57 -0.36 1.72 0.87 -0.02 -1.76 113.55 115.05 3kfc h SER 278 Ca 0.27 -0.09 0.08 0.00 -1.23 0.00 0.00 61.79 60.82 3kfc h SER 278 Cb 0.25 -0.14 -0.08 0.00 -0.44 0.00 0.00 62.40 61.99 3kfc h SER 278 CO -0.22 0.49 -0.15 0.58 -0.53 0.00 0.00 176.83 177.00 3kfc h VAL 279 N 0.59 0.52 -0.48 2.23 2.07 -0.52 -0.18 116.25 120.48 3kfc h VAL 279 Ca 0.16 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.72 3kfc h VAL 279 Cb 0.05 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 3kfc h VAL 279 CO -0.03 0.00 0.24 -0.61 0.02 0.00 0.00 177.57 177.20 3kfc h GLN 280 N -0.08 0.47 -0.40 1.57 4.15 -1.02 -0.49 115.11 119.31 3kfc h GLN 280 Ca 0.18 -0.03 0.06 0.00 0.77 0.00 0.00 58.65 59.63 3kfc h GLN 280 Cb 0.36 -0.11 -0.05 0.00 0.21 0.00 0.00 27.48 27.89 3kfc h GLN 280 CO -0.42 0.31 0.11 0.93 -1.93 0.00 0.00 178.83 177.83 3kfc h GLU 281 N 0.48 0.24 0.08 1.69 5.08 -0.87 -1.41 114.58 119.88 3kfc h GLU 281 Ca 0.21 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 3kfc h GLU 281 Cb 0.11 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.31 3kfc h GLU 281 CO -0.15 0.16 -0.04 0.82 -1.00 0.00 0.00 179.01 178.81 3kfc h ILE 282 N 0.25 0.99 -0.21 3.13 2.04 -0.45 0.55 117.51 123.81 3kfc h ILE 282 Ca 0.19 -0.26 0.06 0.00 1.00 0.00 0.00 64.86 65.85 3kfc h ILE 282 Cb 0.20 1.16 -0.06 0.00 -0.74 0.00 0.00 36.82 37.38 3kfc h ILE 282 CO -0.22 0.06 -0.18 0.58 0.00 0.00 0.00 178.15 178.39 3kfc h VAL 283 N -0.23 0.51 -0.24 1.67 2.07 -1.07 0.46 116.25 119.43 3kfc h VAL 283 Ca -0.01 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.45 3kfc h VAL 283 Cb 0.19 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 3kfc h VAL 283 CO 0.02 0.00 -0.12 0.44 0.02 0.00 0.00 177.57 177.92 3kfc h ASP 284 N -0.19 0.37 0.10 0.57 3.45 -1.11 -2.51 116.42 117.10 3kfc h ASP 284 Ca 0.13 -0.09 -0.00 0.00 0.43 0.00 0.00 57.03 57.49 3kfc h ASP 284 Cb 0.38 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.05 3kfc h ASP 284 CO -0.33 0.53 -0.05 0.15 -1.57 0.00 0.00 179.24 177.98 3kfc h PHE 285 N 0.37 -0.12 -0.72 4.55 3.57 -0.35 -3.26 116.94 120.98 3kfc h PHE 285 Ca 0.07 -0.00 0.15 0.00 3.53 0.00 0.00 57.97 61.71 3kfc h PHE 285 Cb 0.44 0.04 -0.10 0.00 2.79 0.00 0.00 35.95 39.12 3kfc h PHE 285 CO 0.01 0.15 0.21 0.00 -2.23 0.00 0.00 178.31 176.45 3kfc h ALA 286 N 0.49 0.95 -0.28 2.41 0.00 -0.67 0.12 119.26 122.29 3kfc h ALA 286 Ca -0.01 0.14 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3kfc h ALA 286 Cb 0.32 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3kfc h ALA 286 CO 0.02 -0.29 0.31 0.87 0.00 0.00 0.00 179.25 180.16 3kfc h LYS 287 N 0.33 0.00 0.00 0.00 1.57 -1.50 -2.01 116.57 114.96 3kfc h LYS 287 Ca 0.40 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 59.13 3kfc h LYS 287 Cb 0.64 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 3kfc h LYS 287 CO -0.45 0.00 -1.15 1.04 -0.57 0.00 0.00 179.45 178.32 3kfc n GLN 288 N -3.76 0.61 -2.03 3.15 1.13 0.39 -4.81 117.38 112.06 3kfc n GLN 288 Ca 0.04 0.14 -0.43 0.00 -1.94 0.00 0.00 57.00 54.82 3kfc n GLN 288 Cb 0.45 -1.81 -0.03 0.00 0.11 0.00 0.00 30.24 28.96 3kfc n GLN 288 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3kfc s VAL 289 N -3.25 3.60 0.16 5.09 1.01 -0.76 -4.92 120.40 121.33 3kfc s VAL 289 Ca -0.01 0.69 -0.33 0.00 0.00 0.00 0.00 61.98 62.33 3kfc s VAL 289 Cb 0.09 -3.56 -0.12 0.00 0.00 0.00 0.00 36.38 32.79 3kfc s VAL 289 CO 0.80 -0.18 1.71 -2.65 0.00 0.00 0.00 175.10 174.78 3kfc n PRO 290 N 7.53 2.55 0.00 2.72 -0.02 -1.26 -2.28 135.00 144.24 3kfc n PRO 290 Ca 0.19 0.92 0.00 0.00 -2.02 0.00 0.00 63.50 62.59 3kfc n PRO 290 Cb 0.44 -2.76 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 3kfc n PRO 290 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kfc n GLY 291 N 3.88 1.65 0.33 -1.23 0.00 -1.26 -4.97 105.19 103.58 3kfc n GLY 291 Ca 0.17 -0.24 -0.03 0.00 0.00 0.00 0.00 46.02 45.92 3kfc n GLY 291 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3kfc h PHE 292 N 0.00 1.05 -0.01 1.61 3.57 -1.72 -2.34 116.94 119.10 3kfc h PHE 292 Ca 0.00 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.44 3kfc h PHE 292 Cb 0.00 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 38.42 3kfc h PHE 292 CO 0.00 0.78 -0.12 1.28 -2.23 0.00 0.00 178.31 178.03 3kfc n LEU 293 N -4.31 1.03 0.20 0.59 4.77 -1.26 -3.06 117.00 114.96 3kfc n LEU 293 Ca 0.07 -0.28 0.09 0.00 -0.03 0.00 0.00 56.01 55.85 3kfc n LEU 293 Cb 0.16 -0.08 0.27 0.00 -2.33 0.00 0.00 43.42 41.44 3kfc n LEU 293 CO 0.39 0.18 0.72 1.56 -1.33 0.00 0.00 177.39 178.91 3kfc h GLN 294 N 1.44 0.00 -7.16 3.23 4.20 -1.81 -3.45 115.11 111.56 3kfc h GLN 294 Ca 0.00 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 58.25 3kfc h GLN 294 Cb 0.44 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.23 3kfc h GLN 294 CO 0.00 0.24 0.37 -0.51 -0.67 0.00 0.00 178.83 178.26 3kfc s LEU 295 N -6.48 3.70 0.87 1.46 1.43 -1.17 -5.06 118.68 113.42 3kfc s LEU 295 Ca 0.03 1.61 -0.11 0.00 -1.03 0.00 0.00 54.13 54.63 3kfc s LEU 295 Cb 0.08 -4.52 0.12 0.00 0.03 0.00 0.00 46.19 41.90 3kfc s LEU 295 CO 0.67 -0.55 1.17 -0.83 0.23 0.00 0.00 176.35 177.04 3kfc s GLY 296 N -2.84 1.87 0.24 -3.19 0.00 -1.26 -4.79 107.32 97.35 3kfc s GLY 296 Ca 0.60 0.68 -0.06 0.00 0.00 0.00 0.00 44.72 45.94 3kfc s GLY 296 CO 0.27 1.10 1.85 -0.09 0.00 0.00 0.00 173.10 176.22 3kfc h ARG 297 N -1.47 0.92 -0.61 2.90 2.43 -1.96 -1.21 114.38 115.38 3kfc h ARG 297 Ca -0.44 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 58.63 3kfc h ARG 297 Cb 1.28 -0.21 -0.03 0.00 -0.42 0.00 0.00 29.97 30.59 3kfc h ARG 297 CO 0.44 0.61 0.22 0.93 -1.51 0.00 0.00 179.97 180.65 3kfc h GLU 298 N 0.95 0.94 -0.10 0.20 5.08 -1.99 -0.99 114.58 118.68 3kfc h GLU 298 Ca 0.37 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.45 3kfc h GLU 298 Cb 0.16 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3kfc h GLU 298 CO -0.17 0.82 -0.33 -0.44 -1.00 0.00 0.00 179.01 177.89 3kfc h ASP 299 N 0.87 0.19 -0.59 1.42 5.19 -1.80 0.13 116.42 121.83 3kfc h ASP 299 Ca 0.20 -0.07 -0.05 0.00 -0.62 0.00 0.00 57.03 56.50 3kfc h ASP 299 Cb 0.25 -0.05 -0.02 0.00 0.18 0.00 0.00 39.33 39.69 3kfc h ASP 299 CO -0.01 0.51 0.18 1.56 -3.12 0.00 0.00 179.24 178.36 3kfc h GLN 300 N 0.17 0.92 -0.27 3.56 4.20 -0.60 -1.79 115.11 121.29 3kfc h GLN 300 Ca 0.02 -0.20 -0.14 0.00 0.06 0.00 0.00 58.65 58.39 3kfc h GLN 300 Cb 0.66 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.31 3kfc h GLN 300 CO 0.05 0.83 -0.36 0.82 -0.67 0.00 0.00 178.83 179.49 3kfc h ILE 301 N 0.84 1.30 -0.48 2.54 2.04 -0.86 -2.41 117.51 120.48 3kfc h ILE 301 Ca 0.19 -1.55 -0.06 0.00 1.00 0.00 0.00 64.86 64.44 3kfc h ILE 301 Cb 0.30 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 3kfc h ILE 301 CO -0.00 0.50 0.06 0.00 0.00 0.00 0.00 178.15 178.71 3kfc h ALA 302 N 0.68 0.63 -0.41 1.87 0.00 -0.70 -1.30 119.26 120.02 3kfc h ALA 302 Ca 0.03 -0.24 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 3kfc h ALA 302 Cb 0.95 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3kfc h ALA 302 CO 0.09 0.38 -0.21 -0.07 0.00 0.00 0.00 179.25 179.44 3kfc h LEU 303 N 0.67 0.83 -0.42 0.00 3.38 -1.38 -2.99 115.31 115.40 3kfc h LEU 303 Ca 0.14 -0.29 -0.18 0.00 0.09 0.00 0.00 57.88 57.64 3kfc h LEU 303 Cb 0.41 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 3kfc h LEU 303 CO 0.01 1.01 -0.78 -0.07 0.09 0.00 0.00 178.44 178.71 3kfc h LEU 304 N 0.72 0.24 -0.41 1.67 3.38 -1.29 -2.00 115.31 117.62 3kfc h LEU 304 Ca 0.10 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 3kfc h LEU 304 Cb 0.73 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 3kfc h LEU 304 CO 0.06 0.92 0.13 0.50 0.09 0.00 0.00 178.44 180.14 3kfc h LYS 305 N 0.12 0.64 -0.06 1.13 3.64 -1.22 -0.85 116.57 119.97 3kfc h LYS 305 Ca -0.03 -0.13 -0.14 0.00 -1.27 0.00 0.00 60.65 59.08 3kfc h LYS 305 Cb 1.36 -0.09 0.01 0.00 -0.41 0.00 0.00 32.23 33.09 3kfc h LYS 305 CO 0.12 0.63 -0.50 0.00 -2.27 0.00 0.00 179.45 177.42 3kfc h ALA 306 N 0.98 0.14 0.00 5.00 0.00 -1.56 -3.34 119.26 120.48 3kfc h ALA 306 Ca 0.13 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.53 3kfc h ALA 306 Cb 0.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3kfc h ALA 306 CO -0.01 0.33 -0.18 -1.13 0.00 0.00 0.00 179.25 178.27 3kfc n SER 307 N -4.26 0.40 -0.01 0.00 3.41 -0.75 -4.06 113.62 108.35 3kfc n SER 307 Ca -0.09 0.33 -0.09 0.00 -0.26 0.00 0.00 58.87 58.76 3kfc n SER 307 Cb 0.61 -0.35 -0.03 0.00 -0.26 0.00 0.00 64.21 64.18 3kfc n SER 307 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3kfc h THR 308 N 0.00 0.67 -0.70 6.66 2.02 -1.28 -0.60 112.91 119.69 3kfc h THR 308 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 3kfc h THR 308 Cb 0.60 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.65 3kfc h THR 308 CO 0.00 0.00 0.17 -0.29 0.37 0.00 0.00 175.52 175.77 3kfc h ILE 309 N -0.14 1.26 -0.60 3.11 6.09 -1.82 -1.14 117.51 124.28 3kfc h ILE 309 Ca 0.09 -0.95 -0.03 0.00 -1.37 0.00 0.00 64.86 62.60 3kfc h ILE 309 Cb 0.26 0.54 -0.03 0.00 0.47 0.00 0.00 36.82 38.06 3kfc h ILE 309 CO -0.21 0.37 0.27 -0.33 -3.07 0.00 0.00 178.15 175.18 3kfc h GLU 310 N 1.05 0.87 -0.36 2.19 5.08 -1.65 -1.41 114.58 120.35 3kfc h GLU 310 Ca 0.22 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 3kfc h GLU 310 Cb 0.36 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 3kfc h GLU 310 CO 0.00 0.72 -0.07 0.82 -1.00 0.00 0.00 179.01 179.48 3kfc h ILE 311 N 0.82 1.27 -0.64 3.13 2.04 -1.00 -2.22 117.51 120.92 3kfc h ILE 311 Ca 0.20 -1.12 0.12 0.00 1.00 0.00 0.00 64.86 65.06 3kfc h ILE 311 Cb 0.14 1.28 -0.09 0.00 -0.74 0.00 0.00 36.82 37.41 3kfc h ILE 311 CO -0.02 0.37 0.18 0.24 0.00 0.00 0.00 178.15 178.92 3kfc h MET 312 N 0.47 0.31 -0.20 2.37 2.86 -0.96 0.10 114.93 119.89 3kfc h MET 312 Ca 0.09 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.59 3kfc h MET 312 Cb 0.57 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.15 3kfc h MET 312 CO 0.03 0.20 -0.40 -0.07 1.06 0.00 0.00 176.91 177.73 3kfc h LEU 313 N 0.32 0.49 -0.56 1.22 3.38 -1.19 0.21 115.31 119.18 3kfc h LEU 313 Ca 0.34 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 58.03 3kfc h LEU 313 Cb 0.50 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 3kfc h LEU 313 CO -0.40 0.84 0.10 0.25 0.09 0.00 0.00 178.44 179.32 3kfc h LEU 314 N 0.38 0.89 -0.41 1.67 5.85 -0.74 -0.99 115.31 121.95 3kfc h LEU 314 Ca 0.03 -0.26 -0.18 0.00 0.84 0.00 0.00 57.88 58.32 3kfc h LEU 314 Cb 0.87 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 3kfc h LEU 314 CO 0.07 0.92 -0.74 -0.33 -0.34 0.00 0.00 178.44 178.02 3kfc h GLU 315 N 0.82 0.37 -0.61 1.25 4.39 -0.53 -2.70 114.58 117.57 3kfc h GLU 315 Ca 0.17 -0.31 0.02 0.00 0.34 0.00 0.00 59.36 59.58 3kfc h GLU 315 Cb 0.40 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 29.08 3kfc h GLU 315 CO 0.01 0.95 0.39 1.15 -1.16 0.00 0.00 179.01 180.35 3kfc h THR 316 N 0.25 1.11 -0.34 1.13 2.02 -0.46 -2.82 112.91 113.80 3kfc h THR 316 Ca -0.03 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.86 3kfc h THR 316 Cb 1.31 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3kfc h THR 316 CO 0.12 0.14 0.12 0.00 0.37 0.00 0.00 175.52 176.28 3kfc h ALA 317 N 1.25 1.59 0.00 6.16 0.00 -1.01 -2.38 119.26 124.86 3kfc h ALA 317 Ca 0.24 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3kfc h ALA 317 Cb -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3kfc h ALA 317 CO -0.08 0.32 0.00 -0.09 0.00 0.00 0.00 179.25 179.40 3kfc h ARG 318 N 0.47 0.00 -0.48 0.00 2.43 -1.24 -3.08 114.38 112.48 3kfc h ARG 318 Ca 0.12 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3kfc h ARG 318 Cb 0.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.67 3kfc h ARG 318 CO -0.01 0.00 0.00 0.54 -1.51 0.00 0.00 179.97 178.99 3kfc n ARG 319 N -3.01 2.52 -3.03 0.20 1.74 -0.90 -4.97 116.66 109.20 3kfc n ARG 319 Ca 0.02 -2.33 -0.40 0.00 -0.77 0.00 0.00 57.85 54.37 3kfc n ARG 319 Cb 0.38 -1.49 -0.05 0.00 -1.02 0.00 0.00 32.46 30.28 3kfc n ARG 319 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3kfc s TYR 320 N -1.24 3.75 -0.29 -1.55 5.04 -1.17 -1.25 117.35 120.64 3kfc s TYR 320 Ca 0.39 1.44 -0.08 0.00 -2.44 0.00 0.00 57.07 56.38 3kfc s TYR 320 Cb 0.22 -2.77 -0.00 0.00 0.35 0.00 0.00 41.96 39.76 3kfc s TYR 320 CO 0.29 0.32 0.10 1.21 -1.34 0.00 0.00 175.55 176.14 3kfc s ASN 321 N -0.22 5.26 0.43 4.32 3.84 0.56 -4.99 114.94 124.14 3kfc s ASN 321 Ca 0.37 -0.56 0.13 0.00 0.21 0.00 0.00 52.86 53.00 3kfc s ASN 321 Cb -0.20 -1.93 0.94 0.00 -0.55 0.00 0.00 41.25 39.51 3kfc s ASN 321 CO 0.22 -0.17 1.98 -0.74 -2.79 0.00 0.00 177.10 175.60 3kfc h HIS 322 N 8.28 0.10 0.19 0.43 -0.00 -1.96 0.88 115.15 123.06 3kfc h HIS 322 Ca -0.33 -0.01 -0.33 0.00 -0.00 0.00 0.00 60.37 59.70 3kfc h HIS 322 Cb 1.14 -0.03 0.01 0.00 -0.00 0.00 0.00 27.41 28.54 3kfc h HIS 322 CO 0.63 0.24 -1.60 0.93 -0.00 0.00 0.00 177.93 178.12 3kfc h GLU 323 N 0.09 0.40 0.00 5.26 5.08 -1.96 -3.32 114.58 120.13 3kfc h GLU 323 Ca 0.02 -0.68 -0.20 0.00 -1.00 0.00 0.00 59.36 57.49 3kfc h GLU 323 Cb 0.31 0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.78 3kfc h GLU 323 CO 0.02 1.31 -1.35 1.79 -1.00 0.00 0.00 179.01 179.78 3kfc h THR 324 N 0.11 0.78 -1.21 1.13 1.35 -1.99 -3.48 112.91 109.60 3kfc h THR 324 Ca -0.29 -2.40 -0.24 0.00 -0.55 0.00 0.00 66.41 62.94 3kfc h THR 324 Cb 2.10 2.29 -0.05 0.00 -1.73 0.00 0.00 68.15 70.76 3kfc h THR 324 CO 0.20 0.45 -0.27 -0.62 -0.25 0.00 0.00 175.52 175.03 3kfc n GLU 325 N -3.03 -0.89 -3.80 4.72 1.02 0.30 -5.02 120.64 113.95 3kfc n GLU 325 Ca -0.09 0.71 -0.21 0.00 -0.02 0.00 0.00 57.16 57.55 3kfc n GLU 325 Cb 0.90 -4.80 -0.03 0.00 -0.02 0.00 0.00 31.44 27.49 3kfc n GLU 325 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kfc s ILE 327 N -2.29 2.76 -0.27 0.00 1.01 0.15 -0.32 121.20 122.25 3kfc s ILE 327 Ca 0.41 -0.80 -0.07 0.00 0.00 0.00 0.00 60.65 60.19 3kfc s ILE 327 Cb -0.06 -2.09 -0.01 0.00 0.01 0.00 0.00 42.46 40.31 3kfc s ILE 327 CO 0.27 0.56 0.06 0.28 0.00 0.00 0.00 174.94 176.11 3kfc s THR 328 N -0.16 4.01 -0.01 2.92 -1.32 -0.38 0.24 115.64 120.94 3kfc s THR 328 Ca -0.02 -0.50 0.03 0.00 -1.21 0.00 0.00 61.69 59.99 3kfc s THR 328 Cb -0.14 -2.98 -0.03 0.00 -1.51 0.00 0.00 72.50 67.85 3kfc s THR 328 CO 0.03 0.20 -0.06 -0.36 -2.21 0.00 0.00 174.62 172.23 3kfc s PHE 329 N 1.54 2.92 -0.99 9.09 2.99 0.02 -4.73 117.98 128.81 3kfc s PHE 329 Ca 0.04 -0.01 -0.12 0.00 0.00 0.00 0.00 56.93 56.84 3kfc s PHE 329 Cb -0.16 -1.64 -0.01 0.00 0.00 0.00 0.00 43.02 41.21 3kfc s PHE 329 CO 0.02 0.37 0.75 1.28 -0.00 0.00 0.00 175.22 177.64 3kfc n LEU 330 N 1.68 -3.65 0.00 -0.37 4.77 -1.26 -3.67 117.00 114.50 3kfc n LEU 330 Ca -0.16 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.03 3kfc n LEU 330 Cb 0.53 -2.49 0.00 0.00 -2.33 0.00 0.00 43.42 39.13 3kfc n LEU 330 CO 0.30 0.10 0.00 1.17 -1.33 0.00 0.00 177.39 177.63 3kfc n LYS 331 N -3.33 0.00 0.00 3.23 4.81 -1.26 -4.48 118.16 117.13 3kfc n LYS 331 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.33 3kfc n LYS 331 Cb 0.59 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.64 3kfc n LYS 331 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3kfc n ASP 332 N 2.22 0.00 -3.02 3.14 9.92 -1.24 -5.05 116.55 122.52 3kfc n ASP 332 Ca 0.00 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.25 3kfc n ASP 332 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 3kfc n ASP 332 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 3kfc n PHE 333 N 0.00 -1.62 -3.85 1.24 0.99 -1.24 -2.23 117.46 110.75 3kfc n PHE 333 Ca 0.00 0.71 -0.37 0.00 -0.00 0.00 0.00 57.45 57.79 3kfc n PHE 333 Cb 0.00 -2.20 -0.06 0.00 -1.00 0.00 0.00 39.48 36.22 3kfc n PHE 333 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 3kfc s THR 334 N -1.27 5.48 -0.05 4.37 -4.23 -1.26 -0.80 115.64 117.88 3kfc s THR 334 Ca 0.01 0.25 0.02 0.00 -1.18 0.00 0.00 61.69 60.79 3kfc s THR 334 Cb -0.00 -3.42 0.01 0.00 1.34 0.00 0.00 72.50 70.43 3kfc s THR 334 CO 0.32 0.62 -0.09 -0.31 -0.54 0.00 0.00 174.62 174.62 3kfc s TYR 335 N -1.03 1.09 0.60 3.99 1.51 0.14 -4.92 117.35 118.74 3kfc s TYR 335 Ca 0.16 -0.34 0.02 0.00 -1.01 0.00 0.00 57.07 55.90 3kfc s TYR 335 Cb -0.12 -0.83 0.07 0.00 -0.11 0.00 0.00 41.96 40.97 3kfc s TYR 335 CO 0.05 -0.19 0.84 -1.54 -1.11 0.00 0.00 175.55 173.59 3kfc s SER 336 N 0.56 4.96 0.29 2.29 1.04 -1.26 0.33 113.70 121.92 3kfc s SER 336 Ca -0.10 -0.27 0.03 0.00 0.48 0.00 0.00 55.95 56.09 3kfc s SER 336 Cb -0.13 -0.41 0.64 0.00 0.10 0.00 0.00 66.02 66.22 3kfc s SER 336 CO 0.02 -1.38 1.80 0.11 0.98 0.00 0.00 173.24 174.76 3kfc h LYS 337 N -0.08 0.84 -0.13 4.02 1.57 -1.99 -2.01 116.57 118.81 3kfc h LYS 337 Ca -0.38 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.21 3kfc h LYS 337 Cb 1.28 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 3kfc h LYS 337 CO 0.46 0.56 -0.53 -0.44 -0.57 0.00 0.00 179.45 178.93 3kfc h ASP 338 N 0.87 0.39 -0.82 0.86 3.45 -1.98 -2.36 116.42 116.83 3kfc h ASP 338 Ca 0.54 -0.20 -0.04 0.00 0.43 0.00 0.00 57.03 57.76 3kfc h ASP 338 Cb 0.70 -0.11 -0.04 0.00 -0.56 0.00 0.00 39.33 39.32 3kfc h ASP 338 CO -0.33 0.84 0.36 0.44 -1.57 0.00 0.00 179.24 178.99 3kfc h ASP 339 N 0.28 1.11 -0.51 6.45 3.32 -1.76 0.11 116.42 125.42 3kfc h ASP 339 Ca 0.01 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 56.92 3kfc h ASP 339 Cb 1.02 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 3kfc h ASP 339 CO 0.09 0.96 0.32 -0.26 -1.72 0.00 0.00 179.24 178.62 3kfc h PHE 340 N 1.19 0.60 -0.14 4.55 -1.00 -1.18 -1.41 116.94 119.55 3kfc h PHE 340 Ca 0.28 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 61.07 3kfc h PHE 340 Cb 0.17 -0.20 -0.01 0.00 3.61 0.00 0.00 35.95 39.52 3kfc h PHE 340 CO 0.02 0.36 0.08 1.25 -1.61 0.00 0.00 178.31 178.41 3kfc h HIS 341 N 0.65 0.19 -0.32 -0.55 2.76 -1.13 -2.63 115.15 114.12 3kfc h HIS 341 Ca 0.19 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.45 3kfc h HIS 341 Cb -0.03 -0.06 -0.01 0.00 1.55 0.00 0.00 27.41 28.86 3kfc h HIS 341 CO -0.05 0.19 0.24 0.00 -1.30 0.00 0.00 177.93 177.01 3kfc h ARG 342 N 0.13 0.00 -0.04 5.26 3.08 -0.60 -1.44 114.38 120.78 3kfc h ARG 342 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3kfc h ARG 342 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3kfc h ARG 342 CO -0.01 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.89 3kfc n ALA 343 N -2.56 2.58 -0.03 0.04 0.00 -0.55 -4.70 120.51 115.29 3kfc n ALA 343 Ca 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3kfc n ALA 343 Cb 0.41 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.64 3kfc n ALA 343 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kfc n GLY 344 N 0.83 0.59 3.84 0.00 0.00 -0.54 -3.62 105.19 106.29 3kfc n GLY 344 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 3kfc n GLY 344 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kfc s LEU 345 N 0.00 4.29 0.24 0.99 1.43 -1.10 -5.03 118.68 119.50 3kfc s LEU 345 Ca 0.00 1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 54.16 3kfc s LEU 345 Cb 0.00 -3.49 -0.08 0.00 0.03 0.00 0.00 46.19 42.66 3kfc s LEU 345 CO 0.00 0.03 0.58 0.00 0.23 0.00 0.00 176.35 177.19 3kfc s GLN 346 N -2.17 3.84 0.46 1.70 -2.07 -1.26 -4.24 119.66 115.93 3kfc s GLN 346 Ca 0.42 0.35 0.12 0.00 -1.82 0.00 0.00 55.36 54.43 3kfc s GLN 346 Cb -0.14 -2.61 1.06 0.00 -1.09 0.00 0.00 33.01 30.23 3kfc s GLN 346 CO 0.20 0.29 2.08 0.28 -1.32 0.00 0.00 175.29 176.82 3kfc h VAL 347 N 2.01 1.06 0.00 3.63 2.07 -1.98 0.26 116.25 123.31 3kfc h VAL 347 Ca -0.47 -0.20 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 3kfc h VAL 347 Cb 1.17 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 31.84 3kfc h VAL 347 CO 0.68 0.07 -0.03 -0.33 0.02 0.00 0.00 177.57 177.99 3kfc h GLU 348 N 0.20 0.00 0.01 1.57 3.07 -2.01 -2.18 114.58 115.24 3kfc h GLU 348 Ca 0.05 0.00 -0.40 0.00 -0.50 0.00 0.00 59.36 58.51 3kfc h GLU 348 Cb 0.05 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 27.90 3kfc h GLU 348 CO -0.01 0.03 -2.38 0.34 -1.40 0.00 0.00 179.01 175.59 3kfc n PHE 349 N -3.70 0.19 0.00 4.33 7.35 -0.27 -4.51 117.46 120.85 3kfc n PHE 349 Ca -0.03 0.05 -0.10 0.00 -0.76 0.00 0.00 57.45 56.62 3kfc n PHE 349 Cb 0.12 -1.02 -0.04 0.00 0.35 0.00 0.00 39.48 38.89 3kfc n PHE 349 CO 0.00 0.00 0.00 0.82 -0.76 0.00 0.00 176.76 176.82 3kfc h ILE 350 N -0.36 0.70 -0.41 -2.13 2.04 -0.93 -3.02 117.51 113.40 3kfc h ILE 350 Ca -0.59 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.24 3kfc h ILE 350 Cb 1.79 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 3kfc h ILE 350 CO -0.19 0.00 0.15 0.78 0.00 0.00 0.00 178.15 178.90 3kfc h ASN 351 N -0.13 0.57 -0.75 1.72 2.35 -1.65 -1.76 115.58 115.93 3kfc h ASN 351 Ca 0.08 -0.18 0.12 0.00 -0.55 0.00 0.00 56.30 55.77 3kfc h ASN 351 Cb 0.24 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.41 3kfc h ASN 351 CO -0.19 0.59 0.50 -0.65 -1.65 0.00 0.00 177.43 176.03 3kfc h PRO 352 N 0.51 0.55 -0.19 0.81 0.11 -1.79 -0.48 132.00 131.52 3kfc h PRO 352 Ca 0.13 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.20 3kfc h PRO 352 Cb 0.21 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.18 3kfc h PRO 352 CO -0.01 0.36 0.08 0.82 -0.21 0.00 0.00 178.00 179.04 3kfc h ILE 353 N 0.56 1.16 -0.09 4.15 2.04 -1.20 0.30 117.51 124.43 3kfc h ILE 353 Ca 0.36 -0.48 -0.14 0.00 1.00 0.00 0.00 64.86 65.60 3kfc h ILE 353 Cb 0.62 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 3kfc h ILE 353 CO -0.13 0.15 -0.56 -0.26 0.00 0.00 0.00 178.15 177.35 3kfc h PHE 354 N 0.16 0.33 -0.30 1.37 -1.00 -1.20 0.11 116.94 116.41 3kfc h PHE 354 Ca 0.06 -0.12 -0.12 0.00 2.81 0.00 0.00 57.97 60.61 3kfc h PHE 354 Cb 0.17 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 39.66 3kfc h PHE 354 CO -0.01 0.76 -0.27 1.49 -1.61 0.00 0.00 178.31 178.67 3kfc h GLU 355 N 0.20 0.72 -0.79 1.51 4.57 -1.03 -1.01 114.58 118.75 3kfc h GLU 355 Ca 0.00 -0.37 -0.02 0.00 -1.18 0.00 0.00 59.36 57.79 3kfc h GLU 355 Cb 1.05 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 29.61 3kfc h GLU 355 CO 0.09 0.98 0.41 0.35 -1.18 0.00 0.00 179.01 179.67 3kfc h PHE 356 N 0.48 1.10 -0.46 0.92 3.57 -0.84 -0.49 116.94 121.21 3kfc h PHE 356 Ca 0.05 -0.04 0.05 0.00 3.53 0.00 0.00 57.97 61.57 3kfc h PHE 356 Cb 0.84 -0.35 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 3kfc h PHE 356 CO 0.07 0.78 0.20 0.77 -2.23 0.00 0.00 178.31 177.90 3kfc h SER 357 N 1.10 0.25 -0.43 0.41 0.02 -0.64 -0.56 113.55 113.69 3kfc h SER 357 Ca 0.27 0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.23 3kfc h SER 357 Cb 0.06 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 3kfc h SER 357 CO -0.04 0.18 0.13 0.03 -1.14 0.00 0.00 176.83 175.98 3kfc h ARG 358 N 0.39 0.68 -0.50 3.45 3.08 -0.89 -2.46 114.38 118.14 3kfc h ARG 358 Ca 0.21 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 3kfc h ARG 358 Cb 0.17 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 3kfc h ARG 358 CO -0.18 0.67 0.19 0.00 -1.07 0.00 0.00 179.97 179.59 3kfc h ALA 359 N 0.98 1.41 -0.35 0.04 0.00 -0.83 -2.96 119.26 117.55 3kfc h ALA 359 Ca 0.14 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3kfc h ALA 359 Cb 0.28 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3kfc h ALA 359 CO -0.00 0.45 -0.42 0.52 0.00 0.00 0.00 179.25 179.80 3kfc h MET 360 N 0.71 0.87 -0.83 0.00 2.86 -0.95 -3.05 114.93 114.54 3kfc h MET 360 Ca 0.17 -0.48 0.03 0.00 -2.06 0.00 0.00 59.70 57.37 3kfc h MET 360 Cb 0.15 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.78 3kfc h MET 360 CO -0.02 1.12 0.54 -0.09 1.06 0.00 0.00 176.91 179.52 3kfc h ARG 361 N 0.71 1.02 -0.55 1.72 2.43 -1.33 -2.47 114.38 115.91 3kfc h ARG 361 Ca 0.05 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3kfc h ARG 361 Cb 1.01 -0.23 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 3kfc h ARG 361 CO 0.10 0.67 0.36 0.00 -1.51 0.00 0.00 179.97 179.60 3kfc h ARG 362 N 1.05 0.72 -0.39 0.20 3.08 -1.47 -1.17 114.38 116.40 3kfc h ARG 362 Ca 0.33 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.30 3kfc h ARG 362 Cb 0.00 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 3kfc h ARG 362 CO -0.11 0.48 0.08 -0.07 -1.07 0.00 0.00 179.97 179.28 3kfc h LEU 363 N 0.74 0.53 -1.63 3.04 3.38 -1.34 -3.47 115.31 116.56 3kfc h LEU 363 Ca 0.20 -0.08 -0.31 0.00 0.09 0.00 0.00 57.88 57.79 3kfc h LEU 363 Cb -0.08 -0.14 0.15 0.00 0.09 0.00 0.00 40.66 40.68 3kfc h LEU 363 CO -0.04 0.54 -0.70 0.61 0.09 0.00 0.00 178.44 178.93 3kfc n GLY 364 N -1.01 -0.30 3.74 0.83 0.00 -0.44 -4.95 105.19 103.06 3kfc n GLY 364 Ca 0.02 0.06 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 3kfc n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3kfc s LEU 365 N -6.06 4.44 0.93 0.99 1.43 -1.26 -5.05 118.68 114.11 3kfc s LEU 365 Ca 0.03 2.32 -0.15 0.00 -1.03 0.00 0.00 54.13 55.30 3kfc s LEU 365 Cb -0.01 -3.61 0.18 0.00 0.03 0.00 0.00 46.19 42.77 3kfc s LEU 365 CO 0.67 -0.42 1.29 1.51 0.23 0.00 0.00 176.35 179.63 3kfc s ASP 366 N 0.11 3.37 0.16 2.29 1.47 -1.26 -4.81 116.67 118.00 3kfc s ASP 366 Ca 0.53 0.32 -0.15 0.00 1.18 0.00 0.00 52.55 54.44 3kfc s ASP 366 Cb -0.34 -0.45 0.05 0.00 -0.34 0.00 0.00 42.92 41.84 3kfc s ASP 366 CO 0.38 -2.58 1.82 0.44 0.68 0.00 0.00 175.17 175.91 3kfc h ASP 367 N -1.52 0.48 -0.72 2.11 5.19 -1.99 0.27 116.42 120.24 3kfc h ASP 367 Ca -0.44 -0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 55.92 3kfc h ASP 367 Cb 1.25 -0.11 -0.03 0.00 0.18 0.00 0.00 39.33 40.61 3kfc h ASP 367 CO 0.42 0.35 0.29 0.00 -3.12 0.00 0.00 179.24 177.18 3kfc h ALA 368 N 1.18 1.12 0.02 3.45 0.00 -1.94 -0.70 119.26 122.38 3kfc h ALA 368 Ca 0.17 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 3kfc h ALA 368 Cb -0.04 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.46 3kfc h ALA 368 CO -0.05 0.63 -0.01 0.93 0.00 0.00 0.00 179.25 180.75 3kfc h GLU 369 N 1.07 -0.03 0.00 0.00 5.08 -1.83 -1.35 114.58 117.53 3kfc h GLU 369 Ca 0.25 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.64 3kfc h GLU 369 Cb 0.21 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 3kfc h GLU 369 CO -0.02 0.13 -0.23 1.88 -1.00 0.00 0.00 179.01 179.77 3kfc h TYR 370 N -0.17 -0.61 -0.59 4.33 -1.99 -0.76 -1.27 116.97 115.91 3kfc h TYR 370 Ca -0.00 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.75 3kfc h TYR 370 Cb 0.16 0.27 -0.03 0.00 2.00 0.00 0.00 36.73 39.13 3kfc h TYR 370 CO -0.03 -0.32 0.38 0.00 -0.00 0.00 0.00 178.16 178.19 3kfc h ALA 371 N 0.50 0.74 -0.59 3.88 0.00 -1.16 -2.30 119.26 120.32 3kfc h ALA 371 Ca 0.06 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3kfc h ALA 371 Cb 0.44 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3kfc h ALA 371 CO -0.21 0.20 0.04 -0.07 0.00 0.00 0.00 179.25 179.21 3kfc h LEU 372 N 0.79 0.96 -1.17 0.00 3.38 -1.14 -2.21 115.31 115.93 3kfc h LEU 372 Ca 0.21 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 3kfc h LEU 372 Cb -0.07 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 3kfc h LEU 372 CO -0.04 1.00 0.24 0.25 0.09 0.00 0.00 178.44 179.97 3kfc h LEU 373 N 0.93 0.75 -0.27 1.67 5.85 -0.99 -1.18 115.31 122.07 3kfc h LEU 373 Ca 0.18 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.74 3kfc h LEU 373 Cb 0.48 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 3kfc h LEU 373 CO 0.02 0.66 -0.10 0.40 -0.34 0.00 0.00 178.44 179.09 3kfc h ILE 374 N 0.82 1.29 -0.47 4.05 2.04 -1.20 -0.15 117.51 123.89 3kfc h ILE 374 Ca 0.20 -1.15 -0.00 0.00 1.00 0.00 0.00 64.86 64.90 3kfc h ILE 374 Cb 0.14 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 3kfc h ILE 374 CO -0.02 0.36 0.29 0.00 0.00 0.00 0.00 178.15 178.78 3kfc h ALA 375 N 0.75 0.59 -0.33 1.87 0.00 -1.13 0.64 119.26 121.65 3kfc h ALA 375 Ca 0.06 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3kfc h ALA 375 Cb 0.59 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 3kfc h ALA 375 CO 0.03 0.07 0.22 0.82 0.00 0.00 0.00 179.25 180.39 3kfc h ILE 376 N 0.62 1.09 -0.31 0.00 2.04 -1.20 -2.41 117.51 117.35 3kfc h ILE 376 Ca 0.17 -0.17 0.07 0.00 1.00 0.00 0.00 64.86 65.92 3kfc h ILE 376 Cb -0.03 0.62 -0.07 0.00 -0.74 0.00 0.00 36.82 36.60 3kfc h ILE 376 CO -0.03 0.09 -0.15 -1.13 0.00 0.00 0.00 178.15 176.93 3kfc h ASN 377 N 0.44 -0.49 -0.47 1.72 -0.73 -0.65 -2.96 115.58 112.44 3kfc h ASN 377 Ca 0.12 0.12 0.08 0.00 1.87 0.00 0.00 56.30 58.49 3kfc h ASN 377 Cb -0.04 0.27 -0.07 0.00 0.27 0.00 0.00 38.32 38.76 3kfc h ASN 377 CO -0.03 -0.18 0.08 0.40 -0.37 0.00 0.00 177.43 177.33 3kfc h ILE 378 N -0.10 0.73 -1.15 2.57 2.04 -0.62 -3.07 117.51 117.91 3kfc h ILE 378 Ca 0.16 -0.07 -0.67 0.00 1.00 0.00 0.00 64.86 65.28 3kfc h ILE 378 Cb 0.34 0.50 -0.14 0.00 -0.74 0.00 0.00 36.82 36.78 3kfc h ILE 378 CO -0.37 0.04 1.76 0.49 0.00 0.00 0.00 178.15 180.07 3kfc n PHE 379 N -5.12 2.29 -3.47 1.37 3.01 -0.93 -4.87 117.46 109.74 3kfc n PHE 379 Ca 0.05 -2.55 -0.39 0.00 1.01 0.00 0.00 57.45 55.57 3kfc n PHE 379 Cb 0.23 -1.68 -0.10 0.00 -0.01 0.00 0.00 39.48 37.92 3kfc n PHE 379 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 3kfc s SER 380 N 0.32 6.14 0.48 4.37 0.01 -1.16 -4.52 113.70 119.34 3kfc s SER 380 Ca 0.55 -0.06 0.25 0.00 1.31 0.00 0.00 55.95 58.00 3kfc s SER 380 Cb 0.25 -2.17 1.20 0.00 0.21 0.00 0.00 66.02 65.50 3kfc s SER 380 CO -0.14 -0.20 1.96 0.00 0.41 0.00 0.00 173.24 175.27 3kfc h ALA 381 N 8.36 1.20 -0.25 1.44 0.00 -1.86 -3.12 119.26 125.02 3kfc h ALA 381 Ca -0.32 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3kfc h ALA 381 Cb 1.16 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.92 3kfc h ALA 381 CO 0.63 0.23 0.00 -0.40 0.00 0.00 0.00 179.25 179.71 3kfc n ASP 382 N -3.60 2.48 -4.75 0.00 5.75 -1.26 -4.74 116.55 110.44 3kfc n ASP 382 Ca -0.01 -2.25 -0.35 0.00 -0.01 0.00 0.00 54.79 52.17 3kfc n ASP 382 Cb 0.32 -0.45 0.04 0.00 -1.03 0.00 0.00 41.12 40.00 3kfc n ASP 382 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3kfc s ARG 383 N -1.68 2.83 0.29 0.11 1.81 -1.18 -4.95 118.95 116.17 3kfc s ARG 383 Ca 0.21 1.72 -0.30 0.00 -1.72 0.00 0.00 55.73 55.65 3kfc s ARG 383 Cb 0.15 -1.92 -0.13 0.00 -0.45 0.00 0.00 34.95 32.60 3kfc s ARG 383 CO 0.09 -1.29 1.37 -2.30 -0.68 0.00 0.00 175.30 172.49 3kfc n PRO 384 N -1.90 2.13 -1.78 3.54 -0.02 -1.26 -3.52 135.00 132.19 3kfc n PRO 384 Ca 0.13 0.75 -0.13 0.00 -2.02 0.00 0.00 63.50 62.23 3kfc n PRO 384 Cb 0.50 -2.39 -0.03 0.00 -0.02 0.00 0.00 33.50 31.56 3kfc n PRO 384 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3kfc n ASN 385 N 1.56 -4.30 -4.70 2.55 5.03 -1.26 -4.82 115.26 109.32 3kfc n ASN 385 Ca 0.08 0.16 -0.42 0.00 0.87 0.00 0.00 54.58 55.27 3kfc n ASN 385 Cb 0.34 -3.19 -0.03 0.00 -1.02 0.00 0.00 39.78 35.88 3kfc n ASN 385 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 3kfc s VAL 386 N -2.55 4.77 -0.03 2.41 1.01 -1.23 -4.84 120.40 119.94 3kfc s VAL 386 Ca 0.00 2.02 0.09 0.00 0.00 0.00 0.00 61.98 64.08 3kfc s VAL 386 Cb 0.00 -4.29 -0.24 0.00 0.00 0.00 0.00 36.38 31.85 3kfc s VAL 386 CO 0.00 0.06 0.70 1.56 0.00 0.00 0.00 175.10 177.41 3kfc h GLN 387 N 7.01 0.05 -2.20 2.72 4.20 -1.94 -3.40 115.11 121.55 3kfc h GLN 387 Ca -0.35 -0.08 -0.58 0.00 0.06 0.00 0.00 58.65 57.70 3kfc h GLN 387 Cb 1.17 0.03 -0.42 0.00 0.30 0.00 0.00 27.48 28.57 3kfc h GLN 387 CO 0.82 0.67 -0.71 0.39 -0.67 0.00 0.00 178.83 179.33 3kfc n GLU 388 N -3.15 2.52 0.24 1.46 1.02 -1.26 -4.93 120.64 116.54 3kfc n GLU 388 Ca -0.17 -4.51 0.09 0.00 -0.02 0.00 0.00 57.16 52.54 3kfc n GLU 388 Cb 1.04 -2.11 0.59 0.00 -0.02 0.00 0.00 31.44 30.94 3kfc n GLU 388 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3kfc h PRO 389 N 3.59 0.00 -0.73 3.49 0.13 -1.85 -1.25 132.00 135.38 3kfc h PRO 389 Ca 0.15 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.26 3kfc h PRO 389 Cb 0.64 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.74 3kfc h PRO 389 CO 0.77 0.19 0.38 0.78 -0.23 0.00 0.00 178.00 179.89 3kfc h GLY 390 N 0.89 1.10 0.89 1.56 0.00 -1.93 -0.67 103.07 104.91 3kfc h GLY 390 Ca -0.00 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 46.75 3kfc h GLY 390 CO 0.02 0.49 -0.06 3.21 0.00 0.00 0.00 176.54 180.21 3kfc h ARG 391 N 1.01 0.58 -0.74 4.80 2.47 -1.68 -2.13 114.38 118.68 3kfc h ARG 391 Ca 0.25 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.76 3kfc h ARG 391 Cb 0.07 -0.04 -0.04 0.00 -1.65 0.00 0.00 29.97 28.31 3kfc h ARG 391 CO -0.04 0.76 0.46 0.28 0.56 0.00 0.00 179.97 181.99 3kfc h VAL 392 N 0.35 1.20 -0.57 2.04 2.07 -1.21 -0.93 116.25 119.21 3kfc h VAL 392 Ca 0.08 -0.42 -0.05 0.00 0.82 0.00 0.00 66.70 67.13 3kfc h VAL 392 Cb 0.53 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 3kfc h VAL 392 CO 0.03 0.21 0.13 -0.08 0.02 0.00 0.00 177.57 177.87 3kfc h GLU 393 N 1.00 0.88 -0.19 1.57 4.81 -1.12 -2.16 114.58 119.37 3kfc h GLU 393 Ca 0.27 -0.19 -0.14 0.00 -0.13 0.00 0.00 59.36 59.17 3kfc h GLU 393 Cb -0.07 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 3kfc h GLU 393 CO -0.05 0.79 -0.45 0.00 -0.73 0.00 0.00 179.01 178.56 3kfc h ALA 394 N 1.30 0.86 0.00 2.92 0.00 -0.67 -2.92 119.26 120.75 3kfc h ALA 394 Ca 0.18 -0.46 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 3kfc h ALA 394 Cb 0.32 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3kfc h ALA 394 CO 0.00 0.65 -0.56 -0.07 0.00 0.00 0.00 179.25 179.27 3kfc h LEU 395 N 0.38 0.00 -0.66 0.00 3.38 -1.00 -3.17 115.31 114.25 3kfc h LEU 395 Ca 0.03 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.86 3kfc h LEU 395 Cb 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 3kfc h LEU 395 CO 0.08 0.56 -0.38 -0.61 0.09 0.00 0.00 178.44 178.18 3kfc h GLN 396 N 0.00 0.61 -0.62 1.13 4.15 -1.30 -3.36 115.11 115.72 3kfc h GLN 396 Ca -0.01 -0.30 0.06 0.00 0.77 0.00 0.00 58.65 59.17 3kfc h GLN 396 Cb 1.00 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.61 3kfc h GLN 396 CO 0.07 0.89 -0.50 0.37 -1.93 0.00 0.00 178.83 177.74 3kfc h GLN 397 N 0.50 -0.16 -0.32 1.69 4.15 -1.48 -0.47 115.11 119.02 3kfc h GLN 397 Ca 0.05 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.57 3kfc h GLN 397 Cb 0.89 0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.60 3kfc h GLN 397 CO 0.08 -0.11 0.27 -1.00 -1.93 0.00 0.00 178.83 176.14 3kfc h PRO 398 N -0.17 0.00 0.09 -2.39 0.13 -1.75 -0.67 132.00 127.24 3kfc h PRO 398 Ca 0.10 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.97 3kfc h PRO 398 Cb 0.43 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.57 3kfc h PRO 398 CO -0.67 0.00 -1.15 1.88 -0.23 0.00 0.00 178.00 177.84 3kfc h TYR 399 N 0.00 0.58 0.20 1.56 -1.99 -1.33 -1.67 116.97 114.31 3kfc h TYR 399 Ca 0.15 -0.38 -0.01 0.00 2.00 0.00 0.00 58.73 60.49 3kfc h TYR 399 Cb 0.68 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.38 3kfc h TYR 399 CO 0.00 1.25 -0.09 0.28 -0.00 0.00 0.00 178.16 179.60 3kfc h VAL 400 N 0.14 0.83 -0.77 -2.88 2.07 -0.07 -2.34 116.25 113.24 3kfc h VAL 400 Ca -0.12 -0.13 0.11 0.00 0.82 0.00 0.00 66.70 67.37 3kfc h VAL 400 Cb 1.84 0.91 -0.08 0.00 -1.52 0.00 0.00 31.29 32.44 3kfc h VAL 400 CO 0.19 0.03 0.39 -0.33 0.02 0.00 0.00 177.57 177.88 3kfc h GLU 401 N -0.33 0.62 -0.52 1.57 5.08 -1.24 -0.63 114.58 119.14 3kfc h GLU 401 Ca -0.03 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.19 3kfc h GLU 401 Cb 0.25 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3kfc h GLU 401 CO 0.04 0.41 -0.11 0.00 -1.00 0.00 0.00 179.01 178.36 3kfc h ALA 402 N 1.47 0.82 -0.44 3.43 0.00 -1.26 -1.26 119.26 122.02 3kfc h ALA 402 Ca 0.39 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 3kfc h ALA 402 Cb 0.44 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3kfc h ALA 402 CO -0.29 0.66 -0.28 1.25 0.00 0.00 0.00 179.25 180.58 3kfc h LEU 403 N 0.87 1.01 0.05 0.00 5.85 -1.09 0.76 115.31 122.75 3kfc h LEU 403 Ca 0.14 -0.42 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 3kfc h LEU 403 Cb 0.66 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.41 3kfc h LEU 403 CO 0.05 1.22 -0.02 0.25 -0.34 0.00 0.00 178.44 179.59 3kfc h LEU 404 N 0.82 -0.06 -0.73 2.25 5.85 -1.04 -0.87 115.31 121.53 3kfc h LEU 404 Ca 0.09 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 3kfc h LEU 404 Cb 0.87 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 3kfc h LEU 404 CO 0.08 -0.02 0.43 0.28 -0.34 0.00 0.00 178.44 178.87 3kfc h SER 405 N -0.09 0.88 -0.14 1.25 0.02 -1.16 -2.43 113.55 111.89 3kfc h SER 405 Ca -0.01 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.87 3kfc h SER 405 Cb 0.07 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 3kfc h SER 405 CO 0.01 0.70 0.08 0.22 -1.14 0.00 0.00 176.83 176.70 3kfc h TYR 406 N 1.00 0.19 0.00 3.45 3.20 -0.66 -2.42 116.97 121.72 3kfc h TYR 406 Ca 0.26 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.09 3kfc h TYR 406 Cb -0.02 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 3kfc h TYR 406 CO -0.01 0.18 -0.18 1.79 -1.64 0.00 0.00 178.16 178.31 3kfc h THR 407 N 0.14 0.45 -0.22 1.81 1.35 -1.09 0.21 112.91 115.55 3kfc h THR 407 Ca 0.05 -1.00 -0.20 0.00 -0.55 0.00 0.00 66.41 64.71 3kfc h THR 407 Cb 0.05 1.71 0.01 0.00 -1.73 0.00 0.00 68.15 68.19 3kfc h THR 407 CO -0.01 0.18 -0.64 0.03 -0.25 0.00 0.00 175.52 174.83 3kfc h ARG 408 N 0.00 0.83 0.03 4.72 3.08 -1.27 -2.29 114.38 119.48 3kfc h ARG 408 Ca -0.00 -0.59 -0.11 0.00 0.07 0.00 0.00 59.98 59.35 3kfc h ARG 408 Cb 0.70 0.10 0.01 0.00 0.08 0.00 0.00 29.97 30.86 3kfc h ARG 408 CO 0.02 1.21 -0.43 0.82 -1.07 0.00 0.00 179.97 180.53 3kfc h ILE 409 N 0.59 1.54 0.30 2.04 2.04 -1.20 -3.15 117.51 119.68 3kfc h ILE 409 Ca -0.02 -2.16 -0.01 0.00 1.00 0.00 0.00 64.86 63.67 3kfc h ILE 409 Cb 1.26 2.91 0.00 0.00 -0.74 0.00 0.00 36.82 40.25 3kfc h ILE 409 CO 0.14 0.60 -0.15 0.50 0.00 0.00 0.00 178.15 179.24 3kfc h LYS 410 N -0.44 -0.39 -2.95 2.37 3.64 -0.69 -3.37 116.57 114.74 3kfc h LYS 410 Ca -0.06 0.03 -0.61 0.00 -1.27 0.00 0.00 60.65 58.73 3kfc h LYS 410 Cb 1.22 0.09 -0.41 0.00 -0.41 0.00 0.00 32.23 32.72 3kfc h LYS 410 CO 0.08 -0.12 -0.68 1.03 -2.27 0.00 0.00 179.45 177.50 3kfc s ARG 411 N -5.12 1.99 0.45 1.90 1.81 -0.86 -4.95 118.95 114.17 3kfc s ARG 411 Ca -0.15 -2.91 0.18 0.00 -1.72 0.00 0.00 55.73 51.13 3kfc s ARG 411 Cb 0.03 -2.89 1.05 0.00 -0.45 0.00 0.00 34.95 32.68 3kfc s ARG 411 CO 0.58 -1.28 1.97 -1.35 -0.68 0.00 0.00 175.30 174.54 3kfc h PRO 412 N 5.66 0.00 -0.50 3.54 0.11 -1.70 -3.05 132.00 136.06 3kfc h PRO 412 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3kfc h PRO 412 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3kfc h PRO 412 CO 0.62 0.21 0.00 1.04 -0.21 0.00 0.00 178.00 179.67 3kfc n GLN 413 N -4.07 2.34 -3.90 1.05 1.13 -1.26 -4.51 117.38 108.16 3kfc n GLN 413 Ca -0.02 -2.06 -0.30 0.00 -1.94 0.00 0.00 57.00 52.68 3kfc n GLN 413 Cb 0.29 -1.47 -0.14 0.00 0.11 0.00 0.00 30.24 29.03 3kfc n GLN 413 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3kfc s ASP 414 N -1.18 4.29 0.49 1.08 2.15 -1.15 -4.99 116.67 117.37 3kfc s ASP 414 Ca 0.39 -2.51 0.29 0.00 0.43 0.00 0.00 52.55 51.15 3kfc s ASP 414 Cb 0.21 -1.43 0.96 0.00 -0.30 0.00 0.00 42.92 42.36 3kfc s ASP 414 CO 0.28 -0.31 1.83 1.56 -0.17 0.00 0.00 175.17 178.37 3kfc h GLN 415 N 7.07 0.00 -0.50 4.34 1.08 -1.82 -3.21 115.11 122.08 3kfc h GLN 415 Ca -0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 3kfc h GLN 415 Cb 0.95 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.38 3kfc h GLN 415 CO 0.57 0.00 0.00 1.28 -0.95 0.00 0.00 178.83 179.73 3kfc n LEU 416 N -3.04 3.37 0.05 1.46 4.77 -1.26 -4.47 117.00 117.87 3kfc n LEU 416 Ca 0.02 -1.56 -0.12 0.00 -0.03 0.00 0.00 56.01 54.32 3kfc n LEU 416 Cb 0.39 -0.33 -0.07 0.00 -2.33 0.00 0.00 43.42 41.08 3kfc n LEU 416 CO 0.30 0.78 0.82 -0.09 -1.33 0.00 0.00 177.39 177.87 3kfc h ARG 417 N 4.03 -0.04 0.22 3.23 2.43 -1.94 -1.90 114.38 120.41 3kfc h ARG 417 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3kfc h ARG 417 Cb 0.90 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.46 3kfc h ARG 417 CO 0.00 0.04 -0.11 0.35 -1.51 0.00 0.00 179.97 178.74 3kfc h PHE 418 N -0.12 -0.30 -0.64 2.20 3.57 -1.85 -1.61 116.94 118.20 3kfc h PHE 418 Ca -0.00 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.56 3kfc h PHE 418 Cb 0.10 0.10 -0.06 0.00 2.79 0.00 0.00 35.95 38.88 3kfc h PHE 418 CO -0.05 -0.18 0.33 -1.35 -2.23 0.00 0.00 178.31 174.82 3kfc h PRO 419 N -0.31 0.57 -0.78 6.41 0.11 -1.84 -2.00 132.00 134.16 3kfc h PRO 419 Ca -0.03 -0.03 0.10 0.00 0.11 0.00 0.00 66.00 66.14 3kfc h PRO 419 Cb 0.25 -0.13 -0.05 0.00 0.11 0.00 0.00 31.00 31.17 3kfc h PRO 419 CO 0.04 0.38 0.51 0.00 -0.21 0.00 0.00 178.00 178.72 3kfc h ARG 420 N 0.59 0.68 -0.21 1.05 3.08 -1.16 -0.28 114.38 118.14 3kfc h ARG 420 Ca 0.30 -0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.24 3kfc h ARG 420 Cb 0.25 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 3kfc h ARG 420 CO -0.22 0.45 -0.14 0.52 -1.07 0.00 0.00 179.97 179.51 3kfc h MET 421 N 0.70 0.47 0.00 0.04 2.86 -0.65 -2.98 114.93 115.36 3kfc h MET 421 Ca 0.36 -0.22 -0.04 0.00 -2.06 0.00 0.00 59.70 57.73 3kfc h MET 421 Cb 0.46 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 3kfc h MET 421 CO -0.13 0.78 -0.19 -0.07 1.06 0.00 0.00 176.91 178.35 3kfc h LEU 422 N 0.16 0.00 -1.94 1.22 3.38 -0.95 -2.56 115.31 114.61 3kfc h LEU 422 Ca 0.04 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3kfc h LEU 422 Cb 0.66 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 3kfc h LEU 422 CO 0.04 0.19 -0.10 0.24 0.09 0.00 0.00 178.44 178.90 3kfc h MET 423 N 0.00 0.00 0.00 1.13 2.86 -0.90 -2.50 114.93 115.52 3kfc h MET 423 Ca -0.00 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 3kfc h MET 423 Cb 0.36 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.01 3kfc h MET 423 CO 0.03 0.10 -0.36 0.87 1.06 0.00 0.00 176.91 178.60 3kfc h LYS 424 N 0.00 0.00 -0.43 1.72 1.79 -1.45 -2.67 116.57 115.54 3kfc h LYS 424 Ca -0.00 0.00 -0.05 0.00 -2.18 0.00 0.00 60.65 58.42 3kfc h LYS 424 Cb 0.33 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.96 3kfc h LYS 424 CO 0.01 0.36 0.05 -0.07 -1.08 0.00 0.00 179.45 178.73 3kfc h LEU 425 N 0.00 0.62 -0.16 2.94 3.38 -1.55 0.31 115.31 120.85 3kfc h LEU 425 Ca -0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3kfc h LEU 425 Cb 0.92 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 3kfc h LEU 425 CO 0.05 0.66 0.08 0.58 0.09 0.00 0.00 178.44 179.89 3kfc h VAL 426 N 0.64 1.12 -0.60 1.22 2.07 -1.56 -1.98 116.25 117.16 3kfc h VAL 426 Ca 0.14 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.33 3kfc h VAL 426 Cb 0.33 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 3kfc h VAL 426 CO 0.01 0.12 0.36 0.28 0.02 0.00 0.00 177.57 178.35 3kfc h SER 427 N 0.13 0.57 -0.40 0.57 0.02 -1.21 -2.87 113.55 110.36 3kfc h SER 427 Ca 0.05 0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 3kfc h SER 427 Cb 0.12 -0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 3kfc h SER 427 CO -0.01 0.39 0.18 -0.07 -1.14 0.00 0.00 176.83 176.19 3kfc h LEU 428 N 0.70 0.57 -0.69 5.07 3.38 -0.80 -1.47 115.31 122.07 3kfc h LEU 428 Ca 0.25 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 58.13 3kfc h LEU 428 Cb 0.05 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3kfc h LEU 428 CO -0.12 0.52 0.32 0.03 0.09 0.00 0.00 178.44 179.28 3kfc h ARG 429 N 0.63 1.00 0.07 1.13 2.47 -1.15 -1.07 114.38 117.47 3kfc h ARG 429 Ca 0.15 -0.15 -0.00 0.00 -1.26 0.00 0.00 59.98 58.72 3kfc h ARG 429 Cb 0.12 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 28.27 3kfc h ARG 429 CO -0.02 0.80 -0.03 1.15 0.56 0.00 0.00 179.97 182.43 3kfc h THR 430 N 0.97 0.99 -0.89 2.04 2.02 -1.32 -2.43 112.91 114.29 3kfc h THR 430 Ca 0.24 -0.21 0.12 0.00 0.77 0.00 0.00 66.41 67.32 3kfc h THR 430 Cb 0.14 1.13 -0.07 0.00 -1.74 0.00 0.00 68.15 67.61 3kfc h THR 430 CO -0.03 0.05 0.57 -0.07 0.37 0.00 0.00 175.52 176.42 3kfc h LEU 431 N -0.19 0.74 -0.54 2.58 -0.00 -1.18 0.12 115.31 116.84 3kfc h LEU 431 Ca -0.01 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 57.89 3kfc h LEU 431 Cb 0.16 -0.12 -0.03 0.00 -0.00 0.00 0.00 40.66 40.68 3kfc h LEU 431 CO 0.02 0.41 0.30 -1.28 -0.00 0.00 0.00 178.44 177.88 3kfc h SER 432 N 0.80 0.67 -0.33 -0.43 0.87 -1.05 0.30 113.55 114.38 3kfc h SER 432 Ca 0.43 -0.09 0.01 0.00 -1.23 0.00 0.00 61.79 60.91 3kfc h SER 432 Cb 0.55 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.32 3kfc h SER 432 CO -0.19 0.56 0.21 -1.28 -0.53 0.00 0.00 176.83 175.60 3kfc h SER 433 N 0.72 0.37 -0.94 6.23 0.87 -0.71 -1.81 113.55 118.28 3kfc h SER 433 Ca 0.19 -0.01 0.13 0.00 -1.23 0.00 0.00 61.79 60.88 3kfc h SER 433 Cb 0.04 -0.09 -0.09 0.00 -0.44 0.00 0.00 62.40 61.82 3kfc h SER 433 CO -0.03 0.27 0.56 0.58 -0.53 0.00 0.00 176.83 177.68 3kfc h VAL 434 N 0.44 0.84 -0.44 2.23 2.07 -0.80 -2.75 116.25 117.84 3kfc h VAL 434 Ca 0.12 -0.29 -0.06 0.00 0.82 0.00 0.00 66.70 67.29 3kfc h VAL 434 Cb -0.04 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.63 3kfc h VAL 434 CO -0.03 0.15 0.05 -0.74 0.02 0.00 0.00 177.57 177.02 3kfc h HIS 435 N 0.85 0.80 -0.94 1.57 6.17 -0.59 -2.04 115.15 120.97 3kfc h HIS 435 Ca 0.49 -0.12 0.16 0.00 0.71 0.00 0.00 60.37 61.61 3kfc h HIS 435 Cb 0.57 -0.22 -0.08 0.00 2.52 0.00 0.00 27.41 30.20 3kfc h HIS 435 CO -0.03 0.77 0.60 0.77 0.71 0.00 0.00 177.93 180.75 3kfc h SER 436 N 0.60 0.70 -0.36 3.26 0.02 -1.14 0.84 113.55 117.47 3kfc h SER 436 Ca 0.13 0.06 -0.09 0.00 -0.84 0.00 0.00 61.79 61.05 3kfc h SER 436 Cb 0.42 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 3kfc h SER 436 CO 0.01 0.32 -0.12 -0.33 -1.14 0.00 0.00 176.83 175.57 3kfc h GLU 437 N 0.72 0.72 -0.69 3.45 5.08 -1.26 -2.10 114.58 120.50 3kfc h GLU 437 Ca 0.49 -0.29 -0.04 0.00 -1.00 0.00 0.00 59.36 58.52 3kfc h GLU 437 Cb 0.79 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.98 3kfc h GLU 437 CO -0.25 0.89 0.28 0.37 -1.00 0.00 0.00 179.01 179.30 3kfc h GLN 438 N 0.52 1.04 -0.06 2.33 5.75 -0.60 -1.00 115.11 123.09 3kfc h GLN 438 Ca 0.09 -0.19 -0.12 0.00 -0.15 0.00 0.00 58.65 58.28 3kfc h GLN 438 Cb 0.65 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 29.02 3kfc h GLN 438 CO 0.04 0.86 -0.53 -0.39 -2.65 0.00 0.00 178.83 176.16 3kfc h VAL 439 N 0.99 1.37 -0.67 2.39 -1.51 -0.81 -2.75 116.25 115.26 3kfc h VAL 439 Ca 0.23 -1.82 -0.08 0.00 -1.23 0.00 0.00 66.70 63.80 3kfc h VAL 439 Cb 0.20 1.92 -0.03 0.00 -2.13 0.00 0.00 31.29 31.26 3kfc h VAL 439 CO -0.02 0.53 0.09 0.15 -1.23 0.00 0.00 177.57 177.10 3kfc h PHE 440 N 0.12 1.19 0.00 5.19 3.57 -1.10 -2.85 116.94 123.05 3kfc h PHE 440 Ca 0.00 -0.17 -0.01 0.00 3.53 0.00 0.00 57.97 61.32 3kfc h PHE 440 Cb 0.98 -0.32 -0.00 0.00 2.79 0.00 0.00 35.95 39.39 3kfc h PHE 440 CO 0.01 1.00 -0.04 0.00 -2.23 0.00 0.00 178.31 177.04 3kfc h ALA 441 N 1.05 1.08 -0.71 2.41 0.00 -0.91 -2.92 119.26 119.27 3kfc h ALA 441 Ca 0.20 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3kfc h ALA 441 Cb 0.46 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3kfc h ALA 441 CO 0.02 0.06 0.31 -0.07 0.00 0.00 0.00 179.25 179.56 3kfc h LEU 442 N 0.00 0.93 -0.67 0.00 3.38 -1.25 -3.12 115.31 114.59 3kfc h LEU 442 Ca -0.00 -0.12 0.13 0.00 0.09 0.00 0.00 57.88 57.98 3kfc h LEU 442 Cb 0.33 -0.24 -0.13 0.00 0.09 0.00 0.00 40.66 40.72 3kfc h LEU 442 CO 0.01 0.81 -0.26 -0.09 0.09 0.00 0.00 178.44 179.00 3kfc h ARG 443 N 1.01 -0.07 0.00 1.13 9.65 -1.63 -1.04 114.38 123.43 3kfc h ARG 443 Ca 0.24 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.13 3kfc h ARG 443 Cb 0.15 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 28.75 3kfc h ARG 443 CO -0.03 -0.05 -0.09 -0.07 2.80 0.00 0.00 179.97 182.54 3kfc h LEU 444 N -0.07 0.00 -0.98 3.80 3.38 -1.73 -3.25 115.31 116.45 3kfc h LEU 444 Ca 0.30 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.24 3kfc h LEU 444 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 3kfc h LEU 444 CO -0.72 0.01 0.00 0.00 0.09 0.00 0.00 178.44 177.82 3kfc n GLN 445 N -2.30 1.64 -2.75 1.13 1.13 -0.44 -4.91 117.38 110.88 3kfc n GLN 445 Ca 0.05 -0.96 -0.17 0.00 -1.94 0.00 0.00 57.00 53.98 3kfc n GLN 445 Cb 0.44 -1.36 0.02 0.00 0.11 0.00 0.00 30.24 29.45 3kfc n GLN 445 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3kfc n ASP 446 N 0.20 -5.06 -4.28 1.08 -0.08 -1.15 -5.02 116.55 102.23 3kfc n ASP 446 Ca 0.15 -0.19 -0.31 0.00 -1.51 0.00 0.00 54.79 52.93 3kfc n ASP 446 Cb 0.29 -3.96 -0.16 0.00 2.34 0.00 0.00 41.12 39.63 3kfc n ASP 446 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 3kfc s LYS 447 N -5.33 2.53 -0.03 -0.67 1.02 -0.91 -5.08 119.74 111.27 3kfc s LYS 447 Ca 0.19 -0.90 0.05 0.00 0.02 0.00 0.00 55.97 55.34 3kfc s LYS 447 Cb -0.09 -2.17 -0.01 0.00 -0.52 0.00 0.00 37.83 35.05 3kfc s LYS 447 CO 0.24 0.40 -0.19 0.15 -0.92 0.00 0.00 175.35 175.03 3kfc s LYS 448 N -0.20 1.81 0.24 1.68 3.01 -1.26 -4.03 119.74 120.98 3kfc s LYS 448 Ca -0.02 -0.69 -0.30 0.00 -1.01 0.00 0.00 55.97 53.95 3kfc s LYS 448 Cb -0.13 -1.63 -0.09 0.00 -1.01 0.00 0.00 37.83 34.96 3kfc s LYS 448 CO 0.03 0.34 1.24 -0.51 0.51 0.00 0.00 175.35 176.96 3kfc s LEU 449 N -0.21 4.46 0.69 3.17 1.43 -1.26 -5.03 118.68 121.92 3kfc s LEU 449 Ca 0.01 2.39 -0.14 0.00 -1.03 0.00 0.00 54.13 55.36 3kfc s LEU 449 Cb -0.10 -3.62 0.01 0.00 0.03 0.00 0.00 46.19 42.51 3kfc s LEU 449 CO 0.01 -0.41 1.10 -2.16 0.23 0.00 0.00 176.35 175.13 3kfc s PRO 450 N -0.76 2.68 0.22 1.29 0.04 -1.26 -4.54 135.00 132.66 3kfc s PRO 450 Ca 0.52 1.33 -0.08 0.00 0.04 0.00 0.00 61.00 62.80 3kfc s PRO 450 Cb -0.35 -1.94 0.33 0.00 0.04 0.00 0.00 34.50 32.58 3kfc s PRO 450 CO 0.41 -1.34 1.25 -2.30 0.04 0.00 0.00 177.00 175.07 3kfc n PRO 451 N -2.69 -0.10 0.11 0.56 -0.02 -1.26 -0.96 135.00 130.64 3kfc n PRO 451 Ca 0.10 1.25 -0.01 0.00 -2.02 0.00 0.00 63.50 62.82 3kfc n PRO 451 Cb 0.52 -1.87 0.26 0.00 -0.02 0.00 0.00 33.50 32.39 3kfc n PRO 451 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3kfc h LEU 452 N 0.00 0.19 0.02 2.45 3.38 -2.01 -1.68 115.31 117.67 3kfc h LEU 452 Ca 0.36 -0.08 -0.23 0.00 0.09 0.00 0.00 57.88 58.02 3kfc h LEU 452 Cb 0.56 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3kfc h LEU 452 CO -0.82 0.57 -1.13 -0.07 0.09 0.00 0.00 178.44 177.08 3kfc h LEU 453 N 0.16 0.08 -0.57 1.67 3.38 -1.39 -3.32 115.31 115.32 3kfc h LEU 453 Ca 0.02 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.80 3kfc h LEU 453 Cb 0.77 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 3kfc h LEU 453 CO 0.06 1.08 -0.01 -1.28 0.09 0.00 0.00 178.44 178.37 3kfc h SER 454 N 0.01 0.99 0.25 -0.43 0.87 -0.91 -1.29 113.55 113.04 3kfc h SER 454 Ca -0.07 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.17 3kfc h SER 454 Cb 1.84 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 63.53 3kfc h SER 454 CO 0.14 1.06 -0.04 1.05 -0.53 0.00 0.00 176.83 178.51 3kfc h GLU 455 N 0.89 0.00 0.05 2.24 4.11 -1.41 -1.40 114.58 119.06 3kfc h GLU 455 Ca 0.16 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 59.22 3kfc h GLU 455 Cb 0.56 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 3kfc h GLU 455 CO 0.03 0.04 -2.12 -0.89 0.07 0.00 0.00 179.01 176.14 3kfc n ILE 456 N -3.45 1.62 -0.03 -1.06 5.41 -1.09 -4.80 119.36 115.95 3kfc n ILE 456 Ca -0.02 -0.49 0.01 0.00 1.00 0.00 0.00 62.75 63.25 3kfc n ILE 456 Cb 0.16 -1.70 -0.10 0.00 -0.71 0.00 0.00 39.64 37.29 3kfc n ILE 456 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 3kfc n TRP 457 N -3.67 0.00 1.74 1.39 8.01 -0.51 -4.97 117.44 119.44 3kfc n TRP 457 Ca -0.40 0.00 0.14 0.00 -1.31 0.00 0.00 57.50 55.93 3kfc n TRP 457 Cb 0.95 -0.41 0.83 0.00 -2.01 0.00 0.00 31.31 30.67 3kfc n TRP 457 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43