#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kf4 h PRO 230 N 0.00 0.42 -0.75 4.33 0.14 -2.11 -2.42 132.00 131.62 3kf4 h PRO 230 Ca 0.00 -0.36 -0.20 0.00 0.14 0.00 0.00 66.00 65.59 3kf4 h PRO 230 Cb 0.00 0.08 -0.12 0.00 0.14 0.00 0.00 31.00 31.10 3kf4 h PRO 230 CO 0.00 1.00 0.25 0.09 0.14 0.00 0.00 178.00 179.48 3kf4 n ASN 231 N -3.83 4.94 -4.75 1.44 3.02 -1.26 -5.00 115.26 109.83 3kf4 n ASN 231 Ca -0.05 -3.17 -0.41 0.00 -0.03 0.00 0.00 54.58 50.92 3kf4 n ASN 231 Cb 0.72 -0.74 -0.02 0.00 -0.61 0.00 0.00 39.78 39.13 3kf4 n ASN 231 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3kf4 s TYR 232 N -2.93 2.90 -0.07 3.10 5.04 -0.91 -5.01 117.35 119.46 3kf4 s TYR 232 Ca 0.55 0.97 -0.03 0.00 -2.44 0.00 0.00 57.07 56.11 3kf4 s TYR 232 Cb 0.43 -3.92 0.04 0.00 0.35 0.00 0.00 41.96 38.87 3kf4 s TYR 232 CO 0.14 -2.98 0.12 0.34 -1.34 0.00 0.00 175.55 171.83 3kf4 s ASP 233 N 0.34 0.94 0.56 4.32 3.68 -1.26 -5.05 116.67 120.19 3kf4 s ASP 233 Ca 0.60 0.21 0.31 0.00 2.13 0.00 0.00 52.55 55.80 3kf4 s ASP 233 Cb -0.44 0.09 1.66 0.00 -1.45 0.00 0.00 42.92 42.78 3kf4 s ASP 233 CO 0.47 -0.25 2.14 0.07 0.13 0.00 0.00 175.17 177.73 3kf4 h LYS 234 N 8.40 0.00 0.00 4.34 2.10 -2.02 -2.20 116.57 127.18 3kf4 h LYS 234 Ca -0.13 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.52 3kf4 h LYS 234 Cb 1.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 3kf4 h LYS 234 CO 0.15 0.07 -1.38 0.91 -2.00 0.00 0.00 179.45 177.19 3kf4 n TRP 235 N -3.53 0.57 -2.60 0.07 7.02 -1.26 -4.87 117.44 112.83 3kf4 n TRP 235 Ca -0.02 0.17 -0.43 0.00 -1.02 0.00 0.00 57.50 56.20 3kf4 n TRP 235 Cb 0.19 -0.76 -0.02 0.00 -2.42 0.00 0.00 31.31 28.30 3kf4 n TRP 235 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 3kf4 s GLU 236 N -3.42 4.23 0.38 -0.99 0.41 -0.83 -0.22 118.70 118.27 3kf4 s GLU 236 Ca -0.03 1.40 0.08 0.00 -0.41 0.00 0.00 54.97 56.01 3kf4 s GLU 236 Cb 0.11 -3.68 -0.03 0.00 -1.78 0.00 0.00 34.13 28.76 3kf4 s GLU 236 CO 0.84 -0.68 0.29 0.00 -0.49 0.00 0.00 175.26 175.22 3kf4 s MET 237 N 3.32 2.52 0.13 1.61 0.23 -0.04 -4.86 119.30 122.22 3kf4 s MET 237 Ca 0.47 -1.51 -0.27 0.00 -1.03 0.00 0.00 55.69 53.35 3kf4 s MET 237 Cb -0.16 -2.33 -0.07 0.00 -1.53 0.00 0.00 34.83 30.74 3kf4 s MET 237 CO 0.09 -0.06 0.83 -2.00 -2.03 0.00 0.00 175.02 171.85 3kf4 s GLU 238 N -4.02 4.61 0.40 3.16 2.56 -1.26 -4.68 118.70 119.47 3kf4 s GLU 238 Ca 0.44 1.23 0.12 0.00 0.00 0.00 0.00 54.97 56.75 3kf4 s GLU 238 Cb -0.03 -3.31 0.83 0.00 2.00 0.00 0.00 34.13 33.62 3kf4 s GLU 238 CO 0.26 0.43 1.91 -0.09 -0.56 0.00 0.00 175.26 177.21 3kf4 h ARG 239 N 4.88 0.11 -0.00 4.30 2.43 -1.96 -2.11 114.38 122.03 3kf4 h ARG 239 Ca -0.45 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 3kf4 h ARG 239 Cb 1.21 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.74 3kf4 h ARG 239 CO 0.69 0.32 -0.06 0.25 -1.51 0.00 0.00 179.97 179.66 3kf4 n THR 240 N -4.25 0.00 0.33 0.20 -2.24 -1.26 -2.84 114.28 104.23 3kf4 n THR 240 Ca -0.02 -0.01 0.14 0.00 -2.27 0.00 0.00 64.05 61.89 3kf4 n THR 240 Cb 0.30 -0.37 0.60 0.00 -2.10 0.00 0.00 70.33 68.75 3kf4 n THR 240 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3kf4 h ASP 241 N 0.08 0.00 -3.35 3.42 5.19 -1.78 -3.43 116.42 116.56 3kf4 h ASP 241 Ca 0.00 0.00 -0.65 0.00 -0.62 0.00 0.00 57.03 55.76 3kf4 h ASP 241 Cb 0.41 0.00 -0.27 0.00 0.18 0.00 0.00 39.33 39.65 3kf4 h ASP 241 CO 0.00 0.00 -0.73 -0.63 -3.12 0.00 0.00 179.24 174.76 3kf4 s ILE 242 N -3.48 3.30 -0.31 0.35 -1.09 -1.13 -3.12 121.20 115.72 3kf4 s ILE 242 Ca 0.02 -0.54 -0.25 0.00 -2.23 0.00 0.00 60.65 57.65 3kf4 s ILE 242 Cb 0.09 -2.46 0.01 0.00 -1.58 0.00 0.00 42.46 38.52 3kf4 s ILE 242 CO 0.40 0.47 0.88 -0.89 -1.23 0.00 0.00 174.94 174.56 3kf4 s THR 243 N 1.00 4.71 -0.02 2.92 2.01 -0.43 -4.94 115.64 120.89 3kf4 s THR 243 Ca -0.00 1.34 -0.21 0.00 0.31 0.00 0.00 61.69 63.13 3kf4 s THR 243 Cb -0.15 -4.23 -0.05 0.00 0.01 0.00 0.00 72.50 68.08 3kf4 s THR 243 CO -0.00 -0.33 0.61 -0.04 -0.69 0.00 0.00 174.62 174.17 3kf4 s MET 244 N 3.17 4.34 0.00 4.92 -1.94 -1.26 -0.97 119.30 127.56 3kf4 s MET 244 Ca 0.36 0.75 0.00 0.00 -1.71 0.00 0.00 55.69 55.09 3kf4 s MET 244 Cb -0.13 -3.36 0.00 0.00 2.01 0.00 0.00 34.83 33.34 3kf4 s MET 244 CO 0.13 0.31 0.00 1.63 -0.01 0.00 0.00 175.02 177.08 3kf4 n LYS 245 N 2.95 3.06 -2.02 2.03 5.02 0.51 -4.99 118.16 124.72 3kf4 n LYS 245 Ca -0.06 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.90 3kf4 n LYS 245 Cb 0.51 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.54 3kf4 n LYS 245 CO 0.00 0.00 0.00 -3.38 -0.52 0.00 0.00 177.40 173.50 3kf4 s HIS 246 N 4.03 2.81 0.23 2.13 -3.43 -1.26 -4.61 115.29 115.19 3kf4 s HIS 246 Ca 0.00 1.54 -0.30 0.00 -0.80 0.00 0.00 55.06 55.50 3kf4 s HIS 246 Cb 0.00 -3.11 -0.09 0.00 -1.43 0.00 0.00 32.58 27.94 3kf4 s HIS 246 CO 0.00 -1.37 1.35 0.21 -2.00 0.00 0.00 174.74 172.93 3kf4 s LYS 247 N -3.89 4.35 0.31 -0.38 2.20 -1.26 -0.48 119.74 120.59 3kf4 s LYS 247 Ca 0.67 2.15 -0.28 0.00 -0.36 0.00 0.00 55.97 58.14 3kf4 s LYS 247 Cb -0.19 -3.15 -0.09 0.00 -1.51 0.00 0.00 37.83 32.88 3kf4 s LYS 247 CO 0.36 -0.29 1.06 -0.51 -0.36 0.00 0.00 175.35 175.60 3kf4 s LEU 248 N -0.38 4.45 -1.29 5.43 1.43 0.21 -4.14 118.68 124.39 3kf4 s LEU 248 Ca 0.57 2.16 -0.02 0.00 -1.03 0.00 0.00 54.13 55.80 3kf4 s LEU 248 Cb -0.38 -3.78 0.00 0.00 0.03 0.00 0.00 46.19 42.06 3kf4 s LEU 248 CO 0.41 -0.19 0.30 0.61 0.23 0.00 0.00 176.35 177.71 3kf4 n GLY 249 N 1.00 -0.28 2.36 -3.19 0.00 -1.26 -2.44 105.19 101.38 3kf4 n GLY 249 Ca 0.00 -0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.74 3kf4 n GLY 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kf4 n GLY 250 N -1.23 0.54 0.35 -0.02 0.00 -1.26 -1.40 105.19 102.17 3kf4 n GLY 250 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3kf4 n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kf4 n GLY 251 N -0.62 0.48 0.27 -0.02 0.00 -1.02 -4.93 105.19 99.35 3kf4 n GLY 251 Ca -0.19 0.00 0.15 0.00 0.00 0.00 0.00 46.02 45.98 3kf4 n GLY 251 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 3kf4 h GLN 252 N 4.38 0.00 -0.69 1.61 3.07 -1.37 -2.38 115.11 119.73 3kf4 h GLN 252 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3kf4 h GLN 252 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 3kf4 h GLN 252 CO 0.00 0.09 0.00 0.66 0.09 0.00 0.00 178.83 179.67 3kf4 n TYR 253 N -3.42 0.93 -4.10 0.06 4.02 -1.26 -5.05 117.16 108.33 3kf4 n TYR 253 Ca -0.01 -0.46 0.00 0.00 -0.01 0.00 0.00 57.90 57.42 3kf4 n TYR 253 Cb 0.25 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.57 3kf4 n TYR 253 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kf4 n GLY 254 N 1.58 0.27 2.40 2.72 0.00 -0.90 -4.11 105.19 107.16 3kf4 n GLY 254 Ca 0.23 -0.95 -0.40 0.00 0.00 0.00 0.00 46.02 44.90 3kf4 n GLY 254 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3kf4 n GLU 255 N 7.68 4.18 -4.77 1.61 -0.58 -1.26 -4.76 120.64 122.74 3kf4 n GLU 255 Ca 0.00 -2.87 -0.33 0.00 -0.42 0.00 0.00 57.16 53.54 3kf4 n GLU 255 Cb 0.00 -2.71 -0.13 0.00 -0.57 0.00 0.00 31.44 28.02 3kf4 n GLU 255 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 3kf4 s VAL 256 N 0.41 3.18 0.12 2.62 1.01 -1.26 -0.76 120.40 125.72 3kf4 s VAL 256 Ca 0.62 -0.64 0.07 0.00 0.00 0.00 0.00 61.98 62.03 3kf4 s VAL 256 Cb 0.18 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 3kf4 s VAL 256 CO -0.08 0.55 -0.18 -0.31 0.00 0.00 0.00 175.10 175.08 3kf4 s TYR 257 N -0.10 1.65 0.35 5.22 1.51 0.67 -0.62 117.35 126.04 3kf4 s TYR 257 Ca -0.01 -0.47 -0.26 0.00 -1.01 0.00 0.00 57.07 55.32 3kf4 s TYR 257 Cb -0.14 -0.87 -0.09 0.00 -0.11 0.00 0.00 41.96 40.75 3kf4 s TYR 257 CO 0.03 0.22 1.06 -2.00 -1.11 0.00 0.00 175.55 173.75 3kf4 s GLU 258 N -2.37 4.35 0.11 -0.62 2.12 0.37 -0.80 118.70 121.86 3kf4 s GLU 258 Ca 0.09 1.60 -0.04 0.00 0.36 0.00 0.00 54.97 56.98 3kf4 s GLU 258 Cb -0.07 -2.78 -0.03 0.00 0.26 0.00 0.00 34.13 31.51 3kf4 s GLU 258 CO 0.05 0.01 0.10 0.20 -0.54 0.00 0.00 175.26 175.07 3kf4 s GLY 259 N -1.34 0.62 -0.13 -1.50 0.00 -0.04 -0.37 107.32 104.57 3kf4 s GLY 259 Ca 0.53 -1.16 0.02 0.00 0.00 0.00 0.00 44.72 44.11 3kf4 s GLY 259 CO 0.32 -1.16 -0.19 0.14 0.00 0.00 0.00 173.10 172.20 3kf4 s VAL 260 N -3.97 1.85 -1.04 1.40 1.01 -0.15 -0.19 120.40 119.31 3kf4 s VAL 260 Ca 0.16 -0.85 -0.18 0.00 0.00 0.00 0.00 61.98 61.11 3kf4 s VAL 260 Cb 0.06 -1.65 0.13 0.00 0.00 0.00 0.00 36.38 34.93 3kf4 s VAL 260 CO -0.03 0.51 1.27 0.86 0.00 0.00 0.00 175.10 177.71 3kf4 s TRP 261 N 0.88 3.17 0.31 5.22 -0.11 0.80 -1.31 118.94 127.89 3kf4 s TRP 261 Ca -0.07 -1.58 0.06 0.00 1.22 0.00 0.00 56.10 55.73 3kf4 s TRP 261 Cb -0.15 -4.35 0.72 0.00 -1.50 0.00 0.00 33.47 28.19 3kf4 s TRP 261 CO -0.02 -1.51 1.80 1.57 -4.62 0.00 0.00 176.95 174.17 3kf4 h LYS 262 N 8.35 0.78 -1.19 5.86 2.10 -1.82 0.28 116.57 130.92 3kf4 h LYS 262 Ca 0.22 -0.05 0.44 0.00 -2.00 0.00 0.00 60.65 59.26 3kf4 h LYS 262 Cb 0.97 -0.18 -0.16 0.00 -0.90 0.00 0.00 32.23 31.97 3kf4 h LYS 262 CO 1.19 0.51 0.72 -0.22 -2.00 0.00 0.00 179.45 179.65 3kf4 h LYS 263 N 0.80 0.03 0.00 0.07 3.11 -1.89 -1.46 116.57 117.23 3kf4 h LYS 263 Ca 0.54 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.38 3kf4 h LYS 263 Cb 0.80 -0.01 0.00 0.00 -1.00 0.00 0.00 32.23 32.02 3kf4 h LYS 263 CO -0.33 0.02 0.00 0.66 -2.81 0.00 0.00 179.45 176.99 3kf4 n TYR 264 N -4.97 0.00 -3.51 1.91 4.02 0.87 -5.00 117.16 110.48 3kf4 n TYR 264 Ca 0.39 -0.03 -0.19 0.00 -0.01 0.00 0.00 57.90 58.05 3kf4 n TYR 264 Cb 1.40 -0.00 0.06 0.00 -0.02 0.00 0.00 39.34 40.78 3kf4 n TYR 264 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3kf4 n SER 265 N -0.03 -2.68 -3.98 7.72 7.64 -0.55 -4.97 113.62 116.76 3kf4 n SER 265 Ca 0.00 -0.73 -0.29 0.00 1.01 0.00 0.00 58.87 58.86 3kf4 n SER 265 Cb 0.03 -4.64 -0.17 0.00 -1.01 0.00 0.00 64.21 58.42 3kf4 n SER 265 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3kf4 s LEU 266 N -6.32 1.52 0.21 -3.43 2.96 -1.17 -4.98 118.68 107.47 3kf4 s LEU 266 Ca 0.11 -0.43 -0.30 0.00 -0.22 0.00 0.00 54.13 53.29 3kf4 s LEU 266 Cb -0.02 -1.07 -0.09 0.00 0.50 0.00 0.00 46.19 45.52 3kf4 s LEU 266 CO 0.77 -0.08 1.23 -0.89 -1.32 0.00 0.00 176.35 176.06 3kf4 s THR 267 N 1.56 3.38 0.29 3.68 2.01 -1.26 -0.14 115.64 125.15 3kf4 s THR 267 Ca 0.05 1.19 0.02 0.00 0.31 0.00 0.00 61.69 63.26 3kf4 s THR 267 Cb -0.13 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.58 3kf4 s THR 267 CO -0.10 0.20 0.13 0.68 -0.69 0.00 0.00 174.62 174.84 3kf4 s VAL 268 N -0.22 0.49 0.08 3.82 -7.23 0.74 -4.13 120.40 113.96 3kf4 s VAL 268 Ca 0.53 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.76 3kf4 s VAL 268 Cb -0.34 -2.57 -0.04 0.00 0.56 0.00 0.00 36.38 33.99 3kf4 s VAL 268 CO 0.39 0.00 -0.09 0.00 -0.31 0.00 0.00 175.10 175.09 3kf4 s ALA 269 N -3.62 2.97 -0.07 1.32 0.00 -0.23 -0.86 121.76 121.26 3kf4 s ALA 269 Ca 0.36 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 51.10 3kf4 s ALA 269 Cb 0.06 -0.94 0.03 0.00 0.00 0.00 0.00 23.12 22.27 3kf4 s ALA 269 CO 0.16 0.64 0.04 0.08 0.00 0.00 0.00 175.76 176.67 3kf4 s VAL 270 N -1.17 0.12 -0.11 0.00 1.01 0.02 -1.16 120.40 119.11 3kf4 s VAL 270 Ca 0.21 0.21 -0.11 0.00 0.00 0.00 0.00 61.98 62.28 3kf4 s VAL 270 Cb -0.11 -0.38 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 3kf4 s VAL 270 CO 0.13 0.16 0.26 -0.75 0.00 0.00 0.00 175.10 174.90 3kf4 s LYS 271 N 2.07 3.89 0.42 2.72 2.20 0.39 -0.24 119.74 131.20 3kf4 s LYS 271 Ca 0.04 0.08 0.03 0.00 -0.36 0.00 0.00 55.97 55.77 3kf4 s LYS 271 Cb -0.13 -3.29 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 3kf4 s LYS 271 CO -0.05 0.54 0.09 0.95 -0.36 0.00 0.00 175.35 176.53 3kf4 s THR 272 N -0.44 0.83 0.00 3.43 -4.23 0.06 -0.95 115.64 114.33 3kf4 s THR 272 Ca 0.17 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 3kf4 s THR 272 Cb -0.13 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.33 3kf4 s THR 272 CO 0.06 0.00 0.00 0.00 -0.54 0.00 0.00 174.62 174.14 3kf4 n LEU 273 N -0.96 0.00 0.00 4.79 -0.00 -1.23 -4.69 117.00 114.91 3kf4 n LEU 273 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.93 3kf4 n LEU 273 Cb 0.66 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.08 3kf4 n LEU 273 CO 0.37 0.00 0.00 1.07 -0.00 0.00 0.00 177.39 178.83 3kf4 n THR 277 N 0.00 0.00 -0.13 1.47 5.66 -1.26 -4.50 114.28 115.52 3kf4 n THR 277 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 3kf4 n THR 277 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 3kf4 n THR 277 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 175.07 172.25 3kf4 n MET 278 N 0.00 0.00 -0.03 1.09 2.81 -1.26 -4.68 117.12 115.05 3kf4 n MET 278 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.89 3kf4 n MET 278 Cb 0.00 -2.95 0.01 0.00 -0.71 0.00 0.00 33.22 29.57 3kf4 n MET 278 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 3kf4 n GLU 279 N -1.23 1.25 0.28 0.03 2.13 -1.26 -4.90 120.64 116.94 3kf4 n GLU 279 Ca 0.00 -1.01 -0.12 0.00 0.66 0.00 0.00 57.16 56.69 3kf4 n GLU 279 Cb 0.00 -0.74 -0.06 0.00 0.27 0.00 0.00 31.44 30.91 3kf4 n GLU 279 CO 0.00 0.00 0.00 -0.39 -0.41 0.00 0.00 177.13 176.33 3kf4 h VAL 280 N 1.89 0.03 -0.40 6.31 -1.51 -2.01 -3.07 116.25 117.49 3kf4 h VAL 280 Ca 0.00 -0.45 -0.70 0.00 -1.23 0.00 0.00 66.70 64.32 3kf4 h VAL 280 Cb 0.82 0.04 -0.06 0.00 -2.13 0.00 0.00 31.29 29.96 3kf4 h VAL 280 CO 0.00 0.01 2.72 -0.62 -1.23 0.00 0.00 177.57 178.45 3kf4 n GLU 281 N -5.28 3.01 0.00 5.19 4.71 -1.26 -0.97 120.64 126.04 3kf4 n GLU 281 Ca -0.10 -2.91 0.00 0.00 -0.01 0.00 0.00 57.16 54.15 3kf4 n GLU 281 Cb 0.30 -3.36 0.00 0.00 -1.01 0.00 0.00 31.44 27.37 3kf4 n GLU 281 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 3kf4 n GLU 282 N 6.93 0.00 -0.23 3.49 2.13 -1.26 -4.66 120.64 127.04 3kf4 n GLU 282 Ca 0.50 0.00 0.03 0.00 0.66 0.00 0.00 57.16 58.35 3kf4 n GLU 282 Cb 0.42 0.00 0.12 0.00 0.27 0.00 0.00 31.44 32.25 3kf4 n GLU 282 CO 0.00 0.00 0.00 0.35 -0.41 0.00 0.00 177.13 177.07 3kf4 h PHE 283 N 0.00 -0.09 -0.52 4.31 3.57 -0.95 -1.45 116.94 121.81 3kf4 h PHE 283 Ca 0.00 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 3kf4 h PHE 283 Cb 0.00 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 3kf4 h PHE 283 CO 0.00 -0.22 0.19 -0.07 -2.23 0.00 0.00 178.31 175.98 3kf4 h LEU 284 N 0.09 0.69 -0.63 0.59 3.38 -1.36 -2.05 115.31 116.02 3kf4 h LEU 284 Ca 0.37 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 58.14 3kf4 h LEU 284 Cb 0.62 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 3kf4 h LEU 284 CO -0.62 0.64 -0.10 0.50 0.09 0.00 0.00 178.44 178.95 3kf4 h LYS 285 N 0.75 0.97 -0.15 1.13 3.64 -1.71 -1.16 116.57 120.04 3kf4 h LYS 285 Ca 0.18 -0.34 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 3kf4 h LYS 285 Cb 0.18 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 3kf4 h LYS 285 CO -0.01 1.01 0.03 1.49 -2.27 0.00 0.00 179.45 179.70 3kf4 h GLU 286 N 0.87 0.24 -0.87 1.90 4.81 -0.80 -1.88 114.58 118.85 3kf4 h GLU 286 Ca 0.14 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.35 3kf4 h GLU 286 Cb 0.65 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.94 3kf4 h GLU 286 CO 0.04 0.40 0.57 0.00 -0.73 0.00 0.00 179.01 179.30 3kf4 h ALA 287 N 0.83 1.47 -0.40 2.92 0.00 -1.26 -1.42 119.26 121.41 3kf4 h ALA 287 Ca 0.05 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 3kf4 h ALA 287 Cb 0.27 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3kf4 h ALA 287 CO 0.00 0.43 0.08 0.00 0.00 0.00 0.00 179.25 179.76 3kf4 h ALA 288 N 1.50 0.53 -0.68 0.00 0.00 -0.96 -1.99 119.26 117.65 3kf4 h ALA 288 Ca 0.35 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3kf4 h ALA 288 Cb 0.07 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3kf4 h ALA 288 CO -0.11 0.22 0.30 0.28 0.00 0.00 0.00 179.25 179.94 3kf4 h VAL 289 N 0.51 1.24 0.00 0.00 2.07 -0.61 -2.52 116.25 116.93 3kf4 h VAL 289 Ca 0.12 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 66.91 3kf4 h VAL 289 Cb 0.34 0.43 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 3kf4 h VAL 289 CO 0.00 0.29 -0.16 0.24 0.02 0.00 0.00 177.57 177.96 3kf4 h MET 290 N 0.96 0.00 0.00 1.57 2.07 -1.06 -0.33 114.93 118.15 3kf4 h MET 290 Ca 0.23 0.00 -0.01 0.00 -2.07 0.00 0.00 59.70 57.85 3kf4 h MET 290 Cb 0.17 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 29.89 3kf4 h MET 290 CO -0.02 0.16 -0.06 0.87 1.07 0.00 0.00 176.91 178.93 3kf4 h LYS 291 N 0.00 0.00 0.00 1.72 1.57 -0.90 -3.23 116.57 115.72 3kf4 h LYS 291 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kf4 h LYS 291 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 3kf4 h LYS 291 CO 0.02 0.06 -1.32 0.39 -0.57 0.00 0.00 179.45 178.03 3kf4 n GLU 292 N -3.34 0.36 -4.69 3.15 -0.58 -0.14 -4.96 120.64 110.44 3kf4 n GLU 292 Ca -0.01 -0.07 -0.30 0.00 -0.42 0.00 0.00 57.16 56.36 3kf4 n GLU 292 Cb 0.21 -1.48 -0.14 0.00 -0.57 0.00 0.00 31.44 29.47 3kf4 n GLU 292 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 3kf4 s ILE 293 N -3.13 2.40 -0.26 -3.67 -4.36 -1.14 -5.11 121.20 105.93 3kf4 s ILE 293 Ca 0.02 -1.42 -0.09 0.00 -0.26 0.00 0.00 60.65 58.90 3kf4 s ILE 293 Cb 0.15 -2.00 0.11 0.00 1.25 0.00 0.00 42.46 41.97 3kf4 s ILE 293 CO 0.86 0.28 0.56 -0.75 0.24 0.00 0.00 174.94 176.13 3kf4 s LYS 294 N -1.53 0.49 -0.16 0.37 2.20 -1.26 -4.85 119.74 114.99 3kf4 s LYS 294 Ca 0.13 1.28 -0.29 0.00 -0.36 0.00 0.00 55.97 56.74 3kf4 s LYS 294 Cb -0.10 0.63 0.10 0.00 -1.51 0.00 0.00 37.83 36.95 3kf4 s LYS 294 CO 0.04 -0.22 0.87 -1.58 -0.36 0.00 0.00 175.35 174.11 3kf4 s HIS 295 N 2.71 -0.53 0.62 4.03 2.46 -1.26 -5.03 115.29 118.28 3kf4 s HIS 295 Ca -0.05 1.03 0.33 0.00 0.47 0.00 0.00 55.06 56.84 3kf4 s HIS 295 Cb -0.12 0.40 1.88 0.00 -0.13 0.00 0.00 32.58 34.61 3kf4 s HIS 295 CO -0.17 -0.41 2.18 -1.00 -2.47 0.00 0.00 174.74 172.87 3kf4 h PRO 296 N 3.26 0.00 -0.47 2.88 0.13 -2.00 -2.14 132.00 133.66 3kf4 h PRO 296 Ca -0.24 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.60 3kf4 h PRO 296 Cb 1.16 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.10 3kf4 h PRO 296 CO 0.27 0.00 -0.20 0.09 -0.23 0.00 0.00 178.00 177.94 3kf4 n ASN 297 N -3.55 3.41 -4.12 1.44 4.13 -1.26 -4.89 115.26 110.42 3kf4 n ASN 297 Ca -0.01 -3.80 -0.27 0.00 1.68 0.00 0.00 54.58 52.18 3kf4 n ASN 297 Cb 0.21 -0.60 -0.17 0.00 -1.54 0.00 0.00 39.78 37.69 3kf4 n ASN 297 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3kf4 s LEU 298 N -3.39 1.86 0.22 3.41 1.43 -0.81 -1.15 118.68 120.24 3kf4 s LEU 298 Ca 0.47 -0.39 -0.32 0.00 -1.03 0.00 0.00 54.13 52.86 3kf4 s LEU 298 Cb 0.41 -1.05 -0.12 0.00 0.03 0.00 0.00 46.19 45.47 3kf4 s LEU 298 CO -0.00 0.11 1.70 1.33 0.23 0.00 0.00 176.35 179.72 3kf4 n VAL 299 N 3.53 0.12 -3.01 -1.59 0.24 -0.79 -4.57 118.33 112.25 3kf4 n VAL 299 Ca -0.20 -0.03 -0.41 0.00 -2.04 0.00 0.00 64.34 61.66 3kf4 n VAL 299 Cb 0.52 -1.95 -0.05 0.00 -1.47 0.00 0.00 33.84 30.89 3kf4 n VAL 299 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3kf4 s GLN 300 N 0.95 4.26 0.18 7.34 2.00 -1.26 -4.97 119.66 128.16 3kf4 s GLN 300 Ca 0.74 0.80 -0.32 0.00 -2.00 0.00 0.00 55.36 54.58 3kf4 s GLN 300 Cb -0.52 -3.57 -0.11 0.00 0.80 0.00 0.00 33.01 29.62 3kf4 s GLN 300 CO 0.35 -0.27 1.63 -1.17 -0.50 0.00 0.00 175.29 175.33 3kf4 s LEU 301 N 1.98 4.37 -0.17 3.68 2.96 -1.26 -1.88 118.68 128.36 3kf4 s LEU 301 Ca 0.33 2.71 0.05 0.00 -0.22 0.00 0.00 54.13 57.00 3kf4 s LEU 301 Cb -0.16 -3.59 -0.14 0.00 0.50 0.00 0.00 46.19 42.79 3kf4 s LEU 301 CO 0.11 -0.88 -0.10 0.18 -1.32 0.00 0.00 176.35 174.34 3kf4 n LEU 302 N 4.04 2.08 -3.66 -0.68 4.32 0.15 -4.90 117.00 118.36 3kf4 n LEU 302 Ca 0.15 -0.07 -0.01 0.00 -0.02 0.00 0.00 56.01 56.06 3kf4 n LEU 302 Cb 0.37 -0.35 -0.01 0.00 -1.62 0.00 0.00 43.42 41.82 3kf4 n LEU 302 CO 0.62 0.68 0.93 -0.83 -1.22 0.00 0.00 177.39 177.57 3kf4 s GLY 303 N -5.49 -0.35 0.15 -0.72 0.00 -0.81 -4.99 107.32 95.12 3kf4 s GLY 303 Ca -0.20 0.54 0.05 0.00 0.00 0.00 0.00 44.72 45.11 3kf4 s GLY 303 CO 0.48 0.10 -0.11 -1.34 0.00 0.00 0.00 173.10 172.23 3kf4 s VAL 304 N -2.74 1.25 -0.39 1.40 -7.23 0.69 -0.16 120.40 113.21 3kf4 s VAL 304 Ca 0.13 -2.05 0.03 0.00 -1.81 0.00 0.00 61.98 58.28 3kf4 s VAL 304 Cb 0.02 -1.84 0.11 0.00 0.56 0.00 0.00 36.38 35.24 3kf4 s VAL 304 CO -0.02 -0.70 0.15 0.00 -0.31 0.00 0.00 175.10 174.22 3kf4 n THR 306 N 3.97 1.54 0.04 0.00 -2.24 -1.26 -1.01 114.28 115.32 3kf4 n THR 306 Ca 0.04 -2.17 -0.01 0.00 -2.27 0.00 0.00 64.05 59.63 3kf4 n THR 306 Cb 0.38 -0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.54 3kf4 n THR 306 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3kf4 h ARG 307 N 0.47 0.00 -2.92 -0.78 3.08 -1.94 -3.48 114.38 108.82 3kf4 h ARG 307 Ca -0.03 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.94 3kf4 h ARG 307 Cb 1.16 0.00 -0.17 0.00 0.08 0.00 0.00 29.97 31.03 3kf4 h ARG 307 CO 0.01 0.38 -0.09 -1.21 -1.07 0.00 0.00 179.97 177.99 3kf4 s GLU 308 N -2.88 0.90 0.62 0.04 8.01 -1.26 -5.16 118.70 118.98 3kf4 s GLU 308 Ca -0.02 -0.27 -0.18 0.00 0.01 0.00 0.00 54.97 54.51 3kf4 s GLU 308 Cb 0.08 0.41 -0.02 0.00 -4.31 0.00 0.00 34.13 30.29 3kf4 s GLU 308 CO 0.80 -0.30 1.24 -2.14 0.01 0.00 0.00 175.26 174.87 3kf4 s PRO 309 N -2.18 2.76 0.42 0.39 0.02 -1.26 -3.91 135.00 131.24 3kf4 s PRO 309 Ca -0.07 1.90 -0.22 0.00 0.02 0.00 0.00 61.00 62.63 3kf4 s PRO 309 Cb -0.01 -1.89 -0.10 0.00 0.02 0.00 0.00 34.50 32.51 3kf4 s PRO 309 CO -0.00 -1.39 0.96 -1.25 -0.33 0.00 0.00 177.00 174.99 3kf4 s PRO 310 N -3.40 4.22 0.42 5.54 0.05 -1.26 -5.13 135.00 135.44 3kf4 s PRO 310 Ca 0.79 1.19 -0.22 0.00 0.05 0.00 0.00 61.00 62.81 3kf4 s PRO 310 Cb -0.33 -2.27 -0.10 0.00 0.05 0.00 0.00 34.50 31.86 3kf4 s PRO 310 CO 0.36 -0.04 0.99 -0.06 0.05 0.00 0.00 177.00 178.30 3kf4 s PHE 311 N -2.06 3.28 -0.03 0.56 2.99 -1.25 -4.90 117.98 116.57 3kf4 s PHE 311 Ca 0.61 1.64 0.07 0.00 0.00 0.00 0.00 56.93 59.25 3kf4 s PHE 311 Cb -0.12 -2.98 -0.02 0.00 0.00 0.00 0.00 43.02 39.91 3kf4 s PHE 311 CO 0.16 -0.35 -0.24 0.71 -0.00 0.00 0.00 175.22 175.49 3kf4 s TYR 312 N -1.93 2.40 -0.16 0.36 4.12 -0.18 -3.57 117.35 118.38 3kf4 s TYR 312 Ca 0.61 -0.48 -0.02 0.00 0.02 0.00 0.00 57.07 57.20 3kf4 s TYR 312 Cb -0.15 -1.54 -0.01 0.00 -1.52 0.00 0.00 41.96 38.73 3kf4 s TYR 312 CO 0.20 -0.06 -0.09 0.42 0.02 0.00 0.00 175.55 176.03 3kf4 s ILE 313 N -0.51 3.26 -0.17 2.71 1.01 -0.13 -0.16 121.20 127.22 3kf4 s ILE 313 Ca 0.07 -0.57 -0.02 0.00 0.00 0.00 0.00 60.65 60.13 3kf4 s ILE 313 Cb -0.11 -2.41 -0.01 0.00 0.01 0.00 0.00 42.46 39.93 3kf4 s ILE 313 CO 0.00 0.49 -0.10 -0.63 0.00 0.00 0.00 174.94 174.71 3kf4 s ILE 314 N 0.69 3.18 0.25 2.92 1.09 0.78 -0.46 121.20 129.65 3kf4 s ILE 314 Ca -0.05 -0.59 0.04 0.00 -1.10 0.00 0.00 60.65 58.95 3kf4 s ILE 314 Cb -0.15 -2.38 -0.05 0.00 -1.06 0.00 0.00 42.46 38.81 3kf4 s ILE 314 CO 0.02 0.49 -0.00 0.42 -0.10 0.00 0.00 174.94 175.76 3kf4 s THR 315 N 0.81 1.14 0.63 2.92 -4.23 -0.31 0.35 115.64 116.96 3kf4 s THR 315 Ca -0.03 -2.04 -0.17 0.00 -1.18 0.00 0.00 61.69 58.26 3kf4 s THR 315 Cb -0.15 -2.42 -0.07 0.00 1.34 0.00 0.00 72.50 71.21 3kf4 s THR 315 CO 0.01 -0.28 0.50 -1.84 -0.54 0.00 0.00 174.62 172.47 3kf4 n GLU 316 N -0.48 0.42 -3.49 3.99 0.28 -0.79 -1.07 120.64 119.51 3kf4 n GLU 316 Ca -0.05 0.18 -0.37 0.00 -0.16 0.00 0.00 57.16 56.76 3kf4 n GLU 316 Cb 0.64 -1.74 -0.06 0.00 1.43 0.00 0.00 31.44 31.71 3kf4 n GLU 316 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 177.13 177.09 3kf4 s PHE 317 N -1.79 3.54 -0.25 -1.84 5.36 -1.26 -4.16 117.98 117.57 3kf4 s PHE 317 Ca 0.67 0.75 -0.07 0.00 -0.96 0.00 0.00 56.93 57.32 3kf4 s PHE 317 Cb -0.40 -2.36 -0.02 0.00 -0.34 0.00 0.00 43.02 39.89 3kf4 s PHE 317 CO 0.56 0.34 0.06 -1.64 -1.46 0.00 0.00 175.22 173.07 3kf4 s MET 318 N 0.09 3.55 0.41 10.12 -1.94 -1.26 -4.99 119.30 125.28 3kf4 s MET 318 Ca 0.20 -0.54 0.08 0.00 -1.71 0.00 0.00 55.69 53.72 3kf4 s MET 318 Cb -0.14 -3.29 0.87 0.00 2.01 0.00 0.00 34.83 34.27 3kf4 s MET 318 CO 0.07 -0.22 2.04 1.15 -0.01 0.00 0.00 175.02 178.05 3kf4 h THR 319 N 5.60 1.11 -0.15 2.05 2.02 -1.86 -3.11 112.91 118.57 3kf4 h THR 319 Ca -0.38 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 66.53 3kf4 h THR 319 Cb 1.17 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 3kf4 h THR 319 CO 0.59 0.12 0.00 -1.22 0.37 0.00 0.00 175.52 175.37 3kf4 n TYR 320 N -4.45 0.19 -4.19 3.16 4.02 -0.17 -5.03 117.16 110.70 3kf4 n TYR 320 Ca 0.02 -0.21 0.00 0.00 -0.01 0.00 0.00 57.90 57.70 3kf4 n TYR 320 Cb 0.09 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.40 3kf4 n TYR 320 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3kf4 n GLY 321 N 0.59 -0.96 3.79 2.72 0.00 -1.18 -4.78 105.19 105.37 3kf4 n GLY 321 Ca 0.09 -1.20 -0.36 0.00 0.00 0.00 0.00 46.02 44.55 3kf4 n GLY 321 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kf4 s ASN 322 N -4.00 6.57 0.27 1.61 2.20 -1.26 -0.99 114.94 119.33 3kf4 s ASN 322 Ca 0.00 2.02 -0.03 0.00 -0.94 0.00 0.00 52.86 53.91 3kf4 s ASN 322 Cb 0.00 -2.58 0.35 0.00 -2.00 0.00 0.00 41.25 37.02 3kf4 s ASN 322 CO 0.00 -0.63 1.87 0.25 -2.94 0.00 0.00 177.10 175.66 3kf4 h LEU 323 N 2.14 0.95 0.29 3.54 5.85 -0.56 -2.42 115.31 125.10 3kf4 h LEU 323 Ca -0.49 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.13 3kf4 h LEU 323 Cb 1.22 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.98 3kf4 h LEU 323 CO 0.61 0.80 -0.33 0.25 -0.34 0.00 0.00 178.44 179.43 3kf4 h LEU 324 N 1.04 -0.89 -1.26 2.25 5.85 -1.77 -0.28 115.31 120.26 3kf4 h LEU 324 Ca 0.26 0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.98 3kf4 h LEU 324 Cb 0.10 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 3kf4 h LEU 324 CO -0.03 -0.45 -0.35 0.44 -0.34 0.00 0.00 178.44 177.71 3kf4 h ASP 325 N -0.66 0.04 -0.17 1.25 3.32 -1.90 -1.56 116.42 116.75 3kf4 h ASP 325 Ca -0.01 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 57.05 3kf4 h ASP 325 Cb 0.61 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.13 3kf4 h ASP 325 CO -0.08 0.39 0.03 0.22 -1.72 0.00 0.00 179.24 178.07 3kf4 h TYR 326 N 0.04 0.05 -0.64 4.55 3.20 -0.96 -2.02 116.97 121.18 3kf4 h TYR 326 Ca 0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 3kf4 h TYR 326 Cb 0.63 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.88 3kf4 h TYR 326 CO 0.00 0.01 0.13 -0.07 -1.64 0.00 0.00 178.16 176.60 3kf4 h LEU 327 N 0.10 0.98 -1.32 2.82 3.38 -0.61 -2.34 115.31 118.32 3kf4 h LEU 327 Ca 0.08 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 3kf4 h LEU 327 Cb 0.08 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3kf4 h LEU 327 CO -0.11 0.95 -0.24 0.03 0.09 0.00 0.00 178.44 179.17 3kf4 h ARG 328 N 0.98 0.00 -0.10 1.13 3.08 -1.04 -3.18 114.38 115.25 3kf4 h ARG 328 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3kf4 h ARG 328 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 3kf4 h ARG 328 CO 0.01 0.24 0.00 0.39 -1.07 0.00 0.00 179.97 179.53 3kf4 n GLU 329 N -3.53 1.21 -2.59 0.04 1.02 -0.78 -5.04 120.64 110.96 3kf4 n GLU 329 Ca -0.01 -1.32 -0.31 0.00 -0.02 0.00 0.00 57.16 55.50 3kf4 n GLU 329 Cb 0.39 -1.16 -0.03 0.00 -0.02 0.00 0.00 31.44 30.63 3kf4 n GLU 329 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kf4 s ASN 331 N -3.26 6.89 0.00 0.00 3.84 -1.26 -4.93 114.94 116.22 3kf4 s ASN 331 Ca 0.54 1.38 0.28 0.00 0.21 0.00 0.00 52.86 55.26 3kf4 s ASN 331 Cb -0.10 -2.54 0.99 0.00 -0.55 0.00 0.00 41.25 39.04 3kf4 s ASN 331 CO 0.34 -0.86 1.74 0.54 -2.79 0.00 0.00 177.10 176.07 3kf4 n ARG 332 N 6.81 0.11 -0.06 0.43 1.74 -1.26 -0.27 116.66 124.15 3kf4 n ARG 332 Ca 0.13 -0.04 -0.15 0.00 -0.77 0.00 0.00 57.85 57.03 3kf4 n ARG 332 Cb 0.46 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.34 3kf4 n ARG 332 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3kf4 h GLN 333 N 0.09 0.68 0.39 5.56 4.20 -1.98 -3.11 115.11 120.94 3kf4 h GLN 333 Ca 0.00 -0.44 -0.02 0.00 0.06 0.00 0.00 58.65 58.25 3kf4 h GLN 333 Cb 0.47 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.31 3kf4 h GLN 333 CO 0.00 1.06 -0.19 1.49 -0.67 0.00 0.00 178.83 180.52 3kf4 h GLU 334 N 0.38 -0.51 -4.80 1.46 4.81 -1.86 -3.36 114.58 110.71 3kf4 h GLU 334 Ca 0.01 0.03 -0.72 0.00 -0.13 0.00 0.00 59.36 58.55 3kf4 h GLU 334 Cb 1.04 0.12 -0.13 0.00 0.63 0.00 0.00 28.75 30.41 3kf4 h GLU 334 CO 0.10 -0.22 1.89 0.28 -0.73 0.00 0.00 179.01 180.33 3kf4 n VAL 335 N -5.15 4.10 -2.71 0.32 0.31 0.62 -4.88 118.33 110.95 3kf4 n VAL 335 Ca -0.09 -4.33 -0.12 0.00 -0.01 0.00 0.00 64.34 59.79 3kf4 n VAL 335 Cb 0.27 -2.43 0.05 0.00 -0.91 0.00 0.00 33.84 30.83 3kf4 n VAL 335 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 3kf4 n SER 336 N 6.19 0.96 -0.29 4.52 3.41 -1.17 -4.55 113.62 122.69 3kf4 n SER 336 Ca 0.42 -1.75 0.11 0.00 -0.26 0.00 0.00 58.87 57.40 3kf4 n SER 336 Cb 0.42 -0.31 0.27 0.00 -0.26 0.00 0.00 64.21 64.33 3kf4 n SER 336 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3kf4 h ALA 337 N -0.17 1.26 -0.00 7.33 0.00 -1.93 -0.86 119.26 124.89 3kf4 h ALA 337 Ca -0.17 0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 3kf4 h ALA 337 Cb 0.70 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 3kf4 h ALA 337 CO 0.21 -0.36 -0.78 -0.24 0.00 0.00 0.00 179.25 178.07 3kf4 h VAL 338 N 0.33 1.53 -0.46 0.00 3.04 -1.93 -2.67 116.25 116.08 3kf4 h VAL 338 Ca 0.52 -2.58 -0.11 0.00 -1.01 0.00 0.00 66.70 63.51 3kf4 h VAL 338 Cb 0.96 2.40 -0.02 0.00 -2.01 0.00 0.00 31.29 32.63 3kf4 h VAL 338 CO -0.55 0.74 -0.17 0.58 -1.01 0.00 0.00 177.57 177.17 3kf4 h VAL 339 N 0.04 1.27 -0.88 1.51 2.07 -1.55 -1.40 116.25 117.31 3kf4 h VAL 339 Ca -0.02 -1.30 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 3kf4 h VAL 339 Cb 1.38 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 32.20 3kf4 h VAL 339 CO 0.11 0.45 0.45 -0.07 0.02 0.00 0.00 177.57 178.52 3kf4 h LEU 340 N 0.78 1.13 -0.60 2.57 3.38 -0.99 -0.47 115.31 121.12 3kf4 h LEU 340 Ca 0.12 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3kf4 h LEU 340 Cb 0.71 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 3kf4 h LEU 340 CO 0.05 0.93 0.32 -0.07 0.09 0.00 0.00 178.44 179.76 3kf4 h LEU 341 N 1.24 0.76 -0.64 1.67 3.38 -1.20 -1.92 115.31 118.61 3kf4 h LEU 341 Ca 0.31 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.18 3kf4 h LEU 341 Cb 0.08 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3kf4 h LEU 341 CO -0.04 0.64 0.42 0.22 0.09 0.00 0.00 178.44 179.77 3kf4 h TYR 342 N 0.81 0.79 -0.37 1.13 3.20 -0.32 -0.04 116.97 122.18 3kf4 h TYR 342 Ca 0.21 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 3kf4 h TYR 342 Cb 0.06 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.05 3kf4 h TYR 342 CO -0.01 0.49 0.18 0.52 -1.64 0.00 0.00 178.16 177.71 3kf4 h MET 343 N 0.85 0.53 -0.22 1.82 2.86 -0.89 -0.95 114.93 118.93 3kf4 h MET 343 Ca 0.24 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.75 3kf4 h MET 343 Cb -0.08 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 3kf4 h MET 343 CO -0.06 0.46 -0.11 0.00 1.06 0.00 0.00 176.91 178.26 3kf4 h ALA 344 N 1.04 1.40 -0.07 6.32 0.00 -1.10 -1.27 119.26 125.58 3kf4 h ALA 344 Ca 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3kf4 h ALA 344 Cb 0.10 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 3kf4 h ALA 344 CO -0.02 0.41 0.00 1.15 0.00 0.00 0.00 179.25 180.80 3kf4 h THR 345 N 0.34 1.24 -0.63 0.00 2.02 -0.69 -1.46 112.91 113.73 3kf4 h THR 345 Ca 0.07 -0.73 0.04 0.00 0.77 0.00 0.00 66.41 66.56 3kf4 h THR 345 Cb 0.41 1.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.37 3kf4 h THR 345 CO 0.02 0.20 0.37 1.56 0.37 0.00 0.00 175.52 178.05 3kf4 h GLN 346 N -0.15 0.70 -0.08 6.66 4.20 -0.81 0.48 115.11 126.11 3kf4 h GLN 346 Ca 0.02 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 3kf4 h GLN 346 Cb 0.31 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.94 3kf4 h GLN 346 CO 0.00 0.46 -0.04 0.82 -0.67 0.00 0.00 178.83 179.40 3kf4 h ILE 347 N 0.72 1.33 0.00 2.54 2.04 -1.22 -1.94 117.51 120.97 3kf4 h ILE 347 Ca 0.26 -1.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.04 3kf4 h ILE 347 Cb 0.08 1.87 -0.00 0.00 -0.74 0.00 0.00 36.82 38.03 3kf4 h ILE 347 CO -0.13 0.30 -0.09 0.77 0.00 0.00 0.00 178.15 179.00 3kf4 h SER 348 N -0.21 0.00 -0.26 1.72 4.64 -1.12 -0.74 113.55 117.58 3kf4 h SER 348 Ca 0.02 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.30 3kf4 h SER 348 Cb 0.49 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.57 3kf4 h SER 348 CO 0.01 0.09 0.02 -1.28 -0.87 0.00 0.00 176.83 174.80 3kf4 h SER 349 N 0.00 0.43 -0.70 4.97 0.87 -0.43 0.82 113.55 119.51 3kf4 h SER 349 Ca -0.00 -0.29 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 3kf4 h SER 349 Cb 0.25 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.06 3kf4 h SER 349 CO 0.01 0.61 0.45 0.00 -0.53 0.00 0.00 176.83 177.37 3kf4 h ALA 350 N 0.83 0.89 0.00 6.23 0.00 -0.54 -2.39 119.26 124.29 3kf4 h ALA 350 Ca 0.08 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 3kf4 h ALA 350 Cb 0.38 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3kf4 h ALA 350 CO 0.01 0.34 -0.63 0.52 0.00 0.00 0.00 179.25 179.50 3kf4 h MET 351 N 0.96 0.00 -0.76 0.00 2.86 -1.06 -1.49 114.93 115.44 3kf4 h MET 351 Ca 0.25 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.91 3kf4 h MET 351 Cb -0.07 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 3kf4 h MET 351 CO -0.05 0.63 0.50 1.49 1.06 0.00 0.00 176.91 180.53 3kf4 h GLU 352 N 0.00 0.98 -0.03 1.72 4.81 -0.65 -0.68 114.58 120.74 3kf4 h GLU 352 Ca -0.01 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3kf4 h GLU 352 Cb 1.14 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 30.29 3kf4 h GLU 352 CO 0.08 0.65 0.02 -0.92 -0.73 0.00 0.00 179.01 178.11 3kf4 h TYR 353 N 1.01 0.04 -0.66 0.92 3.20 -0.91 0.35 116.97 120.92 3kf4 h TYR 353 Ca 0.28 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.12 3kf4 h TYR 353 Cb -0.10 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 3kf4 h TYR 353 CO -0.02 0.09 0.28 -0.07 -1.64 0.00 0.00 178.16 176.80 3kf4 h LEU 354 N -0.02 0.88 -0.12 2.82 3.38 -1.24 -0.27 115.31 120.74 3kf4 h LEU 354 Ca 0.01 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3kf4 h LEU 354 Cb 0.06 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3kf4 h LEU 354 CO -0.00 0.78 0.05 -0.08 0.09 0.00 0.00 178.44 179.28 3kf4 h GLU 355 N 0.95 0.18 -0.37 1.13 4.81 -0.82 0.52 114.58 120.98 3kf4 h GLU 355 Ca 0.23 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 3kf4 h GLU 355 Cb 0.16 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 3kf4 h GLU 355 CO -0.02 0.27 0.05 -0.22 -0.73 0.00 0.00 179.01 178.35 3kf4 h LYS 356 N 0.05 0.55 0.00 1.92 3.64 -0.67 0.43 116.57 122.48 3kf4 h LYS 356 Ca 0.04 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 3kf4 h LYS 356 Cb 0.15 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 3kf4 h LYS 356 CO -0.00 0.53 0.00 1.63 -2.27 0.00 0.00 179.45 179.34 3kf4 n LYS 357 N -4.31 0.67 -2.97 1.90 5.02 -0.13 -4.89 118.16 113.45 3kf4 n LYS 357 Ca 0.02 0.01 -0.21 0.00 -2.02 0.00 0.00 58.31 56.11 3kf4 n LYS 357 Cb 0.21 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.76 3kf4 n LYS 357 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3kf4 n ASN 358 N -1.11 -5.93 -4.91 4.39 5.15 0.14 -4.89 115.26 108.09 3kf4 n ASN 358 Ca 0.18 -0.27 -0.28 0.00 -0.60 0.00 0.00 54.58 53.61 3kf4 n ASN 358 Cb 0.14 -4.76 -0.03 0.00 -0.53 0.00 0.00 39.78 34.60 3kf4 n ASN 358 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 3kf4 s PHE 359 N -3.15 3.48 0.18 1.20 0.40 0.17 -1.49 117.98 118.77 3kf4 s PHE 359 Ca 0.28 0.51 0.10 0.00 -0.60 0.00 0.00 56.93 57.22 3kf4 s PHE 359 Cb -0.12 -1.99 -0.04 0.00 0.51 0.00 0.00 43.02 41.37 3kf4 s PHE 359 CO 0.35 0.26 -0.18 0.96 0.70 0.00 0.00 175.22 177.31 3kf4 s ILE 360 N -1.99 2.71 -0.23 0.64 -4.36 -0.33 -4.20 121.20 113.44 3kf4 s ILE 360 Ca 0.41 -1.82 -0.16 0.00 -0.26 0.00 0.00 60.65 58.82 3kf4 s ILE 360 Cb -0.11 -2.31 -0.13 0.00 1.25 0.00 0.00 42.46 41.17 3kf4 s ILE 360 CO 0.29 -0.08 -0.17 1.57 0.24 0.00 0.00 174.94 176.80 3kf4 n HIS 361 N 0.28 0.39 -0.99 1.37 -0.00 -1.26 -1.57 115.22 113.43 3kf4 n HIS 361 Ca -0.12 0.17 0.00 0.00 -0.00 0.00 0.00 57.72 57.76 3kf4 n HIS 361 Cb 0.55 -0.95 0.00 0.00 -0.00 0.00 0.00 29.99 29.59 3kf4 n HIS 361 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 3kf4 n ARG 362 N -4.36 -0.08 -2.73 1.57 1.74 -1.26 -2.72 116.66 108.81 3kf4 n ARG 362 Ca -0.39 0.02 -0.02 0.00 -0.77 0.00 0.00 57.85 56.69 3kf4 n ARG 362 Cb 0.73 -2.96 0.10 0.00 -1.02 0.00 0.00 32.46 29.30 3kf4 n ARG 362 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3kf4 n ASP 363 N -0.04 -0.34 -4.70 0.55 2.03 -1.26 -4.98 116.55 107.81 3kf4 n ASP 363 Ca 0.00 -2.18 -0.42 0.00 0.52 0.00 0.00 54.79 52.71 3kf4 n ASP 363 Cb 0.02 0.26 -0.03 0.00 -0.72 0.00 0.00 41.12 40.65 3kf4 n ASP 363 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3kf4 s LEU 364 N -3.93 4.36 -0.03 -2.67 1.02 -1.26 -4.81 118.68 111.36 3kf4 s LEU 364 Ca 0.17 2.40 -0.30 0.00 0.02 0.00 0.00 54.13 56.42 3kf4 s LEU 364 Cb 0.40 -3.57 0.11 0.00 0.02 0.00 0.00 46.19 43.14 3kf4 s LEU 364 CO -0.09 -0.78 0.99 0.00 0.02 0.00 0.00 176.35 176.49 3kf4 s ALA 365 N 1.89 -1.88 0.24 4.21 0.00 -1.26 -4.75 121.76 120.21 3kf4 s ALA 365 Ca 0.69 1.02 -0.03 0.00 0.00 0.00 0.00 51.96 53.63 3kf4 s ALA 365 Cb -0.38 0.32 0.26 0.00 0.00 0.00 0.00 23.12 23.31 3kf4 s ALA 365 CO 0.30 -0.73 1.71 0.00 0.00 0.00 0.00 175.76 177.04 3kf4 h ALA 366 N 2.00 1.01 0.00 0.00 0.00 -1.93 -1.48 119.26 118.86 3kf4 h ALA 366 Ca -0.20 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3kf4 h ALA 366 Cb 1.22 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 3kf4 h ALA 366 CO 0.28 0.60 -0.01 0.07 0.00 0.00 0.00 179.25 180.19 3kf4 h ARG 367 N 0.75 0.00 -0.61 0.00 0.11 -1.95 -1.91 114.38 110.77 3kf4 h ARG 367 Ca 0.13 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.21 3kf4 h ARG 367 Cb 0.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.63 3kf4 h ARG 367 CO 0.03 0.01 0.00 0.09 0.10 0.00 0.00 179.97 180.21 3kf4 n ASN 368 N -3.35 5.13 -4.61 0.08 3.02 -0.56 -4.65 115.26 110.31 3kf4 n ASN 368 Ca -0.03 -2.65 -0.27 0.00 -0.03 0.00 0.00 54.58 51.60 3kf4 n ASN 368 Cb 0.11 -0.62 -0.09 0.00 -0.61 0.00 0.00 39.78 38.58 3kf4 n ASN 368 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kf4 s LEU 370 N -2.73 2.33 -0.09 0.00 1.43 0.47 -0.14 118.68 119.95 3kf4 s LEU 370 Ca 0.25 -0.75 0.03 0.00 -1.03 0.00 0.00 54.13 52.63 3kf4 s LEU 370 Cb -0.10 -1.14 -0.01 0.00 0.03 0.00 0.00 46.19 44.98 3kf4 s LEU 370 CO 0.16 0.14 -0.20 -0.69 0.23 0.00 0.00 176.35 176.00 3kf4 s VAL 371 N -1.16 2.49 0.00 -1.59 1.01 -0.16 -0.85 120.40 120.14 3kf4 s VAL 371 Ca 0.13 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3kf4 s VAL 371 Cb -0.10 -1.98 0.00 0.00 0.00 0.00 0.00 36.38 34.30 3kf4 s VAL 371 CO 0.06 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.32 3kf4 n GLY 372 N 3.25 5.37 3.76 4.51 0.00 0.62 -1.00 105.19 121.70 3kf4 n GLY 372 Ca -0.18 -2.01 -0.36 0.00 0.00 0.00 0.00 46.02 43.47 3kf4 n GLY 372 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kf4 s GLU 373 N 1.89 3.22 -1.38 1.61 0.41 -1.26 -3.40 118.70 119.78 3kf4 s GLU 373 Ca 0.00 1.85 -0.08 0.00 -0.41 0.00 0.00 54.97 56.33 3kf4 s GLU 373 Cb 0.00 -2.09 0.01 0.00 -1.78 0.00 0.00 34.13 30.27 3kf4 s GLU 373 CO 0.00 -1.02 1.10 0.09 -0.49 0.00 0.00 175.26 174.94 3kf4 n ASN 374 N -1.23 -6.35 -2.19 -0.19 3.02 -1.26 -2.23 115.26 104.83 3kf4 n ASN 374 Ca 0.12 -0.50 -0.18 0.00 -0.03 0.00 0.00 54.58 53.99 3kf4 n ASN 374 Cb 0.49 -5.01 -0.03 0.00 -0.61 0.00 0.00 39.78 34.62 3kf4 n ASN 374 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3kf4 n HIS 375 N -4.94 -0.91 -1.93 3.10 8.25 -1.22 -4.92 115.22 112.65 3kf4 n HIS 375 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 3kf4 n HIS 375 Cb 0.57 -3.44 -0.03 0.00 1.12 0.00 0.00 29.99 28.21 3kf4 n HIS 375 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3kf4 s LEU 376 N -5.51 4.37 -0.05 2.41 2.96 -0.95 -4.75 118.68 117.16 3kf4 s LEU 376 Ca 0.00 2.65 0.04 0.00 -0.22 0.00 0.00 54.13 56.60 3kf4 s LEU 376 Cb 0.00 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 43.09 3kf4 s LEU 376 CO 0.00 -0.81 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.36 3kf4 s VAL 377 N 0.90 1.42 -0.02 1.68 1.01 -1.26 -0.28 120.40 123.86 3kf4 s VAL 377 Ca 0.68 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.99 3kf4 s VAL 377 Cb -0.44 -1.23 -0.00 0.00 0.00 0.00 0.00 36.38 34.71 3kf4 s VAL 377 CO 0.34 0.41 -0.10 -0.54 0.00 0.00 0.00 175.10 175.21 3kf4 s LYS 378 N 0.14 0.91 0.26 2.72 1.02 -0.03 -4.67 119.74 120.10 3kf4 s LYS 378 Ca -0.06 -0.34 -0.30 0.00 0.02 0.00 0.00 55.97 55.30 3kf4 s LYS 378 Cb -0.12 -0.86 -0.09 0.00 -0.52 0.00 0.00 37.83 36.23 3kf4 s LYS 378 CO 0.03 0.16 1.14 0.08 -0.92 0.00 0.00 175.35 175.84 3kf4 s VAL 379 N -0.01 3.46 0.12 3.17 1.01 -0.30 -0.39 120.40 127.45 3kf4 s VAL 379 Ca 0.00 1.40 0.01 0.00 0.00 0.00 0.00 61.98 63.40 3kf4 s VAL 379 Cb -0.06 -3.89 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 3kf4 s VAL 379 CO 0.00 0.31 0.05 0.00 0.00 0.00 0.00 175.10 175.46 3kf4 n ALA 380 N 1.48 0.18 -2.47 5.51 0.00 -0.49 -1.89 120.51 122.83 3kf4 n ALA 380 Ca 0.00 -0.63 -0.05 0.00 0.00 0.00 0.00 53.44 52.77 3kf4 n ALA 380 Cb 0.45 0.44 0.01 0.00 0.00 0.00 0.00 19.45 20.34 3kf4 n ALA 380 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3kf4 n ASP 381 N -2.00 -6.14 -1.27 0.00 10.43 -1.26 -4.83 116.55 111.48 3kf4 n ASP 381 Ca -0.01 0.30 0.08 0.00 2.57 0.00 0.00 54.79 57.73 3kf4 n ASP 381 Cb 0.19 -4.07 0.30 0.00 1.84 0.00 0.00 41.12 39.38 3kf4 n ASP 381 CO 0.00 0.00 0.00 0.49 -1.07 0.00 0.00 177.20 176.62 3kf4 n PHE 382 N -0.58 1.26 -0.16 1.24 3.01 -1.26 -4.61 117.46 116.36 3kf4 n PHE 382 Ca 0.07 -0.70 0.17 0.00 1.01 0.00 0.00 57.45 57.99 3kf4 n PHE 382 Cb 0.35 -0.28 0.54 0.00 -0.01 0.00 0.00 39.48 40.08 3kf4 n PHE 382 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3kf4 h GLY 383 N 2.99 0.62 -1.70 1.37 0.00 -1.90 -1.48 103.07 102.98 3kf4 h GLY 383 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.18 3kf4 h GLY 383 CO 0.24 0.04 0.00 1.04 0.00 0.00 0.00 176.54 177.86 3kf4 n LEU 384 N -4.46 2.84 -4.82 3.11 4.32 -1.26 -4.65 117.00 112.08 3kf4 n LEU 384 Ca 0.15 -1.26 -0.31 0.00 -0.02 0.00 0.00 56.01 54.56 3kf4 n LEU 384 Cb 0.58 -0.10 0.03 0.00 -1.62 0.00 0.00 43.42 42.31 3kf4 n LEU 384 CO 0.33 0.57 0.71 -0.44 -1.22 0.00 0.00 177.39 177.34 3kf4 s SER 385 N -1.43 5.61 -0.21 -1.43 0.01 -0.56 -4.65 113.70 111.05 3kf4 s SER 385 Ca 0.27 1.64 -0.12 0.00 1.31 0.00 0.00 55.95 59.04 3kf4 s SER 385 Cb 0.17 -2.50 0.07 0.00 0.21 0.00 0.00 66.02 63.96 3kf4 s SER 385 CO 0.25 -1.29 0.52 -0.13 0.41 0.00 0.00 173.24 173.00 3kf4 s ARG 386 N -4.79 0.52 -0.13 12.44 1.81 -0.61 -4.99 118.95 123.20 3kf4 s ARG 386 Ca 0.59 0.94 -0.29 0.00 -1.72 0.00 0.00 55.73 55.24 3kf4 s ARG 386 Cb -0.14 0.06 -0.02 0.00 -0.45 0.00 0.00 34.95 34.41 3kf4 s ARG 386 CO 0.50 -0.15 1.14 -1.17 -0.68 0.00 0.00 175.30 174.94 3kf4 s LEU 387 N 1.38 4.21 0.15 2.53 2.96 -1.26 -1.18 118.68 127.47 3kf4 s LEU 387 Ca -0.09 1.64 -0.30 0.00 -0.22 0.00 0.00 54.13 55.16 3kf4 s LEU 387 Cb -0.07 -3.55 -0.07 0.00 0.50 0.00 0.00 46.19 43.00 3kf4 s LEU 387 CO -0.14 -0.61 1.01 -0.04 -1.32 0.00 0.00 176.35 175.25 3kf4 s MET 388 N 2.66 4.68 -0.17 1.98 -1.94 -0.55 -4.94 119.30 121.01 3kf4 s MET 388 Ca 0.52 1.56 0.18 0.00 -1.71 0.00 0.00 55.69 56.24 3kf4 s MET 388 Cb -0.21 -3.33 -0.26 0.00 2.01 0.00 0.00 34.83 33.05 3kf4 s MET 388 CO 0.16 0.20 0.14 0.25 -0.01 0.00 0.00 175.02 175.77 3kf4 n THR 389 N 2.47 1.23 -3.86 2.05 -2.24 -1.26 -4.96 114.28 107.70 3kf4 n THR 389 Ca 0.02 -0.81 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 3kf4 n THR 389 Cb 0.48 -0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 3kf4 n THR 389 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3kf4 n GLY 390 N 1.68 4.64 0.20 3.38 0.00 -1.26 -5.04 105.19 108.79 3kf4 n GLY 390 Ca -0.29 -2.11 0.09 0.00 0.00 0.00 0.00 46.02 43.70 3kf4 n GLY 390 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3kf4 h ASP 391 N 0.00 0.00 -4.36 1.61 3.45 -1.96 -3.45 116.42 111.70 3kf4 h ASP 391 Ca 0.00 0.00 -0.45 0.00 0.43 0.00 0.00 57.03 57.01 3kf4 h ASP 391 Cb 0.00 0.00 -0.23 0.00 -0.56 0.00 0.00 39.33 38.54 3kf4 h ASP 391 CO 0.00 0.24 -0.79 0.42 -1.57 0.00 0.00 179.24 177.54 3kf4 s THR 392 N -3.29 1.22 -0.09 0.35 -4.23 -1.26 -4.60 115.64 103.72 3kf4 s THR 392 Ca 0.04 -1.19 -0.00 0.00 -1.18 0.00 0.00 61.69 59.36 3kf4 s THR 392 Cb 0.08 -1.12 -0.03 0.00 1.34 0.00 0.00 72.50 72.77 3kf4 s THR 392 CO 0.68 -0.08 -0.08 -0.47 -0.54 0.00 0.00 174.62 174.13 3kf4 s TYR 393 N -1.04 2.92 -0.37 3.99 6.14 0.11 -4.93 117.35 124.17 3kf4 s TYR 393 Ca 0.01 -0.16 -0.08 0.00 0.64 0.00 0.00 57.07 57.48 3kf4 s TYR 393 Cb -0.09 -1.78 0.05 0.00 0.42 0.00 0.00 41.96 40.56 3kf4 s TYR 393 CO 0.02 0.16 0.17 0.99 0.64 0.00 0.00 175.55 177.53 3kf4 s THR 394 N -0.38 4.09 0.66 4.34 2.01 -1.26 -0.59 115.64 124.50 3kf4 s THR 394 Ca 0.05 -1.13 -0.13 0.00 0.31 0.00 0.00 61.69 60.79 3kf4 s THR 394 Cb -0.12 -3.35 -0.01 0.00 0.01 0.00 0.00 72.50 69.03 3kf4 s THR 394 CO 0.02 -0.27 1.07 0.00 -0.69 0.00 0.00 174.62 174.75 3kf4 s ALA 395 N 1.44 2.63 0.67 7.40 0.00 -0.74 -4.99 121.76 128.17 3kf4 s ALA 395 Ca 0.00 0.30 -0.15 0.00 0.00 0.00 0.00 51.96 52.11 3kf4 s ALA 395 Cb -0.20 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.69 3kf4 s ALA 395 CO 0.04 -1.12 1.12 -3.38 0.00 0.00 0.00 175.76 172.42 3kf4 s HIS 396 N -2.68 2.55 0.31 0.00 -3.43 -1.26 -4.90 115.29 105.88 3kf4 s HIS 396 Ca 0.62 1.56 -0.29 0.00 -0.80 0.00 0.00 55.06 56.15 3kf4 s HIS 396 Cb -0.16 -3.21 -0.10 0.00 -1.43 0.00 0.00 32.58 27.68 3kf4 s HIS 396 CO 0.46 -1.80 1.29 0.00 -2.00 0.00 0.00 174.74 172.69 3kf4 s ALA 397 N -2.28 3.49 0.00 -1.38 0.00 -1.26 -2.24 121.76 118.09 3kf4 s ALA 397 Ca 0.68 1.21 0.00 0.00 0.00 0.00 0.00 51.96 53.85 3kf4 s ALA 397 Cb -0.22 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.44 3kf4 s ALA 397 CO 0.42 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 176.01 3kf4 n GLY 398 N 1.04 1.27 3.70 0.00 0.00 -1.26 -5.03 105.19 104.91 3kf4 n GLY 398 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3kf4 n GLY 398 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kf4 s ALA 399 N -2.36 3.76 -0.10 4.61 0.00 -0.95 -4.99 121.76 121.73 3kf4 s ALA 399 Ca 0.00 1.37 -0.12 0.00 0.00 0.00 0.00 51.96 53.21 3kf4 s ALA 399 Cb 0.00 -3.71 -0.05 0.00 0.00 0.00 0.00 23.12 19.37 3kf4 s ALA 399 CO 0.00 -1.06 0.27 0.15 0.00 0.00 0.00 175.76 175.12 3kf4 s LYS 400 N 2.22 3.90 0.22 0.00 -0.14 -1.26 -5.04 119.74 119.64 3kf4 s LYS 400 Ca 0.76 0.11 0.10 0.00 -1.36 0.00 0.00 55.97 55.57 3kf4 s LYS 400 Cb -0.44 -3.29 -0.04 0.00 -1.68 0.00 0.00 37.83 32.38 3kf4 s LYS 400 CO 0.33 0.55 -0.09 -0.06 -0.76 0.00 0.00 175.35 175.32 3kf4 s PHE 401 N -0.48 2.58 -0.41 3.18 2.99 -1.26 -5.06 117.98 119.51 3kf4 s PHE 401 Ca 0.18 -0.25 -0.28 0.00 0.00 0.00 0.00 56.93 56.58 3kf4 s PHE 401 Cb -0.14 -1.20 -0.02 0.00 0.00 0.00 0.00 43.02 41.66 3kf4 s PHE 401 CO 0.07 0.58 1.77 -1.25 -0.00 0.00 0.00 175.22 176.38 3kf4 s PRO 402 N -3.18 3.17 0.24 0.24 0.04 -1.26 -4.87 135.00 129.38 3kf4 s PRO 402 Ca 0.27 1.16 -0.05 0.00 0.04 0.00 0.00 61.00 62.42 3kf4 s PRO 402 Cb -0.07 -4.23 0.39 0.00 0.04 0.00 0.00 34.50 30.62 3kf4 s PRO 402 CO 0.16 -2.06 1.80 0.82 0.04 0.00 0.00 177.00 177.76 3kf4 h ILE 403 N 6.79 0.89 0.00 0.56 1.08 -1.97 -2.58 117.51 122.28 3kf4 h ILE 403 Ca -0.31 -0.25 0.00 0.00 -0.39 0.00 0.00 64.86 63.91 3kf4 h ILE 403 Cb 1.16 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 35.00 3kf4 h ILE 403 CO 1.09 0.13 0.00 0.11 -0.69 0.00 0.00 178.15 178.79 3kf4 h LYS 404 N 0.73 0.00 -0.02 2.37 1.57 -1.96 -2.70 116.57 116.57 3kf4 h LYS 404 Ca 0.39 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.17 3kf4 h LYS 404 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 3kf4 h LYS 404 CO -0.26 0.00 -0.13 0.91 -0.57 0.00 0.00 179.45 179.40 3kf4 n TRP 405 N -3.08 0.00 -3.56 -1.35 8.01 -0.99 -4.96 117.44 111.50 3kf4 n TRP 405 Ca 0.01 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.83 3kf4 n TRP 405 Cb 0.31 0.00 -0.09 0.00 -2.01 0.00 0.00 31.31 29.52 3kf4 n TRP 405 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.69 177.67 3kf4 s THR 406 N -1.63 5.30 0.76 -0.99 2.01 -1.02 -3.94 115.64 116.13 3kf4 s THR 406 Ca 0.18 0.38 -0.15 0.00 0.31 0.00 0.00 61.69 62.41 3kf4 s THR 406 Cb 0.14 -3.58 0.04 0.00 0.01 0.00 0.00 72.50 69.11 3kf4 s THR 406 CO 0.29 0.32 1.14 0.00 -0.69 0.00 0.00 174.62 175.68 3kf4 n ALA 407 N 4.31 0.08 -0.16 7.40 0.00 -1.26 -4.67 120.51 126.22 3kf4 n ALA 407 Ca -0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 53.44 53.04 3kf4 n ALA 407 Cb 0.52 -2.22 0.06 0.00 0.00 0.00 0.00 19.45 17.81 3kf4 n ALA 407 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3kf4 h PRO 408 N -0.48 0.33 0.00 0.00 0.11 -1.97 0.46 132.00 130.45 3kf4 h PRO 408 Ca -0.47 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.59 3kf4 h PRO 408 Cb 1.32 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 3kf4 h PRO 408 CO 0.47 0.22 -0.14 1.05 -0.21 0.00 0.00 178.00 179.39 3kf4 h GLU 409 N 0.34 0.00 0.02 1.05 9.09 -1.88 0.13 114.58 123.33 3kf4 h GLU 409 Ca 0.23 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.58 3kf4 h GLU 409 Cb 0.25 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.35 3kf4 h GLU 409 CO -0.24 0.14 -0.24 0.77 0.05 0.00 0.00 179.01 179.49 3kf4 h SER 410 N 0.00 0.18 -0.78 3.06 0.02 -1.26 0.09 113.55 114.85 3kf4 h SER 410 Ca -0.00 -0.86 0.03 0.00 -0.84 0.00 0.00 61.79 60.12 3kf4 h SER 410 Cb 0.36 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 62.79 3kf4 h SER 410 CO 0.02 1.02 0.50 -0.07 -1.14 0.00 0.00 176.83 177.16 3kf4 h LEU 411 N -0.63 0.83 0.16 5.07 3.38 -0.54 -0.93 115.31 122.65 3kf4 h LEU 411 Ca -0.04 -0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.64 3kf4 h LEU 411 Cb 1.07 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 41.64 3kf4 h LEU 411 CO 0.05 0.58 -1.39 0.00 0.09 0.00 0.00 178.44 177.76 3kf4 h ALA 412 N 1.33 0.07 0.00 1.53 0.00 -0.83 -3.40 119.26 117.95 3kf4 h ALA 412 Ca 0.31 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3kf4 h ALA 412 Cb 0.00 0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3kf4 h ALA 412 CO -0.11 0.77 -0.00 0.66 0.00 0.00 0.00 179.25 180.57 3kf4 n TYR 413 N -3.85 0.00 -2.23 0.00 0.53 0.01 -4.99 117.16 106.62 3kf4 n TYR 413 Ca -0.22 -0.40 -0.10 0.00 -1.02 0.00 0.00 57.90 56.16 3kf4 n TYR 413 Cb 0.96 -0.04 -0.01 0.00 -1.03 0.00 0.00 39.34 39.22 3kf4 n TYR 413 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 3kf4 n ASN 414 N -0.40 -3.26 -4.72 7.72 4.13 -0.36 -4.90 115.26 113.48 3kf4 n ASN 414 Ca 0.00 0.25 -0.37 0.00 1.68 0.00 0.00 54.58 56.14 3kf4 n ASN 414 Cb 0.30 -2.86 -0.07 0.00 -1.54 0.00 0.00 39.78 35.62 3kf4 n ASN 414 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3kf4 s LYS 415 N -4.62 4.29 0.12 3.52 -0.14 -1.15 -1.79 119.74 119.98 3kf4 s LYS 415 Ca 0.00 0.29 0.08 0.00 -1.36 0.00 0.00 55.97 54.97 3kf4 s LYS 415 Cb 0.00 -3.45 -0.04 0.00 -1.68 0.00 0.00 37.83 32.66 3kf4 s LYS 415 CO 0.00 0.15 -0.19 -0.06 -0.76 0.00 0.00 175.35 174.49 3kf4 s PHE 416 N 0.69 1.72 0.18 3.18 0.40 0.24 -3.20 117.98 121.18 3kf4 s PHE 416 Ca 0.21 -0.45 -0.11 0.00 -0.60 0.00 0.00 56.93 55.98 3kf4 s PHE 416 Cb -0.14 -0.91 0.04 0.00 0.51 0.00 0.00 43.02 42.52 3kf4 s PHE 416 CO 0.08 0.23 0.54 -1.13 0.70 0.00 0.00 175.22 175.64 3kf4 n SER 417 N 0.76 -1.23 0.25 1.36 3.41 -1.26 0.06 113.62 116.97 3kf4 n SER 417 Ca -0.17 -1.77 0.13 0.00 -0.26 0.00 0.00 58.87 56.81 3kf4 n SER 417 Cb 0.55 2.02 0.63 0.00 -0.26 0.00 0.00 64.21 67.16 3kf4 n SER 417 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3kf4 h ILE 418 N 1.59 0.38 -0.01 -1.33 6.09 -1.87 -2.29 117.51 120.06 3kf4 h ILE 418 Ca -0.18 -0.75 -0.12 0.00 -1.37 0.00 0.00 64.86 62.44 3kf4 h ILE 418 Cb 0.73 1.55 -0.02 0.00 0.47 0.00 0.00 36.82 39.55 3kf4 h ILE 418 CO 0.24 0.12 -0.55 0.11 -3.07 0.00 0.00 178.15 175.00 3kf4 h LYS 419 N 0.00 0.04 0.00 2.19 1.79 -1.93 -1.05 116.57 117.60 3kf4 h LYS 419 Ca -0.00 -0.03 -0.14 0.00 -2.18 0.00 0.00 60.65 58.31 3kf4 h LYS 419 Cb 0.54 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.17 3kf4 h LYS 419 CO 0.02 0.58 -0.64 0.66 -1.08 0.00 0.00 179.45 178.99 3kf4 h SER 420 N 0.03 0.00 -0.60 0.86 4.64 -1.79 -2.21 113.55 114.49 3kf4 h SER 420 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3kf4 h SER 420 Cb 0.99 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.05 3kf4 h SER 420 CO 0.07 0.64 0.19 0.44 -0.87 0.00 0.00 176.83 177.31 3kf4 h ASP 421 N 0.00 0.90 -0.73 4.97 3.32 -1.24 -1.94 116.42 121.69 3kf4 h ASP 421 Ca -0.01 -0.16 -0.03 0.00 0.02 0.00 0.00 57.03 56.86 3kf4 h ASP 421 Cb 1.15 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.44 3kf4 h ASP 421 CO 0.08 0.85 0.35 0.58 -1.72 0.00 0.00 179.24 179.38 3kf4 h VAL 422 N 0.93 1.24 -0.19 -1.35 2.07 -0.92 0.20 116.25 118.23 3kf4 h VAL 422 Ca 0.21 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 67.05 3kf4 h VAL 422 Cb 0.27 0.33 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 3kf4 h VAL 422 CO -0.01 0.28 0.12 -0.25 0.02 0.00 0.00 177.57 177.74 3kf4 h TRP 423 N 1.02 0.25 -0.69 1.57 2.91 -1.19 -0.80 115.95 119.01 3kf4 h TRP 423 Ca 0.25 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.28 3kf4 h TRP 423 Cb 0.12 -0.08 -0.03 0.00 -0.51 0.00 0.00 29.16 28.66 3kf4 h TRP 423 CO 0.01 0.18 0.45 0.00 -1.03 0.00 0.00 178.44 178.05 3kf4 h ALA 424 N 1.05 0.88 -0.95 2.65 0.00 -0.96 -1.34 119.26 120.59 3kf4 h ALA 424 Ca 0.07 -0.05 0.08 0.00 0.00 0.00 0.00 54.91 55.01 3kf4 h ALA 424 Cb -0.01 -0.28 -0.07 0.00 0.00 0.00 0.00 17.79 17.44 3kf4 h ALA 424 CO -0.01 0.31 0.61 0.35 0.00 0.00 0.00 179.25 180.51 3kf4 h PHE 425 N 0.94 1.10 -0.81 0.00 3.57 -0.11 0.15 116.94 121.78 3kf4 h PHE 425 Ca 0.25 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.84 3kf4 h PHE 425 Cb -0.09 -0.36 -0.06 0.00 2.79 0.00 0.00 35.95 38.23 3kf4 h PHE 425 CO -0.02 0.54 0.50 0.78 -2.23 0.00 0.00 178.31 177.87 3kf4 h GLY 426 N 1.04 1.21 1.02 2.40 0.00 -0.02 0.13 103.07 108.85 3kf4 h GLY 426 Ca 0.43 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.28 3kf4 h GLY 426 CO -0.18 0.26 -0.17 -2.08 0.00 0.00 0.00 176.54 174.37 3kf4 h VAL 427 N 0.92 1.28 -0.87 4.60 2.07 -0.53 -2.68 116.25 121.04 3kf4 h VAL 427 Ca 0.35 -1.30 0.06 0.00 0.82 0.00 0.00 66.70 66.63 3kf4 h VAL 427 Cb 0.14 1.25 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 3kf4 h VAL 427 CO -0.16 0.44 0.57 0.25 0.02 0.00 0.00 177.57 178.68 3kf4 h LEU 428 N 0.65 0.88 -0.96 2.57 5.85 -0.25 -1.40 115.31 122.66 3kf4 h LEU 428 Ca 0.09 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3kf4 h LEU 428 Cb 0.72 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 3kf4 h LEU 428 CO 0.05 0.58 0.63 -0.07 -0.34 0.00 0.00 178.44 179.29 3kf4 h LEU 429 N 1.01 1.06 -0.49 2.25 3.38 -0.47 -0.69 115.31 121.36 3kf4 h LEU 429 Ca 0.37 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 58.19 3kf4 h LEU 429 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3kf4 h LEU 429 CO -0.13 0.74 -0.22 -0.25 0.09 0.00 0.00 178.44 178.67 3kf4 h TRP 430 N 1.23 1.16 -0.70 1.13 7.01 -0.98 0.97 115.95 125.76 3kf4 h TRP 430 Ca 0.37 -0.28 0.04 0.00 2.11 0.00 0.00 58.89 61.13 3kf4 h TRP 430 Cb -0.04 -0.27 -0.05 0.00 -2.10 0.00 0.00 29.16 26.71 3kf4 h TRP 430 CO -0.01 1.11 0.43 0.93 -2.79 0.00 0.00 178.44 178.12 3kf4 h GLU 431 N 0.86 0.80 -0.10 2.65 5.08 -0.86 -1.27 114.58 121.75 3kf4 h GLU 431 Ca 0.11 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 3kf4 h GLU 431 Cb 0.80 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 3kf4 h GLU 431 CO 0.07 0.53 0.02 0.82 -1.00 0.00 0.00 179.01 179.45 3kf4 h ILE 432 N 0.83 1.22 -0.29 3.13 2.04 -0.82 0.50 117.51 124.11 3kf4 h ILE 432 Ca 0.29 -0.67 -0.00 0.00 1.00 0.00 0.00 64.86 65.47 3kf4 h ILE 432 Cb 0.06 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 3kf4 h ILE 432 CO -0.13 0.19 0.17 0.00 0.00 0.00 0.00 178.15 178.38 3kf4 h ALA 433 N 0.79 1.75 -0.42 1.87 0.00 -0.59 -0.81 119.26 121.84 3kf4 h ALA 433 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3kf4 h ALA 433 Cb 0.29 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3kf4 h ALA 433 CO 0.00 0.22 0.00 0.25 0.00 0.00 0.00 179.25 179.72 3kf4 n THR 434 N -4.47 0.56 -3.91 0.00 -2.24 -0.50 -4.82 114.28 98.90 3kf4 n THR 434 Ca 0.01 -0.66 -0.28 0.00 -2.27 0.00 0.00 64.05 60.85 3kf4 n THR 434 Cb 0.09 0.56 0.01 0.00 -2.10 0.00 0.00 70.33 68.90 3kf4 n THR 434 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3kf4 n TYR 435 N 1.08 -2.01 -0.52 4.78 4.01 -0.31 -3.69 117.16 120.50 3kf4 n TYR 435 Ca 0.18 0.85 0.00 0.00 -0.16 0.00 0.00 57.90 58.77 3kf4 n TYR 435 Cb 0.49 -3.91 0.00 0.00 -0.31 0.00 0.00 39.34 35.60 3kf4 n TYR 435 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3kf4 n GLY 436 N -1.67 0.96 3.76 2.72 0.00 0.17 -3.50 105.19 107.63 3kf4 n GLY 436 Ca -0.11 -0.40 -0.36 0.00 0.00 0.00 0.00 46.02 45.16 3kf4 n GLY 436 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3kf4 s MET 437 N -1.25 3.02 0.14 1.61 -1.94 -1.24 -4.90 119.30 114.74 3kf4 s MET 437 Ca 0.00 1.81 -0.31 0.00 -1.71 0.00 0.00 55.69 55.48 3kf4 s MET 437 Cb 0.00 -1.94 -0.08 0.00 2.01 0.00 0.00 34.83 34.82 3kf4 s MET 437 CO 0.00 -1.16 1.32 0.45 -0.01 0.00 0.00 175.02 175.61 3kf4 s SER 438 N -1.60 6.91 0.84 3.03 0.15 -1.26 -4.72 113.70 117.05 3kf4 s SER 438 Ca 0.77 2.30 -0.12 0.00 0.70 0.00 0.00 55.95 59.60 3kf4 s SER 438 Cb -0.30 -2.60 0.11 0.00 -1.71 0.00 0.00 66.02 61.52 3kf4 s SER 438 CO 0.32 -0.56 1.18 -2.84 1.20 0.00 0.00 173.24 172.55 3kf4 s PRO 439 N 0.53 1.42 -1.08 5.44 0.02 -1.26 -3.79 135.00 136.28 3kf4 s PRO 439 Ca 0.60 1.66 -0.22 0.00 0.02 0.00 0.00 61.00 63.06 3kf4 s PRO 439 Cb -0.35 -1.76 0.02 0.00 0.02 0.00 0.00 34.50 32.42 3kf4 s PRO 439 CO 0.34 -2.35 0.70 0.66 -0.33 0.00 0.00 177.00 176.01 3kf4 n TYR 440 N -3.65 -1.77 -1.67 6.54 4.02 -1.26 -4.81 117.16 114.55 3kf4 n TYR 440 Ca 0.13 0.40 -0.48 0.00 -0.01 0.00 0.00 57.90 57.94 3kf4 n TYR 440 Cb 0.51 -3.04 -0.05 0.00 -0.02 0.00 0.00 39.34 36.74 3kf4 n TYR 440 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 3kf4 n PRO 441 N -4.11 2.11 0.00 -0.72 -0.04 -1.25 -2.69 135.00 128.31 3kf4 n PRO 441 Ca -0.14 0.77 0.00 0.00 -0.04 0.00 0.00 63.50 64.09 3kf4 n PRO 441 Cb 0.60 -2.57 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 3kf4 n PRO 441 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kf4 n GLY 442 N 3.94 2.38 3.72 0.55 0.00 -1.26 -5.00 105.19 109.52 3kf4 n GLY 442 Ca 0.20 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 3kf4 n GLY 442 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kf4 s ILE 443 N -0.80 2.77 0.47 -0.61 1.01 -1.09 -4.99 121.20 117.95 3kf4 s ILE 443 Ca 0.00 0.55 -0.23 0.00 0.00 0.00 0.00 60.65 60.98 3kf4 s ILE 443 Cb 0.00 -3.35 -0.07 0.00 0.01 0.00 0.00 42.46 39.04 3kf4 s ILE 443 CO 0.00 0.04 1.15 -1.81 0.00 0.00 0.00 174.94 174.33 3kf4 s ASP 444 N 1.12 6.16 0.44 3.58 1.01 -1.26 -4.92 116.67 122.80 3kf4 s ASP 444 Ca 0.69 2.27 0.14 0.00 0.71 0.00 0.00 52.55 56.36 3kf4 s ASP 444 Cb -0.42 -2.60 1.06 0.00 1.01 0.00 0.00 42.92 41.97 3kf4 s ASP 444 CO 0.31 -0.92 1.99 -0.07 0.21 0.00 0.00 175.17 176.69 3kf4 h LEU 445 N 1.97 0.33 -0.72 1.23 4.07 -1.96 -2.02 115.31 118.22 3kf4 h LEU 445 Ca -0.49 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.47 3kf4 h LEU 445 Cb 1.25 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.92 3kf4 h LEU 445 CO 0.60 0.20 0.00 -1.20 -1.08 0.00 0.00 178.44 176.96 3kf4 n SER 446 N -4.47 0.57 -0.37 -0.43 7.64 -1.26 -2.31 113.62 112.99 3kf4 n SER 446 Ca 0.09 0.66 0.09 0.00 1.01 0.00 0.00 58.87 60.72 3kf4 n SER 446 Cb 0.36 -0.77 -0.01 0.00 -1.01 0.00 0.00 64.21 62.77 3kf4 n SER 446 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3kf4 n GLN 447 N -2.15 1.50 -0.01 1.43 3.00 -0.76 -4.66 117.38 115.74 3kf4 n GLN 447 Ca 0.02 -0.79 -0.12 0.00 -0.01 0.00 0.00 57.00 56.10 3kf4 n GLN 447 Cb 0.19 -1.34 -0.07 0.00 0.00 0.00 0.00 30.24 29.02 3kf4 n GLN 447 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 3kf4 h VAL 448 N 1.82 1.15 -0.42 5.09 2.07 -1.55 -2.18 116.25 122.22 3kf4 h VAL 448 Ca 0.00 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 3kf4 h VAL 448 Cb 0.60 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.64 3kf4 h VAL 448 CO 0.00 0.13 0.19 0.22 0.02 0.00 0.00 177.57 178.12 3kf4 h TYR 449 N -0.03 0.63 -0.40 1.57 3.20 -1.83 -0.87 116.97 119.23 3kf4 h TYR 449 Ca 0.03 -0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.93 3kf4 h TYR 449 Cb 0.17 -0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.20 3kf4 h TYR 449 CO -0.02 0.53 0.05 0.93 -1.64 0.00 0.00 178.16 178.02 3kf4 h GLU 450 N 0.54 0.16 -0.49 1.82 5.08 -1.85 0.14 114.58 119.99 3kf4 h GLU 450 Ca 0.14 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.48 3kf4 h GLU 450 Cb 0.15 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3kf4 h GLU 450 CO -0.01 0.11 0.25 -0.07 -1.00 0.00 0.00 179.01 178.28 3kf4 h LEU 451 N 0.17 0.64 -0.96 1.33 3.38 -0.92 -1.48 115.31 117.47 3kf4 h LEU 451 Ca 0.20 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 58.06 3kf4 h LEU 451 Cb 0.26 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 3kf4 h LEU 451 CO -0.29 0.58 0.64 -0.07 0.09 0.00 0.00 178.44 179.39 3kf4 h LEU 452 N 0.65 1.09 -1.82 1.67 3.38 -0.75 -0.15 115.31 119.38 3kf4 h LEU 452 Ca 0.17 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 3kf4 h LEU 452 Cb 0.10 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3kf4 h LEU 452 CO -0.02 0.78 -0.09 -0.08 0.09 0.00 0.00 178.44 179.12 3kf4 h GLU 453 N 1.29 0.00 -0.28 1.13 4.81 -0.12 0.42 114.58 121.82 3kf4 h GLU 453 Ca 0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.59 3kf4 h GLU 453 Cb -0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.26 3kf4 h GLU 453 CO -0.09 0.09 0.00 1.63 -0.73 0.00 0.00 179.01 179.92 3kf4 n LYS 454 N -4.42 1.54 -1.70 1.92 5.02 -0.63 -4.89 118.16 115.00 3kf4 n LYS 454 Ca -0.03 -0.74 -0.20 0.00 -2.02 0.00 0.00 58.31 55.33 3kf4 n LYS 454 Cb 0.17 -1.22 -0.07 0.00 -0.02 0.00 0.00 35.03 33.88 3kf4 n LYS 454 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3kf4 n ASP 455 N 0.10 -5.44 -4.72 4.39 2.03 0.15 -4.99 116.55 108.06 3kf4 n ASP 455 Ca 0.07 0.42 -0.42 0.00 0.52 0.00 0.00 54.79 55.37 3kf4 n ASP 455 Cb 0.21 -4.65 -0.03 0.00 -0.72 0.00 0.00 41.12 35.93 3kf4 n ASP 455 CO 0.00 0.00 0.00 -0.47 -1.92 0.00 0.00 177.20 174.81 3kf4 s TYR 456 N -2.78 3.12 0.16 -0.67 5.04 -0.17 -4.98 117.35 117.08 3kf4 s TYR 456 Ca 0.00 0.77 0.07 0.00 -2.44 0.00 0.00 57.07 55.47 3kf4 s TYR 456 Cb 0.00 -3.84 -0.04 0.00 0.35 0.00 0.00 41.96 38.43 3kf4 s TYR 456 CO 0.00 -3.01 -0.14 1.03 -1.34 0.00 0.00 175.55 172.10 3kf4 s ARG 457 N 0.99 1.17 0.31 4.97 1.81 -1.26 -4.07 118.95 122.88 3kf4 s ARG 457 Ca 0.67 -1.43 -0.27 0.00 -1.72 0.00 0.00 55.73 52.98 3kf4 s ARG 457 Cb -0.41 -0.98 -0.13 0.00 -0.45 0.00 0.00 34.95 32.97 3kf4 s ARG 457 CO 0.32 0.17 0.99 -1.33 -0.68 0.00 0.00 175.30 174.77 3kf4 n MET 458 N 0.02 1.33 -1.63 3.54 2.81 -1.26 -4.96 117.12 116.98 3kf4 n MET 458 Ca -0.11 0.47 -0.33 0.00 -1.81 0.00 0.00 57.70 55.91 3kf4 n MET 458 Cb 0.59 -1.86 0.06 0.00 -0.71 0.00 0.00 33.22 31.30 3kf4 n MET 458 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 3kf4 s GLU 459 N -1.62 2.58 0.02 0.03 -1.05 -1.26 -4.95 118.70 112.45 3kf4 s GLU 459 Ca 0.59 1.44 -0.30 0.00 -0.15 0.00 0.00 54.97 56.55 3kf4 s GLU 459 Cb -0.68 -1.92 -0.08 0.00 -0.44 0.00 0.00 34.13 31.02 3kf4 s GLU 459 CO 0.60 -1.43 1.86 0.50 0.95 0.00 0.00 175.26 177.74 3kf4 s ARG 460 N -4.14 4.15 0.59 -4.83 3.52 -1.26 -4.95 118.95 112.03 3kf4 s ARG 460 Ca 0.68 2.48 -0.20 0.00 -0.13 0.00 0.00 55.73 58.57 3kf4 s ARG 460 Cb -0.22 -4.07 -0.03 0.00 -1.56 0.00 0.00 34.95 29.07 3kf4 s ARG 460 CO 0.44 -0.91 1.29 -2.14 -0.81 0.00 0.00 175.30 173.17 3kf4 s PRO 461 N 4.20 2.89 -0.02 5.12 0.02 -1.26 -4.88 135.00 141.06 3kf4 s PRO 461 Ca 0.83 2.05 -0.36 0.00 0.02 0.00 0.00 61.00 63.55 3kf4 s PRO 461 Cb -0.40 -2.02 -0.14 0.00 0.02 0.00 0.00 34.50 31.96 3kf4 s PRO 461 CO 0.38 -1.33 1.64 -1.91 -0.33 0.00 0.00 177.00 175.44 3kf4 n GLU 462 N -1.49 1.70 0.00 5.54 4.07 -1.26 -1.24 120.64 127.96 3kf4 n GLU 462 Ca 0.13 0.62 0.00 0.00 -0.06 0.00 0.00 57.16 57.85 3kf4 n GLU 462 Cb 0.47 -2.36 0.00 0.00 -0.06 0.00 0.00 31.44 29.49 3kf4 n GLU 462 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3kf4 n GLY 463 N 3.64 2.04 3.68 8.31 0.00 -1.26 -4.96 105.19 116.65 3kf4 n GLY 463 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 3kf4 n GLY 463 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kf4 n PRO 465 N 5.62 2.50 -0.29 0.00 -0.04 -1.26 -4.83 135.00 136.70 3kf4 n PRO 465 Ca 0.14 0.88 0.03 0.00 -0.04 0.00 0.00 63.50 64.51 3kf4 n PRO 465 Cb 0.43 -2.58 0.17 0.00 -0.04 0.00 0.00 33.50 31.49 3kf4 n PRO 465 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3kf4 h GLU 466 N 3.25 0.77 0.00 0.54 4.57 -1.99 -0.27 114.58 121.44 3kf4 h GLU 466 Ca -0.49 -0.05 -0.08 0.00 -1.18 0.00 0.00 59.36 57.57 3kf4 h GLU 466 Cb 1.25 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.66 3kf4 h GLU 466 CO 0.67 0.51 -0.39 0.87 -1.18 0.00 0.00 179.01 179.48 3kf4 h LYS 467 N 0.79 0.00 -0.10 1.92 1.79 -1.99 -0.44 116.57 118.54 3kf4 h LYS 467 Ca 0.40 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.83 3kf4 h LYS 467 Cb 0.38 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.03 3kf4 h LYS 467 CO -0.25 0.39 -0.10 0.28 -1.08 0.00 0.00 179.45 178.69 3kf4 h VAL 468 N 0.00 1.37 -0.55 0.50 2.07 -1.47 -2.54 116.25 115.63 3kf4 h VAL 468 Ca -0.00 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.25 3kf4 h VAL 468 Cb 0.79 1.99 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 3kf4 h VAL 468 CO 0.05 0.36 0.34 0.22 0.02 0.00 0.00 177.57 178.57 3kf4 h TYR 469 N -0.18 0.70 -0.37 1.57 3.20 -0.81 0.28 116.97 121.35 3kf4 h TYR 469 Ca 0.01 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.84 3kf4 h TYR 469 Cb 0.62 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 3kf4 h TYR 469 CO 0.09 0.45 0.01 0.93 -1.64 0.00 0.00 178.16 178.00 3kf4 h GLU 470 N 0.74 0.58 -0.45 1.82 5.08 -1.03 -0.46 114.58 120.85 3kf4 h GLU 470 Ca 0.20 -0.12 -0.14 0.00 -1.00 0.00 0.00 59.36 58.29 3kf4 h GLU 470 Cb -0.06 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3kf4 h GLU 470 CO -0.04 0.59 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.22 3kf4 h LEU 471 N 0.55 1.02 -0.25 1.33 3.38 -0.55 -0.55 115.31 120.24 3kf4 h LEU 471 Ca 0.12 -0.42 0.06 0.00 0.09 0.00 0.00 57.88 57.73 3kf4 h LEU 471 Cb 0.34 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 3kf4 h LEU 471 CO 0.01 1.22 -0.16 0.24 0.09 0.00 0.00 178.44 179.84 3kf4 h MET 472 N 0.83 -0.14 -0.88 1.13 2.86 -0.85 -0.80 114.93 117.09 3kf4 h MET 472 Ca 0.10 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 3kf4 h MET 472 Cb 0.86 0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.50 3kf4 h MET 472 CO 0.08 -0.09 0.56 0.00 1.06 0.00 0.00 176.91 178.52 3kf4 h ARG 473 N -0.14 1.17 -0.73 1.72 2.47 -0.82 -0.73 114.38 117.32 3kf4 h ARG 473 Ca 0.14 -0.08 -0.04 0.00 -1.26 0.00 0.00 59.98 58.74 3kf4 h ARG 473 Cb 0.35 -0.26 -0.03 0.00 -1.65 0.00 0.00 29.97 28.38 3kf4 h ARG 473 CO -0.34 0.79 0.30 0.00 0.56 0.00 0.00 179.97 181.29 3kf4 h ALA 474 N 1.42 1.15 0.00 0.04 0.00 -0.63 -2.07 119.26 119.17 3kf4 h ALA 474 Ca 0.32 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3kf4 h ALA 474 Cb -0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.39 3kf4 h ALA 474 CO -0.07 0.62 -0.18 0.00 0.00 0.00 0.00 179.25 179.62 3kf4 n TRP 476 N -3.68 1.99 -1.76 0.00 8.01 -0.40 -3.79 117.44 117.80 3kf4 n TRP 476 Ca -0.01 -1.05 -0.41 0.00 -1.31 0.00 0.00 57.50 54.71 3kf4 n TRP 476 Cb 0.30 -0.56 -0.01 0.00 -2.01 0.00 0.00 31.31 29.03 3kf4 n TRP 476 CO 0.00 0.00 0.00 1.04 -1.01 0.00 0.00 177.69 177.72 3kf4 n GLN 477 N -0.09 2.73 -0.18 -0.99 1.13 -1.00 -4.91 117.38 114.07 3kf4 n GLN 477 Ca 0.33 0.96 -0.08 0.00 -1.94 0.00 0.00 57.00 56.28 3kf4 n GLN 477 Cb 1.23 -2.73 0.01 0.00 0.11 0.00 0.00 30.24 28.86 3kf4 n GLN 477 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 3kf4 h TRP 478 N 4.00 0.76 -3.32 1.08 2.91 -1.92 -3.40 115.95 116.05 3kf4 h TRP 478 Ca -0.49 -0.05 -0.58 0.00 1.13 0.00 0.00 58.89 58.91 3kf4 h TRP 478 Cb 1.23 -0.23 -0.07 0.00 -0.51 0.00 0.00 29.16 29.58 3kf4 h TRP 478 CO 0.56 0.62 0.33 1.21 -1.03 0.00 0.00 178.44 180.13 3kf4 s ASN 479 N -5.95 6.96 0.28 2.65 3.84 -1.26 -4.85 114.94 116.62 3kf4 s ASN 479 Ca -0.13 1.18 0.02 0.00 0.21 0.00 0.00 52.86 54.14 3kf4 s ASN 479 Cb 0.12 -2.45 0.67 0.00 -0.55 0.00 0.00 41.25 39.04 3kf4 s ASN 479 CO 0.77 -0.34 1.68 -0.65 -2.79 0.00 0.00 177.10 175.77 3kf4 h PRO 480 N 7.23 0.32 0.00 0.43 0.11 -1.95 0.42 132.00 138.56 3kf4 h PRO 480 Ca -0.32 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3kf4 h PRO 480 Cb 1.15 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3kf4 h PRO 480 CO 0.82 0.21 0.00 0.66 -0.21 0.00 0.00 178.00 179.48 3kf4 h SER 481 N 0.33 0.00 1.71 -2.05 4.64 -1.94 -1.97 113.55 114.27 3kf4 h SER 481 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 3kf4 h SER 481 Cb 1.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 3kf4 h SER 481 CO -0.56 0.00 -0.14 0.44 -0.87 0.00 0.00 176.83 175.70 3kf4 h ASP 482 N 0.00 0.00 -3.94 4.97 3.32 -1.27 -3.46 116.42 116.04 3kf4 h ASP 482 Ca 0.00 -0.01 -0.49 0.00 0.02 0.00 0.00 57.03 56.55 3kf4 h ASP 482 Cb 0.35 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.93 3kf4 h ASP 482 CO 0.00 0.01 0.44 -0.13 -1.72 0.00 0.00 179.24 177.83 3kf4 s ARG 483 N -3.20 4.20 0.92 3.56 0.52 -0.74 -4.92 118.95 119.29 3kf4 s ARG 483 Ca 0.07 1.61 -0.11 0.00 -0.52 0.00 0.00 55.73 56.78 3kf4 s ARG 483 Cb 0.08 -2.66 0.14 0.00 0.52 0.00 0.00 34.95 33.03 3kf4 s ARG 483 CO 0.67 -0.13 1.10 -1.25 0.02 0.00 0.00 175.30 175.71 3kf4 s PRO 484 N -2.31 1.04 0.73 3.54 0.04 -1.26 -5.04 135.00 131.74 3kf4 s PRO 484 Ca 0.56 1.19 -0.12 0.00 0.04 0.00 0.00 61.00 62.67 3kf4 s PRO 484 Cb -0.25 -1.76 0.03 0.00 0.04 0.00 0.00 34.50 32.56 3kf4 s PRO 484 CO 0.31 -2.50 1.11 -1.54 0.04 0.00 0.00 177.00 174.43 3kf4 s SER 485 N -2.98 5.25 0.34 6.66 1.04 -1.26 -4.93 113.70 117.82 3kf4 s SER 485 Ca 0.65 1.08 0.16 0.00 0.48 0.00 0.00 55.95 58.32 3kf4 s SER 485 Cb -0.21 -1.83 0.57 0.00 0.10 0.00 0.00 66.02 64.65 3kf4 s SER 485 CO 0.58 -1.46 1.69 -0.26 0.98 0.00 0.00 173.24 174.77 3kf4 h PHE 486 N -0.74 0.00 -0.40 5.02 -1.00 -1.93 -1.33 116.94 116.55 3kf4 h PHE 486 Ca -0.45 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.37 3kf4 h PHE 486 Cb 1.27 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.79 3kf4 h PHE 486 CO 0.47 0.46 0.17 0.00 -1.61 0.00 0.00 178.31 177.79 3kf4 h ALA 487 N 1.54 0.48 -0.21 2.45 0.00 -1.89 0.25 119.26 121.90 3kf4 h ALA 487 Ca -0.00 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3kf4 h ALA 487 Cb 0.96 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3kf4 h ALA 487 CO 0.06 -0.21 0.03 0.93 0.00 0.00 0.00 179.25 180.05 3kf4 h GLU 488 N 0.34 0.35 -0.40 0.00 5.08 -1.88 -2.41 114.58 115.66 3kf4 h GLU 488 Ca 0.18 -0.09 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 3kf4 h GLU 488 Cb 0.13 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 3kf4 h GLU 488 CO -0.16 0.50 0.24 0.82 -1.00 0.00 0.00 179.01 179.41 3kf4 h ILE 489 N 0.14 1.05 -0.29 3.13 2.04 -1.02 -1.53 117.51 121.04 3kf4 h ILE 489 Ca 0.06 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 65.76 3kf4 h ILE 489 Cb 0.33 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 3kf4 h ILE 489 CO 0.00 0.09 0.18 -0.74 0.00 0.00 0.00 178.15 177.69 3kf4 h HIS 490 N 0.49 0.36 -0.43 1.37 2.76 -0.46 -0.59 115.15 118.65 3kf4 h HIS 490 Ca 0.16 0.01 -0.06 0.00 -2.20 0.00 0.00 60.37 58.27 3kf4 h HIS 490 Cb -0.01 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 28.81 3kf4 h HIS 490 CO -0.07 0.24 0.03 0.37 -1.30 0.00 0.00 177.93 177.20 3kf4 h GLN 491 N 0.38 0.68 -0.28 5.26 4.15 -1.26 -0.48 115.11 123.55 3kf4 h GLN 491 Ca 0.10 -0.16 -0.00 0.00 0.77 0.00 0.00 58.65 59.37 3kf4 h GLN 491 Cb -0.03 -0.09 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 3kf4 h GLN 491 CO -0.02 0.68 0.17 0.00 -1.93 0.00 0.00 178.83 177.73 3kf4 h ALA 492 N 1.39 0.36 -0.30 3.38 0.00 -0.90 -0.52 119.26 122.66 3kf4 h ALA 492 Ca 0.14 -0.04 -0.18 0.00 0.00 0.00 0.00 54.91 54.82 3kf4 h ALA 492 Cb 0.36 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 3kf4 h ALA 492 CO 0.01 -0.14 -0.52 0.74 0.00 0.00 0.00 179.25 179.34 3kf4 h PHE 493 N 0.36 1.10 -0.61 0.00 0.04 -0.82 -0.76 116.94 116.26 3kf4 h PHE 493 Ca 0.10 -0.38 0.03 0.00 2.80 0.00 0.00 57.97 60.51 3kf4 h PHE 493 Cb 0.01 -0.21 -0.04 0.00 2.20 0.00 0.00 35.95 37.91 3kf4 h PHE 493 CO -0.04 1.21 0.38 1.49 -0.60 0.00 0.00 178.31 180.75 3kf4 h GLU 494 N 0.69 0.72 -0.28 1.51 4.81 -1.06 0.41 114.58 121.37 3kf4 h GLU 494 Ca 0.02 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3kf4 h GLU 494 Cb 1.13 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 3kf4 h GLU 494 CO 0.12 0.48 0.17 1.15 -0.73 0.00 0.00 179.01 180.19 3kf4 h THR 495 N 0.74 1.10 -0.75 0.32 2.02 -0.86 0.21 112.91 115.69 3kf4 h THR 495 Ca 0.24 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 3kf4 h THR 495 Cb 0.01 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.14 3kf4 h THR 495 CO -0.10 0.10 0.29 0.24 0.37 0.00 0.00 175.52 176.42 3kf4 h MET 496 N 0.35 1.12 -0.61 6.66 2.86 -0.71 -1.42 114.93 123.18 3kf4 h MET 496 Ca 0.10 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.51 3kf4 h MET 496 Cb 0.01 -0.18 -0.03 0.00 0.06 0.00 0.00 31.60 31.46 3kf4 h MET 496 CO -0.02 0.92 0.26 0.35 1.06 0.00 0.00 176.91 179.47 3kf4 h PHE 497 N 1.10 0.91 -0.32 -0.22 3.04 0.25 -1.31 116.94 120.39 3kf4 h PHE 497 Ca 0.25 -0.06 -0.06 0.00 3.98 0.00 0.00 57.97 62.08 3kf4 h PHE 497 Cb 0.22 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.43 3kf4 h PHE 497 CO 0.02 0.72 -0.07 1.96 -2.02 0.00 0.00 178.31 178.92 3kf4 h GLN 498 N 0.84 0.52 0.03 1.11 1.08 -0.27 -1.89 115.11 116.53 3kf4 h GLN 498 Ca 0.20 -0.13 -0.22 0.00 -1.45 0.00 0.00 58.65 57.06 3kf4 h GLN 498 Cb 0.18 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 3kf4 h GLN 498 CO -0.02 0.59 -0.99 0.93 -0.95 0.00 0.00 178.83 178.40 3kf4 h GLU 499 N 0.49 0.14 0.00 1.46 5.08 -0.94 -3.29 114.58 117.51 3kf4 h GLU 499 Ca 0.10 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3kf4 h GLU 499 Cb 0.42 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3kf4 h GLU 499 CO 0.02 1.01 -0.79 -1.13 -1.00 0.00 0.00 179.01 177.13 3kf4 n SER 500 N -3.53 0.63 -0.08 1.42 3.41 -0.52 -5.10 113.62 109.84 3kf4 n SER 500 Ca -0.03 -0.16 0.16 0.00 -0.26 0.00 0.00 58.87 58.57 3kf4 n SER 500 Cb 0.89 0.49 0.88 0.00 -0.26 0.00 0.00 64.21 66.21 3kf4 n SER 500 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68