#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qeq s GLN 188 N 0.00 1.48 -0.22 1.97 1.11 -1.26 -4.83 119.66 117.91 2qeq s GLN 188 Ca 0.00 -1.66 -0.12 0.00 0.01 0.00 0.00 55.36 53.59 2qeq s GLN 188 Cb 0.00 -1.43 -0.05 0.00 -1.01 0.00 0.00 33.01 30.53 2qeq s GLN 188 CO 0.00 0.26 0.24 0.42 0.01 0.00 0.00 175.29 176.22 2qeq s ILE 189 N -2.70 5.31 -0.12 1.08 1.01 -1.26 -3.43 121.20 121.08 2qeq s ILE 189 Ca 0.25 0.37 -0.04 0.00 0.00 0.00 0.00 60.65 61.24 2qeq s ILE 189 Cb -0.03 -3.58 -0.03 0.00 0.01 0.00 0.00 42.46 38.83 2qeq s ILE 189 CO 0.10 0.32 0.01 -0.89 0.00 0.00 0.00 174.94 174.49 2qeq s THR 190 N 1.08 4.38 -0.22 2.92 2.01 -0.19 -5.00 115.64 120.62 2qeq s THR 190 Ca 0.12 -0.20 0.02 0.00 0.31 0.00 0.00 61.69 61.93 2qeq s THR 190 Cb -0.14 -2.89 0.04 0.00 0.01 0.00 0.00 72.50 69.52 2qeq s THR 190 CO 0.05 0.56 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.70 2qeq s VAL 191 N -0.40 2.19 -0.60 3.82 1.01 -1.26 0.37 120.40 125.53 2qeq s VAL 191 Ca 0.08 -1.22 -0.21 0.00 0.00 0.00 0.00 61.98 60.62 2qeq s VAL 191 Cb -0.12 -2.09 0.07 0.00 0.00 0.00 0.00 36.38 34.24 2qeq s VAL 191 CO 0.02 0.28 0.84 -0.76 0.00 0.00 0.00 175.10 175.48 2qeq s LEU 192 N 1.22 4.70 0.00 3.92 1.43 0.25 -4.91 118.68 125.28 2qeq s LEU 192 Ca -0.01 -1.01 0.00 0.00 -1.03 0.00 0.00 54.13 52.08 2qeq s LEU 192 Cb -0.16 -2.45 0.00 0.00 0.03 0.00 0.00 46.19 43.61 2qeq s LEU 192 CO -0.09 -1.24 0.90 0.47 0.23 0.00 0.00 176.35 176.61 2qeq n ASP 193 N 7.07 2.57 -4.51 2.29 8.00 -1.26 -2.60 116.55 128.12 2qeq n ASP 193 Ca -0.05 -1.57 -0.43 0.00 0.71 0.00 0.00 54.79 53.45 2qeq n ASP 193 Cb 0.45 -0.47 -0.06 0.00 -0.02 0.00 0.00 41.12 41.01 2qeq n ASP 193 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2qeq n LEU 194 N 0.91 2.07 -4.70 0.64 4.77 -1.24 -4.74 117.00 114.71 2qeq n LEU 194 Ca 0.00 0.01 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 2qeq n LEU 194 Cb 0.36 -1.37 0.12 0.00 -2.33 0.00 0.00 43.42 40.19 2qeq n LEU 194 CO 0.00 -1.03 0.77 -1.38 -1.33 0.00 0.00 177.39 174.42 2qeq s HIS 195 N 9.53 1.87 0.82 -1.77 -3.43 -1.26 -3.96 115.29 117.09 2qeq s HIS 195 Ca 1.08 1.66 -0.16 0.00 -0.80 0.00 0.00 55.06 56.84 2qeq s HIS 195 Cb -0.60 -3.46 -0.10 0.00 -1.43 0.00 0.00 32.58 26.99 2qeq s HIS 195 CO 0.39 -2.77 -0.17 -2.30 -2.00 0.00 0.00 174.74 167.89 2qeq n PRO 196 N -3.20 0.03 0.00 -0.38 -0.02 -1.26 -4.93 135.00 125.23 2qeq n PRO 196 Ca 0.13 0.03 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 2qeq n PRO 196 Cb 0.51 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 2qeq n PRO 196 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qeq n GLY 197 N 2.56 2.58 1.96 -1.23 0.00 -1.26 -4.73 105.19 105.07 2qeq n GLY 197 Ca 0.04 -0.68 -0.08 0.00 0.00 0.00 0.00 46.02 45.30 2qeq n GLY 197 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qeq n ALA 198 N 0.00 5.25 0.90 4.61 0.00 -1.26 -3.72 120.51 126.29 2qeq n ALA 198 Ca 0.00 -1.25 0.10 0.00 0.00 0.00 0.00 53.44 52.29 2qeq n ALA 198 Cb 0.00 -2.06 0.04 0.00 0.00 0.00 0.00 19.45 17.43 2qeq n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qeq n GLY 199 N 2.36 0.39 0.25 0.00 0.00 -1.26 -4.44 105.19 102.49 2qeq n GLY 199 Ca 0.29 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 2qeq n GLY 199 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qeq h LYS 200 N 3.26 -0.55 -0.02 1.61 6.56 -1.97 0.47 116.57 125.93 2qeq h LYS 200 Ca 0.00 0.04 -0.16 0.00 -1.06 0.00 0.00 60.65 59.47 2qeq h LYS 200 Cb 0.79 0.12 -0.02 0.00 -0.57 0.00 0.00 32.23 32.56 2qeq h LYS 200 CO 0.00 -0.34 -0.72 1.15 -2.06 0.00 0.00 179.45 177.48 2qeq h THR 201 N -0.60 1.47 0.10 -0.16 2.02 -1.93 -2.30 112.91 111.51 2qeq h THR 201 Ca -0.06 -2.34 -0.01 0.00 0.77 0.00 0.00 66.41 64.77 2qeq h THR 201 Cb 0.46 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 69.12 2qeq h THR 201 CO 0.10 0.68 -0.05 -0.09 0.37 0.00 0.00 175.52 176.52 2qeq h ARG 202 N 0.08 -0.13 0.00 6.66 9.65 -1.72 -3.40 114.38 125.52 2qeq h ARG 202 Ca -0.02 0.01 -0.18 0.00 -1.10 0.00 0.00 59.98 58.69 2qeq h ARG 202 Cb 1.27 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.86 2qeq h ARG 202 CO 0.10 0.25 -1.59 0.54 2.80 0.00 0.00 179.97 182.07 2qeq n ARG 203 N -4.97 0.54 0.07 0.20 1.74 0.16 -4.81 116.66 109.59 2qeq n ARG 203 Ca -0.09 0.22 -0.23 0.00 -0.77 0.00 0.00 57.85 56.99 2qeq n ARG 203 Cb 0.23 -1.43 -0.15 0.00 -1.02 0.00 0.00 32.46 30.09 2qeq n ARG 203 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2qeq h ILE 204 N -0.98 1.06 -0.07 0.55 5.03 -1.58 -3.38 117.51 118.15 2qeq h ILE 204 Ca -0.27 -2.52 0.04 0.00 -0.12 0.00 0.00 64.86 61.99 2qeq h ILE 204 Cb 1.23 2.84 -0.06 0.00 -3.03 0.00 0.00 36.82 37.80 2qeq h ILE 204 CO -0.17 0.80 -0.32 0.25 -0.68 0.00 0.00 178.15 178.04 2qeq h LEU 205 N -0.02 -0.97 -1.47 1.44 5.85 -1.63 -2.09 115.31 116.43 2qeq h LEU 205 Ca -0.31 0.13 0.08 0.00 0.84 0.00 0.00 57.88 58.63 2qeq h LEU 205 Cb 2.00 0.40 -0.04 0.00 0.37 0.00 0.00 40.66 43.38 2qeq h LEU 205 CO 0.17 -0.37 0.46 1.55 -0.34 0.00 0.00 178.44 179.91 2qeq h PRO 206 N -0.43 0.60 -0.65 5.25 0.13 -1.80 -1.22 132.00 133.89 2qeq h PRO 206 Ca 0.08 -0.04 -0.03 0.00 -0.87 0.00 0.00 66.00 65.14 2qeq h PRO 206 Cb 0.55 -0.14 -0.03 0.00 0.13 0.00 0.00 31.00 31.51 2qeq h PRO 206 CO -0.31 0.40 0.29 1.96 -0.23 0.00 0.00 178.00 180.11 2qeq h GLN 207 N 0.62 0.94 -0.21 0.86 1.08 -1.57 0.87 115.11 117.70 2qeq h GLN 207 Ca 0.31 -0.15 -0.01 0.00 -1.45 0.00 0.00 58.65 57.35 2qeq h GLN 207 Cb 0.41 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 2qeq h GLN 207 CO -0.10 0.77 0.10 0.82 -0.95 0.00 0.00 178.83 179.46 2qeq h ILE 208 N 0.90 1.14 -0.18 2.54 2.04 -0.62 -2.37 117.51 120.95 2qeq h ILE 208 Ca 0.22 -0.39 -0.11 0.00 1.00 0.00 0.00 64.86 65.58 2qeq h ILE 208 Cb 0.15 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.24 2qeq h ILE 208 CO -0.02 0.13 -0.33 0.40 0.00 0.00 0.00 178.15 178.33 2qeq h ILE 209 N 0.21 1.34 -0.51 -0.67 5.03 -1.13 -1.27 117.51 120.51 2qeq h ILE 209 Ca 0.07 -1.56 0.10 0.00 -0.12 0.00 0.00 64.86 63.35 2qeq h ILE 209 Cb 0.12 1.90 -0.09 0.00 -3.03 0.00 0.00 36.82 35.72 2qeq h ILE 209 CO -0.01 0.48 -0.03 0.50 -0.68 0.00 0.00 178.15 178.41 2qeq h LYS 210 N 0.19 0.08 0.00 2.37 3.64 0.79 0.31 116.57 123.96 2qeq h LYS 210 Ca 0.01 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2qeq h LYS 210 Cb 0.92 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 2qeq h LYS 210 CO 0.07 0.06 0.00 -1.91 -2.27 0.00 0.00 179.45 175.40 2qeq n GLU 211 N -5.27 0.18 0.08 1.90 4.07 -0.90 -2.67 120.64 118.03 2qeq n GLU 211 Ca 0.06 0.19 0.13 0.00 -0.06 0.00 0.00 57.16 57.48 2qeq n GLU 211 Cb 0.28 -1.73 0.46 0.00 -0.06 0.00 0.00 31.44 30.39 2qeq n GLU 211 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2qeq n ALA 212 N -1.71 2.28 -0.04 4.31 0.00 0.96 -3.49 120.51 122.82 2qeq n ALA 212 Ca 0.05 -0.04 -0.21 0.00 0.00 0.00 0.00 53.44 53.24 2qeq n ALA 212 Cb 0.37 -1.47 -0.13 0.00 0.00 0.00 0.00 19.45 18.22 2qeq n ALA 212 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2qeq n ILE 213 N -2.07 1.69 -0.11 0.00 5.41 -0.42 -2.51 119.36 121.35 2qeq n ILE 213 Ca 0.06 -0.53 0.06 0.00 1.00 0.00 0.00 62.75 63.34 2qeq n ILE 213 Cb 0.40 -1.75 0.39 0.00 -0.71 0.00 0.00 39.64 37.97 2qeq n ILE 213 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 2qeq h ASN 214 N -0.16 0.58 -0.04 4.38 2.35 -1.66 -1.35 115.58 119.68 2qeq h ASN 214 Ca -0.44 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.30 2qeq h ASN 214 Cb 1.88 -0.13 0.00 0.00 0.05 0.00 0.00 38.32 40.12 2qeq h ASN 214 CO -0.01 0.39 0.00 0.54 -1.65 0.00 0.00 177.43 176.71 2qeq n ARG 215 N -4.47 1.17 -3.85 0.81 1.74 -1.23 -4.92 116.66 105.91 2qeq n ARG 215 Ca 0.07 -0.26 -0.28 0.00 -0.77 0.00 0.00 57.85 56.61 2qeq n ARG 215 Cb 0.16 -1.32 0.03 0.00 -1.02 0.00 0.00 32.46 30.32 2qeq n ARG 215 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2qeq n ARG 216 N -0.53 -5.73 -3.54 5.56 1.74 -0.51 -4.97 116.66 108.67 2qeq n ARG 216 Ca 0.15 0.63 -0.37 0.00 -0.77 0.00 0.00 57.85 57.48 2qeq n ARG 216 Cb 0.13 -5.50 -0.06 0.00 -1.02 0.00 0.00 32.46 26.01 2qeq n ARG 216 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2qeq s LEU 217 N -7.21 4.34 -0.57 0.55 1.43 -1.04 -5.03 118.68 111.15 2qeq s LEU 217 Ca 0.57 0.69 -0.27 0.00 -1.03 0.00 0.00 54.13 54.08 2qeq s LEU 217 Cb -0.28 -2.44 0.01 0.00 0.03 0.00 0.00 46.19 43.51 2qeq s LEU 217 CO 0.82 0.20 1.53 -0.13 0.23 0.00 0.00 176.35 179.00 2qeq s ARG 218 N -0.21 3.15 -0.10 1.70 1.81 -1.26 -4.79 118.95 119.24 2qeq s ARG 218 Ca 0.20 0.49 -0.02 0.00 -1.72 0.00 0.00 55.73 54.68 2qeq s ARG 218 Cb -0.14 -4.19 -0.03 0.00 -0.45 0.00 0.00 34.95 30.13 2qeq s ARG 218 CO 0.08 -2.13 -0.02 0.99 -0.68 0.00 0.00 175.30 173.54 2qeq s THR 219 N 6.75 4.07 -0.22 0.02 2.01 -0.77 0.47 115.64 127.97 2qeq s THR 219 Ca 0.56 -0.33 -0.03 0.00 0.31 0.00 0.00 61.69 62.20 2qeq s THR 219 Cb -0.12 -2.72 -0.00 0.00 0.01 0.00 0.00 72.50 69.67 2qeq s THR 219 CO 0.24 0.57 -0.06 0.00 -0.69 0.00 0.00 174.62 174.68 2qeq s ALA 220 N -0.52 2.75 -0.24 7.40 0.00 -0.45 -1.14 121.76 129.56 2qeq s ALA 220 Ca 0.08 -1.20 -0.16 0.00 0.00 0.00 0.00 51.96 50.69 2qeq s ALA 220 Cb -0.12 -1.65 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 2qeq s ALA 220 CO 0.02 -0.46 0.42 0.08 0.00 0.00 0.00 175.76 175.82 2qeq s VAL 221 N 1.45 5.16 -0.15 0.00 1.01 0.16 -0.98 120.40 127.04 2qeq s VAL 221 Ca 0.05 0.70 -0.01 0.00 0.00 0.00 0.00 61.98 62.72 2qeq s VAL 221 Cb -0.14 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.48 2qeq s VAL 221 CO -0.04 0.18 -0.12 -0.76 0.00 0.00 0.00 175.10 174.35 2qeq s LEU 222 N 1.83 2.71 0.11 3.92 1.43 0.48 -1.80 118.68 127.36 2qeq s LEU 222 Ca 0.18 -0.36 0.08 0.00 -1.03 0.00 0.00 54.13 53.00 2qeq s LEU 222 Cb -0.15 -1.63 -0.04 0.00 0.03 0.00 0.00 46.19 44.40 2qeq s LEU 222 CO 0.09 0.12 -0.20 0.00 0.23 0.00 0.00 176.35 176.59 2qeq s ALA 223 N 0.65 1.76 -0.47 4.21 0.00 -0.57 -0.44 121.76 126.90 2qeq s ALA 223 Ca -0.06 -1.25 0.24 0.00 0.00 0.00 0.00 51.96 50.88 2qeq s ALA 223 Cb -0.15 -0.22 0.31 0.00 0.00 0.00 0.00 23.12 23.05 2qeq s ALA 223 CO 0.03 0.33 1.39 -1.00 0.00 0.00 0.00 175.76 176.50 2qeq h PRO 224 N 4.01 0.00 -4.45 0.00 0.13 -1.88 -0.31 132.00 129.51 2qeq h PRO 224 Ca -0.45 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.49 2qeq h PRO 224 Cb 1.18 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.16 2qeq h PRO 224 CO 0.41 0.00 -0.65 0.95 -0.23 0.00 0.00 178.00 178.48 2qeq s THR 225 N -3.23 0.14 0.08 1.56 -4.23 -1.26 -4.73 115.64 103.97 2qeq s THR 225 Ca 0.05 -1.91 -0.19 0.00 -1.18 0.00 0.00 61.69 58.45 2qeq s THR 225 Cb 0.10 -2.04 -0.09 0.00 1.34 0.00 0.00 72.50 71.81 2qeq s THR 225 CO 0.71 -0.48 1.56 0.03 -0.54 0.00 0.00 174.62 175.89 2qeq h ARG 226 N 2.86 0.36 -0.35 3.99 3.08 -1.97 -0.74 114.38 121.61 2qeq h ARG 226 Ca -0.35 -0.09 0.04 0.00 0.07 0.00 0.00 59.98 59.64 2qeq h ARG 226 Cb 1.20 -0.04 -0.07 0.00 0.08 0.00 0.00 29.97 31.14 2qeq h ARG 226 CO 0.59 0.50 -0.45 0.28 -1.07 0.00 0.00 179.97 179.82 2qeq h VAL 227 N 0.16 0.00 -0.98 2.04 2.07 -1.97 0.31 116.25 117.88 2qeq h VAL 227 Ca 0.07 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.60 2qeq h VAL 227 Cb 0.31 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.03 2qeq h VAL 227 CO 0.00 0.00 0.65 0.58 0.02 0.00 0.00 177.57 178.83 2qeq h VAL 228 N -0.31 1.25 0.00 2.57 2.07 -1.96 0.63 116.25 120.51 2qeq h VAL 228 Ca 0.06 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2qeq h VAL 228 Cb 0.47 -0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.04 2qeq h VAL 228 CO -0.49 0.24 0.00 0.00 0.02 0.00 0.00 177.57 177.34 2qeq h ALA 229 N 1.36 1.00 0.00 1.67 0.00 -0.63 0.44 119.26 123.10 2qeq h ALA 229 Ca 0.36 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.17 2qeq h ALA 229 Cb -0.15 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2qeq h ALA 229 CO -0.08 0.00 -1.67 0.00 0.00 0.00 0.00 179.25 177.50 2qeq n ALA 230 N -1.90 2.31 -0.28 0.00 0.00 0.10 -3.28 120.51 117.47 2qeq n ALA 230 Ca 0.02 -0.58 -0.06 0.00 0.00 0.00 0.00 53.44 52.82 2qeq n ALA 230 Cb 0.28 -0.80 0.06 0.00 0.00 0.00 0.00 19.45 18.99 2qeq n ALA 230 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2qeq h GLU 231 N 0.00 1.13 0.00 0.00 4.57 0.11 -2.78 114.58 117.61 2qeq h GLU 231 Ca -0.13 -0.20 -0.10 0.00 -1.18 0.00 0.00 59.36 57.75 2qeq h GLU 231 Cb 1.35 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.74 2qeq h GLU 231 CO 0.02 0.92 -0.48 0.52 -1.18 0.00 0.00 179.01 178.81 2qeq h MET 232 N 1.10 0.00 0.53 1.92 2.86 -1.05 -2.74 114.93 117.54 2qeq h MET 232 Ca 0.25 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.87 2qeq h MET 232 Cb 0.20 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.87 2qeq h MET 232 CO -0.02 0.48 -0.26 0.00 1.06 0.00 0.00 176.91 178.17 2qeq h ALA 233 N 1.52 -0.71 -0.12 6.32 0.00 -1.51 -2.35 119.26 122.40 2qeq h ALA 233 Ca -0.00 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.76 2qeq h ALA 233 Cb 0.92 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 2qeq h ALA 233 CO 0.06 -0.83 0.25 0.93 0.00 0.00 0.00 179.25 179.66 2qeq h GLU 234 N -0.85 0.00 0.00 0.00 5.08 -1.36 -2.64 114.58 114.81 2qeq h GLU 234 Ca -0.07 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 2qeq h GLU 234 Cb 0.60 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.84 2qeq h GLU 234 CO 0.12 0.00 -1.87 0.00 -1.00 0.00 0.00 179.01 176.26 2qeq n ALA 235 N -2.13 2.55 -1.57 3.43 0.00 -1.05 -4.41 120.51 117.33 2qeq n ALA 235 Ca 0.00 -0.59 -0.35 0.00 0.00 0.00 0.00 53.44 52.51 2qeq n ALA 235 Cb 0.35 -0.74 0.06 0.00 0.00 0.00 0.00 19.45 19.12 2qeq n ALA 235 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2qeq n LEU 236 N -2.42 7.36 -4.63 0.00 4.32 -0.90 -4.87 117.00 115.85 2qeq n LEU 236 Ca -0.08 -4.50 -0.43 0.00 -0.02 0.00 0.00 56.01 50.99 2qeq n LEU 236 Cb 0.66 -0.94 -0.02 0.00 -1.62 0.00 0.00 43.42 41.50 2qeq n LEU 236 CO 0.45 1.62 1.18 -0.60 -1.22 0.00 0.00 177.39 178.82 2qeq s ARG 237 N -3.87 3.92 0.00 3.23 3.52 -1.26 -3.50 118.95 120.99 2qeq s ARG 237 Ca 0.60 1.38 0.00 0.00 -0.13 0.00 0.00 55.73 57.58 2qeq s ARG 237 Cb 0.48 -3.91 0.00 0.00 -1.56 0.00 0.00 34.95 29.96 2qeq s ARG 237 CO -0.12 -1.12 0.00 0.41 -0.81 0.00 0.00 175.30 173.66 2qeq n GLY 238 N 4.33 1.45 3.82 8.12 0.00 -1.26 -5.12 105.19 116.53 2qeq n GLY 238 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2qeq n GLY 238 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qeq s LEU 239 N 0.00 3.96 -0.15 0.99 1.43 -1.23 -5.07 118.68 118.61 2qeq s LEU 239 Ca 0.00 0.05 -0.29 0.00 -1.03 0.00 0.00 54.13 52.86 2qeq s LEU 239 Cb 0.00 -2.61 -0.05 0.00 0.03 0.00 0.00 46.19 43.56 2qeq s LEU 239 CO 0.00 0.16 1.94 -2.16 0.23 0.00 0.00 176.35 176.52 2qeq s PRO 240 N -2.51 3.64 -0.18 1.29 0.04 -1.26 -4.97 135.00 131.05 2qeq s PRO 240 Ca 0.31 2.07 -0.10 0.00 0.04 0.00 0.00 61.00 63.32 2qeq s PRO 240 Cb -0.12 -4.20 0.06 0.00 0.04 0.00 0.00 34.50 30.28 2qeq s PRO 240 CO 0.24 -1.51 0.44 0.42 0.04 0.00 0.00 177.00 176.63 2qeq s ILE 241 N 6.16 -0.02 -0.62 0.56 1.01 -1.26 -4.61 121.20 122.42 2qeq s ILE 241 Ca 0.87 0.08 -0.11 0.00 0.00 0.00 0.00 60.65 61.49 2qeq s ILE 241 Cb -0.33 -0.64 0.16 0.00 0.01 0.00 0.00 42.46 41.66 2qeq s ILE 241 CO 0.35 0.03 0.52 -0.60 0.00 0.00 0.00 174.94 175.25 2qeq s ARG 242 N 1.35 2.95 0.05 2.79 6.06 -0.80 -5.01 118.95 126.33 2qeq s ARG 242 Ca -0.09 -2.07 -0.31 0.00 -2.50 0.00 0.00 55.73 50.76 2qeq s ARG 242 Cb -0.08 -4.14 -0.06 0.00 0.06 0.00 0.00 34.95 30.73 2qeq s ARG 242 CO -0.13 -1.25 1.30 -0.47 -2.50 0.00 0.00 175.30 172.25 2qeq s TYR 243 N 0.86 3.22 0.00 5.12 5.04 -1.26 -1.27 117.35 129.06 2qeq s TYR 243 Ca 0.10 1.08 0.03 0.00 -2.44 0.00 0.00 57.07 55.84 2qeq s TYR 243 Cb -0.22 -3.55 -0.01 0.00 0.35 0.00 0.00 41.96 38.54 2qeq s TYR 243 CO -0.03 -1.86 -0.08 -0.65 -1.34 0.00 0.00 175.55 171.59 2qeq s GLN 244 N 1.51 0.65 0.00 4.97 -0.21 0.18 -4.90 119.66 121.86 2qeq s GLN 244 Ca 0.61 -0.35 0.00 0.00 0.02 0.00 0.00 55.36 55.64 2qeq s GLN 244 Cb -0.31 -0.61 0.00 0.00 1.00 0.00 0.00 33.01 33.09 2qeq s GLN 244 CO 0.28 0.16 0.53 0.25 -2.12 0.00 0.00 175.29 174.39 2qeq n THR 245 N 2.70 0.13 -1.85 -0.19 -2.24 -1.26 -4.47 114.28 107.09 2qeq n THR 245 Ca -0.14 -0.52 -0.01 0.00 -2.27 0.00 0.00 64.05 61.11 2qeq n THR 245 Cb 0.57 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 69.81 2qeq n THR 245 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2qeq n SER 246 N -0.06 -2.06 -3.22 3.42 2.88 -1.26 -5.03 113.62 108.28 2qeq n SER 246 Ca 0.00 -0.02 -0.02 0.00 -1.33 0.00 0.00 58.87 57.50 2qeq n SER 246 Cb 0.06 -0.66 -0.02 0.00 -0.75 0.00 0.00 64.21 62.83 2qeq n SER 246 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2qeq s ALA 247 N -3.01 -1.92 0.00 -1.46 0.00 -1.26 -4.98 121.76 109.13 2qeq s ALA 247 Ca 0.01 0.52 -0.19 0.00 0.00 0.00 0.00 51.96 52.30 2qeq s ALA 247 Cb -0.00 -2.41 -0.29 0.00 0.00 0.00 0.00 23.12 20.41 2qeq s ALA 247 CO 0.02 -1.90 1.01 -0.91 0.00 0.00 0.00 175.76 173.98 2qeq h ASN 253 N 7.80 0.64 -1.29 0.00 2.35 -2.11 -3.57 115.58 119.41 2qeq h ASN 253 Ca -0.02 -0.87 0.00 0.00 -0.55 0.00 0.00 56.30 54.86 2qeq h ASN 253 Cb 1.16 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.33 2qeq h ASN 253 CO 0.18 1.45 0.00 0.61 -1.65 0.00 0.00 177.43 178.02 2qeq n GLY 254 N 1.45 -1.57 0.13 2.83 0.00 -1.26 -4.68 105.19 102.09 2qeq n GLY 254 Ca -0.13 -1.32 -0.18 0.00 0.00 0.00 0.00 46.02 44.39 2qeq n GLY 254 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2qeq n ASN 255 N 0.12 1.78 -4.69 1.61 0.23 -1.26 -4.96 115.26 108.10 2qeq n ASN 255 Ca 0.00 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.63 2qeq n ASN 255 Cb 0.00 -0.39 -0.03 0.00 -2.08 0.00 0.00 39.78 37.28 2qeq n ASN 255 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 2qeq s GLU 256 N -2.53 4.26 0.00 -3.83 2.02 -1.26 -4.89 118.70 112.46 2qeq s GLU 256 Ca -0.27 2.05 0.00 0.00 0.02 0.00 0.00 54.97 56.76 2qeq s GLU 256 Cb 0.08 -3.61 0.00 0.00 0.10 0.00 0.00 34.13 30.70 2qeq s GLU 256 CO 0.68 -0.63 0.12 0.44 0.02 0.00 0.00 175.26 175.90 2qeq n ILE 257 N 4.75 0.00 -4.76 -1.63 -5.35 -1.26 -5.06 119.36 106.04 2qeq n ILE 257 Ca 0.14 -0.19 -0.30 0.00 -0.27 0.00 0.00 62.75 62.13 2qeq n ILE 257 Cb 0.43 1.39 -0.14 0.00 -1.74 0.00 0.00 39.64 39.58 2qeq n ILE 257 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 2qeq s VAL 258 N -0.14 2.18 -0.02 7.28 -7.23 -1.26 -1.85 120.40 119.36 2qeq s VAL 258 Ca 0.00 -1.50 0.06 0.00 -1.81 0.00 0.00 61.98 58.73 2qeq s VAL 258 Cb 0.00 -1.88 -0.02 0.00 0.56 0.00 0.00 36.38 35.05 2qeq s VAL 258 CO 0.00 0.29 -0.21 -1.81 -0.31 0.00 0.00 175.10 173.05 2qeq s ASP 259 N -1.48 2.50 -0.24 4.85 1.01 -0.29 -1.91 116.67 121.11 2qeq s ASP 259 Ca 0.12 -0.39 -0.02 0.00 0.71 0.00 0.00 52.55 52.98 2qeq s ASP 259 Cb -0.10 -0.32 0.02 0.00 1.01 0.00 0.00 42.92 43.53 2qeq s ASP 259 CO 0.03 0.26 -0.07 -0.69 0.21 0.00 0.00 175.17 174.91 2qeq s VAL 260 N -0.46 2.87 0.10 -1.27 1.01 -0.39 0.36 120.40 122.63 2qeq s VAL 260 Ca 0.07 -0.96 -0.15 0.00 0.00 0.00 0.00 61.98 60.94 2qeq s VAL 260 Cb -0.09 -2.43 0.03 0.00 0.00 0.00 0.00 36.38 33.89 2qeq s VAL 260 CO -0.00 0.24 0.36 0.00 0.00 0.00 0.00 175.10 175.70 2qeq s MET 261 N 1.34 0.99 0.58 2.72 0.23 -0.75 -0.64 119.30 123.77 2qeq s MET 261 Ca 0.01 -0.70 -0.18 0.00 -1.03 0.00 0.00 55.69 53.80 2qeq s MET 261 Cb -0.16 0.43 -0.04 0.00 -1.53 0.00 0.00 34.83 33.53 2qeq s MET 261 CO -0.05 -0.37 1.12 0.00 -2.03 0.00 0.00 175.02 173.69 2qeq h HIS 263 N 0.82 0.59 0.00 0.00 -0.00 -1.33 -1.96 115.15 113.26 2qeq h HIS 263 Ca -0.49 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 59.90 2qeq h HIS 263 Cb 1.26 -0.15 -0.00 0.00 -0.00 0.00 0.00 27.41 28.51 2qeq h HIS 263 CO 0.53 0.14 -0.07 0.00 -0.00 0.00 0.00 177.93 178.53 2qeq h ALA 264 N 1.50 1.18 -0.02 2.45 0.00 -1.86 -2.62 119.26 119.88 2qeq h ALA 264 Ca 0.39 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.15 2qeq h ALA 264 Cb 0.53 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.31 2qeq h ALA 264 CO -0.34 0.08 -0.34 1.15 0.00 0.00 0.00 179.25 179.80 2qeq h THR 265 N 0.00 1.48 -0.21 0.00 2.02 -1.73 -2.34 112.91 112.13 2qeq h THR 265 Ca -0.00 -1.89 0.05 0.00 0.77 0.00 0.00 66.41 65.34 2qeq h THR 265 Cb 0.28 2.58 -0.05 0.00 -1.74 0.00 0.00 68.15 69.22 2qeq h THR 265 CO 0.01 0.53 -0.14 0.25 0.37 0.00 0.00 175.52 176.54 2qeq h LEU 266 N -0.31 -0.46 -0.48 2.58 5.85 -1.39 -1.68 115.31 119.42 2qeq h LEU 266 Ca -0.04 0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 2qeq h LEU 266 Cb 1.05 0.24 -0.02 0.00 0.37 0.00 0.00 40.66 42.30 2qeq h LEU 266 CO 0.07 -0.18 0.02 0.71 -0.34 0.00 0.00 178.44 178.71 2qeq h THR 267 N -0.14 1.26 -0.45 1.05 1.35 -1.58 -0.49 112.91 113.91 2qeq h THR 267 Ca 0.12 -1.03 -0.01 0.00 -0.55 0.00 0.00 66.41 64.94 2qeq h THR 267 Cb 0.31 0.99 -0.02 0.00 -1.73 0.00 0.00 68.15 67.70 2qeq h THR 267 CO -0.29 0.36 0.24 0.45 -0.25 0.00 0.00 175.52 176.03 2qeq h HIS 268 N 0.69 0.60 -0.04 4.73 3.86 -1.29 0.20 115.15 123.90 2qeq h HIS 268 Ca 0.14 -0.00 -0.22 0.00 -1.16 0.00 0.00 60.37 59.12 2qeq h HIS 268 Cb 0.48 -0.20 0.01 0.00 1.06 0.00 0.00 27.41 28.76 2qeq h HIS 268 CO 0.04 0.42 -0.90 0.00 0.86 0.00 0.00 177.93 178.35 2qeq h ARG 269 N 0.62 0.52 -0.71 2.45 2.47 -1.06 -2.65 114.38 116.02 2qeq h ARG 269 Ca 0.16 -0.51 -0.05 0.00 -1.26 0.00 0.00 59.98 58.33 2qeq h ARG 269 Cb 0.02 0.13 -0.03 0.00 -1.65 0.00 0.00 29.97 28.45 2qeq h ARG 269 CO -0.03 1.14 0.26 -0.07 0.56 0.00 0.00 179.97 181.83 2qeq h LEU 270 N 0.31 1.01 -0.59 3.04 3.38 -0.30 -2.89 115.31 119.27 2qeq h LEU 270 Ca -0.08 -0.19 -0.14 0.00 0.09 0.00 0.00 57.88 57.57 2qeq h LEU 270 Cb 1.52 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 2qeq h LEU 270 CO 0.16 0.92 -0.39 0.24 0.09 0.00 0.00 178.44 179.47 2qeq h MET 271 N 1.03 0.69 -7.31 1.13 2.86 -0.69 -3.38 114.93 109.27 2qeq h MET 271 Ca 0.23 -0.35 -0.51 0.00 -2.06 0.00 0.00 59.70 57.01 2qeq h MET 271 Cb 0.25 0.01 0.15 0.00 0.06 0.00 0.00 31.60 32.06 2qeq h MET 271 CO -0.01 0.96 0.29 -1.54 1.06 0.00 0.00 176.91 177.67 2qeq s SER 272 N -6.84 4.12 0.00 1.22 1.04 -1.00 -4.86 113.70 107.37 2qeq s SER 272 Ca -0.09 1.89 0.08 0.00 0.48 0.00 0.00 55.95 58.31 2qeq s SER 272 Cb 0.12 -2.52 0.33 0.00 0.10 0.00 0.00 66.02 64.05 2qeq s SER 272 CO 0.84 -2.29 1.24 -0.81 0.98 0.00 0.00 173.24 173.20 2qeq n PRO 273 N -3.69 1.36 -3.23 4.02 -0.05 -1.26 -4.87 135.00 127.28 2qeq n PRO 273 Ca 0.10 -0.55 -0.28 0.00 -0.05 0.00 0.00 63.50 62.71 2qeq n PRO 273 Cb 0.53 -1.17 -0.03 0.00 -0.05 0.00 0.00 33.50 32.78 2qeq n PRO 273 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 175.50 174.44 2qeq s HIS 274 N -1.81 3.49 0.54 0.54 3.76 -1.26 -5.04 115.29 115.50 2qeq s HIS 274 Ca 0.15 0.65 -0.18 0.00 -0.15 0.00 0.00 55.06 55.53 2qeq s HIS 274 Cb 0.08 -2.12 -0.11 0.00 1.11 0.00 0.00 32.58 31.54 2qeq s HIS 274 CO 0.11 0.09 0.27 0.54 -0.85 0.00 0.00 174.74 174.90 2qeq n ARG 275 N -1.24 0.31 -4.83 1.40 1.74 -1.26 -4.90 116.66 107.88 2qeq n ARG 275 Ca -0.02 0.12 -0.25 0.00 -0.77 0.00 0.00 57.85 56.93 2qeq n ARG 275 Cb 0.54 -1.42 -0.16 0.00 -1.02 0.00 0.00 32.46 30.41 2qeq n ARG 275 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2qeq s VAL 276 N -1.82 1.40 0.29 1.55 -7.23 -1.26 -4.97 120.40 108.35 2qeq s VAL 276 Ca 0.64 -0.72 -0.30 0.00 -1.81 0.00 0.00 61.98 59.79 2qeq s VAL 276 Cb -0.47 -1.19 -0.11 0.00 0.56 0.00 0.00 36.38 35.18 2qeq s VAL 276 CO 0.59 0.40 1.48 -2.84 -0.31 0.00 0.00 175.10 174.42 2qeq s PRO 277 N -0.13 4.21 -1.16 4.82 0.02 -1.26 -4.89 135.00 136.60 2qeq s PRO 277 Ca 0.00 2.41 -0.21 0.00 0.02 0.00 0.00 61.00 63.23 2qeq s PRO 277 Cb -0.10 -3.06 0.05 0.00 0.02 0.00 0.00 34.50 31.41 2qeq s PRO 277 CO 0.01 -0.47 1.64 1.21 -0.33 0.00 0.00 177.00 179.06 2qeq s ASN 278 N 0.24 6.53 0.46 2.53 2.47 -1.26 -4.98 114.94 120.92 2qeq s ASN 278 Ca 0.58 -1.92 -0.23 0.00 0.42 0.00 0.00 52.86 51.72 2qeq s ASN 278 Cb -0.44 -2.58 -0.07 0.00 -1.45 0.00 0.00 41.25 36.71 2qeq s ASN 278 CO 0.48 -1.48 1.18 -0.31 -3.72 0.00 0.00 177.10 173.25 2qeq s TYR 279 N 5.17 2.84 -0.19 0.43 1.51 -1.26 -4.83 117.35 121.01 2qeq s TYR 279 Ca 0.52 1.52 0.13 0.00 -1.01 0.00 0.00 57.07 58.23 2qeq s TYR 279 Cb 0.02 -3.42 -0.23 0.00 -0.11 0.00 0.00 41.96 38.22 2qeq s TYR 279 CO 0.01 -1.61 0.08 0.09 -1.11 0.00 0.00 175.55 173.01 2qeq n ASN 280 N -0.50 0.62 -4.05 2.29 3.02 0.18 -4.65 115.26 112.16 2qeq n ASN 280 Ca 0.07 0.03 -0.24 0.00 -0.03 0.00 0.00 54.58 54.41 2qeq n ASN 280 Cb 0.48 0.50 -0.16 0.00 -0.61 0.00 0.00 39.78 39.98 2qeq n ASN 280 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2qeq s LEU 281 N -5.85 1.74 -0.15 3.41 0.20 -0.26 0.01 118.68 117.78 2qeq s LEU 281 Ca -0.15 -0.29 -0.01 0.00 0.69 0.00 0.00 54.13 54.36 2qeq s LEU 281 Cb 0.07 -0.82 -0.01 0.00 -0.43 0.00 0.00 46.19 45.00 2qeq s LEU 281 CO 0.78 0.07 -0.10 -0.36 -0.29 0.00 0.00 176.35 176.45 2qeq s PHE 282 N 0.41 2.88 -0.18 5.38 0.40 0.23 -1.34 117.98 125.76 2qeq s PHE 282 Ca -0.10 -0.66 0.01 0.00 -0.60 0.00 0.00 56.93 55.58 2qeq s PHE 282 Cb -0.13 -1.91 0.03 0.00 0.51 0.00 0.00 43.02 41.51 2qeq s PHE 282 CO 0.03 -0.26 -0.14 0.54 0.70 0.00 0.00 175.22 176.09 2qeq s VAL 283 N 0.58 1.73 -0.20 -0.44 0.11 -0.16 -0.36 120.40 121.67 2qeq s VAL 283 Ca -0.06 -0.90 -0.08 0.00 -2.93 0.00 0.00 61.98 58.01 2qeq s VAL 283 Cb -0.15 -1.70 -0.04 0.00 -1.53 0.00 0.00 36.38 32.96 2qeq s VAL 283 CO 0.03 0.34 0.07 -0.04 -3.33 0.00 0.00 175.10 172.17 2qeq s MET 284 N 1.39 3.92 0.02 1.54 -1.94 0.48 -0.38 119.30 124.33 2qeq s MET 284 Ca 0.02 -0.36 -0.07 0.00 -1.71 0.00 0.00 55.69 53.57 2qeq s MET 284 Cb -0.15 -3.25 -0.05 0.00 2.01 0.00 0.00 34.83 33.39 2qeq s MET 284 CO -0.10 0.18 0.29 0.34 -0.01 0.00 0.00 175.02 175.72 2qeq s ASP 285 N 0.63 6.51 -0.86 3.03 -1.08 0.42 -0.24 116.67 125.08 2qeq s ASP 285 Ca 0.04 0.58 -0.04 0.00 -0.52 0.00 0.00 52.55 52.61 2qeq s ASP 285 Cb -0.13 -2.10 0.00 0.00 -1.46 0.00 0.00 42.92 39.24 2qeq s ASP 285 CO 0.01 0.23 0.64 -0.62 0.52 0.00 0.00 175.17 175.96 2qeq n GLU 286 N 1.03 -1.37 -0.07 4.34 4.71 -0.78 -4.20 120.64 124.29 2qeq n GLU 286 Ca -0.10 0.82 0.01 0.00 -0.01 0.00 0.00 57.16 57.88 2qeq n GLU 286 Cb 0.53 -3.09 0.05 0.00 -1.01 0.00 0.00 31.44 27.91 2qeq n GLU 286 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2qeq n ALA 287 N -2.77 2.56 0.89 0.62 0.00 -0.53 -3.23 120.51 118.06 2qeq n ALA 287 Ca -0.23 -0.20 0.10 0.00 0.00 0.00 0.00 53.44 53.11 2qeq n ALA 287 Cb 0.64 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.07 2qeq n ALA 287 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2qeq n HIS 288 N -0.10 0.00 -1.70 0.00 1.44 -1.26 -4.58 115.22 109.02 2qeq n HIS 288 Ca 0.03 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.31 2qeq n HIS 288 Cb 0.20 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.27 2qeq n HIS 288 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 2qeq n PHE 289 N -0.30 2.61 -1.27 -1.40 0.99 -1.20 -4.90 117.46 111.99 2qeq n PHE 289 Ca 0.07 -0.03 -0.22 0.00 -0.00 0.00 0.00 57.45 57.27 2qeq n PHE 289 Cb 0.40 -2.69 0.18 0.00 -1.00 0.00 0.00 39.48 36.37 2qeq n PHE 289 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2qeq n THR 290 N 4.32 3.15 -2.10 4.37 -2.24 -1.26 -4.37 114.28 116.16 2qeq n THR 290 Ca 0.17 -2.09 -0.41 0.00 -2.27 0.00 0.00 64.05 59.46 2qeq n THR 290 Cb 0.35 -0.49 -0.02 0.00 -2.10 0.00 0.00 70.33 68.07 2qeq n THR 290 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2qeq s ASP 291 N -1.49 6.71 0.26 3.42 2.15 -1.26 -4.86 116.67 121.59 2qeq s ASP 291 Ca 0.56 2.70 -0.01 0.00 0.43 0.00 0.00 52.55 56.23 2qeq s ASP 291 Cb 0.47 -2.65 0.56 0.00 -0.30 0.00 0.00 42.92 41.00 2qeq s ASP 291 CO 0.09 -0.58 1.72 -0.65 -0.17 0.00 0.00 175.17 175.57 2qeq h PRO 292 N 3.28 0.42 -0.12 4.34 0.11 -1.93 -0.12 132.00 137.97 2qeq h PRO 292 Ca -0.49 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.49 2qeq h PRO 292 Cb 1.23 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2qeq h PRO 292 CO 0.65 0.28 -0.39 0.00 -0.21 0.00 0.00 178.00 178.32 2qeq h ALA 293 N 1.61 1.10 0.01 -0.75 0.00 -1.91 -1.45 119.26 117.87 2qeq h ALA 293 Ca 0.47 -0.40 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 2qeq h ALA 293 Cb 0.78 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2qeq h ALA 293 CO -0.46 0.58 -0.87 0.77 0.00 0.00 0.00 179.25 179.28 2qeq h SER 294 N 0.23 0.18 -0.23 0.00 0.02 -1.39 0.36 113.55 112.72 2qeq h SER 294 Ca 0.02 -0.15 -0.10 0.00 -0.84 0.00 0.00 61.79 60.72 2qeq h SER 294 Cb 0.80 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 2qeq h SER 294 CO 0.06 0.97 -0.25 0.40 -1.14 0.00 0.00 176.83 176.87 2qeq h ILE 295 N 0.07 1.32 -0.33 3.27 2.04 -1.00 -1.89 117.51 120.99 2qeq h ILE 295 Ca -0.04 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 2qeq h ILE 295 Cb 1.51 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 39.27 2qeq h ILE 295 CO 0.13 0.44 0.20 0.00 0.00 0.00 0.00 178.15 178.92 2qeq h ALA 296 N 0.66 0.42 -0.26 1.87 0.00 -1.11 -1.91 119.26 118.93 2qeq h ALA 296 Ca 0.03 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2qeq h ALA 296 Cb 0.81 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2qeq h ALA 296 CO 0.06 -0.08 -0.29 0.00 0.00 0.00 0.00 179.25 178.95 2qeq h ALA 297 N 1.08 1.03 0.00 0.00 0.00 -0.29 -1.20 119.26 119.87 2qeq h ALA 297 Ca 0.12 -0.37 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2qeq h ALA 297 Cb 0.01 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 2qeq h ALA 297 CO -0.02 0.59 -0.25 -0.09 0.00 0.00 0.00 179.25 179.47 2qeq h ARG 298 N 0.45 0.00 0.02 0.00 2.43 -1.18 -2.18 114.38 113.92 2qeq h ARG 298 Ca 0.06 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.12 2qeq h ARG 298 Cb 0.73 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.29 2qeq h ARG 298 CO 0.06 0.25 -0.45 0.78 -1.51 0.00 0.00 179.97 179.10 2qeq h GLY 299 N 0.83 0.30 -0.15 2.80 0.00 -0.50 -2.33 103.07 104.04 2qeq h GLY 299 Ca -0.00 -0.57 0.05 0.00 0.00 0.00 0.00 47.33 46.81 2qeq h GLY 299 CO 0.03 0.50 -0.45 -1.82 0.00 0.00 0.00 176.54 174.81 2qeq h TYR 300 N -0.36 -1.30 -0.78 5.60 3.20 -1.12 0.62 116.97 122.83 2qeq h TYR 300 Ca -0.06 0.06 0.10 0.00 3.14 0.00 0.00 58.73 61.97 2qeq h TYR 300 Cb 1.21 0.60 -0.07 0.00 1.54 0.00 0.00 36.73 40.01 2qeq h TYR 300 CO 0.18 -0.47 0.43 0.82 -1.64 0.00 0.00 178.16 177.47 2qeq h ILE 301 N -0.43 0.87 -0.80 1.81 2.04 -1.48 -2.04 117.51 117.47 2qeq h ILE 301 Ca 0.09 -0.24 -0.05 0.00 1.00 0.00 0.00 64.86 65.66 2qeq h ILE 301 Cb 0.62 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 2qeq h ILE 301 CO -0.48 0.13 0.32 -1.28 0.00 0.00 0.00 178.15 176.84 2qeq h SER 302 N 0.71 1.11 -0.60 1.72 0.87 -0.66 -1.21 113.55 115.50 2qeq h SER 302 Ca 0.38 -0.17 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 2qeq h SER 302 Cb 0.39 -0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2qeq h SER 302 CO -0.26 0.98 0.09 0.74 -0.53 0.00 0.00 176.83 177.84 2qeq h THR 303 N 1.17 1.26 0.00 2.23 2.02 -0.48 -2.71 112.91 116.40 2qeq h THR 303 Ca 0.27 -1.01 -0.11 0.00 0.77 0.00 0.00 66.41 66.33 2qeq h THR 303 Cb 0.21 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.36 2qeq h THR 303 CO -0.02 0.37 -0.52 0.03 0.37 0.00 0.00 175.52 175.74 2qeq h ARG 304 N 0.89 0.00 -0.22 6.66 3.08 -0.66 -0.42 114.38 123.72 2qeq h ARG 304 Ca 0.18 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 60.10 2qeq h ARG 304 Cb 0.43 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 2qeq h ARG 304 CO 0.01 0.52 -0.38 0.28 -1.07 0.00 0.00 179.97 179.34 2qeq h VAL 305 N 0.00 1.32 0.00 2.04 2.07 -1.26 -0.52 116.25 119.90 2qeq h VAL 305 Ca -0.01 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 65.91 2qeq h VAL 305 Cb 0.97 1.80 -0.00 0.00 -1.52 0.00 0.00 31.29 32.54 2qeq h VAL 305 CO 0.07 0.50 -0.07 -0.08 0.02 0.00 0.00 177.57 178.01 2qeq h GLU 306 N 0.34 0.00 0.00 1.57 4.81 -1.20 -1.99 114.58 118.12 2qeq h GLU 306 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2qeq h GLU 306 Cb 0.97 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.35 2qeq h GLU 306 CO 0.09 0.07 -0.43 -0.11 -0.73 0.00 0.00 179.01 177.90 2qeq n LEU 307 N -3.34 0.53 0.00 1.64 0.00 -0.19 -4.93 117.00 110.70 2qeq n LEU 307 Ca -0.01 0.22 0.00 0.00 0.00 0.00 0.00 56.01 56.22 2qeq n LEU 307 Cb 0.24 -0.27 0.00 0.00 0.00 0.00 0.00 43.42 43.39 2qeq n LEU 307 CO 0.27 0.01 0.00 0.61 0.00 0.00 0.00 177.39 178.28 2qeq n GLY 308 N 1.42 1.22 0.24 -3.96 0.00 -0.75 -4.95 105.19 98.41 2qeq n GLY 308 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.14 2qeq n GLY 308 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qeq h GLU 309 N 3.33 0.00 -3.15 1.61 5.08 -1.33 -3.45 114.58 116.67 2qeq h GLU 309 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2qeq h GLU 309 Cb 0.00 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 2qeq h GLU 309 CO 0.00 0.15 0.18 0.00 -1.00 0.00 0.00 179.01 178.34 2qeq s ALA 310 N -4.55 -0.81 0.22 3.43 0.00 -1.12 -4.71 121.76 114.22 2qeq s ALA 310 Ca -0.04 -0.61 0.11 0.00 0.00 0.00 0.00 51.96 51.42 2qeq s ALA 310 Cb 0.15 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 24.06 2qeq s ALA 310 CO 0.66 -0.98 -0.16 0.00 0.00 0.00 0.00 175.76 175.28 2qeq s ALA 311 N -3.30 2.77 -0.02 0.00 0.00 0.10 -3.51 121.76 117.80 2qeq s ALA 311 Ca 0.15 -1.64 -0.03 0.00 0.00 0.00 0.00 51.96 50.44 2qeq s ALA 311 Cb -0.05 -0.48 0.00 0.00 0.00 0.00 0.00 23.12 22.59 2qeq s ALA 311 CO 0.10 0.39 0.07 0.00 0.00 0.00 0.00 175.76 176.32 2qeq s ALA 312 N -1.93 -0.16 -0.18 0.00 0.00 -1.22 -0.60 121.76 117.67 2qeq s ALA 312 Ca 0.25 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.33 2qeq s ALA 312 Cb -0.07 -0.08 0.01 0.00 0.00 0.00 0.00 23.12 22.98 2qeq s ALA 312 CO 0.14 -0.05 -0.16 0.42 0.00 0.00 0.00 175.76 176.10 2qeq s ILE 313 N -0.17 2.41 -0.21 0.00 1.01 0.51 -1.03 121.20 123.72 2qeq s ILE 313 Ca -0.02 -0.83 -0.12 0.00 0.00 0.00 0.00 60.65 59.68 2qeq s ILE 313 Cb -0.02 -2.03 -0.05 0.00 0.01 0.00 0.00 42.46 40.37 2qeq s ILE 313 CO 0.00 0.51 0.22 -0.36 0.00 0.00 0.00 174.94 175.31 2qeq s PHE 314 N 1.23 3.37 -0.15 3.97 2.99 0.16 -0.38 117.98 129.16 2qeq s PHE 314 Ca 0.03 0.37 -0.03 0.00 0.00 0.00 0.00 56.93 57.31 2qeq s PHE 314 Cb -0.14 -2.31 -0.02 0.00 0.00 0.00 0.00 43.02 40.55 2qeq s PHE 314 CO -0.08 0.12 -0.06 -1.64 -0.00 0.00 0.00 175.22 173.55 2qeq s MET 315 N 0.88 3.58 -0.29 0.44 -1.94 0.67 -0.59 119.30 122.06 2qeq s MET 315 Ca 0.11 -0.57 -0.28 0.00 -1.71 0.00 0.00 55.69 53.24 2qeq s MET 315 Cb -0.13 -2.83 0.19 0.00 2.01 0.00 0.00 34.83 34.06 2qeq s MET 315 CO 0.04 0.22 1.38 -0.08 -0.01 0.00 0.00 175.02 176.57 2qeq s THR 316 N 0.38 0.00 0.22 2.05 -1.32 -1.07 -1.45 115.64 114.45 2qeq s THR 316 Ca -0.06 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.48 2qeq s THR 316 Cb -0.15 -1.00 -0.08 0.00 -1.51 0.00 0.00 72.50 69.76 2qeq s THR 316 CO 0.04 0.00 1.50 0.00 -2.21 0.00 0.00 174.62 173.95 2qeq h ALA 317 N 2.38 0.76 -2.51 11.08 0.00 -1.83 -3.29 119.26 125.85 2qeq h ALA 317 Ca -0.14 -0.62 -0.60 0.00 0.00 0.00 0.00 54.91 53.55 2qeq h ALA 317 Cb 1.19 -0.09 -0.39 0.00 0.00 0.00 0.00 17.79 18.49 2qeq h ALA 317 CO 0.21 0.83 -0.86 0.25 0.00 0.00 0.00 179.25 179.68 2qeq n THR 318 N -3.76 -0.17 -1.84 0.00 -2.24 -1.26 -4.88 114.28 100.13 2qeq n THR 318 Ca -0.02 -3.99 -0.42 0.00 -2.27 0.00 0.00 64.05 57.35 2qeq n THR 318 Cb 0.69 -1.86 -0.02 0.00 -2.10 0.00 0.00 70.33 67.04 2qeq n THR 318 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2qeq s PRO 319 N -0.65 4.17 -0.08 -0.78 0.04 -1.26 -4.64 135.00 131.79 2qeq s PRO 319 Ca 0.31 2.49 -0.36 0.00 0.04 0.00 0.00 61.00 63.49 2qeq s PRO 319 Cb 0.04 -3.08 -0.14 0.00 0.04 0.00 0.00 34.50 31.36 2qeq s PRO 319 CO -0.17 -0.63 1.72 -2.30 0.04 0.00 0.00 177.00 175.67 2qeq n PRO 320 N 3.12 1.76 0.00 0.56 -0.02 -1.26 -1.07 135.00 138.09 2qeq n PRO 320 Ca 0.11 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 2qeq n PRO 320 Cb 0.37 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2qeq n PRO 320 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qeq n GLY 321 N 3.94 3.68 3.77 -1.23 0.00 -1.26 -4.74 105.19 109.35 2qeq n GLY 321 Ca 0.22 -0.82 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 2qeq n GLY 321 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qeq s THR 322 N 0.00 2.60 -0.28 2.61 -4.23 -0.23 -4.98 115.64 111.13 2qeq s THR 322 Ca 0.00 0.57 0.19 0.00 -1.18 0.00 0.00 61.69 61.27 2qeq s THR 322 Cb 0.00 -3.35 0.49 0.00 1.34 0.00 0.00 72.50 70.99 2qeq s THR 322 CO 0.00 0.11 1.11 -1.54 -0.54 0.00 0.00 174.62 173.76 2qeq n SER 323 N 0.42 2.18 -4.38 3.99 3.41 -1.26 -4.53 113.62 113.45 2qeq n SER 323 Ca 0.02 -2.41 -0.44 0.00 -0.26 0.00 0.00 58.87 55.78 2qeq n SER 323 Cb 0.42 -0.46 -0.08 0.00 -0.26 0.00 0.00 64.21 63.83 2qeq n SER 323 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2qeq s ASP 324 N -3.70 6.09 0.35 4.04 3.68 -1.26 -4.76 116.67 121.11 2qeq s ASP 324 Ca 0.31 -1.31 0.27 0.00 2.13 0.00 0.00 52.55 53.95 2qeq s ASP 324 Cb 0.35 -2.16 1.07 0.00 -1.45 0.00 0.00 42.92 40.73 2qeq s ASP 324 CO -0.02 -0.62 1.80 1.55 0.13 0.00 0.00 175.17 178.01 2qeq h PRO 325 N 8.71 0.00 -3.18 4.34 0.13 -1.97 -3.36 132.00 136.66 2qeq h PRO 325 Ca -0.28 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.23 2qeq h PRO 325 Cb 1.11 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.82 2qeq h PRO 325 CO 0.85 0.00 -0.59 -0.06 -0.23 0.00 0.00 178.00 177.98 2qeq s PHE 326 N -3.41 3.46 0.65 1.56 0.40 -1.26 -3.90 117.98 115.48 2qeq s PHE 326 Ca 0.04 -3.29 -0.09 0.00 -0.60 0.00 0.00 56.93 52.99 2qeq s PHE 326 Cb 0.09 -2.75 0.01 0.00 0.51 0.00 0.00 43.02 40.89 2qeq s PHE 326 CO 0.46 -0.61 1.00 -1.25 0.70 0.00 0.00 175.22 175.53 2qeq s PRO 327 N -1.10 2.88 0.60 0.24 0.04 -1.26 -5.05 135.00 131.36 2qeq s PRO 327 Ca 0.22 0.24 -0.17 0.00 0.04 0.00 0.00 61.00 61.33 2qeq s PRO 327 Cb -0.11 -2.14 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 2qeq s PRO 327 CO -0.11 -0.88 1.10 -1.21 0.04 0.00 0.00 177.00 175.94 2qeq s GLU 328 N -5.19 3.11 0.29 4.56 2.02 -1.26 -5.06 118.70 117.17 2qeq s GLU 328 Ca 0.56 1.42 -0.14 0.00 0.02 0.00 0.00 54.97 56.84 2qeq s GLU 328 Cb -0.11 -1.99 0.01 0.00 0.10 0.00 0.00 34.13 32.14 2qeq s GLU 328 CO 0.49 -1.01 0.57 -1.54 0.02 0.00 0.00 175.26 173.79 2qeq s SER 329 N -2.34 0.03 0.00 -0.19 1.04 -1.26 -4.81 113.70 106.16 2qeq s SER 329 Ca 0.68 -0.97 0.00 0.00 0.48 0.00 0.00 55.95 56.14 2qeq s SER 329 Cb -0.20 0.66 0.00 0.00 0.10 0.00 0.00 66.02 66.58 2qeq s SER 329 CO 0.35 -1.28 0.92 0.59 0.98 0.00 0.00 173.24 174.80 2qeq n ASN 330 N -0.68 0.00 -4.88 7.02 3.02 -1.25 -4.76 115.26 113.73 2qeq n ASN 330 Ca -0.03 0.92 -0.30 0.00 -0.03 0.00 0.00 54.58 55.14 2qeq n ASN 330 Cb 0.61 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 39.32 2qeq n ASN 330 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qeq s ALA 331 N -3.01 3.39 0.42 5.41 0.00 -0.94 -4.92 121.76 122.12 2qeq s ALA 331 Ca 0.00 -0.23 -0.26 0.00 0.00 0.00 0.00 51.96 51.48 2qeq s ALA 331 Cb 0.00 -2.64 -0.08 0.00 0.00 0.00 0.00 23.12 20.39 2qeq s ALA 331 CO 0.00 0.08 1.34 -2.14 0.00 0.00 0.00 175.76 175.05 2qeq s PRO 332 N -3.67 3.86 -0.06 0.00 0.02 -1.26 -4.76 135.00 129.13 2qeq s PRO 332 Ca 0.50 2.24 0.05 0.00 0.02 0.00 0.00 61.00 63.81 2qeq s PRO 332 Cb -0.10 -2.71 -0.02 0.00 0.02 0.00 0.00 34.50 31.69 2qeq s PRO 332 CO 0.29 -0.61 -0.22 0.42 -0.33 0.00 0.00 177.00 176.55 2qeq s ILE 333 N -1.25 2.36 -0.36 2.83 1.01 -1.26 -4.29 121.20 120.24 2qeq s ILE 333 Ca 0.59 -0.96 -0.20 0.00 0.00 0.00 0.00 60.65 60.07 2qeq s ILE 333 Cb -0.40 -1.88 0.00 0.00 0.01 0.00 0.00 42.46 40.20 2qeq s ILE 333 CO 0.51 0.57 0.62 -0.55 0.00 0.00 0.00 174.94 176.10 2qeq s SER 334 N -0.31 6.41 -0.31 3.58 0.15 -0.65 -4.94 113.70 117.63 2qeq s SER 334 Ca 0.01 0.10 -0.14 0.00 0.70 0.00 0.00 55.95 56.62 2qeq s SER 334 Cb -0.13 -2.32 -0.03 0.00 -1.71 0.00 0.00 66.02 61.84 2qeq s SER 334 CO 0.02 -0.60 0.32 -1.81 1.20 0.00 0.00 173.24 172.38 2qeq s ASP 335 N 1.80 6.16 -0.19 5.45 1.01 -1.26 0.39 116.67 130.03 2qeq s ASP 335 Ca 0.24 -0.06 -0.02 0.00 0.71 0.00 0.00 52.55 53.42 2qeq s ASP 335 Cb -0.15 -2.18 0.06 0.00 1.01 0.00 0.00 42.92 41.66 2qeq s ASP 335 CO 0.15 -0.23 0.01 -0.76 0.21 0.00 0.00 175.17 174.55 2qeq s LEU 336 N 1.95 1.39 -0.41 1.23 1.43 -0.30 -4.99 118.68 118.98 2qeq s LEU 336 Ca 0.11 -0.82 -0.28 0.00 -1.03 0.00 0.00 54.13 52.11 2qeq s LEU 336 Cb -0.16 -0.70 0.02 0.00 0.03 0.00 0.00 46.19 45.38 2qeq s LEU 336 CO 0.11 -0.28 1.07 -1.58 0.23 0.00 0.00 176.35 175.90 2qeq s GLN 337 N 1.78 3.82 0.30 1.70 0.74 -1.26 -2.33 119.66 124.41 2qeq s GLN 337 Ca -0.01 0.67 0.03 0.00 0.05 0.00 0.00 55.36 56.10 2qeq s GLN 337 Cb -0.17 -3.85 -0.04 0.00 1.10 0.00 0.00 33.01 30.06 2qeq s GLN 337 CO -0.07 -1.16 0.17 0.95 -0.55 0.00 0.00 175.29 174.63 2qeq s THR 338 N 4.01 0.24 0.12 -0.34 -4.23 -1.02 -4.98 115.64 109.44 2qeq s THR 338 Ca 0.45 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.65 2qeq s THR 338 Cb -0.10 -2.51 -0.06 0.00 1.34 0.00 0.00 72.50 71.18 2qeq s THR 338 CO 0.25 0.00 1.09 -1.61 -0.54 0.00 0.00 174.62 173.81 2qeq s GLU 339 N -3.80 4.56 -0.13 3.99 2.02 -1.26 -3.98 118.70 120.10 2qeq s GLU 339 Ca 0.37 1.66 0.02 0.00 0.02 0.00 0.00 54.97 57.04 2qeq s GLU 339 Cb 0.05 -3.33 0.01 0.00 0.10 0.00 0.00 34.13 30.96 2qeq s GLU 339 CO 0.18 -0.00 -0.21 0.42 0.02 0.00 0.00 175.26 175.68 2qeq s ILE 340 N 0.25 1.93 0.37 -1.63 1.01 -1.26 -5.03 121.20 116.84 2qeq s ILE 340 Ca 0.52 -0.91 -0.28 0.00 0.00 0.00 0.00 60.65 59.98 2qeq s ILE 340 Cb -0.28 -1.71 -0.10 0.00 0.01 0.00 0.00 42.46 40.38 2qeq s ILE 340 CO 0.32 0.53 1.42 -2.16 0.00 0.00 0.00 174.94 175.05 2qeq s PRO 341 N 0.80 4.14 0.05 2.79 0.04 -1.26 -4.91 135.00 136.64 2qeq s PRO 341 Ca -0.08 2.44 0.22 0.00 0.04 0.00 0.00 61.00 63.63 2qeq s PRO 341 Cb -0.16 -2.96 -0.09 0.00 0.04 0.00 0.00 34.50 31.33 2qeq s PRO 341 CO -0.01 -0.46 0.87 -0.25 0.04 0.00 0.00 177.00 177.19 2qeq n ASP 342 N 0.48 0.52 -0.50 6.66 8.00 -1.26 -4.98 116.55 125.47 2qeq n ASP 342 Ca 0.01 -0.14 0.00 0.00 0.71 0.00 0.00 54.79 55.37 2qeq n ASP 342 Cb 0.40 1.09 0.00 0.00 -0.02 0.00 0.00 41.12 42.60 2qeq n ASP 342 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 2qeq n ARG 343 N -2.11 0.00 -0.81 -1.24 1.85 -1.26 -4.83 116.66 108.26 2qeq n ARG 343 Ca 0.00 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.57 2qeq n ARG 343 Cb 0.48 0.00 0.23 0.00 -1.05 0.00 0.00 32.46 32.12 2qeq n ARG 343 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qeq s ALA 344 N -1.83 0.05 -0.28 2.89 0.00 -1.26 -4.68 121.76 116.65 2qeq s ALA 344 Ca 0.00 -0.36 -0.18 0.00 0.00 0.00 0.00 51.96 51.41 2qeq s ALA 344 Cb 0.00 -3.14 0.08 0.00 0.00 0.00 0.00 23.12 20.06 2qeq s ALA 344 CO 0.00 -3.55 0.70 1.67 0.00 0.00 0.00 175.76 174.58 2qeq s TRP 345 N -2.69 -0.99 -0.08 0.00 -2.14 -1.26 -5.06 118.94 106.72 2qeq s TRP 345 Ca 0.68 2.07 -0.25 0.00 2.66 0.00 0.00 56.10 61.25 2qeq s TRP 345 Cb -0.21 0.55 -0.27 0.00 -3.10 0.00 0.00 33.47 30.44 2qeq s TRP 345 CO 0.61 -0.49 0.91 -0.97 -2.66 0.00 0.00 176.95 174.35 2qeq h ASN 346 N 6.49 0.22 -5.05 -2.66 -0.73 -2.01 -3.49 115.58 108.35 2qeq h ASN 346 Ca -0.30 -0.90 -0.05 0.00 1.87 0.00 0.00 56.30 56.93 2qeq h ASN 346 Cb 1.21 -0.07 -0.13 0.00 0.27 0.00 0.00 38.32 39.60 2qeq h ASN 346 CO 0.13 1.10 -0.01 -0.94 -0.37 0.00 0.00 177.43 177.34 2qeq s SER 347 N -6.46 -0.32 0.00 1.15 1.04 -1.26 -5.12 113.70 102.73 2qeq s SER 347 Ca -0.16 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.07 2qeq s SER 347 Cb -0.00 0.50 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2qeq s SER 347 CO 0.75 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.73 2qeq n GLY 348 N -0.15 -0.12 2.99 7.32 0.00 -1.26 -4.96 105.19 109.01 2qeq n GLY 348 Ca -0.17 -1.72 -0.22 0.00 0.00 0.00 0.00 46.02 43.92 2qeq n GLY 348 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qeq n TYR 349 N 0.02 -1.85 0.27 1.61 4.02 -1.26 -4.84 117.16 115.13 2qeq n TYR 349 Ca 0.00 0.46 0.18 0.00 -0.01 0.00 0.00 57.90 58.52 2qeq n TYR 349 Cb 0.00 -4.22 0.94 0.00 -0.02 0.00 0.00 39.34 36.05 2qeq n TYR 349 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 2qeq h GLU 350 N -1.18 0.00 -0.34 -0.72 5.08 -2.01 -1.30 114.58 114.11 2qeq h GLU 350 Ca -0.51 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 57.72 2qeq h GLU 350 Cb 1.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 2qeq h GLU 350 CO 0.56 0.00 -0.31 0.11 -1.00 0.00 0.00 179.01 178.37 2qeq h TRP 351 N 0.00 0.87 -0.43 4.33 5.08 -1.99 -2.54 115.95 121.27 2qeq h TRP 351 Ca 0.00 -0.23 0.08 0.00 1.08 0.00 0.00 58.89 59.82 2qeq h TRP 351 Cb 0.09 -0.20 -0.07 0.00 -3.00 0.00 0.00 29.16 25.98 2qeq h TRP 351 CO 0.00 0.96 0.03 0.82 -1.28 0.00 0.00 178.44 178.98 2qeq h ILE 352 N 0.63 0.71 0.01 0.12 2.04 -1.61 -3.04 117.51 116.36 2qeq h ILE 352 Ca 0.07 -0.05 -0.35 0.00 1.00 0.00 0.00 64.86 65.53 2qeq h ILE 352 Cb 0.84 0.54 -0.06 0.00 -0.74 0.00 0.00 36.82 37.40 2qeq h ILE 352 CO 0.07 0.03 -2.19 0.35 0.00 0.00 0.00 178.15 176.41 2qeq n THR 353 N -5.17 1.49 0.23 -0.27 -2.24 -1.24 -4.22 114.28 102.86 2qeq n THR 353 Ca 0.04 -0.79 0.06 0.00 -2.27 0.00 0.00 64.05 61.08 2qeq n THR 353 Cb 0.22 -0.81 0.52 0.00 -2.10 0.00 0.00 70.33 68.15 2qeq n THR 353 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 2qeq h GLU 354 N 0.00 0.00 -6.87 -0.78 4.57 -1.52 -3.43 114.58 106.55 2qeq h GLU 354 Ca -0.47 0.00 -0.55 0.00 -1.18 0.00 0.00 59.36 57.16 2qeq h GLU 354 Cb 2.13 0.00 0.11 0.00 -0.16 0.00 0.00 28.75 30.83 2qeq h GLU 354 CO 0.03 0.18 0.71 0.98 -1.18 0.00 0.00 179.01 179.74 2qeq n TYR 355 N -4.27 2.80 -4.47 0.92 9.36 -1.15 -5.03 117.16 115.31 2qeq n TYR 355 Ca -0.02 0.46 -0.34 0.00 3.32 0.00 0.00 57.90 61.31 2qeq n TYR 355 Cb 0.25 -2.51 -0.10 0.00 -0.63 0.00 0.00 39.34 36.35 2qeq n TYR 355 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 2qeq s ILE 356 N -1.01 4.03 -2.64 2.97 1.10 -1.26 -5.03 121.20 119.36 2qeq s ILE 356 Ca 0.55 -0.40 0.00 0.00 -0.51 0.00 0.00 60.65 60.29 2qeq s ILE 356 Cb -0.50 -2.69 0.00 0.00 0.15 0.00 0.00 42.46 39.42 2qeq s ILE 356 CO 0.62 0.57 0.00 0.61 -2.11 0.00 0.00 174.94 174.63 2qeq n GLY 357 N 2.06 0.76 3.45 1.50 0.00 -1.26 -5.09 105.19 106.61 2qeq n GLY 357 Ca -0.18 -2.08 -0.30 0.00 0.00 0.00 0.00 46.02 43.46 2qeq n GLY 357 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qeq s LYS 358 N -1.06 1.92 -0.03 1.61 1.02 -1.26 -4.74 119.74 117.21 2qeq s LYS 358 Ca 0.00 -1.07 -0.01 0.00 0.02 0.00 0.00 55.97 54.91 2qeq s LYS 358 Cb 0.00 -2.13 0.02 0.00 -0.52 0.00 0.00 37.83 35.20 2qeq s LYS 358 CO 0.00 0.51 0.06 0.99 -0.92 0.00 0.00 175.35 175.99 2qeq s THR 359 N -0.98 -0.03 -0.26 2.17 2.01 -0.33 -1.73 115.64 116.48 2qeq s THR 359 Ca 0.15 0.10 -0.07 0.00 0.31 0.00 0.00 61.69 62.18 2qeq s THR 359 Cb -0.10 -0.10 -0.01 0.00 0.01 0.00 0.00 72.50 72.29 2qeq s THR 359 CO 0.06 0.04 0.06 -0.69 -0.69 0.00 0.00 174.62 173.41 2qeq s VAL 360 N 0.55 4.10 -0.30 3.82 1.01 -0.38 -0.42 120.40 128.78 2qeq s VAL 360 Ca -0.04 -0.38 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 2qeq s VAL 360 Cb -0.06 -2.98 0.00 0.00 0.00 0.00 0.00 36.38 33.34 2qeq s VAL 360 CO -0.02 0.26 0.12 0.86 0.00 0.00 0.00 175.10 176.32 2qeq s TRP 361 N 1.56 3.16 -0.25 5.22 -0.11 0.21 -0.38 118.94 128.35 2qeq s TRP 361 Ca 0.05 -0.75 -0.18 0.00 1.22 0.00 0.00 56.10 56.44 2qeq s TRP 361 Cb -0.16 -2.31 -0.03 0.00 -1.50 0.00 0.00 33.47 29.47 2qeq s TRP 361 CO 0.02 -0.51 0.52 -0.06 -4.62 0.00 0.00 176.95 172.31 2qeq s PHE 362 N 1.56 3.29 0.14 5.86 0.40 -0.21 -0.66 117.98 128.36 2qeq s PHE 362 Ca 0.04 0.68 0.08 0.00 -0.60 0.00 0.00 56.93 57.13 2qeq s PHE 362 Cb -0.17 -2.72 -0.04 0.00 0.51 0.00 0.00 43.02 40.60 2qeq s PHE 362 CO 0.05 -0.25 -0.11 0.14 0.70 0.00 0.00 175.22 175.75 2qeq s VAL 363 N 2.18 3.23 0.42 -0.44 -7.23 -0.70 -1.85 120.40 116.01 2qeq s VAL 363 Ca 0.22 -1.48 0.08 0.00 -1.81 0.00 0.00 61.98 58.99 2qeq s VAL 363 Cb -0.16 -2.55 0.26 0.00 0.56 0.00 0.00 36.38 34.50 2qeq s VAL 363 CO 0.09 0.01 2.06 -0.65 -0.31 0.00 0.00 175.10 176.30 2qeq h PRO 364 N 3.29 0.48 -3.79 4.82 0.11 -1.90 -3.44 132.00 131.57 2qeq h PRO 364 Ca -0.48 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.51 2qeq h PRO 364 Cb 1.18 -0.11 -0.10 0.00 0.11 0.00 0.00 31.00 32.09 2qeq h PRO 364 CO 0.52 0.32 -0.19 -1.54 -0.21 0.00 0.00 178.00 176.90 2qeq s SER 365 N -6.73 -0.06 0.28 -2.05 1.04 -1.26 -2.52 113.70 102.41 2qeq s SER 365 Ca -0.08 -0.99 0.08 0.00 0.48 0.00 0.00 55.95 55.44 2qeq s SER 365 Cb 0.17 0.55 0.41 0.00 0.10 0.00 0.00 66.02 67.26 2qeq s SER 365 CO 0.73 -1.09 1.66 1.62 0.98 0.00 0.00 173.24 177.14 2qeq h VAL 366 N 2.32 1.36 0.11 5.02 3.04 -1.96 -2.56 116.25 123.57 2qeq h VAL 366 Ca -0.28 -1.75 -0.28 0.00 -1.01 0.00 0.00 66.70 63.38 2qeq h VAL 366 Cb 1.25 1.88 0.02 0.00 -2.01 0.00 0.00 31.29 32.43 2qeq h VAL 366 CO 0.38 0.51 -1.21 0.07 -1.01 0.00 0.00 177.57 176.32 2qeq h LYS 367 N 0.12 0.45 0.00 4.17 2.10 -2.00 -3.02 116.57 118.40 2qeq h LYS 367 Ca 0.00 -0.64 -0.04 0.00 -2.00 0.00 0.00 60.65 57.97 2qeq h LYS 367 Cb 0.94 0.22 -0.01 0.00 -0.90 0.00 0.00 32.23 32.48 2qeq h LYS 367 CO 0.07 1.28 -0.20 0.52 -2.00 0.00 0.00 179.45 179.12 2qeq h MET 368 N 0.19 0.00 0.52 0.07 2.86 -1.88 -2.99 114.93 113.69 2qeq h MET 368 Ca -0.16 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.46 2qeq h MET 368 Cb 1.89 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.54 2qeq h MET 368 CO 0.22 0.20 -0.38 0.78 1.06 0.00 0.00 176.91 178.79 2qeq h GLY 369 N 1.26 -1.11 -0.92 8.32 0.00 -1.34 -2.37 103.07 106.92 2qeq h GLY 369 Ca -0.00 0.48 0.12 0.00 0.00 0.00 0.00 47.33 47.93 2qeq h GLY 369 CO 0.03 -0.36 -0.41 0.70 0.00 0.00 0.00 176.54 176.49 2qeq n ASN 370 N -4.74 -0.71 0.45 0.19 3.02 -1.13 -0.20 115.26 112.14 2qeq n ASN 370 Ca -0.10 1.61 -0.20 0.00 -0.03 0.00 0.00 54.58 55.85 2qeq n ASN 370 Cb 0.37 -0.32 -0.10 0.00 -0.61 0.00 0.00 39.78 39.12 2qeq n ASN 370 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2qeq h GLU 371 N 0.00 -1.19 -0.67 3.52 5.08 -1.55 0.04 114.58 119.81 2qeq h GLU 371 Ca 0.26 0.08 0.14 0.00 -1.00 0.00 0.00 59.36 58.85 2qeq h GLU 371 Cb 0.49 0.27 -0.11 0.00 0.50 0.00 0.00 28.75 29.91 2qeq h GLU 371 CO -0.89 -0.80 0.09 0.82 -1.00 0.00 0.00 179.01 177.23 2qeq h ILE 372 N -1.24 0.51 0.76 3.13 2.04 -0.81 0.11 117.51 122.01 2qeq h ILE 372 Ca -0.11 -0.07 -0.03 0.00 1.00 0.00 0.00 64.86 65.65 2qeq h ILE 372 Cb 0.99 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 2qeq h ILE 372 CO 0.12 0.04 -0.48 0.00 0.00 0.00 0.00 178.15 177.83 2qeq h ALA 373 N 1.58 -1.26 -0.72 1.87 0.00 -0.26 -1.17 119.26 119.30 2qeq h ALA 373 Ca 0.36 -0.24 0.16 0.00 0.00 0.00 0.00 54.91 55.19 2qeq h ALA 373 Cb 0.60 0.61 -0.12 0.00 0.00 0.00 0.00 17.79 18.88 2qeq h ALA 373 CO -0.51 -1.22 0.03 -0.07 0.00 0.00 0.00 179.25 177.48 2qeq h LEU 374 N -1.17 -0.28 -0.68 0.00 3.38 -0.50 0.47 115.31 116.54 2qeq h LEU 374 Ca -0.10 0.18 0.12 0.00 0.09 0.00 0.00 57.88 58.17 2qeq h LEU 374 Cb 0.94 0.31 -0.09 0.00 0.09 0.00 0.00 40.66 41.91 2qeq h LEU 374 CO 0.09 -0.15 0.23 0.00 0.09 0.00 0.00 178.44 178.71 2qeq h LEU 376 N 0.38 0.87 -0.88 0.00 3.38 0.26 -2.91 115.31 116.41 2qeq h LEU 376 Ca 0.36 -0.42 0.01 0.00 0.09 0.00 0.00 57.88 57.92 2qeq h LEU 376 Cb 0.52 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.98 2qeq h LEU 376 CO -0.38 1.19 0.57 1.56 0.09 0.00 0.00 178.44 181.47 2qeq h GLN 377 N 0.64 1.16 0.00 1.13 4.20 -0.22 -1.52 115.11 120.49 2qeq h GLN 377 Ca 0.04 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.64 2qeq h GLN 377 Cb 1.03 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 28.55 2qeq h GLN 377 CO 0.10 0.77 -0.15 -0.09 -0.67 0.00 0.00 178.83 178.79 2qeq h ARG 378 N 1.19 0.00 -0.02 1.46 2.43 -1.03 0.14 114.38 118.54 2qeq h ARG 378 Ca 0.32 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.49 2qeq h ARG 378 Cb -0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 2qeq h ARG 378 CO -0.07 0.15 0.00 0.00 -1.51 0.00 0.00 179.97 178.54 2qeq n ALA 379 N -2.36 2.62 -2.62 2.80 0.00 -0.66 -4.90 120.51 115.40 2qeq n ALA 379 Ca -0.02 -0.24 -0.03 0.00 0.00 0.00 0.00 53.44 53.15 2qeq n ALA 379 Cb 0.25 -1.33 0.01 0.00 0.00 0.00 0.00 19.45 18.37 2qeq n ALA 379 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qeq n GLY 380 N 0.95 0.72 3.56 0.00 0.00 0.47 -5.06 105.19 105.83 2qeq n GLY 380 Ca 0.18 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.30 2qeq n GLY 380 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qeq s LYS 381 N -5.12 2.90 -0.36 1.61 -0.14 -0.71 -5.01 119.74 112.91 2qeq s LYS 381 Ca 0.08 -0.55 -0.28 0.00 -1.36 0.00 0.00 55.97 53.86 2qeq s LYS 381 Cb -0.03 -2.63 0.02 0.00 -1.68 0.00 0.00 37.83 33.50 2qeq s LYS 381 CO 0.10 0.59 1.04 0.15 -0.76 0.00 0.00 175.35 176.46 2qeq s LYS 382 N -0.60 3.94 -0.02 1.68 1.02 -1.26 -3.92 119.74 120.57 2qeq s LYS 382 Ca 0.09 0.83 0.07 0.00 0.02 0.00 0.00 55.97 56.98 2qeq s LYS 382 Cb -0.12 -3.79 -0.02 0.00 -0.52 0.00 0.00 37.83 33.39 2qeq s LYS 382 CO 0.02 -1.00 -0.23 0.14 -0.92 0.00 0.00 175.35 173.36 2qeq s VAL 383 N 3.73 1.83 -0.17 3.17 -7.23 -1.26 -1.12 120.40 119.34 2qeq s VAL 383 Ca 0.43 -0.98 -0.03 0.00 -1.81 0.00 0.00 61.98 59.60 2qeq s VAL 383 Cb -0.11 -1.52 -0.02 0.00 0.56 0.00 0.00 36.38 35.29 2qeq s VAL 383 CO 0.19 0.52 -0.07 -0.63 -0.31 0.00 0.00 175.10 174.80 2qeq s ILE 384 N -0.50 3.40 -0.11 -0.62 1.01 -0.50 -5.00 121.20 118.88 2qeq s ILE 384 Ca 0.08 -0.51 -0.08 0.00 0.00 0.00 0.00 60.65 60.13 2qeq s ILE 384 Cb -0.09 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.84 2qeq s ILE 384 CO -0.01 0.48 0.17 -1.10 0.00 0.00 0.00 174.94 174.49 2qeq s GLN 385 N 0.77 3.58 -0.04 2.79 -0.21 -1.26 -1.53 119.66 123.77 2qeq s GLN 385 Ca -0.03 -0.07 -0.01 0.00 0.02 0.00 0.00 55.36 55.27 2qeq s GLN 385 Cb -0.15 -3.22 0.03 0.00 1.00 0.00 0.00 33.01 30.67 2qeq s GLN 385 CO 0.02 0.71 0.06 -0.48 -2.12 0.00 0.00 175.29 173.48 2qeq s LEU 386 N -0.88 0.49 0.13 2.90 0.05 -1.08 -4.98 118.68 115.31 2qeq s LEU 386 Ca 0.15 0.10 0.00 0.00 0.05 0.00 0.00 54.13 54.43 2qeq s LEU 386 Cb -0.12 -0.05 0.00 0.00 -2.05 0.00 0.00 46.19 43.96 2qeq s LEU 386 CO 0.05 -0.20 0.00 0.59 -0.55 0.00 0.00 176.35 176.24 2qeq n ASN 387 N 4.84 0.67 -2.71 1.48 3.02 -1.26 -3.79 115.26 117.50 2qeq n ASN 387 Ca -0.13 0.20 -0.05 0.00 -0.03 0.00 0.00 54.58 54.57 2qeq n ASN 387 Cb 0.50 -0.12 0.08 0.00 -0.61 0.00 0.00 39.78 39.63 2qeq n ASN 387 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2qeq n ARG 388 N -3.41 1.35 -0.88 3.52 1.74 -1.26 -4.80 116.66 112.91 2qeq n ARG 388 Ca 0.00 -2.43 0.11 0.00 -0.77 0.00 0.00 57.85 54.77 2qeq n ARG 388 Cb 0.05 -0.59 -0.04 0.00 -1.02 0.00 0.00 32.46 30.85 2qeq n ARG 388 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2qeq n ASN 400 N -0.69 -5.24 0.01 0.55 3.02 -1.26 -5.16 115.26 106.49 2qeq n ASN 400 Ca -0.01 0.66 0.00 0.00 -0.03 0.00 0.00 54.58 55.20 2qeq n ASN 400 Cb 0.84 -2.87 0.00 0.00 -0.61 0.00 0.00 39.78 37.13 2qeq n ASN 400 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2qeq n ASP 401 N -3.59 0.02 -4.55 6.41 2.03 -1.26 -5.02 116.55 110.59 2qeq n ASP 401 Ca -0.03 0.05 -0.40 0.00 0.52 0.00 0.00 54.79 54.93 2qeq n ASP 401 Cb 0.41 0.03 -0.03 0.00 -0.72 0.00 0.00 41.12 40.81 2qeq n ASP 401 CO 0.00 0.00 0.00 1.51 -1.92 0.00 0.00 177.20 176.79 2qeq s ASP 402 N -5.03 6.01 0.10 1.67 1.47 -1.26 -4.91 116.67 114.72 2qeq s ASP 402 Ca 0.00 -0.52 -0.08 0.00 1.18 0.00 0.00 52.55 53.13 2qeq s ASP 402 Cb 0.00 -2.56 -0.01 0.00 -0.34 0.00 0.00 42.92 40.01 2qeq s ASP 402 CO 0.00 -1.92 0.18 -1.66 0.68 0.00 0.00 175.17 172.45 2qeq s TRP 403 N 6.44 0.28 -0.07 2.11 1.48 -1.26 -4.95 118.94 122.96 2qeq s TRP 403 Ca 0.45 -0.70 0.03 0.00 -1.06 0.00 0.00 56.10 54.82 2qeq s TRP 403 Cb -0.07 -0.11 -0.06 0.00 -1.16 0.00 0.00 33.47 32.06 2qeq s TRP 403 CO 0.10 -0.57 -0.03 -0.25 -4.06 0.00 0.00 176.95 172.14 2qeq n ASP 404 N -0.08 3.41 -4.08 -2.66 8.00 -0.28 -4.81 116.55 116.06 2qeq n ASP 404 Ca -0.13 -0.02 -0.20 0.00 0.71 0.00 0.00 54.79 55.15 2qeq n ASP 404 Cb 0.62 0.21 -0.15 0.00 -0.02 0.00 0.00 41.12 41.79 2qeq n ASP 404 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2qeq s PHE 405 N -2.16 1.07 -0.11 1.24 0.40 -0.67 -1.18 117.98 116.56 2qeq s PHE 405 Ca -0.07 -0.23 0.03 0.00 -0.60 0.00 0.00 56.93 56.06 2qeq s PHE 405 Cb 0.02 -0.68 0.01 0.00 0.51 0.00 0.00 43.02 42.88 2qeq s PHE 405 CO 0.22 -0.01 -0.21 0.08 0.70 0.00 0.00 175.22 175.99 2qeq s VAL 406 N -0.38 1.92 -0.28 -0.44 1.01 0.44 -1.41 120.40 121.25 2qeq s VAL 406 Ca 0.04 -0.92 -0.04 0.00 0.00 0.00 0.00 61.98 61.06 2qeq s VAL 406 Cb -0.05 -1.69 0.03 0.00 0.00 0.00 0.00 36.38 34.67 2qeq s VAL 406 CO -0.00 0.53 0.01 -0.69 0.00 0.00 0.00 175.10 174.94 2qeq s VAL 407 N 0.60 3.29 0.09 2.92 1.01 -0.58 0.64 120.40 128.37 2qeq s VAL 407 Ca -0.13 -1.02 0.10 0.00 0.00 0.00 0.00 61.98 60.93 2qeq s VAL 407 Cb -0.17 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 2qeq s VAL 407 CO 0.04 0.06 -0.26 -0.89 0.00 0.00 0.00 175.10 174.05 2qeq s THR 408 N 1.36 2.14 -0.01 3.92 2.01 0.16 -2.63 115.64 122.60 2qeq s THR 408 Ca -0.01 -1.56 -0.20 0.00 0.31 0.00 0.00 61.69 60.24 2qeq s THR 408 Cb -0.18 -1.87 -0.30 0.00 0.01 0.00 0.00 72.50 70.16 2qeq s THR 408 CO -0.01 0.20 0.98 0.74 -0.69 0.00 0.00 174.62 175.84 2qeq h THR 409 N 4.06 1.43 -1.63 -0.82 2.02 -1.84 -1.87 112.91 114.26 2qeq h THR 409 Ca -0.48 -2.46 0.06 0.00 0.77 0.00 0.00 66.41 64.30 2qeq h THR 409 Cb 1.16 2.98 -0.22 0.00 -1.74 0.00 0.00 68.15 70.33 2qeq h THR 409 CO 0.41 0.71 0.49 -1.81 0.37 0.00 0.00 175.52 175.69 2qeq s ASP 410 N -7.09 -0.42 0.00 4.18 1.01 -1.26 -4.68 116.67 108.41 2qeq s ASP 410 Ca -0.12 0.47 0.12 0.00 0.71 0.00 0.00 52.55 53.73 2qeq s ASP 410 Cb 0.03 0.36 0.73 0.00 1.01 0.00 0.00 42.92 45.05 2qeq s ASP 410 CO 0.86 -0.38 1.16 2.30 0.21 0.00 0.00 175.17 179.33 2qeq n ILE 411 N 0.82 0.00 -0.14 0.77 -6.64 -1.26 -3.49 119.36 109.42 2qeq n ILE 411 Ca -0.12 0.00 -0.11 0.00 -1.77 0.00 0.00 62.75 60.76 2qeq n ILE 411 Cb 0.58 -0.75 -0.02 0.00 -1.44 0.00 0.00 39.64 38.01 2qeq n ILE 411 CO 0.00 0.00 0.00 0.77 -1.77 0.00 0.00 176.55 175.55 2qeq h SER 412 N 0.00 0.75 -3.31 7.28 4.64 -1.96 -3.42 113.55 117.52 2qeq h SER 412 Ca 0.00 -0.34 -0.58 0.00 -0.47 0.00 0.00 61.79 60.40 2qeq h SER 412 Cb 0.00 -0.20 -0.08 0.00 -0.31 0.00 0.00 62.40 61.81 2qeq h SER 412 CO 0.00 0.92 -0.14 -0.70 -0.87 0.00 0.00 176.83 176.04 2qeq s GLU 413 N -4.86 4.32 1.94 4.77 -6.30 -1.23 -4.96 118.70 112.38 2qeq s GLU 413 Ca -0.13 0.46 0.00 0.00 -2.50 0.00 0.00 54.97 52.80 2qeq s GLU 413 Cb 0.10 -3.42 0.00 0.00 0.00 0.00 0.00 34.13 30.81 2qeq s GLU 413 CO 0.81 0.19 0.00 -1.33 0.02 0.00 0.00 175.26 174.95 2qeq n MET 414 N 3.56 0.00 -2.21 4.30 2.81 -1.26 -4.93 117.12 119.38 2qeq n MET 414 Ca -0.07 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.79 2qeq n MET 414 Cb 0.52 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.03 2qeq n MET 414 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qeq n GLY 415 N 0.00 -0.90 2.78 3.03 0.00 -1.26 -4.91 105.19 103.94 2qeq n GLY 415 Ca 0.00 0.38 -0.18 0.00 0.00 0.00 0.00 46.02 46.22 2qeq n GLY 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qeq s ALA 416 N -2.33 -0.19 -1.11 4.61 0.00 -1.26 -4.94 121.76 116.55 2qeq s ALA 416 Ca 0.07 0.35 -0.09 0.00 0.00 0.00 0.00 51.96 52.28 2qeq s ALA 416 Cb -0.02 -1.12 -0.04 0.00 0.00 0.00 0.00 23.12 21.94 2qeq s ALA 416 CO 0.38 -0.96 0.87 0.09 0.00 0.00 0.00 175.76 176.13 2qeq n ASN 417 N 5.32 -5.44 -3.75 0.00 3.02 -1.26 -5.02 115.26 108.13 2qeq n ASN 417 Ca -0.05 -0.80 -0.29 0.00 -0.03 0.00 0.00 54.58 53.41 2qeq n ASN 417 Cb 0.50 -4.60 -0.16 0.00 -0.61 0.00 0.00 39.78 34.91 2qeq n ASN 417 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2qeq s PHE 418 N -3.43 1.48 0.10 3.10 0.08 -1.26 -5.11 117.98 112.93 2qeq s PHE 418 Ca 0.39 -1.35 -0.32 0.00 0.12 0.00 0.00 56.93 55.76 2qeq s PHE 418 Cb -0.08 -1.39 -0.11 0.00 -0.57 0.00 0.00 43.02 40.86 2qeq s PHE 418 CO 0.78 -0.75 1.81 0.36 -0.10 0.00 0.00 175.22 177.31 2qeq n LYS 419 N 4.92 2.62 -4.20 0.44 -0.00 -1.26 -5.00 118.16 115.68 2qeq n LYS 419 Ca -0.06 0.95 -0.13 0.00 -0.00 0.00 0.00 58.31 59.07 2qeq n LYS 419 Cb 0.44 -2.82 -0.09 0.00 -0.00 0.00 0.00 35.03 32.56 2qeq n LYS 419 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2qeq s ALA 420 N 2.62 1.20 0.00 0.58 0.00 -1.26 -4.89 121.76 120.01 2qeq s ALA 420 Ca 0.83 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 51.07 2qeq s ALA 420 Cb -0.54 1.38 0.00 0.00 0.00 0.00 0.00 23.12 23.97 2qeq s ALA 420 CO 0.39 -0.62 0.00 -1.13 0.00 0.00 0.00 175.76 174.40 2qeq n SER 421 N -0.51 0.24 -3.79 0.00 3.41 -0.71 -4.74 113.62 107.53 2qeq n SER 421 Ca 0.03 -0.30 -0.13 0.00 -0.26 0.00 0.00 58.87 58.20 2qeq n SER 421 Cb 0.65 0.66 -0.14 0.00 -0.26 0.00 0.00 64.21 65.12 2qeq n SER 421 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2qeq s ARG 422 N -0.71 0.12 -0.21 4.33 3.52 -1.15 -1.74 118.95 123.13 2qeq s ARG 422 Ca 0.00 0.26 -0.02 0.00 -0.13 0.00 0.00 55.73 55.84 2qeq s ARG 422 Cb 0.00 -0.05 -0.00 0.00 -1.56 0.00 0.00 34.95 33.34 2qeq s ARG 422 CO 0.00 -0.09 -0.09 0.08 -0.81 0.00 0.00 175.30 174.39 2qeq s VAL 423 N 0.58 2.99 -0.29 7.11 1.01 -0.91 -1.24 120.40 129.65 2qeq s VAL 423 Ca -0.04 -0.62 -0.17 0.00 0.00 0.00 0.00 61.98 61.14 2qeq s VAL 423 Cb -0.06 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 2qeq s VAL 423 CO -0.03 0.46 0.47 -0.63 0.00 0.00 0.00 175.10 175.38 2qeq s ILE 424 N 1.38 5.08 -0.25 2.22 1.01 0.48 -1.68 121.20 129.45 2qeq s ILE 424 Ca 0.05 0.64 0.02 0.00 0.00 0.00 0.00 60.65 61.36 2qeq s ILE 424 Cb -0.14 -3.83 0.06 0.00 0.01 0.00 0.00 42.46 38.56 2qeq s ILE 424 CO -0.06 0.02 -0.10 -0.62 0.00 0.00 0.00 174.94 174.18 2qeq s ASP 425 N 1.63 4.21 0.30 3.58 2.15 0.87 -1.04 116.67 128.38 2qeq s ASP 425 Ca 0.19 -1.30 0.25 0.00 0.43 0.00 0.00 52.55 52.12 2qeq s ASP 425 Cb -0.16 -1.44 1.06 0.00 -0.30 0.00 0.00 42.92 42.08 2qeq s ASP 425 CO 0.11 -0.19 1.74 0.77 -0.17 0.00 0.00 175.17 177.42 2qeq h SER 426 N 7.83 0.00 -1.81 -0.34 4.64 -1.66 -2.60 113.55 119.62 2qeq h SER 426 Ca -0.20 0.00 -0.40 0.00 -0.47 0.00 0.00 61.79 60.72 2qeq h SER 426 Cb 1.05 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.05 2qeq h SER 426 CO 0.45 0.00 -0.43 0.54 -0.87 0.00 0.00 176.83 176.52 2qeq n ARG 427 N -2.34 -1.48 -4.30 4.77 1.74 -1.26 -4.61 116.66 109.18 2qeq n ARG 427 Ca 0.02 1.10 -0.16 0.00 -0.77 0.00 0.00 57.85 58.03 2qeq n ARG 427 Cb 0.22 -5.56 -0.10 0.00 -1.02 0.00 0.00 32.46 25.99 2qeq n ARG 427 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2qeq s LYS 428 N -4.28 1.25 -0.10 5.56 1.02 -1.26 -2.17 119.74 119.75 2qeq s LYS 428 Ca 0.00 -1.61 -0.30 0.00 0.02 0.00 0.00 55.97 54.07 2qeq s LYS 428 Cb 0.00 -0.54 0.10 0.00 -0.52 0.00 0.00 37.83 36.87 2qeq s LYS 428 CO 0.00 -0.08 0.85 -1.54 -0.92 0.00 0.00 175.35 173.66 2qeq s SER 429 N -3.26 -0.50 0.11 2.83 1.04 -0.80 -4.29 113.70 108.83 2qeq s SER 429 Ca 0.26 0.52 -0.26 0.00 0.48 0.00 0.00 55.95 56.95 2qeq s SER 429 Cb 0.05 0.41 -0.07 0.00 0.10 0.00 0.00 66.02 66.52 2qeq s SER 429 CO 0.07 -0.48 0.80 0.68 0.98 0.00 0.00 173.24 175.29 2qeq s VAL 430 N -1.27 4.52 -0.09 5.02 -7.23 -1.05 -2.37 120.40 117.94 2qeq s VAL 430 Ca -0.05 1.74 -0.06 0.00 -1.81 0.00 0.00 61.98 61.79 2qeq s VAL 430 Cb -0.00 -4.16 0.03 0.00 0.56 0.00 0.00 36.38 32.81 2qeq s VAL 430 CO 0.05 0.43 0.21 -1.59 -0.31 0.00 0.00 175.10 173.89 2qeq s LYS 431 N -0.56 0.20 0.19 4.82 -2.85 -1.26 -5.03 119.74 115.26 2qeq s LYS 431 Ca 0.38 0.39 -0.32 0.00 -1.00 0.00 0.00 55.97 55.42 2qeq s LYS 431 Cb -0.22 -0.01 -0.11 0.00 -2.06 0.00 0.00 37.83 35.42 2qeq s LYS 431 CO 0.26 -0.10 1.68 -1.25 0.10 0.00 0.00 175.35 176.04 2qeq s PRO 432 N 0.68 4.15 0.14 1.78 0.04 -1.26 -4.45 135.00 136.08 2qeq s PRO 432 Ca -0.05 2.54 0.11 0.00 0.04 0.00 0.00 61.00 63.64 2qeq s PRO 432 Cb -0.06 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.33 2qeq s PRO 432 CO -0.04 -0.72 -0.26 0.99 0.04 0.00 0.00 177.00 177.02 2qeq s THR 433 N 1.22 2.32 -0.13 1.26 2.01 -0.79 -0.60 115.64 120.92 2qeq s THR 433 Ca 0.74 -1.78 -0.05 0.00 0.31 0.00 0.00 61.69 60.91 2qeq s THR 433 Cb -0.48 -2.04 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 2qeq s THR 433 CO 0.32 0.06 0.04 -0.63 -0.69 0.00 0.00 174.62 173.72 2qeq s ILE 434 N -1.15 4.64 -0.20 1.82 1.01 -0.91 -1.67 121.20 124.74 2qeq s ILE 434 Ca 0.15 -0.11 -0.12 0.00 0.00 0.00 0.00 60.65 60.57 2qeq s ILE 434 Cb -0.10 -3.02 -0.05 0.00 0.01 0.00 0.00 42.46 39.30 2qeq s ILE 434 CO 0.07 0.54 0.23 -0.63 0.00 0.00 0.00 174.94 175.15 2qeq s ILE 435 N -0.31 5.33 0.03 2.92 1.09 0.20 -4.97 121.20 125.49 2qeq s ILE 435 Ca 0.08 0.38 -0.28 0.00 -1.10 0.00 0.00 60.65 59.73 2qeq s ILE 435 Cb -0.12 -3.57 -0.17 0.00 -1.06 0.00 0.00 42.46 37.55 2qeq s ILE 435 CO 0.02 0.37 1.29 0.74 -0.10 0.00 0.00 174.94 177.26 2qeq h THR 436 N 4.81 0.29 -4.36 2.92 2.02 -1.98 -3.21 112.91 113.41 2qeq h THR 436 Ca -0.40 -0.30 -0.51 0.00 0.77 0.00 0.00 66.41 65.98 2qeq h THR 436 Cb 1.16 0.38 0.08 0.00 -1.74 0.00 0.00 68.15 68.03 2qeq h THR 436 CO 0.73 0.03 0.39 -0.70 0.37 0.00 0.00 175.52 176.35 2qeq s GLU 437 N -5.06 3.16 0.00 6.66 2.56 -1.26 -4.02 118.70 120.73 2qeq s GLU 437 Ca -0.15 0.78 0.00 0.00 0.00 0.00 0.00 54.97 55.60 2qeq s GLU 437 Cb 0.02 -2.03 0.00 0.00 2.00 0.00 0.00 34.13 34.12 2qeq s GLU 437 CO 0.51 -0.90 0.00 0.41 -0.56 0.00 0.00 175.26 174.73 2qeq n GLY 438 N -2.46 1.37 0.00 -1.50 0.00 -1.26 -4.16 105.19 97.18 2qeq n GLY 438 Ca 0.07 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2qeq n GLY 438 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qeq n GLU 439 N 0.00 0.00 0.00 1.61 -0.58 -1.26 -5.11 120.64 115.30 2qeq n GLU 439 Ca 0.00 -0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.65 2qeq n GLU 439 Cb 0.00 -0.18 0.00 0.00 -0.57 0.00 0.00 31.44 30.69 2qeq n GLU 439 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qeq n GLY 440 N 0.00 3.01 3.59 0.62 0.00 -1.26 -5.12 105.19 106.04 2qeq n GLY 440 Ca 0.00 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.28 2qeq n GLY 440 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2qeq s ARG 441 N -4.62 0.66 -0.16 1.61 3.52 -1.21 -4.58 118.95 114.16 2qeq s ARG 441 Ca 0.00 0.37 0.01 0.00 -0.13 0.00 0.00 55.73 55.98 2qeq s ARG 441 Cb 0.00 0.31 0.01 0.00 -1.56 0.00 0.00 34.95 33.71 2qeq s ARG 441 CO 0.00 -0.16 -0.18 0.08 -0.81 0.00 0.00 175.30 174.22 2qeq s VAL 442 N -0.59 2.31 0.12 7.11 1.01 -0.93 -0.63 120.40 128.80 2qeq s VAL 442 Ca -0.02 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.13 2qeq s VAL 442 Cb -0.02 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 2qeq s VAL 442 CO 0.00 0.53 0.09 -0.51 0.00 0.00 0.00 175.10 175.21 2qeq s ILE 443 N 0.99 4.42 -0.64 2.22 2.07 -0.67 -0.42 121.20 129.18 2qeq s ILE 443 Ca -0.02 -0.94 -0.09 0.00 -1.41 0.00 0.00 60.65 58.18 2qeq s ILE 443 Cb -0.15 -3.18 0.16 0.00 0.13 0.00 0.00 42.46 39.42 2qeq s ILE 443 CO -0.04 0.02 0.52 -0.76 -1.91 0.00 0.00 174.94 172.77 2qeq s LEU 444 N -2.69 5.94 0.00 8.50 1.43 -1.26 -1.88 118.68 128.72 2qeq s LEU 444 Ca 0.29 -2.44 0.01 0.00 -1.03 0.00 0.00 54.13 50.97 2qeq s LEU 444 Cb -0.11 -2.04 0.04 0.00 0.03 0.00 0.00 46.19 44.11 2qeq s LEU 444 CO 0.22 -0.57 0.27 0.61 0.23 0.00 0.00 176.35 177.11 2qeq n GLY 445 N 4.20 1.21 3.78 -3.19 0.00 -1.26 -5.02 105.19 104.91 2qeq n GLY 445 Ca 0.03 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.60 2qeq n GLY 445 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qeq s GLU 446 N -3.03 4.06 0.00 1.61 2.02 -1.26 -4.72 118.70 117.39 2qeq s GLU 446 Ca 0.19 2.54 -0.37 0.00 0.02 0.00 0.00 54.97 57.35 2qeq s GLU 446 Cb -0.01 -2.93 -0.15 0.00 0.10 0.00 0.00 34.13 31.13 2qeq s GLU 446 CO 0.12 -0.56 1.54 -2.30 0.02 0.00 0.00 175.26 174.09 2qeq n PRO 447 N 0.38 1.49 -4.70 0.39 -0.02 -1.26 -4.87 135.00 126.42 2qeq n PRO 447 Ca 0.01 0.54 -0.31 0.00 -2.02 0.00 0.00 63.50 61.72 2qeq n PRO 447 Cb 0.40 -2.24 -0.08 0.00 -0.02 0.00 0.00 33.50 31.55 2qeq n PRO 447 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2qeq s SER 448 N 1.66 4.09 0.33 2.55 1.04 -1.00 -4.85 113.70 117.53 2qeq s SER 448 Ca 0.87 -1.57 -0.29 0.00 0.48 0.00 0.00 55.95 55.45 2qeq s SER 448 Cb -0.89 0.28 -0.10 0.00 0.10 0.00 0.00 66.02 65.40 2qeq s SER 448 CO 0.49 -0.75 1.34 0.00 0.98 0.00 0.00 173.24 175.30 2qeq s ALA 449 N -2.83 3.51 0.55 5.32 0.00 -1.26 -1.90 121.76 125.15 2qeq s ALA 449 Ca 0.14 1.31 -0.08 0.00 0.00 0.00 0.00 51.96 53.34 2qeq s ALA 449 Cb 0.04 -3.50 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 2qeq s ALA 449 CO 0.07 -0.71 0.90 0.14 0.00 0.00 0.00 175.76 176.17 2qeq s VAL 450 N -1.09 4.72 0.52 0.00 -7.23 -0.92 -4.49 120.40 111.91 2qeq s VAL 450 Ca 0.50 0.48 -0.20 0.00 -1.81 0.00 0.00 61.98 60.95 2qeq s VAL 450 Cb -0.41 -3.84 -0.06 0.00 0.56 0.00 0.00 36.38 32.63 2qeq s VAL 450 CO 0.54 -0.95 1.13 -0.89 -0.31 0.00 0.00 175.10 174.62 2qeq s THR 451 N -2.95 3.22 0.32 5.32 2.01 -1.23 -0.62 115.64 121.71 2qeq s THR 451 Ca 0.51 0.79 0.03 0.00 0.31 0.00 0.00 61.69 63.33 2qeq s THR 451 Cb -0.11 -3.33 0.15 0.00 0.01 0.00 0.00 72.50 69.22 2qeq s THR 451 CO 0.49 -0.14 1.85 0.00 -0.69 0.00 0.00 174.62 176.13 2qeq h ALA 452 N 1.38 1.31 -0.77 7.40 0.00 -1.88 -0.10 119.26 126.61 2qeq h ALA 452 Ca -0.50 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.24 2qeq h ALA 452 Cb 1.26 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.84 2qeq h ALA 452 CO 0.58 0.47 0.51 0.00 0.00 0.00 0.00 179.25 180.80 2qeq h ALA 453 N 1.45 1.57 -0.06 0.00 0.00 -1.84 0.31 119.26 120.68 2qeq h ALA 453 Ca 0.12 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 2qeq h ALA 453 Cb 0.35 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2qeq h ALA 453 CO 0.01 0.34 -0.66 1.03 0.00 0.00 0.00 179.25 179.97 2qeq h SER 454 N 0.91 0.30 -0.16 0.00 0.87 -1.44 -2.40 113.55 111.63 2qeq h SER 454 Ca 0.31 -0.19 -0.21 0.00 -1.23 0.00 0.00 61.79 60.48 2qeq h SER 454 Cb 0.10 -0.09 0.01 0.00 -0.44 0.00 0.00 62.40 61.98 2qeq h SER 454 CO -0.10 0.87 -0.72 0.00 -0.53 0.00 0.00 176.83 176.36 2qeq h ALA 455 N 1.12 0.37 -0.43 6.23 0.00 -0.66 -3.01 119.26 122.89 2qeq h ALA 455 Ca -0.01 -0.58 0.08 0.00 0.00 0.00 0.00 54.91 54.40 2qeq h ALA 455 Cb 1.19 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.87 2qeq h ALA 455 CO 0.10 0.69 0.01 0.00 0.00 0.00 0.00 179.25 180.05 2qeq h ALA 456 N 0.62 0.41 -0.21 0.00 0.00 -0.32 -1.66 119.26 118.09 2qeq h ALA 456 Ca -0.03 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2qeq h ALA 456 Cb 1.34 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 2qeq h ALA 456 CO 0.15 -0.38 -0.04 1.96 0.00 0.00 0.00 179.25 180.94 2qeq h GLN 457 N 0.12 0.32 0.11 0.00 1.08 -1.37 -0.64 115.11 114.72 2qeq h GLN 457 Ca 0.21 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.35 2qeq h GLN 457 Cb 0.31 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 27.69 2qeq h GLN 457 CO -0.35 0.38 -0.05 0.00 -0.95 0.00 0.00 178.83 177.86 2qeq h ARG 458 N 0.31 -0.14 -0.47 1.46 3.08 -1.33 -2.69 114.38 114.60 2qeq h ARG 458 Ca 0.07 0.01 0.14 0.00 0.07 0.00 0.00 59.98 60.26 2qeq h ARG 458 Cb 0.28 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.34 2qeq h ARG 458 CO 0.01 0.36 0.52 -0.09 -1.07 0.00 0.00 179.97 179.70 2qeq h ARG 459 N -0.78 0.00 0.00 0.04 2.43 -1.19 -1.22 114.38 113.66 2qeq h ARG 459 Ca -0.01 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2qeq h ARG 459 Cb 0.56 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 2qeq h ARG 459 CO 0.02 0.00 -0.01 0.78 -1.51 0.00 0.00 179.97 179.25 2qeq h GLY 460 N 0.00 0.00 2.00 2.80 0.00 -0.75 -2.48 103.07 104.64 2qeq h GLY 460 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2qeq h GLY 460 CO -0.00 0.00 0.00 3.21 0.00 0.00 0.00 176.54 179.75 2qeq h ARG 461 N 0.00 0.00 -6.43 4.80 2.47 -1.31 -3.45 114.38 110.46 2qeq h ARG 461 Ca -0.00 0.00 -0.63 0.00 -1.26 0.00 0.00 59.98 58.09 2qeq h ARG 461 Cb 0.07 0.00 -0.16 0.00 -1.65 0.00 0.00 29.97 28.23 2qeq h ARG 461 CO 0.00 0.00 -0.78 0.99 0.56 0.00 0.00 179.97 180.74 2qeq s THR 462 N -3.55 2.53 -0.71 2.04 2.01 -0.94 -4.73 115.64 112.29 2qeq s THR 462 Ca 0.02 -2.13 -0.01 0.00 0.31 0.00 0.00 61.69 59.88 2qeq s THR 462 Cb 0.09 -2.26 0.00 0.00 0.01 0.00 0.00 72.50 70.34 2qeq s THR 462 CO 0.49 -0.23 0.60 0.61 -0.69 0.00 0.00 174.62 175.40 2qeq n GLY 463 N -0.13 0.01 0.00 4.40 0.00 -1.26 -4.95 105.19 103.26 2qeq n GLY 463 Ca -0.09 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2qeq n GLY 463 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2qeq n ARG 464 N -2.87 1.22 -3.74 1.61 1.85 -1.26 -2.20 116.66 111.27 2qeq n ARG 464 Ca -0.12 -0.95 -0.37 0.00 -1.00 0.00 0.00 57.85 55.41 2qeq n ARG 464 Cb 0.58 -0.87 -0.11 0.00 -1.05 0.00 0.00 32.46 31.00 2qeq n ARG 464 CO 0.00 0.00 0.00 1.21 -0.01 0.00 0.00 177.63 178.83 2qeq s ASN 465 N -0.49 5.32 0.58 2.89 3.84 -1.26 -4.74 114.94 121.08 2qeq s ASN 465 Ca 0.00 -1.74 0.28 0.00 0.21 0.00 0.00 52.86 51.61 2qeq s ASN 465 Cb 0.00 -1.86 1.57 0.00 -0.55 0.00 0.00 41.25 40.41 2qeq s ASN 465 CO 0.00 -0.50 2.02 -0.65 -2.79 0.00 0.00 177.10 175.18 2qeq h PRO 466 N 8.16 0.00 0.00 0.43 0.11 -1.92 0.76 132.00 139.53 2qeq h PRO 466 Ca -0.18 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.81 2qeq h PRO 466 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 2qeq h PRO 466 CO 0.69 0.00 -0.58 0.77 -0.21 0.00 0.00 178.00 178.67 2qeq h SER 467 N 0.00 0.00 -3.68 -2.05 0.02 -2.00 -3.42 113.55 102.42 2qeq h SER 467 Ca 0.14 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.42 2qeq h SER 467 Cb 0.78 0.00 -0.19 0.00 0.14 0.00 0.00 62.40 63.13 2qeq h SER 467 CO -0.00 0.58 -0.43 -1.10 -1.14 0.00 0.00 176.83 174.74 2qeq s GLN 468 N -3.52 3.44 -0.03 3.45 -0.21 0.26 -4.95 119.66 118.10 2qeq s GLN 468 Ca -0.01 -0.64 0.13 0.00 0.02 0.00 0.00 55.36 54.86 2qeq s GLN 468 Cb 0.12 -3.83 -0.19 0.00 1.00 0.00 0.00 33.01 30.10 2qeq s GLN 468 CO 0.75 -0.50 0.25 0.00 -2.12 0.00 0.00 175.29 173.67 2qeq n ALA 469 N 5.18 2.37 -0.65 6.09 0.00 -1.26 -4.57 120.51 127.66 2qeq n ALA 469 Ca -0.12 -0.38 -0.07 0.00 0.00 0.00 0.00 53.44 52.87 2qeq n ALA 469 Cb 0.49 -0.38 0.23 0.00 0.00 0.00 0.00 19.45 19.79 2qeq n ALA 469 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qeq n GLY 470 N 1.83 3.37 3.74 0.00 0.00 -1.26 -4.51 105.19 108.36 2qeq n GLY 470 Ca -0.05 -0.81 -0.36 0.00 0.00 0.00 0.00 46.02 44.81 2qeq n GLY 470 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qeq s ASP 471 N -0.73 4.73 0.05 1.61 -0.00 -1.26 -4.90 116.67 116.17 2qeq s ASP 471 Ca 0.45 2.43 -0.05 0.00 -0.00 0.00 0.00 52.55 55.37 2qeq s ASP 471 Cb 0.36 -2.60 -0.01 0.00 -0.00 0.00 0.00 42.92 40.66 2qeq s ASP 471 CO 0.11 -1.91 0.09 -1.83 -0.00 0.00 0.00 175.17 171.64 2qeq s GLU 472 N -3.54 0.67 -0.17 8.23 -1.05 -0.71 -1.64 118.70 120.48 2qeq s GLU 472 Ca 0.78 -0.92 -0.03 0.00 -0.15 0.00 0.00 54.97 54.66 2qeq s GLU 472 Cb -0.32 0.26 0.05 0.00 -0.44 0.00 0.00 34.13 33.68 2qeq s GLU 472 CO 0.39 -0.17 0.03 -0.47 0.95 0.00 0.00 175.26 175.98 2qeq s TYR 473 N -3.26 0.97 -0.29 4.83 5.04 0.16 -2.14 117.35 122.67 2qeq s TYR 473 Ca 0.01 -0.73 -0.07 0.00 -2.44 0.00 0.00 57.07 53.84 2qeq s TYR 473 Cb 0.03 -0.99 0.00 0.00 0.35 0.00 0.00 41.96 41.35 2qeq s TYR 473 CO -0.08 -0.56 0.07 0.00 -1.34 0.00 0.00 175.55 173.65 2qeq s TYR 475 N 1.51 2.32 -0.08 0.00 -0.85 -0.98 -0.09 117.35 119.18 2qeq s TYR 475 Ca 0.03 -0.36 0.00 0.00 -0.52 0.00 0.00 57.07 56.22 2qeq s TYR 475 Cb -0.17 -1.20 0.02 0.00 0.38 0.00 0.00 41.96 40.99 2qeq s TYR 475 CO 0.02 0.42 -0.06 0.20 -1.52 0.00 0.00 175.55 174.62 2qeq s GLY 476 N -2.37 0.65 0.00 5.49 0.00 -0.98 -2.42 107.32 107.69 2qeq s GLY 476 Ca 0.17 -0.31 0.00 0.00 0.00 0.00 0.00 44.72 44.59 2qeq s GLY 476 CO 0.08 0.69 0.00 0.61 0.00 0.00 0.00 173.10 174.48 2qeq n GLY 477 N 4.60 2.28 3.98 0.20 0.00 -1.26 -4.27 105.19 110.71 2qeq n GLY 477 Ca -0.16 -1.75 -0.21 0.00 0.00 0.00 0.00 46.02 43.90 2qeq n GLY 477 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2qeq s HIS 478 N -2.05 2.58 0.36 1.61 0.09 -1.26 -4.93 115.29 111.69 2qeq s HIS 478 Ca 0.00 -0.12 0.01 0.00 -0.00 0.00 0.00 55.06 54.94 2qeq s HIS 478 Cb 0.00 -2.73 -0.03 0.00 -0.00 0.00 0.00 32.58 29.82 2qeq s HIS 478 CO 0.00 -0.98 0.56 0.95 -0.00 0.00 0.00 174.74 175.26 2qeq s THR 479 N -2.78 4.92 -0.07 1.30 -4.23 -1.26 -4.64 115.64 108.88 2qeq s THR 479 Ca 0.59 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.60 2qeq s THR 479 Cb -0.09 -3.79 0.02 0.00 1.34 0.00 0.00 72.50 69.98 2qeq s THR 479 CO 0.39 -0.51 -0.04 0.21 -0.54 0.00 0.00 174.62 174.13 2qeq s ASN 480 N -4.06 1.46 0.30 3.99 2.47 0.21 -4.93 114.94 114.38 2qeq s ASN 480 Ca 0.41 -0.16 0.22 0.00 0.42 0.00 0.00 52.86 53.75 2qeq s ASN 480 Cb -0.10 -0.55 0.14 0.00 -1.45 0.00 0.00 41.25 39.30 2qeq s ASN 480 CO 0.36 -0.11 1.31 -0.33 -3.72 0.00 0.00 177.10 174.61 2qeq h GLU 481 N 7.74 0.00 -6.08 0.43 4.39 -1.93 -3.27 114.58 115.86 2qeq h GLU 481 Ca -0.30 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 58.86 2qeq h GLU 481 Cb 1.14 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.77 2qeq h GLU 481 CO 0.39 0.07 1.36 -0.51 -1.16 0.00 0.00 179.01 179.16 2qeq s ASP 482 N -5.87 5.50 -0.00 1.42 1.11 -1.26 -4.75 116.67 112.81 2qeq s ASP 482 Ca 0.03 1.08 0.02 0.00 0.18 0.00 0.00 52.55 53.87 2qeq s ASP 482 Cb 0.07 -2.52 -0.03 0.00 1.07 0.00 0.00 42.92 41.52 2qeq s ASP 482 CO 0.74 -2.06 0.09 0.47 1.18 0.00 0.00 175.17 175.59 2qeq n ASP 483 N 11.78 0.58 -0.42 0.27 9.92 -1.26 -4.82 116.55 132.60 2qeq n ASP 483 Ca 0.25 -0.49 0.37 0.00 -0.53 0.00 0.00 54.79 54.38 2qeq n ASP 483 Cb 0.49 1.01 0.63 0.00 -0.64 0.00 0.00 41.12 42.61 2qeq n ASP 483 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2qeq n SER 484 N -1.11 0.23 -0.00 -2.24 7.64 -1.26 0.34 113.62 117.21 2qeq n SER 484 Ca 0.00 1.37 0.14 0.00 1.01 0.00 0.00 58.87 61.39 2qeq n SER 484 Cb 0.04 -0.67 0.61 0.00 -1.01 0.00 0.00 64.21 63.17 2qeq n SER 484 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 2qeq n ASN 485 N -4.72 0.03 -4.72 6.43 6.94 -1.26 -4.85 115.26 113.11 2qeq n ASN 485 Ca 0.38 0.43 -0.42 0.00 -0.02 0.00 0.00 54.58 54.95 2qeq n ASN 485 Cb 1.44 -0.45 -0.03 0.00 -2.36 0.00 0.00 39.78 38.38 2qeq n ASN 485 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2qeq h ALA 487 N 6.55 1.89 -0.99 0.00 0.00 -1.16 -2.94 119.26 122.61 2qeq h ALA 487 Ca -0.42 0.03 0.20 0.00 0.00 0.00 0.00 54.91 54.71 2qeq h ALA 487 Cb 1.21 -0.09 -0.10 0.00 0.00 0.00 0.00 17.79 18.81 2qeq h ALA 487 CO 0.84 -0.17 0.61 0.45 0.00 0.00 0.00 179.25 180.99 2qeq h HIS 488 N 0.64 0.97 0.28 0.00 3.86 -1.91 -0.74 115.15 118.25 2qeq h HIS 488 Ca 0.48 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.71 2qeq h HIS 488 Cb 0.87 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.05 2qeq h HIS 488 CO -0.00 0.21 -0.14 -1.49 0.86 0.00 0.00 177.93 177.37 2qeq h TRP 489 N 0.69 -0.35 -0.68 2.45 4.06 -1.85 -0.46 115.95 119.80 2qeq h TRP 489 Ca 0.57 -0.01 0.09 0.00 2.06 0.00 0.00 58.89 61.60 2qeq h TRP 489 Cb 0.99 0.12 -0.07 0.00 -1.00 0.00 0.00 29.16 29.20 2qeq h TRP 489 CO -0.00 -0.07 0.32 1.15 -3.56 0.00 0.00 178.44 176.28 2qeq h THR 490 N -0.62 0.82 -0.34 1.49 2.02 -1.47 0.24 112.91 115.05 2qeq h THR 490 Ca -0.04 -0.19 -0.06 0.00 0.77 0.00 0.00 66.41 66.90 2qeq h THR 490 Cb 0.44 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2qeq h THR 490 CO 0.06 0.10 -0.03 -0.33 0.37 0.00 0.00 175.52 175.69 2qeq h GLU 491 N 0.54 0.55 -0.55 6.66 5.08 -1.09 0.08 114.58 125.85 2qeq h GLU 491 Ca 0.34 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.49 2qeq h GLU 491 Cb 0.38 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2qeq h GLU 491 CO -0.28 0.60 0.05 0.00 -1.00 0.00 0.00 179.01 178.38 2qeq h ALA 492 N 1.45 0.74 -0.44 3.43 0.00 0.65 -2.75 119.26 122.34 2qeq h ALA 492 Ca 0.11 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 2qeq h ALA 492 Cb 0.39 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2qeq h ALA 492 CO 0.02 0.52 -0.21 -0.09 0.00 0.00 0.00 179.25 179.49 2qeq h ARG 493 N 0.83 0.89 -0.36 0.00 1.12 -0.19 -2.25 114.38 114.41 2qeq h ARG 493 Ca 0.16 -0.36 0.01 0.00 -1.11 0.00 0.00 59.98 58.68 2qeq h ARG 493 Cb 0.47 -0.04 -0.02 0.00 -0.01 0.00 0.00 29.97 30.38 2qeq h ARG 493 CO 0.02 1.01 0.24 0.82 -3.11 0.00 0.00 179.97 178.95 2qeq h ILE 494 N 0.77 1.08 -0.02 1.20 2.04 -0.94 -0.97 117.51 120.67 2qeq h ILE 494 Ca 0.11 -0.16 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 2qeq h ILE 494 Cb 0.75 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 2qeq h ILE 494 CO 0.06 0.09 -0.10 0.24 0.00 0.00 0.00 178.15 178.44 2qeq h MET 495 N 0.47 0.11 -0.31 2.37 2.86 -1.12 -2.78 114.93 116.54 2qeq h MET 495 Ca 0.14 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.59 2qeq h MET 495 Cb -0.03 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2qeq h MET 495 CO -0.03 0.74 -0.23 -0.07 1.06 0.00 0.00 176.91 178.38 2qeq h LEU 496 N -0.50 0.60 -0.53 1.22 3.38 -1.33 -2.35 115.31 115.80 2qeq h LEU 496 Ca -0.01 -0.20 0.07 0.00 0.09 0.00 0.00 57.88 57.83 2qeq h LEU 496 Cb 0.76 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.29 2qeq h LEU 496 CO 0.02 0.82 0.20 0.44 0.09 0.00 0.00 178.44 180.02 2qeq h ASP 497 N 0.52 0.22 -0.30 -0.43 3.45 -1.25 -2.58 116.42 116.06 2qeq h ASP 497 Ca 0.08 0.06 -0.15 0.00 0.43 0.00 0.00 57.03 57.45 2qeq h ASP 497 Cb 0.68 0.04 -0.09 0.00 -0.56 0.00 0.00 39.33 39.40 2qeq h ASP 497 CO 0.05 0.15 0.18 0.59 -1.57 0.00 0.00 179.24 178.65 2qeq n ASN 498 N -4.98 3.16 -4.51 6.45 3.02 -0.89 -4.73 115.26 112.77 2qeq n ASN 498 Ca 0.06 -2.48 -0.34 0.00 -0.03 0.00 0.00 54.58 51.79 2qeq n ASN 498 Cb 0.21 -0.60 -0.12 0.00 -0.61 0.00 0.00 39.78 38.66 2qeq n ASN 498 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qeq s ILE 499 N -1.08 3.89 -0.12 2.41 1.01 -0.97 -4.57 121.20 121.76 2qeq s ILE 499 Ca 0.18 -0.37 -0.25 0.00 0.00 0.00 0.00 60.65 60.21 2qeq s ILE 499 Cb 0.15 -2.69 -0.02 0.00 0.01 0.00 0.00 42.46 39.91 2qeq s ILE 499 CO 0.04 0.51 0.79 0.20 0.00 0.00 0.00 174.94 176.48 2qeq s ASN 500 N 0.19 6.99 0.18 3.58 -0.87 -1.26 -4.78 114.94 118.96 2qeq s ASN 500 Ca -0.02 1.20 0.09 0.00 -1.57 0.00 0.00 52.86 52.56 2qeq s ASN 500 Cb -0.14 -2.45 -0.04 0.00 -0.02 0.00 0.00 41.25 38.60 2qeq s ASN 500 CO 0.03 -0.29 -0.19 -0.04 -2.57 0.00 0.00 177.10 174.04 2qeq s MET 501 N 1.62 1.32 0.38 -0.60 -1.94 -1.26 -5.05 119.30 113.77 2qeq s MET 501 Ca 0.39 -1.45 -0.25 0.00 -1.71 0.00 0.00 55.69 52.67 2qeq s MET 501 Cb -0.17 -1.39 -0.12 0.00 2.01 0.00 0.00 34.83 35.15 2qeq s MET 501 CO 0.15 0.28 0.82 -2.30 -0.01 0.00 0.00 175.02 173.97 2qeq n PRO 502 N 0.20 1.00 -0.90 2.03 -0.02 -1.26 -2.72 135.00 133.33 2qeq n PRO 502 Ca -0.12 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.71 2qeq n PRO 502 Cb 0.57 -1.75 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 2qeq n PRO 502 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2qeq n ASN 503 N 1.02 -3.03 0.00 2.55 5.15 -1.26 -2.72 115.26 116.97 2qeq n ASN 503 Ca 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.09 2qeq n ASN 503 Cb 0.37 -1.92 0.00 0.00 -0.53 0.00 0.00 39.78 37.69 2qeq n ASN 503 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2qeq n GLY 504 N -1.18 0.78 3.80 8.20 0.00 -1.10 -5.05 105.19 110.63 2qeq n GLY 504 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2qeq n GLY 504 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qeq s LEU 505 N 0.00 3.10 -0.16 0.99 1.43 -1.10 -4.96 118.68 117.98 2qeq s LEU 505 Ca 0.00 1.71 -0.04 0.00 -1.03 0.00 0.00 54.13 54.77 2qeq s LEU 505 Cb 0.00 -4.51 -0.03 0.00 0.03 0.00 0.00 46.19 41.69 2qeq s LEU 505 CO 0.00 -1.67 -0.03 -0.63 0.23 0.00 0.00 176.35 174.25 2qeq s ILE 506 N -2.97 3.91 0.28 -0.59 1.01 -1.26 -4.16 121.20 117.42 2qeq s ILE 506 Ca 0.59 -0.35 -0.30 0.00 0.00 0.00 0.00 60.65 60.60 2qeq s ILE 506 Cb -0.15 -2.72 -0.11 0.00 0.01 0.00 0.00 42.46 39.49 2qeq s ILE 506 CO 0.55 0.48 1.55 0.00 0.00 0.00 0.00 174.94 177.52 2qeq s ALA 507 N 0.46 3.71 0.37 9.38 0.00 -1.26 -5.02 121.76 129.41 2qeq s ALA 507 Ca -0.03 1.50 -0.04 0.00 0.00 0.00 0.00 51.96 53.39 2qeq s ALA 507 Cb -0.14 -3.62 -0.04 0.00 0.00 0.00 0.00 23.12 19.31 2qeq s ALA 507 CO 0.03 -0.91 0.64 -0.65 0.00 0.00 0.00 175.76 174.86 2qeq s GLN 508 N -0.44 3.57 0.67 0.00 -0.21 -1.26 -4.79 119.66 117.19 2qeq s GLN 508 Ca 0.62 -0.01 -0.15 0.00 0.02 0.00 0.00 55.36 55.84 2qeq s GLN 508 Cb -0.46 -2.55 0.00 0.00 1.00 0.00 0.00 33.01 31.00 2qeq s GLN 508 CO 0.46 0.05 1.13 -0.06 -2.12 0.00 0.00 175.29 174.75 2qeq s PHE 509 N -2.38 2.50 0.20 0.91 0.40 -1.26 -4.50 117.98 113.84 2qeq s PHE 509 Ca 0.44 1.56 -0.33 0.00 -0.60 0.00 0.00 56.93 58.01 2qeq s PHE 509 Cb -0.10 -3.24 -0.13 0.00 0.51 0.00 0.00 43.02 40.06 2qeq s PHE 509 CO 0.36 -1.88 1.62 0.98 0.70 0.00 0.00 175.22 177.01 2qeq n TYR 510 N -2.41 2.50 -0.26 0.36 9.36 -1.26 -4.78 117.16 120.66 2qeq n TYR 510 Ca 0.11 0.20 -0.02 0.00 3.32 0.00 0.00 57.90 61.51 2qeq n TYR 510 Cb 0.52 -2.59 0.04 0.00 -0.63 0.00 0.00 39.34 36.68 2qeq n TYR 510 CO 0.00 0.00 0.00 1.96 0.22 0.00 0.00 176.86 179.04 2qeq h GLN 511 N 5.97 -0.07 -0.66 2.98 4.20 -1.96 0.28 115.11 125.86 2qeq h GLN 511 Ca -0.44 0.00 0.19 0.00 0.06 0.00 0.00 58.65 58.46 2qeq h GLN 511 Cb 1.23 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 29.00 2qeq h GLN 511 CO 0.89 -0.05 0.55 -1.35 -0.67 0.00 0.00 178.83 178.21 2qeq h PRO 512 N -0.08 0.00 -0.38 1.46 0.11 -1.90 -0.28 132.00 130.95 2qeq h PRO 512 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 2qeq h PRO 512 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.68 2qeq h PRO 512 CO -0.79 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 177.39 2qeq n GLU 513 N -4.01 2.39 0.25 1.05 1.02 0.97 -4.46 120.64 117.85 2qeq n GLU 513 Ca 0.13 -2.19 0.15 0.00 -0.02 0.00 0.00 57.16 55.23 2qeq n GLU 513 Cb 0.80 -1.46 0.48 0.00 -0.02 0.00 0.00 31.44 31.23 2qeq n GLU 513 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2qeq h ARG 514 N 3.97 0.00 -0.37 3.49 3.08 -0.81 -3.12 114.38 120.62 2qeq h ARG 514 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2qeq h ARG 514 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.96 2qeq h ARG 514 CO 0.00 0.00 0.00 -0.85 -1.07 0.00 0.00 179.97 178.05 2qeq n GLU 515 N -3.05 1.84 -0.00 0.04 0.00 -1.26 -3.89 120.64 114.32 2qeq n GLU 515 Ca 0.02 -1.30 0.02 0.00 0.00 0.00 0.00 57.16 55.91 2qeq n GLU 515 Cb 0.39 -1.29 -0.12 0.00 0.00 0.00 0.00 31.44 30.43 2qeq n GLU 515 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2qeq n LYS 516 N 0.55 0.65 -4.79 3.44 4.01 -1.18 -4.93 118.16 115.91 2qeq n LYS 516 Ca 0.12 0.02 -0.33 0.00 -0.51 0.00 0.00 58.31 57.61 2qeq n LYS 516 Cb 0.31 -1.65 -0.13 0.00 -0.51 0.00 0.00 35.03 33.05 2qeq n LYS 516 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 2qeq s VAL 517 N -3.06 3.29 -0.09 -0.18 -7.23 -1.25 -4.70 120.40 107.17 2qeq s VAL 517 Ca -0.06 -0.63 0.18 0.00 -1.81 0.00 0.00 61.98 59.66 2qeq s VAL 517 Cb 0.10 -2.32 -0.27 0.00 0.56 0.00 0.00 36.38 34.45 2qeq s VAL 517 CO 0.84 0.59 0.27 -1.22 -0.31 0.00 0.00 175.10 175.27 2qeq n TYR 518 N 2.39 0.00 -0.99 2.82 4.02 -1.26 -4.95 117.16 119.19 2qeq n TYR 518 Ca -0.17 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.39 2qeq n TYR 518 Cb 0.52 -0.64 0.14 0.00 -0.02 0.00 0.00 39.34 39.34 2qeq n TYR 518 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 2qeq s THR 519 N -2.95 2.21 0.06 -0.72 -4.23 -1.26 -5.06 115.64 103.69 2qeq s THR 519 Ca -0.08 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2qeq s THR 519 Cb 0.09 -2.34 0.01 0.00 1.34 0.00 0.00 72.50 71.61 2qeq s THR 519 CO 0.78 -0.08 0.09 1.15 -0.54 0.00 0.00 174.62 176.02 2qeq n MET 520 N -3.65 0.59 -2.68 3.99 0.00 -1.26 -5.06 117.12 109.06 2qeq n MET 520 Ca 0.12 -0.25 -0.39 0.00 0.00 0.00 0.00 57.70 57.18 2qeq n MET 520 Cb 0.51 -0.06 -0.06 0.00 0.00 0.00 0.00 33.22 33.62 2qeq n MET 520 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 2qeq s ASP 521 N -1.36 7.44 0.00 3.17 1.11 -1.26 -3.53 116.67 122.24 2qeq s ASP 521 Ca 0.06 2.01 0.00 0.00 0.18 0.00 0.00 52.55 54.80 2qeq s ASP 521 Cb -0.00 -2.61 0.00 0.00 1.07 0.00 0.00 42.92 41.38 2qeq s ASP 521 CO 0.04 -0.00 0.00 0.61 1.18 0.00 0.00 175.17 177.00 2qeq n GLY 522 N 1.16 0.44 0.29 0.21 0.00 -1.26 -4.91 105.19 101.12 2qeq n GLY 522 Ca -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 2qeq n GLY 522 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qeq h GLU 523 N 1.03 1.00 -0.62 1.61 4.57 -1.97 -2.94 114.58 117.26 2qeq h GLU 523 Ca 0.00 -0.15 0.00 0.00 -1.18 0.00 0.00 59.36 58.03 2qeq h GLU 523 Cb 0.21 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 2qeq h GLU 523 CO 0.00 0.79 0.00 0.66 -1.18 0.00 0.00 179.01 179.28 2qeq n TYR 524 N -4.44 1.12 -1.66 0.92 4.02 -1.26 -4.98 117.16 110.87 2qeq n TYR 524 Ca 0.06 -0.46 -0.47 0.00 -0.01 0.00 0.00 57.90 57.01 2qeq n TYR 524 Cb 0.13 -0.16 -0.04 0.00 -0.02 0.00 0.00 39.34 39.25 2qeq n TYR 524 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 176.86 173.72 2qeq n ARG 525 N 0.97 2.07 -4.47 -0.72 3.00 -1.11 -4.74 116.66 111.66 2qeq n ARG 525 Ca 0.21 0.75 -0.34 0.00 -0.00 0.00 0.00 57.85 58.47 2qeq n ARG 525 Cb 0.69 -2.52 -0.10 0.00 0.00 0.00 0.00 32.46 30.53 2qeq n ARG 525 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2qeq s LEU 526 N 1.23 3.38 -0.04 6.15 1.43 -1.26 -5.07 118.68 124.50 2qeq s LEU 526 Ca 0.81 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.96 2qeq s LEU 526 Cb -0.70 -1.80 0.01 0.00 0.03 0.00 0.00 46.19 43.73 2qeq s LEU 526 CO 0.40 0.35 -0.07 -0.60 0.23 0.00 0.00 176.35 176.66 2qeq s ARG 527 N -1.00 0.95 2.07 1.70 3.52 -1.26 -4.65 118.95 120.28 2qeq s ARG 527 Ca 0.14 -0.21 0.00 0.00 -0.13 0.00 0.00 55.73 55.53 2qeq s ARG 527 Cb -0.11 -0.89 0.00 0.00 -1.56 0.00 0.00 34.95 32.39 2qeq s ARG 527 CO 0.04 0.01 0.00 0.41 -0.81 0.00 0.00 175.30 174.94 2qeq n GLY 528 N 3.70 -0.26 0.24 8.12 0.00 -1.26 -4.03 105.19 111.70 2qeq n GLY 528 Ca -0.22 -1.34 0.11 0.00 0.00 0.00 0.00 46.02 44.58 2qeq n GLY 528 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2qeq h GLU 529 N 0.00 0.00 -0.09 1.61 5.08 -2.01 -2.24 114.58 116.93 2qeq h GLU 529 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2qeq h GLU 529 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 2qeq h GLU 529 CO 0.00 0.00 -0.03 0.93 -1.00 0.00 0.00 179.01 178.91 2qeq h GLU 530 N 0.00 0.18 -0.81 2.33 5.08 -1.90 -2.35 114.58 117.12 2qeq h GLU 530 Ca 0.00 -0.07 0.21 0.00 -1.00 0.00 0.00 59.36 58.50 2qeq h GLU 530 Cb 0.53 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.73 2qeq h GLU 530 CO 0.00 0.52 0.56 0.00 -1.00 0.00 0.00 179.01 179.09 2qeq h ARG 531 N -0.16 0.14 -0.00 2.33 2.47 -1.64 -0.37 114.38 117.14 2qeq h ARG 531 Ca 0.02 -0.01 -0.02 0.00 -1.26 0.00 0.00 59.98 58.72 2qeq h ARG 531 Cb 0.46 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.75 2qeq h ARG 531 CO 0.01 0.09 -0.06 0.87 0.56 0.00 0.00 179.97 181.44 2qeq h LYS 532 N 0.15 0.05 -0.77 0.04 1.57 -1.60 -2.12 116.57 113.89 2qeq h LYS 532 Ca 0.40 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 59.17 2qeq h LYS 532 Cb 1.34 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.61 2qeq h LYS 532 CO -0.06 0.80 0.48 -0.91 -0.57 0.00 0.00 179.45 179.19 2qeq h ASN 533 N -0.69 0.78 -0.16 0.86 2.35 -1.08 -0.11 115.58 117.53 2qeq h ASN 533 Ca -0.01 0.00 0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2qeq h ASN 533 Cb 0.83 -0.16 -0.05 0.00 0.05 0.00 0.00 38.32 38.98 2qeq h ASN 533 CO 0.01 0.53 -0.18 0.15 -1.65 0.00 0.00 177.43 176.29 2qeq h PHE 534 N 0.92 -0.45 -0.63 1.19 3.57 -1.10 -1.79 116.94 118.65 2qeq h PHE 534 Ca 0.32 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.79 2qeq h PHE 534 Cb 0.06 0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.00 2qeq h PHE 534 CO -0.04 -0.25 0.18 -0.07 -2.23 0.00 0.00 178.31 175.90 2qeq h LEU 535 N -0.21 0.90 -0.62 0.59 3.38 -0.92 -2.67 115.31 115.76 2qeq h LEU 535 Ca 0.11 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 57.95 2qeq h LEU 535 Cb 0.37 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.84 2qeq h LEU 535 CO -0.28 0.86 0.37 -0.08 0.09 0.00 0.00 178.44 179.40 2qeq h GLU 536 N 0.93 0.71 0.00 1.13 4.57 -0.53 -2.40 114.58 118.98 2qeq h GLU 536 Ca 0.20 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.34 2qeq h GLU 536 Cb 0.29 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 2qeq h GLU 536 CO -0.01 0.47 0.00 -0.07 -1.18 0.00 0.00 179.01 178.22 2qeq h LEU 537 N 0.73 0.00 0.23 1.64 3.38 -1.06 -2.29 115.31 117.94 2qeq h LEU 537 Ca 0.25 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.21 2qeq h LEU 537 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.80 2qeq h LEU 537 CO -0.11 0.00 -0.11 -0.07 0.09 0.00 0.00 178.44 178.24 2qeq h LEU 538 N 0.00 -0.26 0.00 1.67 3.38 -1.11 -1.49 115.31 117.49 2qeq h LEU 538 Ca 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2qeq h LEU 538 Cb 0.78 0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2qeq h LEU 538 CO 0.00 0.25 -0.12 -0.09 0.09 0.00 0.00 178.44 178.57 2qeq h ARG 539 N -1.02 0.00 0.79 1.13 9.65 -1.59 -2.98 114.38 120.36 2qeq h ARG 539 Ca -0.03 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.81 2qeq h ARG 539 Cb 0.40 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.98 2qeq h ARG 539 CO 0.05 0.00 -0.41 1.15 2.80 0.00 0.00 179.97 183.56 2qeq h THR 540 N -0.86 0.00 0.00 0.20 2.02 -1.65 -2.80 112.91 109.81 2qeq h THR 540 Ca 0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2qeq h THR 540 Cb 0.12 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 66.53 2qeq h THR 540 CO 0.00 0.00 -0.06 0.00 0.37 0.00 0.00 175.52 175.83 2qeq h ALA 541 N -1.41 1.28 -6.18 6.16 0.00 -1.62 -3.47 119.26 114.02 2qeq h ALA 541 Ca -0.11 -0.05 -0.44 0.00 0.00 0.00 0.00 54.91 54.31 2qeq h ALA 541 Cb 0.86 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.67 2qeq h ALA 541 CO 0.16 0.07 -0.85 -0.25 0.00 0.00 0.00 179.25 178.38 2qeq n ASP 542 N -3.56 -1.11 -4.90 0.00 8.00 -1.06 -4.99 116.55 108.94 2qeq n ASP 542 Ca -0.02 -0.87 -0.34 0.00 0.71 0.00 0.00 54.79 54.27 2qeq n ASP 542 Cb 0.17 -3.82 -0.05 0.00 -0.02 0.00 0.00 41.12 37.40 2qeq n ASP 542 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2qeq s LEU 543 N -6.72 4.37 0.50 0.64 1.43 -0.58 -5.04 118.68 113.29 2qeq s LEU 543 Ca 0.02 0.41 -0.22 0.00 -1.03 0.00 0.00 54.13 53.31 2qeq s LEU 543 Cb -0.01 -2.55 -0.08 0.00 0.03 0.00 0.00 46.19 43.59 2qeq s LEU 543 CO 0.83 0.28 1.01 -0.81 0.23 0.00 0.00 176.35 177.89 2qeq n PRO 544 N 1.13 1.22 -0.31 1.29 -0.04 -1.26 -4.56 135.00 132.47 2qeq n PRO 544 Ca -0.12 0.45 0.01 0.00 -0.04 0.00 0.00 63.50 63.79 2qeq n PRO 544 Cb 0.53 -2.13 0.14 0.00 -0.04 0.00 0.00 33.50 32.00 2qeq n PRO 544 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2qeq h VAL 545 N 1.13 1.04 0.12 0.52 2.07 -1.96 -1.94 116.25 117.22 2qeq h VAL 545 Ca -0.47 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 66.73 2qeq h VAL 545 Cb 1.34 -0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.08 2qeq h VAL 545 CO 0.54 0.18 -0.38 -0.25 0.02 0.00 0.00 177.57 177.68 2qeq h TRP 546 N 0.96 -1.11 -0.17 1.57 7.01 -1.92 -1.33 115.95 120.96 2qeq h TRP 546 Ca 0.37 0.03 0.05 0.00 2.11 0.00 0.00 58.89 61.45 2qeq h TRP 546 Cb 0.17 0.47 -0.06 0.00 -2.10 0.00 0.00 29.16 27.64 2qeq h TRP 546 CO -0.03 -0.44 -0.20 1.25 -2.79 0.00 0.00 178.44 176.23 2qeq h LEU 547 N -0.57 -0.63 -0.59 0.65 5.85 -1.78 0.10 115.31 118.34 2qeq h LEU 547 Ca -0.01 0.11 0.11 0.00 0.84 0.00 0.00 57.88 58.93 2qeq h LEU 547 Cb 0.56 0.29 -0.08 0.00 0.37 0.00 0.00 40.66 41.80 2qeq h LEU 547 CO -0.19 -0.25 0.12 0.00 -0.34 0.00 0.00 178.44 177.79 2qeq h ALA 548 N 0.80 0.69 0.43 1.25 0.00 -1.34 0.16 119.26 121.26 2qeq h ALA 548 Ca 0.11 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 2qeq h ALA 548 Cb 0.40 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2qeq h ALA 548 CO -0.31 -0.30 -0.21 -0.92 0.00 0.00 0.00 179.25 177.51 2qeq h TYR 549 N 0.26 -0.54 -0.49 0.00 3.20 -0.26 0.33 116.97 119.46 2qeq h TYR 549 Ca 0.31 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 62.26 2qeq h TYR 549 Cb 0.45 0.18 -0.10 0.00 1.54 0.00 0.00 36.73 38.80 2qeq h TYR 549 CO -0.25 -0.30 -0.24 0.87 -1.64 0.00 0.00 178.16 176.60 2qeq h LYS 550 N -0.65 -0.13 0.29 1.82 1.79 -0.07 0.19 116.57 119.81 2qeq h LYS 550 Ca -0.06 0.01 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 2qeq h LYS 550 Cb 0.49 0.03 -0.01 0.00 -1.58 0.00 0.00 32.23 31.16 2qeq h LYS 550 CO 0.10 -0.09 -0.23 0.28 -1.08 0.00 0.00 179.45 178.43 2qeq h VAL 551 N -0.13 0.00 -0.87 0.50 2.07 -0.87 -2.96 116.25 113.99 2qeq h VAL 551 Ca 0.23 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.89 2qeq h VAL 551 Cb 0.49 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.16 2qeq h VAL 551 CO -0.57 0.00 0.46 0.00 0.02 0.00 0.00 177.57 177.48 2qeq h ALA 552 N -1.45 1.32 0.00 1.67 0.00 -0.26 -0.95 119.26 119.60 2qeq h ALA 552 Ca -0.04 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2qeq h ALA 552 Cb 0.42 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2qeq h ALA 552 CO 0.00 -0.07 -0.11 0.00 0.00 0.00 0.00 179.25 179.07 2qeq h ALA 553 N 1.56 1.15 0.00 0.00 0.00 -0.63 -2.58 119.26 118.76 2qeq h ALA 553 Ca 0.47 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2qeq h ALA 553 Cb 0.66 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2qeq h ALA 553 CO -0.36 0.14 0.00 0.00 0.00 0.00 0.00 179.25 179.03 2qeq n ALA 554 N -2.22 2.21 -0.05 0.00 0.00 -0.36 -4.90 120.51 115.20 2qeq n ALA 554 Ca -0.01 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2qeq n ALA 554 Cb 0.28 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.29 2qeq n ALA 554 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qeq n GLY 555 N 1.23 0.87 3.88 0.00 0.00 -0.97 -5.09 105.19 105.12 2qeq n GLY 555 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.79 2qeq n GLY 555 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qeq s VAL 556 N -2.02 4.76 0.15 1.61 0.11 -1.25 -5.08 120.40 118.68 2qeq s VAL 556 Ca 0.00 0.63 0.07 0.00 -2.93 0.00 0.00 61.98 59.75 2qeq s VAL 556 Cb 0.00 -3.86 -0.04 0.00 -1.53 0.00 0.00 36.38 30.95 2qeq s VAL 556 CO 0.00 -1.03 -0.03 -0.55 -3.33 0.00 0.00 175.10 170.16 2qeq s SER 557 N -4.16 4.66 0.58 3.54 0.15 -1.26 -4.67 113.70 112.55 2qeq s SER 557 Ca 0.52 -0.40 0.30 0.00 0.70 0.00 0.00 55.95 57.08 2qeq s SER 557 Cb -0.11 -0.96 1.43 0.00 -1.71 0.00 0.00 66.02 64.67 2qeq s SER 557 CO 0.51 0.11 1.82 0.22 1.20 0.00 0.00 173.24 177.10 2qeq h TYR 558 N 2.95 0.00 0.00 3.44 3.20 -1.98 0.26 116.97 124.84 2qeq h TYR 558 Ca -0.47 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.40 2qeq h TYR 558 Cb 1.19 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.46 2qeq h TYR 558 CO 0.62 0.00 -1.18 0.72 -1.64 0.00 0.00 178.16 176.68 2qeq n HIS 559 N -3.82 0.05 -1.70 -3.82 8.25 -1.26 -4.71 115.22 108.20 2qeq n HIS 559 Ca 0.14 0.01 -0.41 0.00 -0.26 0.00 0.00 57.72 57.20 2qeq n HIS 559 Cb 0.88 -0.19 -0.01 0.00 1.12 0.00 0.00 29.99 31.79 2qeq n HIS 559 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2qeq n ASP 560 N -1.73 6.18 -0.45 0.41 9.92 0.08 -4.83 116.55 126.13 2qeq n ASP 560 Ca 0.02 -2.82 0.00 0.00 -0.53 0.00 0.00 54.79 51.46 2qeq n ASP 560 Cb 0.40 -1.57 0.00 0.00 -0.64 0.00 0.00 41.12 39.31 2qeq n ASP 560 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2qeq n ARG 561 N 4.43 0.02 -0.23 -1.24 3.00 -1.26 -3.91 116.66 117.46 2qeq n ARG 561 Ca 0.61 0.00 -0.06 0.00 -0.01 0.00 0.00 57.85 58.39 2qeq n ARG 561 Cb 0.32 -1.01 0.09 0.00 0.00 0.00 0.00 32.46 31.86 2qeq n ARG 561 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2qeq h ARG 562 N 0.88 1.06 0.00 5.56 3.08 -1.96 -3.26 114.38 119.75 2qeq h ARG 562 Ca 0.00 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 2qeq h ARG 562 Cb 0.01 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 29.91 2qeq h ARG 562 CO 0.00 0.92 -0.00 0.11 -1.07 0.00 0.00 179.97 179.93 2qeq h TRP 563 N 1.02 0.00 0.00 3.04 0.09 -1.96 -1.92 115.95 116.23 2qeq h TRP 563 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.20 2qeq h TRP 563 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.56 2qeq h TRP 563 CO 0.02 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.56 2qeq n PHE 565 N -0.39 0.00 -2.03 0.00 3.01 -0.72 -0.16 117.46 117.17 2qeq n PHE 565 Ca 0.00 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 58.07 2qeq n PHE 565 Cb 0.05 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.51 2qeq n PHE 565 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2qeq n ASP 566 N -1.31 7.92 -4.68 4.37 5.68 -1.20 -4.44 116.55 122.88 2qeq n ASP 566 Ca 0.00 -3.20 -0.26 0.00 -0.50 0.00 0.00 54.79 50.83 2qeq n ASP 566 Cb 0.07 -1.34 -0.09 0.00 -1.14 0.00 0.00 41.12 38.63 2qeq n ASP 566 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 2qeq s GLY 567 N 0.21 2.38 0.66 6.12 0.00 -0.67 -4.58 107.32 111.42 2qeq s GLY 567 Ca 0.53 -2.18 -0.16 0.00 0.00 0.00 0.00 44.72 42.91 2qeq s GLY 567 CO -0.11 -1.99 1.16 2.56 0.00 0.00 0.00 173.10 174.72 2qeq s PRO 568 N -3.80 2.69 0.43 2.90 0.04 -1.26 -4.89 135.00 131.11 2qeq s PRO 568 Ca 0.38 1.61 0.27 0.00 0.04 0.00 0.00 61.00 63.30 2qeq s PRO 568 Cb 0.06 -1.92 1.35 0.00 0.04 0.00 0.00 34.50 34.03 2qeq s PRO 568 CO 0.20 -1.38 1.66 0.00 0.04 0.00 0.00 177.00 177.53 2qeq h ARG 569 N 0.22 0.15 0.00 4.56 3.08 -1.99 0.42 114.38 120.83 2qeq h ARG 569 Ca -0.48 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2qeq h ARG 569 Cb 1.27 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.29 2qeq h ARG 569 CO 0.53 0.10 0.00 1.79 -1.07 0.00 0.00 179.97 181.32 2qeq h THR 570 N 0.16 0.00 -0.32 2.04 1.35 -2.01 -3.17 112.91 110.96 2qeq h THR 570 Ca 0.76 -0.52 0.00 0.00 -0.55 0.00 0.00 66.41 66.10 2qeq h THR 570 Cb 2.31 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 70.18 2qeq h THR 570 CO -0.37 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.49 2qeq n ASN 571 N -2.52 3.58 -4.66 5.36 4.13 0.15 -4.91 115.26 116.39 2qeq n ASN 571 Ca 0.04 -2.50 -0.43 0.00 1.68 0.00 0.00 54.58 53.37 2qeq n ASN 571 Cb 0.38 -0.60 -0.03 0.00 -1.54 0.00 0.00 39.78 38.00 2qeq n ASN 571 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 2qeq s THR 572 N -1.96 4.74 -0.04 3.41 2.01 -1.20 -3.92 115.64 118.68 2qeq s THR 572 Ca 0.30 1.90 -0.30 0.00 0.31 0.00 0.00 61.69 63.89 2qeq s THR 572 Cb 0.23 -4.25 -0.04 0.00 0.01 0.00 0.00 72.50 68.45 2qeq s THR 572 CO 0.09 -0.13 1.20 -0.63 -0.69 0.00 0.00 174.62 174.46 2qeq s ILE 573 N 2.96 4.24 -0.24 1.82 1.01 -1.16 -5.01 121.20 124.81 2qeq s ILE 573 Ca 0.42 1.57 -0.12 0.00 0.00 0.00 0.00 60.65 62.52 2qeq s ILE 573 Cb -0.15 -4.01 -0.05 0.00 0.01 0.00 0.00 42.46 38.26 2qeq s ILE 573 CO 0.08 0.02 0.24 -1.48 0.00 0.00 0.00 174.94 173.80 2qeq s LEU 574 N 2.02 4.10 -0.01 2.97 2.34 -1.26 -3.30 118.68 125.54 2qeq s LEU 574 Ca 0.56 0.20 -0.02 0.00 0.06 0.00 0.00 54.13 54.94 2qeq s LEU 574 Cb -0.25 -2.24 -0.01 0.00 -0.56 0.00 0.00 46.19 43.13 2qeq s LEU 574 CO 0.23 -0.01 0.35 -0.08 -1.06 0.00 0.00 176.35 175.78 2qeq h GLU 575 N 7.70 -0.06 0.00 1.48 4.81 -1.14 -3.44 114.58 123.93 2qeq h GLU 575 Ca -0.36 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 2qeq h GLU 575 Cb 1.17 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.56 2qeq h GLU 575 CO 0.65 -0.04 -0.10 -0.25 -0.73 0.00 0.00 179.01 178.54 2qeq n ASP 576 N -2.43 0.28 -1.88 1.04 8.00 -1.26 -4.84 116.55 115.46 2qeq n ASP 576 Ca -0.01 0.22 -0.02 0.00 0.71 0.00 0.00 54.79 55.70 2qeq n ASP 576 Cb 0.02 -0.55 0.02 0.00 -0.02 0.00 0.00 41.12 40.60 2qeq n ASP 576 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2qeq n ASN 577 N -2.67 -0.07 -4.15 -2.24 4.13 -1.26 -5.12 115.26 103.87 2qeq n ASN 577 Ca -0.01 -2.05 -0.25 0.00 1.68 0.00 0.00 54.58 53.94 2qeq n ASN 577 Cb 0.05 0.08 -0.15 0.00 -1.54 0.00 0.00 39.78 38.21 2qeq n ASN 577 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 2qeq s ASN 578 N -1.85 2.02 0.21 6.41 0.01 -1.26 -5.01 114.94 115.47 2qeq s ASN 578 Ca 0.16 -0.31 -0.32 0.00 -0.71 0.00 0.00 52.86 51.68 2qeq s ASN 578 Cb 0.27 -0.27 -0.13 0.00 0.41 0.00 0.00 41.25 41.53 2qeq s ASN 578 CO -0.08 0.20 1.53 -0.62 -1.51 0.00 0.00 177.10 176.62 2qeq n GLU 579 N 2.73 2.25 -2.68 -0.60 1.02 -1.26 -0.53 120.64 121.57 2qeq n GLU 579 Ca -0.15 0.81 -0.40 0.00 -0.02 0.00 0.00 57.16 57.39 2qeq n GLU 579 Cb 0.54 -2.54 -0.05 0.00 -0.02 0.00 0.00 31.44 29.36 2qeq n GLU 579 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2qeq s VAL 580 N 0.47 3.98 -0.19 2.62 1.01 -1.21 -4.85 120.40 122.23 2qeq s VAL 580 Ca 0.73 1.93 -0.13 0.00 0.00 0.00 0.00 61.98 64.51 2qeq s VAL 580 Cb -0.63 -4.23 -0.05 0.00 0.00 0.00 0.00 36.38 31.48 2qeq s VAL 580 CO 0.43 0.44 0.26 -1.83 0.00 0.00 0.00 175.10 174.40 2qeq s GLU 581 N -1.07 4.20 -0.14 2.72 -1.05 -1.26 -3.26 118.70 118.85 2qeq s GLU 581 Ca 0.43 0.00 -0.02 0.00 -0.15 0.00 0.00 54.97 55.23 2qeq s GLU 581 Cb -0.27 -3.46 0.04 0.00 -0.44 0.00 0.00 34.13 30.00 2qeq s GLU 581 CO 0.34 0.17 0.01 0.54 0.95 0.00 0.00 175.26 177.26 2qeq s VAL 582 N 0.71 0.57 -0.18 1.83 0.11 -1.25 -5.02 120.40 117.17 2qeq s VAL 582 Ca 0.14 -0.31 -0.24 0.00 -2.93 0.00 0.00 61.98 58.64 2qeq s VAL 582 Cb -0.13 -0.88 -0.02 0.00 -1.53 0.00 0.00 36.38 33.82 2qeq s VAL 582 CO 0.04 0.03 0.79 -0.63 -3.33 0.00 0.00 175.10 172.00 2qeq s ILE 583 N 1.86 4.90 0.24 7.04 1.01 -1.26 -4.09 121.20 130.91 2qeq s ILE 583 Ca 0.02 1.54 -0.03 0.00 0.00 0.00 0.00 60.65 62.18 2qeq s ILE 583 Cb -0.15 -4.10 0.05 0.00 0.01 0.00 0.00 42.46 38.28 2qeq s ILE 583 CO -0.07 0.03 0.33 0.35 0.00 0.00 0.00 174.94 175.59 2qeq n THR 584 N 4.77 0.00 -1.67 2.92 -2.24 -1.25 -4.81 114.28 112.00 2qeq n THR 584 Ca 0.03 -0.32 -0.18 0.00 -2.27 0.00 0.00 64.05 61.31 2qeq n THR 584 Cb 0.49 -1.66 -0.06 0.00 -2.10 0.00 0.00 70.33 66.99 2qeq n THR 584 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2qeq s LYS 585 N -3.56 1.85 -0.63 -0.78 -0.14 -1.26 -3.18 119.74 112.04 2qeq s LYS 585 Ca 0.20 0.41 0.00 0.00 -1.36 0.00 0.00 55.97 55.22 2qeq s LYS 585 Cb -0.01 -4.81 0.00 0.00 -1.68 0.00 0.00 37.83 31.33 2qeq s LYS 585 CO 0.14 -4.11 0.00 1.28 -0.76 0.00 0.00 175.35 171.89 2qeq n LEU 586 N 17.41 -0.51 0.00 3.17 4.77 -1.26 -4.91 117.00 135.67 2qeq n LEU 586 Ca 0.44 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.64 2qeq n LEU 586 Cb 0.45 -1.35 0.00 0.00 -2.33 0.00 0.00 43.42 40.19 2qeq n LEU 586 CO 0.57 -0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2qeq n GLY 587 N -0.31 0.88 1.62 -0.72 0.00 -1.19 -5.13 105.19 100.34 2qeq n GLY 587 Ca -0.07 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.44 2qeq n GLY 587 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qeq n GLU 588 N 0.00 0.94 -3.51 1.61 1.02 -1.26 -4.78 120.64 114.65 2qeq n GLU 588 Ca 0.00 -1.35 -0.42 0.00 -0.02 0.00 0.00 57.16 55.37 2qeq n GLU 588 Cb 0.00 -0.02 -0.06 0.00 -0.02 0.00 0.00 31.44 31.34 2qeq n GLU 588 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2qeq s ARG 589 N -3.05 2.96 -0.13 3.49 3.00 -1.26 -3.86 118.95 120.10 2qeq s ARG 589 Ca 0.21 -2.29 0.02 0.00 -1.00 0.00 0.00 55.73 52.67 2qeq s ARG 589 Cb -0.02 -4.07 0.00 0.00 0.00 0.00 0.00 34.95 30.87 2qeq s ARG 589 CO 0.14 -1.23 -0.19 0.15 0.00 0.00 0.00 175.30 174.16 2qeq s LYS 590 N 0.42 3.13 0.39 5.12 -0.14 -1.26 -5.04 119.74 122.36 2qeq s LYS 590 Ca 0.14 -0.81 -0.26 0.00 -1.36 0.00 0.00 55.97 53.68 2qeq s LYS 590 Cb -0.18 -2.47 -0.09 0.00 -1.68 0.00 0.00 37.83 33.41 2qeq s LYS 590 CO -0.05 0.08 1.19 0.96 -0.76 0.00 0.00 175.35 176.78 2qeq s ILE 591 N 0.61 3.08 -0.21 2.17 -0.00 -1.26 -3.77 121.20 121.82 2qeq s ILE 591 Ca -0.11 0.94 -0.29 0.00 -0.00 0.00 0.00 60.65 61.19 2qeq s ILE 591 Cb -0.16 -3.54 -0.02 0.00 -0.00 0.00 0.00 42.46 38.74 2qeq s ILE 591 CO 0.03 0.11 1.51 -0.22 -0.00 0.00 0.00 174.94 176.37 2qeq s LEU 592 N -2.38 3.98 -0.45 0.37 2.96 -1.20 -4.73 118.68 117.23 2qeq s LEU 592 Ca 0.56 1.63 0.05 0.00 -0.22 0.00 0.00 54.13 56.15 2qeq s LEU 592 Cb -0.32 -3.53 0.18 0.00 0.50 0.00 0.00 46.19 43.01 2qeq s LEU 592 CO 0.41 -1.12 0.49 -0.60 -1.32 0.00 0.00 176.35 174.21 2qeq s ARG 593 N 4.35 0.95 0.59 1.98 3.52 0.78 -2.98 118.95 128.13 2qeq s ARG 593 Ca 0.67 -1.64 -0.17 0.00 -0.13 0.00 0.00 55.73 54.46 2qeq s ARG 593 Cb -0.24 -0.86 -0.04 0.00 -1.56 0.00 0.00 34.95 32.26 2qeq s ARG 593 CO 0.26 -1.35 1.09 -2.14 -0.81 0.00 0.00 175.30 172.35 2qeq s PRO 594 N 0.46 3.20 0.50 5.12 0.02 -1.18 -1.67 135.00 141.45 2qeq s PRO 594 Ca 0.31 1.40 0.32 0.00 0.02 0.00 0.00 61.00 63.05 2qeq s PRO 594 Cb 0.01 -2.00 1.33 0.00 0.02 0.00 0.00 34.50 33.86 2qeq s PRO 594 CO -0.13 -0.93 1.95 -0.09 -0.33 0.00 0.00 177.00 177.46 2qeq h ARG 595 N 0.64 0.00 -4.10 5.54 2.43 -0.77 -3.40 114.38 114.72 2qeq h ARG 595 Ca -0.48 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 58.33 2qeq h ARG 595 Cb 1.24 0.00 -0.32 0.00 -0.42 0.00 0.00 29.97 30.48 2qeq h ARG 595 CO 0.56 0.00 -0.76 -1.58 -1.51 0.00 0.00 179.97 176.68 2qeq s TRP 596 N -3.62 0.55 -0.24 2.20 0.52 -1.26 -4.95 118.94 112.14 2qeq s TRP 596 Ca 0.01 -0.12 -0.08 0.00 0.02 0.00 0.00 56.10 55.94 2qeq s TRP 596 Cb 0.09 -0.47 -0.04 0.00 -1.15 0.00 0.00 33.47 31.91 2qeq s TRP 596 CO 0.51 -0.10 0.09 0.42 0.02 0.00 0.00 176.95 177.90 2qeq s ILE 597 N 0.48 4.64 -0.23 2.03 1.01 -1.26 -5.06 121.20 122.81 2qeq s ILE 597 Ca -0.06 -0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.51 2qeq s ILE 597 Cb -0.09 -3.16 0.07 0.00 0.01 0.00 0.00 42.46 39.29 2qeq s ILE 597 CO -0.00 0.35 0.03 -0.62 0.00 0.00 0.00 174.94 174.70 2qeq s ASP 598 N 1.34 3.33 0.00 3.58 -1.08 -1.26 -2.20 116.67 120.38 2qeq s ASP 598 Ca 0.06 -1.07 0.00 0.00 -0.52 0.00 0.00 52.55 51.02 2qeq s ASP 598 Cb -0.15 -0.75 0.02 0.00 -1.46 0.00 0.00 42.92 40.58 2qeq s ASP 598 CO 0.05 -0.32 0.86 0.00 0.52 0.00 0.00 175.17 176.28 2qeq n ALA 599 N 4.94 1.17 0.12 3.66 0.00 0.45 -2.11 120.51 128.74 2qeq n ALA 599 Ca -0.08 -0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.34 2qeq n ALA 599 Cb 0.45 -1.01 0.13 0.00 0.00 0.00 0.00 19.45 19.03 2qeq n ALA 599 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qeq h ARG 600 N 0.00 0.03 -0.01 0.00 -0.00 -1.95 -2.91 114.38 109.54 2qeq h ARG 600 Ca 0.00 -0.02 0.00 0.00 -0.50 0.00 0.00 59.98 59.46 2qeq h ARG 600 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.98 2qeq h ARG 600 CO 0.00 0.68 -0.22 1.33 0.00 0.00 0.00 179.97 181.76 2qeq n VAL 601 N -3.76 0.00 0.00 2.04 0.24 -0.90 -3.93 118.33 112.03 2qeq n VAL 601 Ca -0.01 -0.16 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 2qeq n VAL 601 Cb 0.65 0.45 0.00 0.00 -1.47 0.00 0.00 33.84 33.47 2qeq n VAL 601 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qeq n TYR 602 N -0.48 0.00 0.29 6.34 0.18 -1.25 -3.20 117.16 119.04 2qeq n TYR 602 Ca 0.13 0.00 0.14 0.00 1.88 0.00 0.00 57.90 60.05 2qeq n TYR 602 Cb 0.36 0.00 0.85 0.00 -0.38 0.00 0.00 39.34 40.17 2qeq n TYR 602 CO 0.00 0.00 0.00 0.77 -2.08 0.00 0.00 176.86 175.55 2qeq h SER 603 N 0.00 0.00 -3.81 9.48 0.02 -1.63 -3.39 113.55 114.22 2qeq h SER 603 Ca 0.00 0.00 -0.69 0.00 -0.84 0.00 0.00 61.79 60.26 2qeq h SER 603 Cb 0.01 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 62.33 2qeq h SER 603 CO 0.00 0.04 -0.73 -0.62 -1.14 0.00 0.00 176.83 174.38 2qeq s ASP 604 N -6.15 4.34 0.28 3.07 3.68 -1.26 -5.02 116.67 115.61 2qeq s ASP 604 Ca -0.04 -0.11 -0.01 0.00 2.13 0.00 0.00 52.55 54.51 2qeq s ASP 604 Cb 0.14 -1.05 0.40 0.00 -1.45 0.00 0.00 42.92 40.97 2qeq s ASP 604 CO 0.56 0.34 1.83 0.45 0.13 0.00 0.00 175.17 178.48 2qeq h HIS 605 N 5.38 0.85 -0.19 -5.34 3.86 -1.99 0.91 115.15 118.63 2qeq h HIS 605 Ca -0.46 -0.08 -0.15 0.00 -1.16 0.00 0.00 60.37 58.52 2qeq h HIS 605 Cb 1.17 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.38 2qeq h HIS 605 CO 0.53 0.71 -0.51 1.96 0.86 0.00 0.00 177.93 181.48 2qeq h GLN 606 N 0.79 0.52 -0.61 2.45 4.20 -1.95 -3.30 115.11 117.22 2qeq h GLN 606 Ca 0.17 -0.31 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 2qeq h GLN 606 Cb 0.30 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.08 2qeq h GLN 606 CO -0.00 0.91 0.29 0.00 -0.67 0.00 0.00 178.83 179.36 2qeq h ALA 607 N 1.03 1.37 -0.30 3.87 0.00 -1.13 -3.08 119.26 121.03 2qeq h ALA 607 Ca 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2qeq h ALA 607 Cb 1.04 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2qeq h ALA 607 CO 0.10 0.49 0.13 1.25 0.00 0.00 0.00 179.25 181.21 2qeq h LEU 608 N 0.85 0.41 -0.71 0.00 5.85 -1.42 -2.54 115.31 117.75 2qeq h LEU 608 Ca 0.21 -0.16 0.14 0.00 0.84 0.00 0.00 57.88 58.92 2qeq h LEU 608 Cb 0.09 -0.11 -0.10 0.00 0.37 0.00 0.00 40.66 40.91 2qeq h LEU 608 CO -0.03 0.45 0.20 0.11 -0.34 0.00 0.00 178.44 178.83 2qeq h LYS 609 N 0.34 0.30 -0.01 1.25 1.57 -1.67 0.18 116.57 118.53 2qeq h LYS 609 Ca 0.10 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.73 2qeq h LYS 609 Cb 0.17 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 2qeq h LYS 609 CO -0.01 0.20 -0.60 0.66 -0.57 0.00 0.00 179.45 179.13 2qeq h SER 610 N 0.31 0.04 -0.05 0.86 4.64 -1.56 0.64 113.55 118.43 2qeq h SER 610 Ca 0.39 -0.02 -0.17 0.00 -0.47 0.00 0.00 61.79 61.52 2qeq h SER 610 Cb 0.64 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.71 2qeq h SER 610 CO -0.46 0.63 -0.55 0.15 -0.87 0.00 0.00 176.83 175.73 2qeq h PHE 611 N 0.03 0.81 0.02 4.77 3.57 -0.93 0.89 116.94 126.09 2qeq h PHE 611 Ca -0.01 -0.29 -0.00 0.00 3.53 0.00 0.00 57.97 61.21 2qeq h PHE 611 Cb 1.06 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.65 2qeq h PHE 611 CO 0.00 1.05 -0.01 0.87 -2.23 0.00 0.00 178.31 177.99 2qeq h LYS 612 N 0.49 -0.02 0.00 1.11 1.57 -0.13 -1.03 116.57 118.56 2qeq h LYS 612 Ca 0.01 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2qeq h LYS 612 Cb 1.12 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.43 2qeq h LYS 612 CO 0.11 0.08 -0.02 -0.44 -0.57 0.00 0.00 179.45 178.61 2qeq h ASP 613 N -0.11 0.00 0.17 0.86 3.32 0.35 -1.53 116.42 119.48 2qeq h ASP 613 Ca -0.00 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.82 2qeq h ASP 613 Cb 0.10 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.68 2qeq h ASP 613 CO 0.00 0.02 -0.99 0.15 -1.72 0.00 0.00 179.24 176.70 2qeq h PHE 614 N 0.00 0.67 0.00 4.55 3.57 -0.36 -2.96 116.94 122.41 2qeq h PHE 614 Ca -0.00 -0.49 -0.01 0.00 3.53 0.00 0.00 57.97 61.01 2qeq h PHE 614 Cb 0.08 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 38.79 2qeq h PHE 614 CO 0.00 1.38 -0.02 0.00 -2.23 0.00 0.00 178.31 177.43 2qeq h ALA 615 N 0.11 1.00 0.05 2.41 0.00 -0.87 -3.26 119.26 118.71 2qeq h ALA 615 Ca -0.17 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 2qeq h ALA 615 Cb 1.78 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2qeq h ALA 615 CO 0.19 0.03 -0.02 1.03 0.00 0.00 0.00 179.25 180.47 2qeq h SER 616 N 0.00 -0.06 0.00 0.00 0.87 -1.37 -3.47 113.55 109.53 2qeq h SER 616 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2qeq h SER 616 Cb 0.61 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 2qeq h SER 616 CO 0.00 0.03 0.00 0.61 -0.53 0.00 0.00 176.83 176.94