#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iv4 s ILE 203 N 0.00 1.65 0.02 0.55 2.07 -1.26 -0.79 121.20 123.43 1iv4 s ILE 203 Ca 0.00 -1.66 -0.00 0.00 -1.41 0.00 0.00 60.65 57.58 1iv4 s ILE 203 Cb 0.00 -1.60 -0.02 0.00 0.13 0.00 0.00 42.46 40.97 1iv4 s ILE 203 CO 0.00 -0.20 -0.02 -0.83 -1.91 0.00 0.00 174.94 171.99 1iv4 s GLY 204 N -2.19 0.22 -0.06 1.50 0.00 -0.54 -4.16 107.32 102.08 1iv4 s GLY 204 Ca 0.09 -0.53 0.02 0.00 0.00 0.00 0.00 44.72 44.29 1iv4 s GLY 204 CO 0.05 -0.60 -0.09 -0.47 0.00 0.00 0.00 173.10 171.98 1iv4 s TYR 205 N -1.38 1.22 0.04 1.90 5.04 -1.26 -0.85 117.35 122.06 1iv4 s TYR 205 Ca -0.15 -0.44 -0.00 0.00 -2.44 0.00 0.00 57.07 54.04 1iv4 s TYR 205 Cb -0.09 -0.94 -0.03 0.00 0.35 0.00 0.00 41.96 41.24 1iv4 s TYR 205 CO -0.01 -0.26 -0.03 0.20 -1.34 0.00 0.00 175.55 174.11 1iv4 s GLY 206 N 0.82 0.39 0.04 8.97 0.00 -0.27 -4.38 107.32 112.89 1iv4 s GLY 206 Ca -0.12 -0.93 0.01 0.00 0.00 0.00 0.00 44.72 43.67 1iv4 s GLY 206 CO 0.02 -1.02 -0.05 -0.54 0.00 0.00 0.00 173.10 171.51 1iv4 s GLU 207 N -2.76 0.51 0.13 2.90 2.02 -1.26 -0.47 118.70 119.77 1iv4 s GLU 207 Ca -0.03 -0.89 -0.14 0.00 0.02 0.00 0.00 54.97 53.93 1iv4 s GLU 207 Cb -0.01 -0.03 0.02 0.00 0.10 0.00 0.00 34.13 34.21 1iv4 s GLU 207 CO -0.05 -0.03 0.35 0.34 0.02 0.00 0.00 175.26 175.89 1iv4 s ASP 208 N -2.03 -0.12 0.04 -0.19 2.15 -0.23 -4.52 116.67 111.77 1iv4 s ASP 208 Ca -0.05 -0.49 -0.19 0.00 0.43 0.00 0.00 52.55 52.25 1iv4 s ASP 208 Cb -0.04 0.45 0.04 0.00 -0.30 0.00 0.00 42.92 43.07 1iv4 s ASP 208 CO -0.03 -0.86 0.43 -0.94 -0.17 0.00 0.00 175.17 173.60 1iv4 s SER 209 N -2.85 -0.31 -0.04 -0.34 1.04 -1.26 -1.19 113.70 108.75 1iv4 s SER 209 Ca 0.06 0.06 -0.07 0.00 0.48 0.00 0.00 55.95 56.48 1iv4 s SER 209 Cb 0.02 0.43 0.01 0.00 0.10 0.00 0.00 66.02 66.58 1iv4 s SER 209 CO -0.09 -0.65 0.16 -1.00 0.98 0.00 0.00 173.24 172.64 1iv4 s HIS 210 N -2.33 -0.10 0.30 5.02 3.76 -0.29 -4.99 115.29 116.66 1iv4 s HIS 210 Ca -0.06 0.23 -0.29 0.00 -0.15 0.00 0.00 55.06 54.78 1iv4 s HIS 210 Cb -0.01 0.02 -0.10 0.00 1.11 0.00 0.00 32.58 33.60 1iv4 s HIS 210 CO -0.01 -0.18 1.39 0.50 -0.85 0.00 0.00 174.74 175.59 1iv4 s ARG 211 N -0.53 4.29 -0.05 1.40 3.52 -1.26 -0.98 118.95 125.34 1iv4 s ARG 211 Ca -0.06 2.29 -0.05 0.00 -0.13 0.00 0.00 55.73 57.78 1iv4 s ARG 211 Cb -0.04 -3.08 -0.04 0.00 -1.56 0.00 0.00 34.95 30.23 1iv4 s ARG 211 CO 0.01 -0.33 0.18 -0.51 -0.81 0.00 0.00 175.30 173.84 1iv4 s LEU 212 N -1.15 4.38 0.03 -0.88 1.43 0.99 0.41 118.68 123.88 1iv4 s LEU 212 Ca 0.54 0.43 0.03 0.00 -1.03 0.00 0.00 54.13 54.10 1iv4 s LEU 212 Cb -0.41 -2.41 -0.02 0.00 0.03 0.00 0.00 46.19 43.38 1iv4 s LEU 212 CO 0.49 0.32 -0.09 -1.61 0.23 0.00 0.00 176.35 175.70 1iv4 s GLU 213 N -1.55 0.60 0.40 1.70 8.01 0.11 -4.80 118.70 123.17 1iv4 s GLU 213 Ca 0.22 -0.60 -0.27 0.00 0.01 0.00 0.00 54.97 54.33 1iv4 s GLU 213 Cb -0.13 -0.49 -0.09 0.00 -4.31 0.00 0.00 34.13 29.11 1iv4 s GLU 213 CO 0.13 0.11 1.39 -1.21 0.01 0.00 0.00 175.26 175.69 1iv4 s GLU 214 N -1.07 3.98 0.00 1.61 0.41 -1.26 -0.98 118.70 121.39 1iv4 s GLU 214 Ca -0.04 2.36 0.00 0.00 -0.41 0.00 0.00 54.97 56.88 1iv4 s GLU 214 Cb -0.07 -2.83 0.00 0.00 -1.78 0.00 0.00 34.13 29.44 1iv4 s GLU 214 CO 0.00 -0.55 0.00 0.41 -0.49 0.00 0.00 175.26 174.63 1iv4 n GLY 215 N 0.60 0.77 3.92 -1.39 0.00 -0.47 -4.87 105.19 103.75 1iv4 n GLY 215 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 1iv4 n GLY 215 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iv4 s ARG 216 N -0.10 3.49 0.34 1.61 0.52 -1.21 -4.97 118.95 118.62 1iv4 s ARG 216 Ca 0.00 -0.38 -0.29 0.00 -0.52 0.00 0.00 55.73 54.55 1iv4 s ARG 216 Cb 0.00 -2.94 -0.10 0.00 0.52 0.00 0.00 34.95 32.42 1iv4 s ARG 216 CO 0.00 0.52 1.35 -2.14 0.02 0.00 0.00 175.30 175.05 1iv4 s PRO 217 N -2.85 4.30 -0.24 3.54 0.02 -1.26 -2.46 135.00 136.06 1iv4 s PRO 217 Ca 0.37 2.29 -0.09 0.00 0.02 0.00 0.00 61.00 63.59 1iv4 s PRO 217 Cb -0.12 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.30 1iv4 s PRO 217 CO 0.28 -0.27 0.12 -1.17 -0.33 0.00 0.00 177.00 175.63 1iv4 s LEU 218 N -1.78 3.87 -0.17 -5.54 2.96 -1.26 -3.04 118.68 113.72 1iv4 s LEU 218 Ca 0.50 0.01 -0.01 0.00 -0.22 0.00 0.00 54.13 54.41 1iv4 s LEU 218 Cb -0.41 -2.03 -0.00 0.00 0.50 0.00 0.00 46.19 44.24 1iv4 s LEU 218 CO 0.54 0.04 -0.13 -0.31 -1.32 0.00 0.00 176.35 175.18 1iv4 s TYR 219 N 1.17 2.84 -0.05 5.38 2.02 -1.26 -1.13 117.35 126.32 1iv4 s TYR 219 Ca 0.06 -1.03 -0.04 0.00 -0.37 0.00 0.00 57.07 55.69 1iv4 s TYR 219 Cb -0.14 -1.95 0.02 0.00 -0.40 0.00 0.00 41.96 39.49 1iv4 s TYR 219 CO 0.05 -0.50 0.13 -0.51 -1.57 0.00 0.00 175.55 173.15 1iv4 s LEU 220 N 0.99 1.30 -1.26 -1.29 1.43 -0.32 -4.02 118.68 115.51 1iv4 s LEU 220 Ca -0.02 0.27 -0.07 0.00 -1.03 0.00 0.00 54.13 53.28 1iv4 s LEU 220 Cb -0.15 0.42 0.05 0.00 0.03 0.00 0.00 46.19 46.54 1iv4 s LEU 220 CO -0.02 -0.07 0.42 0.00 0.23 0.00 0.00 176.35 176.91 1iv4 n GLY 222 N -1.15 2.04 3.75 0.00 0.00 -1.26 -4.49 105.19 104.08 1iv4 n GLY 222 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.67 1iv4 n GLY 222 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1iv4 s LEU 223 N 0.00 3.71 -0.12 0.99 1.43 -0.33 -5.04 118.68 119.32 1iv4 s LEU 223 Ca 0.00 -0.05 -0.29 0.00 -1.03 0.00 0.00 54.13 52.75 1iv4 s LEU 223 Cb 0.00 -2.41 -0.03 0.00 0.03 0.00 0.00 46.19 43.79 1iv4 s LEU 223 CO 0.00 0.17 1.36 -0.22 0.23 0.00 0.00 176.35 177.89 1iv4 s LEU 224 N -2.36 4.23 -0.28 1.79 1.98 -1.26 -1.17 118.68 121.60 1iv4 s LEU 224 Ca 0.28 1.85 -0.08 0.00 -2.89 0.00 0.00 54.13 53.29 1iv4 s LEU 224 Cb -0.12 -3.54 -0.01 0.00 0.66 0.00 0.00 46.19 43.18 1iv4 s LEU 224 CO 0.21 -0.78 0.11 -0.63 -1.89 0.00 0.00 176.35 173.36 1iv4 s ILE 225 N 3.46 4.36 0.20 6.68 -1.09 -0.28 -4.98 121.20 129.56 1iv4 s ILE 225 Ca 0.60 -0.38 -0.33 0.00 -2.23 0.00 0.00 60.65 58.31 1iv4 s ILE 225 Cb -0.25 -3.16 -0.13 0.00 -1.58 0.00 0.00 42.46 37.33 1iv4 s ILE 225 CO 0.19 0.17 1.52 -2.65 -1.23 0.00 0.00 174.94 172.94 1iv4 n PRO 226 N 4.94 2.18 -3.58 2.79 -0.02 -1.26 -4.23 135.00 135.81 1iv4 n PRO 226 Ca -0.15 0.78 -0.13 0.00 -2.02 0.00 0.00 63.50 61.99 1iv4 n PRO 226 Cb 0.50 -2.51 -0.06 0.00 -0.02 0.00 0.00 33.50 31.41 1iv4 n PRO 226 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1iv4 s SER 227 N 0.66 -0.50 0.03 2.55 0.15 -1.26 -4.88 113.70 110.45 1iv4 s SER 227 Ca 0.74 0.67 0.23 0.00 0.70 0.00 0.00 55.95 58.29 1iv4 s SER 227 Cb -0.65 0.58 0.97 0.00 -1.71 0.00 0.00 66.02 65.22 1iv4 s SER 227 CO 0.43 -0.37 1.74 -0.81 1.20 0.00 0.00 173.24 175.43 1iv4 n PRO 228 N 1.24 0.03 -4.04 5.44 -0.04 -1.26 -4.80 135.00 131.57 1iv4 n PRO 228 Ca -0.13 0.12 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 1iv4 n PRO 228 Cb 0.57 -1.54 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 1iv4 n PRO 228 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1iv4 s VAL 229 N -3.02 0.20 0.32 0.52 -7.23 -1.26 -1.37 120.40 108.56 1iv4 s VAL 229 Ca 0.11 -1.63 -0.19 0.00 -1.81 0.00 0.00 61.98 58.46 1iv4 s VAL 229 Cb 0.15 -1.40 0.04 0.00 0.56 0.00 0.00 36.38 35.73 1iv4 s VAL 229 CO 0.43 -0.90 0.79 -0.83 -0.31 0.00 0.00 175.10 174.28 1iv4 s GLY 230 N -2.81 0.15 0.19 2.32 0.00 -0.15 -4.11 107.32 102.92 1iv4 s GLY 230 Ca 0.05 -0.51 -0.31 0.00 0.00 0.00 0.00 44.72 43.95 1iv4 s GLY 230 CO -0.10 -0.04 1.46 0.00 0.00 0.00 0.00 173.10 174.43 1iv4 s ALA 231 N -2.95 3.66 -0.89 3.20 0.00 -1.17 0.06 121.76 123.67 1iv4 s ALA 231 Ca 0.14 1.29 -0.18 0.00 0.00 0.00 0.00 51.96 53.21 1iv4 s ALA 231 Cb -0.05 -3.57 0.14 0.00 0.00 0.00 0.00 23.12 19.64 1iv4 s ALA 231 CO 0.09 -0.72 1.04 -1.17 0.00 0.00 0.00 175.76 175.01 1iv4 s LEU 232 N 0.39 5.32 0.26 0.00 2.96 0.16 -4.78 118.68 123.00 1iv4 s LEU 232 Ca 0.63 -2.08 -0.18 0.00 -0.22 0.00 0.00 54.13 52.28 1iv4 s LEU 232 Cb -0.41 -2.36 0.01 0.00 0.50 0.00 0.00 46.19 43.93 1iv4 s LEU 232 CO 0.37 -1.00 0.64 0.00 -1.32 0.00 0.00 176.35 175.03 1iv4 s ALA 233 N 2.33 -0.91 -0.64 5.97 0.00 -1.26 -4.46 121.76 122.78 1iv4 s ALA 233 Ca 0.29 -0.47 0.25 0.00 0.00 0.00 0.00 51.96 52.03 1iv4 s ALA 233 Cb -0.07 0.92 0.60 0.00 0.00 0.00 0.00 23.12 24.57 1iv4 s ALA 233 CO -0.08 -0.97 1.63 0.45 0.00 0.00 0.00 175.76 176.79 1iv4 h HIS 234 N 2.09 0.00 -2.12 0.00 3.86 -2.02 -3.45 115.15 113.50 1iv4 h HIS 234 Ca -0.22 0.00 -0.47 0.00 -1.16 0.00 0.00 60.37 58.52 1iv4 h HIS 234 Cb 1.25 0.00 0.09 0.00 1.06 0.00 0.00 27.41 29.82 1iv4 h HIS 234 CO 0.41 0.00 0.15 -1.54 0.86 0.00 0.00 177.93 177.81 1iv4 s SER 235 N -4.81 4.06 0.00 2.45 1.04 -1.26 -4.81 113.70 110.38 1iv4 s SER 235 Ca 0.09 -0.43 0.22 0.00 0.48 0.00 0.00 55.95 56.31 1iv4 s SER 235 Cb 0.11 0.18 0.99 0.00 0.10 0.00 0.00 66.02 67.40 1iv4 s SER 235 CO 0.64 -2.07 1.72 -0.90 0.98 0.00 0.00 173.24 173.61 1iv4 n ASP 236 N -2.98 0.00 -0.75 7.02 3.85 -1.26 -4.92 116.55 117.51 1iv4 n ASP 236 Ca 0.17 0.38 -0.09 0.00 -0.71 0.00 0.00 54.79 54.54 1iv4 n ASP 236 Cb 0.61 -0.45 -0.03 0.00 -1.35 0.00 0.00 41.12 39.89 1iv4 n ASP 236 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1iv4 n GLY 237 N 0.76 0.93 3.56 6.12 0.00 -1.26 -4.44 105.19 110.86 1iv4 n GLY 237 Ca 0.07 -0.61 -0.38 0.00 0.00 0.00 0.00 46.02 45.10 1iv4 n GLY 237 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iv4 s ASP 238 N -2.86 6.15 0.30 1.61 -1.08 -1.26 -4.81 116.67 114.72 1iv4 s ASP 238 Ca 0.00 -1.08 -0.01 0.00 -0.52 0.00 0.00 52.55 50.94 1iv4 s ASP 238 Cb 0.00 -2.56 0.48 0.00 -1.46 0.00 0.00 42.92 39.38 1iv4 s ASP 238 CO 0.00 -1.82 1.94 0.00 0.52 0.00 0.00 175.17 175.82 1iv4 h ALA 239 N 10.33 1.46 -0.06 3.66 0.00 -1.92 -1.16 119.26 131.58 1iv4 h ALA 239 Ca 0.09 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1iv4 h ALA 239 Cb 1.02 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1iv4 h ALA 239 CO 1.36 0.46 0.02 0.00 0.00 0.00 0.00 179.25 181.09 1iv4 h ALA 240 N 1.49 0.07 -0.44 0.00 0.00 -1.88 -0.52 119.26 117.99 1iv4 h ALA 240 Ca 0.34 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.18 1iv4 h ALA 240 Cb 0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1iv4 h ALA 240 CO -0.10 -0.34 0.24 0.52 0.00 0.00 0.00 179.25 179.58 1iv4 h MET 241 N -0.08 0.48 -0.42 0.00 2.86 -1.81 -1.80 114.93 114.17 1iv4 h MET 241 Ca 0.02 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 1iv4 h MET 241 Cb 0.18 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.71 1iv4 h MET 241 CO -0.00 0.31 0.07 0.45 1.06 0.00 0.00 176.91 178.81 1iv4 h HIS 242 N 0.49 0.73 -0.76 -0.22 3.86 -1.10 0.03 115.15 118.18 1iv4 h HIS 242 Ca 0.18 -0.10 -0.03 0.00 -1.16 0.00 0.00 60.37 59.27 1iv4 h HIS 242 Cb 0.05 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.28 1iv4 h HIS 242 CO -0.08 0.70 0.37 0.00 0.86 0.00 0.00 177.93 179.78 1iv4 h ALA 243 N 0.94 1.22 -0.37 2.45 0.00 -0.97 0.02 119.26 122.54 1iv4 h ALA 243 Ca 0.13 -0.14 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1iv4 h ALA 243 Cb 0.36 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1iv4 h ALA 243 CO 0.01 0.60 -0.38 -0.07 0.00 0.00 0.00 179.25 179.41 1iv4 h LEU 244 N 1.08 0.97 0.15 0.00 3.38 -1.13 -0.45 115.31 119.31 1iv4 h LEU 244 Ca 0.26 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.76 1iv4 h LEU 244 Cb 0.10 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1iv4 h LEU 244 CO -0.03 1.24 -0.12 0.74 0.09 0.00 0.00 178.44 180.36 1iv4 h THR 245 N 0.72 0.75 -0.94 0.22 2.02 -0.60 -0.47 112.91 114.60 1iv4 h THR 245 Ca 0.06 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.28 1iv4 h THR 245 Cb 0.98 0.75 -0.06 0.00 -1.74 0.00 0.00 68.15 68.08 1iv4 h THR 245 CO 0.09 0.00 0.62 0.44 0.37 0.00 0.00 175.52 177.04 1iv4 h ASP 246 N -0.28 1.01 -0.57 4.18 3.32 -0.93 -0.86 116.42 122.31 1iv4 h ASP 246 Ca -0.01 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 1iv4 h ASP 246 Cb 0.25 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.54 1iv4 h ASP 246 CO -0.01 0.69 0.32 0.00 -1.72 0.00 0.00 179.24 178.53 1iv4 h ALA 247 N 1.45 0.72 -0.38 3.45 0.00 -0.63 0.76 119.26 124.63 1iv4 h ALA 247 Ca 0.38 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.17 1iv4 h ALA 247 Cb 0.03 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1iv4 h ALA 247 CO -0.12 0.23 0.14 -0.07 0.00 0.00 0.00 179.25 179.44 1iv4 h LEU 248 N 0.76 0.54 -0.66 0.00 3.38 -0.49 -1.77 115.31 117.07 1iv4 h LEU 248 Ca 0.20 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 1iv4 h LEU 248 Cb 0.03 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.61 1iv4 h LEU 248 CO -0.03 0.57 0.27 -0.07 0.09 0.00 0.00 178.44 179.27 1iv4 h LEU 249 N 0.47 0.90 -1.39 1.67 3.38 -0.96 -2.56 115.31 116.83 1iv4 h LEU 249 Ca 0.13 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1iv4 h LEU 249 Cb 0.21 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1iv4 h LEU 249 CO -0.01 0.82 0.34 -1.28 0.09 0.00 0.00 178.44 178.41 1iv4 h SER 250 N 0.93 0.66 0.31 -0.43 0.87 -0.63 -1.21 113.55 114.05 1iv4 h SER 250 Ca 0.22 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 1iv4 h SER 250 Cb 0.20 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 1iv4 h SER 250 CO -0.02 0.51 0.00 0.00 -0.53 0.00 0.00 176.83 176.79 1iv4 h ALA 251 N 1.61 1.00 -0.08 6.23 0.00 -0.88 -1.78 119.26 125.35 1iv4 h ALA 251 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1iv4 h ALA 251 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1iv4 h ALA 251 CO -0.04 0.00 0.00 0.66 0.00 0.00 0.00 179.25 179.87 1iv4 n TYR 252 N -2.70 0.11 -2.13 0.00 4.02 -0.67 -4.75 117.16 111.05 1iv4 n TYR 252 Ca -0.01 -0.39 -0.14 0.00 -0.01 0.00 0.00 57.90 57.34 1iv4 n TYR 252 Cb 0.13 -0.03 -0.02 0.00 -0.02 0.00 0.00 39.34 39.40 1iv4 n TYR 252 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1iv4 n GLY 253 N -0.12 0.07 0.01 2.72 0.00 -0.62 -4.91 105.19 102.34 1iv4 n GLY 253 Ca 0.03 -0.30 0.14 0.00 0.00 0.00 0.00 46.02 45.89 1iv4 n GLY 253 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iv4 n LEU 254 N -1.98 0.15 0.00 0.99 4.77 -0.56 -5.00 117.00 115.37 1iv4 n LEU 254 Ca -0.17 0.41 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 1iv4 n LEU 254 Cb 0.60 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1iv4 n LEU 254 CO 0.20 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.88 1iv4 n GLY 255 N 1.49 0.16 3.38 -0.72 0.00 -1.26 -4.95 105.19 103.29 1iv4 n GLY 255 Ca 0.07 -1.87 -0.14 0.00 0.00 0.00 0.00 46.02 44.07 1iv4 n GLY 255 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1iv4 s ASP 256 N -4.00 0.70 0.52 1.61 1.47 -1.26 -4.25 116.67 111.45 1iv4 s ASP 256 Ca 0.00 -1.42 0.21 0.00 1.18 0.00 0.00 52.55 52.51 1iv4 s ASP 256 Cb 0.00 0.55 1.35 0.00 -0.34 0.00 0.00 42.92 44.48 1iv4 s ASP 256 CO 0.00 -1.09 2.12 0.16 0.68 0.00 0.00 175.17 177.03 1iv4 h ILE 257 N 2.28 0.86 -0.23 2.11 3.07 -1.92 -1.40 117.51 122.28 1iv4 h ILE 257 Ca -0.29 -0.26 -0.15 0.00 1.55 0.00 0.00 64.86 65.71 1iv4 h ILE 257 Cb 1.24 1.15 -0.01 0.00 -0.27 0.00 0.00 36.82 38.93 1iv4 h ILE 257 CO 0.42 0.07 -0.47 1.23 -1.05 0.00 0.00 178.15 178.35 1iv4 h GLY 258 N 0.28 0.65 0.52 0.16 0.00 -1.97 0.13 103.07 102.84 1iv4 h GLY 258 Ca -0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 47.33 46.58 1iv4 h GLY 258 CO 0.01 0.62 -0.21 -2.00 0.00 0.00 0.00 176.54 174.96 1iv4 h LEU 259 N 0.47 0.24 0.01 3.11 5.85 -1.74 -3.33 115.31 119.92 1iv4 h LEU 259 Ca 0.03 -0.69 -0.24 0.00 0.84 0.00 0.00 57.88 57.81 1iv4 h LEU 259 Cb 1.00 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.92 1iv4 h LEU 259 CO 0.09 0.89 -1.28 -0.07 -0.34 0.00 0.00 178.44 177.73 1iv4 h LEU 260 N -0.40 0.02 -5.22 2.25 3.38 -1.29 -3.39 115.31 110.66 1iv4 h LEU 260 Ca -0.02 -0.02 -0.52 0.00 0.09 0.00 0.00 57.88 57.40 1iv4 h LEU 260 Cb 0.89 -0.01 -0.41 0.00 0.09 0.00 0.00 40.66 41.23 1iv4 h LEU 260 CO 0.04 1.02 -0.89 0.49 0.09 0.00 0.00 178.44 179.19 1iv4 n PHE 261 N -3.24 2.49 -2.25 1.13 3.72 0.44 -5.07 117.46 114.68 1iv4 n PHE 261 Ca -0.07 -3.53 -0.39 0.00 -0.05 0.00 0.00 57.45 53.41 1iv4 n PHE 261 Cb 0.99 -0.35 -0.02 0.00 -0.94 0.00 0.00 39.48 39.15 1iv4 n PHE 261 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1iv4 s PRO 262 N -3.18 4.12 0.00 -1.08 0.04 -1.25 -4.80 135.00 128.85 1iv4 s PRO 262 Ca 0.43 1.93 0.15 0.00 0.04 0.00 0.00 61.00 63.55 1iv4 s PRO 262 Cb 0.36 -2.78 0.87 0.00 0.04 0.00 0.00 34.50 32.99 1iv4 s PRO 262 CO -0.11 -0.29 1.49 -0.40 0.04 0.00 0.00 177.00 177.74 1iv4 n ASP 263 N 0.26 0.00 0.00 6.66 5.68 -1.26 -1.00 116.55 126.89 1iv4 n ASP 263 Ca 0.03 -1.37 0.12 0.00 -0.50 0.00 0.00 54.79 53.07 1iv4 n ASP 263 Cb 0.45 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 41.02 1iv4 n ASP 263 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1iv4 n THR 264 N -0.75 0.24 -3.45 2.12 -2.24 -1.26 -4.50 114.28 104.43 1iv4 n THR 264 Ca 0.11 0.06 -0.42 0.00 -2.27 0.00 0.00 64.05 61.53 1iv4 n THR 264 Cb 0.05 -0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 67.54 1iv4 n THR 264 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1iv4 s ASP 265 N -2.79 6.12 0.36 3.42 -1.08 -0.17 -4.99 116.67 117.53 1iv4 s ASP 265 Ca 0.18 -0.60 0.11 0.00 -0.52 0.00 0.00 52.55 51.72 1iv4 s ASP 265 Cb 0.17 -2.17 0.89 0.00 -1.46 0.00 0.00 42.92 40.35 1iv4 s ASP 265 CO 0.42 -0.38 1.83 -0.65 0.52 0.00 0.00 175.17 176.91 1iv4 h PRO 266 N 8.57 0.60 0.00 4.34 0.11 -1.85 -0.12 132.00 143.64 1iv4 h PRO 266 Ca -0.29 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.76 1iv4 h PRO 266 Cb 1.14 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 1iv4 h PRO 266 CO 0.70 0.39 -0.11 0.00 -0.21 0.00 0.00 178.00 178.77 1iv4 h ARG 267 N 0.61 0.00 0.00 1.05 3.08 -1.94 -3.19 114.38 113.99 1iv4 h ARG 267 Ca 0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.55 1iv4 h ARG 267 Cb 0.96 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.01 1iv4 h ARG 267 CO -0.25 0.11 -1.16 0.91 -1.07 0.00 0.00 179.97 178.51 1iv4 n TRP 268 N -4.08 0.00 -2.06 3.04 5.03 -0.21 -4.84 117.44 114.31 1iv4 n TRP 268 Ca -0.02 0.00 -0.42 0.00 3.03 0.00 0.00 57.50 60.09 1iv4 n TRP 268 Cb 0.20 -0.16 -0.03 0.00 -1.03 0.00 0.00 31.31 30.29 1iv4 n TRP 268 CO 0.00 0.00 0.00 0.50 -0.03 0.00 0.00 177.69 178.16 1iv4 s ARG 269 N -2.71 4.28 0.00 -0.99 3.52 -0.30 -2.75 118.95 119.99 1iv4 s ARG 269 Ca 0.00 2.21 0.00 0.00 -0.13 0.00 0.00 55.73 57.82 1iv4 s ARG 269 Cb 0.11 -3.19 0.00 0.00 -1.56 0.00 0.00 34.95 30.30 1iv4 s ARG 269 CO 0.62 -0.49 0.00 0.41 -0.81 0.00 0.00 175.30 175.03 1iv4 n GLY 270 N 3.42 0.48 3.84 8.12 0.00 -1.26 -5.01 105.19 114.78 1iv4 n GLY 270 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1iv4 n GLY 270 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iv4 s GLU 271 N -0.55 4.05 0.64 1.61 0.41 -1.11 -5.04 118.70 118.71 1iv4 s GLU 271 Ca 0.00 0.98 -0.17 0.00 -0.41 0.00 0.00 54.97 55.37 1iv4 s GLU 271 Cb 0.00 -2.18 -0.01 0.00 -1.78 0.00 0.00 34.13 30.16 1iv4 s GLU 271 CO 0.00 -0.15 1.15 1.03 -0.49 0.00 0.00 175.26 176.81 1iv4 s ARG 272 N -3.67 2.80 0.57 1.61 0.52 -1.26 -4.77 118.95 114.75 1iv4 s ARG 272 Ca 0.59 1.60 0.33 0.00 -0.52 0.00 0.00 55.73 57.74 1iv4 s ARG 272 Cb -0.10 -1.93 1.66 0.00 0.52 0.00 0.00 34.95 35.10 1iv4 s ARG 272 CO 0.24 -1.29 2.12 0.77 0.02 0.00 0.00 175.30 177.16 1iv4 h SER 273 N 0.37 0.00 0.18 0.23 0.02 -1.96 -1.12 113.55 111.27 1iv4 h SER 273 Ca -0.48 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.45 1iv4 h SER 273 Cb 1.27 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.81 1iv4 h SER 273 CO 0.54 0.06 -0.07 -0.08 -1.14 0.00 0.00 176.83 176.14 1iv4 h GLU 274 N 0.00 0.00 -0.63 3.45 4.81 -1.96 -0.30 114.58 119.96 1iv4 h GLU 274 Ca -0.00 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1iv4 h GLU 274 Cb 0.32 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 1iv4 h GLU 274 CO 0.01 0.07 0.20 0.28 -0.73 0.00 0.00 179.01 178.83 1iv4 h VAL 275 N 0.00 1.25 -0.32 0.32 2.07 -1.56 0.46 116.25 118.46 1iv4 h VAL 275 Ca -0.00 -0.84 -0.18 0.00 0.82 0.00 0.00 66.70 66.50 1iv4 h VAL 275 Cb 0.17 0.60 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1iv4 h VAL 275 CO 0.01 0.32 -0.49 -0.26 0.02 0.00 0.00 177.57 177.17 1iv4 h PHE 276 N 0.91 1.12 -0.45 1.57 0.04 -1.19 -1.73 116.94 117.20 1iv4 h PHE 276 Ca 0.20 -0.38 0.03 0.00 2.80 0.00 0.00 57.97 60.62 1iv4 h PHE 276 Cb 0.29 -0.22 -0.03 0.00 2.20 0.00 0.00 35.95 38.19 1iv4 h PHE 276 CO 0.02 1.21 0.25 1.25 -0.60 0.00 0.00 178.31 180.44 1iv4 h LEU 277 N 0.71 0.39 -1.07 1.54 5.85 -1.18 -0.27 115.31 121.27 1iv4 h LEU 277 Ca 0.03 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1iv4 h LEU 277 Cb 1.10 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 1iv4 h LEU 277 CO 0.11 0.27 -0.02 0.03 -0.34 0.00 0.00 178.44 178.50 1iv4 h ARG 278 N 0.50 0.64 -0.44 1.25 3.08 -0.74 0.35 114.38 119.02 1iv4 h ARG 278 Ca 0.19 -0.16 -0.15 0.00 0.07 0.00 0.00 59.98 59.93 1iv4 h ARG 278 Cb 0.05 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1iv4 h ARG 278 CO -0.11 0.67 -0.30 1.49 -1.07 0.00 0.00 179.97 180.66 1iv4 h GLU 279 N 0.60 0.97 -0.64 0.04 4.57 -0.93 -0.18 114.58 119.01 1iv4 h GLU 279 Ca 0.12 -0.46 0.00 0.00 -1.18 0.00 0.00 59.36 57.85 1iv4 h GLU 279 Cb 0.41 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.96 1iv4 h GLU 279 CO 0.02 1.12 0.41 0.00 -1.18 0.00 0.00 179.01 179.38 1iv4 h ALA 280 N 0.84 0.81 -0.84 2.92 0.00 -0.64 -1.13 119.26 121.21 1iv4 h ALA 280 Ca 0.09 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1iv4 h ALA 280 Cb 0.88 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1iv4 h ALA 280 CO 0.08 0.26 0.49 0.52 0.00 0.00 0.00 179.25 180.60 1iv4 h MET 281 N 0.87 1.15 -0.82 0.00 2.86 -0.75 -1.48 114.93 116.76 1iv4 h MET 281 Ca 0.23 -0.11 0.05 0.00 -2.06 0.00 0.00 59.70 57.81 1iv4 h MET 281 Cb -0.07 -0.24 -0.06 0.00 0.06 0.00 0.00 31.60 31.29 1iv4 h MET 281 CO -0.05 0.82 0.51 -0.09 1.06 0.00 0.00 176.91 179.16 1iv4 h ARG 282 N 1.16 0.91 -0.36 1.72 2.43 -0.41 -0.36 114.38 119.48 1iv4 h ARG 282 Ca 0.30 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 59.28 1iv4 h ARG 282 Cb -0.02 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.31 1iv4 h ARG 282 CO -0.05 0.60 -0.31 -0.07 -1.51 0.00 0.00 179.97 178.63 1iv4 h LEU 283 N 0.94 0.90 -0.25 3.80 3.38 -0.92 -0.37 115.31 122.79 1iv4 h LEU 283 Ca 0.35 -0.45 -0.19 0.00 0.09 0.00 0.00 57.88 57.68 1iv4 h LEU 283 Cb 0.13 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1iv4 h LEU 283 CO -0.16 1.16 -0.88 -0.37 0.09 0.00 0.00 178.44 178.28 1iv4 h VAL 284 N 0.64 1.60 -0.24 1.22 -1.51 -1.13 -2.90 116.25 113.94 1iv4 h VAL 284 Ca 0.06 -2.92 -0.10 0.00 -1.23 0.00 0.00 66.70 62.51 1iv4 h VAL 284 Cb 0.89 2.60 -0.01 0.00 -2.13 0.00 0.00 31.29 32.64 1iv4 h VAL 284 CO 0.08 0.84 -0.28 -0.33 -1.23 0.00 0.00 177.57 176.64 1iv4 h GLU 285 N 0.02 0.47 0.00 5.19 5.08 -0.97 0.07 114.58 124.44 1iv4 h GLU 285 Ca -0.02 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.15 1iv4 h GLU 285 Cb 1.55 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 30.78 1iv4 h GLU 285 CO 0.12 0.71 -0.03 0.00 -1.00 0.00 0.00 179.01 178.81 1iv4 h ALA 286 N 1.29 1.05 -0.61 3.43 0.00 -0.87 -0.96 119.26 122.59 1iv4 h ALA 286 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1iv4 h ALA 286 Cb 0.71 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1iv4 h ALA 286 CO 0.05 0.04 0.00 0.54 0.00 0.00 0.00 179.25 179.88 1iv4 n ARG 287 N -3.19 3.52 -0.29 0.00 1.74 -0.41 -4.90 116.66 113.13 1iv4 n ARG 287 Ca -0.01 -2.65 0.00 0.00 -0.77 0.00 0.00 57.85 54.43 1iv4 n ARG 287 Cb 0.22 -1.85 0.00 0.00 -1.02 0.00 0.00 32.46 29.82 1iv4 n ARG 287 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iv4 n GLY 288 N 1.10 0.74 3.77 -0.13 0.00 -0.36 -5.05 105.19 105.25 1iv4 n GLY 288 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1iv4 n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iv4 s ALA 289 N -2.33 3.20 -0.33 4.61 0.00 -0.13 -4.97 121.76 121.82 1iv4 s ALA 289 Ca 0.00 1.12 0.03 0.00 0.00 0.00 0.00 51.96 53.11 1iv4 s ALA 289 Cb 0.00 -3.44 0.10 0.00 0.00 0.00 0.00 23.12 19.77 1iv4 s ALA 289 CO 0.00 -0.71 0.06 0.15 0.00 0.00 0.00 175.76 175.25 1iv4 s LYS 290 N -2.27 1.31 0.25 0.00 3.01 -1.26 -4.46 119.74 116.31 1iv4 s LYS 290 Ca 0.57 -1.64 -0.31 0.00 -1.01 0.00 0.00 55.97 53.58 1iv4 s LYS 290 Cb -0.35 -2.88 -0.12 0.00 -1.01 0.00 0.00 37.83 33.46 1iv4 s LYS 290 CO 0.44 -0.93 1.57 -0.11 0.51 0.00 0.00 175.35 176.83 1iv4 n LEU 291 N 4.41 3.82 -0.06 3.17 7.94 -1.26 -0.08 117.00 134.94 1iv4 n LEU 291 Ca 0.02 1.12 -0.07 0.00 -1.11 0.00 0.00 56.01 55.96 1iv4 n LEU 291 Cb 0.42 -1.53 -0.06 0.00 0.53 0.00 0.00 43.42 42.78 1iv4 n LEU 291 CO 0.19 -0.06 -0.88 0.18 -1.11 0.00 0.00 177.39 175.72 1iv4 n LEU 292 N 2.67 2.16 -3.53 -1.96 4.32 0.60 -4.85 117.00 116.42 1iv4 n LEU 292 Ca 0.12 -0.05 -0.15 0.00 -0.02 0.00 0.00 56.01 55.91 1iv4 n LEU 292 Cb 0.34 -0.24 -0.05 0.00 -1.62 0.00 0.00 43.42 41.84 1iv4 n LEU 292 CO 0.64 0.58 0.53 -1.58 -1.22 0.00 0.00 177.39 176.33 1iv4 s GLN 293 N -2.24 0.95 -0.03 3.23 0.74 -0.88 -4.86 119.66 116.57 1iv4 s GLN 293 Ca -0.13 0.16 0.01 0.00 0.05 0.00 0.00 55.36 55.45 1iv4 s GLN 293 Cb 0.04 0.45 0.02 0.00 1.10 0.00 0.00 33.01 34.62 1iv4 s GLN 293 CO 0.31 -0.31 -0.02 0.00 -0.55 0.00 0.00 175.29 174.72 1iv4 s ALA 294 N -1.42 0.43 -0.11 1.58 0.00 -0.68 -1.50 121.76 120.07 1iv4 s ALA 294 Ca -0.07 0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.96 1iv4 s ALA 294 Cb -0.00 -0.33 0.02 0.00 0.00 0.00 0.00 23.12 22.81 1iv4 s ALA 294 CO 0.06 -0.03 -0.09 0.45 0.00 0.00 0.00 175.76 176.14 1iv4 s SER 295 N 0.87 2.13 0.05 0.00 0.15 0.04 -0.14 113.70 116.80 1iv4 s SER 295 Ca -0.10 -0.32 -0.07 0.00 0.70 0.00 0.00 55.95 56.16 1iv4 s SER 295 Cb -0.13 -0.87 -0.01 0.00 -1.71 0.00 0.00 66.02 63.31 1iv4 s SER 295 CO -0.01 -0.08 0.15 -1.48 1.20 0.00 0.00 173.24 173.02 1iv4 s LEU 296 N 1.45 1.60 -0.11 3.45 2.34 0.20 -0.54 118.68 127.06 1iv4 s LEU 296 Ca 0.00 -0.52 0.03 0.00 0.06 0.00 0.00 54.13 53.71 1iv4 s LEU 296 Cb -0.13 0.80 0.00 0.00 -0.56 0.00 0.00 46.19 46.30 1iv4 s LEU 296 CO -0.06 -0.58 -0.22 -0.69 -1.06 0.00 0.00 176.35 173.75 1iv4 s VAL 297 N -2.91 1.96 -0.20 1.48 1.01 -0.29 -1.45 120.40 120.02 1iv4 s VAL 297 Ca -0.02 -0.95 -0.06 0.00 0.00 0.00 0.00 61.98 60.95 1iv4 s VAL 297 Cb 0.01 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.64 1iv4 s VAL 297 CO -0.06 0.54 0.03 -0.76 0.00 0.00 0.00 175.10 174.84 1iv4 s LEU 298 N 0.54 3.46 -0.25 3.92 1.43 -0.30 -1.98 118.68 125.51 1iv4 s LEU 298 Ca -0.14 -0.10 -0.05 0.00 -1.03 0.00 0.00 54.13 52.80 1iv4 s LEU 298 Cb -0.17 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.17 1iv4 s LEU 298 CO 0.05 0.10 0.01 -0.89 0.23 0.00 0.00 176.35 175.84 1iv4 s THR 299 N 0.82 3.57 -0.18 5.49 2.01 0.65 -0.81 115.64 127.19 1iv4 s THR 299 Ca 0.02 -0.64 -0.28 0.00 0.31 0.00 0.00 61.69 61.10 1iv4 s THR 299 Cb -0.14 -2.74 0.10 0.00 0.01 0.00 0.00 72.50 69.73 1iv4 s THR 299 CO 0.02 0.25 0.89 -1.48 -0.69 0.00 0.00 174.62 173.61 1iv4 s LEU 300 N 1.47 -0.52 0.08 4.42 2.34 0.39 -1.05 118.68 125.81 1iv4 s LEU 300 Ca 0.04 0.76 -0.11 0.00 0.06 0.00 0.00 54.13 54.87 1iv4 s LEU 300 Cb -0.16 2.12 -0.23 0.00 -0.56 0.00 0.00 46.19 47.36 1iv4 s LEU 300 CO -0.01 -0.34 1.18 0.44 -1.06 0.00 0.00 176.35 176.56 1iv4 h ASP 301 N 3.48 0.79 -5.01 1.48 5.19 -1.82 -3.34 116.42 117.18 1iv4 h ASP 301 Ca -0.25 -0.68 -0.08 0.00 -0.62 0.00 0.00 57.03 55.40 1iv4 h ASP 301 Cb 1.16 -0.24 -0.18 0.00 0.18 0.00 0.00 39.33 40.25 1iv4 h ASP 301 CO 0.23 1.49 -0.02 0.00 -3.12 0.00 0.00 179.24 177.82 1iv4 s ARG 302 N -3.12 0.93 0.80 3.56 1.70 -1.26 -4.70 118.95 116.86 1iv4 s ARG 302 Ca -0.08 -0.10 -0.10 0.00 -0.47 0.00 0.00 55.73 54.98 1iv4 s ARG 302 Cb 0.07 0.43 0.11 0.00 -0.57 0.00 0.00 34.95 34.98 1iv4 s ARG 302 CO 0.91 -0.30 1.14 -1.25 -1.08 0.00 0.00 175.30 174.72 1iv4 s PRO 303 N -1.80 1.71 0.21 3.89 0.04 -1.26 -4.91 135.00 132.88 1iv4 s PRO 303 Ca -0.09 -0.25 -0.31 0.00 0.04 0.00 0.00 61.00 60.39 1iv4 s PRO 303 Cb -0.02 -2.04 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 1iv4 s PRO 303 CO 0.03 -1.65 1.50 0.15 0.04 0.00 0.00 177.00 177.08 1iv4 s LYS 304 N -5.49 4.24 0.04 4.56 1.02 -1.26 -4.93 119.74 117.92 1iv4 s LYS 304 Ca 0.64 2.33 0.22 0.00 0.02 0.00 0.00 55.97 59.19 1iv4 s LYS 304 Cb -0.09 -3.13 -0.12 0.00 -0.52 0.00 0.00 37.83 33.97 1iv4 s LYS 304 CO 0.48 -0.52 0.83 1.28 -0.92 0.00 0.00 175.35 176.51 1iv4 n LEU 305 N 3.13 0.49 -0.26 3.17 4.77 -1.26 -4.45 117.00 122.60 1iv4 n LEU 305 Ca 0.10 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1iv4 n LEU 305 Cb 0.39 -0.05 0.07 0.00 -2.33 0.00 0.00 43.42 41.51 1iv4 n LEU 305 CO 0.61 0.01 0.69 1.23 -1.33 0.00 0.00 177.39 178.60 1iv4 h GLY 306 N 4.31 0.39 1.84 -0.72 0.00 -2.00 0.38 103.07 107.27 1iv4 h GLY 306 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1iv4 h GLY 306 CO 0.00 -0.27 0.06 -2.55 0.00 0.00 0.00 176.54 173.78 1iv4 h PRO 307 N -0.03 0.00 -0.22 4.80 0.11 -2.01 -1.63 132.00 133.02 1iv4 h PRO 307 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1iv4 h PRO 307 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 1iv4 h PRO 307 CO -0.77 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 177.74 1iv4 n HIS 308 N -2.34 0.28 -0.07 0.65 8.25 0.08 -4.77 115.22 117.30 1iv4 n HIS 308 Ca -0.02 -0.28 -0.07 0.00 -0.26 0.00 0.00 57.72 57.10 1iv4 n HIS 308 Cb 0.10 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.19 1iv4 n HIS 308 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1iv4 h ARG 309 N 2.25 -0.08 -0.44 -0.41 2.43 -0.79 0.09 114.38 117.43 1iv4 h ARG 309 Ca 0.00 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.17 1iv4 h ARG 309 Cb 0.64 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.19 1iv4 h ARG 309 CO 0.00 -0.05 0.25 -0.22 -1.51 0.00 0.00 179.97 178.44 1iv4 h LYS 310 N -0.08 0.61 -0.45 0.20 3.64 -1.86 -0.72 116.57 117.90 1iv4 h LYS 310 Ca 0.15 -0.07 -0.08 0.00 -1.27 0.00 0.00 60.65 59.38 1iv4 h LYS 310 Cb 0.31 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1iv4 h LYS 310 CO -0.35 0.47 -0.05 0.00 -2.27 0.00 0.00 179.45 177.25 1iv4 h ALA 311 N 1.10 1.06 -0.09 5.00 0.00 -1.78 0.11 119.26 124.66 1iv4 h ALA 311 Ca 0.16 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1iv4 h ALA 311 Cb 0.03 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1iv4 h ALA 311 CO -0.03 0.58 0.02 -0.07 0.00 0.00 0.00 179.25 179.75 1iv4 h LEU 312 N 0.72 0.14 -0.86 0.00 3.38 -0.61 0.30 115.31 118.37 1iv4 h LEU 312 Ca 0.13 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.80 1iv4 h LEU 312 Cb 0.51 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.19 1iv4 h LEU 312 CO 0.03 0.36 0.24 0.58 0.09 0.00 0.00 178.44 179.74 1iv4 h VAL 313 N -0.08 1.25 -0.89 1.22 2.07 -1.07 -1.92 116.25 116.84 1iv4 h VAL 313 Ca 0.03 -0.85 -0.02 0.00 0.82 0.00 0.00 66.70 66.68 1iv4 h VAL 313 Cb 0.28 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 30.46 1iv4 h VAL 313 CO 0.00 0.33 0.49 0.44 0.02 0.00 0.00 177.57 178.85 1iv4 h ASP 314 N 1.04 1.11 -0.09 0.57 3.32 -0.61 -0.61 116.42 121.15 1iv4 h ASP 314 Ca 0.23 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 1iv4 h ASP 314 Cb 0.27 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 1iv4 h ASP 314 CO -0.01 0.89 0.04 -1.28 -1.72 0.00 0.00 179.24 177.16 1iv4 h SER 315 N 1.25 0.12 -0.24 6.45 0.87 -0.50 -0.73 113.55 120.76 1iv4 h SER 315 Ca 0.31 -0.12 -0.06 0.00 -1.23 0.00 0.00 61.79 60.69 1iv4 h SER 315 Cb 0.02 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 1iv4 h SER 315 CO -0.05 0.21 -0.02 -0.07 -0.53 0.00 0.00 176.83 176.36 1iv4 h LEU 316 N 0.02 0.54 -0.58 2.23 3.38 -1.19 -1.21 115.31 118.50 1iv4 h LEU 316 Ca 0.03 -0.12 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 1iv4 h LEU 316 Cb 0.12 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1iv4 h LEU 316 CO -0.00 0.63 0.07 -1.28 0.09 0.00 0.00 178.44 177.95 1iv4 h SER 317 N 0.54 0.94 -0.12 -0.43 0.87 -0.86 -0.43 113.55 114.06 1iv4 h SER 317 Ca 0.11 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.37 1iv4 h SER 317 Cb 0.39 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 1iv4 h SER 317 CO 0.02 0.98 -0.02 -0.09 -0.53 0.00 0.00 176.83 177.18 1iv4 h ARG 318 N 0.87 0.23 -0.50 2.24 2.43 -0.81 -0.30 114.38 118.54 1iv4 h ARG 318 Ca 0.17 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.19 1iv4 h ARG 318 Cb 0.45 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.97 1iv4 h ARG 318 CO 0.02 0.52 0.04 -0.07 -1.51 0.00 0.00 179.97 178.96 1iv4 h LEU 319 N -0.08 0.83 -1.93 3.80 4.07 -1.19 -3.07 115.31 117.74 1iv4 h LEU 319 Ca 0.03 -0.29 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1iv4 h LEU 319 Cb 0.43 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.95 1iv4 h LEU 319 CO 0.01 0.91 0.00 0.23 -1.08 0.00 0.00 178.44 178.51 1iv4 n MET 320 N -4.36 2.27 -3.76 1.13 2.81 -0.18 -4.96 117.12 110.07 1iv4 n MET 320 Ca 0.01 -1.91 -0.25 0.00 -1.81 0.00 0.00 57.70 53.74 1iv4 n MET 320 Cb 0.29 -1.48 0.04 0.00 -0.71 0.00 0.00 33.22 31.36 1iv4 n MET 320 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1iv4 n ARG 321 N 1.13 -5.65 -4.67 0.03 1.74 -0.17 -4.99 116.66 104.08 1iv4 n ARG 321 Ca 0.18 0.65 -0.31 0.00 -0.77 0.00 0.00 57.85 57.60 1iv4 n ARG 321 Cb 0.52 -5.44 -0.13 0.00 -1.02 0.00 0.00 32.46 26.40 1iv4 n ARG 321 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1iv4 s LEU 322 N -6.98 2.63 0.67 0.55 1.43 -0.91 -5.06 118.68 111.01 1iv4 s LEU 322 Ca 0.35 -0.40 -0.17 0.00 -1.03 0.00 0.00 54.13 52.88 1iv4 s LEU 322 Cb -0.17 -1.53 0.00 0.00 0.03 0.00 0.00 46.19 44.52 1iv4 s LEU 322 CO 0.80 0.26 1.22 -2.16 0.23 0.00 0.00 176.35 176.71 1iv4 s PRO 323 N -1.38 2.52 0.49 1.29 0.04 -1.26 -4.58 135.00 132.11 1iv4 s PRO 323 Ca 0.14 1.83 0.15 0.00 0.04 0.00 0.00 61.00 63.17 1iv4 s PRO 323 Cb -0.11 -1.87 1.17 0.00 0.04 0.00 0.00 34.50 33.73 1iv4 s PRO 323 CO 0.05 -1.56 2.09 1.96 0.04 0.00 0.00 177.00 179.58 1iv4 h GLN 324 N 0.27 0.17 0.00 4.56 1.08 -1.94 0.14 115.11 119.39 1iv4 h GLN 324 Ca -0.49 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.70 1iv4 h GLN 324 Cb 1.30 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.70 1iv4 h GLN 324 CO 0.52 0.11 0.00 -0.40 -0.95 0.00 0.00 178.83 178.11 1iv4 n ASP 325 N -4.49 0.00 -1.01 1.46 5.68 -1.26 -2.72 116.55 114.21 1iv4 n ASP 325 Ca 0.02 0.07 0.08 0.00 -0.50 0.00 0.00 54.79 54.46 1iv4 n ASP 325 Cb 0.19 -0.33 0.24 0.00 -1.14 0.00 0.00 41.12 40.08 1iv4 n ASP 325 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1iv4 n ARG 326 N -1.33 2.97 -3.76 0.11 5.12 0.50 -4.82 116.66 115.45 1iv4 n ARG 326 Ca 0.10 -2.42 -0.38 0.00 -1.93 0.00 0.00 57.85 53.22 1iv4 n ARG 326 Cb 0.21 -1.50 -0.12 0.00 -1.16 0.00 0.00 32.46 29.89 1iv4 n ARG 326 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1iv4 s ILE 327 N -1.28 3.83 -0.44 0.55 -1.09 -1.10 -1.69 121.20 119.98 1iv4 s ILE 327 Ca 0.36 -0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 57.78 1iv4 s ILE 327 Cb 0.21 -3.10 0.12 0.00 -1.58 0.00 0.00 42.46 38.11 1iv4 s ILE 327 CO 0.22 -0.08 0.24 -0.83 -1.23 0.00 0.00 174.94 173.25 1iv4 s GLY 328 N 1.44 2.09 -0.18 6.18 0.00 0.80 -4.99 107.32 112.66 1iv4 s GLY 328 Ca -0.00 -2.68 -0.01 0.00 0.00 0.00 0.00 44.72 42.03 1iv4 s GLY 328 CO 0.03 1.04 -0.11 -2.27 0.00 0.00 0.00 173.10 171.78 1iv4 s LEU 329 N 0.90 2.63 0.11 0.66 2.96 -1.26 0.61 118.68 125.29 1iv4 s LEU 329 Ca 0.10 -0.44 0.06 0.00 -0.22 0.00 0.00 54.13 53.63 1iv4 s LEU 329 Cb -0.22 -1.63 -0.04 0.00 0.50 0.00 0.00 46.19 44.80 1iv4 s LEU 329 CO -0.04 0.05 -0.14 0.42 -1.32 0.00 0.00 176.35 175.31 1iv4 s THR 330 N 1.05 1.28 0.07 3.68 -4.23 -0.53 -5.00 115.64 111.97 1iv4 s THR 330 Ca -0.00 -1.61 0.09 0.00 -1.18 0.00 0.00 61.69 58.98 1iv4 s THR 330 Cb -0.15 -1.42 -0.03 0.00 1.34 0.00 0.00 72.50 72.24 1iv4 s THR 330 CO -0.02 -0.36 -0.25 -0.36 -0.54 0.00 0.00 174.62 173.09 1iv4 s PHE 331 N -1.91 2.14 0.06 3.99 0.08 -1.26 -1.15 117.98 119.93 1iv4 s PHE 331 Ca 0.06 -0.40 -0.10 0.00 0.12 0.00 0.00 56.93 56.62 1iv4 s PHE 331 Cb -0.06 -1.24 0.00 0.00 -0.57 0.00 0.00 43.02 41.16 1iv4 s PHE 331 CO 0.03 0.18 0.21 0.15 -0.10 0.00 0.00 175.22 175.69 1iv4 s LYS 332 N -1.51 0.78 0.82 0.44 -0.14 0.01 -4.94 119.74 115.21 1iv4 s LYS 332 Ca 0.11 -0.76 -0.09 0.00 -1.36 0.00 0.00 55.97 53.88 1iv4 s LYS 332 Cb -0.10 0.32 0.14 0.00 -1.68 0.00 0.00 37.83 36.52 1iv4 s LYS 332 CO 0.03 -0.24 1.14 0.95 -0.76 0.00 0.00 175.35 176.47 1iv4 s THR 333 N -3.15 2.10 -2.29 2.17 -4.23 -1.25 -0.47 115.64 108.52 1iv4 s THR 333 Ca -0.01 -0.26 0.21 0.00 -1.18 0.00 0.00 61.69 60.45 1iv4 s THR 333 Cb 0.02 -2.84 0.44 0.00 1.34 0.00 0.00 72.50 71.46 1iv4 s THR 333 CO -0.07 0.00 1.45 -1.54 -0.54 0.00 0.00 174.62 173.92 1iv4 n SER 334 N -3.26 2.68 -4.13 3.99 3.41 -1.26 -4.67 113.62 110.38 1iv4 n SER 334 Ca 0.13 -1.90 -0.34 0.00 -0.26 0.00 0.00 58.87 56.50 1iv4 n SER 334 Cb 0.60 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.31 1iv4 n SER 334 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1iv4 n GLU 335 N 0.98 -3.74 -0.20 4.33 -0.58 -1.26 -1.11 120.64 119.06 1iv4 n GLU 335 Ca 0.18 0.43 0.00 0.00 -0.42 0.00 0.00 57.16 57.35 1iv4 n GLU 335 Cb 0.47 -5.15 0.00 0.00 -0.57 0.00 0.00 31.44 26.19 1iv4 n GLU 335 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1iv4 n GLY 336 N -1.51 2.03 0.25 0.62 0.00 -1.26 -4.92 105.19 100.40 1iv4 n GLY 336 Ca 0.04 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.99 1iv4 n GLY 336 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1iv4 h LEU 337 N 0.00 0.67 -5.75 0.99 5.85 -1.53 -3.38 115.31 112.16 1iv4 h LEU 337 Ca 0.00 -0.25 -0.45 0.00 0.84 0.00 0.00 57.88 58.02 1iv4 h LEU 337 Cb 0.00 -0.18 -0.33 0.00 0.37 0.00 0.00 40.66 40.51 1iv4 h LEU 337 CO 0.00 0.92 -0.98 0.00 -0.34 0.00 0.00 178.44 178.03 1iv4 n ALA 338 N -2.50 1.40 0.30 1.25 0.00 -1.26 -4.98 120.51 114.73 1iv4 n ALA 338 Ca -0.00 -2.91 0.17 0.00 0.00 0.00 0.00 53.44 50.69 1iv4 n ALA 338 Cb 0.45 -0.96 0.67 0.00 0.00 0.00 0.00 19.45 19.61 1iv4 n ALA 338 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1iv4 h PRO 339 N 3.55 0.00 -0.41 0.00 0.13 -1.94 -2.99 132.00 130.35 1iv4 h PRO 339 Ca 0.03 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 65.00 1iv4 h PRO 339 Cb 0.96 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.99 1iv4 h PRO 339 CO 0.42 0.00 0.04 0.43 -0.23 0.00 0.00 178.00 178.66 1iv4 n SER 340 N -2.95 3.18 -4.13 1.44 7.64 -1.26 -4.77 113.62 112.77 1iv4 n SER 340 Ca 0.01 -3.49 -0.11 0.00 1.01 0.00 0.00 58.87 56.28 1iv4 n SER 340 Cb 0.29 -0.63 -0.10 0.00 -1.01 0.00 0.00 64.21 62.75 1iv4 n SER 340 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1iv4 s HIS 341 N -3.11 0.81 -0.12 1.43 3.76 -1.13 -0.01 115.29 116.92 1iv4 s HIS 341 Ca 0.46 -0.79 -0.03 0.00 -0.15 0.00 0.00 55.06 54.55 1iv4 s HIS 341 Cb 0.40 -0.48 -0.03 0.00 1.11 0.00 0.00 32.58 33.58 1iv4 s HIS 341 CO 0.04 -0.14 -0.00 0.54 -0.85 0.00 0.00 174.74 174.33 1iv4 s VAL 342 N -2.92 4.23 0.05 -0.90 0.11 -0.15 -4.60 120.40 116.22 1iv4 s VAL 342 Ca 0.05 -0.26 0.07 0.00 -2.93 0.00 0.00 61.98 58.91 1iv4 s VAL 342 Cb 0.01 -2.82 -0.03 0.00 -1.53 0.00 0.00 36.38 32.01 1iv4 s VAL 342 CO -0.03 0.55 -0.21 -1.10 -3.33 0.00 0.00 175.10 170.98 1iv4 s GLN 343 N -0.32 1.36 0.00 1.54 -0.21 -0.21 -1.14 119.66 120.68 1iv4 s GLN 343 Ca 0.06 -0.96 0.00 0.00 0.02 0.00 0.00 55.36 54.48 1iv4 s GLN 343 Cb -0.12 -1.49 -0.00 0.00 1.00 0.00 0.00 33.01 32.39 1iv4 s GLN 343 CO 0.02 0.38 -0.01 0.00 -2.12 0.00 0.00 175.29 173.56 1iv4 s ALA 344 N -0.84 0.05 -0.03 6.09 0.00 -0.34 -0.25 121.76 126.45 1iv4 s ALA 344 Ca 0.07 -0.06 0.01 0.00 0.00 0.00 0.00 51.96 51.98 1iv4 s ALA 344 Cb -0.09 -0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.05 1iv4 s ALA 344 CO 0.02 0.00 -0.05 1.03 0.00 0.00 0.00 175.76 176.76 1iv4 s ARG 345 N -0.11 0.72 0.01 0.00 0.52 -0.84 -1.07 118.95 118.18 1iv4 s ARG 345 Ca -0.01 -0.12 0.02 0.00 -0.52 0.00 0.00 55.73 55.10 1iv4 s ARG 345 Cb -0.01 -0.73 -0.01 0.00 0.52 0.00 0.00 34.95 34.72 1iv4 s ARG 345 CO -0.00 -0.03 -0.08 0.00 0.02 0.00 0.00 175.30 175.21 1iv4 s ALA 346 N 0.66 0.61 -0.08 2.13 0.00 0.38 -1.13 121.76 124.33 1iv4 s ALA 346 Ca -0.09 -0.42 0.04 0.00 0.00 0.00 0.00 51.96 51.49 1iv4 s ALA 346 Cb -0.12 -0.11 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 1iv4 s ALA 346 CO 0.00 0.11 -0.22 0.08 0.00 0.00 0.00 175.76 175.74 1iv4 s VAL 347 N -0.45 2.32 0.12 0.00 1.01 0.30 -1.11 120.40 122.60 1iv4 s VAL 347 Ca 0.00 -0.96 0.11 0.00 0.00 0.00 0.00 61.98 61.13 1iv4 s VAL 347 Cb -0.04 -1.88 -0.04 0.00 0.00 0.00 0.00 36.38 34.42 1iv4 s VAL 347 CO 0.00 0.56 -0.27 0.68 0.00 0.00 0.00 175.10 176.07 1iv4 s VAL 348 N -0.04 2.25 -0.10 2.92 -7.23 -0.03 -0.78 120.40 117.39 1iv4 s VAL 348 Ca -0.06 -1.73 0.03 0.00 -1.81 0.00 0.00 61.98 58.40 1iv4 s VAL 348 Cb -0.15 -1.99 0.01 0.00 0.56 0.00 0.00 36.38 34.81 1iv4 s VAL 348 CO 0.05 0.11 -0.20 -0.22 -0.31 0.00 0.00 175.10 174.53 1iv4 s LEU 349 N -2.00 1.95 0.08 1.32 2.96 -0.56 -1.47 118.68 120.95 1iv4 s LEU 349 Ca 0.14 -0.50 0.04 0.00 -0.22 0.00 0.00 54.13 53.59 1iv4 s LEU 349 Cb -0.10 -1.26 -0.03 0.00 0.50 0.00 0.00 46.19 45.30 1iv4 s LEU 349 CO 0.06 0.10 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.32 1iv4 s LEU 350 N 0.57 2.32 0.00 -0.68 1.02 0.03 -0.29 118.68 121.64 1iv4 s LEU 350 Ca -0.15 -0.68 0.00 0.00 0.02 0.00 0.00 54.13 53.33 1iv4 s LEU 350 Cb -0.17 -0.37 0.00 0.00 0.02 0.00 0.00 46.19 45.67 1iv4 s LEU 350 CO 0.05 -0.17 0.00 0.47 0.02 0.00 0.00 176.35 176.72