#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ird n HIS 202 N 0.00 3.40 -3.52 1.45 -0.00 -1.26 -4.93 115.22 110.36 1ird n HIS 202 Ca 0.00 -3.80 -0.37 0.00 -0.00 0.00 0.00 57.72 53.55 1ird n HIS 202 Cb 0.00 -0.70 -0.06 0.00 -0.00 0.00 0.00 29.99 29.23 1ird n HIS 202 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1ird s LEU 203 N -2.69 4.37 0.75 2.41 1.02 -1.26 -5.07 118.68 118.21 1ird s LEU 203 Ca 0.39 0.76 -0.11 0.00 0.02 0.00 0.00 54.13 55.19 1ird s LEU 203 Cb 0.14 -2.49 0.04 0.00 0.02 0.00 0.00 46.19 43.91 1ird s LEU 203 CO -0.00 0.22 1.08 0.42 0.02 0.00 0.00 176.35 178.08 1ird s THR 204 N -0.36 3.53 0.30 5.49 -4.23 -1.26 -4.77 115.64 114.34 1ird s THR 204 Ca 0.21 0.50 0.03 0.00 -1.18 0.00 0.00 61.69 61.25 1ird s THR 204 Cb -0.15 -3.16 0.29 0.00 1.34 0.00 0.00 72.50 70.82 1ird s THR 204 CO 0.09 -0.65 1.83 -0.65 -0.54 0.00 0.00 174.62 174.71 1ird h PRO 205 N -0.97 0.90 -0.24 3.99 0.11 -1.99 0.13 132.00 133.94 1ird h PRO 205 Ca -0.45 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 1ird h PRO 205 Cb 1.24 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1ird h PRO 205 CO 0.56 0.60 -0.27 0.93 -0.21 0.00 0.00 178.00 179.61 1ird h GLU 206 N 0.93 0.46 -0.58 1.05 5.08 -2.00 -0.64 114.58 118.87 1ird h GLU 206 Ca 0.50 -0.18 -0.10 0.00 -1.00 0.00 0.00 59.36 58.58 1ird h GLU 206 Cb 0.57 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 1ird h GLU 206 CO -0.27 0.69 -0.05 0.93 -1.00 0.00 0.00 179.01 179.31 1ird h GLU 207 N 0.40 1.05 -0.83 2.33 5.08 -1.57 -2.20 114.58 118.84 1ird h GLU 207 Ca 0.06 -0.36 -0.02 0.00 -1.00 0.00 0.00 59.36 58.04 1ird h GLU 207 Cb 0.68 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.81 1ird h GLU 207 CO 0.05 1.05 0.45 0.87 -1.00 0.00 0.00 179.01 180.43 1ird h LYS 208 N 0.95 1.16 -0.51 2.33 1.57 -0.44 0.26 116.57 121.89 1ird h LYS 208 Ca 0.16 -0.14 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1ird h LYS 208 Cb 0.61 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1ird h LYS 208 CO 0.04 0.85 0.19 1.03 -0.57 0.00 0.00 179.45 181.00 1ird h SER 209 N 1.17 0.72 -0.12 0.86 0.87 -1.00 0.14 113.55 116.19 1ird h SER 209 Ca 0.29 -0.18 0.01 0.00 -1.23 0.00 0.00 61.79 60.68 1ird h SER 209 Cb 0.04 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.80 1ird h SER 209 CO -0.05 0.70 0.04 0.00 -0.53 0.00 0.00 176.83 176.99 1ird h ALA 210 N 1.04 0.12 -0.31 6.23 0.00 -0.75 -0.16 119.26 125.44 1ird h ALA 210 Ca 0.17 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1ird h ALA 210 Cb 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ird h ALA 210 CO -0.01 -0.42 0.02 0.28 0.00 0.00 0.00 179.25 179.12 1ird h VAL 211 N 0.09 1.25 0.00 0.00 2.07 -0.25 -2.62 116.25 116.79 1ird h VAL 211 Ca 0.05 -0.90 -0.19 0.00 0.82 0.00 0.00 66.70 66.48 1ird h VAL 211 Cb 0.03 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.00 1ird h VAL 211 CO -0.05 0.29 -0.90 0.71 0.02 0.00 0.00 177.57 177.64 1ird h THR 212 N 0.34 1.63 -0.87 2.57 1.35 -0.59 -1.50 112.91 115.84 1ird h THR 212 Ca 0.09 -3.10 -0.01 0.00 -0.55 0.00 0.00 66.41 62.84 1ird h THR 212 Cb 0.40 2.68 -0.04 0.00 -1.73 0.00 0.00 68.15 69.46 1ird h THR 212 CO 0.01 0.88 0.51 0.00 -0.25 0.00 0.00 175.52 176.68 1ird h ALA 213 N 1.10 1.11 -0.29 6.62 0.00 -1.01 -1.94 119.26 124.85 1ird h ALA 213 Ca -0.01 -0.11 -0.19 0.00 0.00 0.00 0.00 54.91 54.61 1ird h ALA 213 Cb 1.61 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1ird h ALA 213 CO 0.12 0.59 -0.55 1.25 0.00 0.00 0.00 179.25 180.66 1ird h LEU 214 N 1.21 0.98 -1.85 0.00 5.85 -1.36 -3.18 115.31 116.96 1ird h LEU 214 Ca 0.31 -0.52 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1ird h LEU 214 Cb -0.03 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.72 1ird h LEU 214 CO -0.06 1.33 -0.09 -0.25 -0.34 0.00 0.00 178.44 179.03 1ird h TRP 215 N 0.68 0.00 0.00 1.25 2.91 -0.85 -0.48 115.95 119.45 1ird h TRP 215 Ca 0.02 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.04 1ird h TRP 215 Cb 1.15 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.80 1ird h TRP 215 CO 0.07 0.09 0.00 0.78 -1.03 0.00 0.00 178.44 178.35 1ird h GLY 216 N 0.28 0.00 -0.23 2.65 0.00 -1.34 -1.86 103.07 102.57 1ird h GLY 216 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ird h GLY 216 CO 0.01 0.00 -0.47 0.28 0.00 0.00 0.00 176.54 176.36 1ird n LYS 217 N -2.90 0.80 -2.23 4.80 5.02 -0.20 -4.96 118.16 118.51 1ird n LYS 217 Ca -0.01 -0.59 -0.41 0.00 -2.02 0.00 0.00 58.31 55.27 1ird n LYS 217 Cb 0.18 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.67 1ird n LYS 217 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ird s VAL 218 N -2.60 3.24 -0.53 -0.18 1.01 -0.70 -4.97 120.40 115.67 1ird s VAL 218 Ca 0.19 1.01 -0.28 0.00 0.00 0.00 0.00 61.98 62.90 1ird s VAL 218 Cb 0.18 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.94 1ird s VAL 218 CO 0.60 0.15 1.28 0.21 0.00 0.00 0.00 175.10 177.34 1ird s ASN 219 N 0.38 6.37 0.00 3.32 3.84 -1.26 -4.89 114.94 122.70 1ird s ASN 219 Ca 0.57 0.32 0.22 0.00 0.21 0.00 0.00 52.86 54.18 1ird s ASN 219 Cb -0.36 -2.55 0.92 0.00 -0.55 0.00 0.00 41.25 38.71 1ird s ASN 219 CO 0.38 -1.50 1.69 1.33 -2.79 0.00 0.00 177.10 176.21 1ird n VAL 220 N 6.82 0.51 0.77 -5.21 0.24 -1.26 -1.62 118.33 118.57 1ird n VAL 220 Ca 0.11 0.13 0.12 0.00 -2.04 0.00 0.00 64.34 62.66 1ird n VAL 220 Cb 0.49 -0.76 0.27 0.00 -1.47 0.00 0.00 33.84 32.38 1ird n VAL 220 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 1ird n ASP 221 N -1.51 0.56 0.00 -1.34 8.00 -1.26 -4.59 116.55 116.41 1ird n ASP 221 Ca 0.05 0.09 0.00 0.00 0.71 0.00 0.00 54.79 55.64 1ird n ASP 221 Cb 0.25 0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.37 1ird n ASP 221 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ird n GLU 222 N -1.85 0.73 0.06 -1.24 1.02 -0.91 -4.76 120.64 113.70 1ird n GLU 222 Ca 0.05 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.18 1ird n GLU 222 Cb 0.39 -0.97 0.28 0.00 -0.02 0.00 0.00 31.44 31.13 1ird n GLU 222 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ird h VAL 223 N 0.00 1.24 -0.30 2.62 2.07 -1.55 -1.85 116.25 118.48 1ird h VAL 223 Ca 0.00 -1.09 -0.15 0.00 0.82 0.00 0.00 66.70 66.28 1ird h VAL 223 Cb 0.94 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.02 1ird h VAL 223 CO 0.00 0.34 -0.42 1.23 0.02 0.00 0.00 177.57 178.74 1ird h GLY 224 N 0.95 0.80 1.76 2.17 0.00 -1.83 -0.58 103.07 106.33 1ird h GLY 224 Ca 0.05 -0.82 -0.07 0.00 0.00 0.00 0.00 47.33 46.49 1ird h GLY 224 CO 0.04 0.74 -0.19 -1.33 0.00 0.00 0.00 176.54 175.80 1ird h GLY 225 N 0.93 0.31 0.98 4.60 0.00 -1.62 0.43 103.07 108.70 1ird h GLY 225 Ca 0.04 -0.21 -0.09 0.00 0.00 0.00 0.00 47.33 47.07 1ird h GLY 225 CO 0.09 0.20 -0.13 -2.09 0.00 0.00 0.00 176.54 174.61 1ird h GLU 226 N 0.26 0.77 -0.22 4.80 4.57 -0.98 0.36 114.58 124.15 1ird h GLU 226 Ca 0.05 -0.31 -0.10 0.00 -1.18 0.00 0.00 59.36 57.82 1ird h GLU 226 Cb 0.49 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.04 1ird h GLU 226 CO 0.03 0.92 -0.23 0.00 -1.18 0.00 0.00 179.01 178.55 1ird h ALA 227 N 0.83 0.33 -0.61 2.92 0.00 -0.90 -1.16 119.26 120.67 1ird h ALA 227 Ca 0.09 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 1ird h ALA 227 Cb 0.66 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1ird h ALA 227 CO 0.04 0.29 0.11 1.25 0.00 0.00 0.00 179.25 180.95 1ird h LEU 228 N 0.24 0.95 -0.45 0.00 5.85 -0.85 -0.27 115.31 120.78 1ird h LEU 228 Ca 0.03 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.49 1ird h LEU 228 Cb 0.79 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1ird h LEU 228 CO 0.06 0.96 0.25 1.23 -0.34 0.00 0.00 178.44 180.59 1ird h GLY 229 N 0.90 0.68 1.38 3.75 0.00 -0.93 -1.41 103.07 107.44 1ird h GLY 229 Ca 0.19 -0.31 -0.07 0.00 0.00 0.00 0.00 47.33 47.14 1ird h GLY 229 CO 0.01 0.30 0.02 3.21 0.00 0.00 0.00 176.54 180.07 1ird h ARG 230 N 0.60 0.76 -0.42 4.80 3.08 -0.94 -1.69 114.38 120.57 1ird h ARG 230 Ca 0.16 -0.19 0.06 0.00 0.07 0.00 0.00 59.98 60.07 1ird h ARG 230 Cb 0.06 -0.10 -0.05 0.00 0.08 0.00 0.00 29.97 29.96 1ird h ARG 230 CO -0.03 0.76 0.13 1.25 -1.07 0.00 0.00 179.97 181.02 1ird h LEU 231 N 0.72 0.11 -1.27 3.04 5.85 -0.35 0.80 115.31 124.22 1ird h LEU 231 Ca 0.14 0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.84 1ird h LEU 231 Cb 0.42 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 1ird h LEU 231 CO 0.02 0.10 -0.36 -0.07 -0.34 0.00 0.00 178.44 177.78 1ird h LEU 232 N 0.28 0.00 0.11 2.25 3.38 -0.73 -0.11 115.31 120.49 1ird h LEU 232 Ca 0.20 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.97 1ird h LEU 232 Cb 0.21 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.97 1ird h LEU 232 CO -0.22 0.36 -0.95 0.58 0.09 0.00 0.00 178.44 178.30 1ird h VAL 233 N 0.00 1.35 0.03 1.22 2.07 -1.02 -3.33 116.25 116.58 1ird h VAL 233 Ca -0.00 -2.46 -0.22 0.00 0.82 0.00 0.00 66.70 64.84 1ird h VAL 233 Cb 0.66 3.01 -0.00 0.00 -1.52 0.00 0.00 31.29 33.44 1ird h VAL 233 CO 0.05 0.68 -0.98 0.58 0.02 0.00 0.00 177.57 177.92 1ird h VAL 234 N -0.44 1.47 -2.57 2.57 2.07 -0.81 -3.38 116.25 115.15 1ird h VAL 234 Ca -0.19 -2.67 -0.60 0.00 0.82 0.00 0.00 66.70 64.05 1ird h VAL 234 Cb 1.60 2.56 -0.41 0.00 -1.52 0.00 0.00 31.29 33.52 1ird h VAL 234 CO 0.09 0.79 -0.69 -1.22 0.02 0.00 0.00 177.57 176.55 1ird n TYR 235 N -3.65 2.42 0.48 1.57 4.01 -0.06 -4.99 117.16 116.94 1ird n TYR 235 Ca -0.06 -4.04 0.11 0.00 -0.16 0.00 0.00 57.90 53.75 1ird n TYR 235 Cb 0.87 -0.45 0.44 0.00 -0.31 0.00 0.00 39.34 39.89 1ird n TYR 235 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1ird n PRO 236 N 1.65 0.14 0.30 -0.72 -0.05 -1.25 -1.03 135.00 134.05 1ird n PRO 236 Ca 0.25 0.33 0.17 0.00 -0.05 0.00 0.00 63.50 64.20 1ird n PRO 236 Cb 0.41 -1.75 0.97 0.00 -0.05 0.00 0.00 33.50 33.08 1ird n PRO 236 CO 0.00 0.00 0.00 0.11 -0.05 0.00 0.00 175.50 175.56 1ird h TRP 237 N 0.00 0.00 0.00 0.54 0.09 -1.92 -1.90 115.95 112.76 1ird h TRP 237 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1ird h TRP 237 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.62 1ird h TRP 237 CO 0.00 0.00 0.00 1.79 0.09 0.00 0.00 178.44 180.32 1ird h THR 238 N 0.00 0.00 0.00 0.12 1.35 -1.40 -1.68 112.91 111.30 1ird h THR 238 Ca 0.01 -0.19 -0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1ird h THR 238 Cb 0.07 0.98 -0.00 0.00 -1.73 0.00 0.00 68.15 67.47 1ird h THR 238 CO -0.00 0.00 -0.02 1.56 -0.25 0.00 0.00 175.52 176.81 1ird h GLN 239 N 0.00 0.00 -0.84 4.72 4.20 -1.55 -2.64 115.11 118.99 1ird h GLN 239 Ca 0.00 0.00 0.23 0.00 0.06 0.00 0.00 58.65 58.94 1ird h GLN 239 Cb 0.23 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.97 1ird h GLN 239 CO 0.00 0.02 0.59 -0.09 -0.67 0.00 0.00 178.83 178.69 1ird h ARG 240 N 0.00 0.07 -0.01 1.46 2.43 -1.51 -0.41 114.38 116.41 1ird h ARG 240 Ca -0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1ird h ARG 240 Cb 0.10 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1ird h ARG 240 CO 0.00 0.04 -0.16 1.19 -1.51 0.00 0.00 179.97 179.54 1ird n PHE 241 N -4.33 0.00 -2.12 2.20 3.01 -1.00 -4.27 117.46 110.95 1ird n PHE 241 Ca 0.17 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.57 1ird n PHE 241 Cb 0.86 -0.09 0.08 0.00 -0.01 0.00 0.00 39.48 40.32 1ird n PHE 241 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 1ird n PHE 242 N -0.45 1.18 0.07 1.38 3.01 -0.16 -4.84 117.46 117.65 1ird n PHE 242 Ca 0.15 -1.70 0.10 0.00 1.01 0.00 0.00 57.45 57.00 1ird n PHE 242 Cb 0.34 -0.26 0.56 0.00 -0.01 0.00 0.00 39.48 40.11 1ird n PHE 242 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 1ird h GLU 243 N 1.71 0.24 0.00 -1.08 3.07 -1.74 -1.42 114.58 115.35 1ird h GLU 243 Ca 0.06 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1ird h GLU 243 Cb 1.38 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 29.24 1ird h GLU 243 CO 0.31 0.16 0.00 -1.13 -1.40 0.00 0.00 179.01 176.95 1ird n SER 244 N -4.48 0.00 0.00 1.42 3.41 -1.26 -3.32 113.62 109.38 1ird n SER 244 Ca 0.04 -0.13 0.12 0.00 -0.26 0.00 0.00 58.87 58.63 1ird n SER 244 Cb 0.22 -0.28 0.59 0.00 -0.26 0.00 0.00 64.21 64.48 1ird n SER 244 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1ird n PHE 245 N -1.28 0.00 -0.23 7.33 0.99 -0.54 -5.00 117.46 118.74 1ird n PHE 245 Ca 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.59 1ird n PHE 245 Cb 0.23 -0.34 0.00 0.00 -1.00 0.00 0.00 39.48 38.37 1ird n PHE 245 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1ird n GLY 246 N 0.82 0.47 3.58 1.37 0.00 -1.21 -4.80 105.19 105.41 1ird n GLY 246 Ca 0.10 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.82 1ird n GLY 246 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ird s ASP 247 N -4.00 5.71 -0.23 1.61 3.68 -1.26 -4.79 116.67 117.38 1ird s ASP 247 Ca 0.00 0.71 0.11 0.00 2.13 0.00 0.00 52.55 55.50 1ird s ASP 247 Cb 0.00 -2.53 0.44 0.00 -1.45 0.00 0.00 42.92 39.38 1ird s ASP 247 CO 0.00 -1.96 1.31 0.18 0.13 0.00 0.00 175.17 174.83 1ird n LEU 248 N 11.08 3.23 0.21 -1.34 4.77 -1.26 -4.23 117.00 129.46 1ird n LEU 248 Ca 0.20 -3.76 0.10 0.00 -0.03 0.00 0.00 56.01 52.51 1ird n LEU 248 Cb 0.49 -0.56 0.25 0.00 -2.33 0.00 0.00 43.42 41.28 1ird n LEU 248 CO 0.70 1.27 0.74 0.77 -1.33 0.00 0.00 177.39 179.54 1ird h SER 249 N 0.94 0.00 -5.22 -1.43 4.64 -1.91 -3.44 113.55 107.13 1ird h SER 249 Ca 0.08 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.28 1ird h SER 249 Cb 1.25 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.19 1ird h SER 249 CO 0.15 0.18 -0.67 0.42 -0.87 0.00 0.00 176.83 176.04 1ird s THR 250 N -3.28 0.21 0.22 2.95 -4.23 -1.26 -5.02 115.64 105.23 1ird s THR 250 Ca 0.04 -1.73 -0.07 0.00 -1.18 0.00 0.00 61.69 58.74 1ird s THR 250 Cb 0.07 -1.44 0.17 0.00 1.34 0.00 0.00 72.50 72.64 1ird s THR 250 CO 0.67 -0.96 1.75 -0.65 -0.54 0.00 0.00 174.62 174.89 1ird h PRO 251 N 3.22 0.48 -0.63 3.99 0.11 -1.99 -0.18 132.00 137.00 1ird h PRO 251 Ca -0.34 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.69 1ird h PRO 251 Cb 1.15 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 1ird h PRO 251 CO 0.64 0.32 0.19 -0.44 -0.21 0.00 0.00 178.00 178.50 1ird h ASP 252 N 0.49 0.89 -0.45 -2.05 3.32 -1.98 0.13 116.42 116.77 1ird h ASP 252 Ca 0.35 -0.15 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 1ird h ASP 252 Cb 0.43 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 1ird h ASP 252 CO -0.31 0.83 0.01 0.00 -1.72 0.00 0.00 179.24 178.05 1ird h ALA 253 N 1.29 0.61 -0.09 3.45 0.00 -1.63 -0.79 119.26 122.09 1ird h ALA 253 Ca 0.21 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ird h ALA 253 Cb 0.27 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ird h ALA 253 CO -0.01 0.39 0.04 0.28 0.00 0.00 0.00 179.25 179.96 1ird h VAL 254 N 0.64 1.12 0.00 0.00 2.07 -0.42 -1.93 116.25 117.73 1ird h VAL 254 Ca 0.13 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.26 1ird h VAL 254 Cb 0.48 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 1ird h VAL 254 CO 0.02 0.10 -0.23 0.24 0.02 0.00 0.00 177.57 177.73 1ird h MET 255 N 0.02 0.00 -0.19 1.57 2.07 -0.82 -2.56 114.93 115.02 1ird h MET 255 Ca 0.03 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.66 1ird h MET 255 Cb 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.86 1ird h MET 255 CO -0.00 0.23 0.00 0.41 1.07 0.00 0.00 176.91 178.61 1ird n GLY 256 N 0.08 1.11 3.64 8.32 0.00 -0.32 -4.85 105.19 113.18 1ird n GLY 256 Ca -0.00 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 1ird n GLY 256 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ird s ASN 257 N -1.74 6.56 0.56 1.61 3.84 -0.73 -4.90 114.94 120.13 1ird s ASN 257 Ca 0.34 1.67 0.26 0.00 0.21 0.00 0.00 52.86 55.33 1ird s ASN 257 Cb 0.21 -2.53 1.61 0.00 -0.55 0.00 0.00 41.25 39.99 1ird s ASN 257 CO 0.31 -1.10 2.19 -0.65 -2.79 0.00 0.00 177.10 175.05 1ird h PRO 258 N 9.93 0.00 -0.05 0.43 0.11 -1.90 -1.76 132.00 138.75 1ird h PRO 258 Ca -0.32 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.64 1ird h PRO 258 Cb 1.14 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1ird h PRO 258 CO 0.99 0.03 -0.64 0.87 -0.21 0.00 0.00 178.00 179.05 1ird h LYS 259 N 0.00 0.20 -0.25 1.05 1.57 -1.90 -0.72 116.57 116.52 1ird h LYS 259 Ca -0.00 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.60 1ird h LYS 259 Cb 0.08 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1ird h LYS 259 CO 0.00 0.77 0.02 0.28 -0.57 0.00 0.00 179.45 179.96 1ird h VAL 260 N 0.14 1.24 -0.42 0.50 2.07 -1.64 0.39 116.25 118.54 1ird h VAL 260 Ca -0.01 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1ird h VAL 260 Cb 1.15 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 32.20 1ird h VAL 260 CO 0.10 0.26 0.25 0.50 0.02 0.00 0.00 177.57 178.70 1ird h LYS 261 N 0.22 0.57 -0.48 1.57 3.64 -1.31 0.16 116.57 120.93 1ird h LYS 261 Ca 0.07 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.31 1ird h LYS 261 Cb 0.37 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.05 1ird h LYS 261 CO 0.01 0.42 -0.05 0.00 -2.27 0.00 0.00 179.45 177.56 1ird h ALA 262 N 1.11 0.66 -0.42 5.00 0.00 -1.05 -1.58 119.26 122.98 1ird h ALA 262 Ca 0.15 -0.31 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1ird h ALA 262 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1ird h ALA 262 CO -0.03 0.51 -0.26 1.25 0.00 0.00 0.00 179.25 180.72 1ird h HIS 263 N 0.74 1.02 -0.54 0.00 -0.00 -0.76 -2.69 115.15 112.92 1ird h HIS 263 Ca 0.13 -0.26 0.01 0.00 -0.00 0.00 0.00 60.37 60.26 1ird h HIS 263 Cb 0.59 -0.24 -0.03 0.00 -0.00 0.00 0.00 27.41 27.73 1ird h HIS 263 CO 0.04 1.04 0.36 0.78 -0.00 0.00 0.00 177.93 180.15 1ird h GLY 264 N 0.90 0.74 0.89 5.26 0.00 -0.48 -1.33 103.07 109.05 1ird h GLY 264 Ca 0.09 -0.27 0.03 0.00 0.00 0.00 0.00 47.33 47.19 1ird h GLY 264 CO 0.07 0.26 0.63 1.70 0.00 0.00 0.00 176.54 179.20 1ird h LYS 265 N 0.69 1.20 -0.34 4.80 3.64 -0.96 -0.32 116.57 125.29 1ird h LYS 265 Ca 0.20 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 1ird h LYS 265 Cb -0.03 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.50 1ird h LYS 265 CO -0.05 0.79 0.16 0.87 -2.27 0.00 0.00 179.45 178.95 1ird h LYS 266 N 1.24 0.49 -0.48 1.90 1.57 -1.13 -1.46 116.57 118.69 1ird h LYS 266 Ca 0.38 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 59.14 1ird h LYS 266 Cb -0.02 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.16 1ird h LYS 266 CO -0.12 0.45 0.22 0.28 -0.57 0.00 0.00 179.45 179.72 1ird h VAL 267 N 0.41 0.93 -0.16 0.50 2.07 -0.94 -1.96 116.25 117.10 1ird h VAL 267 Ca 0.12 -0.15 -0.09 0.00 0.82 0.00 0.00 66.70 67.39 1ird h VAL 267 Cb 0.13 0.45 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1ird h VAL 267 CO -0.01 0.08 -0.29 0.25 0.02 0.00 0.00 177.57 177.61 1ird h LEU 268 N 0.44 0.31 -1.16 2.57 5.85 -0.89 -1.87 115.31 120.56 1ird h LEU 268 Ca 0.21 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.79 1ird h LEU 268 Cb 0.15 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 1ird h LEU 268 CO -0.17 0.60 0.17 1.23 -0.34 0.00 0.00 178.44 179.93 1ird h GLY 269 N 1.04 0.82 0.99 3.75 0.00 -0.69 0.68 103.07 109.66 1ird h GLY 269 Ca 0.04 -0.43 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 1ird h GLY 269 CO 0.05 0.40 0.13 0.00 0.00 0.00 0.00 176.54 177.12 1ird h ALA 270 N 1.44 0.71 -0.92 3.60 0.00 -0.63 -1.02 119.26 122.45 1ird h ALA 270 Ca 0.17 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ird h ALA 270 Cb 0.20 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1ird h ALA 270 CO -0.01 0.41 0.60 0.74 0.00 0.00 0.00 179.25 180.98 1ird h PHE 271 N 0.76 1.12 -0.85 0.00 -1.00 -0.79 -0.48 116.94 115.70 1ird h PHE 271 Ca 0.17 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.98 1ird h PHE 271 Cb 0.34 -0.37 -0.04 0.00 3.61 0.00 0.00 35.95 39.49 1ird h PHE 271 CO 0.02 0.65 0.55 0.77 -1.61 0.00 0.00 178.31 178.69 1ird h SER 272 N 1.16 0.99 -0.30 2.17 0.02 -0.60 0.57 113.55 117.55 1ird h SER 272 Ca 0.36 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 1ird h SER 272 Cb -0.01 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.27 1ird h SER 272 CO -0.12 0.73 0.19 -0.78 -1.14 0.00 0.00 176.83 175.71 1ird h ASP 273 N 1.15 0.36 -0.83 3.07 -0.00 -0.57 -1.14 116.42 118.46 1ird h ASP 273 Ca 0.31 -0.03 0.07 0.00 -0.00 0.00 0.00 57.03 57.38 1ird h ASP 273 Cb -0.11 -0.09 -0.06 0.00 -0.00 0.00 0.00 39.33 39.07 1ird h ASP 273 CO -0.06 0.28 0.50 1.23 -0.00 0.00 0.00 179.24 181.19 1ird h GLY 274 N 0.40 1.25 1.43 -0.78 0.00 -0.41 -0.81 103.07 104.16 1ird h GLY 274 Ca 0.11 -0.36 0.03 0.00 0.00 0.00 0.00 47.33 47.11 1ird h GLY 274 CO -0.02 0.23 0.31 1.41 0.00 0.00 0.00 176.54 178.47 1ird h LEU 275 N 0.90 0.45 0.00 3.11 3.38 -0.07 -1.11 115.31 121.97 1ird h LEU 275 Ca 0.37 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1ird h LEU 275 Cb 0.21 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1ird h LEU 275 CO -0.19 0.32 -0.00 0.00 0.09 0.00 0.00 178.44 178.66 1ird n ALA 276 N -2.48 2.32 -2.75 1.53 0.00 -0.39 -4.00 120.51 114.73 1ird n ALA 276 Ca 0.05 -0.08 -0.14 0.00 0.00 0.00 0.00 53.44 53.27 1ird n ALA 276 Cb 0.14 -1.47 0.01 0.00 0.00 0.00 0.00 19.45 18.13 1ird n ALA 276 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1ird n HIS 277 N -1.70 1.41 0.30 0.00 8.25 -0.46 -4.93 115.22 118.09 1ird n HIS 277 Ca 0.07 -3.10 0.20 0.00 -0.26 0.00 0.00 57.72 54.62 1ird n HIS 277 Cb 0.36 -0.35 1.02 0.00 1.12 0.00 0.00 29.99 32.15 1ird n HIS 277 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1ird h LEU 278 N 2.94 0.00 -1.85 2.41 3.38 -1.60 -0.23 115.31 120.36 1ird h LEU 278 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1ird h LEU 278 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1ird h LEU 278 CO 0.56 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.56 1ird n ASP 279 N -2.90 2.75 -2.93 -0.43 8.00 -1.26 -4.35 116.55 115.43 1ird n ASP 279 Ca -0.02 -1.91 -0.13 0.00 0.71 0.00 0.00 54.79 53.44 1ird n ASP 279 Cb 0.10 -0.23 0.04 0.00 -0.02 0.00 0.00 41.12 41.00 1ird n ASP 279 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1ird n ASN 280 N 1.02 -0.70 0.19 -2.24 5.15 -0.10 -4.94 115.26 113.64 1ird n ASN 280 Ca 0.18 -3.27 0.04 0.00 -0.60 0.00 0.00 54.58 50.93 1ird n ASN 280 Cb 0.48 0.62 0.45 0.00 -0.53 0.00 0.00 39.78 40.80 1ird n ASN 280 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1ird h LEU 281 N 2.94 0.06 -0.29 1.20 3.38 -1.74 -2.27 115.31 118.59 1ird h LEU 281 Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1ird h LEU 281 Cb 1.06 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1ird h LEU 281 CO 0.30 0.26 0.11 0.50 0.09 0.00 0.00 178.44 179.70 1ird h LYS 282 N 0.06 0.44 -0.51 1.13 3.64 -1.91 -1.27 116.57 118.14 1ird h LYS 282 Ca 0.01 -0.08 -0.09 0.00 -1.27 0.00 0.00 60.65 59.21 1ird h LYS 282 Cb 0.37 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1ird h LYS 282 CO 0.03 0.47 -0.05 0.78 -2.27 0.00 0.00 179.45 178.41 1ird h GLY 283 N 0.32 1.01 0.70 5.01 0.00 -1.93 -2.01 103.07 106.17 1ird h GLY 283 Ca 0.10 -0.78 0.07 0.00 0.00 0.00 0.00 47.33 46.71 1ird h GLY 283 CO -0.01 0.72 0.58 -0.84 0.00 0.00 0.00 176.54 176.99 1ird h THR 284 N 0.80 1.05 -0.68 4.70 2.02 -1.17 -2.75 112.91 116.88 1ird h THR 284 Ca 0.14 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1ird h THR 284 Cb 0.59 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 1ird h THR 284 CO 0.04 0.19 0.00 0.49 0.37 0.00 0.00 175.52 176.61 1ird n PHE 285 N -4.58 0.90 -0.06 3.16 3.01 -0.50 -4.68 117.46 114.71 1ird n PHE 285 Ca 0.14 -0.46 -0.08 0.00 1.01 0.00 0.00 57.45 58.06 1ird n PHE 285 Cb 0.19 -0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 39.65 1ird n PHE 285 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ird h ALA 286 N 4.29 0.18 -0.16 4.37 0.00 -1.05 0.26 119.26 127.16 1ird h ALA 286 Ca 0.00 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1ird h ALA 286 Cb 0.99 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1ird h ALA 286 CO 0.00 -0.45 -0.48 1.79 0.00 0.00 0.00 179.25 180.11 1ird h THR 287 N 0.03 1.33 0.00 0.00 1.35 -1.83 -1.48 112.91 112.30 1ird h THR 287 Ca 0.12 -1.69 -0.08 0.00 -0.55 0.00 0.00 66.41 64.20 1ird h THR 287 Cb 0.17 1.73 -0.01 0.00 -1.73 0.00 0.00 68.15 68.30 1ird h THR 287 CO -0.23 0.52 -0.40 -0.07 -0.25 0.00 0.00 175.52 175.09 1ird h LEU 288 N 0.33 0.00 -0.22 3.87 3.38 -1.69 -1.47 115.31 119.51 1ird h LEU 288 Ca 0.02 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1ird h LEU 288 Cb 0.96 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 1ird h LEU 288 CO 0.08 0.40 -0.17 -1.28 0.09 0.00 0.00 178.44 177.57 1ird h SER 289 N 0.00 0.52 -0.69 -0.43 0.87 0.01 -0.44 113.55 113.40 1ird h SER 289 Ca -0.00 -0.45 0.07 0.00 -1.23 0.00 0.00 61.79 60.18 1ird h SER 289 Cb 0.77 -0.15 -0.06 0.00 -0.44 0.00 0.00 62.40 62.53 1ird h SER 289 CO 0.05 0.86 0.36 -0.33 -0.53 0.00 0.00 176.83 177.25 1ird h GLU 290 N 0.19 0.63 0.17 2.24 5.08 -1.01 0.03 114.58 121.91 1ird h GLU 290 Ca 0.04 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1ird h GLU 290 Cb 0.69 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1ird h GLU 290 CO 0.04 0.42 -0.08 1.25 -1.00 0.00 0.00 179.01 179.64 1ird h LEU 291 N 0.65 -0.20 -0.18 1.33 5.85 -1.10 -0.47 115.31 121.19 1ird h LEU 291 Ca 0.32 -0.11 -0.17 0.00 0.84 0.00 0.00 57.88 58.76 1ird h LEU 291 Cb 0.26 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1ird h LEU 291 CO -0.22 -0.01 -0.82 0.45 -0.34 0.00 0.00 178.44 177.50 1ird h HIS 292 N -0.38 0.00 0.00 1.25 3.86 -0.89 0.50 115.15 119.50 1ird h HIS 292 Ca -0.02 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.16 1ird h HIS 292 Cb 0.29 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 28.76 1ird h HIS 292 CO -0.02 0.82 -0.72 0.00 0.86 0.00 0.00 177.93 178.86 1ird h ASP 294 N -1.00 0.49 0.02 0.00 3.45 -1.21 -2.70 116.42 115.47 1ird h ASP 294 Ca -0.04 -0.43 -0.37 0.00 0.43 0.00 0.00 57.03 56.62 1ird h ASP 294 Cb 0.70 -0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 39.27 1ird h ASP 294 CO -0.02 1.26 -2.08 1.17 -1.57 0.00 0.00 179.24 178.00 1ird n LYS 295 N -3.67 0.63 0.06 3.56 3.00 -0.87 -4.60 118.16 116.28 1ird n LYS 295 Ca -0.07 0.32 0.11 0.00 -0.00 0.00 0.00 58.31 58.67 1ird n LYS 295 Cb 0.90 -1.61 -0.06 0.00 0.00 0.00 0.00 35.03 34.27 1ird n LYS 295 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1ird n LEU 296 N -3.94 0.56 -3.54 3.14 4.77 0.15 -4.98 117.00 113.16 1ird n LEU 296 Ca -0.42 0.20 -0.24 0.00 -0.03 0.00 0.00 56.01 55.52 1ird n LEU 296 Cb 0.89 -0.04 0.07 0.00 -2.33 0.00 0.00 43.42 42.00 1ird n LEU 296 CO 0.20 -0.12 0.20 1.41 -1.33 0.00 0.00 177.39 177.75 1ird n HIS 297 N -2.51 -2.71 -2.37 -1.77 8.25 -0.94 -4.96 115.22 108.20 1ird n HIS 297 Ca -0.01 0.94 -0.42 0.00 -0.26 0.00 0.00 57.72 57.96 1ird n HIS 297 Cb 0.55 -4.87 -0.03 0.00 1.12 0.00 0.00 29.99 26.76 1ird n HIS 297 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ird s VAL 298 N -3.30 3.94 0.25 1.59 1.01 -0.16 -4.98 120.40 118.76 1ird s VAL 298 Ca 0.55 1.37 -0.30 0.00 0.00 0.00 0.00 61.98 63.61 1ird s VAL 298 Cb -0.25 -3.88 -0.10 0.00 0.00 0.00 0.00 36.38 32.15 1ird s VAL 298 CO 0.69 0.08 1.50 -0.62 0.00 0.00 0.00 175.10 176.75 1ird s ASP 299 N 1.20 6.56 0.39 3.32 2.15 -1.26 -4.78 116.67 124.25 1ird s ASP 299 Ca 0.60 2.75 0.28 0.00 0.43 0.00 0.00 52.55 56.60 1ird s ASP 299 Cb -0.30 -2.62 1.27 0.00 -0.30 0.00 0.00 42.92 40.97 1ird s ASP 299 CO 0.28 -0.78 1.85 1.55 -0.17 0.00 0.00 175.17 177.90 1ird h PRO 300 N 5.19 0.00 -0.65 4.34 0.13 -1.96 -1.18 132.00 137.87 1ird h PRO 300 Ca -0.46 0.00 0.17 0.00 -0.87 0.00 0.00 66.00 64.84 1ird h PRO 300 Cb 1.22 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 1ird h PRO 300 CO 0.80 0.00 0.46 1.49 -0.23 0.00 0.00 178.00 180.51 1ird h GLU 301 N 0.00 0.14 0.00 0.86 4.57 -1.99 -0.43 114.58 117.73 1ird h GLU 301 Ca 0.00 -0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.14 1ird h GLU 301 Cb 0.30 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.86 1ird h GLU 301 CO 0.00 0.09 -0.14 -0.91 -1.18 0.00 0.00 179.01 176.87 1ird h ASN 302 N 0.15 0.00 -0.49 1.04 2.35 -1.58 -1.59 115.58 115.46 1ird h ASN 302 Ca 0.32 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.97 1ird h ASN 302 Cb 1.04 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.39 1ird h ASN 302 CO -0.05 0.14 -0.07 -0.26 -1.65 0.00 0.00 177.43 175.55 1ird h PHE 303 N 0.00 1.05 -0.51 1.19 0.04 -1.22 -0.80 116.94 116.68 1ird h PHE 303 Ca -0.00 -0.19 -0.04 0.00 2.80 0.00 0.00 57.97 60.54 1ird h PHE 303 Cb 0.56 -0.27 -0.02 0.00 2.20 0.00 0.00 35.95 38.41 1ird h PHE 303 CO 0.00 0.97 0.18 -0.09 -0.60 0.00 0.00 178.31 178.77 1ird h ARG 304 N 0.86 0.78 -0.49 1.51 2.43 -1.38 -2.08 114.38 116.01 1ird h ARG 304 Ca 0.15 -0.15 -0.03 0.00 -0.81 0.00 0.00 59.98 59.13 1ird h ARG 304 Cb 0.60 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1ird h ARG 304 CO 0.04 0.71 0.20 -0.07 -1.51 0.00 0.00 179.97 179.34 1ird h LEU 305 N 0.69 0.67 -0.80 3.80 3.38 -1.07 -1.12 115.31 120.86 1ird h LEU 305 Ca 0.17 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 57.89 1ird h LEU 305 Cb 0.24 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1ird h LEU 305 CO -0.01 0.65 0.01 0.25 0.09 0.00 0.00 178.44 179.43 1ird h LEU 306 N 0.65 0.89 -0.84 1.67 5.85 -1.08 -0.03 115.31 122.42 1ird h LEU 306 Ca 0.16 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1ird h LEU 306 Cb 0.18 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1ird h LEU 306 CO -0.01 0.94 0.47 1.23 -0.34 0.00 0.00 178.44 180.73 1ird h GLY 307 N 1.00 1.24 1.93 3.75 0.00 -1.05 -0.59 103.07 109.34 1ird h GLY 307 Ca 0.16 -0.55 -0.14 0.00 0.00 0.00 0.00 47.33 46.80 1ird h GLY 307 CO 0.02 0.53 -0.65 3.43 0.00 0.00 0.00 176.54 179.88 1ird h ASN 308 N 1.16 0.08 -0.60 0.19 2.35 -0.61 -1.30 115.58 116.86 1ird h ASN 308 Ca 0.30 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.95 1ird h ASN 308 Cb 0.01 -0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.33 1ird h ASN 308 CO -0.05 0.71 0.21 0.58 -1.65 0.00 0.00 177.43 177.22 1ird h VAL 309 N 0.05 1.24 -0.81 2.81 2.07 -0.61 -1.31 116.25 119.68 1ird h VAL 309 Ca -0.01 -0.79 0.02 0.00 0.82 0.00 0.00 66.70 66.74 1ird h VAL 309 Cb 1.15 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 31.50 1ird h VAL 309 CO 0.09 0.30 0.53 0.25 0.02 0.00 0.00 177.57 178.76 1ird h LEU 310 N 0.84 0.90 -0.58 2.57 5.85 -0.79 -0.03 115.31 124.08 1ird h LEU 310 Ca 0.20 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1ird h LEU 310 Cb 0.26 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.03 1ird h LEU 310 CO -0.01 0.64 0.35 0.58 -0.34 0.00 0.00 178.44 179.66 1ird h VAL 311 N 1.06 1.07 -0.99 1.05 2.07 -0.82 0.39 116.25 120.07 1ird h VAL 311 Ca 0.31 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.61 1ird h VAL 311 Cb -0.06 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 29.96 1ird h VAL 311 CO -0.09 0.13 0.66 0.00 0.02 0.00 0.00 177.57 178.29 1ird h VAL 313 N 1.33 1.22 -0.85 0.00 2.07 -0.10 -0.48 116.25 119.44 1ird h VAL 313 Ca 0.37 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 67.17 1ird h VAL 313 Cb -0.12 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1ird h VAL 313 CO -0.09 0.27 0.45 -0.07 0.02 0.00 0.00 177.57 178.14 1ird h LEU 314 N 0.72 1.08 -0.51 2.57 3.38 -0.58 -0.27 115.31 121.70 1ird h LEU 314 Ca 0.18 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 58.07 1ird h LEU 314 Cb 0.22 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.65 1ird h LEU 314 CO -0.01 0.88 0.28 0.00 0.09 0.00 0.00 178.44 179.68 1ird h ALA 315 N 1.24 0.66 -0.41 1.53 0.00 -0.91 0.34 119.26 121.70 1ird h ALA 315 Ca 0.30 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1ird h ALA 315 Cb 0.06 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ird h ALA 315 CO -0.04 -0.05 0.24 1.25 0.00 0.00 0.00 179.25 180.65 1ird h HIS 316 N 0.55 0.55 0.00 0.00 -0.00 -0.62 0.97 115.15 116.59 1ird h HIS 316 Ca 0.22 -0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.45 1ird h HIS 316 Cb 0.09 -0.18 -0.02 0.00 -0.00 0.00 0.00 27.41 27.30 1ird h HIS 316 CO -0.09 0.40 -0.62 0.45 -0.00 0.00 0.00 177.93 178.07 1ird h HIS 317 N 0.54 0.00 0.00 5.26 -0.00 -0.84 -3.34 115.15 116.78 1ird h HIS 317 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.52 1ird h HIS 317 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.43 1ird h HIS 317 CO -0.03 0.62 -0.89 1.19 -0.00 0.00 0.00 177.93 178.82 1ird n PHE 318 N -3.42 0.00 -2.37 2.45 3.01 0.09 -5.06 117.46 112.16 1ird n PHE 318 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1ird n PHE 318 Cb 0.72 -0.09 0.00 0.00 -0.01 0.00 0.00 39.48 40.10 1ird n PHE 318 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ird n GLY 319 N 1.43 3.28 0.29 1.37 0.00 0.33 -1.69 105.19 110.20 1ird n GLY 319 Ca 0.01 -0.22 0.15 0.00 0.00 0.00 0.00 46.02 45.96 1ird n GLY 319 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ird h LYS 320 N 0.00 0.00 0.00 1.61 3.64 -1.97 0.74 116.57 120.59 1ird h LYS 320 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1ird h LYS 320 Cb 0.00 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1ird h LYS 320 CO 0.00 0.01 -0.04 0.93 -2.27 0.00 0.00 179.45 178.09 1ird h GLU 321 N 0.00 0.00 -3.51 1.90 5.08 -1.72 -3.28 114.58 113.04 1ird h GLU 321 Ca -0.00 0.00 -0.74 0.00 -1.00 0.00 0.00 59.36 57.62 1ird h GLU 321 Cb 0.04 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.18 1ird h GLU 321 CO 0.00 0.04 2.45 0.34 -1.00 0.00 0.00 179.01 180.84 1ird n PHE 322 N -3.22 3.02 -1.20 4.33 7.35 0.25 -4.91 117.46 123.08 1ird n PHE 322 Ca -0.01 -2.85 -0.30 0.00 -0.76 0.00 0.00 57.45 53.53 1ird n PHE 322 Cb 0.23 -2.12 0.14 0.00 0.35 0.00 0.00 39.48 38.08 1ird n PHE 322 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 1ird s THR 323 N 1.05 2.66 0.23 -2.13 -4.23 -1.24 -4.66 115.64 107.32 1ird s THR 323 Ca 0.44 0.22 -0.06 0.00 -1.18 0.00 0.00 61.69 61.10 1ird s THR 323 Cb 0.12 -2.70 0.18 0.00 1.34 0.00 0.00 72.50 71.45 1ird s THR 323 CO -0.03 -0.28 1.76 -0.65 -0.54 0.00 0.00 174.62 174.88 1ird h PRO 324 N -1.55 0.53 -0.33 3.99 0.11 -1.93 0.72 132.00 133.54 1ird h PRO 324 Ca -0.49 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.51 1ird h PRO 324 Cb 1.28 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1ird h PRO 324 CO 0.54 0.35 -0.12 -1.35 -0.21 0.00 0.00 178.00 177.21 1ird h PRO 325 N 0.55 0.58 -0.54 1.05 0.11 -1.99 -0.77 132.00 130.99 1ird h PRO 325 Ca 0.36 -0.18 -0.03 0.00 0.11 0.00 0.00 66.00 66.27 1ird h PRO 325 Cb 0.43 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 31.46 1ird h PRO 325 CO -0.30 0.69 0.23 0.28 -0.21 0.00 0.00 178.00 178.69 1ird h VAL 326 N 0.53 1.21 -0.63 3.15 2.07 -1.71 -2.16 116.25 118.72 1ird h VAL 326 Ca 0.10 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 67.00 1ird h VAL 326 Cb 0.53 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 1ird h VAL 326 CO 0.03 0.25 0.40 -0.61 0.02 0.00 0.00 177.57 177.66 1ird h GLN 327 N 0.73 0.77 -0.98 1.57 4.15 -0.59 -1.41 115.11 119.35 1ird h GLN 327 Ca 0.18 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 59.56 1ird h GLN 327 Cb 0.17 -0.17 -0.05 0.00 0.21 0.00 0.00 27.48 27.63 1ird h GLN 327 CO -0.02 0.51 0.65 0.00 -1.93 0.00 0.00 178.83 178.04 1ird h ALA 328 N 1.25 1.29 -0.38 3.38 0.00 -0.81 0.27 119.26 124.27 1ird h ALA 328 Ca 0.24 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 1ird h ALA 328 Cb -0.03 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 1ird h ALA 328 CO -0.08 0.66 0.03 0.00 0.00 0.00 0.00 179.25 179.85 1ird h ALA 329 N 1.38 0.51 -0.02 0.00 0.00 -1.03 -2.51 119.26 117.59 1ird h ALA 329 Ca 0.36 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 1ird h ALA 329 Cb -0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1ird h ALA 329 CO -0.08 0.25 -0.19 1.88 0.00 0.00 0.00 179.25 181.12 1ird h TYR 330 N 0.49 0.03 -0.42 0.00 0.05 -0.35 -2.37 116.97 114.40 1ird h TYR 330 Ca 0.11 -0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.81 1ird h TYR 330 Cb 0.42 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.13 1ird h TYR 330 CO 0.03 0.22 -0.05 1.96 -1.05 0.00 0.00 178.16 179.27 1ird h GLN 331 N 0.03 0.72 -0.73 4.88 1.08 -0.24 -0.57 115.11 120.27 1ird h GLN 331 Ca 0.00 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 56.99 1ird h GLN 331 Cb 0.35 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.67 1ird h GLN 331 CO 0.02 0.76 0.43 0.87 -0.95 0.00 0.00 178.83 179.96 1ird h LYS 332 N 0.66 1.00 0.24 1.46 1.57 -1.00 -1.15 116.57 119.36 1ird h LYS 332 Ca 0.13 -0.10 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1ird h LYS 332 Cb 0.48 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1ird h LYS 332 CO 0.02 0.72 -0.12 0.28 -0.57 0.00 0.00 179.45 179.79 1ird h VAL 333 N 1.00 0.78 -0.00 0.50 2.07 -1.01 -0.99 116.25 118.60 1ird h VAL 333 Ca 0.26 -0.13 -0.11 0.00 0.82 0.00 0.00 66.70 67.54 1ird h VAL 333 Cb -0.01 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1ird h VAL 333 CO -0.05 0.03 -0.54 -0.37 0.02 0.00 0.00 177.57 176.67 1ird h VAL 334 N -0.39 1.39 -0.53 2.57 -1.51 -1.06 -0.21 116.25 116.50 1ird h VAL 334 Ca -0.03 -1.84 -0.03 0.00 -1.23 0.00 0.00 66.70 63.57 1ird h VAL 334 Cb 0.30 1.99 -0.02 0.00 -2.13 0.00 0.00 31.29 31.42 1ird h VAL 334 CO 0.06 0.53 0.23 0.00 -1.23 0.00 0.00 177.57 177.15 1ird h ALA 335 N 1.46 0.69 -0.48 5.19 0.00 -1.15 -1.18 119.26 123.78 1ird h ALA 335 Ca -0.01 -0.15 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1ird h ALA 335 Cb 0.95 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 1ird h ALA 335 CO 0.07 0.29 -0.12 0.78 0.00 0.00 0.00 179.25 180.27 1ird h GLY 336 N 0.72 0.98 0.91 0.00 0.00 -0.66 -0.69 103.07 104.33 1ird h GLY 336 Ca 0.18 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 1ird h GLY 336 CO -0.02 0.71 0.09 -2.08 0.00 0.00 0.00 176.54 175.24 1ird h VAL 337 N 0.81 1.22 -0.69 4.60 2.07 -0.95 -1.57 116.25 121.74 1ird h VAL 337 Ca 0.13 -0.72 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 1ird h VAL 337 Cb 0.65 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1ird h VAL 337 CO 0.05 0.24 0.40 0.00 0.02 0.00 0.00 177.57 178.28 1ird h ALA 338 N 0.93 0.88 -0.53 1.67 0.00 -1.05 -0.13 119.26 121.03 1ird h ALA 338 Ca 0.11 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1ird h ALA 338 Cb 0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1ird h ALA 338 CO -0.00 0.36 0.01 -0.97 0.00 0.00 0.00 179.25 178.65 1ird h ASN 339 N 0.94 0.86 -0.41 0.00 -0.73 -0.99 -1.37 115.58 113.87 1ird h ASN 339 Ca 0.24 -0.22 -0.14 0.00 1.87 0.00 0.00 56.30 58.06 1ird h ASN 339 Cb -0.00 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.35 1ird h ASN 339 CO -0.04 0.91 -0.30 0.00 -0.37 0.00 0.00 177.43 177.63 1ird h ALA 340 N 1.18 0.66 0.00 1.57 0.00 -1.01 -2.69 119.26 118.98 1ird h ALA 340 Ca 0.16 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1ird h ALA 340 Cb 0.48 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ird h ALA 340 CO 0.02 0.67 -0.18 1.25 0.00 0.00 0.00 179.25 181.02 1ird h LEU 341 N 0.79 0.00 -1.42 0.00 5.85 -0.75 -2.48 115.31 117.30 1ird h LEU 341 Ca 0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.81 1ird h LEU 341 Cb 0.88 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1ird h LEU 341 CO 0.08 0.18 0.00 0.00 -0.34 0.00 0.00 178.44 178.35 1ird n ALA 342 N -2.31 2.49 -0.21 1.25 0.00 -0.54 -4.36 120.51 116.82 1ird n ALA 342 Ca -0.02 -0.65 0.06 0.00 0.00 0.00 0.00 53.44 52.84 1ird n ALA 342 Cb 0.29 -1.02 0.33 0.00 0.00 0.00 0.00 19.45 19.05 1ird n ALA 342 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1ird h HIS 343 N 2.71 0.83 0.00 0.00 6.17 -1.30 -0.21 115.15 123.34 1ird h HIS 343 Ca 0.00 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.10 1ird h HIS 343 Cb 0.60 -0.27 0.00 0.00 2.52 0.00 0.00 27.41 30.26 1ird h HIS 343 CO 0.16 0.43 0.00 1.63 0.71 0.00 0.00 177.93 180.86 1ird n LYS 344 N -4.48 0.15 0.06 5.26 4.76 -1.26 -1.32 118.16 121.32 1ird n LYS 344 Ca 0.11 0.50 0.12 0.00 -2.87 0.00 0.00 58.31 56.17 1ird n LYS 344 Cb 0.23 -1.85 0.21 0.00 -1.84 0.00 0.00 35.03 31.78 1ird n LYS 344 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 1ird n TYR 345 N -2.14 0.53 1.38 2.13 4.01 -0.10 -4.96 117.16 118.01 1ird n TYR 345 Ca 0.01 0.15 0.14 0.00 -0.16 0.00 0.00 57.90 58.04 1ird n TYR 345 Cb 0.14 -0.65 0.42 0.00 -0.31 0.00 0.00 39.34 38.94 1ird n TYR 345 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12