#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mae s PRO 178 N 0.00 3.11 0.29 -0.78 0.02 -1.26 -5.03 135.00 131.35 3mae s PRO 178 Ca 0.00 0.65 -0.29 0.00 0.02 0.00 0.00 61.00 61.37 3mae s PRO 178 Cb 0.00 -2.03 -0.10 0.00 0.02 0.00 0.00 34.50 32.38 3mae s PRO 178 CO 0.00 -0.90 1.42 -1.25 -0.33 0.00 0.00 177.00 175.94 3mae s PRO 179 N -5.23 4.27 0.00 5.54 0.04 -1.26 -4.93 135.00 133.42 3mae s PRO 179 Ca 0.57 2.32 0.16 0.00 0.04 0.00 0.00 61.00 64.09 3mae s PRO 179 Cb -0.12 -3.08 -0.12 0.00 0.04 0.00 0.00 34.50 31.22 3mae s PRO 179 CO 0.53 -0.38 0.75 1.33 0.04 0.00 0.00 177.00 179.28 3mae n VAL 180 N 1.73 0.00 -4.57 -0.36 0.24 -1.26 -4.97 118.33 109.14 3mae n VAL 180 Ca 0.04 -0.18 -0.28 0.00 -2.04 0.00 0.00 64.34 61.88 3mae n VAL 180 Cb 0.40 1.07 -0.14 0.00 -1.47 0.00 0.00 33.84 33.70 3mae n VAL 180 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3mae s ARG 181 N -2.36 1.49 0.00 7.34 0.52 -1.26 -5.03 118.95 119.66 3mae s ARG 181 Ca 0.09 -1.20 0.00 0.00 -0.52 0.00 0.00 55.73 54.09 3mae s ARG 181 Cb 0.13 -1.82 0.00 0.00 0.52 0.00 0.00 34.95 33.78 3mae s ARG 181 CO 0.59 0.45 0.42 -1.13 0.02 0.00 0.00 175.30 175.65 3mae n SER 182 N 1.32 0.63 -3.52 0.23 3.41 -1.26 -5.07 113.62 109.36 3mae n SER 182 Ca -0.18 -1.18 -0.16 0.00 -0.26 0.00 0.00 58.87 57.10 3mae n SER 182 Cb 0.53 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.43 3mae n SER 182 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3mae s ALA 183 N -0.18 -1.64 0.40 7.33 0.00 -1.26 -5.03 121.76 121.38 3mae s ALA 183 Ca 0.00 1.02 0.08 0.00 0.00 0.00 0.00 51.96 53.06 3mae s ALA 183 Cb 0.00 0.24 0.85 0.00 0.00 0.00 0.00 23.12 24.21 3mae s ALA 183 CO 0.00 -0.47 2.00 0.00 0.00 0.00 0.00 175.76 177.29 3mae h ALA 184 N 2.80 1.78 -0.22 0.00 0.00 -2.05 -2.62 119.26 118.95 3mae h ALA 184 Ca -0.29 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3mae h ALA 184 Cb 1.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.82 3mae h ALA 184 CO 0.39 0.13 0.00 0.41 0.00 0.00 0.00 179.25 180.18 3mae n GLY 185 N -1.48 0.94 3.75 0.00 0.00 -1.26 -4.89 105.19 102.25 3mae n GLY 185 Ca 0.08 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 3mae n GLY 185 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3mae s ASP 186 N -0.68 6.76 -0.17 1.61 1.11 -0.99 -5.00 116.67 119.32 3mae s ASP 186 Ca 0.17 2.60 -0.15 0.00 0.18 0.00 0.00 52.55 55.35 3mae s ASP 186 Cb 0.11 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.43 3mae s ASP 186 CO 0.09 -0.60 0.34 -0.75 1.18 0.00 0.00 175.17 175.42 3mae s LYS 187 N -0.74 4.25 -0.26 8.23 2.20 -1.26 -5.05 119.74 127.11 3mae s LYS 187 Ca 0.55 0.16 -0.11 0.00 -0.36 0.00 0.00 55.97 56.21 3mae s LYS 187 Cb -0.40 -3.45 -0.05 0.00 -1.51 0.00 0.00 37.83 32.42 3mae s LYS 187 CO 0.45 0.16 0.18 -1.21 -0.36 0.00 0.00 175.35 174.57 3mae s GLU 188 N 0.69 4.01 -0.28 4.03 2.02 -1.26 -5.07 118.70 122.84 3mae s GLU 188 Ca 0.18 -0.28 -0.04 0.00 0.02 0.00 0.00 54.97 54.85 3mae s GLU 188 Cb -0.14 -3.60 0.02 0.00 0.10 0.00 0.00 34.13 30.51 3mae s GLU 188 CO 0.06 -0.07 0.02 0.42 0.02 0.00 0.00 175.26 175.71 3mae s ILE 189 N 1.43 3.42 0.46 -1.63 1.01 -1.26 -5.10 121.20 119.54 3mae s ILE 189 Ca 0.08 -0.90 -0.23 0.00 0.00 0.00 0.00 60.65 59.60 3mae s ILE 189 Cb -0.15 -2.78 -0.07 0.00 0.01 0.00 0.00 42.46 39.47 3mae s ILE 189 CO 0.08 0.11 1.18 -2.16 0.00 0.00 0.00 174.94 174.14 3mae s PRO 190 N 1.40 3.73 -0.29 2.79 0.04 -1.26 -5.01 135.00 136.39 3mae s PRO 190 Ca 0.01 1.81 -0.09 0.00 0.04 0.00 0.00 61.00 62.76 3mae s PRO 190 Cb -0.17 -2.40 -0.01 0.00 0.04 0.00 0.00 34.50 31.95 3mae s PRO 190 CO -0.01 -0.59 0.13 0.42 0.04 0.00 0.00 177.00 177.00 3mae s ILE 191 N -1.53 4.54 0.75 0.56 1.01 -1.26 -5.09 121.20 120.19 3mae s ILE 191 Ca 0.64 -0.34 -0.12 0.00 0.00 0.00 0.00 60.65 60.82 3mae s ILE 191 Cb -0.29 -3.27 0.05 0.00 0.01 0.00 0.00 42.46 38.96 3mae s ILE 191 CO 0.36 0.14 1.12 0.54 0.00 0.00 0.00 174.94 177.09 3mae s ASN 192 N 1.62 4.41 0.42 3.58 2.20 -1.26 -4.78 114.94 121.13 3mae s ASN 192 Ca 0.05 1.99 0.17 0.00 -0.94 0.00 0.00 52.86 54.13 3mae s ASN 192 Cb -0.17 -2.54 1.07 0.00 -2.00 0.00 0.00 41.25 37.61 3mae s ASN 192 CO 0.06 -2.10 1.87 1.23 -2.94 0.00 0.00 177.10 175.22 3mae h GLY 193 N -0.79 0.82 0.65 0.45 0.00 -1.98 -0.93 103.07 101.28 3mae h GLY 193 Ca -0.45 -0.18 -0.01 0.00 0.00 0.00 0.00 47.33 46.69 3mae h GLY 193 CO 0.50 0.02 -0.10 -2.08 0.00 0.00 0.00 176.54 174.88 3mae h VAL 194 N 0.41 0.88 -0.23 4.60 2.07 -1.99 -1.01 116.25 120.97 3mae h VAL 194 Ca 0.44 -0.68 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 3mae h VAL 194 Cb 1.08 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 3mae h VAL 194 CO -0.16 0.15 -0.17 -0.09 0.02 0.00 0.00 177.57 177.32 3mae h ARG 195 N -0.63 0.40 -0.04 1.57 2.43 -1.89 -2.29 114.38 113.92 3mae h ARG 195 Ca -0.03 -0.12 -0.08 0.00 -0.81 0.00 0.00 59.98 58.94 3mae h ARG 195 Cb 0.46 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 3mae h ARG 195 CO 0.05 0.56 -0.35 -0.22 -1.51 0.00 0.00 179.97 178.50 3mae h LYS 196 N 0.37 0.09 -0.05 0.20 3.64 -1.16 -1.65 116.57 118.01 3mae h LYS 196 Ca 0.07 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.35 3mae h LYS 196 Cb 0.51 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3mae h LYS 196 CO 0.03 0.43 -0.21 0.00 -2.27 0.00 0.00 179.45 177.43 3mae h ALA 197 N 1.58 0.09 -0.50 5.00 0.00 -0.76 -2.05 119.26 122.61 3mae h ALA 197 Ca 0.01 -0.40 0.08 0.00 0.00 0.00 0.00 54.91 54.60 3mae h ALA 197 Cb 0.65 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.37 3mae h ALA 197 CO 0.05 0.06 0.14 0.82 0.00 0.00 0.00 179.25 180.32 3mae h ILE 198 N -0.32 0.77 -0.48 0.00 1.08 -1.38 -0.16 117.51 117.03 3mae h ILE 198 Ca -0.01 -0.10 -0.06 0.00 -0.39 0.00 0.00 64.86 64.30 3mae h ILE 198 Cb 0.85 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 35.03 3mae h ILE 198 CO 0.04 0.05 0.06 0.00 -0.69 0.00 0.00 178.15 177.62 3mae h ALA 199 N 1.37 1.20 -0.06 1.87 0.00 -1.33 -1.29 119.26 121.03 3mae h ALA 199 Ca 0.25 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.78 3mae h ALA 199 Cb 0.31 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3mae h ALA 199 CO -0.29 0.53 -0.66 -0.22 0.00 0.00 0.00 179.25 178.61 3mae h LYS 200 N 0.72 0.24 -0.34 0.00 1.63 -0.96 -2.69 116.57 115.17 3mae h LYS 200 Ca 0.15 -0.18 -0.04 0.00 -0.85 0.00 0.00 60.65 59.73 3mae h LYS 200 Cb 0.35 0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 32.00 3mae h LYS 200 CO 0.01 0.81 0.05 1.25 -3.45 0.00 0.00 179.45 178.12 3mae h HIS 201 N 0.17 0.60 -0.73 1.91 2.76 -0.59 -1.29 115.15 117.99 3mae h HIS 201 Ca -0.01 -0.08 0.02 0.00 -2.20 0.00 0.00 60.37 58.09 3mae h HIS 201 Cb 1.19 -0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.94 3mae h HIS 201 CO 0.02 0.63 0.47 0.52 -1.30 0.00 0.00 177.93 178.27 3mae h MET 202 N 0.40 0.90 -0.41 5.26 2.86 -1.20 -1.05 114.93 121.68 3mae h MET 202 Ca 0.10 -0.05 -0.07 0.00 -2.06 0.00 0.00 59.70 57.62 3mae h MET 202 Cb 0.36 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3mae h MET 202 CO 0.01 0.59 -0.02 0.77 1.06 0.00 0.00 176.91 179.32 3mae h SER 203 N 0.93 0.73 -0.24 1.22 0.02 -1.41 -2.34 113.55 112.45 3mae h SER 203 Ca 0.28 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.91 3mae h SER 203 Cb -0.03 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 3mae h SER 203 CO -0.09 0.87 0.13 0.58 -1.14 0.00 0.00 176.83 177.19 3mae h VAL 204 N 0.57 1.11 -0.35 2.27 2.07 -1.03 -1.83 116.25 119.06 3mae h VAL 204 Ca 0.11 -0.29 0.05 0.00 0.82 0.00 0.00 66.70 67.40 3mae h VAL 204 Cb 0.51 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.10 3mae h VAL 204 CO 0.02 0.11 0.05 0.28 0.02 0.00 0.00 177.57 178.05 3mae h SER 205 N 0.28 -0.03 -0.12 0.57 0.02 -1.17 -0.33 113.55 112.77 3mae h SER 205 Ca 0.08 0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 60.99 3mae h SER 205 Cb 0.05 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 3mae h SER 205 CO -0.01 0.02 -0.26 0.11 -1.14 0.00 0.00 176.83 175.55 3mae h LYS 206 N 0.16 0.58 -0.26 3.45 1.79 -1.32 -1.09 116.57 119.87 3mae h LYS 206 Ca 0.17 -0.23 -0.17 0.00 -2.18 0.00 0.00 60.65 58.24 3mae h LYS 206 Cb 0.20 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 3mae h LYS 206 CO -0.24 0.78 -0.49 1.96 -1.08 0.00 0.00 179.45 180.39 3mae h GLN 207 N 0.51 0.79 0.05 3.15 4.20 -1.02 -3.34 115.11 119.44 3mae h GLN 207 Ca 0.07 -0.50 -0.24 0.00 0.06 0.00 0.00 58.65 58.04 3mae h GLN 207 Cb 0.71 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.53 3mae h GLN 207 CO 0.05 1.13 -1.16 1.49 -0.67 0.00 0.00 178.83 179.67 3mae h GLU 208 N 0.54 0.10 -5.09 1.46 4.57 -1.00 -3.45 114.58 111.71 3mae h GLU 208 Ca 0.01 -0.18 -0.65 0.00 -1.18 0.00 0.00 59.36 57.36 3mae h GLU 208 Cb 1.09 0.07 -0.27 0.00 -0.16 0.00 0.00 28.75 29.49 3mae h GLU 208 CO 0.11 1.05 -0.72 0.42 -1.18 0.00 0.00 179.01 178.69 3mae s ILE 209 N -2.68 3.42 -0.66 2.32 1.01 -0.42 -5.07 121.20 119.13 3mae s ILE 209 Ca -0.02 -0.49 -0.27 0.00 0.00 0.00 0.00 60.65 59.87 3mae s ILE 209 Cb 0.09 -2.53 0.02 0.00 0.01 0.00 0.00 42.46 40.05 3mae s ILE 209 CO 0.84 0.45 1.32 -2.16 0.00 0.00 0.00 174.94 175.39 3mae s PRO 210 N 1.13 3.25 0.20 2.79 0.04 -1.26 -4.69 135.00 136.46 3mae s PRO 210 Ca 0.02 0.06 -0.30 0.00 0.04 0.00 0.00 61.00 60.82 3mae s PRO 210 Cb -0.15 -4.14 -0.08 0.00 0.04 0.00 0.00 34.50 30.17 3mae s PRO 210 CO -0.01 -2.04 1.07 -1.01 0.04 0.00 0.00 177.00 175.05 3mae s HIS 211 N 5.84 3.66 0.22 0.56 3.76 -1.26 -2.10 115.29 125.96 3mae s HIS 211 Ca 0.42 1.68 0.04 0.00 -0.15 0.00 0.00 55.06 57.05 3mae s HIS 211 Cb -0.09 -3.22 -0.05 0.00 1.11 0.00 0.00 32.58 30.33 3mae s HIS 211 CO 0.20 -0.39 -0.03 0.00 -0.85 0.00 0.00 174.74 173.67 3mae s ALA 212 N -0.54 1.77 0.00 -1.40 0.00 -0.85 -4.94 121.76 115.80 3mae s ALA 212 Ca 0.47 -1.72 -0.00 0.00 0.00 0.00 0.00 51.96 50.71 3mae s ALA 212 Cb -0.29 0.39 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 3mae s ALA 212 CO 0.35 -0.21 -0.00 -0.46 0.00 0.00 0.00 175.76 175.44 3mae s TRP 213 N -3.38 0.02 0.02 0.00 -0.00 -1.26 -0.60 118.94 113.75 3mae s TRP 213 Ca 0.26 -0.05 0.00 0.00 -0.00 0.00 0.00 56.10 56.32 3mae s TRP 213 Cb 0.05 -0.02 -0.02 0.00 -0.00 0.00 0.00 33.47 33.48 3mae s TRP 213 CO 0.07 -0.02 -0.04 -1.64 -0.00 0.00 0.00 176.95 175.33 3mae s MET 214 N -0.13 0.34 -0.06 5.86 -1.94 0.00 -5.00 119.30 118.36 3mae s MET 214 Ca -0.01 -0.63 -0.04 0.00 -1.71 0.00 0.00 55.69 53.29 3mae s MET 214 Cb -0.01 0.05 0.03 0.00 2.01 0.00 0.00 34.83 36.90 3mae s MET 214 CO -0.00 -0.03 0.15 1.41 -0.01 0.00 0.00 175.02 176.54 3mae s MET 215 N -1.47 0.15 0.10 2.03 1.75 -1.26 -0.29 119.30 120.31 3mae s MET 215 Ca -0.15 0.29 0.08 0.00 -1.25 0.00 0.00 55.69 54.66 3mae s MET 215 Cb -0.10 -0.03 -0.03 0.00 2.84 0.00 0.00 34.83 37.51 3mae s MET 215 CO -0.01 -0.08 -0.20 0.14 -0.65 0.00 0.00 175.02 174.21 3mae s VAL 216 N 0.56 1.68 0.03 10.11 -7.23 -0.91 -4.99 120.40 119.66 3mae s VAL 216 Ca -0.04 -1.54 -0.19 0.00 -1.81 0.00 0.00 61.98 58.40 3mae s VAL 216 Cb -0.06 -1.54 -0.06 0.00 0.56 0.00 0.00 36.38 35.29 3mae s VAL 216 CO -0.03 -0.08 0.56 -1.61 -0.31 0.00 0.00 175.10 173.64 3mae s GLU 217 N -1.92 4.23 -0.07 4.82 2.02 -1.26 -1.20 118.70 125.32 3mae s GLU 217 Ca 0.06 0.70 0.01 0.00 0.02 0.00 0.00 54.97 55.76 3mae s GLU 217 Cb -0.10 -3.29 0.02 0.00 0.10 0.00 0.00 34.13 30.86 3mae s GLU 217 CO 0.04 0.51 -0.08 0.08 0.02 0.00 0.00 175.26 175.84 3mae s VAL 218 N -0.66 0.83 -0.57 2.63 1.01 0.83 -4.97 120.40 119.50 3mae s VAL 218 Ca 0.29 -0.27 -0.28 0.00 0.00 0.00 0.00 61.98 61.73 3mae s VAL 218 Cb -0.19 -0.82 0.02 0.00 0.00 0.00 0.00 36.38 35.39 3mae s VAL 218 CO 0.17 0.30 1.39 -0.62 0.00 0.00 0.00 175.10 176.34 3mae s ASP 219 N 1.02 6.16 -0.17 3.32 -1.08 -1.26 -0.54 116.67 124.12 3mae s ASP 219 Ca -0.09 0.24 0.16 0.00 -0.52 0.00 0.00 52.55 52.35 3mae s ASP 219 Cb -0.14 -2.55 0.73 0.00 -1.46 0.00 0.00 42.92 39.50 3mae s ASP 219 CO -0.00 -1.70 1.65 0.00 0.52 0.00 0.00 175.17 175.64 3mae n ALA 220 N 9.48 3.39 -0.16 3.66 0.00 0.83 -4.33 120.51 133.38 3mae n ALA 220 Ca 0.12 -1.81 -0.07 0.00 0.00 0.00 0.00 53.44 51.68 3mae n ALA 220 Cb 0.49 -1.01 0.01 0.00 0.00 0.00 0.00 19.45 18.95 3mae n ALA 220 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3mae h THR 221 N 3.75 1.12 -0.62 0.00 2.02 -1.89 0.24 112.91 117.53 3mae h THR 221 Ca 0.00 -0.22 0.03 0.00 0.77 0.00 0.00 66.41 66.99 3mae h THR 221 Cb 1.66 0.43 -0.04 0.00 -1.74 0.00 0.00 68.15 68.45 3mae h THR 221 CO 0.33 0.12 0.38 1.23 0.37 0.00 0.00 175.52 177.96 3mae h GLY 222 N 0.64 0.89 1.02 2.16 0.00 -1.82 -0.74 103.07 105.22 3mae h GLY 222 Ca 0.17 -0.29 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 3mae h GLY 222 CO -0.04 0.25 0.28 -2.00 0.00 0.00 0.00 176.54 175.03 3mae h LEU 223 N 0.76 0.96 -0.09 3.11 6.46 -1.58 -0.50 115.31 124.42 3mae h LEU 223 Ca 0.25 -0.17 -0.01 0.00 -0.12 0.00 0.00 57.88 57.83 3mae h LEU 223 Cb 0.01 -0.25 -0.00 0.00 -0.73 0.00 0.00 40.66 39.69 3mae h LEU 223 CO -0.10 0.87 0.02 0.58 -0.62 0.00 0.00 178.44 179.19 3mae h VAL 224 N 0.99 1.20 -0.38 1.05 2.07 -0.69 -2.22 116.25 118.26 3mae h VAL 224 Ca 0.23 -0.61 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 3mae h VAL 224 Cb 0.21 1.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3mae h VAL 224 CO -0.02 0.17 0.12 0.03 0.02 0.00 0.00 177.57 177.90 3mae h ARG 225 N -0.06 0.60 -0.62 1.57 3.08 -1.05 -1.50 114.38 116.39 3mae h ARG 225 Ca 0.03 -0.13 -0.07 0.00 0.07 0.00 0.00 59.98 59.89 3mae h ARG 225 Cb 0.26 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 3mae h ARG 225 CO 0.00 0.60 0.13 -0.92 -1.07 0.00 0.00 179.97 178.71 3mae h TYR 226 N 0.48 1.07 -0.28 3.04 3.20 -1.14 -1.97 116.97 121.37 3mae h TYR 226 Ca 0.12 -0.14 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 3mae h TYR 226 Cb 0.25 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 3mae h TYR 226 CO 0.01 0.90 0.02 -0.09 -1.64 0.00 0.00 178.16 177.36 3mae h ARG 227 N 0.93 0.49 0.00 1.82 1.12 -1.28 -2.91 114.38 114.55 3mae h ARG 227 Ca 0.19 -0.15 -0.04 0.00 -1.11 0.00 0.00 59.98 58.88 3mae h ARG 227 Cb 0.39 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.30 3mae h ARG 227 CO 0.01 0.63 -0.19 -0.91 -3.11 0.00 0.00 179.97 176.39 3mae h ASN 228 N 0.28 0.00 0.62 -3.80 2.35 -1.23 -0.11 115.58 113.69 3mae h ASN 228 Ca 0.08 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.71 3mae h ASN 228 Cb 0.40 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 3mae h ASN 228 CO 0.01 0.19 -0.60 0.00 -1.65 0.00 0.00 177.43 175.38 3mae h ALA 229 N 1.81 1.00 0.00 -0.83 0.00 -1.23 -3.37 119.26 116.64 3mae h ALA 229 Ca -0.00 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3mae h ALA 229 Cb 0.61 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3mae h ALA 229 CO 0.02 0.75 -0.51 1.33 0.00 0.00 0.00 179.25 180.85 3mae n VAL 230 N -3.81 0.00 0.11 0.00 0.24 -0.96 -4.74 118.33 109.18 3mae n VAL 230 Ca -0.01 -0.29 0.03 0.00 -2.04 0.00 0.00 64.34 62.02 3mae n VAL 230 Cb 0.60 0.92 0.41 0.00 -1.47 0.00 0.00 33.84 34.30 3mae n VAL 230 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 3mae h LYS 231 N 0.00 0.26 0.00 7.34 2.10 -1.19 -2.36 116.57 122.72 3mae h LYS 231 Ca 0.00 -0.05 -0.00 0.00 -2.00 0.00 0.00 60.65 58.60 3mae h LYS 231 Cb 0.22 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 3mae h LYS 231 CO 0.00 0.35 -0.00 -0.44 -2.00 0.00 0.00 179.45 177.36 3mae h ASP 232 N 0.25 -0.00 1.16 7.07 5.19 -1.85 -2.86 116.42 125.38 3mae h ASP 232 Ca 0.05 -0.60 -0.02 0.00 -0.62 0.00 0.00 57.03 55.85 3mae h ASP 232 Cb 0.30 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.81 3mae h ASP 232 CO 0.01 0.60 -0.08 0.77 -3.12 0.00 0.00 179.24 177.42 3mae h SER 233 N -0.60 0.00 -0.12 6.45 4.64 -1.88 -2.98 113.55 119.06 3mae h SER 233 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3mae h SER 233 Cb 0.60 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3mae h SER 233 CO 0.00 0.08 -0.05 0.15 -0.87 0.00 0.00 176.83 176.15 3mae h PHE 234 N 0.00 0.27 -0.22 4.77 3.04 -1.43 -2.35 116.94 121.03 3mae h PHE 234 Ca -0.00 -0.06 -0.09 0.00 3.98 0.00 0.00 57.97 61.80 3mae h PHE 234 Cb 0.69 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 39.12 3mae h PHE 234 CO 0.00 0.57 -0.25 -0.22 -2.02 0.00 0.00 178.31 176.39 3mae h LYS 235 N -0.10 0.41 -0.24 1.11 3.64 -1.46 0.72 116.57 120.65 3mae h LYS 235 Ca 0.03 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 3mae h LYS 235 Cb 0.49 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 3mae h LYS 235 CO 0.02 0.63 0.11 0.87 -2.27 0.00 0.00 179.45 178.81 3mae h LYS 236 N 0.36 0.34 0.07 1.90 6.56 -1.54 -2.12 116.57 122.14 3mae h LYS 236 Ca 0.06 -0.05 -0.11 0.00 -1.06 0.00 0.00 60.65 59.49 3mae h LYS 236 Cb 0.63 -0.06 0.01 0.00 -0.57 0.00 0.00 32.23 32.24 3mae h LYS 236 CO 0.05 0.35 -0.46 1.49 -2.06 0.00 0.00 179.45 178.81 3mae h GLU 237 N 0.25 0.19 0.00 3.15 4.81 -1.19 -3.39 114.58 118.40 3mae h GLU 237 Ca 0.08 -0.30 -0.26 0.00 -0.13 0.00 0.00 59.36 58.76 3mae h GLU 237 Cb 0.12 0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 3mae h GLU 237 CO -0.01 1.12 -1.58 0.93 -0.73 0.00 0.00 179.01 178.74 3mae h GLU 238 N -0.59 0.00 0.00 1.92 4.39 -0.99 -3.48 114.58 115.83 3mae h GLU 238 Ca -0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.62 3mae h GLU 238 Cb 1.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.99 3mae h GLU 238 CO 0.09 0.48 0.00 0.41 -1.16 0.00 0.00 179.01 178.82 3mae n GLY 239 N 1.50 0.93 3.19 -3.84 0.00 -0.80 -5.04 105.19 101.14 3mae n GLY 239 Ca -0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.70 3mae n GLY 239 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mae s TYR 240 N -2.44 1.28 0.40 1.61 1.13 -1.26 -5.02 117.35 113.05 3mae s TYR 240 Ca 0.00 -0.49 -0.19 0.00 -1.41 0.00 0.00 57.07 54.98 3mae s TYR 240 Cb 0.00 -0.71 -0.10 0.00 -1.10 0.00 0.00 41.96 40.05 3mae s TYR 240 CO 0.00 0.08 0.89 -1.54 -2.51 0.00 0.00 175.55 172.47 3mae s SER 241 N -1.94 6.90 -0.29 -0.18 1.04 -1.26 -4.05 113.70 113.92 3mae s SER 241 Ca 0.01 1.58 -0.12 0.00 0.48 0.00 0.00 55.95 57.90 3mae s SER 241 Cb -0.09 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 3mae s SER 241 CO 0.02 -0.31 0.25 -0.22 0.98 0.00 0.00 173.24 173.97 3mae s LEU 242 N -3.10 4.13 0.42 2.42 2.96 -1.26 -4.89 118.68 119.37 3mae s LEU 242 Ca 0.60 -0.02 0.08 0.00 -0.22 0.00 0.00 54.13 54.56 3mae s LEU 242 Cb -0.10 -2.21 0.01 0.00 0.50 0.00 0.00 46.19 44.40 3mae s LEU 242 CO 0.14 -0.13 0.58 0.42 -1.32 0.00 0.00 176.35 176.04 3mae s THR 243 N 1.85 3.02 0.39 3.68 -4.23 -1.26 -4.92 115.64 114.16 3mae s THR 243 Ca 0.09 -0.98 0.06 0.00 -1.18 0.00 0.00 61.69 59.68 3mae s THR 243 Cb -0.16 -3.01 0.24 0.00 1.34 0.00 0.00 72.50 70.90 3mae s THR 243 CO 0.11 -0.00 2.01 1.88 -0.54 0.00 0.00 174.62 178.07 3mae h TYR 244 N 0.62 0.54 -0.83 3.99 0.05 -1.98 -3.21 116.97 116.14 3mae h TYR 244 Ca -0.40 -0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.42 3mae h TYR 244 Cb 1.28 -0.18 -0.05 0.00 1.01 0.00 0.00 36.73 38.79 3mae h TYR 244 CO 0.40 0.39 0.55 0.35 -1.05 0.00 0.00 178.16 178.80 3mae h PHE 245 N 0.56 0.97 -0.97 4.88 -0.00 -2.00 -2.49 116.94 117.88 3mae h PHE 245 Ca 0.14 0.02 0.08 0.00 -0.00 0.00 0.00 57.97 58.21 3mae h PHE 245 Cb 0.04 -0.32 -0.07 0.00 -0.00 0.00 0.00 35.95 35.60 3mae h PHE 245 CO 0.00 0.54 0.62 0.00 -0.00 0.00 0.00 178.31 179.47 3mae h ALA 246 N 1.53 1.37 -0.53 2.41 0.00 -1.92 -1.10 119.26 121.01 3mae h ALA 246 Ca 0.34 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 3mae h ALA 246 Cb 0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3mae h ALA 246 CO -0.11 0.37 0.13 0.74 0.00 0.00 0.00 179.25 180.38 3mae h PHE 247 N 1.10 0.89 -0.49 0.00 0.04 -1.64 -2.52 116.94 114.32 3mae h PHE 247 Ca 0.43 -0.10 -0.03 0.00 2.80 0.00 0.00 57.97 61.06 3mae h PHE 247 Cb 0.23 -0.25 -0.02 0.00 2.20 0.00 0.00 35.95 38.11 3mae h PHE 247 CO -0.01 0.77 0.17 0.74 -0.60 0.00 0.00 178.31 179.39 3mae h PHE 248 N 0.74 0.77 -0.58 -0.55 -1.00 -1.32 -0.50 116.94 114.51 3mae h PHE 248 Ca 0.17 -0.07 0.05 0.00 2.81 0.00 0.00 57.97 60.93 3mae h PHE 248 Cb 0.33 -0.23 -0.05 0.00 3.61 0.00 0.00 35.95 39.62 3mae h PHE 248 CO 0.02 0.66 0.31 0.82 -1.61 0.00 0.00 178.31 178.52 3mae h ILE 249 N 0.66 0.97 -0.52 -0.55 1.08 -1.18 0.33 117.51 118.30 3mae h ILE 249 Ca 0.16 -0.20 -0.03 0.00 -0.39 0.00 0.00 64.86 64.40 3mae h ILE 249 Cb 0.24 0.33 -0.02 0.00 -3.07 0.00 0.00 36.82 34.29 3mae h ILE 249 CO -0.01 0.11 0.22 0.50 -0.69 0.00 0.00 178.15 178.28 3mae h LYS 250 N 0.59 0.77 -0.71 2.37 1.63 -1.22 -0.68 116.57 119.33 3mae h LYS 250 Ca 0.25 -0.13 -0.05 0.00 -0.85 0.00 0.00 60.65 59.87 3mae h LYS 250 Cb 0.14 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 3mae h LYS 250 CO -0.16 0.67 0.26 0.00 -3.45 0.00 0.00 179.45 176.77 3mae h ALA 251 N 1.06 1.13 -0.13 5.00 0.00 -0.57 -2.39 119.26 123.35 3mae h ALA 251 Ca 0.17 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3mae h ALA 251 Cb 0.18 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 3mae h ALA 251 CO -0.02 0.62 -0.07 0.28 0.00 0.00 0.00 179.25 180.06 3mae h VAL 252 N 1.03 1.32 -0.71 0.00 2.07 -0.81 -2.86 116.25 116.30 3mae h VAL 252 Ca 0.24 -1.13 0.06 0.00 0.82 0.00 0.00 66.70 66.68 3mae h VAL 252 Cb 0.23 1.80 -0.06 0.00 -1.52 0.00 0.00 31.29 31.74 3mae h VAL 252 CO -0.02 0.33 0.41 0.00 0.02 0.00 0.00 177.57 178.31 3mae h ALA 253 N 0.65 0.95 -0.74 1.67 0.00 -1.02 0.71 119.26 121.48 3mae h ALA 253 Ca 0.03 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3mae h ALA 253 Cb 0.55 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3mae h ALA 253 CO 0.02 0.10 0.23 1.96 0.00 0.00 0.00 179.25 181.57 3mae h GLN 254 N 0.75 1.14 0.00 0.00 1.08 -1.49 -2.41 115.11 114.18 3mae h GLN 254 Ca 0.31 -0.24 -0.10 0.00 -1.45 0.00 0.00 58.65 57.17 3mae h GLN 254 Cb 0.17 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 3mae h GLN 254 CO -0.17 0.97 -0.48 0.00 -0.95 0.00 0.00 178.83 178.19 3mae h ALA 255 N 1.15 1.11 -0.10 3.87 0.00 -1.08 -1.90 119.26 122.31 3mae h ALA 255 Ca 0.24 -0.43 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 3mae h ALA 255 Cb 0.30 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3mae h ALA 255 CO -0.01 0.60 -0.39 -0.07 0.00 0.00 0.00 179.25 179.37 3mae h LEU 256 N 0.00 0.22 -0.82 0.00 3.38 -0.65 0.71 115.31 118.15 3mae h LEU 256 Ca -0.00 -0.09 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 3mae h LEU 256 Cb 0.90 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3mae h LEU 256 CO 0.06 0.59 -0.44 0.50 0.09 0.00 0.00 178.44 179.24 3mae h LYS 257 N 0.18 0.33 -0.29 1.13 3.64 -0.94 -2.72 116.57 117.91 3mae h LYS 257 Ca 0.02 -0.17 -0.19 0.00 -1.27 0.00 0.00 60.65 59.04 3mae h LYS 257 Cb 0.78 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3mae h LYS 257 CO 0.06 0.71 -0.55 0.93 -2.27 0.00 0.00 179.45 178.33 3mae h GLU 258 N 0.27 0.88 -2.90 1.90 5.08 -1.05 -3.40 114.58 115.37 3mae h GLU 258 Ca 0.02 -0.56 -0.61 0.00 -1.00 0.00 0.00 59.36 57.20 3mae h GLU 258 Cb 0.89 0.07 -0.41 0.00 0.50 0.00 0.00 28.75 29.80 3mae h GLU 258 CO 0.07 1.20 -0.69 -0.06 -1.00 0.00 0.00 179.01 178.54 3mae s PHE 259 N -4.12 2.84 -0.12 4.33 0.08 0.22 -4.95 117.98 116.25 3mae s PHE 259 Ca -0.11 -3.03 0.28 0.00 0.12 0.00 0.00 56.93 54.20 3mae s PHE 259 Cb 0.10 -2.21 1.32 0.00 -0.57 0.00 0.00 43.02 41.66 3mae s PHE 259 CO 0.89 -0.64 1.86 -1.00 -0.10 0.00 0.00 175.22 176.23 3mae h PRO 260 N 5.56 0.00 -0.27 0.24 0.13 -1.71 -2.53 132.00 133.41 3mae h PRO 260 Ca 0.16 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.37 3mae h PRO 260 Cb 0.81 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.93 3mae h PRO 260 CO 0.62 0.00 0.22 1.96 -0.23 0.00 0.00 178.00 180.57 3mae h GLN 261 N 0.00 0.00 0.00 0.86 7.50 -1.92 -0.18 115.11 121.37 3mae h GLN 261 Ca 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 58.65 59.10 3mae h GLN 261 Cb 0.26 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.78 3mae h GLN 261 CO 0.00 0.00 -0.25 -0.07 -1.50 0.00 0.00 178.83 177.01 3mae h LEU 262 N 0.00 0.00 -6.12 1.46 -0.00 -1.80 -3.36 115.31 105.49 3mae h LEU 262 Ca 0.13 0.00 -0.79 0.00 -0.00 0.00 0.00 57.88 57.22 3mae h LEU 262 Cb 0.57 0.00 -0.23 0.00 -0.00 0.00 0.00 40.66 40.99 3mae h LEU 262 CO -0.00 0.25 1.38 -3.20 -0.00 0.00 0.00 178.44 176.86 3mae n ASN 263 N -3.17 7.50 -3.29 -0.43 5.15 -0.08 -4.37 115.26 116.58 3mae n ASN 263 Ca 0.03 -3.55 -0.19 0.00 -0.60 0.00 0.00 54.58 50.27 3mae n ASN 263 Cb 0.62 -1.22 -0.07 0.00 -0.53 0.00 0.00 39.78 38.58 3mae n ASN 263 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3mae s SER 264 N -0.92 1.57 -0.11 1.20 1.04 -1.26 -1.02 113.70 114.20 3mae s SER 264 Ca 0.43 -1.72 -0.07 0.00 0.48 0.00 0.00 55.95 55.06 3mae s SER 264 Cb 0.19 0.59 0.04 0.00 0.10 0.00 0.00 66.02 66.93 3mae s SER 264 CO -0.12 -1.13 0.28 -0.89 0.98 0.00 0.00 173.24 172.37 3mae s THR 265 N -3.32 -0.02 0.10 2.02 2.01 -0.49 -2.35 115.64 113.60 3mae s THR 265 Ca 0.39 0.08 -0.30 0.00 0.31 0.00 0.00 61.69 62.17 3mae s THR 265 Cb 0.02 -0.41 -0.06 0.00 0.01 0.00 0.00 72.50 72.06 3mae s THR 265 CO 0.27 0.03 0.96 0.86 -0.69 0.00 0.00 174.62 176.05 3mae s TRP 266 N 0.84 3.80 -0.06 4.92 -0.11 -1.26 -1.34 118.94 125.72 3mae s TRP 266 Ca -0.06 1.79 0.15 0.00 1.22 0.00 0.00 56.10 59.20 3mae s TRP 266 Cb -0.07 -3.05 0.30 0.00 -1.50 0.00 0.00 33.47 29.15 3mae s TRP 266 CO -0.06 0.20 1.13 0.00 -4.62 0.00 0.00 176.95 173.61 3mae n ALA 267 N 2.84 2.53 0.00 5.86 0.00 -0.24 -4.95 120.51 126.54 3mae n ALA 267 Ca 0.02 -2.24 0.00 0.00 0.00 0.00 0.00 53.44 51.23 3mae n ALA 267 Cb 0.49 -0.54 0.00 0.00 0.00 0.00 0.00 19.45 19.40 3mae n ALA 267 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3mae n GLY 268 N -0.24 0.75 0.11 0.00 0.00 -1.26 -3.71 105.19 100.84 3mae n GLY 268 Ca 0.09 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 3mae n GLY 268 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 3mae h ASP 269 N 0.00 0.35 -4.91 1.61 -0.00 -2.02 -3.48 116.42 107.97 3mae h ASP 269 Ca 0.00 -0.80 -0.34 0.00 -0.00 0.00 0.00 57.03 55.89 3mae h ASP 269 Cb 0.00 -0.11 -0.14 0.00 -0.00 0.00 0.00 39.33 39.08 3mae h ASP 269 CO 0.00 1.10 -0.59 -1.59 -0.00 0.00 0.00 179.24 178.16 3mae s LYS 270 N -3.04 1.42 -0.15 0.28 0.00 -1.24 -5.15 119.74 111.86 3mae s LYS 270 Ca -0.15 -1.78 -0.02 0.00 0.00 0.00 0.00 55.97 54.02 3mae s LYS 270 Cb 0.02 -0.05 -0.02 0.00 0.00 0.00 0.00 37.83 37.78 3mae s LYS 270 CO 0.78 -0.38 -0.07 0.42 0.00 0.00 0.00 175.35 176.10 3mae s ILE 271 N -3.81 3.53 -0.32 3.79 1.01 -1.26 -1.08 121.20 123.06 3mae s ILE 271 Ca 0.38 -0.48 -0.12 0.00 0.00 0.00 0.00 60.65 60.43 3mae s ILE 271 Cb 0.07 -2.53 -0.02 0.00 0.01 0.00 0.00 42.46 39.98 3mae s ILE 271 CO 0.15 0.49 0.21 -0.63 0.00 0.00 0.00 174.94 175.16 3mae s ILE 272 N 0.49 5.11 -0.16 2.92 1.01 -0.45 -4.96 121.20 125.16 3mae s ILE 272 Ca -0.05 -0.21 -0.20 0.00 0.00 0.00 0.00 60.65 60.19 3mae s ILE 272 Cb -0.15 -3.59 -0.03 0.00 0.01 0.00 0.00 42.46 38.70 3mae s ILE 272 CO 0.03 0.05 0.56 -1.61 0.00 0.00 0.00 174.94 173.97 3mae s GLU 273 N 1.70 4.27 0.02 2.79 2.02 -1.26 -1.39 118.70 126.84 3mae s GLU 273 Ca 0.06 0.54 -0.21 0.00 0.02 0.00 0.00 54.97 55.37 3mae s GLU 273 Cb -0.17 -3.51 -0.06 0.00 0.10 0.00 0.00 34.13 30.49 3mae s GLU 273 CO 0.09 -0.05 0.63 -1.01 0.02 0.00 0.00 175.26 174.94 3mae s HIS 274 N 1.30 3.71 0.18 1.61 3.76 -0.19 -4.97 115.29 120.70 3mae s HIS 274 Ca 0.27 1.28 -0.05 0.00 -0.15 0.00 0.00 55.06 56.41 3mae s HIS 274 Cb -0.16 -2.65 0.06 0.00 1.11 0.00 0.00 32.58 30.95 3mae s HIS 274 CO 0.11 0.36 1.48 0.00 -0.85 0.00 0.00 174.74 175.84 3mae h ALA 275 N 5.49 0.64 -2.33 -1.40 0.00 -1.97 -3.43 119.26 116.25 3mae h ALA 275 Ca -0.45 -0.52 -0.55 0.00 0.00 0.00 0.00 54.91 53.39 3mae h ALA 275 Cb 1.20 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 3mae h ALA 275 CO 0.69 0.69 0.48 -0.80 0.00 0.00 0.00 179.25 180.31 3mae s ASN 276 N -6.93 7.30 -0.86 0.00 -0.87 -1.26 -5.00 114.94 107.32 3mae s ASN 276 Ca -0.08 1.59 -0.15 0.00 -1.57 0.00 0.00 52.86 52.65 3mae s ASN 276 Cb 0.11 -2.56 0.19 0.00 -0.02 0.00 0.00 41.25 38.97 3mae s ASN 276 CO 0.85 -0.36 0.89 -0.63 -2.57 0.00 0.00 177.10 175.28 3mae s ILE 277 N 1.55 5.34 -0.32 0.60 1.01 -1.26 -4.84 121.20 123.27 3mae s ILE 277 Ca 0.50 -2.19 -0.07 0.00 0.00 0.00 0.00 60.65 58.89 3mae s ILE 277 Cb -0.20 -4.57 0.02 0.00 0.01 0.00 0.00 42.46 37.73 3mae s ILE 277 CO 0.23 -1.18 0.09 0.20 0.00 0.00 0.00 174.94 174.27 3mae s ASN 278 N 2.62 5.20 -0.37 3.58 0.01 -1.26 -1.47 114.94 123.26 3mae s ASN 278 Ca 0.23 -0.91 -0.15 0.00 -0.71 0.00 0.00 52.86 51.31 3mae s ASN 278 Cb -0.08 -1.87 -0.00 0.00 0.41 0.00 0.00 41.25 39.70 3mae s ASN 278 CO -0.09 -0.26 0.35 -0.63 -1.51 0.00 0.00 177.10 174.96 3mae s ILE 279 N 1.45 5.18 0.12 0.60 1.01 -0.47 -0.59 121.20 128.51 3mae s ILE 279 Ca 0.01 -0.17 -0.31 0.00 0.00 0.00 0.00 60.65 60.17 3mae s ILE 279 Cb -0.18 -3.86 -0.08 0.00 0.01 0.00 0.00 42.46 38.35 3mae s ILE 279 CO 0.03 -0.17 1.35 -0.44 0.00 0.00 0.00 174.94 175.71 3mae s SER 280 N 1.74 6.87 -0.04 3.58 0.01 0.95 -0.47 113.70 126.34 3mae s SER 280 Ca 0.10 2.29 0.07 0.00 1.31 0.00 0.00 55.95 59.72 3mae s SER 280 Cb -0.17 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.45 3mae s SER 280 CO 0.12 -0.61 -0.25 0.27 0.41 0.00 0.00 173.24 173.17 3mae s ILE 281 N 0.98 2.06 -0.22 1.44 -4.36 0.20 -0.89 121.20 120.41 3mae s ILE 281 Ca 0.63 -1.09 -0.26 0.00 -0.26 0.00 0.00 60.65 59.67 3mae s ILE 281 Cb -0.36 -1.72 -0.00 0.00 1.25 0.00 0.00 42.46 41.63 3mae s ILE 281 CO 0.31 0.58 0.87 0.00 0.24 0.00 0.00 174.94 176.94 3mae s ALA 282 N -0.41 3.62 -0.19 2.27 0.00 -1.11 -3.00 121.76 122.94 3mae s ALA 282 Ca 0.04 -0.02 0.01 0.00 0.00 0.00 0.00 51.96 51.98 3mae s ALA 282 Cb -0.12 -3.33 0.04 0.00 0.00 0.00 0.00 23.12 19.71 3mae s ALA 282 CO 0.01 -0.88 -0.11 0.42 0.00 0.00 0.00 175.76 175.20 3mae s ILE 283 N 2.74 1.63 -0.07 0.00 1.01 -0.13 -4.61 121.20 121.77 3mae s ILE 283 Ca 0.38 -0.92 -0.02 0.00 0.00 0.00 0.00 60.65 60.08 3mae s ILE 283 Cb -0.16 -1.66 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 3mae s ILE 283 CO 0.08 0.24 0.05 0.00 0.00 0.00 0.00 174.94 175.32 3mae s ALA 284 N 1.42 3.49 -0.29 9.38 0.00 -1.26 -0.92 121.76 133.56 3mae s ALA 284 Ca 0.00 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.18 3mae s ALA 284 Cb -0.15 -1.60 0.09 0.00 0.00 0.00 0.00 23.12 21.45 3mae s ALA 284 CO -0.09 0.62 0.05 0.00 0.00 0.00 0.00 175.76 176.34 3mae s ALA 285 N -1.00 1.98 0.00 0.00 0.00 -0.33 -4.99 121.76 117.42 3mae s ALA 285 Ca 0.16 -1.78 0.00 0.00 0.00 0.00 0.00 51.96 50.34 3mae s ALA 285 Cb -0.12 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.35 3mae s ALA 285 CO 0.06 -1.54 0.00 0.41 0.00 0.00 0.00 175.76 174.69 3mae n GLY 286 N 4.65 1.11 0.13 0.00 0.00 -1.26 -2.63 105.19 107.20 3mae n GLY 286 Ca -0.03 0.33 -0.18 0.00 0.00 0.00 0.00 46.02 46.13 3mae n GLY 286 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3mae n ASP 287 N 9.67 1.90 -4.80 1.61 8.00 -1.26 -4.98 116.55 126.69 3mae n ASP 287 Ca 0.00 0.01 -0.35 0.00 0.71 0.00 0.00 54.79 55.15 3mae n ASP 287 Cb 0.00 -0.49 -0.07 0.00 -0.02 0.00 0.00 41.12 40.55 3mae n ASP 287 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3mae s LEU 288 N -6.64 4.19 -0.13 0.64 0.05 -1.08 -5.07 118.68 110.64 3mae s LEU 288 Ca -0.28 1.73 -0.00 0.00 0.05 0.00 0.00 54.13 55.63 3mae s LEU 288 Cb 0.08 -4.17 0.03 0.00 -2.05 0.00 0.00 46.19 40.07 3mae s LEU 288 CO 0.68 -0.17 -0.10 -0.22 -0.55 0.00 0.00 176.35 175.99 3mae s LEU 289 N -2.49 1.44 0.07 1.48 2.96 -1.26 -1.18 118.68 119.70 3mae s LEU 289 Ca 0.54 -0.43 0.03 0.00 -0.22 0.00 0.00 54.13 54.06 3mae s LEU 289 Cb -0.15 -0.98 -0.04 0.00 0.50 0.00 0.00 46.19 45.53 3mae s LEU 289 CO 0.19 -0.11 0.05 -0.31 -1.32 0.00 0.00 176.35 174.85 3mae s TYR 290 N 1.62 3.12 -0.55 5.38 1.51 -0.10 -5.00 117.35 123.32 3mae s TYR 290 Ca 0.04 0.05 0.06 0.00 -1.01 0.00 0.00 57.07 56.21 3mae s TYR 290 Cb -0.13 -1.60 0.21 0.00 -0.11 0.00 0.00 41.96 40.32 3mae s TYR 290 CO -0.09 0.50 0.53 0.28 -1.11 0.00 0.00 175.55 175.66 3mae n VAL 291 N 0.61 0.60 -1.58 0.71 0.31 -1.26 -0.95 118.33 116.77 3mae n VAL 291 Ca -0.10 -4.41 -0.32 0.00 -0.01 0.00 0.00 64.34 59.50 3mae n VAL 291 Cb 0.52 -1.98 0.06 0.00 -0.91 0.00 0.00 33.84 31.52 3mae n VAL 291 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 3mae s PRO 292 N -1.28 2.72 -0.11 5.55 0.04 -1.16 -4.65 135.00 136.10 3mae s PRO 292 Ca 0.33 1.18 -0.00 0.00 0.04 0.00 0.00 61.00 62.55 3mae s PRO 292 Cb 0.07 -1.95 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 3mae s PRO 292 CO -0.13 -1.29 -0.10 0.08 0.04 0.00 0.00 177.00 175.61 3mae s VAL 293 N -2.72 3.38 -0.50 -0.36 1.01 0.11 -0.62 120.40 120.70 3mae s VAL 293 Ca 0.62 -0.56 -0.17 0.00 0.00 0.00 0.00 61.98 61.87 3mae s VAL 293 Cb -0.17 -2.41 0.08 0.00 0.00 0.00 0.00 36.38 33.88 3mae s VAL 293 CO 0.49 0.54 0.49 -0.63 0.00 0.00 0.00 175.10 175.99 3mae s ILE 294 N -0.06 5.12 0.30 2.22 1.01 0.38 -4.93 121.20 125.24 3mae s ILE 294 Ca -0.01 -1.03 -0.29 0.00 0.00 0.00 0.00 60.65 59.32 3mae s ILE 294 Cb -0.14 -4.23 -0.10 0.00 0.01 0.00 0.00 42.46 38.00 3mae s ILE 294 CO 0.03 -0.73 1.32 -0.54 0.00 0.00 0.00 174.94 175.03 3mae s LYS 295 N 1.92 4.36 -1.33 2.79 3.01 -1.26 -1.36 119.74 127.86 3mae s LYS 295 Ca 0.07 2.19 -0.08 0.00 -1.01 0.00 0.00 55.97 57.14 3mae s LYS 295 Cb -0.24 -3.10 0.00 0.00 -1.01 0.00 0.00 37.83 33.48 3mae s LYS 295 CO 0.07 -0.22 0.51 0.09 0.51 0.00 0.00 175.35 176.31 3mae n ASN 296 N 1.32 -1.74 0.26 2.83 3.02 -0.95 -4.87 115.26 115.14 3mae n ASN 296 Ca 0.02 -1.04 0.14 0.00 -0.03 0.00 0.00 54.58 53.67 3mae n ASN 296 Cb 0.42 -2.98 0.67 0.00 -0.61 0.00 0.00 39.78 37.28 3mae n ASN 296 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3mae h ALA 297 N 0.89 1.07 0.00 5.41 0.00 -1.38 -2.25 119.26 123.00 3mae h ALA 297 Ca -0.65 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.11 3mae h ALA 297 Cb 1.37 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 3mae h ALA 297 CO 0.58 0.13 -0.27 0.38 0.00 0.00 0.00 179.25 180.07 3mae h ASP 298 N 0.00 0.00 0.88 0.00 -0.00 -1.85 -3.10 116.42 112.35 3mae h ASP 298 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3mae h ASP 298 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.83 3mae h ASP 298 CO 0.01 0.27 -0.98 -0.62 -0.00 0.00 0.00 179.24 177.92 3mae n GLU 299 N -3.86 0.53 -2.66 4.15 1.02 -0.85 -4.90 120.64 114.06 3mae n GLU 299 Ca -0.02 0.09 -0.33 0.00 -0.02 0.00 0.00 57.16 56.89 3mae n GLU 299 Cb 0.36 -1.77 -0.06 0.00 -0.02 0.00 0.00 31.44 29.95 3mae n GLU 299 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3mae s LYS 300 N -3.32 4.12 0.73 3.49 -0.14 -1.17 -5.08 119.74 118.35 3mae s LYS 300 Ca 0.01 1.05 -0.07 0.00 -1.36 0.00 0.00 55.97 55.59 3mae s LYS 300 Cb 0.11 -2.17 0.07 0.00 -1.68 0.00 0.00 37.83 34.16 3mae s LYS 300 CO 0.78 -0.12 1.04 -1.54 -0.76 0.00 0.00 175.35 174.76 3mae s SER 301 N -2.53 4.69 0.24 2.83 1.04 -1.26 -4.88 113.70 113.83 3mae s SER 301 Ca 0.61 0.44 -0.06 0.00 0.48 0.00 0.00 55.95 57.42 3mae s SER 301 Cb -0.09 -1.04 0.28 0.00 0.10 0.00 0.00 66.02 65.26 3mae s SER 301 CO 0.20 -1.69 1.90 0.40 0.98 0.00 0.00 173.24 175.03 3mae h ILE 302 N -0.68 1.18 -0.05 -1.02 2.04 -1.85 -0.38 117.51 116.74 3mae h ILE 302 Ca -0.44 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.03 3mae h ILE 302 Cb 1.31 -0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3mae h ILE 302 CO 0.59 0.22 -0.11 0.50 0.00 0.00 0.00 178.15 179.35 3mae h LYS 303 N 1.21 -0.16 -0.89 2.37 3.64 -1.89 -0.31 116.57 120.54 3mae h LYS 303 Ca 0.36 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.76 3mae h LYS 303 Cb -0.04 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 3mae h LYS 303 CO -0.11 -0.11 0.57 0.78 -2.27 0.00 0.00 179.45 178.31 3mae h GLY 304 N -0.17 1.27 0.91 5.01 0.00 -1.73 -1.61 103.07 106.75 3mae h GLY 304 Ca 0.06 -0.50 -0.01 0.00 0.00 0.00 0.00 47.33 46.88 3mae h GLY 304 CO -0.15 0.48 0.10 -2.22 0.00 0.00 0.00 176.54 174.75 3mae h ILE 305 N 1.21 1.15 -0.83 2.60 2.04 -0.92 -2.31 117.51 120.45 3mae h ILE 305 Ca 0.32 -0.44 0.08 0.00 1.00 0.00 0.00 64.86 65.81 3mae h ILE 305 Cb -0.10 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 36.94 3mae h ILE 305 CO -0.07 0.15 0.50 0.00 0.00 0.00 0.00 178.15 178.73 3mae h ALA 306 N 0.95 1.16 -0.28 1.87 0.00 -0.81 -0.69 119.26 121.47 3mae h ALA 306 Ca 0.08 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3mae h ALA 306 Cb 0.14 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3mae h ALA 306 CO -0.01 0.19 0.13 -0.09 0.00 0.00 0.00 179.25 179.47 3mae h ARG 307 N 0.88 0.27 -0.02 0.00 2.43 -1.16 -2.31 114.38 114.47 3mae h ARG 307 Ca 0.38 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.42 3mae h ARG 307 Cb 0.26 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 3mae h ARG 307 CO -0.20 0.18 -0.52 1.49 -1.51 0.00 0.00 179.97 179.41 3mae h GLU 308 N 0.28 0.05 0.24 0.20 4.81 -1.01 -1.49 114.58 117.67 3mae h GLU 308 Ca 0.11 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.30 3mae h GLU 308 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 3mae h GLU 308 CO -0.08 0.56 -0.11 0.82 -0.73 0.00 0.00 179.01 179.46 3mae h ILE 309 N 0.04 0.81 -0.26 2.32 2.04 -0.94 -1.19 117.51 120.33 3mae h ILE 309 Ca -0.00 -0.32 -0.07 0.00 1.00 0.00 0.00 64.86 65.47 3mae h ILE 309 Cb 0.93 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 3mae h ILE 309 CO 0.07 0.07 -0.13 0.77 0.00 0.00 0.00 178.15 178.93 3mae h SER 310 N -0.48 0.43 0.08 1.72 4.64 -1.35 -0.22 113.55 118.37 3mae h SER 310 Ca -0.03 -0.11 -0.00 0.00 -0.47 0.00 0.00 61.79 61.18 3mae h SER 310 Cb 0.36 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 3mae h SER 310 CO 0.05 0.59 -0.04 -0.33 -0.87 0.00 0.00 176.83 176.23 3mae h GLU 311 N 0.41 -0.11 -0.14 4.77 5.08 -1.26 -1.62 114.58 121.72 3mae h GLU 311 Ca 0.08 0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.30 3mae h GLU 311 Cb 0.47 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3mae h GLU 311 CO 0.03 0.08 -0.54 -0.07 -1.00 0.00 0.00 179.01 177.51 3mae h LEU 312 N -0.28 0.44 -0.64 1.33 3.38 -1.01 -1.88 115.31 116.65 3mae h LEU 312 Ca -0.01 -0.23 -0.15 0.00 0.09 0.00 0.00 57.88 57.58 3mae h LEU 312 Cb 0.24 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3mae h LEU 312 CO 0.02 0.89 -0.63 0.00 0.09 0.00 0.00 178.44 178.81 3mae h ALA 313 N 1.12 0.84 -0.43 1.53 0.00 -1.11 -1.34 119.26 119.88 3mae h ALA 313 Ca 0.01 -0.56 -0.06 0.00 0.00 0.00 0.00 54.91 54.30 3mae h ALA 313 Cb 1.04 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.73 3mae h ALA 313 CO 0.09 0.75 0.04 0.78 0.00 0.00 0.00 179.25 180.92 3mae h GLY 314 N 1.58 0.79 2.00 0.00 0.00 -1.12 -2.81 103.07 103.50 3mae h GLY 314 Ca -0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 3mae h GLY 314 CO 0.09 0.50 -0.04 0.50 0.00 0.00 0.00 176.54 177.60 3mae h LYS 315 N 0.58 0.00 -0.03 4.80 1.57 -1.28 -2.66 116.57 119.55 3mae h LYS 315 Ca 0.13 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.69 3mae h LYS 315 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 3mae h LYS 315 CO 0.01 0.04 -0.89 0.00 -0.57 0.00 0.00 179.45 178.05 3mae h ALA 316 N 1.96 0.38 -0.03 3.86 0.00 -1.11 -0.33 119.26 123.99 3mae h ALA 316 Ca -0.00 -0.67 -0.22 0.00 0.00 0.00 0.00 54.91 54.02 3mae h ALA 316 Cb 0.79 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 3mae h ALA 316 CO 0.01 0.77 -0.90 0.00 0.00 0.00 0.00 179.25 179.13 3mae h ARG 317 N 0.30 0.48 0.00 0.00 3.08 -1.49 -3.22 114.38 113.52 3mae h ARG 317 Ca -0.07 -0.48 -0.08 0.00 0.07 0.00 0.00 59.98 59.42 3mae h ARG 317 Cb 1.51 0.13 -0.01 0.00 0.08 0.00 0.00 29.97 31.68 3mae h ARG 317 CO 0.16 1.12 -0.38 -0.91 -1.07 0.00 0.00 179.97 178.89 3mae h ASN 318 N 0.29 0.00 0.00 7.04 4.21 -1.50 -3.47 115.58 122.14 3mae h ASN 318 Ca -0.07 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.44 3mae h ASN 318 Cb 1.52 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.72 3mae h ASN 318 CO 0.16 0.38 0.00 0.61 -1.29 0.00 0.00 177.43 177.29 3mae n GLY 319 N 0.27 0.70 2.53 2.83 0.00 -0.23 -4.95 105.19 106.35 3mae n GLY 319 Ca -0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 3mae n GLY 319 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3mae n LYS 320 N -2.52 2.44 -3.59 1.61 4.76 -0.61 -4.91 118.16 115.33 3mae n LYS 320 Ca 0.00 -2.58 -0.40 0.00 -2.87 0.00 0.00 58.31 52.46 3mae n LYS 320 Cb 0.00 -2.13 -0.11 0.00 -1.84 0.00 0.00 35.03 30.94 3mae n LYS 320 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3mae s LEU 321 N -2.64 4.35 0.83 -0.35 2.96 -1.23 -4.89 118.68 117.71 3mae s LEU 321 Ca 0.55 -0.53 -0.12 0.00 -0.22 0.00 0.00 54.13 53.81 3mae s LEU 321 Cb 0.39 -2.06 0.09 0.00 0.50 0.00 0.00 46.19 45.11 3mae s LEU 321 CO -0.24 -0.23 1.14 -0.94 -1.32 0.00 0.00 176.35 174.75 3mae s SER 322 N 1.65 4.26 0.21 3.68 1.04 -1.26 -4.99 113.70 118.30 3mae s SER 322 Ca 0.05 0.99 0.05 0.00 0.48 0.00 0.00 55.95 57.51 3mae s SER 322 Cb -0.17 -1.60 0.17 0.00 0.10 0.00 0.00 66.02 64.52 3mae s SER 322 CO 0.08 -2.08 1.50 -0.61 0.98 0.00 0.00 173.24 173.11 3mae h GLN 323 N -1.17 0.19 -0.06 4.02 4.15 -2.00 -3.17 115.11 117.07 3mae h GLN 323 Ca -0.48 -0.16 -0.05 0.00 0.77 0.00 0.00 58.65 58.74 3mae h GLN 323 Cb 1.31 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 29.02 3mae h GLN 323 CO 0.63 0.82 -0.17 0.00 -1.93 0.00 0.00 178.83 178.18 3mae h ALA 324 N 1.14 1.60 0.00 3.38 0.00 -1.94 -1.92 119.26 121.52 3mae h ALA 324 Ca -0.02 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 3mae h ALA 324 Cb 1.25 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3mae h ALA 324 CO 0.11 0.30 -0.56 -0.44 0.00 0.00 0.00 179.25 178.65 3mae h ASP 325 N 0.10 0.00 1.26 0.00 3.45 -1.92 -3.20 116.42 116.11 3mae h ASP 325 Ca 0.02 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.48 3mae h ASP 325 Cb 0.37 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.14 3mae h ASP 325 CO 0.02 0.56 -0.09 0.23 -1.57 0.00 0.00 179.24 178.40 3mae n MET 326 N -3.82 0.20 -4.12 3.56 2.81 -0.74 0.09 117.12 115.09 3mae n MET 326 Ca -0.01 0.14 -0.27 0.00 -1.81 0.00 0.00 57.70 55.75 3mae n MET 326 Cb 0.58 -1.71 -0.06 0.00 -0.71 0.00 0.00 33.22 31.31 3mae n MET 326 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 3mae s GLU 327 N -3.08 2.72 0.00 0.03 2.02 -1.10 -4.69 118.70 114.59 3mae s GLU 327 Ca 0.11 -0.94 0.00 0.00 0.02 0.00 0.00 54.97 54.16 3mae s GLU 327 Cb 0.14 -2.55 0.00 0.00 0.10 0.00 0.00 34.13 31.82 3mae s GLU 327 CO 0.60 0.48 0.00 0.41 0.02 0.00 0.00 175.26 176.77 3mae n GLY 328 N -0.17 0.87 3.74 -1.39 0.00 -1.26 -4.82 105.19 102.16 3mae n GLY 328 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 3mae n GLY 328 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3mae s GLY 329 N -1.96 2.68 -0.00 -0.02 0.00 -1.26 -4.71 107.32 102.04 3mae s GLY 329 Ca 0.00 1.03 0.04 0.00 0.00 0.00 0.00 44.72 45.80 3mae s GLY 329 CO 0.00 1.89 0.13 -1.30 0.00 0.00 0.00 173.10 173.83 3mae n THR 330 N 2.20 0.00 -3.69 0.90 -2.24 0.24 -4.87 114.28 106.82 3mae n THR 330 Ca 0.04 -0.22 -0.14 0.00 -2.27 0.00 0.00 64.05 61.45 3mae n THR 330 Cb 0.44 0.65 -0.08 0.00 -2.10 0.00 0.00 70.33 69.23 3mae n THR 330 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 3mae s PHE 331 N -1.93 -0.38 -0.08 4.78 2.19 -1.07 -4.26 117.98 117.24 3mae s PHE 331 Ca -0.00 0.71 0.05 0.00 0.33 0.00 0.00 56.93 58.02 3mae s PHE 331 Cb 0.03 0.19 -0.01 0.00 -1.31 0.00 0.00 43.02 41.92 3mae s PHE 331 CO 0.18 -0.41 -0.24 0.99 1.83 0.00 0.00 175.22 177.57 3mae s THR 332 N -0.91 2.09 -0.10 0.12 2.01 -1.24 -0.03 115.64 117.57 3mae s THR 332 Ca -0.10 -1.03 0.03 0.00 0.31 0.00 0.00 61.69 60.90 3mae s THR 332 Cb -0.03 -1.77 -0.01 0.00 0.01 0.00 0.00 72.50 70.70 3mae s THR 332 CO 0.05 0.57 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.64 3mae s VAL 333 N 0.04 2.33 -0.12 3.82 1.01 -0.07 -1.11 120.40 126.30 3mae s VAL 333 Ca -0.10 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 60.97 3mae s VAL 333 Cb -0.15 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.31 3mae s VAL 333 CO 0.06 0.55 -0.17 0.21 0.00 0.00 0.00 175.10 175.75 3mae s ASN 334 N 0.28 3.68 -1.25 3.32 3.84 0.65 -2.77 114.94 122.70 3mae s ASN 334 Ca -0.15 -0.41 -0.09 0.00 0.21 0.00 0.00 52.86 52.43 3mae s ASN 334 Cb -0.17 -1.51 0.19 0.00 -0.55 0.00 0.00 41.25 39.21 3mae s ASN 334 CO 0.08 0.17 1.81 -0.24 -2.79 0.00 0.00 177.10 176.12 3mae n SER 335 N 3.48 5.30 0.06 -4.21 2.88 -1.26 -0.73 113.62 119.14 3mae n SER 335 Ca -0.18 -3.16 0.09 0.00 -1.33 0.00 0.00 58.87 54.29 3mae n SER 335 Cb 0.53 -1.45 0.39 0.00 -0.75 0.00 0.00 64.21 62.93 3mae n SER 335 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3mae n THR 336 N 3.03 0.97 0.26 2.46 -2.24 -1.05 -2.52 114.28 115.19 3mae n THR 336 Ca 0.38 0.27 0.14 0.00 -2.27 0.00 0.00 64.05 62.56 3mae n THR 336 Cb 0.36 -1.12 0.70 0.00 -2.10 0.00 0.00 70.33 68.17 3mae n THR 336 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 3mae h GLY 337 N 2.20 0.00 2.00 3.38 0.00 -1.53 -2.32 103.07 106.81 3mae h GLY 337 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3mae h GLY 337 CO 0.00 0.00 -0.10 1.76 0.00 0.00 0.00 176.54 178.20 3mae h SER 338 N 0.00 0.00 -0.56 0.19 0.02 -1.79 -2.54 113.55 108.87 3mae h SER 338 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3mae h SER 338 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 3mae h SER 338 CO 0.01 0.10 0.00 0.49 -1.14 0.00 0.00 176.83 176.30 3mae n PHE 339 N -3.57 0.74 -1.04 3.45 3.72 -0.88 -4.94 117.46 114.94 3mae n PHE 339 Ca -0.02 -0.37 -0.01 0.00 -0.05 0.00 0.00 57.45 57.00 3mae n PHE 339 Cb 0.23 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.76 3mae n PHE 339 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3mae n GLY 340 N 1.50 0.51 3.81 1.37 0.00 -0.96 -5.03 105.19 106.39 3mae n GLY 340 Ca 0.21 -0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.37 3mae n GLY 340 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3mae s SER 341 N -2.51 7.09 -0.15 1.61 1.04 -1.17 -4.91 113.70 114.68 3mae s SER 341 Ca 0.00 1.70 0.10 0.00 0.48 0.00 0.00 55.95 58.23 3mae s SER 341 Cb 0.00 -2.53 -0.17 0.00 0.10 0.00 0.00 66.02 63.42 3mae s SER 341 CO 0.00 -0.21 0.00 0.52 0.98 0.00 0.00 173.24 174.53 3mae n VAL 342 N -0.08 1.02 -3.78 5.02 0.31 -1.26 -1.25 118.33 118.30 3mae n VAL 342 Ca 0.04 -0.57 -0.13 0.00 -0.01 0.00 0.00 64.34 63.67 3mae n VAL 342 Cb 0.52 -0.73 -0.09 0.00 -0.91 0.00 0.00 33.84 32.63 3mae n VAL 342 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3mae s GLN 343 N -2.36 0.58 -0.00 5.55 -0.21 -1.26 -4.61 119.66 117.35 3mae s GLN 343 Ca -0.11 -0.13 -0.26 0.00 0.02 0.00 0.00 55.36 54.88 3mae s GLN 343 Cb 0.05 0.26 0.06 0.00 1.00 0.00 0.00 33.01 34.37 3mae s GLN 343 CO 0.56 -0.15 0.57 -1.54 -2.12 0.00 0.00 175.29 172.62 3mae s SER 344 N -1.08 -0.52 -0.21 5.90 1.04 -1.26 -5.13 113.70 112.44 3mae s SER 344 Ca -0.11 0.42 0.01 0.00 0.48 0.00 0.00 55.95 56.74 3mae s SER 344 Cb -0.05 0.49 0.03 0.00 0.10 0.00 0.00 66.02 66.59 3mae s SER 344 CO 0.03 -0.64 -0.14 -0.32 0.98 0.00 0.00 173.24 173.15 3mae s MET 345 N -1.72 2.83 0.34 4.02 1.75 -1.26 -4.79 119.30 120.47 3mae s MET 345 Ca -0.09 -0.96 0.03 0.00 -1.25 0.00 0.00 55.69 53.42 3mae s MET 345 Cb -0.01 -2.75 -0.02 0.00 2.84 0.00 0.00 34.83 34.89 3mae s MET 345 CO 0.04 -0.32 0.51 0.20 -0.65 0.00 0.00 175.02 174.80 3mae s GLY 346 N 1.27 1.41 -0.18 2.11 0.00 -1.26 -5.09 107.32 105.58 3mae s GLY 346 Ca 0.01 -1.15 -0.18 0.00 0.00 0.00 0.00 44.72 43.40 3mae s GLY 346 CO -0.09 -1.08 0.51 -0.42 0.00 0.00 0.00 173.10 172.02 3mae s ILE 347 N -2.25 5.12 0.18 0.90 1.01 -1.26 -4.76 121.20 120.15 3mae s ILE 347 Ca 0.41 0.95 -0.32 0.00 0.00 0.00 0.00 60.65 61.70 3mae s ILE 347 Cb -0.09 -3.84 -0.12 0.00 0.01 0.00 0.00 42.46 38.42 3mae s ILE 347 CO 0.33 0.21 1.77 -0.38 0.00 0.00 0.00 174.94 176.87 3mae n ILE 348 N 4.36 0.14 -2.15 2.92 5.41 -1.26 -4.90 119.36 123.88 3mae n ILE 348 Ca -0.05 -0.03 -0.30 0.00 1.00 0.00 0.00 62.75 63.37 3mae n ILE 348 Cb 0.51 -2.03 -0.05 0.00 -0.71 0.00 0.00 39.64 37.36 3mae n ILE 348 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 3mae s ASN 349 N 1.76 5.38 0.30 4.38 2.47 -1.26 -4.83 114.94 123.13 3mae s ASN 349 Ca 0.78 -1.26 -0.29 0.00 0.42 0.00 0.00 52.86 52.50 3mae s ASN 349 Cb -0.50 -2.57 -0.13 0.00 -1.45 0.00 0.00 41.25 36.60 3mae s ASN 349 CO 0.34 -2.62 1.31 1.57 -3.72 0.00 0.00 177.10 173.98 3mae n HIS 350 N 13.16 2.14 -0.48 0.43 -0.00 -1.26 -1.63 115.22 127.57 3mae n HIS 350 Ca 0.42 0.52 -0.11 0.00 -0.00 0.00 0.00 57.72 58.55 3mae n HIS 350 Cb 0.47 -2.42 0.16 0.00 -0.00 0.00 0.00 29.99 28.21 3mae n HIS 350 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 3mae n PRO 351 N 1.16 2.33 -1.48 1.57 -0.04 -1.26 -5.04 135.00 132.24 3mae n PRO 351 Ca 0.08 -2.10 -0.29 0.00 -0.04 0.00 0.00 63.50 61.15 3mae n PRO 351 Cb 0.34 -1.87 0.14 0.00 -0.04 0.00 0.00 33.50 32.07 3mae n PRO 351 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 3mae s GLN 352 N -2.26 1.11 -0.10 0.54 -0.21 -0.65 -4.31 119.66 113.79 3mae s GLN 352 Ca 0.39 0.35 0.19 0.00 0.02 0.00 0.00 55.36 56.31 3mae s GLN 352 Cb 0.32 -1.83 -0.26 0.00 1.00 0.00 0.00 33.01 32.24 3mae s GLN 352 CO 0.08 -2.23 0.34 0.00 -2.12 0.00 0.00 175.29 171.37 3mae n ALA 353 N -3.80 2.01 -3.00 6.09 0.00 -0.99 -4.82 120.51 116.00 3mae n ALA 353 Ca 0.06 -0.92 -0.11 0.00 0.00 0.00 0.00 53.44 52.47 3mae n ALA 353 Cb 0.59 -0.51 -0.05 0.00 0.00 0.00 0.00 19.45 19.47 3mae n ALA 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3mae s ALA 354 N -2.91 -0.89 -0.01 0.00 0.00 -1.26 -0.69 121.76 116.00 3mae s ALA 354 Ca -0.08 -0.01 0.01 0.00 0.00 0.00 0.00 51.96 51.88 3mae s ALA 354 Cb 0.09 0.59 0.00 0.00 0.00 0.00 0.00 23.12 23.80 3mae s ALA 354 CO 0.85 -0.58 -0.04 -1.50 0.00 0.00 0.00 175.76 174.49 3mae s ILE 355 N -3.47 0.39 -0.15 0.00 2.07 -0.83 -3.66 121.20 115.55 3mae s ILE 355 Ca 0.01 -0.17 -0.02 0.00 -1.41 0.00 0.00 60.65 59.06 3mae s ILE 355 Cb 0.01 -0.36 -0.02 0.00 0.13 0.00 0.00 42.46 42.22 3mae s ILE 355 CO -0.09 0.13 -0.09 -0.22 -1.91 0.00 0.00 174.94 172.76 3mae s LEU 356 N 0.15 2.91 -0.22 8.50 2.96 -0.27 -1.68 118.68 131.04 3mae s LEU 356 Ca -0.01 -0.27 -0.09 0.00 -0.22 0.00 0.00 54.13 53.53 3mae s LEU 356 Cb -0.05 -1.68 -0.05 0.00 0.50 0.00 0.00 46.19 44.91 3mae s LEU 356 CO -0.00 0.14 0.12 -1.10 -1.32 0.00 0.00 176.35 174.19 3mae s GLN 357 N 0.50 4.03 -0.39 1.98 -1.52 0.81 -0.25 119.66 124.81 3mae s GLN 357 Ca -0.07 -0.30 -0.15 0.00 -1.95 0.00 0.00 55.36 52.89 3mae s GLN 357 Cb -0.15 -3.41 0.01 0.00 -0.22 0.00 0.00 33.01 29.23 3mae s GLN 357 CO 0.04 0.14 0.32 0.08 -0.25 0.00 0.00 175.29 175.61 3mae s VAL 358 N 0.81 5.22 0.04 1.09 1.01 0.09 -1.35 120.40 127.32 3mae s VAL 358 Ca 0.06 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.59 3mae s VAL 358 Cb -0.13 -3.90 0.01 0.00 0.00 0.00 0.00 36.38 32.36 3mae s VAL 358 CO 0.02 -0.25 0.06 -0.62 0.00 0.00 0.00 175.10 174.31 3mae n GLU 359 N 5.26 -0.12 -2.31 2.72 -0.58 -0.85 -1.85 120.64 122.90 3mae n GLU 359 Ca -0.10 -0.09 -0.40 0.00 -0.42 0.00 0.00 57.16 56.14 3mae n GLU 359 Cb 0.48 -0.06 -0.03 0.00 -0.57 0.00 0.00 31.44 31.26 3mae n GLU 359 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 3mae s SER 360 N -1.24 6.92 -0.26 1.62 0.01 -0.38 -4.15 113.70 116.21 3mae s SER 360 Ca 0.03 2.43 -0.27 0.00 1.31 0.00 0.00 55.95 59.45 3mae s SER 360 Cb -0.00 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.61 3mae s SER 360 CO 0.02 -0.40 0.98 -0.63 0.41 0.00 0.00 173.24 173.62 3mae s ILE 361 N -1.22 4.68 -0.05 1.44 1.01 -1.26 -4.35 121.20 121.45 3mae s ILE 361 Ca 0.49 1.77 0.03 0.00 0.00 0.00 0.00 60.65 62.94 3mae s ILE 361 Cb -0.34 -4.28 0.00 0.00 0.01 0.00 0.00 42.46 37.85 3mae s ILE 361 CO 0.44 -0.24 -0.15 -0.69 0.00 0.00 0.00 174.94 174.31 3mae s VAL 362 N 3.21 1.27 0.07 2.92 1.01 0.37 -4.92 120.40 124.33 3mae s VAL 362 Ca 0.41 -0.60 -0.31 0.00 0.00 0.00 0.00 61.98 61.49 3mae s VAL 362 Cb -0.14 -1.12 -0.07 0.00 0.00 0.00 0.00 36.38 35.05 3mae s VAL 362 CO 0.09 0.38 1.45 -0.54 0.00 0.00 0.00 175.10 176.48 3mae s LYS 363 N 0.30 4.28 0.01 2.72 1.02 -1.26 -0.67 119.74 126.14 3mae s LYS 363 Ca -0.08 2.10 0.01 0.00 0.02 0.00 0.00 55.97 58.02 3mae s LYS 363 Cb -0.13 -3.42 -0.01 0.00 -0.52 0.00 0.00 37.83 33.74 3mae s LYS 363 CO 0.03 -0.55 -0.04 1.03 -0.92 0.00 0.00 175.35 174.90 3mae s ARG 364 N 1.85 0.32 0.26 1.68 0.52 -0.06 -4.94 118.95 118.59 3mae s ARG 364 Ca 0.66 -0.40 -0.29 0.00 -0.52 0.00 0.00 55.73 55.18 3mae s ARG 364 Cb -0.36 -0.15 -0.09 0.00 0.52 0.00 0.00 34.95 34.87 3mae s ARG 364 CO 0.29 0.03 1.15 -1.25 0.02 0.00 0.00 175.30 175.54 3mae s PRO 365 N -0.81 4.56 0.01 3.54 0.04 -1.26 -1.81 135.00 139.27 3mae s PRO 365 Ca -0.06 1.87 -0.09 0.00 0.04 0.00 0.00 61.00 62.77 3mae s PRO 365 Cb -0.06 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.30 3mae s PRO 365 CO -0.00 0.08 0.17 0.08 0.04 0.00 0.00 177.00 177.37 3mae s VAL 366 N -0.85 0.09 -0.35 -0.36 1.01 0.55 -4.96 120.40 115.53 3mae s VAL 366 Ca 0.47 -0.72 -0.14 0.00 0.00 0.00 0.00 61.98 61.59 3mae s VAL 366 Cb -0.33 -0.57 -0.01 0.00 0.00 0.00 0.00 36.38 35.47 3mae s VAL 366 CO 0.41 -0.40 0.30 -0.63 0.00 0.00 0.00 175.10 174.78 3mae s ILE 367 N -1.66 5.23 -0.17 2.22 -1.09 -1.26 -0.37 121.20 124.09 3mae s ILE 367 Ca -0.12 -0.19 0.01 0.00 -2.23 0.00 0.00 60.65 58.12 3mae s ILE 367 Cb -0.06 -3.79 0.03 0.00 -1.58 0.00 0.00 42.46 37.06 3mae s ILE 367 CO 0.01 -0.10 -0.16 -0.63 -1.23 0.00 0.00 174.94 172.83 3mae s ILE 368 N 1.84 1.81 -1.39 2.92 1.01 -0.36 -4.81 121.20 122.22 3mae s ILE 368 Ca 0.08 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 59.85 3mae s ILE 368 Cb -0.17 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.59 3mae s ILE 368 CO 0.11 0.42 0.44 0.47 0.00 0.00 0.00 174.94 176.38 3mae n ASP 369 N 4.68 -0.61 -1.13 3.58 8.00 -1.26 -0.80 116.55 129.01 3mae n ASP 369 Ca -0.18 -1.01 -0.15 0.00 0.71 0.00 0.00 54.79 54.16 3mae n ASP 369 Cb 0.49 -3.07 -0.06 0.00 -0.02 0.00 0.00 41.12 38.46 3mae n ASP 369 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3mae n ASP 370 N -2.96 -5.62 -4.61 -2.24 8.00 -1.26 -5.00 116.55 102.86 3mae n ASP 370 Ca -0.30 0.37 -0.25 0.00 0.71 0.00 0.00 54.79 55.31 3mae n ASP 370 Cb 0.68 -4.42 -0.08 0.00 -0.02 0.00 0.00 41.12 37.28 3mae n ASP 370 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 3mae s MET 371 N -3.24 2.19 -0.25 -1.24 -1.94 0.02 -5.11 119.30 109.74 3mae s MET 371 Ca 0.00 -1.30 -0.19 0.00 -1.71 0.00 0.00 55.69 52.49 3mae s MET 371 Cb 0.00 -2.18 -0.03 0.00 2.01 0.00 0.00 34.83 34.63 3mae s MET 371 CO 0.00 0.41 0.54 0.42 -0.01 0.00 0.00 175.02 176.39 3mae s ILE 372 N -1.94 5.06 0.15 2.53 1.01 -1.26 -1.22 121.20 125.53 3mae s ILE 372 Ca 0.28 0.96 0.09 0.00 0.00 0.00 0.00 60.65 61.98 3mae s ILE 372 Cb -0.08 -3.86 -0.04 0.00 0.01 0.00 0.00 42.46 38.49 3mae s ILE 372 CO 0.17 0.09 -0.21 0.00 0.00 0.00 0.00 174.94 175.00 3mae s ALA 373 N 2.22 2.09 -0.33 9.38 0.00 0.50 -4.92 121.76 130.70 3mae s ALA 373 Ca 0.23 -1.46 -0.16 0.00 0.00 0.00 0.00 51.96 50.57 3mae s ALA 373 Cb -0.16 -0.24 -0.02 0.00 0.00 0.00 0.00 23.12 22.71 3mae s ALA 373 CO 0.09 0.33 0.39 0.08 0.00 0.00 0.00 175.76 176.64 3mae s VAL 374 N -1.70 5.15 0.14 0.00 1.01 -1.26 -0.33 120.40 123.41 3mae s VAL 374 Ca 0.14 0.19 0.07 0.00 0.00 0.00 0.00 61.98 62.39 3mae s VAL 374 Cb -0.07 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.45 3mae s VAL 374 CO 0.07 -0.06 -0.16 -0.13 0.00 0.00 0.00 175.10 174.81 3mae s ARG 375 N 2.09 1.15 -0.91 2.72 1.81 -0.75 -4.94 118.95 120.11 3mae s ARG 375 Ca 0.13 -1.32 -0.19 0.00 -1.72 0.00 0.00 55.73 52.63 3mae s ARG 375 Cb -0.16 -1.11 0.12 0.00 -0.45 0.00 0.00 34.95 33.35 3mae s ARG 375 CO 0.12 0.22 1.13 -0.51 -0.68 0.00 0.00 175.30 175.58 3mae s ASP 376 N -2.57 6.58 0.11 0.23 -0.00 -1.26 -0.88 116.67 118.89 3mae s ASP 376 Ca 0.12 -1.92 -0.13 0.00 -0.00 0.00 0.00 52.55 50.63 3mae s ASP 376 Cb -0.05 -2.41 -0.06 0.00 -0.00 0.00 0.00 42.92 40.39 3mae s ASP 376 CO 0.05 -1.12 0.50 -0.04 -0.00 0.00 0.00 175.17 174.55 3mae s MET 377 N 2.95 3.92 -0.01 8.23 -1.94 0.15 -0.12 119.30 132.48 3mae s MET 377 Ca 0.33 0.40 0.01 0.00 -1.71 0.00 0.00 55.69 54.72 3mae s MET 377 Cb -0.06 -2.98 0.01 0.00 2.01 0.00 0.00 34.83 33.81 3mae s MET 377 CO -0.08 0.52 -0.04 0.54 -0.01 0.00 0.00 175.02 175.95 3mae s VAL 378 N -1.41 0.37 0.07 -6.03 0.11 0.29 -0.48 120.40 113.32 3mae s VAL 378 Ca 0.35 -0.14 -0.21 0.00 -2.93 0.00 0.00 61.98 59.05 3mae s VAL 378 Cb -0.15 -0.35 -0.06 0.00 -1.53 0.00 0.00 36.38 34.29 3mae s VAL 378 CO 0.18 0.13 0.64 0.20 -3.33 0.00 0.00 175.10 172.92 3mae s ASN 379 N 0.24 7.12 -0.21 3.54 0.01 -1.26 -0.12 114.94 124.26 3mae s ASN 379 Ca -0.02 1.33 -0.03 0.00 -0.71 0.00 0.00 52.86 53.42 3mae s ASN 379 Cb -0.06 -2.40 -0.01 0.00 0.41 0.00 0.00 41.25 39.19 3mae s ASN 379 CO -0.00 0.19 -0.06 -0.76 -1.51 0.00 0.00 177.10 174.96 3mae s LEU 380 N -0.76 2.83 -0.19 0.60 1.43 -0.34 -2.02 118.68 120.24 3mae s LEU 380 Ca 0.32 -0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 53.00 3mae s LEU 380 Cb -0.20 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.31 3mae s LEU 380 CO 0.20 -0.01 -0.13 0.00 0.23 0.00 0.00 176.35 176.65 3mae s LEU 382 N 1.26 2.33 -0.11 0.00 2.96 0.61 -0.14 118.68 125.59 3mae s LEU 382 Ca 0.03 -0.53 -0.10 0.00 -0.22 0.00 0.00 54.13 53.31 3mae s LEU 382 Cb -0.14 -1.52 -0.05 0.00 0.50 0.00 0.00 46.19 44.98 3mae s LEU 382 CO -0.06 0.07 0.22 -0.44 -1.32 0.00 0.00 176.35 174.82 3mae s SER 383 N 0.87 6.48 0.07 3.68 0.01 -0.68 -0.82 113.70 123.31 3mae s SER 383 Ca -0.05 0.57 0.08 0.00 1.31 0.00 0.00 55.95 57.86 3mae s SER 383 Cb -0.15 -2.13 -0.03 0.00 0.21 0.00 0.00 66.02 63.92 3mae s SER 383 CO -0.02 0.32 -0.22 0.27 0.41 0.00 0.00 173.24 174.01 3mae s ILE 384 N -0.69 1.76 -0.55 1.44 -4.36 0.23 -1.97 121.20 117.06 3mae s ILE 384 Ca 0.17 -1.38 -0.28 0.00 -0.26 0.00 0.00 60.65 58.90 3mae s ILE 384 Cb -0.13 -1.56 0.01 0.00 1.25 0.00 0.00 42.46 42.03 3mae s ILE 384 CO 0.06 0.11 1.45 -0.62 0.24 0.00 0.00 174.94 176.18 3mae s ASP 385 N -1.51 6.09 0.00 4.36 3.68 0.13 -2.00 116.67 127.42 3mae s ASP 385 Ca 0.08 0.36 0.20 0.00 2.13 0.00 0.00 52.55 55.32 3mae s ASP 385 Cb -0.09 -2.54 1.01 0.00 -1.45 0.00 0.00 42.92 39.85 3mae s ASP 385 CO 0.03 -1.72 1.62 1.57 0.13 0.00 0.00 175.17 176.80 3mae n HIS 386 N 9.71 0.00 0.11 -5.34 -0.00 -0.89 -1.46 115.22 117.35 3mae n HIS 386 Ca 0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.83 3mae n HIS 386 Cb 0.49 -0.28 0.20 0.00 -0.00 0.00 0.00 29.99 30.40 3mae n HIS 386 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3mae h ARG 387 N 0.00 0.15 0.02 1.57 3.08 -1.90 -3.36 114.38 113.94 3mae h ARG 387 Ca 0.00 -0.09 -0.39 0.00 0.07 0.00 0.00 59.98 59.57 3mae h ARG 387 Cb 0.18 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.18 3mae h ARG 387 CO 0.00 0.63 -2.38 -0.89 -1.07 0.00 0.00 179.97 176.26 3mae n ILE 388 N -3.93 1.54 -4.27 2.04 5.41 -0.54 -5.04 119.36 114.57 3mae n ILE 388 Ca -0.02 -0.55 -0.21 0.00 1.00 0.00 0.00 62.75 62.98 3mae n ILE 388 Cb 0.54 -1.54 -0.12 0.00 -0.71 0.00 0.00 39.64 37.82 3mae n ILE 388 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3mae s LEU 389 N -6.76 2.36 0.00 1.39 1.43 -0.54 -5.11 118.68 111.46 3mae s LEU 389 Ca -0.33 -0.76 0.00 0.00 -1.03 0.00 0.00 54.13 52.01 3mae s LEU 389 Cb 0.09 -0.71 -0.00 0.00 0.03 0.00 0.00 46.19 45.60 3mae s LEU 389 CO 0.61 -0.05 0.00 -0.90 0.23 0.00 0.00 176.35 176.25 3mae n ASP 390 N 0.75 2.68 0.13 2.29 3.85 -1.26 -4.22 116.55 120.76 3mae n ASP 390 Ca -0.17 -2.20 0.06 0.00 -0.71 0.00 0.00 54.79 51.77 3mae n ASP 390 Cb 0.55 0.21 0.53 0.00 -1.35 0.00 0.00 41.12 41.06 3mae n ASP 390 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 3mae h GLY 391 N 0.67 0.30 0.87 6.12 0.00 -2.00 -2.63 103.07 106.39 3mae h GLY 391 Ca -0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 3mae h GLY 391 CO 0.37 0.11 -0.17 -2.00 0.00 0.00 0.00 176.54 174.85 3mae h LEU 392 N 0.29 -0.40 -0.40 3.11 5.85 -1.98 0.22 115.31 121.99 3mae h LEU 392 Ca 0.08 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 3mae h LEU 392 Cb -0.03 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 3mae h LEU 392 CO -0.02 -0.17 0.10 -0.07 -0.34 0.00 0.00 178.44 177.94 3mae h LEU 393 N -0.61 0.60 -0.85 2.25 3.38 -1.97 -2.14 115.31 115.96 3mae h LEU 393 Ca -0.05 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.70 3mae h LEU 393 Cb 0.45 -0.16 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 3mae h LEU 393 CO 0.08 0.67 0.54 0.00 0.09 0.00 0.00 178.44 179.81 3mae h ALA 394 N 0.95 1.09 -0.55 1.53 0.00 -1.45 -0.33 119.26 120.50 3mae h ALA 394 Ca 0.13 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3mae h ALA 394 Cb 0.30 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3mae h ALA 394 CO -0.00 0.52 0.14 0.78 0.00 0.00 0.00 179.25 180.70 3mae h GLY 395 N 1.17 0.94 0.90 0.00 0.00 -0.51 -1.13 103.07 104.45 3mae h GLY 395 Ca 0.31 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 47.03 3mae h GLY 395 CO -0.06 0.55 0.08 0.50 0.00 0.00 0.00 176.54 177.61 3mae h LYS 396 N 0.78 0.49 -0.35 4.80 1.57 -1.08 -1.35 116.57 121.42 3mae h LYS 396 Ca 0.17 -0.11 0.02 0.00 -1.87 0.00 0.00 60.65 58.86 3mae h LYS 396 Cb 0.33 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.55 3mae h LYS 396 CO 0.00 0.55 0.19 0.35 -0.57 0.00 0.00 179.45 179.97 3mae h PHE 397 N 0.34 0.35 -0.17 -1.35 3.57 -1.00 -1.05 116.94 117.62 3mae h PHE 397 Ca 0.10 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.54 3mae h PHE 397 Cb 0.27 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.89 3mae h PHE 397 CO 0.01 0.20 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.01 3mae h LEU 398 N 0.39 0.29 -0.52 0.59 3.38 -1.13 -2.16 115.31 116.15 3mae h LEU 398 Ca 0.14 -0.08 -0.15 0.00 0.09 0.00 0.00 57.88 57.89 3mae h LEU 398 Cb 0.03 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3mae h LEU 398 CO -0.09 0.52 -0.38 -0.61 0.09 0.00 0.00 178.44 177.97 3mae h GLN 399 N 0.28 0.78 -0.34 1.13 5.75 -0.88 -0.87 115.11 120.95 3mae h GLN 399 Ca 0.05 -0.40 -0.01 0.00 -0.15 0.00 0.00 58.65 58.14 3mae h GLN 399 Cb 0.53 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.07 3mae h GLN 399 CO 0.04 1.03 0.18 0.00 -2.65 0.00 0.00 178.83 177.42 3mae h ALA 400 N 0.92 0.43 -0.60 3.38 0.00 -0.85 0.22 119.26 122.76 3mae h ALA 400 Ca 0.05 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3mae h ALA 400 Cb 0.94 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 3mae h ALA 400 CO 0.09 -0.03 0.26 0.82 0.00 0.00 0.00 179.25 180.38 3mae h ILE 401 N 0.42 1.22 -0.11 0.00 2.04 -1.31 -0.80 117.51 118.97 3mae h ILE 401 Ca 0.12 -0.68 0.03 0.00 1.00 0.00 0.00 64.86 65.33 3mae h ILE 401 Cb 0.08 0.55 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 3mae h ILE 401 CO -0.02 0.27 -0.09 0.50 0.00 0.00 0.00 178.15 178.81 3mae h LYS 402 N 0.83 -0.11 -0.81 2.37 3.64 -0.93 -0.64 116.57 120.92 3mae h LYS 402 Ca 0.20 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 3mae h LYS 402 Cb 0.18 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.98 3mae h LYS 402 CO -0.02 -0.07 0.45 0.00 -2.27 0.00 0.00 179.45 177.54 3mae h ALA 403 N 0.98 1.04 -0.94 5.00 0.00 -0.80 -0.27 119.26 124.26 3mae h ALA 403 Ca 0.08 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.89 3mae h ALA 403 Cb 0.22 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3mae h ALA 403 CO -0.18 0.54 0.62 -0.91 0.00 0.00 0.00 179.25 179.32 3mae h ASN 404 N 1.13 1.06 0.02 0.00 2.35 -0.76 -2.49 115.58 116.89 3mae h ASN 404 Ca 0.29 -0.02 -0.23 0.00 -0.55 0.00 0.00 56.30 55.79 3mae h ASN 404 Cb 0.02 -0.26 0.02 0.00 0.05 0.00 0.00 38.32 38.15 3mae h ASN 404 CO -0.05 0.76 -0.91 0.58 -1.65 0.00 0.00 177.43 176.16 3mae h VAL 405 N 1.25 1.34 0.00 2.81 2.07 -0.80 -3.33 116.25 119.59 3mae h VAL 405 Ca 0.35 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.65 3mae h VAL 405 Cb -0.10 2.52 0.00 0.00 -1.52 0.00 0.00 31.29 32.19 3mae h VAL 405 CO -0.09 0.67 0.00 -0.33 0.02 0.00 0.00 177.57 177.84 3mae h GLU 406 N 0.18 0.00 -0.00 1.57 5.08 -1.00 -2.67 114.58 117.74 3mae h GLU 406 Ca -0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3mae h GLU 406 Cb 1.59 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.84 3mae h GLU 406 CO 0.18 0.00 -0.15 0.36 -1.00 0.00 0.00 179.01 178.39 3mae n LYS 407 N -2.88 0.73 -2.12 2.33 2.85 -0.95 -4.91 118.16 113.23 3mae n LYS 407 Ca 0.02 -0.32 -0.42 0.00 -1.05 0.00 0.00 58.31 56.54 3mae n LYS 407 Cb 0.34 -1.49 -0.03 0.00 -0.65 0.00 0.00 35.03 33.20 3mae n LYS 407 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 3mae s ILE 408 N -2.48 3.74 0.05 0.58 1.01 -1.01 -4.73 121.20 118.36 3mae s ILE 408 Ca 0.27 0.92 -0.01 0.00 0.00 0.00 0.00 60.65 61.84 3mae s ILE 408 Cb 0.20 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 39.08 3mae s ILE 408 CO 0.49 -0.07 0.08 -1.54 0.00 0.00 0.00 174.94 173.90 3mae n SER 409 N 6.85 -0.23 -0.01 3.58 3.41 -1.26 -4.03 113.62 121.92 3mae n SER 409 Ca 0.16 -1.26 -0.02 0.00 -0.26 0.00 0.00 58.87 57.49 3mae n SER 409 Cb 0.43 0.42 0.25 0.00 -0.26 0.00 0.00 64.21 65.05 3mae n SER 409 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 3mae h LYS 410 N 0.00 0.54 0.03 4.33 -0.00 -1.92 -2.92 116.57 116.63 3mae h LYS 410 Ca -0.04 -0.14 -0.31 0.00 -0.00 0.00 0.00 60.65 60.16 3mae h LYS 410 Cb 0.17 -0.06 -0.04 0.00 -0.00 0.00 0.00 32.23 32.30 3mae h LYS 410 CO 0.06 0.62 -1.76 0.93 -0.00 0.00 0.00 179.45 179.30 3mae h GLU 411 N 0.51 0.07 0.01 0.07 5.08 -1.97 -3.38 114.58 114.96 3mae h GLU 411 Ca 0.10 -0.11 -0.24 0.00 -1.00 0.00 0.00 59.36 58.10 3mae h GLU 411 Cb 0.45 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.70 3mae h GLU 411 CO 0.02 0.67 -1.26 -0.91 -1.00 0.00 0.00 179.01 176.53 3mae h ASN 412 N 0.02 0.05 -3.41 1.42 4.21 -1.85 -3.46 115.58 112.56 3mae h ASN 412 Ca -0.31 -0.06 -0.65 0.00 1.21 0.00 0.00 56.30 56.49 3mae h ASN 412 Cb 2.02 -0.02 -0.25 0.00 -1.12 0.00 0.00 38.32 38.95 3mae h ASN 412 CO 0.08 1.05 -0.69 -0.89 -1.29 0.00 0.00 177.43 175.69 3mae s THR 413 N -2.67 3.67 -0.12 2.81 2.01 -1.10 -4.94 115.64 115.31 3mae s THR 413 Ca -0.02 -0.41 -0.01 0.00 0.31 0.00 0.00 61.69 61.56 3mae s THR 413 Cb 0.09 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.92 3mae s THR 413 CO 0.83 0.44 -0.07 0.00 -0.69 0.00 0.00 174.62 175.12 3mae s ALA 414 N 1.07 2.90 -0.33 7.40 0.00 -1.26 -4.83 121.76 126.70 3mae s ALA 414 Ca 0.01 -0.86 0.23 0.00 0.00 0.00 0.00 51.96 51.34 3mae s ALA 414 Cb -0.15 -1.36 0.42 0.00 0.00 0.00 0.00 23.12 22.04 3mae s ALA 414 CO 0.01 0.35 1.63 -0.07 0.00 0.00 0.00 175.76 177.68 3mae h LEU 415 N 6.20 0.00 -0.93 0.00 3.38 -1.99 -3.44 115.31 118.53 3mae h LEU 415 Ca -0.36 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.61 3mae h LEU 415 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 3mae h LEU 415 CO 0.57 0.07 0.00 -1.22 0.09 0.00 0.00 178.44 177.96