#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fei n LEU 203 N 0.00 4.42 0.18 -2.12 -0.00 -1.26 -4.67 117.00 113.55 3fei n LEU 203 Ca 0.00 -4.50 0.08 0.00 -0.00 0.00 0.00 56.01 51.59 3fei n LEU 203 Cb 0.00 -0.25 0.10 0.00 -0.00 0.00 0.00 43.42 43.27 3fei n LEU 203 CO 0.00 1.94 0.65 0.07 -0.00 0.00 0.00 177.39 180.06 3fei h LYS 204 N 2.17 0.00 -0.02 1.47 2.10 -2.05 -3.30 116.57 116.93 3fei h LYS 204 Ca 0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.94 3fei h LYS 204 Cb 1.49 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.82 3fei h LYS 204 CO 0.66 0.22 -0.11 -1.13 -2.00 0.00 0.00 179.45 177.09 3fei n SER 205 N -3.15 2.40 -0.06 7.07 3.41 -1.26 -4.68 113.62 117.34 3fei n SER 205 Ca 0.03 -1.70 -0.11 0.00 -0.26 0.00 0.00 58.87 56.83 3fei n SER 205 Cb 0.62 0.13 -0.05 0.00 -0.26 0.00 0.00 64.21 64.66 3fei n SER 205 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3fei h LEU 206 N 3.34 0.32 -0.41 1.04 5.85 -1.89 -2.08 115.31 121.49 3fei h LEU 206 Ca 0.00 -0.29 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 3fei h LEU 206 Cb 0.77 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.69 3fei h LEU 206 CO 0.00 0.53 0.24 0.00 -0.34 0.00 0.00 178.44 178.87 3fei h ALA 207 N 0.81 0.53 -0.26 1.25 0.00 -1.83 -1.86 119.26 117.89 3fei h ALA 207 Ca 0.06 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3fei h ALA 207 Cb 0.36 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3fei h ALA 207 CO 0.01 0.03 0.10 -0.22 0.00 0.00 0.00 179.25 179.16 3fei h LYS 208 N 0.54 0.21 -0.87 0.00 3.11 -1.84 -0.97 116.57 116.75 3fei h LYS 208 Ca 0.15 -0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 57.95 3fei h LYS 208 Cb 0.02 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.16 3fei h LYS 208 CO -0.03 0.14 0.43 0.00 -2.81 0.00 0.00 179.45 177.19 3fei h ARG 209 N 0.22 1.24 -0.15 1.90 3.08 -1.21 -0.86 114.38 118.60 3fei h ARG 209 Ca 0.11 -0.17 -0.13 0.00 0.07 0.00 0.00 59.98 59.86 3fei h ARG 209 Cb 0.07 -0.23 0.00 0.00 0.08 0.00 0.00 29.97 29.90 3fei h ARG 209 CO -0.11 0.94 -0.40 0.82 -1.07 0.00 0.00 179.97 180.15 3fei h ILE 210 N 1.23 1.35 -0.41 2.04 2.04 -1.10 -1.08 117.51 121.58 3fei h ILE 210 Ca 0.30 -1.67 -0.06 0.00 1.00 0.00 0.00 64.86 64.43 3fei h ILE 210 Cb 0.09 2.01 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 3fei h ILE 210 CO -0.04 0.51 0.03 0.22 0.00 0.00 0.00 178.15 178.86 3fei h TYR 211 N 0.17 0.77 -0.58 1.37 3.20 -1.13 -0.97 116.97 119.80 3fei h TYR 211 Ca -0.01 -0.12 -0.03 0.00 3.14 0.00 0.00 58.73 61.71 3fei h TYR 211 Cb 1.01 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 39.05 3fei h TYR 211 CO 0.10 0.76 0.24 1.49 -1.64 0.00 0.00 178.16 179.12 3fei h GLU 212 N 0.55 0.86 -0.43 1.82 4.81 -1.18 -1.25 114.58 119.75 3fei h GLU 212 Ca 0.12 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 3fei h GLU 212 Cb 0.44 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 3fei h GLU 212 CO 0.02 0.73 0.23 0.00 -0.73 0.00 0.00 179.01 179.26 3fei h ALA 213 N 1.09 1.59 -0.05 2.92 0.00 -0.95 -1.74 119.26 122.12 3fei h ALA 213 Ca 0.20 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3fei h ALA 213 Cb 0.18 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3fei h ALA 213 CO -0.02 0.34 -0.06 -0.92 0.00 0.00 0.00 179.25 178.59 3fei h TYR 214 N 0.60 0.15 -0.81 0.00 3.20 -0.76 -2.43 116.97 116.93 3fei h TYR 214 Ca 0.16 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 3fei h TYR 214 Cb 0.03 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.23 3fei h TYR 214 CO 0.00 0.60 0.42 -0.07 -1.64 0.00 0.00 178.16 177.47 3fei h LEU 215 N -0.34 1.03 -0.72 2.82 3.38 -1.06 -2.50 115.31 117.92 3fei h LEU 215 Ca 0.01 -0.10 -0.14 0.00 0.09 0.00 0.00 57.88 57.74 3fei h LEU 215 Cb 0.58 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3fei h LEU 215 CO 0.01 0.85 -0.62 0.11 0.09 0.00 0.00 178.44 178.88 3fei h LYS 216 N 1.14 0.09 0.00 1.13 1.57 -1.35 -3.36 116.57 115.79 3fei h LYS 216 Ca 0.28 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 3fei h LYS 216 Cb 0.07 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3fei h LYS 216 CO -0.04 0.68 -1.93 0.09 -0.57 0.00 0.00 179.45 177.68 3fei n ASN 217 N -3.83 0.31 -4.35 0.86 4.13 -0.91 -4.88 115.26 106.58 3fei n ASN 217 Ca -0.02 -0.01 -0.39 0.00 1.68 0.00 0.00 54.58 55.84 3fei n ASN 217 Cb 0.62 1.93 -0.12 0.00 -1.54 0.00 0.00 39.78 40.67 3fei n ASN 217 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 3fei s PHE 218 N -3.42 3.21 0.38 3.10 0.08 -0.95 -4.73 117.98 115.65 3fei s PHE 218 Ca -0.07 -1.01 0.11 0.00 0.12 0.00 0.00 56.93 56.08 3fei s PHE 218 Cb 0.13 -2.34 0.91 0.00 -0.57 0.00 0.00 43.02 41.15 3fei s PHE 218 CO 0.86 -0.62 1.89 -2.95 -0.10 0.00 0.00 175.22 174.30 3fei h ASN 219 N 8.32 0.55 -3.41 1.36 7.08 -1.89 -3.40 115.58 124.18 3fei h ASN 219 Ca -0.28 0.03 -0.67 0.00 -3.08 0.00 0.00 56.30 52.30 3fei h ASN 219 Cb 1.11 -0.08 -0.17 0.00 -2.08 0.00 0.00 38.32 37.10 3fei h ASN 219 CO 0.63 0.28 -0.65 -0.32 -2.08 0.00 0.00 177.43 175.30 3fei s MET 220 N -5.57 3.03 0.33 4.14 1.75 -1.26 -5.08 119.30 116.65 3fei s MET 220 Ca -0.09 -0.46 0.05 0.00 -1.25 0.00 0.00 55.69 53.94 3fei s MET 220 Cb 0.21 -2.76 -0.03 0.00 2.84 0.00 0.00 34.83 35.09 3fei s MET 220 CO 0.78 0.62 0.22 0.54 -0.65 0.00 0.00 175.02 176.53 3fei s ASN 221 N -0.67 1.76 0.23 1.11 2.20 -1.26 -5.04 114.94 113.27 3fei s ASN 221 Ca 0.10 -1.68 -0.01 0.00 -0.94 0.00 0.00 52.86 50.34 3fei s ASN 221 Cb -0.12 0.51 0.26 0.00 -2.00 0.00 0.00 41.25 39.90 3fei s ASN 221 CO 0.02 -0.99 1.63 0.50 -2.94 0.00 0.00 177.10 175.31 3fei h LYS 222 N 2.12 0.56 -0.10 3.55 3.64 -1.95 0.05 116.57 124.44 3fei h LYS 222 Ca -0.29 -0.26 -0.01 0.00 -1.27 0.00 0.00 60.65 58.81 3fei h LYS 222 Cb 1.24 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.05 3fei h LYS 222 CO 0.44 0.84 0.02 0.28 -2.27 0.00 0.00 179.45 178.76 3fei h VAL 223 N 0.48 1.20 -0.21 2.00 2.07 -1.98 0.33 116.25 120.15 3fei h VAL 223 Ca 0.05 -0.62 0.01 0.00 0.82 0.00 0.00 66.70 66.96 3fei h VAL 223 Cb 0.83 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 3fei h VAL 223 CO 0.07 0.18 0.13 0.50 0.02 0.00 0.00 177.57 178.46 3fei h LYS 224 N -0.05 0.25 -0.70 1.57 3.64 -1.96 -2.42 116.57 116.91 3fei h LYS 224 Ca 0.03 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 3fei h LYS 224 Cb 0.26 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 3fei h LYS 224 CO 0.00 0.17 0.19 0.00 -2.27 0.00 0.00 179.45 177.54 3fei h ALA 225 N 1.08 1.01 -0.17 5.00 0.00 -0.94 -2.60 119.26 122.66 3fei h ALA 225 Ca 0.08 -0.23 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 3fei h ALA 225 Cb -0.02 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3fei h ALA 225 CO -0.03 0.65 -0.55 0.00 0.00 0.00 0.00 179.25 179.32 3fei h ARG 226 N 1.05 0.49 0.00 0.00 2.47 -0.78 -1.77 114.38 115.84 3fei h ARG 226 Ca 0.22 -0.31 -0.05 0.00 -1.26 0.00 0.00 59.98 58.59 3fei h ARG 226 Cb 0.34 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.69 3fei h ARG 226 CO -0.00 0.91 -0.22 -0.39 0.56 0.00 0.00 179.97 180.83 3fei h VAL 227 N 0.38 0.39 -0.06 2.04 -1.51 -1.37 0.31 116.25 116.43 3fei h VAL 227 Ca 0.01 -1.51 -0.14 0.00 -1.23 0.00 0.00 66.70 63.83 3fei h VAL 227 Cb 1.08 2.16 0.01 0.00 -2.13 0.00 0.00 31.29 32.40 3fei h VAL 227 CO 0.10 0.22 -0.50 0.40 -1.23 0.00 0.00 177.57 176.56 3fei h ILE 228 N 0.00 1.40 -0.16 7.19 2.04 -1.42 -3.32 117.51 123.23 3fei h ILE 228 Ca -0.00 -1.89 -0.14 0.00 1.00 0.00 0.00 64.86 63.83 3fei h ILE 228 Cb 1.14 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 39.56 3fei h ILE 228 CO 0.03 0.56 -0.51 -0.07 0.00 0.00 0.00 178.15 178.16 3fei h LEU 229 N -0.00 0.49 -3.43 1.44 3.38 -1.28 -3.47 115.31 112.44 3fei h LEU 229 Ca -0.04 -0.25 -0.28 0.00 0.09 0.00 0.00 57.88 57.40 3fei h LEU 229 Cb 1.17 -0.14 -0.23 0.00 0.09 0.00 0.00 40.66 41.55 3fei h LEU 229 CO 0.10 0.91 -0.69 -1.20 0.09 0.00 0.00 178.44 177.66 3fei n SER 230 N -3.97 3.24 0.00 -0.43 7.64 0.09 -5.09 113.62 115.10 3fei n SER 230 Ca -0.02 -3.73 0.00 0.00 1.01 0.00 0.00 58.87 56.12 3fei n SER 230 Cb 0.57 -0.43 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 3fei n SER 230 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 3fei n PRO 238 N -0.87 0.00 -1.99 1.43 -0.04 -1.26 -4.50 135.00 127.77 3fei n PRO 238 Ca 0.30 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.34 3fei n PRO 238 Cb 0.84 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.27 3fei n PRO 238 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3fei s PHE 239 N -0.03 2.31 -0.03 0.54 2.19 -0.43 -4.66 117.98 117.87 3fei s PHE 239 Ca 0.00 0.33 -0.27 0.00 0.33 0.00 0.00 56.93 57.32 3fei s PHE 239 Cb 0.00 -3.91 -0.03 0.00 -1.31 0.00 0.00 43.02 37.76 3fei s PHE 239 CO 0.00 -3.71 0.86 0.08 1.83 0.00 0.00 175.22 174.28 3fei s VAL 240 N 3.10 4.95 -0.34 3.12 1.01 -1.26 -0.77 120.40 130.21 3fei s VAL 240 Ca 0.73 1.79 -0.08 0.00 0.00 0.00 0.00 61.98 64.41 3fei s VAL 240 Cb -0.37 -4.20 0.03 0.00 0.00 0.00 0.00 36.38 31.85 3fei s VAL 240 CO 0.31 0.19 0.14 -0.63 0.00 0.00 0.00 175.10 175.11 3fei s ILE 241 N 0.95 4.13 0.00 2.22 1.01 0.10 -4.88 121.20 124.73 3fei s ILE 241 Ca 0.45 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 60.18 3fei s ILE 241 Cb -0.19 -3.28 0.00 0.00 0.01 0.00 0.00 42.46 39.00 3fei s ILE 241 CO 0.23 -0.14 0.05 0.00 0.00 0.00 0.00 174.94 175.08 3fei n HIS 242 N 4.89 0.00 -3.80 3.97 1.44 -1.26 -2.26 115.22 118.21 3fei n HIS 242 Ca -0.13 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.49 3fei n HIS 242 Cb 0.46 0.00 -0.00 0.00 0.12 0.00 0.00 29.99 30.57 3fei n HIS 242 CO 0.00 0.00 0.00 -0.40 -2.81 0.00 0.00 176.34 173.13 3fei n ASP 243 N -0.33 -1.39 -0.18 4.39 5.68 -1.26 -4.66 116.55 118.80 3fei n ASP 243 Ca 0.00 -2.37 -0.08 0.00 -0.50 0.00 0.00 54.79 51.84 3fei n ASP 243 Cb 0.03 2.44 0.07 0.00 -1.14 0.00 0.00 41.12 42.52 3fei n ASP 243 CO 0.00 0.00 0.00 0.24 -1.33 0.00 0.00 177.20 176.11 3fei h MET 244 N 0.00 0.98 -0.36 0.11 2.86 -1.99 -2.04 114.93 114.50 3fei h MET 244 Ca -0.23 -0.30 -0.02 0.00 -2.06 0.00 0.00 59.70 57.08 3fei h MET 244 Cb 0.94 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.49 3fei h MET 244 CO 0.31 0.97 0.15 1.49 1.06 0.00 0.00 176.91 180.89 3fei h GLU 245 N 0.90 0.53 -0.41 1.72 4.81 -2.00 -2.18 114.58 117.96 3fei h GLU 245 Ca 0.16 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 59.22 3fei h GLU 245 Cb 0.54 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.82 3fei h GLU 245 CO 0.03 0.51 -0.05 1.79 -0.73 0.00 0.00 179.01 180.56 3fei h THR 246 N 0.43 1.24 -0.93 0.32 1.35 -1.89 -2.28 112.91 111.16 3fei h THR 246 Ca 0.12 -1.03 0.07 0.00 -0.55 0.00 0.00 66.41 65.03 3fei h THR 246 Cb 0.18 0.98 -0.07 0.00 -1.73 0.00 0.00 68.15 67.51 3fei h THR 246 CO -0.01 0.35 0.58 0.25 -0.25 0.00 0.00 175.52 176.44 3fei h LEU 247 N 0.64 0.91 -0.18 3.87 5.85 -1.13 -2.37 115.31 122.89 3fei h LEU 247 Ca 0.12 0.02 -0.22 0.00 0.84 0.00 0.00 57.88 58.65 3fei h LEU 247 Cb 0.48 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.34 3fei h LEU 247 CO 0.02 0.56 -0.95 0.00 -0.34 0.00 0.00 178.44 177.73 3fei h MET 249 N 0.14 0.69 0.00 0.00 2.86 -1.32 -2.92 114.93 114.38 3fei h MET 249 Ca -0.07 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.51 3fei h MET 249 Cb 1.60 -0.15 0.00 0.00 0.06 0.00 0.00 31.60 33.11 3fei h MET 249 CO 0.15 0.50 0.00 0.00 1.06 0.00 0.00 176.91 178.62 3fei h ALA 250 N 1.15 1.00 -3.00 6.32 0.00 -1.38 -3.52 119.26 119.84 3fei h ALA 250 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3fei h ALA 250 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3fei h ALA 250 CO -0.03 0.00 0.00 -1.91 0.00 0.00 0.00 179.25 177.31 3fei n GLU 251 N -2.70 3.58 0.00 0.00 2.13 -0.74 -5.10 120.64 117.81 3fei n GLU 251 Ca 0.03 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.85 3fei n GLU 251 Cb 0.37 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.08 3fei n GLU 251 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3fei n LYS 266 N 0.00 0.00 -1.37 5.31 5.02 -1.26 -5.07 118.16 120.78 3fei n LYS 266 Ca 0.00 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 55.98 3fei n LYS 266 Cb 0.00 0.00 0.08 0.00 -0.02 0.00 0.00 35.03 35.09 3fei n LYS 266 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 3fei s GLU 267 N -0.38 2.39 0.00 1.97 2.12 -1.26 -4.89 118.70 118.65 3fei s GLU 267 Ca 0.00 1.04 0.00 0.00 0.36 0.00 0.00 54.97 56.37 3fei s GLU 267 Cb 0.00 -1.92 0.00 0.00 0.26 0.00 0.00 34.13 32.47 3fei s GLU 267 CO 0.00 -1.51 0.81 0.00 -0.54 0.00 0.00 175.26 174.01 3fei n ALA 268 N -3.42 -0.23 -0.32 6.30 0.00 -1.26 -1.71 120.51 119.86 3fei n ALA 268 Ca 0.08 0.00 0.24 0.00 0.00 0.00 0.00 53.44 53.76 3fei n ALA 268 Cb 0.54 0.09 0.46 0.00 0.00 0.00 0.00 19.45 20.54 3fei n ALA 268 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3fei h GLU 269 N 0.00 0.16 -0.02 0.00 3.07 -1.98 0.51 114.58 116.31 3fei h GLU 269 Ca 0.00 -0.01 -0.08 0.00 -0.50 0.00 0.00 59.36 58.77 3fei h GLU 269 Cb 0.00 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.86 3fei h GLU 269 CO 0.00 0.10 -0.37 0.28 -1.40 0.00 0.00 179.01 177.62 3fei h VAL 270 N 0.16 1.28 0.00 3.13 2.07 -1.88 -1.51 116.25 119.49 3fei h VAL 270 Ca 0.73 -1.32 -0.20 0.00 0.82 0.00 0.00 66.70 66.73 3fei h VAL 270 Cb 1.71 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 33.14 3fei h VAL 270 CO -0.71 0.38 -0.95 0.03 0.02 0.00 0.00 177.57 176.35 3fei h ARG 271 N 0.04 0.00 -0.15 1.57 3.08 0.87 -2.28 114.38 117.50 3fei h ARG 271 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 3fei h ARG 271 Cb 0.68 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.73 3fei h ARG 271 CO 0.05 0.89 -0.15 0.82 -1.07 0.00 0.00 179.97 180.51 3fei h ILE 272 N 0.00 1.34 -0.67 2.04 2.04 -1.15 -2.19 117.51 118.93 3fei h ILE 272 Ca -0.02 -1.31 0.13 0.00 1.00 0.00 0.00 64.86 64.66 3fei h ILE 272 Cb 1.71 1.85 -0.09 0.00 -0.74 0.00 0.00 36.82 39.55 3fei h ILE 272 CO 0.12 0.39 0.17 0.15 0.00 0.00 0.00 178.15 178.98 3fei h PHE 273 N 0.01 0.28 -0.23 1.37 3.04 -1.33 -0.93 116.94 119.15 3fei h PHE 273 Ca 0.02 0.04 -0.08 0.00 3.98 0.00 0.00 57.97 61.93 3fei h PHE 273 Cb 0.68 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.16 3fei h PHE 273 CO 0.08 -0.03 -0.19 1.25 -2.02 0.00 0.00 178.31 177.40 3fei h HIS 274 N 0.30 0.45 -0.34 0.41 2.76 -1.38 -2.90 115.15 114.44 3fei h HIS 274 Ca 0.36 -0.08 -0.13 0.00 -2.20 0.00 0.00 60.37 58.32 3fei h HIS 274 Cb 0.56 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.40 3fei h HIS 274 CO -0.24 0.59 -0.30 0.00 -1.30 0.00 0.00 177.93 176.68 3fei h GLN 277 N 1.18 0.43 -0.22 0.00 4.20 -1.40 -0.13 115.11 119.18 3fei h GLN 277 Ca 0.31 -0.03 0.05 0.00 0.06 0.00 0.00 58.65 59.05 3fei h GLN 277 Cb -0.06 -0.10 -0.06 0.00 0.30 0.00 0.00 27.48 27.57 3fei h GLN 277 CO -0.06 0.28 -0.14 0.00 -0.67 0.00 0.00 178.83 178.25 3fei h THR 279 N -0.13 0.79 -0.42 0.00 2.02 -1.22 -0.56 112.91 113.39 3fei h THR 279 Ca 0.12 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.39 3fei h THR 279 Cb 0.32 0.79 -0.09 0.00 -1.74 0.00 0.00 68.15 67.43 3fei h THR 279 CO -0.30 0.00 -0.16 0.28 0.37 0.00 0.00 175.52 175.71 3fei h SER 280 N -0.05 -0.56 -0.49 4.18 0.02 -0.57 0.20 113.55 116.29 3fei h SER 280 Ca 0.08 0.14 0.03 0.00 -0.84 0.00 0.00 61.79 61.20 3fei h SER 280 Cb 0.16 0.32 -0.04 0.00 0.14 0.00 0.00 62.40 62.99 3fei h SER 280 CO -0.18 -0.20 0.28 0.58 -1.14 0.00 0.00 176.83 176.18 3fei h VAL 281 N -0.07 1.02 -0.26 2.27 2.07 -0.16 0.27 116.25 121.38 3fei h VAL 281 Ca 0.20 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.52 3fei h VAL 281 Cb 0.38 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3fei h VAL 281 CO -0.47 0.10 0.09 -0.08 0.02 0.00 0.00 177.57 177.24 3fei h GLU 282 N 0.55 0.39 -0.95 1.57 4.81 -0.54 -2.10 114.58 118.31 3fei h GLU 282 Ca 0.20 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.36 3fei h GLU 282 Cb 0.05 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.32 3fei h GLU 282 CO -0.11 0.44 0.62 1.15 -0.73 0.00 0.00 179.01 180.39 3fei h THR 283 N 0.26 1.25 -0.55 0.32 2.02 -0.24 -0.52 112.91 115.44 3fei h THR 283 Ca 0.09 -0.46 -0.00 0.00 0.77 0.00 0.00 66.41 66.80 3fei h THR 283 Cb 0.20 -0.15 -0.03 0.00 -1.74 0.00 0.00 68.15 66.44 3fei h THR 283 CO -0.01 0.24 0.33 0.58 0.37 0.00 0.00 175.52 177.04 3fei h VAL 284 N 1.30 1.17 -0.42 3.16 2.07 -0.87 0.40 116.25 123.05 3fei h VAL 284 Ca 0.35 -0.38 0.08 0.00 0.82 0.00 0.00 66.70 67.57 3fei h VAL 284 Cb -0.14 0.43 -0.07 0.00 -1.52 0.00 0.00 31.29 29.99 3fei h VAL 284 CO -0.07 0.17 0.01 0.74 0.02 0.00 0.00 177.57 178.44 3fei h THR 285 N 0.74 0.69 -0.62 2.57 2.02 -0.72 0.97 112.91 118.55 3fei h THR 285 Ca 0.20 -0.04 -0.09 0.00 0.77 0.00 0.00 66.41 67.25 3fei h THR 285 Cb -0.01 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 3fei h THR 285 CO -0.04 0.02 0.05 -0.33 0.37 0.00 0.00 175.52 175.59 3fei h GLU 286 N 0.12 1.06 -0.34 6.66 5.08 -0.33 -3.10 114.58 123.74 3fei h GLU 286 Ca 0.21 -0.31 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 3fei h GLU 286 Cb 0.30 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.42 3fei h GLU 286 CO -0.34 1.01 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.50 3fei h LEU 287 N 0.98 0.56 -0.20 1.33 3.38 0.42 -0.89 115.31 120.89 3fei h LEU 287 Ca 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3fei h LEU 287 Cb 0.50 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3fei h LEU 287 CO 0.02 0.71 0.09 0.74 0.09 0.00 0.00 178.44 180.10 3fei h THR 288 N 0.54 1.14 0.18 0.22 2.02 -0.81 0.14 112.91 116.34 3fei h THR 288 Ca 0.10 -0.40 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 3fei h THR 288 Cb 0.51 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.96 3fei h THR 288 CO 0.03 0.13 -0.09 -0.33 0.37 0.00 0.00 175.52 175.64 3fei h GLU 289 N 0.19 -0.24 -0.68 6.66 4.39 -1.44 -1.91 114.58 121.55 3fei h GLU 289 Ca 0.07 0.02 0.15 0.00 0.34 0.00 0.00 59.36 59.93 3fei h GLU 289 Cb 0.13 0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 28.72 3fei h GLU 289 CO -0.01 -0.03 0.01 0.35 -1.16 0.00 0.00 179.01 178.16 3fei h PHE 290 N -0.41 -0.04 -0.47 4.33 3.57 -1.14 -2.33 116.94 120.46 3fei h PHE 290 Ca -0.03 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 3fei h PHE 290 Cb 0.32 0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.16 3fei h PHE 290 CO -0.02 -0.19 0.26 0.00 -2.23 0.00 0.00 178.31 176.13 3fei h ALA 291 N 1.62 0.60 -0.28 2.41 0.00 -0.56 -2.46 119.26 120.59 3fei h ALA 291 Ca 0.36 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.27 3fei h ALA 291 Cb 0.61 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3fei h ALA 291 CO -0.58 0.11 0.21 0.87 0.00 0.00 0.00 179.25 179.86 3fei h LYS 292 N 0.62 0.00 -0.00 0.00 1.57 -0.82 0.50 116.57 118.45 3fei h LYS 292 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 3fei h LYS 292 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 3fei h LYS 292 CO -0.03 0.00 -0.19 0.00 -0.57 0.00 0.00 179.45 178.66 3fei n ALA 293 N -2.57 2.82 -2.36 3.86 0.00 -0.95 -4.26 120.51 117.05 3fei n ALA 293 Ca 0.04 -0.22 -0.43 0.00 0.00 0.00 0.00 53.44 52.84 3fei n ALA 293 Cb 0.37 -1.33 -0.02 0.00 0.00 0.00 0.00 19.45 18.47 3fei n ALA 293 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3fei s ILE 294 N -2.90 4.17 -0.16 0.00 1.01 0.17 -4.80 121.20 118.69 3fei s ILE 294 Ca 0.16 1.40 -0.38 0.00 0.00 0.00 0.00 60.65 61.83 3fei s ILE 294 Cb 0.19 -3.94 -0.15 0.00 0.01 0.00 0.00 42.46 38.57 3fei s ILE 294 CO 0.58 -0.17 1.71 -2.65 0.00 0.00 0.00 174.94 174.41 3fei n PRO 295 N 6.77 1.41 0.00 2.79 -0.02 -1.26 -1.18 135.00 143.52 3fei n PRO 295 Ca 0.15 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 3fei n PRO 295 Cb 0.45 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3fei n PRO 295 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3fei n GLY 296 N 3.95 2.93 0.17 -1.23 0.00 -1.26 -4.94 105.19 104.81 3fei n GLY 296 Ca 0.24 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.11 3fei n GLY 296 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3fei h PHE 297 N 0.00 0.68 0.00 1.61 3.57 -1.43 -2.97 116.94 118.40 3fei h PHE 297 Ca 0.00 -0.27 0.00 0.00 3.53 0.00 0.00 57.97 61.23 3fei h PHE 297 Cb 0.00 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.62 3fei h PHE 297 CO 0.00 1.01 0.00 0.00 -2.23 0.00 0.00 178.31 177.09 3fei n ALA 298 N -2.52 1.68 0.65 2.41 0.00 -1.26 -2.41 120.51 119.07 3fei n ALA 298 Ca -0.07 0.05 0.13 0.00 0.00 0.00 0.00 53.44 53.56 3fei n ALA 298 Cb 0.53 -1.36 0.44 0.00 0.00 0.00 0.00 19.45 19.06 3fei n ALA 298 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3fei n ASN 299 N -2.09 0.69 -4.84 0.00 3.02 -1.12 -4.89 115.26 106.03 3fei n ASN 299 Ca 0.02 0.57 -0.31 0.00 -0.03 0.00 0.00 54.58 54.83 3fei n ASN 299 Cb 0.22 -0.76 0.02 0.00 -0.61 0.00 0.00 39.78 38.65 3fei n ASN 299 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3fei s LEU 300 N -4.32 3.30 0.34 3.41 1.43 -1.01 -5.00 118.68 116.83 3fei s LEU 300 Ca 0.11 1.57 -0.29 0.00 -1.03 0.00 0.00 54.13 54.49 3fei s LEU 300 Cb 0.13 -4.49 -0.12 0.00 0.03 0.00 0.00 46.19 41.74 3fei s LEU 300 CO 0.57 -1.07 1.43 -0.67 0.23 0.00 0.00 176.35 176.84 3fei n ASP 301 N -2.58 3.36 0.06 2.29 2.03 -1.26 -4.80 116.55 115.65 3fei n ASP 301 Ca 0.07 1.20 0.19 0.00 0.52 0.00 0.00 54.79 56.77 3fei n ASP 301 Cb 0.54 -1.55 0.72 0.00 -0.72 0.00 0.00 41.12 40.11 3fei n ASP 301 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 3fei h LEU 302 N 3.24 0.00 -0.53 -2.67 6.46 -1.94 0.26 115.31 120.13 3fei h LEU 302 Ca -0.48 0.00 -0.14 0.00 -0.12 0.00 0.00 57.88 57.14 3fei h LEU 302 Cb 1.26 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 41.17 3fei h LEU 302 CO 0.67 0.00 -0.65 0.78 -0.62 0.00 0.00 178.44 178.62 3fei h ASN 303 N 0.00 0.00 0.49 1.25 2.35 -2.00 -2.65 115.58 115.02 3fei h ASN 303 Ca 0.20 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.75 3fei h ASN 303 Cb 0.89 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.25 3fei h ASN 303 CO -0.00 0.65 -0.88 0.44 -1.65 0.00 0.00 177.43 175.99 3fei h ASP 304 N 0.00 0.34 0.06 5.81 5.19 -0.87 -2.30 116.42 124.65 3fei h ASP 304 Ca -0.01 -0.27 -0.09 0.00 -0.62 0.00 0.00 57.03 56.04 3fei h ASP 304 Cb 1.25 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.65 3fei h ASP 304 CO 0.08 1.06 -0.27 1.56 -3.12 0.00 0.00 179.24 178.55 3fei h GLN 305 N 0.15 0.35 0.05 3.56 4.20 -1.29 -1.87 115.11 120.26 3fei h GLN 305 Ca -0.05 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.53 3fei h GLN 305 Cb 1.50 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 29.26 3fei h GLN 305 CO 0.14 0.60 -0.02 0.28 -0.67 0.00 0.00 178.83 179.16 3fei h VAL 306 N 0.31 1.28 -0.58 -0.54 2.07 -1.44 -2.72 116.25 114.64 3fei h VAL 306 Ca 0.05 -1.16 0.12 0.00 0.82 0.00 0.00 66.70 66.52 3fei h VAL 306 Cb 0.65 2.04 -0.10 0.00 -1.52 0.00 0.00 31.29 32.35 3fei h VAL 306 CO 0.05 0.29 -0.03 0.74 0.02 0.00 0.00 177.57 178.63 3fei h THR 307 N -0.58 0.50 -0.18 2.57 2.02 -1.37 0.90 112.91 116.77 3fei h THR 307 Ca -0.01 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.14 3fei h THR 307 Cb 0.52 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 3fei h THR 307 CO 0.01 0.02 0.08 -0.07 0.37 0.00 0.00 175.52 175.93 3fei h LEU 308 N 0.09 0.24 -0.44 2.58 3.38 -1.37 -1.59 115.31 118.20 3fei h LEU 308 Ca 0.29 -0.13 -0.16 0.00 0.09 0.00 0.00 57.88 57.97 3fei h LEU 308 Cb 0.47 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 3fei h LEU 308 CO -0.52 0.30 -0.44 -0.07 0.09 0.00 0.00 178.44 177.81 3fei h LEU 309 N 0.16 0.88 -0.58 1.67 3.38 -1.31 0.17 115.31 119.68 3fei h LEU 309 Ca 0.06 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 57.66 3fei h LEU 309 Cb 0.13 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 3fei h LEU 309 CO -0.01 1.19 0.31 0.50 0.09 0.00 0.00 178.44 180.52 3fei h LYS 310 N 0.66 0.57 0.00 1.13 3.64 -0.73 -1.95 116.57 119.89 3fei h LYS 310 Ca 0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3fei h LYS 310 Cb 1.01 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 3fei h LYS 310 CO 0.10 0.38 -1.20 0.66 -2.27 0.00 0.00 179.45 177.12 3fei n TYR 311 N -4.84 0.53 0.27 1.91 4.01 -0.61 -4.34 117.16 114.09 3fei n TYR 311 Ca 0.06 0.15 0.11 0.00 -0.16 0.00 0.00 57.90 58.06 3fei n TYR 311 Cb 0.15 -0.69 -0.12 0.00 -0.31 0.00 0.00 39.34 38.37 3fei n TYR 311 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fei n GLY 312 N 1.26 -1.07 0.14 2.72 0.00 0.57 -4.68 105.19 104.13 3fei n GLY 312 Ca -0.00 -0.49 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 3fei n GLY 312 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 3fei h VAL 313 N 0.00 1.27 -0.07 1.61 3.04 -1.55 -0.36 116.25 120.19 3fei h VAL 313 Ca 0.00 -0.95 -0.13 0.00 -1.01 0.00 0.00 66.70 64.62 3fei h VAL 313 Cb 0.87 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 31.60 3fei h VAL 313 CO 0.00 0.29 -0.54 1.88 -1.01 0.00 0.00 177.57 178.19 3fei h TYR 314 N 0.14 0.23 -0.63 3.17 0.05 -1.84 0.58 116.97 118.68 3fei h TYR 314 Ca 0.06 -0.08 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 3fei h TYR 314 Cb 0.44 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 38.11 3fei h TYR 314 CO 0.04 0.68 0.37 0.93 -1.05 0.00 0.00 178.16 179.13 3fei h GLU 315 N 0.14 0.86 -0.49 4.88 5.08 -1.75 -2.34 114.58 120.96 3fei h GLU 315 Ca 0.00 -0.09 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 3fei h GLU 315 Cb 0.99 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 3fei h GLU 315 CO 0.08 0.63 -0.19 0.00 -1.00 0.00 0.00 179.01 178.52 3fei h ALA 316 N 1.18 0.72 0.09 3.43 0.00 -0.63 -2.72 119.26 121.33 3fei h ALA 316 Ca 0.22 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3fei h ALA 316 Cb -0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3fei h ALA 316 CO -0.04 0.67 -0.09 0.82 0.00 0.00 0.00 179.25 180.62 3fei h ILE 317 N 0.86 0.80 0.00 0.00 2.04 -0.74 -1.21 117.51 119.27 3fei h ILE 317 Ca 0.12 0.00 -0.07 0.00 1.00 0.00 0.00 64.86 65.91 3fei h ILE 317 Cb 0.77 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 3fei h ILE 317 CO 0.06 0.00 -0.34 -0.26 0.00 0.00 0.00 178.15 177.61 3fei h PHE 318 N -0.19 0.00 -0.28 1.37 0.04 -1.47 0.31 116.94 116.72 3fei h PHE 318 Ca 0.01 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.68 3fei h PHE 318 Cb 0.19 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 3fei h PHE 318 CO -0.11 0.34 -0.20 0.00 -0.60 0.00 0.00 178.31 177.74 3fei h ALA 319 N 1.66 0.40 -0.02 2.45 0.00 -1.32 -3.00 119.26 119.43 3fei h ALA 319 Ca -0.00 -0.36 -0.15 0.00 0.00 0.00 0.00 54.91 54.40 3fei h ALA 319 Cb 0.87 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.55 3fei h ALA 319 CO 0.04 0.34 -0.66 0.52 0.00 0.00 0.00 179.25 179.49 3fei h MET 320 N 0.36 0.09 0.00 0.00 2.86 -0.94 -3.20 114.93 114.11 3fei h MET 320 Ca 0.05 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.59 3fei h MET 320 Cb 0.74 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.41 3fei h MET 320 CO 0.05 0.72 -0.14 1.25 1.06 0.00 0.00 176.91 179.86 3fei h LEU 321 N 0.07 0.00 -1.18 1.22 5.85 -0.39 -2.11 115.31 118.77 3fei h LEU 321 Ca -0.01 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.88 3fei h LEU 321 Cb 1.18 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 42.13 3fei h LEU 321 CO 0.09 0.14 0.61 0.28 -0.34 0.00 0.00 178.44 179.22 3fei h SER 322 N 0.00 0.70 -0.30 1.25 0.02 -1.51 -1.99 113.55 111.71 3fei h SER 322 Ca -0.00 0.06 0.09 0.00 -0.84 0.00 0.00 61.79 61.10 3fei h SER 322 Cb 0.28 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.74 3fei h SER 322 CO 0.02 0.30 0.26 0.28 -1.14 0.00 0.00 176.83 176.55 3fei h SER 323 N 0.71 0.00 -0.68 3.07 0.02 -1.56 -1.84 113.55 113.27 3fei h SER 323 Ca 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 3fei h SER 323 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 3fei h SER 323 CO -0.28 0.00 0.00 1.33 -1.14 0.00 0.00 176.83 176.74 3fei n VAL 324 N -4.14 1.01 -4.96 2.27 0.24 -0.75 -4.53 118.33 107.48 3fei n VAL 324 Ca 0.04 -1.00 -0.32 0.00 -2.04 0.00 0.00 64.34 61.02 3fei n VAL 324 Cb 0.42 0.49 -0.15 0.00 -1.47 0.00 0.00 33.84 33.13 3fei n VAL 324 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 3fei s MET 325 N -1.02 3.01 0.00 7.34 -1.94 -0.69 -1.13 119.30 124.86 3fei s MET 325 Ca 0.46 -0.76 0.00 0.00 -1.71 0.00 0.00 55.69 53.68 3fei s MET 325 Cb 0.24 -2.44 0.00 0.00 2.01 0.00 0.00 34.83 34.63 3fei s MET 325 CO 0.31 0.32 0.00 0.27 -0.01 0.00 0.00 175.02 175.91 3fei n ASN 326 N 3.17 1.67 0.06 3.03 0.23 0.57 -4.93 115.26 119.07 3fei n ASN 326 Ca -0.18 -0.89 0.10 0.00 -0.53 0.00 0.00 54.58 53.08 3fei n ASN 326 Cb 0.53 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.65 3fei n ASN 326 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 3fei n LYS 327 N -0.15 0.10 -0.00 -3.83 2.85 -1.26 -3.26 118.16 112.62 3fei n LYS 327 Ca 0.00 0.30 0.06 0.00 -1.05 0.00 0.00 58.31 57.61 3fei n LYS 327 Cb 0.00 -1.68 -0.08 0.00 -0.65 0.00 0.00 35.03 32.62 3fei n LYS 327 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3fei n ASP 328 N -1.88 1.36 0.00 -5.58 8.00 -1.26 -4.86 116.55 112.33 3fei n ASP 328 Ca 0.03 -0.41 0.00 0.00 0.71 0.00 0.00 54.79 55.12 3fei n ASP 328 Cb 0.23 1.25 0.00 0.00 -0.02 0.00 0.00 41.12 42.58 3fei n ASP 328 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3fei n GLY 329 N 1.53 -0.75 3.20 0.44 0.00 -1.20 -0.35 105.19 108.06 3fei n GLY 329 Ca 0.00 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 3fei n GLY 329 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3fei s MET 330 N -2.00 0.79 0.29 1.61 0.23 -0.51 -0.32 119.30 119.38 3fei s MET 330 Ca 0.00 -0.81 -0.26 0.00 -1.03 0.00 0.00 55.69 53.59 3fei s MET 330 Cb 0.00 0.32 -0.09 0.00 -1.53 0.00 0.00 34.83 33.53 3fei s MET 330 CO 0.00 -0.24 0.91 -0.51 -2.03 0.00 0.00 175.02 173.15 3fei s LEU 331 N -2.52 4.41 0.27 0.18 1.43 -0.29 -1.39 118.68 120.78 3fei s LEU 331 Ca 0.01 1.80 0.03 0.00 -1.03 0.00 0.00 54.13 54.93 3fei s LEU 331 Cb 0.02 -3.85 -0.04 0.00 0.03 0.00 0.00 46.19 42.36 3fei s LEU 331 CO -0.08 0.00 0.18 0.68 0.23 0.00 0.00 176.35 177.36 3fei s VAL 332 N -1.50 0.13 -1.16 -1.59 -7.23 0.04 -4.86 120.40 104.23 3fei s VAL 332 Ca 0.47 -2.00 -0.24 0.00 -1.81 0.00 0.00 61.98 58.40 3fei s VAL 332 Cb -0.20 -2.51 0.03 0.00 0.56 0.00 0.00 36.38 34.26 3fei s VAL 332 CO 0.25 0.00 0.45 0.00 -0.31 0.00 0.00 175.10 175.50 3fei n ALA 333 N -0.48 -2.31 -3.18 1.32 0.00 -1.26 -1.43 120.51 113.17 3fei n ALA 333 Ca 0.03 -0.50 -0.22 0.00 0.00 0.00 0.00 53.44 52.74 3fei n ALA 333 Cb 0.65 -1.89 0.05 0.00 0.00 0.00 0.00 19.45 18.26 3fei n ALA 333 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3fei n TYR 334 N -4.55 -2.21 0.00 0.00 4.01 -1.26 -1.02 117.16 112.12 3fei n TYR 334 Ca -0.15 0.66 0.00 0.00 -0.16 0.00 0.00 57.90 58.26 3fei n TYR 334 Cb 0.53 -4.61 0.00 0.00 -0.31 0.00 0.00 39.34 34.95 3fei n TYR 334 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3fei n GLY 335 N -1.66 3.21 0.27 2.72 0.00 -0.95 -4.90 105.19 103.88 3fei n GLY 335 Ca -0.08 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.09 3fei n GLY 335 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3fei h ASN 336 N 0.00 0.00 -3.19 1.61 2.35 -0.99 -3.41 115.58 111.95 3fei h ASN 336 Ca 0.00 0.00 -0.62 0.00 -0.55 0.00 0.00 56.30 55.13 3fei h ASN 336 Cb 0.00 0.00 -0.18 0.00 0.05 0.00 0.00 38.32 38.19 3fei h ASN 336 CO 0.00 0.09 -0.81 -0.83 -1.65 0.00 0.00 177.43 174.23 3fei s GLY 337 N -4.20 1.66 -0.06 2.83 0.00 -0.51 -1.32 107.32 105.72 3fei s GLY 337 Ca -0.01 -1.63 -0.00 0.00 0.00 0.00 0.00 44.72 43.07 3fei s GLY 337 CO 0.56 -1.67 -0.02 -0.12 0.00 0.00 0.00 173.10 171.85 3fei s PHE 338 N -1.82 0.65 -0.10 1.90 2.19 0.05 -0.78 117.98 120.07 3fei s PHE 338 Ca 0.20 -0.16 -0.00 0.00 0.33 0.00 0.00 56.93 57.30 3fei s PHE 338 Cb -0.07 -0.70 -0.03 0.00 -1.31 0.00 0.00 43.02 40.91 3fei s PHE 338 CO 0.10 -0.25 -0.07 -1.50 1.83 0.00 0.00 175.22 175.32 3fei s ILE 339 N 1.45 3.62 0.35 3.12 2.07 -0.49 0.01 121.20 131.34 3fei s ILE 339 Ca -0.03 -0.49 -0.13 0.00 -1.41 0.00 0.00 60.65 58.59 3fei s ILE 339 Cb -0.13 -2.51 -0.08 0.00 0.13 0.00 0.00 42.46 39.87 3fei s ILE 339 CO -0.03 0.56 0.74 0.42 -1.91 0.00 0.00 174.94 174.72 3fei s THR 340 N -0.33 4.73 0.25 4.00 -4.23 -0.96 -1.43 115.64 117.67 3fei s THR 340 Ca 0.05 0.80 -0.03 0.00 -1.18 0.00 0.00 61.69 61.32 3fei s THR 340 Cb -0.12 -3.65 0.13 0.00 1.34 0.00 0.00 72.50 70.19 3fei s THR 340 CO 0.02 -0.30 1.77 -0.09 -0.54 0.00 0.00 174.62 175.48 3fei h ARG 341 N 1.90 0.91 -0.24 3.99 2.43 -1.02 -2.84 114.38 119.50 3fei h ARG 341 Ca -0.48 -0.21 -0.15 0.00 -0.81 0.00 0.00 59.98 58.33 3fei h ARG 341 Cb 1.18 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.61 3fei h ARG 341 CO 0.65 0.84 -0.42 1.49 -1.51 0.00 0.00 179.97 181.01 3fei h GLU 342 N 0.86 0.72 -0.78 0.20 4.57 -1.94 -1.51 114.58 116.70 3fei h GLU 342 Ca 0.18 -0.45 0.04 0.00 -1.18 0.00 0.00 59.36 57.95 3fei h GLU 342 Cb 0.37 0.05 -0.05 0.00 -0.16 0.00 0.00 28.75 28.96 3fei h GLU 342 CO 0.01 1.07 0.49 0.35 -1.18 0.00 0.00 179.01 179.75 3fei h PHE 343 N 0.45 0.91 -0.34 0.92 3.57 -1.81 -2.47 116.94 118.17 3fei h PHE 343 Ca 0.02 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 3fei h PHE 343 Cb 1.02 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.45 3fei h PHE 343 CO 0.08 0.50 0.06 -0.07 -2.23 0.00 0.00 178.31 176.66 3fei h LEU 344 N 0.94 0.54 -2.37 0.59 3.38 -1.35 -2.65 115.31 114.38 3fei h LEU 344 Ca 0.32 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3fei h LEU 344 Cb 0.06 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3fei h LEU 344 CO -0.13 0.65 0.08 0.11 0.09 0.00 0.00 178.44 179.24 3fei h LYS 345 N 0.40 0.00 -0.42 1.13 1.57 -1.03 -3.00 116.57 115.22 3fei h LYS 345 Ca 0.10 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3fei h LYS 345 Cb 0.34 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.63 3fei h LYS 345 CO 0.01 0.00 0.03 -1.13 -0.57 0.00 0.00 179.45 177.79 3fei n SER 346 N -2.81 4.45 -4.93 0.86 3.41 -0.95 -4.84 113.62 108.80 3fei n SER 346 Ca -0.02 -3.07 -0.25 0.00 -0.26 0.00 0.00 58.87 55.26 3fei n SER 346 Cb 0.13 -0.62 0.06 0.00 -0.26 0.00 0.00 64.21 63.52 3fei n SER 346 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3fei s LEU 347 N -2.87 2.98 0.35 1.04 1.43 -1.13 -5.04 118.68 115.43 3fei s LEU 347 Ca 0.48 0.45 -0.26 0.00 -1.03 0.00 0.00 54.13 53.77 3fei s LEU 347 Cb 0.38 -3.17 -0.09 0.00 0.03 0.00 0.00 46.19 43.34 3fei s LEU 347 CO 0.11 -1.41 1.04 0.00 0.23 0.00 0.00 176.35 176.32 3fei s ARG 348 N -5.12 4.39 0.30 1.70 1.70 -1.26 -4.27 118.95 116.39 3fei s ARG 348 Ca 0.58 1.57 -0.29 0.00 -0.47 0.00 0.00 55.73 57.12 3fei s ARG 348 Cb -0.11 -2.80 -0.13 0.00 -0.57 0.00 0.00 34.95 31.35 3fei s ARG 348 CO 0.44 0.05 1.22 1.63 -1.08 0.00 0.00 175.30 177.56 3fei n LYS 349 N 0.45 1.83 -0.31 3.89 5.02 -1.26 -1.41 118.16 126.36 3fei n LYS 349 Ca 0.03 0.64 0.11 0.00 -2.02 0.00 0.00 58.31 57.07 3fei n LYS 349 Cb 0.48 -2.17 0.29 0.00 -0.02 0.00 0.00 35.03 33.61 3fei n LYS 349 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 3fei n PRO 350 N 0.93 2.57 0.24 1.97 -0.04 -1.26 -4.93 135.00 134.48 3fei n PRO 350 Ca 0.08 -2.43 0.07 0.00 -0.04 0.00 0.00 63.50 61.18 3fei n PRO 350 Cb 0.33 -1.53 0.58 0.00 -0.04 0.00 0.00 33.50 32.84 3fei n PRO 350 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3fei h PHE 351 N 4.15 0.00 0.00 0.54 0.04 -1.56 -1.56 116.94 118.55 3fei h PHE 351 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3fei h PHE 351 Cb 0.94 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.09 3fei h PHE 351 CO 0.41 0.16 0.00 0.00 -0.60 0.00 0.00 178.31 178.27 3fei n ASP 353 N -1.40 1.58 -0.02 0.00 8.00 -0.59 -4.48 116.55 119.65 3fei n ASP 353 Ca 0.04 -1.24 -0.13 0.00 0.71 0.00 0.00 54.79 54.17 3fei n ASP 353 Cb 0.11 0.31 -0.10 0.00 -0.02 0.00 0.00 41.12 41.41 3fei n ASP 353 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3fei h ILE 354 N 1.91 1.43 0.07 0.53 2.04 -1.64 -3.39 117.51 118.46 3fei h ILE 354 Ca 0.00 -1.50 -0.30 0.00 1.00 0.00 0.00 64.86 64.06 3fei h ILE 354 Cb 0.64 2.42 -0.03 0.00 -0.74 0.00 0.00 36.82 39.12 3fei h ILE 354 CO 0.00 0.38 -1.62 0.24 0.00 0.00 0.00 178.15 177.15 3fei h MET 355 N -0.69 0.14 -0.49 2.37 2.86 -1.80 -3.41 114.93 113.91 3fei h MET 355 Ca -0.00 -0.24 0.06 0.00 -2.06 0.00 0.00 59.70 57.45 3fei h MET 355 Cb 0.64 0.09 -0.05 0.00 0.06 0.00 0.00 31.60 32.34 3fei h MET 355 CO 0.01 0.91 0.20 1.49 1.06 0.00 0.00 176.91 180.57 3fei h GLU 356 N 0.04 0.38 0.00 1.72 4.57 -1.78 0.08 114.58 119.58 3fei h GLU 356 Ca -0.27 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 57.88 3fei h GLU 356 Cb 1.99 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 30.50 3fei h GLU 356 CO 0.12 0.25 -0.05 -1.35 -1.18 0.00 0.00 179.01 176.80 3fei h PRO 357 N 0.39 0.00 -0.19 0.92 0.11 -1.79 -0.74 132.00 130.70 3fei h PRO 357 Ca 0.23 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 66.15 3fei h PRO 357 Cb 0.21 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.33 3fei h PRO 357 CO -0.21 0.05 -0.61 0.87 -0.21 0.00 0.00 178.00 177.88 3fei h LYS 358 N 0.00 0.75 -0.42 1.05 6.56 -1.24 -1.07 116.57 122.21 3fei h LYS 358 Ca -0.00 -0.55 0.05 0.00 -1.06 0.00 0.00 60.65 59.09 3fei h LYS 358 Cb 0.09 0.10 -0.05 0.00 -0.57 0.00 0.00 32.23 31.80 3fei h LYS 358 CO 0.01 1.17 0.15 0.74 -2.06 0.00 0.00 179.45 179.46 3fei h PHE 359 N 0.48 0.27 -0.17 -1.35 0.04 -0.98 0.21 116.94 115.44 3fei h PHE 359 Ca -0.02 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.81 3fei h PHE 359 Cb 1.23 -0.06 -0.04 0.00 2.20 0.00 0.00 35.95 39.29 3fei h PHE 359 CO 0.09 0.10 -0.06 0.22 -0.60 0.00 0.00 178.31 178.06 3fei h ASP 360 N 0.32 -0.22 -0.37 2.17 1.82 -0.99 -0.07 116.42 119.08 3fei h ASP 360 Ca 0.19 0.06 -0.02 0.00 -0.39 0.00 0.00 57.03 56.87 3fei h ASP 360 Cb 0.17 0.13 -0.02 0.00 0.68 0.00 0.00 39.33 40.30 3fei h ASP 360 CO -0.19 -0.09 0.15 0.15 -1.61 0.00 0.00 179.24 177.65 3fei h PHE 361 N -0.04 0.56 -0.33 0.28 3.04 -0.96 -3.23 116.94 116.27 3fei h PHE 361 Ca 0.09 -0.04 0.03 0.00 3.98 0.00 0.00 57.97 62.02 3fei h PHE 361 Cb 0.17 -0.17 -0.03 0.00 2.56 0.00 0.00 35.95 38.48 3fei h PHE 361 CO -0.21 0.51 0.15 0.00 -2.02 0.00 0.00 178.31 176.74 3fei h ALA 362 N 1.00 0.40 -0.61 2.41 0.00 -0.04 -1.72 119.26 120.69 3fei h ALA 362 Ca 0.12 0.02 0.12 0.00 0.00 0.00 0.00 54.91 55.17 3fei h ALA 362 Cb 0.18 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.85 3fei h ALA 362 CO -0.01 -0.23 0.12 0.52 0.00 0.00 0.00 179.25 179.65 3fei h MET 363 N 0.32 0.25 -0.16 0.00 2.86 -1.04 0.52 114.93 117.67 3fei h MET 363 Ca 0.14 -0.01 -0.16 0.00 -2.06 0.00 0.00 59.70 57.60 3fei h MET 363 Cb 0.07 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 3fei h MET 363 CO -0.11 0.16 -0.57 0.87 1.06 0.00 0.00 176.91 178.32 3fei h LYS 364 N 0.25 0.51 -0.13 1.72 1.57 -1.56 -2.33 116.57 116.60 3fei h LYS 364 Ca 0.32 -0.33 -0.07 0.00 -1.87 0.00 0.00 60.65 58.70 3fei h LYS 364 Cb 0.49 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.84 3fei h LYS 364 CO -0.42 0.94 -0.20 0.35 -0.57 0.00 0.00 179.45 179.55 3fei h PHE 365 N 0.39 0.45 0.00 -1.35 3.04 -0.52 -3.10 116.94 115.85 3fei h PHE 365 Ca 0.00 -0.16 -0.02 0.00 3.98 0.00 0.00 57.97 61.77 3fei h PHE 365 Cb 1.11 -0.09 -0.00 0.00 2.56 0.00 0.00 35.95 39.53 3fei h PHE 365 CO 0.04 0.82 -0.11 -0.91 -2.02 0.00 0.00 178.31 176.13 3fei h ASN 366 N -0.04 0.00 0.66 0.41 -0.26 -0.03 -1.90 115.58 114.42 3fei h ASN 366 Ca 0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 3fei h ASN 366 Cb 0.78 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.04 3fei h ASN 366 CO 0.05 0.11 0.00 0.00 -1.06 0.00 0.00 177.43 176.53 3fei h ALA 367 N 1.89 1.00 0.00 -0.83 0.00 -1.34 -2.21 119.26 117.77 3fei h ALA 367 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fei h ALA 367 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3fei h ALA 367 CO 0.01 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.54 3fei n LEU 368 N -2.57 0.00 -3.41 0.00 4.77 -0.71 -4.93 117.00 110.15 3fei n LEU 368 Ca 0.01 0.39 -0.25 0.00 -0.03 0.00 0.00 56.01 56.13 3fei n LEU 368 Cb 0.21 -0.39 0.02 0.00 -2.33 0.00 0.00 43.42 40.93 3fei n LEU 368 CO 0.21 -0.06 0.02 -0.62 -1.33 0.00 0.00 177.39 175.60 3fei n GLU 369 N -1.39 -4.50 -2.19 3.23 1.02 -0.83 -4.97 120.64 111.01 3fei n GLU 369 Ca 0.09 0.64 -0.35 0.00 -0.02 0.00 0.00 57.16 57.52 3fei n GLU 369 Cb 0.24 -5.45 0.01 0.00 -0.02 0.00 0.00 31.44 26.22 3fei n GLU 369 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3fei s LEU 370 N -6.77 3.74 0.55 -4.62 1.43 -1.26 -5.08 118.68 106.67 3fei s LEU 370 Ca 0.44 2.24 0.07 0.00 -1.03 0.00 0.00 54.13 55.86 3fei s LEU 370 Cb -0.22 -4.57 0.05 0.00 0.03 0.00 0.00 46.19 41.48 3fei s LEU 370 CO 0.55 -1.30 0.53 1.51 0.23 0.00 0.00 176.35 177.87 3fei s ASP 371 N -1.70 4.81 0.41 2.29 1.47 -1.26 -4.99 116.67 117.70 3fei s ASP 371 Ca 0.73 -1.08 0.08 0.00 1.18 0.00 0.00 52.55 53.46 3fei s ASP 371 Cb -0.26 0.31 0.87 0.00 -0.34 0.00 0.00 42.92 43.50 3fei s ASP 371 CO 0.29 -1.15 2.03 0.44 0.68 0.00 0.00 175.17 177.46 3fei h ASP 372 N 0.58 0.48 -0.77 2.11 3.32 -1.97 -2.10 116.42 118.06 3fei h ASP 372 Ca -0.35 -0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.65 3fei h ASP 372 Cb 1.30 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.70 3fei h ASP 372 CO 0.52 0.34 0.31 0.77 -1.72 0.00 0.00 179.24 179.46 3fei h SER 373 N 0.56 1.06 -0.32 6.45 4.64 -1.96 0.13 113.55 124.12 3fei h SER 373 Ca 0.19 -0.17 -0.04 0.00 -0.47 0.00 0.00 61.79 61.30 3fei h SER 373 Cb 0.07 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.87 3fei h SER 373 CO -0.05 0.94 0.05 0.44 -0.87 0.00 0.00 176.83 177.35 3fei h ASP 374 N 1.12 0.51 -0.69 4.97 3.32 -1.83 -3.14 116.42 120.68 3fei h ASP 374 Ca 0.26 -0.26 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3fei h ASP 374 Cb 0.21 -0.14 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 3fei h ASP 374 CO -0.02 0.64 0.35 0.40 -1.72 0.00 0.00 179.24 178.89 3fei h ILE 375 N 0.36 1.22 -0.64 0.35 2.04 -0.86 -1.03 117.51 118.96 3fei h ILE 375 Ca 0.10 -0.60 0.09 0.00 1.00 0.00 0.00 64.86 65.44 3fei h ILE 375 Cb 0.35 0.35 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 3fei h ILE 375 CO 0.01 0.25 0.28 0.77 0.00 0.00 0.00 178.15 179.46 3fei h SER 376 N 0.96 0.33 -0.18 1.72 4.64 -0.71 0.27 113.55 120.59 3fei h SER 376 Ca 0.24 0.07 -0.12 0.00 -0.47 0.00 0.00 61.79 61.50 3fei h SER 376 Cb 0.08 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 3fei h SER 376 CO -0.03 0.20 -0.36 -0.07 -0.87 0.00 0.00 176.83 175.69 3fei h LEU 377 N 0.49 0.63 -0.44 5.97 3.38 -1.46 -1.22 115.31 122.67 3fei h LEU 377 Ca 0.31 -0.55 0.07 0.00 0.09 0.00 0.00 57.88 57.80 3fei h LEU 377 Cb 0.34 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.86 3fei h LEU 377 CO -0.27 1.06 0.11 0.15 0.09 0.00 0.00 178.44 179.57 3fei h PHE 378 N 0.22 0.18 -0.41 1.13 3.57 -0.89 -1.29 116.94 119.45 3fei h PHE 378 Ca 0.01 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.46 3fei h PHE 378 Cb 0.96 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 3fei h PHE 378 CO 0.09 0.03 -0.01 0.28 -2.23 0.00 0.00 178.31 176.48 3fei h VAL 379 N 0.25 1.26 -0.96 1.41 2.07 -0.36 -1.60 116.25 118.32 3fei h VAL 379 Ca 0.21 -1.03 0.14 0.00 0.82 0.00 0.00 66.70 66.84 3fei h VAL 379 Cb 0.25 1.11 -0.09 0.00 -1.52 0.00 0.00 31.29 31.04 3fei h VAL 379 CO -0.26 0.35 0.57 0.00 0.02 0.00 0.00 177.57 178.25 3fei h ALA 380 N 0.89 1.48 -0.13 1.67 0.00 -1.02 -1.90 119.26 120.26 3fei h ALA 380 Ca 0.12 0.05 -0.21 0.00 0.00 0.00 0.00 54.91 54.87 3fei h ALA 380 Cb 0.49 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3fei h ALA 380 CO 0.02 0.08 -0.75 0.00 0.00 0.00 0.00 179.25 178.60 3fei h ALA 381 N 1.57 0.43 -0.55 0.00 0.00 -0.89 -1.31 119.26 118.50 3fei h ALA 381 Ca 0.51 -0.60 0.09 0.00 0.00 0.00 0.00 54.91 54.91 3fei h ALA 381 Cb 0.63 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.31 3fei h ALA 381 CO -0.32 0.71 0.16 0.82 0.00 0.00 0.00 179.25 180.62 3fei h ILE 382 N 0.45 0.73 -0.01 0.00 2.04 -1.00 -3.27 117.51 116.45 3fei h ILE 382 Ca -0.04 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 3fei h ILE 382 Cb 1.36 0.40 0.00 0.00 -0.74 0.00 0.00 36.82 37.84 3fei h ILE 382 CO 0.15 0.06 -0.04 0.40 0.00 0.00 0.00 178.15 178.71 3fei h ILE 383 N 0.31 1.48 -0.49 -0.67 2.04 -1.06 -3.37 117.51 115.75 3fei h ILE 383 Ca 0.28 -1.46 -0.72 0.00 1.00 0.00 0.00 64.86 63.96 3fei h ILE 383 Cb 0.37 2.43 -0.08 0.00 -0.74 0.00 0.00 36.82 38.80 3fei h ILE 383 CO -0.32 0.39 2.72 0.00 0.00 0.00 0.00 178.15 180.94 3fei n GLY 386 N 4.41 -1.26 0.91 0.00 0.00 -1.26 -3.52 105.19 104.48 3fei n GLY 386 Ca -0.19 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.76 3fei n GLY 386 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3fei n ASP 387 N -1.26 3.81 -4.75 1.61 5.75 -1.26 -4.87 116.55 115.58 3fei n ASP 387 Ca 0.15 -2.77 -0.41 0.00 -0.01 0.00 0.00 54.79 51.75 3fei n ASP 387 Cb 0.23 -0.48 -0.02 0.00 -1.03 0.00 0.00 41.12 39.82 3fei n ASP 387 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3fei s ARG 388 N -2.38 4.32 0.38 0.11 1.81 -1.23 -4.93 118.95 117.03 3fei s ARG 388 Ca 0.39 2.24 -0.28 0.00 -1.72 0.00 0.00 55.73 56.36 3fei s ARG 388 Cb 0.30 -3.10 -0.11 0.00 -0.45 0.00 0.00 34.95 31.59 3fei s ARG 388 CO 0.11 -0.30 1.49 -2.14 -0.68 0.00 0.00 175.30 173.78 3fei s PRO 389 N -0.97 4.07 -0.37 3.54 0.02 -1.26 -3.31 135.00 136.72 3fei s PRO 389 Ca 0.54 2.59 0.00 0.00 0.02 0.00 0.00 61.00 64.15 3fei s PRO 389 Cb -0.40 -2.94 0.00 0.00 0.02 0.00 0.00 34.50 31.17 3fei s PRO 389 CO 0.47 -0.57 0.00 0.41 -0.33 0.00 0.00 177.00 176.98 3fei n GLY 390 N 0.44 0.62 3.75 0.52 0.00 -1.26 -5.01 105.19 104.25 3fei n GLY 390 Ca 0.01 -0.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 3fei n GLY 390 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fei s LEU 391 N -0.83 4.49 -0.11 0.99 1.43 -1.21 -4.99 118.68 118.46 3fei s LEU 391 Ca 0.00 2.27 -0.03 0.00 -1.03 0.00 0.00 54.13 55.34 3fei s LEU 391 Cb 0.00 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.59 3fei s LEU 391 CO 0.00 -0.28 -0.05 -0.07 0.23 0.00 0.00 176.35 176.18 3fei h LEU 392 N 4.52 0.00 -6.91 1.79 3.38 -1.94 -3.40 115.31 112.74 3fei h LEU 392 Ca -0.46 0.00 -0.80 0.00 0.09 0.00 0.00 57.88 56.71 3fei h LEU 392 Cb 1.21 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 41.70 3fei h LEU 392 CO 0.71 0.56 0.91 -3.20 0.09 0.00 0.00 178.44 177.51 3fei n ASN 393 N -4.68 6.21 -0.36 -0.43 4.05 -1.26 -4.84 115.26 113.96 3fei n ASN 393 Ca -0.02 -3.35 0.07 0.00 0.45 0.00 0.00 54.58 51.72 3fei n ASN 393 Cb 0.07 -1.31 0.23 0.00 1.23 0.00 0.00 39.78 40.01 3fei n ASN 393 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 177.26 174.79 3fei h VAL 394 N 3.49 0.93 -0.04 3.44 2.07 -1.90 -3.00 116.25 121.23 3fei h VAL 394 Ca 0.22 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.42 3fei h VAL 394 Cb 0.63 -0.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 3fei h VAL 394 CO 1.35 0.18 -0.06 1.23 0.02 0.00 0.00 177.57 180.29 3fei h GLY 395 N 0.98 -0.03 1.02 2.17 0.00 -1.93 0.97 103.07 106.24 3fei h GLY 395 Ca 0.49 0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.85 3fei h GLY 395 CO -0.26 -0.07 0.30 0.84 0.00 0.00 0.00 176.54 177.35 3fei h HIS 396 N -0.09 1.05 -0.31 5.60 6.17 -1.95 -2.47 115.15 123.14 3fei h HIS 396 Ca 0.04 -0.07 -0.16 0.00 0.71 0.00 0.00 60.37 60.89 3fei h HIS 396 Cb 0.15 -0.32 -0.01 0.00 2.52 0.00 0.00 27.41 29.75 3fei h HIS 396 CO -0.15 0.80 -0.43 0.82 0.71 0.00 0.00 177.93 179.68 3fei h ILE 397 N 0.99 1.28 -0.55 6.26 2.04 -1.38 0.40 117.51 126.55 3fei h ILE 397 Ca 0.24 -1.61 0.05 0.00 1.00 0.00 0.00 64.86 64.54 3fei h ILE 397 Cb 0.18 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3fei h ILE 397 CO -0.02 0.53 0.37 -0.33 0.00 0.00 0.00 178.15 178.69 3fei h GLU 398 N 0.64 0.53 -0.00 2.37 5.08 -0.77 0.14 114.58 122.56 3fei h GLU 398 Ca 0.04 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.26 3fei h GLU 398 Cb 1.00 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 30.14 3fei h GLU 398 CO 0.10 0.35 -0.44 0.87 -1.00 0.00 0.00 179.01 178.88 3fei h LYS 399 N 0.54 0.30 -0.46 2.33 6.56 -0.90 -0.94 116.57 124.00 3fei h LYS 399 Ca 0.23 -0.32 0.09 0.00 -1.06 0.00 0.00 60.65 59.60 3fei h LYS 399 Cb 0.24 0.09 -0.09 0.00 -0.57 0.00 0.00 32.23 31.90 3fei h LYS 399 CO -0.07 1.02 -0.19 0.52 -2.06 0.00 0.00 179.45 178.68 3fei h MET 400 N -0.29 -0.08 -0.37 3.15 2.86 -0.80 -1.95 114.93 117.44 3fei h MET 400 Ca -0.06 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 3fei h MET 400 Cb 1.18 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.84 3fei h MET 400 CO 0.09 -0.06 0.21 0.37 1.06 0.00 0.00 176.91 178.58 3fei h GLN 401 N -0.09 0.52 -0.75 1.72 4.15 -0.70 -2.35 115.11 117.62 3fei h GLN 401 Ca 0.22 -0.06 0.14 0.00 0.77 0.00 0.00 58.65 59.72 3fei h GLN 401 Cb 0.43 -0.10 -0.09 0.00 0.21 0.00 0.00 27.48 27.92 3fei h GLN 401 CO -0.52 0.42 0.29 1.49 -1.93 0.00 0.00 178.83 178.58 3fei h GLU 402 N 0.48 0.42 -0.39 1.69 4.81 -0.91 0.55 114.58 121.23 3fei h GLU 402 Ca 0.13 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3fei h GLU 402 Cb 0.05 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3fei h GLU 402 CO -0.02 0.28 0.24 0.78 -0.73 0.00 0.00 179.01 179.56 3fei h GLY 403 N 0.43 0.55 0.70 1.92 0.00 -1.03 -1.99 103.07 103.65 3fei h GLY 403 Ca 0.41 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.49 3fei h GLY 403 CO -0.40 0.21 -0.05 -2.22 0.00 0.00 0.00 176.54 174.08 3fei h ILE 404 N 0.51 1.32 -0.92 2.60 2.04 -0.71 -1.81 117.51 120.55 3fei h ILE 404 Ca 0.14 -1.07 0.04 0.00 1.00 0.00 0.00 64.86 64.97 3fei h ILE 404 Cb -0.03 1.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.82 3fei h ILE 404 CO -0.03 0.30 0.60 0.58 0.00 0.00 0.00 178.15 179.61 3fei h VAL 405 N -0.14 1.14 0.01 1.67 2.07 -0.99 0.87 116.25 120.87 3fei h VAL 405 Ca 0.02 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 3fei h VAL 405 Cb 0.50 -0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 3fei h VAL 405 CO 0.02 0.21 -0.01 -0.74 0.02 0.00 0.00 177.57 177.06 3fei h HIS 406 N 1.13 -0.02 -0.25 1.57 -0.00 -1.21 -0.48 115.15 115.89 3fei h HIS 406 Ca 0.37 -0.00 -0.06 0.00 -0.00 0.00 0.00 60.37 60.69 3fei h HIS 406 Cb 0.06 0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 27.46 3fei h HIS 406 CO -0.00 0.16 -0.09 0.28 -0.00 0.00 0.00 177.93 178.28 3fei h VAL 407 N -0.19 1.20 -0.42 5.26 2.07 -0.94 -2.28 116.25 120.95 3fei h VAL 407 Ca -0.00 -0.85 -0.09 0.00 0.82 0.00 0.00 66.70 66.57 3fei h VAL 407 Cb 0.19 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 3fei h VAL 407 CO 0.00 0.28 -0.11 0.25 0.02 0.00 0.00 177.57 178.01 3fei h LEU 408 N 0.38 0.82 -0.10 2.57 5.85 -0.63 -1.25 115.31 122.95 3fei h LEU 408 Ca 0.08 -0.37 0.03 0.00 0.84 0.00 0.00 57.88 58.46 3fei h LEU 408 Cb 0.39 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.17 3fei h LEU 408 CO 0.02 0.99 -0.07 -0.09 -0.34 0.00 0.00 178.44 178.95 3fei h ARG 409 N 0.63 -0.08 -0.81 1.25 2.43 -0.66 -1.39 114.38 115.75 3fei h ARG 409 Ca 0.10 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3fei h ARG 409 Cb 0.64 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.17 3fei h ARG 409 CO 0.04 -0.05 0.51 -0.07 -1.51 0.00 0.00 179.97 178.90 3fei h LEU 410 N -0.08 0.95 -0.46 3.80 3.38 -1.39 -2.59 115.31 118.92 3fei h LEU 410 Ca 0.06 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 3fei h LEU 410 Cb 0.17 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3fei h LEU 410 CO -0.15 0.71 0.09 -0.74 0.09 0.00 0.00 178.44 178.45 3fei h HIS 411 N 1.11 0.80 -0.56 1.13 2.76 -0.83 -2.79 115.15 116.77 3fei h HIS 411 Ca 0.29 -0.11 -0.07 0.00 -2.20 0.00 0.00 60.37 58.29 3fei h HIS 411 Cb -0.09 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 28.63 3fei h HIS 411 CO -0.01 0.74 0.06 -0.07 -1.30 0.00 0.00 177.93 177.35 3fei h LEU 412 N 0.63 0.88 -0.74 0.26 3.38 -1.15 0.56 115.31 119.12 3fei h LEU 412 Ca 0.14 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.92 3fei h LEU 412 Cb 0.36 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 3fei h LEU 412 CO 0.01 0.90 0.49 1.56 0.09 0.00 0.00 178.44 181.48 3fei h GLN 413 N 0.86 0.96 0.11 1.13 4.20 -1.28 0.38 115.11 121.47 3fei h GLN 413 Ca 0.17 -0.06 -0.30 0.00 0.06 0.00 0.00 58.65 58.52 3fei h GLN 413 Cb 0.42 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.98 3fei h GLN 413 CO 0.01 0.63 -1.51 0.66 -0.67 0.00 0.00 178.83 177.96 3fei h SER 414 N 0.98 0.37 0.82 1.46 4.64 -1.36 -3.14 113.55 117.33 3fei h SER 414 Ca 0.28 -0.51 -0.17 0.00 -0.47 0.00 0.00 61.79 60.91 3fei h SER 414 Cb -0.09 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 61.86 3fei h SER 414 CO -0.07 1.42 -0.83 -1.13 -0.87 0.00 0.00 176.83 175.35 3fei h ASN 415 N 0.06 0.01 -2.06 4.97 -1.24 -0.82 -3.38 115.58 113.12 3fei h ASN 415 Ca -0.23 -0.01 -0.52 0.00 0.71 0.00 0.00 56.30 56.25 3fei h ASN 415 Cb 2.01 -0.00 -0.40 0.00 0.73 0.00 0.00 38.32 40.65 3fei h ASN 415 CO 0.16 0.84 -1.05 1.41 -1.29 0.00 0.00 177.43 177.49 3fei n HIS 416 N -3.56 0.95 0.07 0.67 8.25 0.13 -4.99 115.22 116.74 3fei n HIS 416 Ca -0.01 -3.82 0.04 0.00 -0.26 0.00 0.00 57.72 53.67 3fei n HIS 416 Cb 0.79 -0.43 0.44 0.00 1.12 0.00 0.00 29.99 31.92 3fei n HIS 416 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3fei h PRO 417 N 3.25 0.38 0.00 -0.41 0.11 -1.70 -1.94 132.00 131.69 3fei h PRO 417 Ca 0.11 -0.04 -0.07 0.00 0.11 0.00 0.00 66.00 66.11 3fei h PRO 417 Cb 0.85 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.88 3fei h PRO 417 CO 0.57 0.32 -0.32 -0.44 -0.21 0.00 0.00 178.00 177.92 3fei h ASP 418 N 0.38 0.00 -2.74 -2.05 3.45 -1.93 -3.40 116.42 110.13 3fei h ASP 418 Ca 0.10 0.00 -0.69 0.00 0.43 0.00 0.00 57.03 56.87 3fei h ASP 418 Cb 0.09 0.00 -0.18 0.00 -0.56 0.00 0.00 39.33 38.67 3fei h ASP 418 CO -0.01 0.32 0.50 -0.62 -1.57 0.00 0.00 179.24 177.86 3fei s ASP 419 N -6.37 6.41 0.20 6.45 -1.08 -0.73 -4.88 116.67 116.68 3fei s ASP 419 Ca 0.00 -1.70 -0.03 0.00 -0.52 0.00 0.00 52.55 50.30 3fei s ASP 419 Cb 0.11 -2.36 0.15 0.00 -1.46 0.00 0.00 42.92 39.36 3fei s ASP 419 CO 0.67 -1.12 1.55 0.40 0.52 0.00 0.00 175.17 177.19 3fei h ILE 420 N 5.79 1.30 -0.60 4.11 1.08 -1.82 -3.18 117.51 124.18 3fei h ILE 420 Ca -0.08 -1.63 0.00 0.00 -0.39 0.00 0.00 64.86 62.77 3fei h ILE 420 Cb 1.05 1.59 0.00 0.00 -3.07 0.00 0.00 36.82 36.39 3fei h ILE 420 CO 1.09 0.52 0.00 0.49 -0.69 0.00 0.00 178.15 179.55 3fei n PHE 421 N -4.01 0.80 -0.14 1.37 3.72 -1.26 -4.59 117.46 113.35 3fei n PHE 421 Ca -0.02 -0.40 -0.04 0.00 -0.05 0.00 0.00 57.45 56.94 3fei n PHE 421 Cb 0.54 0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.10 3fei n PHE 421 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3fei h LEU 422 N 4.17 -0.50 0.08 4.37 5.85 -1.93 0.50 115.31 127.85 3fei h LEU 422 Ca 0.00 0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.87 3fei h LEU 422 Cb 0.94 0.31 -0.03 0.00 0.37 0.00 0.00 40.66 42.26 3fei h LEU 422 CO 0.00 -0.18 -0.30 0.15 -0.34 0.00 0.00 178.44 177.77 3fei h PHE 423 N -0.04 -0.87 -0.90 1.25 3.57 -1.85 0.12 116.94 118.23 3fei h PHE 423 Ca 0.21 0.02 0.26 0.00 3.53 0.00 0.00 57.97 62.00 3fei h PHE 423 Cb 0.37 0.37 -0.04 0.00 2.79 0.00 0.00 35.95 39.44 3fei h PHE 423 CO -0.41 -0.34 0.65 -1.35 -2.23 0.00 0.00 178.31 174.63 3fei h PRO 424 N -0.44 0.00 -0.22 6.41 0.11 -1.84 -1.54 132.00 134.48 3fei h PRO 424 Ca -0.01 0.00 -0.10 0.00 0.11 0.00 0.00 66.00 66.00 3fei h PRO 424 Cb 0.44 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.54 3fei h PRO 424 CO -0.15 0.00 -0.27 0.87 -0.21 0.00 0.00 178.00 178.24 3fei h LYS 425 N 0.00 0.58 0.08 1.05 1.57 0.29 -2.48 116.57 117.65 3fei h LYS 425 Ca 0.43 -0.32 0.02 0.00 -1.87 0.00 0.00 60.65 58.90 3fei h LYS 425 Cb 1.72 0.02 -0.03 0.00 0.08 0.00 0.00 32.23 34.02 3fei h LYS 425 CO -0.00 0.92 -0.17 -0.07 -0.57 0.00 0.00 179.45 179.55 3fei h LEU 426 N 0.27 -0.48 -0.90 2.94 3.38 0.16 -1.82 115.31 118.86 3fei h LEU 426 Ca 0.03 0.06 0.24 0.00 0.09 0.00 0.00 57.88 58.30 3fei h LEU 426 Cb 0.83 0.19 -0.14 0.00 0.09 0.00 0.00 40.66 41.63 3fei h LEU 426 CO 0.06 -0.24 0.30 -0.07 0.09 0.00 0.00 178.44 178.58 3fei h LEU 427 N -0.32 0.12 -0.79 1.67 4.07 -1.40 0.47 115.31 119.13 3fei h LEU 427 Ca 0.03 0.19 0.01 0.00 0.08 0.00 0.00 57.88 58.19 3fei h LEU 427 Cb 0.35 0.23 -0.04 0.00 1.08 0.00 0.00 40.66 42.28 3fei h LEU 427 CO -0.11 -0.13 0.52 -0.61 -1.08 0.00 0.00 178.44 177.03 3fei h GLN 428 N 0.25 1.03 -0.65 1.13 5.75 -0.98 -2.79 115.11 118.85 3fei h GLN 428 Ca 0.58 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 59.00 3fei h GLN 428 Cb 1.18 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 29.47 3fei h GLN 428 CO -0.63 0.68 0.33 0.87 -2.65 0.00 0.00 178.83 177.43 3fei h LYS 429 N 1.06 0.90 -0.31 1.69 1.79 0.70 -1.45 116.57 120.95 3fei h LYS 429 Ca 0.29 -0.11 0.05 0.00 -2.18 0.00 0.00 60.65 58.71 3fei h LYS 429 Cb -0.11 -0.18 -0.05 0.00 -1.58 0.00 0.00 32.23 30.31 3fei h LYS 429 CO -0.07 0.68 0.01 0.52 -1.08 0.00 0.00 179.45 179.52 3fei h MET 430 N 0.91 0.10 -0.14 3.15 2.86 -0.83 0.39 114.93 121.37 3fei h MET 430 Ca 0.23 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.78 3fei h MET 430 Cb 0.06 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 3fei h MET 430 CO -0.03 0.07 -0.26 0.00 1.06 0.00 0.00 176.91 177.74 3fei h ALA 431 N 1.26 1.30 -0.34 6.32 0.00 -1.35 -2.53 119.26 123.92 3fei h ALA 431 Ca 0.15 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 3fei h ALA 431 Cb 0.19 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3fei h ALA 431 CO -0.24 0.48 -0.18 -0.44 0.00 0.00 0.00 179.25 178.86 3fei h ASP 432 N 0.23 0.62 -0.34 0.00 5.19 -0.70 -2.93 116.42 118.48 3fei h ASP 432 Ca 0.04 -0.20 -0.11 0.00 -0.62 0.00 0.00 57.03 56.14 3fei h ASP 432 Cb 0.59 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 39.93 3fei h ASP 432 CO 0.04 0.81 -0.22 -0.07 -3.12 0.00 0.00 179.24 176.69 3fei h LEU 433 N 0.56 0.78 -0.52 1.55 3.38 -0.64 -0.58 115.31 119.84 3fei h LEU 433 Ca 0.09 -0.43 0.10 0.00 0.09 0.00 0.00 57.88 57.73 3fei h LEU 433 Cb 0.63 -0.22 -0.09 0.00 0.09 0.00 0.00 40.66 41.07 3fei h LEU 433 CO 0.04 1.04 -0.03 0.03 0.09 0.00 0.00 178.44 179.62 3fei h ARG 434 N 0.53 0.09 -0.37 1.13 3.08 -1.40 0.69 114.38 118.12 3fei h ARG 434 Ca 0.07 -0.01 -0.09 0.00 0.07 0.00 0.00 59.98 60.03 3fei h ARG 434 Cb 0.77 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.79 3fei h ARG 434 CO 0.06 0.06 -0.11 0.37 -1.07 0.00 0.00 179.97 179.28 3fei h GLN 435 N 0.09 0.73 -0.60 0.04 5.75 -1.40 -1.41 115.11 118.31 3fei h GLN 435 Ca 0.26 -0.29 0.08 0.00 -0.15 0.00 0.00 58.65 58.55 3fei h GLN 435 Cb 0.40 -0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.85 3fei h GLN 435 CO -0.46 0.88 0.27 1.25 -2.65 0.00 0.00 178.83 178.13 3fei h LEU 436 N 0.53 0.33 -0.57 -2.39 5.85 -0.57 -1.72 115.31 116.77 3fei h LEU 436 Ca 0.09 0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.80 3fei h LEU 436 Cb 0.62 0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3fei h LEU 436 CO 0.04 0.21 0.11 0.58 -0.34 0.00 0.00 178.44 179.03 3fei h VAL 437 N 0.49 1.25 -0.18 1.05 2.07 -0.77 -1.17 116.25 118.98 3fei h VAL 437 Ca 0.29 -0.96 0.01 0.00 0.82 0.00 0.00 66.70 66.87 3fei h VAL 437 Cb 0.29 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 3fei h VAL 437 CO -0.25 0.35 0.09 0.74 0.02 0.00 0.00 177.57 178.52 3fei h THR 438 N 0.84 0.99 -0.80 2.57 2.02 -0.92 0.31 112.91 117.92 3fei h THR 438 Ca 0.18 -0.06 -0.04 0.00 0.77 0.00 0.00 66.41 67.25 3fei h THR 438 Cb 0.40 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.56 3fei h THR 438 CO 0.01 0.03 0.34 -0.33 0.37 0.00 0.00 175.52 175.95 3fei h GLU 439 N 0.19 1.19 -0.21 6.66 5.08 -1.29 -2.43 114.58 123.76 3fei h GLU 439 Ca 0.08 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.21 3fei h GLU 439 Cb 0.02 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3fei h GLU 439 CO -0.06 0.95 0.04 1.25 -1.00 0.00 0.00 179.01 180.19 3fei h HIS 440 N 1.16 0.37 -0.77 4.33 2.76 -0.79 -1.79 115.15 120.42 3fei h HIS 440 Ca 0.27 -0.05 0.06 0.00 -2.20 0.00 0.00 60.37 58.46 3fei h HIS 440 Cb 0.19 -0.10 -0.05 0.00 1.55 0.00 0.00 27.41 29.00 3fei h HIS 440 CO 0.02 0.48 0.50 0.00 -1.30 0.00 0.00 177.93 177.63 3fei h ALA 441 N 0.85 1.66 -0.17 5.26 0.00 -0.91 0.45 119.26 126.39 3fei h ALA 441 Ca 0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 3fei h ALA 441 Cb 0.30 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3fei h ALA 441 CO 0.00 0.22 0.01 0.37 0.00 0.00 0.00 179.25 179.86 3fei h GLN 442 N 0.82 0.30 -0.74 0.00 4.15 -1.14 -0.73 115.11 117.76 3fei h GLN 442 Ca 0.33 -0.09 -0.05 0.00 0.77 0.00 0.00 58.65 59.61 3fei h GLN 442 Cb 0.25 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.87 3fei h GLN 442 CO -0.11 0.49 0.25 1.25 -1.93 0.00 0.00 178.83 178.78 3fei h LEU 443 N 0.07 1.06 -0.82 -2.39 5.85 -0.71 -0.92 115.31 117.44 3fei h LEU 443 Ca 0.05 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.57 3fei h LEU 443 Cb 0.34 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 3fei h LEU 443 CO 0.01 0.97 0.44 0.58 -0.34 0.00 0.00 178.44 180.09 3fei h VAL 444 N 1.10 1.24 -0.52 1.05 2.07 -0.83 -1.18 116.25 119.19 3fei h VAL 444 Ca 0.24 -0.62 -0.11 0.00 0.82 0.00 0.00 66.70 67.03 3fei h VAL 444 Cb 0.28 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.19 3fei h VAL 444 CO -0.01 0.28 -0.12 -0.61 0.02 0.00 0.00 177.57 177.13 3fei h GLN 445 N 1.14 0.97 -0.36 1.57 5.75 -0.61 -0.76 115.11 122.82 3fei h GLN 445 Ca 0.29 -0.36 0.01 0.00 -0.15 0.00 0.00 58.65 58.44 3fei h GLN 445 Cb 0.05 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.52 3fei h GLN 445 CO -0.04 1.03 0.23 0.82 -2.65 0.00 0.00 178.83 178.22 3fei h ILE 446 N 0.86 1.08 -0.37 2.39 2.04 -0.86 -2.24 117.51 120.41 3fei h ILE 446 Ca 0.13 -0.16 -0.04 0.00 1.00 0.00 0.00 64.86 65.79 3fei h ILE 446 Cb 0.67 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 3fei h ILE 446 CO 0.05 0.09 0.07 0.40 0.00 0.00 0.00 178.15 178.75 3fei h ILE 447 N 0.48 1.23 -0.54 -0.67 2.04 -0.98 -2.51 117.51 116.57 3fei h ILE 447 Ca 0.14 -0.82 0.07 0.00 1.00 0.00 0.00 64.86 65.25 3fei h ILE 447 Cb -0.04 1.07 -0.06 0.00 -0.74 0.00 0.00 36.82 37.05 3fei h ILE 447 CO -0.04 0.28 0.21 0.50 0.00 0.00 0.00 178.15 179.10 3fei h LYS 448 N 0.44 0.39 0.00 2.37 3.64 -0.99 0.29 116.57 122.71 3fei h LYS 448 Ca 0.11 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3fei h LYS 448 Cb 0.34 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 3fei h LYS 448 CO 0.01 0.26 -0.09 0.87 -2.27 0.00 0.00 179.45 178.23 3fei h LYS 449 N 0.40 0.00 0.00 1.90 1.79 -1.31 -3.37 116.57 115.98 3fei h LYS 449 Ca 0.26 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.73 3fei h LYS 449 Cb 0.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 3fei h LYS 449 CO -0.25 0.00 -0.05 0.25 -1.08 0.00 0.00 179.45 178.32 3fei n THR 450 N -2.96 0.00 -4.17 -0.16 -2.24 -0.95 -4.96 114.28 98.84 3fei n THR 450 Ca 0.04 -0.47 -0.34 0.00 -2.27 0.00 0.00 64.05 61.00 3fei n THR 450 Cb 0.52 0.98 -0.13 0.00 -2.10 0.00 0.00 70.33 69.60 3fei n THR 450 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3fei s GLU 451 N -1.06 3.55 0.30 -0.78 0.41 0.07 -5.01 118.70 116.17 3fei s GLU 451 Ca 0.00 -0.56 0.05 0.00 -0.41 0.00 0.00 54.97 54.05 3fei s GLU 451 Cb 0.00 -2.99 0.48 0.00 -1.78 0.00 0.00 34.13 29.84 3fei s GLU 451 CO 0.01 0.03 1.74 0.66 -0.49 0.00 0.00 175.26 177.21 3fei h SER 452 N 7.41 0.37 -1.23 -0.19 4.64 -1.88 -3.21 113.55 119.45 3fei h SER 452 Ca -0.35 -0.13 -0.70 0.00 -0.47 0.00 0.00 61.79 60.14 3fei h SER 452 Cb 1.18 -0.10 -0.29 0.00 -0.31 0.00 0.00 62.40 62.88 3fei h SER 452 CO 0.61 0.65 0.90 0.47 -0.87 0.00 0.00 176.83 178.58 3fei n ASP 453 N -4.11 7.63 -3.20 4.97 8.00 -1.26 -4.76 116.55 123.82 3fei n ASP 453 Ca -0.01 -3.80 -0.23 0.00 0.71 0.00 0.00 54.79 51.46 3fei n ASP 453 Cb 0.41 -0.99 -0.06 0.00 -0.02 0.00 0.00 41.12 40.46 3fei n ASP 453 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3fei n ALA 454 N -0.83 2.54 -1.84 2.24 0.00 -1.21 -4.88 120.51 116.52 3fei n ALA 454 Ca 0.61 -3.56 -0.32 0.00 0.00 0.00 0.00 53.44 50.17 3fei n ALA 454 Cb 0.56 -0.84 -0.01 0.00 0.00 0.00 0.00 19.45 19.15 3fei n ALA 454 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fei s ALA 455 N -1.68 3.07 -0.10 0.00 0.00 -1.26 -4.48 121.76 117.31 3fei s ALA 455 Ca 0.37 0.08 -0.02 0.00 0.00 0.00 0.00 51.96 52.39 3fei s ALA 455 Cb 0.22 -3.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.20 3fei s ALA 455 CO -0.10 -0.44 -0.02 -0.51 0.00 0.00 0.00 175.76 174.69 3fei s LEU 456 N -4.53 3.41 0.21 0.00 1.43 -1.26 -4.96 118.68 112.98 3fei s LEU 456 Ca 0.57 0.03 -0.31 0.00 -1.03 0.00 0.00 54.13 53.40 3fei s LEU 456 Cb -0.11 -1.78 -0.15 0.00 0.03 0.00 0.00 46.19 44.18 3fei s LEU 456 CO 0.40 0.32 1.05 1.57 0.23 0.00 0.00 176.35 179.92 3fei n HIS 457 N 2.55 1.13 -0.07 0.29 -0.00 -1.26 -4.70 115.22 113.16 3fei n HIS 457 Ca -0.18 0.72 0.22 0.00 -0.00 0.00 0.00 57.72 58.47 3fei n HIS 457 Cb 0.53 -2.24 0.67 0.00 -0.00 0.00 0.00 29.99 28.95 3fei n HIS 457 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3fei h PRO 458 N 2.66 0.06 -0.10 1.57 0.13 -1.98 -0.38 132.00 133.96 3fei h PRO 458 Ca -0.41 -0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.70 3fei h PRO 458 Cb 1.35 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 3fei h PRO 458 CO 0.65 0.04 -0.00 1.25 -0.23 0.00 0.00 178.00 179.72 3fei h LEU 459 N 0.07 0.18 -1.16 1.56 5.85 -2.00 -1.95 115.31 117.85 3fei h LEU 459 Ca 0.32 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3fei h LEU 459 Cb 1.16 -0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 3fei h LEU 459 CO -0.02 0.45 0.34 -0.07 -0.34 0.00 0.00 178.44 178.79 3fei h LEU 460 N -0.10 0.83 -0.82 2.25 3.38 -1.74 -2.25 115.31 116.86 3fei h LEU 460 Ca 0.03 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 3fei h LEU 460 Cb 0.35 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 3fei h LEU 460 CO 0.01 0.68 0.14 -0.61 0.09 0.00 0.00 178.44 178.75 3fei h GLN 461 N 0.93 1.03 -0.13 1.13 5.75 -1.02 -1.14 115.11 121.65 3fei h GLN 461 Ca 0.23 -0.24 0.03 0.00 -0.15 0.00 0.00 58.65 58.52 3fei h GLN 461 Cb 0.06 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.44 3fei h GLN 461 CO -0.03 0.92 -0.06 0.93 -2.65 0.00 0.00 178.83 177.93 3fei h GLU 462 N 0.98 -0.05 -0.40 1.69 5.08 -0.95 -1.32 114.58 119.60 3fei h GLU 462 Ca 0.20 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.56 3fei h GLU 462 Cb 0.36 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 3fei h GLU 462 CO 0.00 -0.03 0.24 0.82 -1.00 0.00 0.00 179.01 179.03 3fei h ILE 463 N -0.05 1.14 0.00 3.13 2.04 -1.15 -2.76 117.51 119.85 3fei h ILE 463 Ca 0.07 -0.33 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 3fei h ILE 463 Cb 0.16 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 36.87 3fei h ILE 463 CO -0.17 0.14 -0.09 1.88 0.00 0.00 0.00 178.15 179.91 3fei h TYR 464 N 0.52 0.00 -3.47 1.37 0.05 -1.16 -3.44 116.97 110.83 3fei h TYR 464 Ca 0.14 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 58.39 3fei h TYR 464 Cb 0.02 0.00 0.07 0.00 1.01 0.00 0.00 36.73 37.83 3fei h TYR 464 CO -0.03 0.09 0.79 0.50 -1.05 0.00 0.00 178.16 178.46 3fei s ARG 465 N -3.51 4.21 -0.76 4.88 3.52 -0.50 -2.58 118.95 124.21 3fei s ARG 465 Ca 0.03 2.41 0.00 0.00 -0.13 0.00 0.00 55.73 58.04 3fei s ARG 465 Cb 0.08 -3.06 0.00 0.00 -1.56 0.00 0.00 34.95 30.41 3fei s ARG 465 CO 0.61 -0.48 0.00 -0.25 -0.81 0.00 0.00 175.30 174.37 3fei n ASP 466 N 1.93 -4.83 -0.05 -2.12 9.92 -1.26 -4.94 116.55 115.20 3fei n ASP 466 Ca 0.06 0.18 -0.05 0.00 -0.53 0.00 0.00 54.79 54.45 3fei n ASP 466 Cb 0.39 -2.96 -0.04 0.00 -0.64 0.00 0.00 41.12 37.87 3fei n ASP 466 CO 0.00 0.00 0.00 -0.03 0.13 0.00 0.00 177.20 177.30 3fei h MET 467 N 0.16 -0.00 0.00 -1.24 4.05 -1.79 -3.54 114.93 112.57 3fei h MET 467 Ca -0.15 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.27 3fei h MET 467 Cb 0.79 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.59 3fei h MET 467 CO 0.22 0.34 0.00 2.48 0.23 0.00 0.00 176.91 180.18