#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lxm n PRO 174 N 0.00 0.72 -4.02 -0.41 -0.02 -1.26 -5.01 135.00 125.00 1lxm n PRO 174 Ca 0.00 0.26 -0.12 0.00 -2.02 0.00 0.00 63.50 61.62 1lxm n PRO 174 Cb 0.00 -1.60 -0.12 0.00 -0.02 0.00 0.00 33.50 31.76 1lxm n PRO 174 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1lxm s GLN 175 N -1.63 0.36 1.08 -0.52 -0.21 -1.26 -4.87 119.66 112.61 1lxm s GLN 175 Ca 0.63 -0.51 -0.12 0.00 0.02 0.00 0.00 55.36 55.38 1lxm s GLN 175 Cb -0.62 -0.13 0.23 0.00 1.00 0.00 0.00 33.01 33.49 1lxm s GLN 175 CO 0.58 0.02 0.98 -0.35 -2.12 0.00 0.00 175.29 174.40 1lxm n PRO 176 N 1.98 -1.69 -3.76 2.91 -0.04 -1.14 -4.86 135.00 128.38 1lxm n PRO 176 Ca -0.20 -0.45 -0.37 0.00 -0.04 0.00 0.00 63.50 62.44 1lxm n PRO 176 Cb 0.56 -2.20 -0.12 0.00 -0.04 0.00 0.00 33.50 31.70 1lxm n PRO 176 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1lxm s VAL 177 N -2.47 3.41 0.31 0.52 1.01 -1.26 -5.09 120.40 116.82 1lxm s VAL 177 Ca 0.67 -1.85 -0.12 0.00 0.00 0.00 0.00 61.98 60.69 1lxm s VAL 177 Cb -0.24 -3.24 -0.08 0.00 0.00 0.00 0.00 36.38 32.83 1lxm s VAL 177 CO 0.63 -0.58 0.67 0.42 0.00 0.00 0.00 175.10 176.25 1lxm s THR 178 N 1.21 4.80 0.15 3.92 -4.23 -1.26 -5.06 115.64 115.17 1lxm s THR 178 Ca 0.05 0.67 -0.07 0.00 -1.18 0.00 0.00 61.69 61.17 1lxm s THR 178 Cb -0.22 -3.65 -0.02 0.00 1.34 0.00 0.00 72.50 69.95 1lxm s THR 178 CO -0.03 -0.23 0.21 0.42 -0.54 0.00 0.00 174.62 174.46 1lxm s THR 179 N -2.02 0.09 0.31 3.99 -4.23 -1.26 -5.19 115.64 107.33 1lxm s THR 179 Ca 0.51 -1.50 0.03 0.00 -1.18 0.00 0.00 61.69 59.55 1lxm s THR 179 Cb -0.11 -1.83 -0.05 0.00 1.34 0.00 0.00 72.50 71.85 1lxm s THR 179 CO 0.22 -0.39 0.08 0.00 -0.54 0.00 0.00 174.62 173.99 1lxm s GLN 180 N -3.97 1.59 0.35 3.99 0.00 -1.26 -5.04 119.66 115.31 1lxm s GLN 180 Ca 0.17 -1.89 -0.29 0.00 -0.00 0.00 0.00 55.36 53.36 1lxm s GLN 180 Cb 0.05 -0.59 -0.11 0.00 0.00 0.00 0.00 33.01 32.36 1lxm s GLN 180 CO -0.01 -0.27 1.48 0.42 0.00 0.00 0.00 175.29 176.91 1lxm s ILE 181 N -3.47 2.20 0.60 3.63 1.09 -1.26 -4.74 121.20 119.25 1lxm s ILE 181 Ca 0.36 0.19 -0.19 0.00 -1.10 0.00 0.00 60.65 59.91 1lxm s ILE 181 Cb 0.08 -3.12 -0.03 0.00 -1.06 0.00 0.00 42.46 38.32 1lxm s ILE 181 CO 0.15 0.04 1.23 -1.61 -0.10 0.00 0.00 174.94 174.65 1lxm s GLU 182 N -1.63 2.92 0.15 2.79 8.01 -1.26 -4.90 118.70 124.77 1lxm s GLU 182 Ca 0.55 1.90 0.23 0.00 0.01 0.00 0.00 54.97 57.66 1lxm s GLU 182 Cb -0.45 -1.95 0.09 0.00 -4.31 0.00 0.00 34.13 27.51 1lxm s GLU 182 CO 0.57 -1.27 1.10 1.63 0.01 0.00 0.00 175.26 177.30 1lxm n LYS 183 N -1.58 0.47 -3.55 1.61 5.02 -1.26 -4.88 118.16 113.99 1lxm n LYS 183 Ca 0.14 0.08 -0.08 0.00 -2.02 0.00 0.00 58.31 56.42 1lxm n LYS 183 Cb 0.49 -1.74 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 1lxm n LYS 183 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1lxm s SER 184 N -4.78 -0.33 -0.13 4.39 0.15 -1.26 -4.32 113.70 107.42 1lxm s SER 184 Ca 0.02 0.14 -0.00 0.00 0.70 0.00 0.00 55.95 56.81 1lxm s SER 184 Cb 0.12 0.31 0.02 0.00 -1.71 0.00 0.00 66.02 64.76 1lxm s SER 184 CO 0.78 -0.45 -0.10 -0.69 1.20 0.00 0.00 173.24 173.97 1lxm s VAL 185 N -2.27 1.26 -0.20 4.45 1.01 0.31 -4.97 120.40 120.00 1lxm s VAL 185 Ca 0.03 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.59 1lxm s VAL 185 Cb -0.01 -1.23 0.03 0.00 0.00 0.00 0.00 36.38 35.17 1lxm s VAL 185 CO -0.05 0.41 -0.17 0.20 0.00 0.00 0.00 175.10 175.49 1lxm s ASN 186 N 1.60 3.44 -0.01 3.32 0.01 -1.26 -0.92 114.94 121.12 1lxm s ASN 186 Ca 0.05 -0.83 0.01 0.00 -0.71 0.00 0.00 52.86 51.38 1lxm s ASN 186 Cb -0.13 -1.47 0.00 0.00 0.41 0.00 0.00 41.25 40.07 1lxm s ASN 186 CO -0.09 -0.06 -0.04 0.28 -1.51 0.00 0.00 177.10 175.68 1lxm s THR 187 N 1.26 0.37 0.46 1.60 -1.32 -0.74 -5.00 115.64 112.28 1lxm s THR 187 Ca 0.01 -0.16 -0.24 0.00 -1.21 0.00 0.00 61.69 60.10 1lxm s THR 187 Cb -0.15 -0.34 -0.07 0.00 -1.51 0.00 0.00 72.50 70.43 1lxm s THR 187 CO -0.11 0.13 1.23 0.00 -2.21 0.00 0.00 174.62 173.66 1lxm s ALA 188 N 0.15 3.03 0.31 11.08 0.00 -1.26 0.07 121.76 135.13 1lxm s ALA 188 Ca -0.01 1.08 0.04 0.00 0.00 0.00 0.00 51.96 53.07 1lxm s ALA 188 Cb -0.05 -3.44 0.65 0.00 0.00 0.00 0.00 23.12 20.28 1lxm s ALA 188 CO -0.00 -0.81 1.85 1.25 0.00 0.00 0.00 175.76 178.05 1lxm h LEU 189 N 2.15 0.83 -0.43 0.00 5.85 -1.41 -1.51 115.31 120.78 1lxm h LEU 189 Ca -0.50 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.27 1lxm h LEU 189 Cb 1.26 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 42.16 1lxm h LEU 189 CO 0.60 0.44 -0.19 -0.46 -0.34 0.00 0.00 178.44 178.49 1lxm n ASN 190 N -4.59 0.86 -4.74 1.25 2.04 -1.26 -4.41 115.26 104.40 1lxm n ASN 190 Ca 0.18 -0.82 -0.35 0.00 -0.44 0.00 0.00 54.58 53.14 1lxm n ASN 190 Cb 0.39 0.05 -0.08 0.00 -2.53 0.00 0.00 39.78 37.61 1lxm n ASN 190 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1lxm s LYS 191 N -2.45 3.51 -0.34 -3.83 1.02 -0.57 -4.81 119.74 112.26 1lxm s LYS 191 Ca 0.27 -0.28 -0.20 0.00 0.02 0.00 0.00 55.97 55.77 1lxm s LYS 191 Cb 0.20 -3.09 -0.00 0.00 -0.52 0.00 0.00 37.83 34.42 1lxm s LYS 191 CO 0.49 0.58 0.64 -0.80 -0.92 0.00 0.00 175.35 175.34 1lxm s ASN 192 N -0.49 6.46 -0.22 2.83 0.01 0.25 -4.39 114.94 119.39 1lxm s ASN 192 Ca 0.10 0.26 -0.28 0.00 -0.71 0.00 0.00 52.86 52.23 1lxm s ASN 192 Cb -0.12 -2.33 0.00 0.00 0.41 0.00 0.00 41.25 39.22 1lxm s ASN 192 CO 0.02 -0.56 0.98 -0.47 -1.51 0.00 0.00 177.10 175.56 1lxm s TYR 193 N 2.69 3.35 -0.40 2.20 5.04 -0.24 -4.48 117.35 125.51 1lxm s TYR 193 Ca 0.25 1.40 -0.16 0.00 -2.44 0.00 0.00 57.07 56.12 1lxm s TYR 193 Cb -0.15 -3.21 0.01 0.00 0.35 0.00 0.00 41.96 38.97 1lxm s TYR 193 CO 0.14 -0.43 0.35 0.08 -1.34 0.00 0.00 175.55 174.35 1lxm s VAL 194 N 2.99 5.19 0.42 3.14 1.01 -1.26 -0.01 120.40 131.88 1lxm s VAL 194 Ca 0.42 -0.40 -0.26 0.00 0.00 0.00 0.00 61.98 61.74 1lxm s VAL 194 Cb -0.15 -3.93 -0.09 0.00 0.00 0.00 0.00 36.38 32.21 1lxm s VAL 194 CO 0.07 -0.29 1.34 -0.36 0.00 0.00 0.00 175.10 175.87 1lxm s PHE 195 N 1.90 2.70 0.26 5.22 0.08 -0.68 -4.93 117.98 122.53 1lxm s PHE 195 Ca 0.09 1.36 -0.04 0.00 0.12 0.00 0.00 56.93 58.46 1lxm s PHE 195 Cb -0.18 -3.75 0.52 0.00 -0.57 0.00 0.00 43.02 39.04 1lxm s PHE 195 CO 0.12 -2.36 1.65 -0.91 -0.10 0.00 0.00 175.22 173.61 1lxm h ASN 196 N 2.57 -0.18 -3.33 1.36 2.35 -1.90 -3.40 115.58 113.05 1lxm h ASN 196 Ca -0.50 0.19 -0.64 0.00 -0.55 0.00 0.00 56.30 54.80 1lxm h ASN 196 Cb 1.25 0.29 -0.22 0.00 0.05 0.00 0.00 38.32 39.70 1lxm h ASN 196 CO 0.62 -0.14 -0.67 -0.54 -1.65 0.00 0.00 177.43 175.05 1lxm s LYS 197 N -6.05 3.65 0.83 0.81 -0.14 -1.26 -4.97 119.74 112.62 1lxm s LYS 197 Ca -0.13 -0.52 -0.11 0.00 -1.36 0.00 0.00 55.97 53.84 1lxm s LYS 197 Cb 0.23 -2.94 0.19 0.00 -1.68 0.00 0.00 37.83 33.63 1lxm s LYS 197 CO 0.76 0.19 1.14 0.00 -0.76 0.00 0.00 175.35 176.68 1lxm n ALA 198 N 3.68 -0.99 -0.66 5.17 0.00 -1.26 -4.24 120.51 122.21 1lxm n ALA 198 Ca -0.17 -1.64 0.00 0.00 0.00 0.00 0.00 53.44 51.63 1lxm n ALA 198 Cb 0.52 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1lxm n ALA 198 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1lxm n ASP 199 N -3.56 0.00 -4.96 0.00 8.00 -1.26 -4.97 116.55 109.80 1lxm n ASP 199 Ca 0.15 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.44 1lxm n ASP 199 Cb 0.53 -1.60 -0.02 0.00 -0.02 0.00 0.00 41.12 40.01 1lxm n ASP 199 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1lxm s TYR 200 N -2.05 3.46 -0.21 1.24 2.02 -1.26 -4.86 117.35 115.69 1lxm s TYR 200 Ca 0.00 0.05 -0.10 0.00 -0.37 0.00 0.00 57.07 56.64 1lxm s TYR 200 Cb 0.00 -1.63 -0.05 0.00 -0.40 0.00 0.00 41.96 39.88 1lxm s TYR 200 CO 0.00 0.39 0.15 -1.14 -1.57 0.00 0.00 175.55 173.37 1lxm s GLN 201 N -4.03 4.17 -0.03 -0.62 0.74 -0.46 -4.70 119.66 114.72 1lxm s GLN 201 Ca 0.35 -0.21 0.07 0.00 0.05 0.00 0.00 55.36 55.62 1lxm s GLN 201 Cb -0.09 -3.45 -0.02 0.00 1.10 0.00 0.00 33.01 30.55 1lxm s GLN 201 CO 0.30 0.24 -0.23 0.71 -0.55 0.00 0.00 175.29 175.76 1lxm s TYR 202 N 0.52 2.43 -0.11 1.67 1.51 -1.26 -1.34 117.35 120.77 1lxm s TYR 202 Ca 0.08 -0.40 -0.09 0.00 -1.01 0.00 0.00 57.07 55.66 1lxm s TYR 202 Cb -0.12 -1.54 0.03 0.00 -0.11 0.00 0.00 41.96 40.22 1lxm s TYR 202 CO -0.00 -0.00 0.27 0.95 -1.11 0.00 0.00 175.55 175.66 1lxm s THR 203 N -0.60 -0.01 -0.07 -0.71 -4.23 -1.04 -4.95 115.64 104.04 1lxm s THR 203 Ca 0.09 0.03 -0.16 0.00 -1.18 0.00 0.00 61.69 60.47 1lxm s THR 203 Cb -0.10 -0.39 -0.05 0.00 1.34 0.00 0.00 72.50 73.29 1lxm s THR 203 CO -0.00 0.01 0.43 -0.76 -0.54 0.00 0.00 174.62 173.76 1lxm s LEU 204 N 0.41 4.37 0.00 4.79 1.02 -1.26 -1.14 118.68 126.86 1lxm s LEU 204 Ca -0.02 0.86 0.14 0.00 0.02 0.00 0.00 54.13 55.13 1lxm s LEU 204 Cb -0.04 -2.62 0.77 0.00 0.02 0.00 0.00 46.19 44.32 1lxm s LEU 204 CO -0.02 0.16 1.36 0.35 0.02 0.00 0.00 176.35 178.22 1lxm n THR 205 N 2.81 0.41 -3.45 5.49 -2.24 -0.65 -3.68 114.28 112.97 1lxm n THR 205 Ca -0.11 0.10 -0.27 0.00 -2.27 0.00 0.00 64.05 61.51 1lxm n THR 205 Cb 0.52 -0.87 -0.12 0.00 -2.10 0.00 0.00 70.33 67.76 1lxm n THR 205 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1lxm s ASN 206 N -2.39 2.71 0.64 3.42 3.04 -1.26 -4.99 114.94 116.11 1lxm s ASN 206 Ca 0.16 -1.94 0.30 0.00 0.04 0.00 0.00 52.86 51.42 1lxm s ASN 206 Cb 0.10 -0.21 1.65 0.00 -1.54 0.00 0.00 41.25 41.25 1lxm s ASN 206 CO 0.20 -0.32 1.92 -0.65 -3.04 0.00 0.00 177.10 175.22 1lxm h PRO 207 N 7.22 0.00 0.41 0.43 0.11 -1.87 -2.98 132.00 135.33 1lxm h PRO 207 Ca 0.02 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 66.11 1lxm h PRO 207 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1lxm h PRO 207 CO 0.27 0.00 -0.20 0.66 -0.21 0.00 0.00 178.00 178.52 1lxm h SER 208 N 0.00 -0.47 -0.65 -2.05 4.64 -1.94 -3.23 113.55 109.85 1lxm h SER 208 Ca 0.00 -0.11 0.19 0.00 -0.47 0.00 0.00 61.79 61.39 1lxm h SER 208 Cb 0.58 0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.77 1lxm h SER 208 CO 0.00 -0.08 1.10 0.18 -0.87 0.00 0.00 176.83 177.16 1lxm n LEU 209 N -5.19 0.00 0.00 5.97 4.77 -1.12 -3.98 117.00 117.45 1lxm n LEU 209 Ca -0.10 0.64 0.00 0.00 -0.03 0.00 0.00 56.01 56.52 1lxm n LEU 209 Cb 0.29 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1lxm n LEU 209 CO 0.28 -0.64 0.00 0.61 -1.33 0.00 0.00 177.39 176.31 1lxm n GLY 210 N -1.60 0.79 3.27 -0.72 0.00 -1.22 -0.55 105.19 105.16 1lxm n GLY 210 Ca 0.15 -0.98 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 1lxm n GLY 210 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lxm s LYS 211 N -2.00 2.98 -0.14 1.61 2.20 -0.57 -4.79 119.74 119.03 1lxm s LYS 211 Ca 0.00 -0.91 -0.19 0.00 -0.36 0.00 0.00 55.97 54.51 1lxm s LYS 211 Cb 0.00 -3.18 -0.04 0.00 -1.51 0.00 0.00 37.83 33.10 1lxm s LYS 211 CO 0.00 -0.42 0.54 0.42 -0.36 0.00 0.00 175.35 175.54 1lxm s ILE 212 N 1.41 5.13 -0.28 5.43 1.01 -1.26 -0.98 121.20 131.66 1lxm s ILE 212 Ca 0.01 1.06 0.01 0.00 0.00 0.00 0.00 60.65 61.74 1lxm s ILE 212 Cb -0.17 -3.87 0.08 0.00 0.01 0.00 0.00 42.46 38.50 1lxm s ILE 212 CO -0.01 0.26 -0.00 -0.69 0.00 0.00 0.00 174.94 174.49 1lxm s VAL 213 N 1.02 1.62 0.00 2.92 1.01 -0.19 -4.99 120.40 121.78 1lxm s VAL 213 Ca 0.28 -1.54 0.00 0.00 0.00 0.00 0.00 61.98 60.71 1lxm s VAL 213 Cb -0.16 -2.01 0.00 0.00 0.00 0.00 0.00 36.38 34.22 1lxm s VAL 213 CO 0.11 -0.32 0.00 0.61 0.00 0.00 0.00 175.10 175.50 1lxm n GLY 214 N 4.59 3.41 1.18 4.51 0.00 -1.26 -2.27 105.19 115.35 1lxm n GLY 214 Ca -0.06 -0.10 0.08 0.00 0.00 0.00 0.00 46.02 45.93 1lxm n GLY 214 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lxm n GLY 215 N 0.00 3.50 3.26 -0.02 0.00 -1.26 -4.42 105.19 106.25 1lxm n GLY 215 Ca 0.00 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 44.83 1lxm n GLY 215 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lxm s ILE 216 N -2.48 1.74 -0.15 -0.61 1.01 -0.96 -1.69 121.20 118.05 1lxm s ILE 216 Ca 0.44 -1.13 -0.02 0.00 0.00 0.00 0.00 60.65 59.94 1lxm s ILE 216 Cb 0.33 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 1lxm s ILE 216 CO 0.13 0.32 -0.08 -0.22 0.00 0.00 0.00 174.94 175.09 1lxm s LEU 217 N -0.96 2.95 -0.57 2.97 2.96 0.99 -1.02 118.68 126.00 1lxm s LEU 217 Ca 0.08 -0.26 -0.09 0.00 -0.22 0.00 0.00 54.13 53.64 1lxm s LEU 217 Cb -0.09 -1.70 0.15 0.00 0.50 0.00 0.00 46.19 45.05 1lxm s LEU 217 CO 0.01 0.14 0.45 -0.31 -1.32 0.00 0.00 176.35 175.32 1lxm s TYR 218 N 0.51 3.47 0.45 5.38 2.02 -0.16 -1.08 117.35 127.94 1lxm s TYR 218 Ca -0.06 -2.01 -0.23 0.00 -0.37 0.00 0.00 57.07 54.40 1lxm s TYR 218 Cb -0.15 -3.53 -0.10 0.00 -0.40 0.00 0.00 41.96 37.79 1lxm s TYR 218 CO 0.03 -0.97 0.95 -2.30 -1.57 0.00 0.00 175.55 171.69 1lxm n PRO 219 N 4.51 1.19 0.00 -1.71 -0.02 -1.26 -1.51 135.00 136.20 1lxm n PRO 219 Ca -0.02 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1lxm n PRO 219 Cb 0.41 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1lxm n PRO 219 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1lxm n ASN 220 N 0.40 2.32 -4.41 2.55 2.85 0.29 -4.80 115.26 114.45 1lxm n ASN 220 Ca 0.10 0.00 -0.21 0.00 -0.11 0.00 0.00 54.58 54.36 1lxm n ASN 220 Cb 0.41 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.32 1lxm n ASN 220 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1lxm s ALA 221 N -1.68 2.37 0.22 5.20 0.00 -0.43 -4.94 121.76 122.49 1lxm s ALA 221 Ca 0.00 -1.81 0.05 0.00 0.00 0.00 0.00 51.96 50.20 1lxm s ALA 221 Cb 0.00 -0.07 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 1lxm s ALA 221 CO 0.00 0.10 0.31 -0.08 0.00 0.00 0.00 175.76 176.09 1lxm s THR 222 N -2.82 5.12 -3.60 0.00 -1.32 -1.26 -4.68 115.64 107.08 1lxm s THR 222 Ca 0.27 -1.00 0.00 0.00 -1.21 0.00 0.00 61.69 59.75 1lxm s THR 222 Cb -0.01 -3.75 0.00 0.00 -1.51 0.00 0.00 72.50 67.24 1lxm s THR 222 CO 0.11 -0.28 0.00 0.61 -2.21 0.00 0.00 174.62 172.85 1lxm n GLY 223 N -1.18 0.92 3.57 6.08 0.00 0.13 -4.88 105.19 109.84 1lxm n GLY 223 Ca -0.08 -2.05 -0.33 0.00 0.00 0.00 0.00 46.02 43.56 1lxm n GLY 223 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lxm s SER 224 N -1.21 4.52 0.00 1.61 0.01 -1.26 0.10 113.70 117.47 1lxm s SER 224 Ca 0.00 -0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.13 1lxm s SER 224 Cb 0.00 -1.05 0.00 0.00 0.21 0.00 0.00 66.02 65.18 1lxm s SER 224 CO 0.00 0.31 0.00 1.07 0.41 0.00 0.00 173.24 175.03 1lxm n THR 225 N 1.82 0.00 -4.08 1.44 5.66 0.48 -4.96 114.28 114.64 1lxm n THR 225 Ca -0.16 0.00 -0.14 0.00 -3.05 0.00 0.00 64.05 60.70 1lxm n THR 225 Cb 0.53 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.17 1lxm n THR 225 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1lxm s THR 226 N -2.38 0.38 -0.22 1.09 -4.23 -1.26 -0.64 115.64 108.37 1lxm s THR 226 Ca 0.00 -0.52 -0.05 0.00 -1.18 0.00 0.00 61.69 59.94 1lxm s THR 226 Cb 0.00 -0.39 -0.02 0.00 1.34 0.00 0.00 72.50 73.44 1lxm s THR 226 CO 0.00 -0.11 -0.00 0.54 -0.54 0.00 0.00 174.62 174.51 1lxm s VAL 227 N -0.62 3.74 -0.29 2.29 0.11 0.11 -1.64 120.40 124.11 1lxm s VAL 227 Ca -0.03 -0.37 -0.18 0.00 -2.93 0.00 0.00 61.98 58.46 1lxm s VAL 227 Cb -0.05 -2.71 -0.02 0.00 -1.53 0.00 0.00 36.38 32.07 1lxm s VAL 227 CO -0.00 0.40 0.52 -0.54 -3.33 0.00 0.00 175.10 172.15 1lxm s LYS 228 N 1.39 3.93 -0.22 1.54 1.02 -0.30 -0.96 119.74 126.14 1lxm s LYS 228 Ca 0.05 0.17 -0.13 0.00 0.02 0.00 0.00 55.97 56.08 1lxm s LYS 228 Cb -0.15 -3.70 -0.05 0.00 -0.52 0.00 0.00 37.83 33.42 1lxm s LYS 228 CO -0.00 -0.45 0.27 0.42 -0.92 0.00 0.00 175.35 174.67 1lxm s ILE 229 N 2.35 5.29 0.19 2.17 1.01 -0.52 -2.50 121.20 129.20 1lxm s ILE 229 Ca 0.21 0.41 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1lxm s ILE 229 Cb -0.15 -3.60 -0.04 0.00 0.01 0.00 0.00 42.46 38.67 1lxm s ILE 229 CO 0.11 0.30 0.08 -0.94 0.00 0.00 0.00 174.94 174.49 1lxm s SER 230 N 1.05 0.63 0.64 3.58 1.04 -0.45 -0.44 113.70 119.76 1lxm s SER 230 Ca 0.13 -1.30 0.06 0.00 0.48 0.00 0.00 55.95 55.31 1lxm s SER 230 Cb -0.14 0.26 0.11 0.00 0.10 0.00 0.00 66.02 66.35 1lxm s SER 230 CO 0.06 -0.74 0.87 -0.90 0.98 0.00 0.00 173.24 173.52 1lxm n ASP 231 N -0.27 1.86 0.21 7.02 5.68 -0.87 -1.36 116.55 128.83 1lxm n ASP 231 Ca -0.02 -2.41 0.08 0.00 -0.50 0.00 0.00 54.79 51.94 1lxm n ASP 231 Cb 0.65 -0.50 0.46 0.00 -1.14 0.00 0.00 41.12 40.58 1lxm n ASP 231 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1lxm h LYS 232 N 0.00 0.00 0.00 0.11 2.10 -1.91 -1.75 116.57 115.12 1lxm h LYS 232 Ca -0.29 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.27 1lxm h LYS 232 Cb 1.24 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.56 1lxm h LYS 232 CO 0.38 0.28 -0.42 0.66 -2.00 0.00 0.00 179.45 178.34 1lxm h SER 233 N 0.00 0.00 0.00 7.07 4.64 -2.02 -3.47 113.55 119.77 1lxm h SER 233 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1lxm h SER 233 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1lxm h SER 233 CO 0.04 0.42 0.00 0.61 -0.87 0.00 0.00 176.83 177.03 1lxm n GLY 234 N 0.16 2.36 3.75 -0.77 0.00 -0.66 -5.09 105.19 104.94 1lxm n GLY 234 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 1lxm n GLY 234 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lxm s LYS 235 N -0.31 4.11 -0.56 1.61 2.20 -1.26 -4.63 119.74 120.90 1lxm s LYS 235 Ca 0.00 2.59 -0.28 0.00 -0.36 0.00 0.00 55.97 57.92 1lxm s LYS 235 Cb 0.00 -3.01 0.03 0.00 -1.51 0.00 0.00 37.83 33.34 1lxm s LYS 235 CO 0.00 -0.63 1.16 0.42 -0.36 0.00 0.00 175.35 175.94 1lxm s ILE 236 N -0.15 4.08 0.08 5.43 1.01 -1.26 -2.04 121.20 128.34 1lxm s ILE 236 Ca 0.62 0.89 -0.19 0.00 0.00 0.00 0.00 60.65 61.96 1lxm s ILE 236 Cb -0.48 -4.69 -0.10 0.00 0.01 0.00 0.00 42.46 37.20 1lxm s ILE 236 CO 0.50 -1.28 1.50 0.40 0.00 0.00 0.00 174.94 176.07 1lxm h ILE 237 N 6.15 1.26 -3.52 2.92 2.04 -1.09 -3.48 117.51 121.79 1lxm h ILE 237 Ca -0.25 -0.90 -0.10 0.00 1.00 0.00 0.00 64.86 64.61 1lxm h ILE 237 Cb 1.06 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 38.50 1lxm h ILE 237 CO 1.17 0.28 0.02 -0.75 0.00 0.00 0.00 178.15 178.87 1lxm s LYS 238 N -4.95 1.89 -0.21 2.37 2.20 -0.89 -5.02 119.74 115.13 1lxm s LYS 238 Ca -0.14 -1.43 -0.04 0.00 -0.36 0.00 0.00 55.97 54.01 1lxm s LYS 238 Cb 0.07 0.53 0.10 0.00 -1.51 0.00 0.00 37.83 37.01 1lxm s LYS 238 CO 0.74 -0.83 0.23 -1.21 -0.36 0.00 0.00 175.35 173.92 1lxm s GLU 239 N -3.21 0.20 -0.00 4.03 2.02 -1.26 -1.44 118.70 119.03 1lxm s GLU 239 Ca 0.21 0.20 0.00 0.00 0.02 0.00 0.00 54.97 55.41 1lxm s GLU 239 Cb -0.03 -1.17 -0.04 0.00 0.10 0.00 0.00 34.13 32.99 1lxm s GLU 239 CO 0.13 -0.67 0.05 0.08 0.02 0.00 0.00 175.26 174.87 1lxm s VAL 240 N 2.33 4.51 0.14 2.63 1.01 -0.14 -4.93 120.40 125.95 1lxm s VAL 240 Ca 0.07 -0.48 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1lxm s VAL 240 Cb -0.16 -3.04 -0.07 0.00 0.00 0.00 0.00 36.38 33.11 1lxm s VAL 240 CO -0.13 0.36 1.13 -2.84 0.00 0.00 0.00 175.10 173.63 1lxm s PRO 241 N -1.66 4.54 -0.00 2.72 0.02 -1.26 -0.71 135.00 138.65 1lxm s PRO 241 Ca 0.21 1.74 0.02 0.00 0.02 0.00 0.00 61.00 62.99 1lxm s PRO 241 Cb -0.12 -3.30 -0.01 0.00 0.02 0.00 0.00 34.50 31.10 1lxm s PRO 241 CO 0.12 -0.04 -0.06 -1.17 -0.33 0.00 0.00 177.00 175.53 1lxm s LEU 242 N 0.10 2.03 -0.18 -5.54 0.20 0.19 -0.53 118.68 114.94 1lxm s LEU 242 Ca 0.52 -0.13 -0.12 0.00 0.69 0.00 0.00 54.13 55.09 1lxm s LEU 242 Cb -0.29 -0.27 0.06 0.00 -0.43 0.00 0.00 46.19 45.26 1lxm s LEU 242 CO 0.33 0.04 0.46 -0.94 -0.29 0.00 0.00 176.35 175.96 1lxm s SER 243 N -0.24 -0.56 -0.08 3.68 1.04 -0.09 0.18 113.70 117.63 1lxm s SER 243 Ca 0.01 0.98 -0.26 0.00 0.48 0.00 0.00 55.95 57.16 1lxm s SER 243 Cb -0.03 0.89 -0.03 0.00 0.10 0.00 0.00 66.02 66.96 1lxm s SER 243 CO -0.00 -0.19 0.82 -0.69 0.98 0.00 0.00 173.24 174.16 1lxm s VAL 244 N 1.12 4.95 0.18 5.02 1.01 0.28 -1.78 120.40 131.18 1lxm s VAL 244 Ca -0.07 1.68 0.01 0.00 0.00 0.00 0.00 61.98 63.60 1lxm s VAL 244 Cb -0.07 -4.15 0.01 0.00 0.00 0.00 0.00 36.38 32.17 1lxm s VAL 244 CO -0.10 0.16 0.09 0.35 0.00 0.00 0.00 175.10 175.60 1lxm n THR 245 N 4.08 0.00 -1.57 3.92 -2.24 0.11 0.20 114.28 118.78 1lxm n THR 245 Ca 0.02 -0.78 -0.48 0.00 -2.27 0.00 0.00 64.05 60.54 1lxm n THR 245 Cb 0.51 -0.15 -0.04 0.00 -2.10 0.00 0.00 70.33 68.55 1lxm n THR 245 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1lxm n ALA 246 N -2.54 -0.92 -1.77 6.98 0.00 -1.26 -1.49 120.51 119.51 1lxm n ALA 246 Ca -0.07 0.46 -0.39 0.00 0.00 0.00 0.00 53.44 53.44 1lxm n ALA 246 Cb 0.22 -1.99 -0.04 0.00 0.00 0.00 0.00 19.45 17.64 1lxm n ALA 246 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1lxm s SER 247 N -0.14 6.99 -0.03 0.00 0.15 -1.26 -4.09 113.70 115.32 1lxm s SER 247 Ca 0.71 2.30 0.14 0.00 0.70 0.00 0.00 55.95 59.80 1lxm s SER 247 Cb -0.85 -2.62 0.44 0.00 -1.71 0.00 0.00 66.02 61.28 1lxm s SER 247 CO 0.54 -0.34 1.35 0.35 1.20 0.00 0.00 173.24 176.33 1lxm n THR 248 N 0.75 0.84 -1.80 6.45 -2.24 -1.26 -4.93 114.28 112.09 1lxm n THR 248 Ca 0.01 -0.69 -0.42 0.00 -2.27 0.00 0.00 64.05 60.68 1lxm n THR 248 Cb 0.45 0.21 -0.03 0.00 -2.10 0.00 0.00 70.33 68.86 1lxm n THR 248 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1lxm s GLU 249 N -1.48 4.15 0.00 -0.78 2.12 -1.26 -4.82 118.70 116.63 1lxm s GLU 249 Ca 0.33 2.53 0.00 0.00 0.36 0.00 0.00 54.97 58.18 1lxm s GLU 249 Cb 0.19 -3.12 0.00 0.00 0.26 0.00 0.00 34.13 31.45 1lxm s GLU 249 CO 0.20 -0.71 0.00 -0.40 -0.54 0.00 0.00 175.26 173.81 1lxm n ASP 250 N 4.06 0.00 0.15 -1.70 5.68 -1.26 -5.01 116.55 118.46 1lxm n ASP 250 Ca 0.15 -0.10 0.01 0.00 -0.50 0.00 0.00 54.79 54.35 1lxm n ASP 250 Cb 0.36 0.00 0.33 0.00 -1.14 0.00 0.00 41.12 40.67 1lxm n ASP 250 CO 0.00 0.00 0.00 0.78 -1.33 0.00 0.00 177.20 176.65 1lxm h ASN 251 N 0.00 0.12 0.28 -1.12 2.35 -1.99 -2.55 115.58 112.67 1lxm h ASN 251 Ca 0.00 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.70 1lxm h ASN 251 Cb 0.00 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.34 1lxm h ASN 251 CO 0.00 0.45 -0.14 -0.26 -1.65 0.00 0.00 177.43 175.83 1lxm h PHE 252 N 0.11 -0.35 -0.39 1.19 0.04 -1.94 -1.96 116.94 113.63 1lxm h PHE 252 Ca 0.01 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.75 1lxm h PHE 252 Cb 0.63 0.12 -0.02 0.00 2.20 0.00 0.00 35.95 38.88 1lxm h PHE 252 CO 0.01 -0.13 0.13 1.79 -0.60 0.00 0.00 178.31 179.51 1lxm h THR 253 N -0.51 1.16 -0.77 -1.55 1.35 -1.84 0.81 112.91 111.57 1lxm h THR 253 Ca -0.04 -0.55 -0.04 0.00 -0.55 0.00 0.00 66.41 65.23 1lxm h THR 253 Cb 0.38 0.73 -0.03 0.00 -1.73 0.00 0.00 68.15 67.49 1lxm h THR 253 CO 0.06 0.21 0.31 0.11 -0.25 0.00 0.00 175.52 175.96 1lxm h LYS 254 N 0.56 1.15 -0.03 4.72 1.79 -1.30 -0.70 116.57 122.77 1lxm h LYS 254 Ca 0.14 -0.20 -0.15 0.00 -2.18 0.00 0.00 60.65 58.26 1lxm h LYS 254 Cb 0.16 -0.19 -0.02 0.00 -1.58 0.00 0.00 32.23 30.61 1lxm h LYS 254 CO -0.01 0.93 -0.66 -0.07 -1.08 0.00 0.00 179.45 178.56 1lxm h LEU 255 N 1.12 0.13 -0.28 2.94 3.38 -0.46 -2.08 115.31 120.06 1lxm h LEU 255 Ca 0.26 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1lxm h LEU 255 Cb 0.20 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1lxm h LEU 255 CO -0.02 0.75 0.05 -0.07 0.09 0.00 0.00 178.44 179.24 1lxm h LEU 256 N 0.08 0.45 -0.55 1.67 3.38 -0.29 -1.06 115.31 118.98 1lxm h LEU 256 Ca -0.01 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.72 1lxm h LEU 256 Cb 1.18 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.78 1lxm h LEU 256 CO 0.09 0.59 0.35 0.44 0.09 0.00 0.00 178.44 180.00 1lxm h ASP 257 N 0.29 0.60 -0.56 -0.43 3.45 -1.03 -1.13 116.42 117.60 1lxm h ASP 257 Ca 0.09 -0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.51 1lxm h ASP 257 Cb 0.33 -0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 38.93 1lxm h ASP 257 CO 0.00 0.43 0.28 0.50 -1.57 0.00 0.00 179.24 178.89 1lxm h LYS 258 N 0.71 0.84 -0.17 3.56 3.64 -1.19 -0.81 116.57 123.15 1lxm h LYS 258 Ca 0.21 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1lxm h LYS 258 Cb -0.05 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 1lxm h LYS 258 CO -0.06 0.65 0.09 2.35 -2.27 0.00 0.00 179.45 180.21 1lxm h TRP 259 N 0.84 0.24 -0.57 1.91 2.91 -0.39 -0.80 115.95 120.09 1lxm h TRP 259 Ca 0.21 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.23 1lxm h TRP 259 Cb 0.09 -0.07 -0.03 0.00 -0.51 0.00 0.00 29.16 28.64 1lxm h TRP 259 CO 0.01 0.24 0.37 -0.91 -1.03 0.00 0.00 178.44 177.12 1lxm h ASN 260 N 0.17 0.64 -0.89 2.65 2.35 -0.61 -1.21 115.58 118.67 1lxm h ASN 260 Ca 0.06 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 1lxm h ASN 260 Cb 0.08 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.25 1lxm h ASN 260 CO -0.01 0.46 0.52 0.44 -1.65 0.00 0.00 177.43 177.19 1lxm h ASP 261 N 0.76 1.08 -0.28 5.81 3.32 -0.94 0.20 116.42 126.37 1lxm h ASP 261 Ca 0.21 -0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.08 1lxm h ASP 261 Cb -0.07 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.20 1lxm h ASP 261 CO -0.05 0.85 -0.22 0.58 -1.72 0.00 0.00 179.24 178.67 1lxm h VAL 262 N 1.23 1.30 0.01 -1.35 2.07 -0.70 -2.35 116.25 116.46 1lxm h VAL 262 Ca 0.32 -1.37 -0.15 0.00 0.82 0.00 0.00 66.70 66.31 1lxm h VAL 262 Cb -0.02 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 1lxm h VAL 262 CO -0.06 0.44 -0.83 0.71 0.02 0.00 0.00 177.57 177.85 1lxm h THR 263 N 0.38 1.23 0.00 2.57 1.35 -1.13 -3.43 112.91 113.88 1lxm h THR 263 Ca 0.05 -2.25 -0.33 0.00 -0.55 0.00 0.00 66.41 63.33 1lxm h THR 263 Cb 0.78 2.66 -0.05 0.00 -1.73 0.00 0.00 68.15 69.81 1lxm h THR 263 CO 0.06 0.44 -1.83 -0.38 -0.25 0.00 0.00 175.52 173.55 1lxm n ILE 264 N -4.47 1.53 -3.29 6.82 2.08 0.50 -4.72 119.36 117.81 1lxm n ILE 264 Ca -0.24 -0.18 -0.17 0.00 0.56 0.00 0.00 62.75 62.72 1lxm n ILE 264 Cb 0.62 -1.99 0.06 0.00 -0.75 0.00 0.00 39.64 37.59 1lxm n ILE 264 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1lxm n GLY 265 N 1.35 -0.15 0.29 7.39 0.00 -0.04 -2.96 105.19 111.07 1lxm n GLY 265 Ca -0.41 0.01 0.14 0.00 0.00 0.00 0.00 46.02 45.76 1lxm n GLY 265 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1lxm h ASN 266 N -1.95 0.00 0.53 1.61 -0.26 -1.84 -1.17 115.58 112.50 1lxm h ASN 266 Ca -0.42 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.32 1lxm h ASN 266 Cb 1.27 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.53 1lxm h ASN 266 CO 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 176.78 1lxm n TYR 267 N -3.92 0.00 -1.47 1.19 4.11 -1.26 -2.72 117.16 113.09 1lxm n TYR 267 Ca -0.03 0.00 0.07 0.00 -0.00 0.00 0.00 57.90 57.94 1lxm n TYR 267 Cb 0.09 -0.46 0.16 0.00 -0.00 0.00 0.00 39.34 39.13 1lxm n TYR 267 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 1lxm n VAL 268 N -1.46 1.80 -2.39 -3.48 0.24 -0.44 -5.03 118.33 107.56 1lxm n VAL 268 Ca 0.05 -2.50 -0.42 0.00 -2.04 0.00 0.00 64.34 59.43 1lxm n VAL 268 Cb 0.19 -0.11 -0.03 0.00 -1.47 0.00 0.00 33.84 32.41 1lxm n VAL 268 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1lxm s TYR 269 N -2.68 3.39 -0.32 6.34 5.04 -1.10 -4.86 117.35 123.17 1lxm s TYR 269 Ca 0.33 1.24 -0.06 0.00 -2.44 0.00 0.00 57.07 56.14 1lxm s TYR 269 Cb 0.31 -3.46 0.03 0.00 0.35 0.00 0.00 41.96 39.19 1lxm s TYR 269 CO -0.03 -1.45 0.09 0.34 -1.34 0.00 0.00 175.55 173.16 1lxm s ASP 270 N 1.10 5.18 0.52 4.32 3.68 -1.26 -4.97 116.67 125.25 1lxm s ASP 270 Ca 0.59 -0.96 0.23 0.00 2.13 0.00 0.00 52.55 54.54 1lxm s ASP 270 Cb -0.30 -1.86 1.43 0.00 -1.45 0.00 0.00 42.92 40.73 1lxm s ASP 270 CO 0.29 -0.26 2.12 0.74 0.13 0.00 0.00 175.17 178.18 1lxm h THR 271 N 6.06 0.76 -0.06 1.71 2.02 -1.99 -0.35 112.91 121.06 1lxm h THR 271 Ca -0.27 -0.32 -0.24 0.00 0.77 0.00 0.00 66.41 66.35 1lxm h THR 271 Cb 1.10 1.19 0.01 0.00 -1.74 0.00 0.00 68.15 68.71 1lxm h THR 271 CO 0.60 0.08 -0.91 0.78 0.37 0.00 0.00 175.52 176.44 1lxm h ASN 272 N 0.00 0.81 -2.36 4.18 2.35 -2.03 -3.44 115.58 115.09 1lxm h ASN 272 Ca -0.00 -0.60 -0.54 0.00 -0.55 0.00 0.00 56.30 54.62 1lxm h ASN 272 Cb 0.18 -0.24 0.02 0.00 0.05 0.00 0.00 38.32 38.33 1lxm h ASN 272 CO 0.01 1.39 1.25 -0.62 -1.65 0.00 0.00 177.43 177.81 1lxm s ASP 273 N -7.16 6.38 0.28 5.81 2.15 -0.14 -4.90 116.67 119.09 1lxm s ASP 273 Ca -0.09 2.58 0.06 0.00 0.43 0.00 0.00 52.55 55.53 1lxm s ASP 273 Cb 0.08 -2.53 0.41 0.00 -0.30 0.00 0.00 42.92 40.58 1lxm s ASP 273 CO 0.90 -1.12 1.66 0.28 -0.17 0.00 0.00 175.17 176.72 1lxm h SER 274 N 10.89 0.23 -0.07 -0.34 0.02 -1.85 -1.98 113.55 120.46 1lxm h SER 274 Ca -0.48 -0.11 -0.21 0.00 -0.84 0.00 0.00 61.79 60.15 1lxm h SER 274 Cb 1.23 -0.07 0.01 0.00 0.14 0.00 0.00 62.40 63.72 1lxm h SER 274 CO 0.94 0.67 -0.79 0.78 -1.14 0.00 0.00 176.83 177.29 1lxm h ASN 275 N 0.18 0.81 -0.57 3.07 4.21 -1.93 -0.17 115.58 121.18 1lxm h ASN 275 Ca 0.01 -0.69 -0.04 0.00 1.21 0.00 0.00 56.30 56.79 1lxm h ASN 275 Cb 0.90 -0.24 -0.02 0.00 -1.12 0.00 0.00 38.32 37.83 1lxm h ASN 275 CO 0.07 1.39 0.21 0.24 -1.29 0.00 0.00 177.43 178.04 1lxm h MET 276 N 0.31 0.86 -0.67 0.81 2.86 -1.84 0.21 114.93 117.47 1lxm h MET 276 Ca -0.08 -0.17 -0.06 0.00 -2.06 0.00 0.00 59.70 57.34 1lxm h MET 276 Cb 1.45 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.95 1lxm h MET 276 CO 0.16 0.76 0.20 1.96 1.06 0.00 0.00 176.91 181.05 1lxm h GLN 277 N 0.78 1.04 -0.76 1.72 4.20 -1.34 0.48 115.11 121.23 1lxm h GLN 277 Ca 0.19 -0.23 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 1lxm h GLN 277 Cb 0.23 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.83 1lxm h GLN 277 CO -0.01 0.91 0.38 0.87 -0.67 0.00 0.00 178.83 180.31 1lxm h LYS 278 N 0.97 1.09 0.60 1.46 1.57 -0.60 0.38 116.57 122.04 1lxm h LYS 278 Ca 0.21 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.81 1lxm h LYS 278 Cb 0.31 -0.20 0.01 0.00 0.08 0.00 0.00 32.23 32.42 1lxm h LYS 278 CO -0.01 0.84 -0.29 1.25 -0.57 0.00 0.00 179.45 180.68 1lxm h LEU 279 N 1.07 -0.68 -1.33 2.94 5.85 -0.04 -3.01 115.31 120.10 1lxm h LEU 279 Ca 0.26 0.02 0.29 0.00 0.84 0.00 0.00 57.88 59.29 1lxm h LEU 279 Cb 0.10 0.18 -0.10 0.00 0.37 0.00 0.00 40.66 41.20 1lxm h LEU 279 CO -0.04 -0.31 0.68 -1.13 -0.34 0.00 0.00 178.44 177.31 1lxm h ASN 280 N -1.16 0.44 0.20 1.25 -1.24 0.01 -1.94 115.58 113.13 1lxm h ASN 280 Ca -0.08 0.10 -0.20 0.00 0.71 0.00 0.00 56.30 56.83 1lxm h ASN 280 Cb 0.62 0.03 -0.00 0.00 0.73 0.00 0.00 38.32 39.70 1lxm h ASN 280 CO 0.14 0.05 -0.77 -0.61 -1.29 0.00 0.00 177.43 174.94 1lxm h GLN 281 N 0.36 0.48 -0.12 6.67 5.75 -0.94 -2.92 115.11 124.39 1lxm h GLN 281 Ca 0.63 -0.41 -0.18 0.00 -0.15 0.00 0.00 58.65 58.55 1lxm h GLN 281 Cb 1.63 0.09 -0.00 0.00 1.07 0.00 0.00 27.48 30.27 1lxm h GLN 281 CO -0.33 1.04 -0.67 -0.22 -2.65 0.00 0.00 178.83 176.00 1lxm h LYS 282 N 0.32 0.48 -0.12 1.69 3.64 -1.22 -3.09 116.57 118.26 1lxm h LYS 282 Ca -0.04 -0.36 -0.00 0.00 -1.27 0.00 0.00 60.65 58.98 1lxm h LYS 282 Cb 1.37 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.25 1lxm h LYS 282 CO 0.14 0.98 0.06 1.25 -2.27 0.00 0.00 179.45 179.61 1lxm h LEU 283 N 0.34 0.15 -1.82 5.20 5.85 -1.50 -2.45 115.31 121.09 1lxm h LEU 283 Ca -0.02 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.58 1lxm h LEU 283 Cb 1.23 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.22 1lxm h LEU 283 CO 0.12 0.21 -0.12 0.44 -0.34 0.00 0.00 178.44 178.74 1lxm h ASP 284 N 0.09 0.00 0.88 1.25 3.45 -1.55 0.32 116.42 120.86 1lxm h ASP 284 Ca 0.04 0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.34 1lxm h ASP 284 Cb 0.09 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.84 1lxm h ASP 284 CO -0.01 0.12 -0.77 -0.33 -1.57 0.00 0.00 179.24 176.69 1lxm h GLU 285 N 0.00 0.00 0.01 3.56 5.08 -1.41 -2.02 114.58 119.80 1lxm h GLU 285 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1lxm h GLU 285 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1lxm h GLU 285 CO 0.02 0.77 -0.15 1.15 -1.00 0.00 0.00 179.01 179.79 1lxm h THR 286 N 0.00 1.64 -0.48 1.13 2.02 -0.73 -2.71 112.91 113.77 1lxm h THR 286 Ca -0.01 -2.08 0.05 0.00 0.77 0.00 0.00 66.41 65.15 1lxm h THR 286 Cb 1.42 3.01 -0.03 0.00 -1.74 0.00 0.00 68.15 70.81 1lxm h THR 286 CO 0.10 0.55 0.32 0.78 0.37 0.00 0.00 175.52 177.64 1lxm h ASN 287 N -0.71 0.37 0.10 4.18 2.35 -1.04 -0.93 115.58 119.90 1lxm h ASN 287 Ca -0.02 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 1lxm h ASN 287 Cb 0.99 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.28 1lxm h ASN 287 CO 0.03 0.25 -0.05 0.00 -1.65 0.00 0.00 177.43 176.01 1lxm h ALA 288 N 1.74 -0.13 -0.28 -0.83 0.00 -1.38 -0.09 119.26 118.28 1lxm h ALA 288 Ca 0.21 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1lxm h ALA 288 Cb 0.27 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 1lxm h ALA 288 CO -0.05 -0.46 0.08 0.87 0.00 0.00 0.00 179.25 179.69 1lxm h LYS 289 N -0.36 0.20 -0.55 0.00 1.57 -1.01 -1.34 116.57 115.07 1lxm h LYS 289 Ca -0.01 -0.01 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1lxm h LYS 289 Cb 0.30 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1lxm h LYS 289 CO 0.02 0.13 0.09 -0.91 -0.57 0.00 0.00 179.45 178.22 1lxm h ASN 290 N 0.20 0.87 0.12 0.86 2.35 -1.16 0.16 115.58 118.99 1lxm h ASN 290 Ca 0.13 -0.26 -0.07 0.00 -0.55 0.00 0.00 56.30 55.55 1lxm h ASN 290 Cb 0.11 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 1lxm h ASN 290 CO -0.15 0.91 -0.24 0.40 -1.65 0.00 0.00 177.43 176.70 1lxm h ILE 291 N 0.80 1.23 0.07 2.81 2.04 -0.76 -0.24 117.51 123.46 1lxm h ILE 291 Ca 0.17 -1.06 -0.24 0.00 1.00 0.00 0.00 64.86 64.73 1lxm h ILE 291 Cb 0.40 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1lxm h ILE 291 CO 0.01 0.32 -1.09 -0.08 0.00 0.00 0.00 178.15 177.31 1lxm h GLU 292 N 0.19 0.22 -0.01 2.37 4.81 -1.02 -3.33 114.58 117.81 1lxm h GLU 292 Ca 0.03 -0.32 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1lxm h GLU 292 Cb 0.54 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.03 1lxm h GLU 292 CO 0.04 1.11 -0.25 0.00 -0.73 0.00 0.00 179.01 179.18 1lxm n ALA 293 N -2.48 3.07 -1.78 2.92 0.00 0.02 -4.96 120.51 117.30 1lxm n ALA 293 Ca -0.06 -0.47 -0.41 0.00 0.00 0.00 0.00 53.44 52.51 1lxm n ALA 293 Cb 0.95 -1.06 -0.02 0.00 0.00 0.00 0.00 19.45 19.32 1lxm n ALA 293 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1lxm s ILE 294 N -2.40 2.58 -0.08 0.00 2.07 -0.13 -4.73 121.20 118.50 1lxm s ILE 294 Ca 0.25 0.57 -0.30 0.00 -1.41 0.00 0.00 60.65 59.77 1lxm s ILE 294 Cb 0.19 -3.36 -0.02 0.00 0.13 0.00 0.00 42.46 39.40 1lxm s ILE 294 CO 0.49 0.13 1.07 -0.54 -1.91 0.00 0.00 174.94 174.18 1lxm s LYS 295 N -1.70 4.42 0.00 3.50 3.01 0.18 -4.95 119.74 124.19 1lxm s LYS 295 Ca 0.51 1.49 0.16 0.00 -1.01 0.00 0.00 55.97 57.11 1lxm s LYS 295 Cb -0.41 -3.53 -0.16 0.00 -1.01 0.00 0.00 37.83 32.71 1lxm s LYS 295 CO 0.54 -0.33 0.68 1.28 0.51 0.00 0.00 175.35 178.03 1lxm n LEU 296 N 4.92 0.79 -4.66 3.17 4.32 -1.26 -4.81 117.00 119.47 1lxm n LEU 296 Ca 0.09 -0.52 -0.53 0.00 -0.02 0.00 0.00 56.01 55.03 1lxm n LEU 296 Cb 0.48 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 42.22 1lxm n LEU 296 CO 0.53 0.19 1.20 -0.67 -1.22 0.00 0.00 177.39 177.42 1lxm n ASP 297 N -1.30 2.37 0.09 -1.43 2.03 -1.26 -4.76 116.55 112.28 1lxm n ASP 297 Ca 0.03 1.08 0.21 0.00 0.52 0.00 0.00 54.79 56.62 1lxm n ASP 297 Cb 0.25 -1.22 0.72 0.00 -0.72 0.00 0.00 41.12 40.15 1lxm n ASP 297 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1lxm h SER 298 N 6.51 0.00 -0.66 1.67 4.64 -2.02 0.23 113.55 123.91 1lxm h SER 298 Ca -0.47 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 60.41 1lxm h SER 298 Cb 1.31 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.12 1lxm h SER 298 CO 0.89 0.00 -0.16 0.59 -0.87 0.00 0.00 176.83 177.28 1lxm n ASN 299 N -3.60 4.62 -4.79 4.97 3.02 -1.26 -2.91 115.26 115.31 1lxm n ASN 299 Ca 0.08 -3.78 -0.32 0.00 -0.03 0.00 0.00 54.58 50.53 1lxm n ASN 299 Cb 0.68 -0.60 0.05 0.00 -0.61 0.00 0.00 39.78 39.30 1lxm n ASN 299 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lxm s ARG 300 N -3.52 2.80 0.00 3.52 3.03 0.80 -4.98 118.95 120.60 1lxm s ARG 300 Ca 0.52 1.18 0.09 0.00 2.03 0.00 0.00 55.73 59.55 1lxm s ARG 300 Cb 0.43 -1.96 0.03 0.00 -1.03 0.00 0.00 34.95 32.41 1lxm s ARG 300 CO 0.01 -1.22 0.66 0.25 -1.13 0.00 0.00 175.30 173.87 1lxm n THR 301 N -2.81 0.00 -3.92 4.99 -2.24 -1.26 -4.69 114.28 104.35 1lxm n THR 301 Ca 0.09 -0.44 -0.12 0.00 -2.27 0.00 0.00 64.05 61.31 1lxm n THR 301 Cb 0.53 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.90 1lxm n THR 301 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1lxm s PHE 302 N -1.06 0.56 -0.13 4.78 -0.12 -1.26 -4.66 117.98 116.09 1lxm s PHE 302 Ca 0.09 -1.06 0.05 0.00 -0.05 0.00 0.00 56.93 55.96 1lxm s PHE 302 Cb 0.07 0.47 -0.12 0.00 -0.63 0.00 0.00 43.02 42.82 1lxm s PHE 302 CO 0.18 -1.44 -0.05 1.28 -0.05 0.00 0.00 175.22 175.14 1lxm n LEU 303 N -0.56 1.58 -4.01 -1.99 4.77 -1.26 -4.67 117.00 110.85 1lxm n LEU 303 Ca -0.05 -0.04 -0.22 0.00 -0.03 0.00 0.00 56.01 55.67 1lxm n LEU 303 Cb 0.60 -0.14 -0.16 0.00 -2.33 0.00 0.00 43.42 41.40 1lxm n LEU 303 CO 0.29 0.52 -0.45 0.26 -1.33 0.00 0.00 177.39 176.68 1lxm s TRP 304 N -2.28 1.19 0.24 -1.77 0.51 -1.26 0.50 118.94 116.07 1lxm s TRP 304 Ca -0.13 -0.36 0.27 0.00 -2.12 0.00 0.00 56.10 53.76 1lxm s TRP 304 Cb 0.04 -0.87 1.46 0.00 -0.81 0.00 0.00 33.47 33.29 1lxm s TRP 304 CO 0.39 -0.18 1.80 0.87 -0.51 0.00 0.00 176.95 179.32 1lxm h LYS 305 N 6.65 0.00 -0.55 4.98 1.79 -1.94 0.19 116.57 127.69 1lxm h LYS 305 Ca -0.33 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.14 1lxm h LYS 305 Cb 1.17 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.82 1lxm h LYS 305 CO 0.48 0.00 0.00 -0.40 -1.08 0.00 0.00 179.45 178.45 1lxm n ASP 306 N -2.53 3.47 -2.83 0.86 3.85 -1.26 -3.99 116.55 114.11 1lxm n ASP 306 Ca -0.02 -1.98 -0.11 0.00 -0.71 0.00 0.00 54.79 51.97 1lxm n ASP 306 Cb 0.19 -0.36 0.03 0.00 -1.35 0.00 0.00 41.12 39.63 1lxm n ASP 306 CO 0.00 0.00 0.00 0.18 -1.01 0.00 0.00 177.20 176.37 1lxm n LEU 307 N 1.43 0.24 -0.02 -2.12 4.77 0.63 -4.96 117.00 116.98 1lxm n LEU 307 Ca 0.21 -4.06 0.14 0.00 -0.03 0.00 0.00 56.01 52.28 1lxm n LEU 307 Cb 0.57 0.51 0.65 0.00 -2.33 0.00 0.00 43.42 42.82 1lxm n LEU 307 CO 0.16 1.90 0.94 -0.90 -1.33 0.00 0.00 177.39 178.15 1lxm n ASP 308 N 0.00 0.11 -4.01 -1.43 5.75 -1.10 -4.40 116.55 111.47 1lxm n ASP 308 Ca 0.11 0.03 -0.33 0.00 -0.01 0.00 0.00 54.79 54.59 1lxm n ASP 308 Cb 0.76 -0.30 -0.08 0.00 -1.03 0.00 0.00 41.12 40.48 1lxm n ASP 308 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1lxm n ASN 309 N -1.33 3.89 0.00 -1.12 2.85 -1.26 -4.73 115.26 113.55 1lxm n ASN 309 Ca 0.11 -3.18 0.03 0.00 -0.11 0.00 0.00 54.58 51.42 1lxm n ASN 309 Cb 0.29 -0.95 0.15 0.00 1.24 0.00 0.00 39.78 40.51 1lxm n ASN 309 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1lxm n LEU 310 N 2.09 0.00 -0.35 1.20 4.77 -1.26 -0.29 117.00 123.16 1lxm n LEU 310 Ca 0.22 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.32 1lxm n LEU 310 Cb 0.36 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.67 1lxm n LEU 310 CO 0.35 0.00 0.50 0.59 -1.33 0.00 0.00 177.39 177.49 1lxm n ASN 311 N -0.66 1.45 -4.51 -1.43 5.03 -1.26 -4.63 115.26 109.25 1lxm n ASN 311 Ca 0.04 -1.15 -0.41 0.00 0.87 0.00 0.00 54.58 53.93 1lxm n ASN 311 Cb 0.02 0.29 -0.11 0.00 -1.02 0.00 0.00 39.78 38.96 1lxm n ASN 311 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1lxm s ASN 312 N -2.50 6.03 0.21 6.41 3.04 0.60 -4.90 114.94 123.83 1lxm s ASN 312 Ca 0.22 -0.54 -0.21 0.00 0.04 0.00 0.00 52.86 52.36 1lxm s ASN 312 Cb 0.19 -2.13 0.15 0.00 -1.54 0.00 0.00 41.25 37.92 1lxm s ASN 312 CO 0.55 -0.28 1.55 0.28 -3.04 0.00 0.00 177.10 176.16 1lxm h SER 313 N 8.51 -1.59 -0.54 -4.21 0.02 -1.84 0.13 113.55 114.02 1lxm h SER 313 Ca -0.30 0.31 0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1lxm h SER 313 Cb 1.15 0.79 -0.03 0.00 0.14 0.00 0.00 62.40 64.45 1lxm h SER 313 CO 0.65 -0.28 0.36 0.00 -1.14 0.00 0.00 176.83 176.42 1lxm h ALA 314 N 1.11 1.69 -0.11 3.77 0.00 -1.94 -1.59 119.26 122.20 1lxm h ALA 314 Ca 0.29 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.04 1lxm h ALA 314 Cb 0.55 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1lxm h ALA 314 CO -0.94 0.25 -0.51 1.96 0.00 0.00 0.00 179.25 180.01 1lxm h GLN 315 N 0.66 0.30 0.00 0.00 4.20 -1.06 -0.43 115.11 118.78 1lxm h GLN 315 Ca 0.21 -0.17 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1lxm h GLN 315 Cb 0.04 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1lxm h GLN 315 CO -0.05 0.74 -0.32 1.25 -0.67 0.00 0.00 178.83 179.77 1lxm h LEU 316 N 0.24 0.00 0.05 1.46 5.85 -0.59 -2.45 115.31 119.87 1lxm h LEU 316 Ca 0.01 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 1lxm h LEU 316 Cb 0.99 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.03 1lxm h LEU 316 CO 0.08 0.32 -0.45 0.74 -0.34 0.00 0.00 178.44 178.80 1lxm h THR 317 N 0.00 1.56 -0.55 1.05 2.02 -1.00 -2.84 112.91 113.15 1lxm h THR 317 Ca -0.00 -2.24 0.05 0.00 0.77 0.00 0.00 66.41 64.99 1lxm h THR 317 Cb 1.15 3.00 -0.03 0.00 -1.74 0.00 0.00 68.15 70.53 1lxm h THR 317 CO 0.04 0.62 0.36 0.00 0.37 0.00 0.00 175.52 176.91 1lxm h ALA 318 N 0.16 1.82 -0.05 6.16 0.00 -1.09 -1.57 119.26 124.69 1lxm h ALA 318 Ca -0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1lxm h ALA 318 Cb 1.26 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 1lxm h ALA 318 CO 0.09 0.10 -0.01 1.15 0.00 0.00 0.00 179.25 180.58 1lxm h THR 319 N 0.55 1.28 -0.21 0.00 2.02 -1.48 -2.28 112.91 112.79 1lxm h THR 319 Ca 0.23 -0.87 -0.02 0.00 0.77 0.00 0.00 66.41 66.52 1lxm h THR 319 Cb 0.22 1.76 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 1lxm h THR 319 CO -0.06 0.24 0.02 1.88 0.37 0.00 0.00 175.52 177.96 1lxm h TYR 320 N -0.24 0.30 -0.12 3.16 0.05 -1.23 -2.27 116.97 116.62 1lxm h TYR 320 Ca 0.01 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.67 1lxm h TYR 320 Cb 0.38 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 38.01 1lxm h TYR 320 CO 0.05 0.30 -0.43 0.00 -1.05 0.00 0.00 178.16 177.03 1lxm h ARG 321 N 0.30 0.29 -0.32 4.88 3.08 -1.12 -2.04 114.38 119.45 1lxm h ARG 321 Ca 0.07 -0.14 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 1lxm h ARG 321 Cb 0.17 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1lxm h ARG 321 CO 0.00 0.67 -0.16 0.00 -1.07 0.00 0.00 179.97 179.41 1lxm h ARG 322 N 0.24 0.58 -0.04 0.04 3.08 -0.82 -1.05 114.38 116.41 1lxm h ARG 322 Ca 0.02 -0.19 -0.13 0.00 0.07 0.00 0.00 59.98 59.75 1lxm h ARG 322 Cb 0.86 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.84 1lxm h ARG 322 CO 0.07 0.72 -0.55 -0.07 -1.07 0.00 0.00 179.97 179.06 1lxm h LEU 323 N 0.52 0.13 -0.23 3.04 3.38 -1.39 -2.65 115.31 118.12 1lxm h LEU 323 Ca 0.09 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1lxm h LEU 323 Cb 0.57 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1lxm h LEU 323 CO 0.04 0.65 0.07 -0.08 0.09 0.00 0.00 178.44 179.21 1lxm h GLU 324 N 0.09 0.36 -0.12 1.13 4.81 -0.59 -0.55 114.58 119.70 1lxm h GLU 324 Ca -0.00 -0.08 0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1lxm h GLU 324 Cb 1.00 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 30.33 1lxm h GLU 324 CO 0.08 0.46 0.09 -0.44 -0.73 0.00 0.00 179.01 178.47 1lxm h ASP 325 N 0.20 0.00 0.12 1.04 3.45 -1.08 -0.41 116.42 119.74 1lxm h ASP 325 Ca 0.07 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.53 1lxm h ASP 325 Cb 0.25 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 1lxm h ASP 325 CO -0.00 0.00 -0.06 -0.07 -1.57 0.00 0.00 179.24 177.54 1lxm h LEU 326 N 0.00 -0.13 -2.03 1.55 3.38 -0.94 -3.12 115.31 114.02 1lxm h LEU 326 Ca 0.06 -0.35 0.13 0.00 0.09 0.00 0.00 57.88 57.80 1lxm h LEU 326 Cb 0.25 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1lxm h LEU 326 CO -0.00 0.31 0.34 0.00 0.09 0.00 0.00 178.44 179.18 1lxm h ALA 327 N 0.18 2.32 -0.36 1.53 0.00 0.42 -0.64 119.26 122.72 1lxm h ALA 327 Ca -0.02 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1lxm h ALA 327 Cb 0.48 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1lxm h ALA 327 CO 0.03 -0.57 -0.19 0.87 0.00 0.00 0.00 179.25 179.39 1lxm h LYS 328 N 0.00 0.76 0.00 0.00 1.57 -1.23 -3.13 116.57 114.53 1lxm h LYS 328 Ca 0.21 -0.34 -0.11 0.00 -1.87 0.00 0.00 60.65 58.54 1lxm h LYS 328 Cb 0.89 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.16 1lxm h LYS 328 CO -0.00 0.95 -0.72 1.96 -0.57 0.00 0.00 179.45 181.07 1lxm h GLN 329 N 0.54 0.00 0.00 3.15 1.08 -1.23 -3.06 115.11 115.59 1lxm h GLN 329 Ca 0.08 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.27 1lxm h GLN 329 Cb 0.74 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.16 1lxm h GLN 329 CO 0.06 0.40 -0.04 0.82 -0.95 0.00 0.00 178.83 179.11 1lxm h ILE 330 N 0.00 0.13 -0.29 2.54 2.04 -1.18 -2.42 117.51 118.33 1lxm h ILE 330 Ca -0.04 -0.55 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1lxm h ILE 330 Cb 1.39 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 38.95 1lxm h ILE 330 CO 0.05 0.04 0.00 0.35 0.00 0.00 0.00 178.15 178.60 1lxm n THR 331 N -3.18 0.69 -3.21 -0.27 -2.24 -1.18 -1.66 114.28 103.22 1lxm n THR 331 Ca -0.00 -0.84 -0.44 0.00 -2.27 0.00 0.00 64.05 60.49 1lxm n THR 331 Cb 0.29 0.74 -0.06 0.00 -2.10 0.00 0.00 70.33 69.20 1lxm n THR 331 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1lxm s ASN 332 N -1.03 6.20 0.66 3.42 2.47 -0.91 -4.93 114.94 120.81 1lxm s ASN 332 Ca 0.24 -1.16 0.25 0.00 0.42 0.00 0.00 52.86 52.60 1lxm s ASN 332 Cb 0.13 -2.26 1.32 0.00 -1.45 0.00 0.00 41.25 39.00 1lxm s ASN 332 CO 0.18 -0.87 1.75 -0.65 -3.72 0.00 0.00 177.10 173.79 1lxm h PRO 333 N 8.97 0.00 -0.63 0.43 0.11 -1.87 0.27 132.00 139.27 1lxm h PRO 333 Ca -0.28 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.52 1lxm h PRO 333 Cb 1.10 0.00 -0.18 0.00 0.11 0.00 0.00 31.00 32.02 1lxm h PRO 333 CO 0.97 0.00 0.24 0.72 -0.21 0.00 0.00 178.00 179.73 1lxm n HIS 334 N -2.91 1.98 -4.01 0.65 8.25 -1.26 -4.96 115.22 112.96 1lxm n HIS 334 Ca -0.00 -1.64 -0.22 0.00 -0.26 0.00 0.00 57.72 55.60 1lxm n HIS 334 Cb 0.53 -0.68 -0.05 0.00 1.12 0.00 0.00 29.99 30.91 1lxm n HIS 334 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1lxm s SER 335 N -1.91 4.99 0.19 0.41 0.15 0.94 -5.04 113.70 113.44 1lxm s SER 335 Ca 0.50 -0.60 0.02 0.00 0.70 0.00 0.00 55.95 56.58 1lxm s SER 335 Cb 0.44 -0.91 0.09 0.00 -1.71 0.00 0.00 66.02 63.93 1lxm s SER 335 CO 0.06 -0.26 1.45 0.74 1.20 0.00 0.00 173.24 176.42 1lxm h THR 336 N 1.46 1.43 -0.57 6.45 2.02 -1.86 -3.25 112.91 118.60 1lxm h THR 336 Ca -0.45 -2.31 0.00 0.00 0.77 0.00 0.00 66.41 64.42 1lxm h THR 336 Cb 1.25 2.24 0.00 0.00 -1.74 0.00 0.00 68.15 69.91 1lxm h THR 336 CO 0.61 0.68 0.00 2.30 0.37 0.00 0.00 175.52 179.48 1lxm n ILE 337 N -3.76 2.20 -1.61 3.11 -5.35 -1.26 -4.87 119.36 107.81 1lxm n ILE 337 Ca -0.03 -1.35 -0.46 0.00 -0.27 0.00 0.00 62.75 60.65 1lxm n ILE 337 Cb 0.72 -0.05 -0.04 0.00 -1.74 0.00 0.00 39.64 38.54 1lxm n ILE 337 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1lxm n TYR 338 N 0.75 2.12 -1.05 4.28 9.36 -1.21 -0.25 117.16 131.16 1lxm n TYR 338 Ca 0.26 -0.08 -0.02 0.00 3.32 0.00 0.00 57.90 61.38 1lxm n TYR 338 Cb 0.99 -2.70 -0.01 0.00 -0.63 0.00 0.00 39.34 37.00 1lxm n TYR 338 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 1lxm n LYS 339 N 7.85 -1.22 -2.09 2.98 5.02 -0.66 -4.94 118.16 125.09 1lxm n LYS 339 Ca 0.28 0.40 -0.42 0.00 -2.02 0.00 0.00 58.31 56.54 1lxm n LYS 339 Cb 0.36 -4.36 -0.03 0.00 -0.02 0.00 0.00 35.03 30.99 1lxm n LYS 339 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1lxm s ASN 340 N -2.11 6.73 0.22 4.39 3.84 0.65 -4.94 114.94 123.73 1lxm s ASN 340 Ca 0.00 2.20 -0.07 0.00 0.21 0.00 0.00 52.86 55.20 1lxm s ASN 340 Cb 0.00 -2.55 0.18 0.00 -0.55 0.00 0.00 41.25 38.34 1lxm s ASN 340 CO 0.00 -0.84 1.75 -0.08 -2.79 0.00 0.00 177.10 175.14 1lxm h GLU 341 N 8.67 1.09 -0.03 0.43 4.81 -1.92 -0.79 114.58 126.84 1lxm h GLU 341 Ca -0.38 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 58.60 1lxm h GLU 341 Cb 1.18 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 1lxm h GLU 341 CO 0.94 0.95 0.01 -0.22 -0.73 0.00 0.00 179.01 179.96 1lxm h LYS 342 N 1.04 0.05 -1.00 1.92 3.64 -1.97 0.14 116.57 120.40 1lxm h LYS 342 Ca 0.22 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 1lxm h LYS 342 Cb 0.33 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.09 1lxm h LYS 342 CO -0.00 0.21 0.65 0.00 -2.27 0.00 0.00 179.45 178.04 1lxm h ALA 343 N 0.84 1.36 0.71 5.00 0.00 -1.89 -0.70 119.26 124.57 1lxm h ALA 343 Ca 0.01 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1lxm h ALA 343 Cb 0.18 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 17.63 1lxm h ALA 343 CO -0.00 0.53 -0.34 0.82 0.00 0.00 0.00 179.25 180.26 1lxm h ILE 344 N 1.25 0.00 -0.87 0.00 2.04 -0.86 -2.66 117.51 116.42 1lxm h ILE 344 Ca 0.41 -0.29 0.22 0.00 1.00 0.00 0.00 64.86 66.19 1lxm h ILE 344 Cb 0.04 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.06 1lxm h ILE 344 CO -0.13 0.00 0.59 0.03 0.00 0.00 0.00 178.15 178.64 1lxm h ARG 345 N -1.24 0.24 -0.59 2.37 3.08 -0.61 0.18 114.38 117.82 1lxm h ARG 345 Ca -0.10 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 59.90 1lxm h ARG 345 Cb 0.73 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.70 1lxm h ARG 345 CO 0.16 0.16 0.23 1.15 -1.07 0.00 0.00 179.97 180.60 1lxm h THR 346 N 0.25 1.23 -0.09 2.04 2.02 -1.02 0.57 112.91 117.91 1lxm h THR 346 Ca 0.44 -0.72 -0.04 0.00 0.77 0.00 0.00 66.41 66.85 1lxm h THR 346 Cb 1.31 0.61 -0.00 0.00 -1.74 0.00 0.00 68.15 68.33 1lxm h THR 346 CO -0.11 0.28 -0.10 0.58 0.37 0.00 0.00 175.52 176.54 1lxm h VAL 347 N 0.81 1.37 -0.78 3.16 2.07 -0.40 -0.58 116.25 121.89 1lxm h VAL 347 Ca 0.19 -1.26 -0.05 0.00 0.82 0.00 0.00 66.70 66.41 1lxm h VAL 347 Cb 0.22 2.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 1lxm h VAL 347 CO -0.01 0.36 0.31 0.11 0.02 0.00 0.00 177.57 178.35 1lxm h LYS 348 N -0.19 1.18 -0.03 1.57 1.57 -0.74 -1.03 116.57 118.89 1lxm h LYS 348 Ca 0.01 -0.22 -0.19 0.00 -1.87 0.00 0.00 60.65 58.38 1lxm h LYS 348 Cb 0.61 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1lxm h LYS 348 CO 0.02 0.96 -0.81 0.93 -0.57 0.00 0.00 179.45 179.98 1lxm h GLU 349 N 1.15 0.32 -0.03 3.15 5.08 0.13 -2.93 114.58 121.44 1lxm h GLU 349 Ca 0.26 -0.30 -0.16 0.00 -1.00 0.00 0.00 59.36 58.16 1lxm h GLU 349 Cb 0.23 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1lxm h GLU 349 CO -0.02 0.97 -0.71 0.77 -1.00 0.00 0.00 179.01 179.02 1lxm h SER 350 N 0.20 0.22 -0.32 1.42 0.02 -0.89 -2.62 113.55 111.57 1lxm h SER 350 Ca -0.04 -0.14 -0.17 0.00 -0.84 0.00 0.00 61.79 60.59 1lxm h SER 350 Cb 1.41 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.89 1lxm h SER 350 CO 0.13 0.85 -0.46 -0.07 -1.14 0.00 0.00 176.83 176.14 1lxm h LEU 351 N 0.12 0.96 -0.84 5.07 3.38 -1.21 -1.22 115.31 121.57 1lxm h LEU 351 Ca -0.02 -0.51 -0.07 0.00 0.09 0.00 0.00 57.88 57.37 1lxm h LEU 351 Cb 1.26 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1lxm h LEU 351 CO 0.11 1.28 0.05 0.00 0.09 0.00 0.00 178.44 179.96 1lxm h ALA 352 N 0.71 1.04 0.06 1.53 0.00 -1.52 -2.18 119.26 118.90 1lxm h ALA 352 Ca 0.03 -0.26 -0.27 0.00 0.00 0.00 0.00 54.91 54.40 1lxm h ALA 352 Cb 1.07 -0.22 0.02 0.00 0.00 0.00 0.00 17.79 18.66 1lxm h ALA 352 CO 0.11 0.61 -1.13 2.35 0.00 0.00 0.00 179.25 181.19 1lxm h TRP 353 N 0.86 0.91 -0.01 0.00 7.01 -1.41 -0.77 115.95 122.53 1lxm h TRP 353 Ca 0.17 -0.54 -0.11 0.00 2.11 0.00 0.00 58.89 60.52 1lxm h TRP 353 Cb 0.44 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.40 1lxm h TRP 353 CO 0.03 1.38 -0.51 -0.07 -2.79 0.00 0.00 178.44 176.47 1lxm h LEU 354 N 0.29 0.04 -0.03 0.65 3.38 -1.24 0.06 115.31 118.46 1lxm h LEU 354 Ca -0.15 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 1lxm h LEU 354 Cb 1.79 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.53 1lxm h LEU 354 CO 0.21 0.55 -0.26 -0.74 0.09 0.00 0.00 178.44 178.29 1lxm h HIS 355 N 0.03 0.32 -0.69 1.13 2.76 -1.42 0.57 115.15 117.86 1lxm h HIS 355 Ca -0.00 -0.15 -0.06 0.00 -2.20 0.00 0.00 60.37 57.95 1lxm h HIS 355 Cb 0.92 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 29.81 1lxm h HIS 355 CO 0.00 0.90 0.18 0.37 -1.30 0.00 0.00 177.93 178.09 1lxm h GLN 356 N -0.35 1.08 0.00 5.26 4.15 -1.02 -3.31 115.11 120.92 1lxm h GLN 356 Ca -0.02 -0.24 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1lxm h GLN 356 Cb 0.95 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.49 1lxm h GLN 356 CO 0.05 0.94 -1.83 0.09 -1.93 0.00 0.00 178.83 176.16 1lxm n ASN 357 N -4.24 0.46 0.00 -0.69 5.03 -0.00 -4.88 115.26 110.94 1lxm n ASN 357 Ca 0.05 -0.09 0.00 0.00 0.87 0.00 0.00 54.58 55.42 1lxm n ASN 357 Cb 0.24 1.83 0.00 0.00 -1.02 0.00 0.00 39.78 40.84 1lxm n ASN 357 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1lxm n PHE 358 N -2.13 0.00 -3.89 3.10 3.72 0.16 -4.95 117.46 113.47 1lxm n PHE 358 Ca -0.03 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.07 1lxm n PHE 358 Cb 0.50 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.91 1lxm n PHE 358 CO 0.00 0.00 0.00 -0.47 -0.05 0.00 0.00 176.76 176.24 1lxm s TYR 359 N -1.23 2.97 0.25 1.38 5.04 0.98 -4.95 117.35 121.79 1lxm s TYR 359 Ca 0.00 -3.04 -0.08 0.00 -2.44 0.00 0.00 57.07 51.51 1lxm s TYR 359 Cb 0.00 -2.60 -0.01 0.00 0.35 0.00 0.00 41.96 39.70 1lxm s TYR 359 CO 0.00 -0.72 0.39 0.54 -1.34 0.00 0.00 175.55 174.41 1lxm s ASN 360 N -0.32 0.12 0.33 4.32 2.20 -1.25 -4.42 114.94 115.93 1lxm s ASN 360 Ca 0.18 -1.13 0.02 0.00 -0.94 0.00 0.00 52.86 50.99 1lxm s ASN 360 Cb -0.22 0.54 0.59 0.00 -2.00 0.00 0.00 41.25 40.16 1lxm s ASN 360 CO -0.02 -1.09 1.92 -0.37 -2.94 0.00 0.00 177.10 174.60 1lxm h VAL 361 N 2.33 1.18 0.00 3.54 -1.51 -1.88 -2.64 116.25 117.28 1lxm h VAL 361 Ca -0.29 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 64.61 1lxm h VAL 361 Cb 1.25 0.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 1lxm h VAL 361 CO 0.40 0.22 0.00 0.59 -1.23 0.00 0.00 177.57 177.56 1lxm n ASN 362 N -4.35 0.16 -3.73 4.19 3.02 -1.26 -4.71 115.26 108.58 1lxm n ASN 362 Ca 0.04 -1.09 -0.18 0.00 -0.03 0.00 0.00 54.58 53.31 1lxm n ASN 362 Cb 0.16 -0.08 -0.02 0.00 -0.61 0.00 0.00 39.78 39.23 1lxm n ASN 362 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1lxm n LYS 363 N -0.29 1.11 -3.63 3.52 4.76 -0.99 -5.16 118.16 117.47 1lxm n LYS 363 Ca 0.00 -2.24 -0.03 0.00 -2.87 0.00 0.00 58.31 53.17 1lxm n LYS 363 Cb 0.04 0.43 -0.04 0.00 -1.84 0.00 0.00 35.03 33.62 1lxm n LYS 363 CO 0.00 0.00 0.00 0.16 -1.37 0.00 0.00 177.40 176.19 1lxm s ASP 364 N -2.88 -0.08 0.28 4.39 3.84 -1.26 -5.01 116.67 115.95 1lxm s ASP 364 Ca 0.09 0.08 -0.30 0.00 -0.00 0.00 0.00 52.55 52.42 1lxm s ASP 364 Cb -0.01 0.07 -0.12 0.00 -1.38 0.00 0.00 42.92 41.48 1lxm s ASP 364 CO 0.06 -0.09 1.47 -0.38 -0.00 0.00 0.00 175.17 176.24 1lxm n ILE 365 N 0.43 1.19 -1.64 2.11 5.41 -1.26 -5.03 119.36 120.58 1lxm n ILE 365 Ca -0.01 -0.30 0.00 0.00 1.00 0.00 0.00 62.75 63.44 1lxm n ILE 365 Cb 0.58 -1.72 0.00 0.00 -0.71 0.00 0.00 39.64 37.79 1lxm n ILE 365 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1lxm n GLU 366 N 1.77 3.59 0.00 0.38 -0.58 -1.26 -5.03 120.64 119.51 1lxm n GLU 366 Ca 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1lxm n GLU 366 Cb 0.35 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.22 1lxm n GLU 366 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1lxm n GLY 367 N 5.00 -0.50 0.45 0.62 0.00 -1.26 -3.84 105.19 105.66 1lxm n GLY 367 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1lxm n GLY 367 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1lxm n SER 368 N -1.96 0.39 -4.64 1.61 2.88 -1.26 -4.67 113.62 105.96 1lxm n SER 368 Ca 0.00 -0.85 -0.35 0.00 -1.33 0.00 0.00 58.87 56.34 1lxm n SER 368 Cb 0.00 -0.19 -0.10 0.00 -0.75 0.00 0.00 64.21 63.17 1lxm n SER 368 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1lxm s ALA 369 N -1.10 3.38 -0.36 -1.46 0.00 -1.25 -4.58 121.76 116.38 1lxm s ALA 369 Ca 0.00 -0.75 -0.27 0.00 0.00 0.00 0.00 51.96 50.94 1lxm s ALA 369 Cb 0.00 -1.81 0.02 0.00 0.00 0.00 0.00 23.12 21.32 1lxm s ALA 369 CO 0.00 0.28 0.97 1.21 0.00 0.00 0.00 175.76 178.22 1lxm s ASN 370 N 0.07 6.73 0.57 0.00 3.84 -1.26 -4.69 114.94 120.20 1lxm s ASN 370 Ca 0.04 0.67 0.28 0.00 0.21 0.00 0.00 52.86 54.07 1lxm s ASN 370 Cb -0.12 -2.49 1.48 0.00 -0.55 0.00 0.00 41.25 39.57 1lxm s ASN 370 CO 0.01 -0.88 1.95 4.11 -2.79 0.00 0.00 177.10 179.49 1lxm h TRP 371 N 8.44 0.00 -0.29 0.43 5.08 -1.95 -0.32 115.95 127.34 1lxm h TRP 371 Ca -0.23 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.73 1lxm h TRP 371 Cb 1.07 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.22 1lxm h TRP 371 CO 0.84 0.00 0.13 2.35 -1.28 0.00 0.00 178.44 180.48 1lxm h TRP 372 N 0.00 0.42 -0.28 0.12 7.01 -1.97 0.26 115.95 121.52 1lxm h TRP 372 Ca 0.24 -0.02 -0.06 0.00 2.11 0.00 0.00 58.89 61.16 1lxm h TRP 372 Cb 1.13 -0.13 -0.02 0.00 -2.10 0.00 0.00 29.16 28.04 1lxm h TRP 372 CO 0.00 0.40 -0.08 -0.44 -2.79 0.00 0.00 178.44 175.52 1lxm h ASP 373 N 0.33 0.43 1.35 2.65 3.32 -1.41 1.02 116.42 124.11 1lxm h ASP 373 Ca 0.10 -0.10 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 1lxm h ASP 373 Cb 0.14 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1lxm h ASP 373 CO -0.01 0.56 -0.64 -0.26 -1.72 0.00 0.00 179.24 177.17 1lxm h PHE 374 N 0.43 0.00 0.00 4.55 -1.00 -1.34 0.64 116.94 120.21 1lxm h PHE 374 Ca 0.09 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.63 1lxm h PHE 374 Cb 0.41 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.93 1lxm h PHE 374 CO 0.01 0.64 -1.91 0.39 -1.61 0.00 0.00 178.31 175.83 1lxm n GLU 375 N -3.26 1.79 0.02 1.51 1.02 0.06 -4.51 120.64 117.26 1lxm n GLU 375 Ca 0.01 -0.01 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 1lxm n GLU 375 Cb 0.79 -1.34 -0.00 0.00 -0.02 0.00 0.00 31.44 30.86 1lxm n GLU 375 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1lxm n ILE 376 N -2.48 0.73 0.04 -3.67 5.41 0.32 -4.64 119.36 115.06 1lxm n ILE 376 Ca -0.21 0.20 -0.11 0.00 1.00 0.00 0.00 62.75 63.63 1lxm n ILE 376 Cb 0.92 -1.59 -0.04 0.00 -0.71 0.00 0.00 39.64 38.22 1lxm n ILE 376 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1lxm h GLY 377 N -0.06 -0.45 0.14 7.39 0.00 -0.73 -2.20 103.07 107.16 1lxm h GLY 377 Ca -0.02 0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.67 1lxm h GLY 377 CO -0.01 -0.22 -0.01 -2.08 0.00 0.00 0.00 176.54 174.21 1lxm h VAL 378 N -0.42 1.36 -0.73 4.60 2.07 0.06 -3.12 116.25 120.07 1lxm h VAL 378 Ca 0.08 -1.79 0.14 0.00 0.82 0.00 0.00 66.70 65.94 1lxm h VAL 378 Cb 0.53 2.46 -0.05 0.00 -1.52 0.00 0.00 31.29 32.72 1lxm h VAL 378 CO -0.29 0.42 0.49 -0.65 0.02 0.00 0.00 177.57 177.56 1lxm h PRO 379 N -0.90 0.38 -0.37 1.57 0.11 -1.75 0.84 132.00 131.89 1lxm h PRO 379 Ca -0.00 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.03 1lxm h PRO 379 Cb 0.72 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.73 1lxm h PRO 379 CO 0.01 0.25 0.01 -0.09 -0.21 0.00 0.00 178.00 177.97 1lxm h ARG 380 N 0.40 0.64 -0.23 1.05 2.43 -1.49 -0.73 114.38 116.45 1lxm h ARG 380 Ca 0.36 -0.20 -0.15 0.00 -0.81 0.00 0.00 59.98 59.18 1lxm h ARG 380 Cb 0.83 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1lxm h ARG 380 CO -0.11 0.75 -0.42 1.03 -1.51 0.00 0.00 179.97 179.71 1lxm h SER 381 N 0.46 0.77 0.36 -3.80 0.87 -1.11 -2.55 113.55 108.56 1lxm h SER 381 Ca 0.10 -0.54 -0.01 0.00 -1.23 0.00 0.00 61.79 60.12 1lxm h SER 381 Cb 0.45 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 1lxm h SER 381 CO 0.02 1.16 -0.24 0.40 -0.53 0.00 0.00 176.83 177.64 1lxm h ILE 382 N 0.41 0.50 -0.74 2.23 2.04 -0.85 -1.56 117.51 119.54 1lxm h ILE 382 Ca 0.01 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.00 1lxm h ILE 382 Cb 1.02 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 1lxm h ILE 382 CO 0.09 0.00 0.49 0.71 0.00 0.00 0.00 178.15 179.44 1lxm h THR 383 N -0.59 0.85 -0.15 -0.27 1.35 -1.17 -1.00 112.91 111.94 1lxm h THR 383 Ca -0.03 -0.17 -0.03 0.00 -0.55 0.00 0.00 66.41 65.62 1lxm h THR 383 Cb 0.49 0.30 -0.01 0.00 -1.73 0.00 0.00 68.15 67.21 1lxm h THR 383 CO 0.02 0.09 -0.01 1.23 -0.25 0.00 0.00 175.52 176.60 1lxm h GLY 384 N 0.51 0.30 0.86 5.82 0.00 -1.00 -0.87 103.07 108.69 1lxm h GLY 384 Ca 0.35 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 1lxm h GLY 384 CO -0.12 0.21 0.05 -0.84 0.00 0.00 0.00 176.54 175.85 1lxm h THR 385 N 0.00 1.17 -0.36 4.70 2.02 -0.57 -0.68 112.91 119.19 1lxm h THR 385 Ca 0.04 -0.50 -0.05 0.00 0.77 0.00 0.00 66.41 66.67 1lxm h THR 385 Cb 0.41 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.04 1lxm h THR 385 CO 0.01 0.15 0.01 -0.07 0.37 0.00 0.00 175.52 175.99 1lxm h LEU 386 N 0.07 0.52 -0.04 2.58 3.38 -1.24 0.85 115.31 121.43 1lxm h LEU 386 Ca 0.05 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1lxm h LEU 386 Cb 0.19 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1lxm h LEU 386 CO -0.00 0.58 -0.00 -1.28 0.09 0.00 0.00 178.44 177.83 1lxm h SER 387 N 0.53 0.07 0.49 -0.43 0.87 -0.88 -0.52 113.55 113.68 1lxm h SER 387 Ca 0.11 -0.32 -0.02 0.00 -1.23 0.00 0.00 61.79 60.33 1lxm h SER 387 Cb 0.33 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.27 1lxm h SER 387 CO 0.01 0.37 -0.24 -0.07 -0.53 0.00 0.00 176.83 176.37 1lxm h LEU 388 N -0.24 -0.56 -3.51 2.23 3.38 -0.85 -3.14 115.31 112.63 1lxm h LEU 388 Ca 0.01 -0.04 -0.40 0.00 0.09 0.00 0.00 57.88 57.54 1lxm h LEU 388 Cb 0.34 0.15 -0.19 0.00 0.09 0.00 0.00 40.66 41.04 1lxm h LEU 388 CO 0.00 -0.30 0.51 0.23 0.09 0.00 0.00 178.44 178.97 1lxm n MET 389 N -5.32 1.98 -0.31 1.13 2.81 0.27 -4.64 117.12 113.04 1lxm n MET 389 Ca -0.11 -2.06 0.12 0.00 -1.81 0.00 0.00 57.70 53.83 1lxm n MET 389 Cb 0.30 -1.81 0.29 0.00 -0.71 0.00 0.00 33.22 31.29 1lxm n MET 389 CO 0.00 0.00 0.00 -0.97 1.51 0.00 0.00 175.97 176.51 1lxm h ASN 390 N 1.24 0.41 0.78 7.83 -0.73 -1.03 -1.24 115.58 122.84 1lxm h ASN 390 Ca 0.40 0.14 0.00 0.00 1.87 0.00 0.00 56.30 58.71 1lxm h ASN 390 Cb 1.43 0.09 0.00 0.00 0.27 0.00 0.00 38.32 40.11 1lxm h ASN 390 CO 0.91 0.07 0.00 0.59 -0.37 0.00 0.00 177.43 178.63 1lxm n ASN 391 N -4.99 0.26 -0.74 1.15 5.03 -1.26 -3.13 115.26 111.58 1lxm n ASN 391 Ca 0.21 0.55 0.13 0.00 0.87 0.00 0.00 54.58 56.34 1lxm n ASN 391 Cb 0.60 -0.61 0.25 0.00 -1.02 0.00 0.00 39.78 39.01 1lxm n ASN 391 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1lxm n TYR 392 N -1.77 0.00 -4.40 3.10 4.01 -0.47 -0.58 117.16 117.05 1lxm n TYR 392 Ca 0.04 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.51 1lxm n TYR 392 Cb 0.25 -0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.16 1lxm n TYR 392 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1lxm s PHE 393 N -2.05 2.27 0.60 -0.72 0.40 -1.18 -4.70 117.98 112.60 1lxm s PHE 393 Ca 0.31 -0.37 -0.09 0.00 -0.60 0.00 0.00 56.93 56.17 1lxm s PHE 393 Cb 0.20 -1.17 -0.03 0.00 0.51 0.00 0.00 43.02 42.53 1lxm s PHE 393 CO 0.34 0.42 0.98 0.95 0.70 0.00 0.00 175.22 178.60 1lxm s THR 394 N -1.43 4.52 -0.13 0.64 -4.23 -1.26 -4.92 115.64 108.83 1lxm s THR 394 Ca 0.17 0.62 0.30 0.00 -1.18 0.00 0.00 61.69 61.60 1lxm s THR 394 Cb -0.09 -3.79 0.34 0.00 1.34 0.00 0.00 72.50 70.31 1lxm s THR 394 CO 0.08 -0.97 1.88 0.44 -0.54 0.00 0.00 174.62 175.51 1lxm h ASP 395 N -0.23 0.00 -0.09 3.99 3.32 -1.97 -2.56 116.42 118.88 1lxm h ASP 395 Ca -0.45 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.52 1lxm h ASP 395 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1lxm h ASP 395 CO 0.62 0.00 -0.28 0.00 -1.72 0.00 0.00 179.24 177.86 1lxm h ALA 396 N 2.10 0.15 -0.00 3.45 0.00 -1.99 -2.82 119.26 120.14 1lxm h ALA 396 Ca 0.00 -0.42 -0.13 0.00 0.00 0.00 0.00 54.91 54.37 1lxm h ALA 396 Cb 0.51 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1lxm h ALA 396 CO 0.00 0.17 -0.59 1.05 0.00 0.00 0.00 179.25 179.87 1lxm h GLU 397 N -0.12 0.01 -0.23 0.00 4.11 -1.89 -2.12 114.58 114.34 1lxm h GLU 397 Ca -0.01 -0.01 -0.06 0.00 0.07 0.00 0.00 59.36 59.35 1lxm h GLU 397 Cb 0.90 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.14 1lxm h GLU 397 CO 0.06 0.60 -0.13 0.82 0.07 0.00 0.00 179.01 180.43 1lxm h ILE 398 N 0.01 1.21 -0.17 -1.06 2.04 -1.51 0.24 117.51 118.28 1lxm h ILE 398 Ca -0.01 -0.93 -0.09 0.00 1.00 0.00 0.00 64.86 64.83 1lxm h ILE 398 Cb 1.05 1.18 -0.00 0.00 -0.74 0.00 0.00 36.82 38.32 1lxm h ILE 398 CO 0.08 0.30 -0.26 0.50 0.00 0.00 0.00 178.15 178.77 1lxm h LYS 399 N 0.35 0.48 -0.17 2.37 3.11 -1.21 -2.51 116.57 118.99 1lxm h LYS 399 Ca 0.07 -0.28 0.04 0.00 -2.81 0.00 0.00 60.65 57.66 1lxm h LYS 399 Cb 0.45 0.03 -0.04 0.00 -1.00 0.00 0.00 32.23 31.67 1lxm h LYS 399 CO 0.03 0.88 -0.07 1.15 -2.81 0.00 0.00 179.45 178.63 1lxm h THR 400 N 0.11 0.77 0.00 1.00 2.02 -0.86 0.46 112.91 116.43 1lxm h THR 400 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.20 1lxm h THR 400 Cb 0.84 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1lxm h THR 400 CO 0.06 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 174.73 1lxm n TYR 401 N -5.21 0.85 0.33 3.16 4.01 0.03 -2.99 117.16 117.34 1lxm n TYR 401 Ca -0.03 0.31 0.11 0.00 -0.16 0.00 0.00 57.90 58.13 1lxm n TYR 401 Cb 0.14 -1.01 -0.13 0.00 -0.31 0.00 0.00 39.34 38.03 1lxm n TYR 401 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1lxm n THR 402 N -2.26 0.03 -0.17 -0.72 -2.24 -0.73 -4.44 114.28 103.75 1lxm n THR 402 Ca 0.03 -0.34 -0.01 0.00 -2.27 0.00 0.00 64.05 61.46 1lxm n THR 402 Cb 0.28 0.30 0.08 0.00 -2.10 0.00 0.00 70.33 68.88 1lxm n THR 402 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1lxm h ASP 403 N 0.00 -0.09 -0.70 3.42 3.45 -0.84 -1.02 116.42 120.64 1lxm h ASP 403 Ca 0.00 0.11 0.13 0.00 0.43 0.00 0.00 57.03 57.70 1lxm h ASP 403 Cb 0.83 0.17 -0.05 0.00 -0.56 0.00 0.00 39.33 39.73 1lxm h ASP 403 CO 0.00 -0.02 0.47 1.55 -1.57 0.00 0.00 179.24 179.67 1lxm h PRO 404 N 0.19 0.42 -0.53 3.56 0.13 -1.78 -0.34 132.00 133.65 1lxm h PRO 404 Ca 0.27 -0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 65.30 1lxm h PRO 404 Cb 0.40 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 31.42 1lxm h PRO 404 CO -0.39 0.28 0.00 0.82 -0.23 0.00 0.00 178.00 178.48 1lxm h ILE 405 N 0.44 1.25 0.00 -3.56 2.04 -1.47 0.20 117.51 116.41 1lxm h ILE 405 Ca 0.34 -1.07 -0.09 0.00 1.00 0.00 0.00 64.86 65.03 1lxm h ILE 405 Cb 0.71 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1lxm h ILE 405 CO -0.10 0.38 -0.45 -0.33 0.00 0.00 0.00 178.15 177.65 1lxm h GLU 406 N 0.84 0.00 -0.03 2.37 4.39 -0.84 0.31 114.58 121.62 1lxm h GLU 406 Ca 0.16 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.72 1lxm h GLU 406 Cb 0.49 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.15 1lxm h GLU 406 CO 0.02 0.45 -0.54 1.25 -1.16 0.00 0.00 179.01 179.04 1lxm h HIS 407 N 0.00 0.60 0.01 4.33 -0.00 -0.05 -2.98 115.15 117.07 1lxm h HIS 407 Ca -0.00 -0.30 -0.25 0.00 -0.00 0.00 0.00 60.37 59.81 1lxm h HIS 407 Cb 0.84 -0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 28.14 1lxm h HIS 407 CO 0.00 1.10 -1.28 0.74 -0.00 0.00 0.00 177.93 178.49 1lxm h PHE 408 N -0.08 0.06 -2.25 5.26 0.04 -0.58 -3.39 116.94 115.99 1lxm h PHE 408 Ca -0.06 -0.04 -0.59 0.00 2.80 0.00 0.00 57.97 60.08 1lxm h PHE 408 Cb 1.23 -0.00 -0.41 0.00 2.20 0.00 0.00 35.95 38.97 1lxm h PHE 408 CO 0.14 1.04 -0.81 0.28 -0.60 0.00 0.00 178.31 178.36 1lxm n VAL 409 N -3.27 0.80 0.17 -0.55 0.31 0.11 -4.50 118.33 111.41 1lxm n VAL 409 Ca -0.07 -4.56 0.06 0.00 -0.01 0.00 0.00 64.34 59.76 1lxm n VAL 409 Cb 0.99 -2.01 0.11 0.00 -0.91 0.00 0.00 33.84 32.02 1lxm n VAL 409 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1lxm h PRO 410 N 4.42 0.00 -4.71 5.55 0.13 -1.68 -3.41 132.00 132.30 1lxm h PRO 410 Ca 0.16 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.60 1lxm h PRO 410 Cb 0.78 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 31.57 1lxm h PRO 410 CO 0.64 0.34 -0.67 0.34 -0.23 0.00 0.00 178.00 178.42 1lxm s ASP 411 N -6.36 4.98 0.10 1.44 -1.08 -1.26 -4.97 116.67 109.51 1lxm s ASP 411 Ca 0.04 -1.46 0.06 0.00 -0.52 0.00 0.00 52.55 50.68 1lxm s ASP 411 Cb 0.07 -1.74 0.32 0.00 -1.46 0.00 0.00 42.92 40.12 1lxm s ASP 411 CO 0.71 -0.32 1.13 0.00 0.52 0.00 0.00 175.17 177.21 1lxm n ALA 412 N 4.61 0.89 0.23 3.66 0.00 -1.26 -1.78 120.51 126.86 1lxm n ALA 412 Ca -0.10 0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.50 1lxm n ALA 412 Cb 0.43 -0.97 -0.12 0.00 0.00 0.00 0.00 19.45 18.79 1lxm n ALA 412 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1lxm n GLU 413 N -1.68 0.51 -4.23 0.00 1.02 -1.26 -4.84 120.64 110.15 1lxm n GLU 413 Ca -0.00 -0.11 -0.15 0.00 -0.02 0.00 0.00 57.16 56.87 1lxm n GLU 413 Cb 0.08 -1.56 -0.10 0.00 -0.02 0.00 0.00 31.44 29.84 1lxm n GLU 413 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1lxm s TYR 414 N -3.38 1.26 -0.01 -0.32 1.51 -0.73 0.50 117.35 116.17 1lxm s TYR 414 Ca -0.03 -0.67 0.06 0.00 -1.01 0.00 0.00 57.07 55.42 1lxm s TYR 414 Cb 0.14 -0.65 -0.03 0.00 -0.11 0.00 0.00 41.96 41.31 1lxm s TYR 414 CO 0.88 0.09 -0.20 -0.06 -1.11 0.00 0.00 175.55 175.15 1lxm s PHE 415 N -2.78 2.52 -0.45 2.71 0.08 -0.33 -4.65 117.98 115.08 1lxm s PHE 415 Ca 0.12 -0.29 -0.01 0.00 0.12 0.00 0.00 56.93 56.87 1lxm s PHE 415 Cb -0.01 -1.53 0.00 0.00 -0.57 0.00 0.00 43.02 40.91 1lxm s PHE 415 CO 0.01 0.12 0.07 0.54 -0.10 0.00 0.00 175.22 175.87 1lxm n ARG 416 N 2.14 -0.82 0.03 0.44 1.74 -1.26 -1.97 116.66 116.96 1lxm n ARG 416 Ca -0.17 0.26 0.06 0.00 -0.77 0.00 0.00 57.85 57.23 1lxm n ARG 416 Cb 0.52 -3.92 0.26 0.00 -1.02 0.00 0.00 32.46 28.30 1lxm n ARG 416 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1lxm n LYS 417 N -1.57 0.04 0.00 5.56 4.76 -1.26 -0.99 118.16 124.69 1lxm n LYS 417 Ca -0.05 0.38 0.11 0.00 -2.87 0.00 0.00 58.31 55.88 1lxm n LYS 417 Cb 0.54 -1.59 0.05 0.00 -1.84 0.00 0.00 35.03 32.19 1lxm n LYS 417 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 1lxm n THR 418 N -1.66 0.00 -3.58 -0.18 -2.24 -1.26 -4.96 114.28 100.40 1lxm n THR 418 Ca 0.02 -0.19 -0.05 0.00 -2.27 0.00 0.00 64.05 61.55 1lxm n THR 418 Cb 0.11 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.39 1lxm n THR 418 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1lxm n LEU 419 N -0.39 0.00 -0.71 3.22 4.32 -0.16 -5.01 117.00 118.26 1lxm n LEU 419 Ca 0.09 -0.57 0.10 0.00 -0.02 0.00 0.00 56.01 55.61 1lxm n LEU 419 Cb 0.42 -0.01 0.31 0.00 -1.62 0.00 0.00 43.42 42.53 1lxm n LEU 419 CO 0.30 -0.32 0.74 1.33 -1.22 0.00 0.00 177.39 178.23 1lxm n VAL 420 N -0.76 0.32 -2.59 4.08 0.24 -1.26 -4.38 118.33 113.98 1lxm n VAL 420 Ca -0.00 -0.46 -0.13 0.00 -2.04 0.00 0.00 64.34 61.70 1lxm n VAL 420 Cb 0.13 0.49 0.03 0.00 -1.47 0.00 0.00 33.84 33.01 1lxm n VAL 420 CO 0.00 0.00 0.00 -0.46 -2.14 0.00 0.00 176.83 174.23 1lxm n ASN 421 N 0.63 2.61 -4.71 -1.34 2.04 -1.26 -5.10 115.26 108.12 1lxm n ASN 421 Ca 0.16 -2.93 -0.43 0.00 -0.44 0.00 0.00 54.58 50.94 1lxm n ASN 421 Cb 0.39 -0.48 -0.02 0.00 -2.53 0.00 0.00 39.78 37.13 1lxm n ASN 421 CO 0.00 0.00 0.00 -0.81 -0.44 0.00 0.00 177.26 176.01 1lxm n PRO 422 N -0.33 2.49 -4.43 -0.53 -0.04 -1.23 -4.87 135.00 126.07 1lxm n PRO 422 Ca 0.19 0.89 -0.21 0.00 -0.04 0.00 0.00 63.50 64.34 1lxm n PRO 422 Cb 0.79 -2.65 -0.14 0.00 -0.04 0.00 0.00 33.50 31.46 1lxm n PRO 422 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1lxm s PHE 423 N 0.28 1.28 0.29 0.54 -0.71 -0.83 -4.95 117.98 113.88 1lxm s PHE 423 Ca 0.68 -0.33 -0.30 0.00 -1.04 0.00 0.00 56.93 55.94 1lxm s PHE 423 Cb -0.55 -0.77 -0.11 0.00 -1.21 0.00 0.00 43.02 40.37 1lxm s PHE 423 CO 0.45 0.03 1.58 0.21 -1.34 0.00 0.00 175.22 176.15 1lxm s LYS 424 N -1.00 4.13 -0.23 1.99 2.20 -1.26 -1.18 119.74 124.38 1lxm s LYS 424 Ca 0.03 2.56 -0.29 0.00 -0.36 0.00 0.00 55.97 57.91 1lxm s LYS 424 Cb -0.07 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 33.22 1lxm s LYS 424 CO 0.01 -0.61 1.16 0.00 -0.36 0.00 0.00 175.35 175.55 1lxm s ALA 425 N -0.07 3.60 0.02 3.13 0.00 0.18 -4.83 121.76 123.79 1lxm s ALA 425 Ca 0.62 0.23 -0.03 0.00 0.00 0.00 0.00 51.96 52.78 1lxm s ALA 425 Cb -0.47 -3.63 -0.02 0.00 0.00 0.00 0.00 23.12 19.00 1lxm s ALA 425 CO 0.49 -1.27 0.03 -0.51 0.00 0.00 0.00 175.76 174.50 1lxm s LEU 426 N 3.55 2.02 0.00 0.00 1.43 -1.26 -4.52 118.68 119.90 1lxm s LEU 426 Ca 0.50 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.10 1lxm s LEU 426 Cb -0.17 0.34 0.00 0.00 0.03 0.00 0.00 46.19 46.39 1lxm s LEU 426 CO 0.13 -0.39 0.00 0.61 0.23 0.00 0.00 176.35 176.93 1lxm n GLY 427 N 1.22 4.28 0.26 -3.19 0.00 -1.26 -2.52 105.19 103.98 1lxm n GLY 427 Ca -0.22 0.12 -0.06 0.00 0.00 0.00 0.00 46.02 45.86 1lxm n GLY 427 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1lxm h GLY 428 N 0.00 0.91 1.08 -0.02 0.00 -1.95 -1.37 103.07 101.72 1lxm h GLY 428 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 47.33 46.92 1lxm h GLY 428 CO 0.00 0.35 0.30 3.43 0.00 0.00 0.00 176.54 180.62 1lxm h ASN 429 N 0.86 1.08 0.24 0.19 2.35 -1.89 -1.70 115.58 116.72 1lxm h ASN 429 Ca 0.23 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.72 1lxm h ASN 429 Cb -0.06 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.02 1lxm h ASN 429 CO -0.05 0.96 -0.36 0.25 -1.65 0.00 0.00 177.43 176.58 1lxm h LEU 430 N 1.13 0.18 0.47 1.61 5.85 -1.43 0.13 115.31 123.25 1lxm h LEU 430 Ca 0.26 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 1lxm h LEU 430 Cb 0.23 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1lxm h LEU 430 CO -0.02 0.53 -0.22 0.58 -0.34 0.00 0.00 178.44 178.97 1lxm h VAL 431 N 0.15 0.47 -0.90 1.05 2.07 -0.72 -1.32 116.25 117.05 1lxm h VAL 431 Ca 0.02 -0.37 0.17 0.00 0.82 0.00 0.00 66.70 67.33 1lxm h VAL 431 Cb 0.71 0.62 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 1lxm h VAL 431 CO 0.05 0.06 0.58 0.44 0.02 0.00 0.00 177.57 178.72 1lxm h ASP 432 N -0.87 0.59 -0.36 0.57 3.45 -1.10 0.15 116.42 118.85 1lxm h ASP 432 Ca -0.06 0.05 -0.13 0.00 0.43 0.00 0.00 57.03 57.32 1lxm h ASP 432 Cb 0.58 -0.07 -0.01 0.00 -0.56 0.00 0.00 39.33 39.27 1lxm h ASP 432 CO 0.11 0.27 -0.24 -0.03 -1.57 0.00 0.00 179.24 177.78 1lxm h MET 433 N 0.61 0.87 -0.32 3.56 4.05 -0.83 -1.80 114.93 121.08 1lxm h MET 433 Ca 0.47 -0.37 -0.09 0.00 -0.28 0.00 0.00 59.70 59.42 1lxm h MET 433 Cb 0.87 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.62 1lxm h MET 433 CO -0.22 1.02 -0.19 0.78 0.23 0.00 0.00 176.91 178.53 1lxm h GLY 434 N 0.92 0.65 0.99 1.39 0.00 0.40 -0.16 103.07 107.26 1lxm h GLY 434 Ca 0.10 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 1lxm h GLY 434 CO 0.07 0.47 0.14 -0.09 0.00 0.00 0.00 176.54 177.13 1lxm h ARG 435 N 0.54 0.85 0.27 4.80 9.65 -0.81 -0.71 114.38 128.96 1lxm h ARG 435 Ca 0.08 -0.20 -0.01 0.00 -1.10 0.00 0.00 59.98 58.75 1lxm h ARG 435 Cb 0.63 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.10 1lxm h ARG 435 CO 0.04 0.80 -0.13 0.28 2.80 0.00 0.00 179.97 183.76 1lxm h VAL 436 N 0.74 0.39 -0.21 0.20 2.07 -1.07 -3.28 116.25 115.10 1lxm h VAL 436 Ca 0.17 -0.87 -0.13 0.00 0.82 0.00 0.00 66.70 66.69 1lxm h VAL 436 Cb 0.32 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1lxm h VAL 436 CO -0.00 0.10 -0.41 0.11 0.02 0.00 0.00 177.57 177.39 1lxm h LYS 437 N -1.01 0.49 -0.04 1.57 1.79 -1.12 0.14 116.57 118.39 1lxm h LYS 437 Ca -0.04 -0.25 -0.01 0.00 -2.18 0.00 0.00 60.65 58.18 1lxm h LYS 437 Cb 0.44 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1lxm h LYS 437 CO 0.06 0.81 0.00 0.82 -1.08 0.00 0.00 179.45 180.07 1lxm h ILE 438 N 0.40 1.22 -0.43 1.86 2.04 -1.30 0.98 117.51 122.29 1lxm h ILE 438 Ca 0.03 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.16 1lxm h ILE 438 Cb 0.89 1.60 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 1lxm h ILE 438 CO 0.08 0.18 0.05 0.40 0.00 0.00 0.00 178.15 178.86 1lxm h ILE 439 N -0.19 1.21 -0.71 -0.67 1.08 -1.61 -1.64 117.51 114.97 1lxm h ILE 439 Ca 0.01 -0.82 -0.04 0.00 -0.39 0.00 0.00 64.86 63.62 1lxm h ILE 439 Cb 0.29 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 34.84 1lxm h ILE 439 CO 0.00 0.29 0.28 -0.08 -0.69 0.00 0.00 178.15 177.95 1lxm h GLU 440 N 0.65 1.07 0.00 2.37 4.81 -0.74 0.18 114.58 122.91 1lxm h GLU 440 Ca 0.14 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.11 1lxm h GLU 440 Cb 0.33 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 1lxm h GLU 440 CO 0.01 0.88 -0.31 0.78 -0.73 0.00 0.00 179.01 179.63 1lxm h GLY 441 N 1.02 0.00 1.43 1.92 0.00 -0.36 -0.73 103.07 106.35 1lxm h GLY 441 Ca 0.24 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.30 1lxm h GLY 441 CO -0.02 0.00 -1.14 1.41 0.00 0.00 0.00 176.54 176.79 1lxm h LEU 442 N 0.00 0.67 -0.32 3.11 3.38 -0.76 0.52 115.31 121.91 1lxm h LEU 442 Ca -0.00 -0.61 -0.12 0.00 0.09 0.00 0.00 57.88 57.24 1lxm h LEU 442 Cb 0.89 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 1lxm h LEU 442 CO 0.04 1.43 -0.25 -0.07 0.09 0.00 0.00 178.44 179.67 1lxm h LEU 443 N 0.22 0.78 -1.16 1.67 3.38 -0.42 -2.94 115.31 116.84 1lxm h LEU 443 Ca -0.14 -0.45 0.00 0.00 0.09 0.00 0.00 57.88 57.38 1lxm h LEU 443 Cb 1.81 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.34 1lxm h LEU 443 CO 0.21 1.06 0.00 0.54 0.09 0.00 0.00 178.44 180.34 1lxm n ARG 444 N -4.26 1.75 -3.97 1.13 1.74 -0.30 -4.89 116.66 107.85 1lxm n ARG 444 Ca -0.03 -1.14 -0.31 0.00 -0.77 0.00 0.00 57.85 55.59 1lxm n ARG 444 Cb 0.45 -1.35 0.02 0.00 -1.02 0.00 0.00 32.46 30.56 1lxm n ARG 444 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1lxm n LYS 445 N 0.38 -5.11 -3.88 5.56 5.02 -0.27 -4.95 118.16 114.91 1lxm n LYS 445 Ca 0.15 0.56 -0.35 0.00 -2.02 0.00 0.00 58.31 56.64 1lxm n LYS 445 Cb 0.31 -5.43 -0.13 0.00 -0.02 0.00 0.00 35.03 29.77 1lxm n LYS 445 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1lxm s ASP 446 N -3.29 4.98 0.42 4.39 2.15 0.17 -4.96 116.67 120.52 1lxm s ASP 446 Ca 0.69 -1.43 0.29 0.00 0.43 0.00 0.00 52.55 52.53 1lxm s ASP 446 Cb -0.35 -1.74 1.19 0.00 -0.30 0.00 0.00 42.92 41.72 1lxm s ASP 446 CO 0.85 -0.32 1.86 0.78 -0.17 0.00 0.00 175.17 178.17 1lxm h ASN 447 N 8.01 0.00 1.05 -0.34 4.21 -1.93 -2.37 115.58 124.21 1lxm h ASN 447 Ca -0.19 0.00 -0.06 0.00 1.21 0.00 0.00 56.30 57.26 1lxm h ASN 447 Cb 1.06 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 38.25 1lxm h ASN 447 CO 0.57 0.00 -0.29 0.74 -1.29 0.00 0.00 177.43 177.15 1lxm h THR 448 N 0.00 0.65 0.02 2.81 2.02 -1.95 0.37 112.91 116.83 1lxm h THR 448 Ca 0.00 -1.38 -0.05 0.00 0.77 0.00 0.00 66.41 65.75 1lxm h THR 448 Cb 0.45 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 1lxm h THR 448 CO 0.00 0.29 -0.19 0.40 0.37 0.00 0.00 175.52 176.39 1lxm h ILE 449 N 0.00 1.65 -0.44 3.11 2.04 -1.80 -1.52 117.51 120.55 1lxm h ILE 449 Ca -0.00 -2.14 -0.02 0.00 1.00 0.00 0.00 64.86 63.69 1lxm h ILE 449 Cb 0.90 3.07 -0.02 0.00 -0.74 0.00 0.00 36.82 40.02 1lxm h ILE 449 CO 0.04 0.57 0.19 0.40 0.00 0.00 0.00 178.15 179.35 1lxm h ILE 450 N -0.71 1.19 -0.16 -0.67 2.04 -1.47 0.34 117.51 118.07 1lxm h ILE 450 Ca -0.03 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1lxm h ILE 450 Cb 1.04 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.87 1lxm h ILE 450 CO 0.04 0.22 0.11 1.05 0.00 0.00 0.00 178.15 179.56 1lxm h GLU 451 N 0.57 0.21 -0.17 2.37 -0.00 -0.34 0.48 114.58 117.71 1lxm h GLU 451 Ca 0.15 -0.01 -0.10 0.00 -0.00 0.00 0.00 59.36 59.40 1lxm h GLU 451 Cb 0.16 -0.05 -0.01 0.00 -0.00 0.00 0.00 28.75 28.85 1lxm h GLU 451 CO -0.02 0.14 -0.32 0.87 -0.00 0.00 0.00 179.01 179.69 1lxm h LYS 452 N 0.22 0.33 -0.03 1.06 1.57 -1.05 -1.93 116.57 116.73 1lxm h LYS 452 Ca 0.06 -0.13 -0.24 0.00 -1.87 0.00 0.00 60.65 58.47 1lxm h LYS 452 Cb -0.02 -0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.28 1lxm h LYS 452 CO -0.01 0.62 -0.94 1.15 -0.57 0.00 0.00 179.45 179.69 1lxm h THR 453 N 0.29 1.33 0.42 -0.16 2.02 0.13 -1.86 112.91 115.08 1lxm h THR 453 Ca 0.04 -2.26 -0.01 0.00 0.77 0.00 0.00 66.41 64.94 1lxm h THR 453 Cb 0.71 2.31 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 1lxm h THR 453 CO 0.05 0.69 -0.27 0.28 0.37 0.00 0.00 175.52 176.65 1lxm h SER 454 N 0.35 -0.68 -0.56 4.18 0.02 0.13 0.85 113.55 117.85 1lxm h SER 454 Ca -0.09 0.04 0.10 0.00 -0.84 0.00 0.00 61.79 61.00 1lxm h SER 454 Cb 1.58 0.20 -0.08 0.00 0.14 0.00 0.00 62.40 64.25 1lxm h SER 454 CO 0.18 -0.42 0.13 -0.74 -1.14 0.00 0.00 176.83 174.84 1lxm h HIS 455 N -0.67 0.21 -0.57 3.45 6.17 -1.39 0.28 115.15 122.63 1lxm h HIS 455 Ca -0.05 0.03 -0.07 0.00 0.71 0.00 0.00 60.37 61.00 1lxm h HIS 455 Cb 0.55 -0.01 -0.02 0.00 2.52 0.00 0.00 27.41 30.45 1lxm h HIS 455 CO -0.10 -0.00 0.10 1.03 0.71 0.00 0.00 177.93 179.66 1lxm h SER 456 N 0.27 0.90 -0.15 3.26 0.87 -0.94 -2.56 113.55 115.20 1lxm h SER 456 Ca 0.29 -0.26 0.04 0.00 -1.23 0.00 0.00 61.79 60.63 1lxm h SER 456 Cb 0.40 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.12 1lxm h SER 456 CO -0.36 0.93 0.12 0.25 -0.53 0.00 0.00 176.83 177.24 1lxm h LEU 457 N 0.83 0.00 -2.65 2.23 5.85 0.27 -0.89 115.31 120.95 1lxm h LEU 457 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1lxm h LEU 457 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1lxm h LEU 457 CO 0.01 0.00 0.00 0.11 -0.34 0.00 0.00 178.44 178.22 1lxm h LYS 458 N 0.00 0.00 0.00 1.25 1.79 -0.68 -1.52 116.57 117.41 1lxm h LYS 458 Ca 0.07 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.54 1lxm h LYS 458 Cb 0.31 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.96 1lxm h LYS 458 CO -0.00 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 178.46 1lxm n ASN 459 N -2.90 0.00 0.00 0.86 3.02 -0.34 -1.59 115.26 114.31 1lxm n ASN 459 Ca -0.03 -0.38 -0.09 0.00 -0.03 0.00 0.00 54.58 54.05 1lxm n ASN 459 Cb 0.06 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.10 1lxm n ASN 459 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1lxm h LEU 460 N 0.00 0.02 -7.36 3.41 3.38 -1.49 -3.42 115.31 109.84 1lxm h LEU 460 Ca 0.00 -0.03 -0.73 0.00 0.09 0.00 0.00 57.88 57.21 1lxm h LEU 460 Cb 0.00 -0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.60 1lxm h LEU 460 CO 0.00 1.02 1.78 0.49 0.09 0.00 0.00 178.44 181.82 1lxm n PHE 461 N -3.14 4.39 -3.68 1.13 3.72 -0.62 -4.89 117.46 114.37 1lxm n PHE 461 Ca -0.13 -3.12 -0.10 0.00 -0.05 0.00 0.00 57.45 54.05 1lxm n PHE 461 Cb 1.02 -2.24 -0.05 0.00 -0.94 0.00 0.00 39.48 37.27 1lxm n PHE 461 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1lxm s THR 462 N 1.90 0.07 -0.25 4.37 -4.23 -1.26 -5.08 115.64 111.15 1lxm s THR 462 Ca 0.44 -0.68 -0.08 0.00 -1.18 0.00 0.00 61.69 60.19 1lxm s THR 462 Cb 0.02 -1.28 -0.03 0.00 1.34 0.00 0.00 72.50 72.55 1lxm s THR 462 CO 0.01 -0.30 0.09 -0.89 -0.54 0.00 0.00 174.62 172.99 1lxm s THR 463 N -3.83 4.49 0.29 3.99 2.01 -1.26 -4.55 115.64 116.79 1lxm s THR 463 Ca 0.05 -0.11 -0.29 0.00 0.31 0.00 0.00 61.69 61.65 1lxm s THR 463 Cb 0.02 -3.10 -0.09 0.00 0.01 0.00 0.00 72.50 69.33 1lxm s THR 463 CO -0.10 0.34 1.08 0.00 -0.69 0.00 0.00 174.62 175.25 1lxm s ALA 464 N 1.53 3.36 -0.04 7.40 0.00 0.77 -4.94 121.76 129.85 1lxm s ALA 464 Ca 0.06 0.85 0.04 0.00 0.00 0.00 0.00 51.96 52.92 1lxm s ALA 464 Cb -0.15 -3.31 -0.06 0.00 0.00 0.00 0.00 23.12 19.60 1lxm s ALA 464 CO 0.05 -0.14 0.10 0.25 0.00 0.00 0.00 175.76 176.02 1lxm n THR 465 N 1.04 0.00 -3.58 0.00 -2.24 -1.26 -4.23 114.28 104.01 1lxm n THR 465 Ca -0.00 -0.15 -0.15 0.00 -2.27 0.00 0.00 64.05 61.48 1lxm n THR 465 Cb 0.46 0.51 -0.06 0.00 -2.10 0.00 0.00 70.33 69.13 1lxm n THR 465 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1lxm s LYS 466 N -2.14 1.00 5.92 -0.78 2.20 -1.26 -5.11 119.74 119.57 1lxm s LYS 466 Ca -0.01 -0.04 0.00 0.00 -0.36 0.00 0.00 55.97 55.56 1lxm s LYS 466 Cb 0.03 0.46 0.00 0.00 -1.51 0.00 0.00 37.83 36.81 1lxm s LYS 466 CO 0.17 -0.33 0.00 0.00 -0.36 0.00 0.00 175.35 174.83 1lxm n ALA 467 N 0.71 0.00 -2.91 3.13 0.00 -1.26 -4.85 120.51 115.33 1lxm n ALA 467 Ca -0.19 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 52.97 1lxm n ALA 467 Cb 0.58 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.00 1lxm n ALA 467 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1lxm s GLU 468 N 0.00 3.36 0.00 0.00 8.01 -1.26 -4.70 118.70 124.11 1lxm s GLU 468 Ca 0.00 -0.56 0.00 0.00 0.01 0.00 0.00 54.97 54.42 1lxm s GLU 468 Cb 0.00 -2.95 0.00 0.00 -4.31 0.00 0.00 34.13 26.87 1lxm s GLU 468 CO 0.00 0.56 0.00 0.41 0.01 0.00 0.00 175.26 176.24 1lxm n GLY 469 N -0.13 0.73 3.59 -1.39 0.00 -0.34 -4.78 105.19 102.87 1lxm n GLY 469 Ca -0.06 -2.09 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 1lxm n GLY 469 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lxm s PHE 470 N -1.09 3.22 0.73 1.61 0.08 -1.26 -1.74 117.98 119.53 1lxm s PHE 470 Ca 0.00 0.50 -0.08 0.00 0.12 0.00 0.00 56.93 57.47 1lxm s PHE 470 Cb 0.00 -2.90 0.07 0.00 -0.57 0.00 0.00 43.02 39.62 1lxm s PHE 470 CO 0.00 -0.44 1.07 0.71 -0.10 0.00 0.00 175.22 176.46 1lxm s TYR 471 N 2.48 2.94 0.28 0.36 1.51 0.71 -0.16 117.35 125.46 1lxm s TYR 471 Ca 0.23 0.55 -0.02 0.00 -1.01 0.00 0.00 57.07 56.81 1lxm s TYR 471 Cb -0.15 -3.28 0.42 0.00 -0.11 0.00 0.00 41.96 38.83 1lxm s TYR 471 CO 0.11 -1.51 1.94 0.00 -1.11 0.00 0.00 175.55 174.98 1lxm h ALA 472 N -0.73 1.40 -0.16 3.71 0.00 -1.88 -2.04 119.26 119.56 1lxm h ALA 472 Ca -0.45 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1lxm h ALA 472 Cb 1.32 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1lxm h ALA 472 CO 0.62 0.52 0.00 -0.40 0.00 0.00 0.00 179.25 179.99 1lxm n ASP 473 N -4.43 1.24 0.00 0.00 3.85 -1.26 -4.88 116.55 111.07 1lxm n ASP 473 Ca 0.12 -2.06 0.00 0.00 -0.71 0.00 0.00 54.79 52.13 1lxm n ASP 473 Cb 0.08 -0.24 0.00 0.00 -1.35 0.00 0.00 41.12 39.61 1lxm n ASP 473 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1lxm n GLY 474 N 0.58 1.28 3.76 6.12 0.00 -0.77 -4.76 105.19 111.41 1lxm n GLY 474 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 1lxm n GLY 474 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1lxm s SER 475 N -3.04 5.80 -0.11 1.61 0.01 -1.26 -4.27 113.70 112.43 1lxm s SER 475 Ca 0.00 2.38 0.01 0.00 1.31 0.00 0.00 55.95 59.65 1lxm s SER 475 Cb 0.00 -2.60 0.02 0.00 0.21 0.00 0.00 66.02 63.65 1lxm s SER 475 CO 0.00 -1.18 -0.11 -0.47 0.41 0.00 0.00 173.24 171.89 1lxm s TYR 476 N -1.54 1.66 0.07 2.43 5.04 -1.26 -0.21 117.35 123.54 1lxm s TYR 476 Ca 0.68 -0.79 0.08 0.00 -2.44 0.00 0.00 57.07 54.60 1lxm s TYR 476 Cb -0.30 -1.28 -0.04 0.00 0.35 0.00 0.00 41.96 40.69 1lxm s TYR 476 CO 0.36 -0.48 -0.19 0.42 -1.34 0.00 0.00 175.55 174.32 1lxm s ILE 477 N 1.31 2.75 0.09 3.14 -1.09 -0.71 -1.36 121.20 125.32 1lxm s ILE 477 Ca -0.02 -1.34 -0.09 0.00 -2.23 0.00 0.00 60.65 56.97 1lxm s ILE 477 Cb -0.14 -2.20 -0.00 0.00 -1.58 0.00 0.00 42.46 38.54 1lxm s ILE 477 CO -0.05 0.24 0.19 -0.62 -1.23 0.00 0.00 174.94 173.47 1lxm s ASP 478 N -1.72 0.12 -1.02 3.58 -1.08 -0.64 -1.20 116.67 114.70 1lxm s ASP 478 Ca 0.16 -0.66 -0.05 0.00 -0.52 0.00 0.00 52.55 51.48 1lxm s ASP 478 Cb -0.10 0.34 0.01 0.00 -1.46 0.00 0.00 42.92 41.70 1lxm s ASP 478 CO 0.07 -0.73 0.88 1.41 0.52 0.00 0.00 175.17 177.32 1lxm n HIS 479 N -0.07 -2.09 0.00 -5.34 8.25 -1.26 -1.63 115.22 113.08 1lxm n HIS 479 Ca -0.15 0.78 0.00 0.00 -0.26 0.00 0.00 57.72 58.09 1lxm n HIS 479 Cb 0.62 -4.23 0.00 0.00 1.12 0.00 0.00 29.99 27.50 1lxm n HIS 479 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1lxm n THR 480 N -4.15 0.00 -2.76 1.59 -1.04 -1.26 -4.15 114.28 102.51 1lxm n THR 480 Ca -0.06 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 61.94 1lxm n THR 480 Cb 0.57 0.00 0.09 0.00 -1.82 0.00 0.00 70.33 69.17 1lxm n THR 480 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1lxm n ASN 481 N 3.78 0.14 -4.42 8.00 0.23 -1.24 -4.22 115.26 117.53 1lxm n ASN 481 Ca 0.00 -2.11 -0.33 0.00 -0.53 0.00 0.00 54.58 51.61 1lxm n ASN 481 Cb 0.00 0.07 -0.14 0.00 -2.08 0.00 0.00 39.78 37.63 1lxm n ASN 481 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1lxm s VAL 482 N -1.96 3.05 -0.15 3.53 1.01 -0.64 -1.80 120.40 123.44 1lxm s VAL 482 Ca 0.19 -0.69 -0.29 0.00 0.00 0.00 0.00 61.98 61.18 1lxm s VAL 482 Cb 0.38 -2.24 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1lxm s VAL 482 CO -0.08 0.56 1.70 0.00 0.00 0.00 0.00 175.10 177.27 1lxm s ALA 483 N -0.16 3.35 -0.27 5.51 0.00 -1.26 -1.62 121.76 127.31 1lxm s ALA 483 Ca -0.01 0.69 0.22 0.00 0.00 0.00 0.00 51.96 52.87 1lxm s ALA 483 Cb -0.13 -3.84 0.50 0.00 0.00 0.00 0.00 23.12 19.65 1lxm s ALA 483 CO 0.03 -1.82 1.11 0.66 0.00 0.00 0.00 175.76 175.74 1lxm n TYR 484 N 8.24 1.10 -0.09 0.00 4.01 -0.47 -4.18 117.16 125.77 1lxm n TYR 484 Ca 0.19 -2.20 -0.13 0.00 -0.16 0.00 0.00 57.90 55.61 1lxm n TYR 484 Cb 0.44 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 39.26 1lxm n TYR 484 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1lxm h THR 485 N 5.24 1.30 0.00 -0.72 2.02 -1.61 0.75 112.91 119.89 1lxm h THR 485 Ca -0.15 -1.37 0.00 0.00 0.77 0.00 0.00 66.41 65.66 1lxm h THR 485 Cb 1.26 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 69.24 1lxm h THR 485 CO 0.20 0.44 0.00 0.61 0.37 0.00 0.00 175.52 177.14 1lxm n GLY 486 N 0.10 -0.83 0.00 2.16 0.00 -0.51 -1.06 105.19 105.06 1lxm n GLY 486 Ca -0.04 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1lxm n GLY 486 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lxm n ALA 487 N -0.65 1.54 0.16 4.61 0.00 -1.22 -4.69 120.51 120.26 1lxm n ALA 487 Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.55 1lxm n ALA 487 Cb 0.03 0.00 0.50 0.00 0.00 0.00 0.00 19.45 19.97 1lxm n ALA 487 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1lxm h TYR 488 N 0.00 0.16 -0.13 0.00 0.05 -1.75 -1.79 116.97 113.52 1lxm h TYR 488 Ca 0.00 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.74 1lxm h TYR 488 Cb 0.00 -0.05 -0.00 0.00 1.01 0.00 0.00 36.73 37.69 1lxm h TYR 488 CO 0.00 0.21 -0.05 0.78 -1.05 0.00 0.00 178.16 178.04 1lxm h GLY 489 N 0.44 0.28 0.02 3.88 0.00 -0.69 -2.93 103.07 104.07 1lxm h GLY 489 Ca 0.04 -0.25 0.06 0.00 0.00 0.00 0.00 47.33 47.17 1lxm h GLY 489 CO 0.01 0.23 -0.35 3.43 0.00 0.00 0.00 176.54 179.85 1lxm h ASN 490 N -0.08 -1.11 -0.99 0.19 4.21 -0.27 -2.14 115.58 115.38 1lxm h ASN 490 Ca 0.03 0.17 0.13 0.00 1.21 0.00 0.00 56.30 57.84 1lxm h ASN 490 Cb 0.51 0.48 -0.09 0.00 -1.12 0.00 0.00 38.32 38.10 1lxm h ASN 490 CO 0.02 -0.37 0.61 0.58 -1.29 0.00 0.00 177.43 176.98 1lxm h VAL 491 N -0.38 0.87 0.12 2.81 2.07 -1.41 0.14 116.25 120.47 1lxm h VAL 491 Ca 0.11 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 1lxm h VAL 491 Cb 0.56 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1lxm h VAL 491 CO -0.42 0.17 -0.06 0.25 0.02 0.00 0.00 177.57 177.53 1lxm h LEU 492 N 0.92 -0.14 -1.37 2.57 5.85 -1.24 -1.38 115.31 120.52 1lxm h LEU 492 Ca 0.51 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.83 1lxm h LEU 492 Cb 0.58 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1lxm h LEU 492 CO -0.29 0.32 -0.01 -0.29 -0.34 0.00 0.00 178.44 177.82 1lxm h ILE 493 N -0.63 1.17 0.38 4.05 6.09 -1.16 0.12 117.51 127.52 1lxm h ILE 493 Ca -0.02 -0.67 -0.02 0.00 -1.37 0.00 0.00 64.86 62.79 1lxm h ILE 493 Cb 0.49 0.98 0.00 0.00 0.47 0.00 0.00 36.82 38.77 1lxm h ILE 493 CO 0.03 0.22 -0.18 -0.78 -3.07 0.00 0.00 178.15 174.37 1lxm h ASP 494 N 0.39 -0.43 -0.24 2.19 3.58 -0.68 -0.24 116.42 120.98 1lxm h ASP 494 Ca 0.09 -0.08 -0.06 0.00 0.42 0.00 0.00 57.03 57.40 1lxm h ASP 494 Cb 0.28 0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.42 1lxm h ASP 494 CO 0.01 -0.18 -0.02 1.23 -2.88 0.00 0.00 179.24 177.40 1lxm h GLY 495 N -0.68 0.61 1.30 -0.78 0.00 -1.02 -2.69 103.07 99.82 1lxm h GLY 495 Ca -0.05 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 46.86 1lxm h GLY 495 CO 0.09 0.35 0.18 -2.00 0.00 0.00 0.00 176.54 175.16 1lxm h LEU 496 N 0.54 0.82 0.00 3.11 5.85 -0.53 -1.72 115.31 123.38 1lxm h LEU 496 Ca 0.11 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1lxm h LEU 496 Cb 0.38 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1lxm h LEU 496 CO 0.01 0.77 0.00 0.35 -0.34 0.00 0.00 178.44 179.24 1lxm n THR 497 N -4.29 0.33 -0.06 1.05 -2.24 -0.12 -2.14 114.28 106.81 1lxm n THR 497 Ca 0.05 0.08 -0.12 0.00 -2.27 0.00 0.00 64.05 61.79 1lxm n THR 497 Cb 0.20 -0.75 -0.15 0.00 -2.10 0.00 0.00 70.33 67.54 1lxm n THR 497 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1lxm n GLN 498 N -1.24 0.67 0.09 -0.78 6.02 -0.67 -4.41 117.38 117.07 1lxm n GLN 498 Ca 0.10 0.17 -0.15 0.00 -0.01 0.00 0.00 57.00 57.11 1lxm n GLN 498 Cb 0.14 -1.65 -0.14 0.00 1.02 0.00 0.00 30.24 29.61 1lxm n GLN 498 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1lxm h LEU 499 N 0.01 0.37 -0.40 1.08 3.38 -1.24 -3.38 115.31 115.13 1lxm h LEU 499 Ca -0.43 -0.40 0.08 0.00 0.09 0.00 0.00 57.88 57.22 1lxm h LEU 499 Cb 2.09 -0.12 -0.09 0.00 0.09 0.00 0.00 40.66 42.63 1lxm h LEU 499 CO 0.04 1.32 -0.24 -0.07 0.09 0.00 0.00 178.44 179.58 1lxm h LEU 500 N 0.06 -0.81 -1.85 1.67 3.38 -1.64 0.35 115.31 116.47 1lxm h LEU 500 Ca -0.13 0.17 0.14 0.00 0.09 0.00 0.00 57.88 58.15 1lxm h LEU 500 Cb 1.95 0.41 -0.02 0.00 0.09 0.00 0.00 40.66 43.10 1lxm h LEU 500 CO 0.19 -0.26 0.55 -0.65 0.09 0.00 0.00 178.44 178.36 1lxm h PRO 501 N -0.17 0.00 0.05 1.13 0.11 -1.81 0.14 132.00 131.44 1lxm h PRO 501 Ca 0.19 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.94 1lxm h PRO 501 Cb 0.47 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.54 1lxm h PRO 501 CO -0.50 0.00 -2.02 -0.89 -0.21 0.00 0.00 178.00 174.38 1lxm n ILE 502 N -3.62 1.62 -0.04 4.15 -0.00 -0.28 -3.97 119.36 117.21 1lxm n ILE 502 Ca 0.09 -0.44 -0.08 0.00 -0.00 0.00 0.00 62.75 62.32 1lxm n ILE 502 Cb 0.74 -1.76 -0.02 0.00 -0.00 0.00 0.00 39.64 38.60 1lxm n ILE 502 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 1lxm h ILE 503 N -0.38 0.67 0.00 1.39 2.04 0.02 -0.12 117.51 121.14 1lxm h ILE 503 Ca -0.49 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.37 1lxm h ILE 503 Cb 1.76 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1lxm h ILE 503 CO -0.11 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.04 1lxm n GLN 504 N -5.26 0.04 -0.01 2.37 1.13 0.39 -0.44 117.38 115.59 1lxm n GLN 504 Ca -0.02 0.49 0.09 0.00 -1.94 0.00 0.00 57.00 55.62 1lxm n GLN 504 Cb 0.18 -1.62 -0.16 0.00 0.11 0.00 0.00 30.24 28.75 1lxm n GLN 504 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1lxm n GLU 505 N -1.70 0.66 -1.54 -1.09 -0.58 -0.15 -4.84 120.64 111.41 1lxm n GLU 505 Ca 0.00 -0.16 -0.30 0.00 -0.42 0.00 0.00 57.16 56.28 1lxm n GLU 505 Cb 0.04 -1.54 0.22 0.00 -0.57 0.00 0.00 31.44 29.59 1lxm n GLU 505 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1lxm s THR 506 N -3.40 1.79 -1.93 2.62 -4.23 0.41 -4.93 115.64 105.97 1lxm s THR 506 Ca -0.08 0.00 0.13 0.00 -1.18 0.00 0.00 61.69 60.56 1lxm s THR 506 Cb 0.13 -2.76 0.38 0.00 1.34 0.00 0.00 72.50 71.59 1lxm s THR 506 CO 0.89 0.00 1.31 0.47 -0.54 0.00 0.00 174.62 176.75 1lxm n ASP 507 N -4.28 2.34 -2.39 3.99 8.00 -1.26 -3.92 116.55 119.03 1lxm n ASP 507 Ca 0.15 -2.03 -0.16 0.00 0.71 0.00 0.00 54.79 53.47 1lxm n ASP 507 Cb 0.59 -0.30 0.03 0.00 -0.02 0.00 0.00 41.12 41.42 1lxm n ASP 507 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1lxm n TYR 508 N 0.72 2.26 -0.67 1.24 4.01 -1.26 -5.09 117.16 118.37 1lxm n TYR 508 Ca 0.14 -2.38 -0.31 0.00 -0.16 0.00 0.00 57.90 55.19 1lxm n TYR 508 Cb 0.38 -0.27 0.17 0.00 -0.31 0.00 0.00 39.34 39.31 1lxm n TYR 508 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1lxm s LYS 509 N -3.61 0.95 0.41 -0.72 3.01 -1.24 -4.89 119.74 113.65 1lxm s LYS 509 Ca 0.41 1.56 -0.21 0.00 -1.01 0.00 0.00 55.97 56.72 1lxm s LYS 509 Cb 0.39 -1.72 -0.11 0.00 -1.01 0.00 0.00 37.83 35.38 1lxm s LYS 509 CO -0.02 -2.68 0.94 0.96 0.51 0.00 0.00 175.35 175.06 1lxm s ILE 510 N -2.64 4.38 0.87 2.17 -4.36 -1.26 -5.01 121.20 115.36 1lxm s ILE 510 Ca 0.67 1.50 -0.12 0.00 -0.26 0.00 0.00 60.65 62.44 1lxm s ILE 510 Cb -0.23 -3.65 0.12 0.00 1.25 0.00 0.00 42.46 39.94 1lxm s ILE 510 CO 0.58 -0.25 1.13 -0.94 0.24 0.00 0.00 174.94 175.69 1lxm s SER 511 N -2.11 3.82 0.19 4.36 1.04 -1.26 -4.83 113.70 114.92 1lxm s SER 511 Ca 0.60 1.06 -0.12 0.00 0.48 0.00 0.00 55.95 57.97 1lxm s SER 511 Cb -0.10 -1.68 0.15 0.00 0.10 0.00 0.00 66.02 64.48 1lxm s SER 511 CO 0.15 -2.36 1.83 0.78 0.98 0.00 0.00 173.24 174.61 1lxm h ASN 512 N -1.37 0.61 -0.21 7.02 2.35 -1.99 0.18 115.58 122.17 1lxm h ASN 512 Ca -0.49 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.22 1lxm h ASN 512 Cb 1.31 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 39.54 1lxm h ASN 512 CO 0.61 0.43 0.03 0.06 -1.65 0.00 0.00 177.43 176.91 1lxm h GLN 513 N 0.74 0.46 -0.16 0.81 -0.00 -2.00 -1.57 115.11 113.39 1lxm h GLN 513 Ca 0.25 -0.08 -0.19 0.00 -0.00 0.00 0.00 58.65 58.62 1lxm h GLN 513 Cb 0.02 -0.08 0.00 0.00 -0.00 0.00 0.00 27.48 27.43 1lxm h GLN 513 CO -0.10 0.46 -0.69 0.93 -0.00 0.00 0.00 178.83 179.44 1lxm h GLU 514 N 0.45 0.64 -0.38 0.06 5.08 -1.71 -3.04 114.58 115.67 1lxm h GLU 514 Ca 0.10 -0.48 -0.01 0.00 -1.00 0.00 0.00 59.36 57.97 1lxm h GLU 514 Cb 0.25 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1lxm h GLU 514 CO 0.00 1.10 0.19 1.25 -1.00 0.00 0.00 179.01 180.55 1lxm h LEU 515 N 0.45 0.49 -1.61 1.33 6.46 -0.41 -2.24 115.31 119.79 1lxm h LEU 515 Ca -0.02 -0.12 0.05 0.00 -0.12 0.00 0.00 57.88 57.67 1lxm h LEU 515 Cb 1.28 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 41.05 1lxm h LEU 515 CO 0.13 0.47 0.33 0.44 -0.62 0.00 0.00 178.44 179.19 1lxm h ASP 516 N 0.48 0.43 -0.57 1.25 3.45 -1.32 0.11 116.42 120.25 1lxm h ASP 516 Ca 0.13 -0.00 0.07 0.00 0.43 0.00 0.00 57.03 57.66 1lxm h ASP 516 Cb 0.10 -0.10 -0.03 0.00 -0.56 0.00 0.00 39.33 38.74 1lxm h ASP 516 CO -0.02 0.29 0.38 0.24 -1.57 0.00 0.00 179.24 178.56 1lxm h MET 517 N 0.49 0.50 -0.05 3.56 2.86 -1.29 0.26 114.93 121.27 1lxm h MET 517 Ca 0.21 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 1lxm h MET 517 Cb 0.21 -0.11 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 1lxm h MET 517 CO -0.05 0.33 -0.04 0.28 1.06 0.00 0.00 176.91 178.49 1lxm h VAL 518 N 0.52 1.36 -0.44 -2.22 2.07 -0.71 -1.34 116.25 115.48 1lxm h VAL 518 Ca 0.25 -1.13 0.01 0.00 0.82 0.00 0.00 66.70 66.65 1lxm h VAL 518 Cb 0.32 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 1lxm h VAL 518 CO -0.07 0.31 0.29 1.88 0.02 0.00 0.00 177.57 180.00 1lxm h TYR 519 N -0.32 0.55 -0.64 1.57 0.05 -1.08 -0.48 116.97 116.62 1lxm h TYR 519 Ca 0.01 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 1lxm h TYR 519 Cb 0.51 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 38.04 1lxm h TYR 519 CO 0.08 0.34 0.34 -0.22 -1.05 0.00 0.00 178.16 177.66 1lxm h LYS 520 N 0.59 0.90 0.15 4.88 3.64 -0.27 0.43 116.57 126.90 1lxm h LYS 520 Ca 0.16 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1lxm h LYS 520 Cb -0.05 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 31.60 1lxm h LYS 520 CO -0.04 0.69 -0.07 -1.49 -2.27 0.00 0.00 179.45 176.28 1lxm h TRP 521 N 0.88 -0.18 -0.11 1.91 6.55 -0.05 0.53 115.95 125.47 1lxm h TRP 521 Ca 0.22 -0.00 0.05 0.00 0.95 0.00 0.00 58.89 60.10 1lxm h TRP 521 Cb 0.06 0.06 -0.06 0.00 -0.86 0.00 0.00 29.16 28.36 1lxm h TRP 521 CO -0.00 -0.02 -0.31 0.82 -1.05 0.00 0.00 178.44 177.88 1lxm h ILE 522 N -0.32 0.31 0.55 1.49 2.04 -0.72 0.48 117.51 121.34 1lxm h ILE 522 Ca -0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 1lxm h ILE 522 Cb 0.25 0.31 0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1lxm h ILE 522 CO 0.03 0.00 -0.27 0.78 0.00 0.00 0.00 178.15 178.70 1lxm h ASN 523 N -0.39 -0.63 0.99 1.72 2.35 0.02 0.06 115.58 119.70 1lxm h ASN 523 Ca 0.09 -0.04 -0.19 0.00 -0.55 0.00 0.00 56.30 55.61 1lxm h ASN 523 Cb 0.53 0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.04 1lxm h ASN 523 CO -0.33 -0.26 -0.92 -0.61 -1.65 0.00 0.00 177.43 173.66 1lxm h GLN 524 N -1.07 0.00 0.00 0.81 4.15 0.05 -3.37 115.11 115.68 1lxm h GLN 524 Ca -0.08 0.00 -0.45 0.00 0.77 0.00 0.00 58.65 58.89 1lxm h GLN 524 Cb 0.63 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.26 1lxm h GLN 524 CO 0.12 0.92 -2.48 0.43 -1.93 0.00 0.00 178.83 175.89 1lxm n SER 525 N -3.39 1.96 -0.09 -0.69 7.64 0.16 -4.71 113.62 114.50 1lxm n SER 525 Ca 0.00 0.31 -0.16 0.00 1.01 0.00 0.00 58.87 60.04 1lxm n SER 525 Cb 0.89 -0.80 -0.09 0.00 -1.01 0.00 0.00 64.21 63.20 1lxm n SER 525 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1lxm h PHE 526 N -0.93 0.00 -0.48 1.43 0.04 -1.16 -3.40 116.94 112.44 1lxm h PHE 526 Ca -0.68 0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.18 1lxm h PHE 526 Cb 1.62 0.00 -0.10 0.00 2.20 0.00 0.00 35.95 39.67 1lxm h PHE 526 CO -0.07 1.00 -0.26 -0.07 -0.60 0.00 0.00 178.31 178.31 1lxm h LEU 527 N -1.00 -0.90 -1.02 1.54 3.38 -1.15 0.52 115.31 116.69 1lxm h LEU 527 Ca -0.22 0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1lxm h LEU 527 Cb 1.02 0.46 0.00 0.00 0.09 0.00 0.00 40.66 42.23 1lxm h LEU 527 CO -0.13 -0.28 0.24 -2.65 0.09 0.00 0.00 178.44 175.71 1lxm n PRO 528 N -5.42 0.10 0.00 1.13 -0.02 -1.26 -0.54 135.00 129.00 1lxm n PRO 528 Ca 0.03 0.59 0.11 0.00 -2.02 0.00 0.00 63.50 62.21 1lxm n PRO 528 Cb 0.33 -2.08 0.04 0.00 -0.02 0.00 0.00 33.50 31.77 1lxm n PRO 528 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1lxm n LEU 529 N -2.11 1.87 -4.41 2.45 4.77 0.17 -4.74 117.00 115.00 1lxm n LEU 529 Ca -0.01 -0.69 -0.43 0.00 -0.03 0.00 0.00 56.01 54.86 1lxm n LEU 529 Cb 0.26 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.24 1lxm n LEU 529 CO 0.07 0.35 -0.06 -0.63 -1.33 0.00 0.00 177.39 175.78 1lxm s ILE 530 N -2.50 5.04 -0.16 -0.08 1.01 0.30 -0.52 121.20 124.29 1lxm s ILE 530 Ca 0.19 -0.86 0.01 0.00 0.00 0.00 0.00 60.65 59.99 1lxm s ILE 530 Cb 0.18 -3.88 0.02 0.00 0.01 0.00 0.00 42.46 38.79 1lxm s ILE 530 CO 0.58 -0.38 -0.18 0.54 0.00 0.00 0.00 174.94 175.50 1lxm s VAL 531 N 1.63 1.84 -1.37 2.92 0.11 -0.06 -4.74 120.40 120.73 1lxm s VAL 531 Ca 0.04 -0.81 -0.05 0.00 -2.93 0.00 0.00 61.98 58.23 1lxm s VAL 531 Cb -0.21 -1.68 0.03 0.00 -1.53 0.00 0.00 36.38 32.99 1lxm s VAL 531 CO 0.08 0.51 0.86 0.29 -3.33 0.00 0.00 175.10 173.51 1lxm n LYS 532 N 4.55 -5.59 -0.93 1.54 5.02 -1.26 -2.24 118.16 119.25 1lxm n LYS 532 Ca -0.19 0.66 0.00 0.00 -2.02 0.00 0.00 58.31 56.76 1lxm n LYS 532 Cb 0.50 -5.41 0.00 0.00 -0.02 0.00 0.00 35.03 30.10 1lxm n LYS 532 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1lxm n GLY 533 N -1.61 1.12 3.14 0.72 0.00 -1.26 -4.72 105.19 102.57 1lxm n GLY 533 Ca -0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.64 1lxm n GLY 533 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1lxm s GLU 534 N -0.01 0.99 -0.21 1.61 -1.05 -0.95 -4.56 118.70 114.52 1lxm s GLU 534 Ca 0.00 -0.70 -0.28 0.00 -0.15 0.00 0.00 54.97 53.84 1lxm s GLU 534 Cb 0.00 -0.99 0.00 0.00 -0.44 0.00 0.00 34.13 32.70 1lxm s GLU 534 CO 0.00 0.25 0.99 -1.17 0.95 0.00 0.00 175.26 176.28 1lxm s LEU 535 N -0.93 4.12 -0.24 1.83 0.20 0.13 -0.88 118.68 122.90 1lxm s LEU 535 Ca 0.03 1.33 -0.40 0.00 0.69 0.00 0.00 54.13 55.77 1lxm s LEU 535 Cb -0.07 -3.46 -0.16 0.00 -0.43 0.00 0.00 46.19 42.06 1lxm s LEU 535 CO 0.01 -0.60 1.65 0.23 -0.29 0.00 0.00 176.35 177.35 1lxm n MET 536 N 6.04 1.01 -0.32 1.98 2.81 0.33 -4.63 117.12 124.33 1lxm n MET 536 Ca 0.10 0.37 0.03 0.00 -1.81 0.00 0.00 57.70 56.39 1lxm n MET 536 Cb 0.47 -2.02 0.22 0.00 -0.71 0.00 0.00 33.22 31.18 1lxm n MET 536 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1lxm h ASP 537 N 6.47 0.94 0.00 7.83 3.32 -1.93 -2.00 116.42 131.06 1lxm h ASP 537 Ca -0.47 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1lxm h ASP 537 Cb 1.33 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1lxm h ASP 537 CO 0.93 0.61 0.15 1.15 -1.72 0.00 0.00 179.24 180.35 1lxm n MET 538 N -4.49 0.01 -0.16 3.56 0.00 -1.26 -0.10 117.12 114.69 1lxm n MET 538 Ca 0.14 0.39 0.06 0.00 0.00 0.00 0.00 57.70 58.29 1lxm n MET 538 Cb 0.19 -1.70 0.15 0.00 0.00 0.00 0.00 33.22 31.86 1lxm n MET 538 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1lxm n SER 539 N -1.46 2.83 -0.89 3.17 3.41 -0.75 -4.63 113.62 115.30 1lxm n SER 539 Ca -0.00 -1.89 0.09 0.00 -0.26 0.00 0.00 58.87 56.81 1lxm n SER 539 Cb 0.15 -0.20 0.16 0.00 -0.26 0.00 0.00 64.21 64.06 1lxm n SER 539 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1lxm n ARG 540 N 0.67 2.12 0.00 4.33 1.74 0.85 -1.42 116.66 124.95 1lxm n ARG 540 Ca 0.12 -1.97 0.00 0.00 -0.77 0.00 0.00 57.85 55.23 1lxm n ARG 540 Cb 0.42 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 1lxm n ARG 540 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1lxm n GLY 541 N 1.12 2.95 0.00 -0.13 0.00 -1.26 -1.80 105.19 106.06 1lxm n GLY 541 Ca 0.15 -0.29 0.10 0.00 0.00 0.00 0.00 46.02 45.98 1lxm n GLY 541 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1lxm n ARG 542 N 14.00 0.36 0.00 1.61 1.85 -1.25 -3.43 116.66 129.80 1lxm n ARG 542 Ca 0.00 0.08 0.09 0.00 -1.00 0.00 0.00 57.85 57.01 1lxm n ARG 542 Cb 0.00 -1.50 0.43 0.00 -1.05 0.00 0.00 32.46 30.34 1lxm n ARG 542 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1lxm n SER 543 N -1.24 0.00 0.17 2.89 7.64 -0.75 -2.71 113.62 119.63 1lxm n SER 543 Ca 0.11 0.11 0.04 0.00 1.01 0.00 0.00 58.87 60.13 1lxm n SER 543 Cb 0.15 -0.32 0.25 0.00 -1.01 0.00 0.00 64.21 63.28 1lxm n SER 543 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1lxm h ILE 544 N 0.00 0.99 -0.00 0.44 3.07 -1.73 -2.86 117.51 117.42 1lxm h ILE 544 Ca 0.00 -1.79 0.00 0.00 1.55 0.00 0.00 64.86 64.62 1lxm h ILE 544 Cb 0.18 2.07 0.00 0.00 -0.27 0.00 0.00 36.82 38.80 1lxm h ILE 544 CO 0.00 0.44 -0.01 -1.54 -1.05 0.00 0.00 178.15 175.99 1lxm n SER 545 N -3.51 0.04 -4.62 2.16 3.41 -1.10 -4.73 113.62 105.27 1lxm n SER 545 Ca -0.00 -0.19 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 1lxm n SER 545 Cb 0.58 -0.26 -0.05 0.00 -0.26 0.00 0.00 64.21 64.22 1lxm n SER 545 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1lxm s ARG 546 N -2.56 3.99 0.54 4.33 0.52 -1.08 -4.59 118.95 120.10 1lxm s ARG 546 Ca 0.29 0.67 0.25 0.00 -0.52 0.00 0.00 55.73 56.42 1lxm s ARG 546 Cb 0.20 -3.72 1.51 0.00 0.52 0.00 0.00 34.95 33.46 1lxm s ARG 546 CO 0.46 -0.69 2.14 1.49 0.02 0.00 0.00 175.30 178.72 1lxm h GLU 547 N 8.08 0.00 -0.01 3.54 4.81 -1.88 -2.61 114.58 126.51 1lxm h GLU 547 Ca -0.24 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1lxm h GLU 547 Cb 1.09 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1lxm h GLU 547 CO 0.90 0.08 -0.27 0.00 -0.73 0.00 0.00 179.01 178.99 1lxm n ALA 548 N -2.35 3.10 -3.90 2.92 0.00 -1.26 -4.51 120.51 114.51 1lxm n ALA 548 Ca -0.02 -0.48 -0.28 0.00 0.00 0.00 0.00 53.44 52.66 1lxm n ALA 548 Cb 0.17 -1.04 -0.12 0.00 0.00 0.00 0.00 19.45 18.45 1lxm n ALA 548 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lxm s ALA 549 N -2.41 3.79 0.74 0.00 0.00 -0.98 -4.95 121.76 117.95 1lxm s ALA 549 Ca 0.25 -3.80 -0.07 0.00 0.00 0.00 0.00 51.96 48.33 1lxm s ALA 549 Cb 0.19 -2.17 0.09 0.00 0.00 0.00 0.00 23.12 21.23 1lxm s ALA 549 CO 0.50 -2.09 1.05 -1.54 0.00 0.00 0.00 175.76 173.67 1lxm s SER 550 N -1.38 4.53 0.46 0.00 1.04 -1.26 -4.70 113.70 112.40 1lxm s SER 550 Ca 0.24 0.30 0.20 0.00 0.48 0.00 0.00 55.95 57.17 1lxm s SER 550 Cb -0.06 -0.83 1.14 0.00 0.10 0.00 0.00 66.02 66.36 1lxm s SER 550 CO -0.15 -1.78 1.98 0.77 0.98 0.00 0.00 173.24 175.04 1lxm h SER 551 N -0.71 0.00 0.31 7.02 4.64 -1.91 -0.97 113.55 121.93 1lxm h SER 551 Ca -0.43 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.56 1lxm h SER 551 Cb 1.30 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.42 1lxm h SER 551 CO 0.54 0.20 -1.44 0.45 -0.87 0.00 0.00 176.83 175.71 1lxm h HIS 552 N 0.00 0.92 -0.27 4.77 3.86 -1.87 0.37 115.15 122.94 1lxm h HIS 552 Ca -0.00 -0.67 -0.12 0.00 -1.16 0.00 0.00 60.37 58.42 1lxm h HIS 552 Cb 0.42 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 1lxm h HIS 552 CO 0.00 1.52 -0.33 0.00 0.86 0.00 0.00 177.93 179.98 1lxm h ALA 553 N 0.23 0.93 -0.18 2.45 0.00 -1.82 -2.76 119.26 118.10 1lxm h ALA 553 Ca -0.24 -0.40 -0.07 0.00 0.00 0.00 0.00 54.91 54.21 1lxm h ALA 553 Cb 2.13 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.79 1lxm h ALA 553 CO 0.27 0.62 -0.18 0.00 0.00 0.00 0.00 179.25 179.96 1lxm h ALA 554 N 1.16 1.37 -0.30 0.00 0.00 -1.25 -1.43 119.26 118.80 1lxm h ALA 554 Ca 0.06 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1lxm h ALA 554 Cb 0.80 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1lxm h ALA 554 CO 0.07 0.43 -0.38 0.00 0.00 0.00 0.00 179.25 179.37 1lxm h ALA 555 N 1.54 0.78 -0.08 0.00 0.00 -1.40 -2.93 119.26 117.16 1lxm h ALA 555 Ca 0.05 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 1lxm h ALA 555 Cb 0.48 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1lxm h ALA 555 CO 0.03 0.65 -0.37 0.28 0.00 0.00 0.00 179.25 179.84 1lxm h VAL 556 N 0.58 1.29 -0.17 0.00 2.07 -1.06 -1.22 116.25 117.73 1lxm h VAL 556 Ca 0.05 -1.39 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 1lxm h VAL 556 Cb 0.90 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.31 1lxm h VAL 556 CO 0.08 0.41 -0.05 -0.08 0.02 0.00 0.00 177.57 177.95 1lxm h GLU 557 N 0.14 0.25 0.05 1.57 4.81 -1.10 -2.33 114.58 117.97 1lxm h GLU 557 Ca 0.01 -0.04 -0.35 0.00 -0.13 0.00 0.00 59.36 58.85 1lxm h GLU 557 Cb 0.73 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.02 1lxm h GLU 557 CO 0.05 0.32 -2.05 1.33 -0.73 0.00 0.00 179.01 177.93 1lxm n VAL 558 N -4.34 1.63 0.08 0.32 0.24 -1.09 -3.86 118.33 111.30 1lxm n VAL 558 Ca -0.00 -0.71 0.04 0.00 -2.04 0.00 0.00 64.34 61.62 1lxm n VAL 558 Cb 0.21 -1.30 0.44 0.00 -1.47 0.00 0.00 33.84 31.72 1lxm n VAL 558 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1lxm h LEU 559 N 0.03 0.33 -0.47 1.34 3.38 -1.16 0.42 115.31 119.18 1lxm h LEU 559 Ca -0.43 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.34 1lxm h LEU 559 Cb 2.04 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.70 1lxm h LEU 559 CO 0.05 0.32 -0.65 0.08 0.09 0.00 0.00 178.44 178.32 1lxm h ARG 560 N 0.37 0.44 -0.09 1.13 0.11 -1.60 -0.60 114.38 114.14 1lxm h ARG 560 Ca 0.09 -0.32 -0.02 0.00 0.10 0.00 0.00 59.98 59.83 1lxm h ARG 560 Cb 0.10 0.06 -0.00 0.00 1.11 0.00 0.00 29.97 31.23 1lxm h ARG 560 CO -0.01 0.95 -0.02 0.78 0.10 0.00 0.00 179.97 181.76 1lxm h GLY 561 N 1.21 0.20 0.84 0.08 0.00 -1.25 -2.09 103.07 102.05 1lxm h GLY 561 Ca -0.02 -0.16 0.11 0.00 0.00 0.00 0.00 47.33 47.26 1lxm h GLY 561 CO 0.11 0.15 0.49 0.74 0.00 0.00 0.00 176.54 178.04 1lxm h PHE 562 N -0.15 0.65 -0.65 5.60 0.04 -0.15 -1.16 116.94 121.12 1lxm h PHE 562 Ca 0.02 0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.73 1lxm h PHE 562 Cb 0.44 -0.21 -0.03 0.00 2.20 0.00 0.00 35.95 38.35 1lxm h PHE 562 CO 0.05 0.29 0.08 1.25 -0.60 0.00 0.00 178.31 179.39 1lxm h LEU 563 N 0.60 1.06 0.12 1.54 6.46 -0.73 -0.71 115.31 123.64 1lxm h LEU 563 Ca 0.35 -0.27 0.02 0.00 -0.12 0.00 0.00 57.88 57.86 1lxm h LEU 563 Cb 0.55 -0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 40.17 1lxm h LEU 563 CO -0.13 1.06 -0.27 0.03 -0.62 0.00 0.00 178.44 178.52 1lxm h ARG 564 N 1.01 -0.46 -0.03 1.25 3.08 -0.54 -1.70 114.38 116.99 1lxm h ARG 564 Ca 0.20 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.31 1lxm h ARG 564 Cb 0.47 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.57 1lxm h ARG 564 CO 0.02 -0.31 -0.29 1.25 -1.07 0.00 0.00 179.97 179.57 1lxm h LEU 565 N -0.48 -0.88 -2.28 3.04 5.85 -1.13 -2.31 115.31 117.12 1lxm h LEU 565 Ca 0.03 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1lxm h LEU 565 Cb 0.51 0.36 -0.00 0.00 0.37 0.00 0.00 40.66 41.90 1lxm h LEU 565 CO -0.16 -0.35 0.01 0.00 -0.34 0.00 0.00 178.44 177.60 1lxm h ALA 566 N 0.37 1.73 0.00 1.25 0.00 -1.00 -1.42 119.26 120.18 1lxm h ALA 566 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1lxm h ALA 566 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1lxm h ALA 566 CO -0.27 -0.02 0.00 0.09 0.00 0.00 0.00 179.25 179.05 1lxm n ASN 567 N -4.11 0.00 0.15 0.00 3.02 -0.65 -3.38 115.26 110.29 1lxm n ASN 567 Ca -0.03 0.31 0.13 0.00 -0.03 0.00 0.00 54.58 54.96 1lxm n ASN 567 Cb 0.10 -0.43 0.51 0.00 -0.61 0.00 0.00 39.78 39.35 1lxm n ASN 567 CO 0.00 0.00 0.00 0.24 -2.62 0.00 0.00 177.26 174.88 1lxm h MET 568 N 0.00 0.00 -1.94 3.52 2.86 -1.20 -3.46 114.93 114.71 1lxm h MET 568 Ca 0.00 0.00 0.21 0.00 -2.06 0.00 0.00 59.70 57.85 1lxm h MET 568 Cb 0.38 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 31.90 1lxm h MET 568 CO 0.00 0.00 0.63 -1.54 1.06 0.00 0.00 176.91 177.06 1lxm s SER 569 N -4.56 -0.20 0.00 1.22 1.04 -1.22 -5.02 113.70 104.97 1lxm s SER 569 Ca 0.04 -0.13 0.22 0.00 0.48 0.00 0.00 55.95 56.56 1lxm s SER 569 Cb 0.09 0.31 0.70 0.00 0.10 0.00 0.00 66.02 67.23 1lxm s SER 569 CO 0.44 -0.54 1.53 0.59 0.98 0.00 0.00 173.24 176.25 1lxm n ASN 570 N -0.32 2.00 -4.21 7.02 5.03 -1.26 -4.52 115.26 118.99 1lxm n ASN 570 Ca -0.06 -1.75 -0.34 0.00 0.87 0.00 0.00 54.58 53.30 1lxm n ASN 570 Cb 0.61 -0.11 0.10 0.00 -1.02 0.00 0.00 39.78 39.36 1lxm n ASN 570 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1lxm n GLU 571 N 0.54 -0.58 0.19 3.52 -0.58 -1.26 -4.50 120.64 117.98 1lxm n GLU 571 Ca 0.17 -0.15 -0.10 0.00 -0.42 0.00 0.00 57.16 56.66 1lxm n GLU 571 Cb 0.39 -1.48 -0.05 0.00 -0.57 0.00 0.00 31.44 29.73 1lxm n GLU 571 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 1lxm h GLU 572 N -1.50 -0.57 -0.91 3.49 4.22 -1.99 -1.21 114.58 116.10 1lxm h GLU 572 Ca -0.46 0.04 0.25 0.00 0.08 0.00 0.00 59.36 59.27 1lxm h GLU 572 Cb 1.33 0.13 -0.05 0.00 0.50 0.00 0.00 28.75 30.66 1lxm h GLU 572 CO 0.31 -0.38 0.64 0.07 -2.18 0.00 0.00 179.01 177.47 1lxm h ARG 573 N -0.59 0.13 -0.18 1.92 0.11 -1.98 0.37 114.38 114.16 1lxm h ARG 573 Ca -0.05 -0.01 -0.20 0.00 0.10 0.00 0.00 59.98 59.83 1lxm h ARG 573 Cb 0.49 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.55 1lxm h ARG 573 CO 0.01 0.08 -0.68 -0.91 0.10 0.00 0.00 179.97 178.58 1lxm h ASN 574 N 0.13 0.82 -0.27 0.08 2.35 -1.78 0.84 115.58 117.74 1lxm h ASN 574 Ca 0.45 -0.49 -0.16 0.00 -0.55 0.00 0.00 56.30 55.55 1lxm h ASN 574 Cb 1.57 -0.24 -0.01 0.00 0.05 0.00 0.00 38.32 39.70 1lxm h ASN 574 CO -0.07 1.27 -0.41 -0.07 -1.65 0.00 0.00 177.43 176.50 1lxm h LEU 575 N 0.51 0.89 -0.70 1.61 3.38 0.79 -2.79 115.31 119.00 1lxm h LEU 575 Ca -0.02 -0.42 -0.13 0.00 0.09 0.00 0.00 57.88 57.40 1lxm h LEU 575 Cb 1.28 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1lxm h LEU 575 CO 0.14 1.18 -0.39 -0.78 0.09 0.00 0.00 178.44 178.68 1lxm h ASP 576 N 0.67 0.57 -0.47 -0.43 -0.00 -0.43 -2.94 116.42 113.40 1lxm h ASP 576 Ca 0.05 -0.25 -0.03 0.00 -0.00 0.00 0.00 57.03 56.80 1lxm h ASP 576 Cb 0.99 -0.16 -0.02 0.00 -0.00 0.00 0.00 39.33 40.14 1lxm h ASP 576 CO 0.09 0.91 0.18 0.25 -0.00 0.00 0.00 179.24 180.68 1lxm h LEU 577 N 0.45 0.66 -1.37 2.28 5.85 -0.75 -2.30 115.31 120.13 1lxm h LEU 577 Ca 0.04 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.64 1lxm h LEU 577 Cb 0.89 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 1lxm h LEU 577 CO 0.08 0.65 0.47 0.11 -0.34 0.00 0.00 178.44 179.41 1lxm h LYS 578 N 0.62 0.76 -0.12 1.25 1.57 -1.41 -0.21 116.57 119.03 1lxm h LYS 578 Ca 0.16 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.79 1lxm h LYS 578 Cb 0.20 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1lxm h LYS 578 CO -0.01 0.50 -0.38 1.03 -0.57 0.00 0.00 179.45 180.03 1lxm h SER 579 N 0.78 0.27 0.10 0.86 0.87 -1.27 -2.02 113.55 113.14 1lxm h SER 579 Ca 0.30 -0.11 -0.23 0.00 -1.23 0.00 0.00 61.79 60.53 1lxm h SER 579 Cb 0.19 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.09 1lxm h SER 579 CO -0.10 0.63 -0.88 0.74 -0.53 0.00 0.00 176.83 176.69 1lxm h THR 580 N 0.22 1.33 -0.29 2.23 2.02 -0.55 -2.09 112.91 115.78 1lxm h THR 580 Ca 0.02 -2.21 -0.07 0.00 0.77 0.00 0.00 66.41 64.93 1lxm h THR 580 Cb 0.77 2.23 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 1lxm h THR 580 CO 0.06 0.68 -0.09 0.40 0.37 0.00 0.00 175.52 176.93 1lxm h ILE 581 N 0.37 1.29 -0.46 3.11 2.04 -1.12 -1.93 117.51 120.81 1lxm h ILE 581 Ca -0.08 -1.14 -0.06 0.00 1.00 0.00 0.00 64.86 64.58 1lxm h ILE 581 Cb 1.51 1.43 -0.02 0.00 -0.74 0.00 0.00 36.82 39.00 1lxm h ILE 581 CO 0.17 0.36 0.04 0.50 0.00 0.00 0.00 178.15 179.22 1lxm h LYS 582 N 0.33 0.74 -0.16 2.37 3.64 -1.42 0.99 116.57 123.06 1lxm h LYS 582 Ca 0.07 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1lxm h LYS 582 Cb 0.58 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 1lxm h LYS 582 CO 0.03 0.73 0.03 1.15 -2.27 0.00 0.00 179.45 179.12 1lxm h THR 583 N 0.70 1.21 0.27 1.00 2.02 -1.26 -1.69 112.91 115.16 1lxm h THR 583 Ca 0.15 -0.66 -0.01 0.00 0.77 0.00 0.00 66.41 66.65 1lxm h THR 583 Cb 0.38 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.14 1lxm h THR 583 CO 0.01 0.20 -0.13 0.40 0.37 0.00 0.00 175.52 176.37 1lxm h ILE 584 N 0.06 0.78 -0.75 3.11 2.04 -0.98 -1.72 117.51 120.04 1lxm h ILE 584 Ca 0.05 -0.38 0.12 0.00 1.00 0.00 0.00 64.86 65.65 1lxm h ILE 584 Cb 0.28 1.00 -0.08 0.00 -0.74 0.00 0.00 36.82 37.27 1lxm h ILE 584 CO 0.00 0.08 0.35 0.40 0.00 0.00 0.00 178.15 178.99 1lxm h ILE 585 N -0.56 0.76 0.00 -0.67 1.08 -0.86 -1.29 117.51 115.97 1lxm h ILE 585 Ca -0.04 -0.19 -0.05 0.00 -0.39 0.00 0.00 64.86 64.19 1lxm h ILE 585 Cb 0.41 0.16 -0.01 0.00 -3.07 0.00 0.00 36.82 34.31 1lxm h ILE 585 CO 0.06 0.10 -0.26 0.74 -0.69 0.00 0.00 178.15 178.10 1lxm h THR 586 N 0.55 0.68 -0.14 -0.27 2.02 -1.20 -2.97 112.91 111.57 1lxm h THR 586 Ca 0.39 -1.16 -0.17 0.00 0.77 0.00 0.00 66.41 66.25 1lxm h THR 586 Cb 0.51 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 1lxm h THR 586 CO -0.33 0.25 -0.62 0.77 0.37 0.00 0.00 175.52 175.96 1lxm h SER 587 N 0.00 0.57 -2.02 4.18 4.64 -0.29 -3.42 113.55 117.21 1lxm h SER 587 Ca -0.00 -0.33 -0.56 0.00 -0.47 0.00 0.00 61.79 60.42 1lxm h SER 587 Cb 0.73 -0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1lxm h SER 587 CO 0.03 1.05 1.48 0.21 -0.87 0.00 0.00 176.83 178.74 1lxm s ASN 588 N -6.94 5.32 -0.09 4.97 3.84 -1.01 -4.80 114.94 116.22 1lxm s ASN 588 Ca -0.07 1.60 0.15 0.00 0.21 0.00 0.00 52.86 54.75 1lxm s ASN 588 Cb 0.11 -2.51 0.48 0.00 -0.55 0.00 0.00 41.25 38.78 1lxm s ASN 588 CO 0.84 -2.11 1.40 0.29 -2.79 0.00 0.00 177.10 174.73 1lxm n LYS 589 N 8.78 3.10 0.00 0.43 4.76 -1.26 -4.59 118.16 129.38 1lxm n LYS 589 Ca 0.30 -2.53 0.00 0.00 -2.87 0.00 0.00 58.31 53.20 1lxm n LYS 589 Cb 0.47 -1.62 0.00 0.00 -1.84 0.00 0.00 35.03 32.04 1lxm n LYS 589 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1lxm n PHE 590 N 0.29 0.00 -4.38 2.13 7.35 -1.26 -5.06 117.46 116.53 1lxm n PHE 590 Ca 0.18 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.53 1lxm n PHE 590 Cb 0.70 0.01 -0.09 0.00 0.35 0.00 0.00 39.48 40.45 1lxm n PHE 590 CO 0.00 0.00 0.00 -0.47 -0.76 0.00 0.00 176.76 175.53 1lxm s TYR 591 N -1.93 3.11 -0.65 -5.13 5.04 -1.26 -5.07 117.35 111.46 1lxm s TYR 591 Ca 0.00 0.14 -0.20 0.00 -2.44 0.00 0.00 57.07 54.57 1lxm s TYR 591 Cb 0.00 -1.74 0.10 0.00 0.35 0.00 0.00 41.96 40.67 1lxm s TYR 591 CO 0.00 0.45 0.82 1.21 -1.34 0.00 0.00 175.55 176.69 1lxm s ASN 592 N -1.08 6.24 0.27 4.32 2.47 -1.26 -4.91 114.94 120.98 1lxm s ASN 592 Ca 0.15 -1.40 0.16 0.00 0.42 0.00 0.00 52.86 52.19 1lxm s ASN 592 Cb -0.11 -2.34 0.97 0.00 -1.45 0.00 0.00 41.25 38.32 1lxm s ASN 592 CO 0.05 -1.19 1.11 0.55 -3.72 0.00 0.00 177.10 173.89 1lxm n VAL 593 N 5.60 -0.27 0.50 -5.21 3.14 -1.26 0.11 118.33 120.94 1lxm n VAL 593 Ca -0.04 1.39 0.05 0.00 -2.96 0.00 0.00 64.34 62.78 1lxm n VAL 593 Cb 0.44 -2.27 0.25 0.00 -1.06 0.00 0.00 33.84 31.20 1lxm n VAL 593 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 1lxm n PHE 594 N -4.49 0.00 0.43 1.45 3.72 -1.26 -1.53 117.46 115.78 1lxm n PHE 594 Ca 0.27 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.80 1lxm n PHE 594 Cb 0.95 -0.17 0.45 0.00 -0.94 0.00 0.00 39.48 39.77 1lxm n PHE 594 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1lxm h ASN 595 N 0.00 0.00 -0.38 4.37 2.35 0.37 -3.17 115.58 119.12 1lxm h ASN 595 Ca 0.00 0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.46 1lxm h ASN 595 Cb 0.05 0.00 -0.31 0.00 0.05 0.00 0.00 38.32 38.11 1lxm h ASN 595 CO 0.00 0.00 -0.85 -3.20 -1.65 0.00 0.00 177.43 171.73 1lxm n ASN 596 N -2.51 2.77 -3.95 5.81 4.05 -0.58 -4.91 115.26 115.94 1lxm n ASN 596 Ca 0.03 -3.11 -0.30 0.00 0.45 0.00 0.00 54.58 51.65 1lxm n ASN 596 Cb 0.35 -0.41 -0.14 0.00 1.23 0.00 0.00 39.78 40.81 1lxm n ASN 596 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1lxm s LEU 597 N -3.02 4.26 -0.27 1.20 1.43 -1.20 -4.74 118.68 116.34 1lxm s LEU 597 Ca 0.40 -2.69 0.11 0.00 -1.03 0.00 0.00 54.13 50.92 1lxm s LEU 597 Cb 0.38 -1.57 0.75 0.00 0.03 0.00 0.00 46.19 45.78 1lxm s LEU 597 CO -0.04 -0.28 1.73 0.29 0.23 0.00 0.00 176.35 178.28 1lxm n LYS 598 N 3.53 4.13 -4.05 1.70 4.76 -1.26 -4.73 118.16 122.25 1lxm n LYS 598 Ca 0.05 -2.97 -0.09 0.00 -2.87 0.00 0.00 58.31 52.43 1lxm n LYS 598 Cb 0.35 -2.21 -0.11 0.00 -1.84 0.00 0.00 35.03 31.23 1lxm n LYS 598 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1lxm s SER 599 N -0.84 0.47 0.30 4.39 1.04 -1.26 -5.05 113.70 112.76 1lxm s SER 599 Ca 0.52 -0.73 0.06 0.00 0.48 0.00 0.00 55.95 56.28 1lxm s SER 599 Cb 0.41 0.13 0.49 0.00 0.10 0.00 0.00 66.02 67.15 1lxm s SER 599 CO 0.14 -0.42 1.74 1.88 0.98 0.00 0.00 173.24 177.56 1lxm h TYR 600 N 3.93 0.36 -0.34 5.02 0.05 -1.82 -0.40 116.97 123.77 1lxm h TYR 600 Ca -0.33 -0.08 -0.15 0.00 0.05 0.00 0.00 58.73 58.22 1lxm h TYR 600 Cb 1.18 -0.08 -0.00 0.00 1.01 0.00 0.00 36.73 38.83 1lxm h TYR 600 CO 0.60 0.61 -0.37 0.66 -1.05 0.00 0.00 178.16 178.61 1lxm h SER 601 N 0.27 0.91 0.32 3.88 4.64 -1.75 0.09 113.55 121.92 1lxm h SER 601 Ca 0.04 -0.48 -0.20 0.00 -0.47 0.00 0.00 61.79 60.68 1lxm h SER 601 Cb 0.71 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1lxm h SER 601 CO 0.05 1.20 -0.83 0.44 -0.87 0.00 0.00 176.83 176.83 1lxm h ASP 602 N 0.64 0.49 -0.43 4.97 3.32 -1.83 -0.60 116.42 122.97 1lxm h ASP 602 Ca 0.05 -0.35 -0.13 0.00 0.02 0.00 0.00 57.03 56.62 1lxm h ASP 602 Cb 0.96 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 1lxm h ASP 602 CO 0.09 1.12 -0.21 0.40 -1.72 0.00 0.00 179.24 178.93 1lxm h ILE 603 N 0.24 1.27 0.17 0.35 2.04 -1.05 -2.20 117.51 118.34 1lxm h ILE 603 Ca -0.05 -1.36 -0.01 0.00 1.00 0.00 0.00 64.86 64.44 1lxm h ILE 603 Cb 1.44 1.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.65 1lxm h ILE 603 CO 0.14 0.47 -0.08 0.00 0.00 0.00 0.00 178.15 178.68 1lxm h ALA 604 N 0.94 -0.23 -0.73 1.87 0.00 -0.88 -2.62 119.26 117.62 1lxm h ALA 604 Ca 0.11 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1lxm h ALA 604 Cb 0.76 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.56 1lxm h ALA 604 CO 0.06 -0.53 0.32 -0.91 0.00 0.00 0.00 179.25 178.19 1lxm h ASN 605 N -0.41 0.34 0.04 0.00 -0.26 -1.03 -0.35 115.58 113.91 1lxm h ASN 605 Ca -0.02 0.09 -0.08 0.00 -0.56 0.00 0.00 56.30 55.72 1lxm h ASN 605 Cb 0.32 0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.62 1lxm h ASN 605 CO 0.04 0.16 -0.25 -0.03 -1.06 0.00 0.00 177.43 176.29 1lxm h MET 606 N 0.50 0.35 -0.17 0.81 4.05 -1.38 -2.53 114.93 116.56 1lxm h MET 606 Ca 0.39 -0.12 -0.07 0.00 -0.28 0.00 0.00 59.70 59.61 1lxm h MET 606 Cb 0.53 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.30 1lxm h MET 606 CO -0.35 0.58 -0.18 -0.91 0.23 0.00 0.00 176.91 176.27 1lxm h ASN 607 N 0.31 0.46 -0.29 1.39 -0.26 -0.72 -1.67 115.58 114.81 1lxm h ASN 607 Ca 0.05 -0.49 -0.04 0.00 -0.56 0.00 0.00 56.30 55.27 1lxm h ASN 607 Cb 0.61 -0.13 -0.02 0.00 -1.06 0.00 0.00 38.32 37.72 1lxm h ASN 607 CO 0.04 0.85 0.08 0.11 -1.06 0.00 0.00 177.43 177.45 1lxm h LYS 608 N 0.08 0.54 0.51 0.81 1.57 -1.16 -0.92 116.57 117.99 1lxm h LYS 608 Ca 0.03 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1lxm h LYS 608 Cb 0.73 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1lxm h LYS 608 CO 0.05 0.51 -0.24 1.25 -0.57 0.00 0.00 179.45 180.44 1lxm h LEU 609 N 0.53 -0.58 -2.13 2.94 6.46 -1.37 -0.34 115.31 120.83 1lxm h LEU 609 Ca 0.12 -0.06 -0.02 0.00 -0.12 0.00 0.00 57.88 57.80 1lxm h LEU 609 Cb 0.23 0.15 -0.00 0.00 -0.73 0.00 0.00 40.66 40.30 1lxm h LEU 609 CO -0.00 -0.20 -0.07 -0.07 -0.62 0.00 0.00 178.44 177.48 1lxm h LEU 610 N -1.03 0.00 -1.53 2.25 3.38 -1.26 -1.90 115.31 115.23 1lxm h LEU 610 Ca -0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1lxm h LEU 610 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1lxm h LEU 610 CO 0.11 0.07 -0.17 0.59 0.09 0.00 0.00 178.44 179.14 1lxm n ASN 611 N -3.57 2.51 -4.57 -0.43 5.03 -0.36 -4.85 115.26 109.03 1lxm n ASN 611 Ca -0.02 -1.75 -0.42 0.00 0.87 0.00 0.00 54.58 53.25 1lxm n ASN 611 Cb 0.19 0.18 -0.06 0.00 -1.02 0.00 0.00 39.78 39.08 1lxm n ASN 611 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1lxm s ASP 612 N -2.04 6.47 0.31 6.41 3.68 -0.14 -4.89 116.67 126.47 1lxm s ASP 612 Ca 0.23 0.13 0.16 0.00 2.13 0.00 0.00 52.55 55.20 1lxm s ASP 612 Cb 0.18 -2.38 0.27 0.00 -1.45 0.00 0.00 42.92 39.54 1lxm s ASP 612 CO 0.38 -0.77 1.54 0.77 0.13 0.00 0.00 175.17 177.21 1lxm h SER 613 N 8.66 0.00 0.22 -0.34 4.64 -1.88 -2.87 113.55 121.98 1lxm h SER 613 Ca -0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1lxm h SER 613 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1lxm h SER 613 CO 0.91 0.48 0.00 0.35 -0.87 0.00 0.00 176.83 177.71 1lxm n THR 614 N -3.33 1.35 -3.86 2.95 -2.24 -1.26 -4.15 114.28 103.74 1lxm n THR 614 Ca 0.01 0.34 -0.36 0.00 -2.27 0.00 0.00 64.05 61.77 1lxm n THR 614 Cb 0.67 -1.21 -0.13 0.00 -2.10 0.00 0.00 70.33 67.55 1lxm n THR 614 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1lxm s VAL 615 N -2.89 3.24 0.07 2.28 1.01 -1.08 -5.10 120.40 117.92 1lxm s VAL 615 Ca 0.04 -1.31 0.02 0.00 0.00 0.00 0.00 61.98 60.73 1lxm s VAL 615 Cb 0.05 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1lxm s VAL 615 CO 0.13 -0.13 0.12 0.00 0.00 0.00 0.00 175.10 175.22 1lxm s ALA 616 N 1.30 3.71 0.69 5.51 0.00 -1.26 -4.89 121.76 126.82 1lxm s ALA 616 Ca -0.04 -0.95 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 1lxm s ALA 616 Cb -0.20 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.35 1lxm s ALA 616 CO 0.00 0.77 1.08 0.95 0.00 0.00 0.00 175.76 178.57 1lxm s THR 617 N -1.42 3.77 0.17 0.00 -4.23 -1.26 -4.67 115.64 108.00 1lxm s THR 617 Ca 0.31 0.58 0.07 0.00 -1.18 0.00 0.00 61.69 61.46 1lxm s THR 617 Cb -0.12 -3.56 -0.04 0.00 1.34 0.00 0.00 72.50 70.11 1lxm s THR 617 CO 0.24 -0.75 -0.14 -1.59 -0.54 0.00 0.00 174.62 171.83 1lxm s LYS 618 N -5.31 1.18 0.55 3.99 -2.85 -1.26 -5.03 119.74 111.01 1lxm s LYS 618 Ca 0.57 -1.44 -0.20 0.00 -1.00 0.00 0.00 55.97 53.90 1lxm s LYS 618 Cb -0.11 -0.98 -0.05 0.00 -2.06 0.00 0.00 37.83 34.63 1lxm s LYS 618 CO 0.52 0.17 1.17 -1.25 0.10 0.00 0.00 175.35 176.06 1lxm s PRO 619 N -3.30 3.28 0.53 1.78 0.04 -1.26 -4.96 135.00 131.11 1lxm s PRO 619 Ca 0.17 1.74 -0.22 0.00 0.04 0.00 0.00 61.00 62.73 1lxm s PRO 619 Cb -0.02 -2.06 -0.05 0.00 0.04 0.00 0.00 34.50 32.41 1lxm s PRO 619 CO 0.04 -0.94 1.37 -0.51 0.04 0.00 0.00 177.00 177.01 1lxm s LEU 620 N -3.75 3.90 -0.07 -3.56 1.02 -1.26 -5.02 118.68 109.94 1lxm s LEU 620 Ca 0.73 2.80 0.05 0.00 0.02 0.00 0.00 54.13 57.72 1lxm s LEU 620 Cb -0.28 -4.21 -0.00 0.00 0.02 0.00 0.00 46.19 41.72 1lxm s LEU 620 CO 0.31 -1.50 -0.21 -0.75 0.02 0.00 0.00 176.35 174.22 1lxm s LYS 621 N -2.82 2.42 0.42 1.70 2.20 -1.26 -4.86 119.74 117.54 1lxm s LYS 621 Ca 0.70 -0.77 -0.26 0.00 -0.36 0.00 0.00 55.97 55.28 1lxm s LYS 621 Cb -0.41 -1.97 -0.09 0.00 -1.51 0.00 0.00 37.83 33.85 1lxm s LYS 621 CO 0.49 0.24 1.41 -1.12 -0.36 0.00 0.00 175.35 176.02 1lxm s SER 622 N 0.14 6.08 -0.11 1.43 0.01 -1.26 -4.72 113.70 115.28 1lxm s SER 622 Ca -0.10 2.88 -0.12 0.00 1.31 0.00 0.00 55.95 59.92 1lxm s SER 622 Cb -0.15 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.46 1lxm s SER 622 CO 0.05 -1.03 0.33 0.21 0.41 0.00 0.00 173.24 173.21 1lxm s ASN 623 N -0.49 -0.32 -0.16 2.44 2.47 -0.12 -4.97 114.94 113.79 1lxm s ASN 623 Ca 0.58 0.58 -0.04 0.00 0.42 0.00 0.00 52.86 54.39 1lxm s ASN 623 Cb -0.43 0.62 0.06 0.00 -1.45 0.00 0.00 41.25 40.05 1lxm s ASN 623 CO 0.56 -0.17 0.08 -0.22 -3.72 0.00 0.00 177.10 173.63 1lxm s LEU 624 N -0.06 0.41 -0.13 3.21 0.20 -1.26 -0.14 118.68 120.90 1lxm s LEU 624 Ca -0.02 -0.56 0.00 0.00 0.69 0.00 0.00 54.13 54.25 1lxm s LEU 624 Cb -0.03 -0.27 -0.01 0.00 -0.43 0.00 0.00 46.19 45.45 1lxm s LEU 624 CO 0.01 -0.33 -0.15 -0.44 -0.29 0.00 0.00 176.35 175.15 1lxm s SER 625 N 2.11 3.83 -0.60 3.68 0.01 -0.35 -4.84 113.70 117.54 1lxm s SER 625 Ca 0.02 -0.39 -0.09 0.00 1.31 0.00 0.00 55.95 56.81 1lxm s SER 625 Cb -0.16 -1.58 0.16 0.00 0.21 0.00 0.00 66.02 64.65 1lxm s SER 625 CO -0.08 0.14 0.48 0.42 0.41 0.00 0.00 173.24 174.60 1lxm s THR 626 N 0.49 4.41 -1.23 1.44 -4.23 -1.26 -2.11 115.64 113.15 1lxm s THR 626 Ca -0.10 -2.29 -0.11 0.00 -1.18 0.00 0.00 61.69 58.00 1lxm s THR 626 Cb -0.16 -3.84 0.18 0.00 1.34 0.00 0.00 72.50 70.02 1lxm s THR 626 CO 0.05 -0.87 1.59 0.49 -0.54 0.00 0.00 174.62 175.34 1lxm n PHE 627 N 4.27 4.10 -0.13 3.99 3.72 0.10 -4.77 117.46 128.74 1lxm n PHE 627 Ca 0.02 -3.14 -0.08 0.00 -0.05 0.00 0.00 57.45 54.20 1lxm n PHE 627 Cb 0.41 -2.03 0.08 0.00 -0.94 0.00 0.00 39.48 37.00 1lxm n PHE 627 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1lxm h ASN 628 N 6.50 0.89 -0.10 4.37 4.21 -1.91 0.13 115.58 129.66 1lxm h ASN 628 Ca 0.34 -0.28 0.03 0.00 1.21 0.00 0.00 56.30 57.59 1lxm h ASN 628 Cb 0.77 -0.24 -0.00 0.00 -1.12 0.00 0.00 38.32 37.72 1lxm h ASN 628 CO 1.38 1.01 0.40 0.28 -1.29 0.00 0.00 177.43 179.22 1lxm h SER 629 N 0.80 0.00 0.00 5.81 0.02 -1.94 0.05 113.55 118.28 1lxm h SER 629 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1lxm h SER 629 Cb 0.64 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.18 1lxm h SER 629 CO 0.04 0.00 -0.11 1.15 -1.14 0.00 0.00 176.83 176.78 1lxm n MET 630 N -3.04 1.16 -3.73 3.45 0.00 -0.96 -4.97 117.12 109.03 1lxm n MET 630 Ca 0.00 -1.38 -0.26 0.00 0.00 0.00 0.00 57.70 56.06 1lxm n MET 630 Cb 0.48 -0.88 0.03 0.00 0.00 0.00 0.00 33.22 32.84 1lxm n MET 630 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1lxm n ASP 631 N -0.48 -2.92 -4.00 3.17 10.43 0.04 -4.73 116.55 118.05 1lxm n ASP 631 Ca 0.04 -0.94 -0.12 0.00 2.57 0.00 0.00 54.79 56.34 1lxm n ASP 631 Cb 0.50 -3.59 -0.12 0.00 1.84 0.00 0.00 41.12 39.75 1lxm n ASP 631 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 1lxm s ARG 632 N -6.03 0.39 -0.07 -1.24 1.81 0.22 -1.95 118.95 112.08 1lxm s ARG 632 Ca 0.22 -0.57 -0.01 0.00 -1.72 0.00 0.00 55.73 53.65 1lxm s ARG 632 Cb -0.07 -0.13 0.03 0.00 -0.45 0.00 0.00 34.95 34.33 1lxm s ARG 632 CO 0.85 0.01 -0.02 -1.17 -0.68 0.00 0.00 175.30 174.29 1lxm s LEU 633 N -1.24 0.82 -0.09 2.53 0.20 -0.40 0.03 118.68 120.54 1lxm s LEU 633 Ca -0.10 -0.13 0.01 0.00 0.69 0.00 0.00 54.13 54.60 1lxm s LEU 633 Cb -0.08 -0.51 -0.03 0.00 -0.43 0.00 0.00 46.19 45.14 1lxm s LEU 633 CO -0.00 -0.16 -0.09 0.00 -0.29 0.00 0.00 176.35 175.81 1lxm s ALA 634 N 1.74 2.87 -0.08 5.97 0.00 -0.90 0.02 121.76 131.39 1lxm s ALA 634 Ca 0.02 -0.90 -0.06 0.00 0.00 0.00 0.00 51.96 51.03 1lxm s ALA 634 Cb -0.13 -1.22 0.03 0.00 0.00 0.00 0.00 23.12 21.80 1lxm s ALA 634 CO -0.05 0.47 0.19 -0.47 0.00 0.00 0.00 175.76 175.91 1lxm s TYR 635 N -0.46 -0.23 -0.07 0.00 5.04 0.43 -1.21 117.35 120.86 1lxm s TYR 635 Ca 0.06 0.56 0.00 0.00 -2.44 0.00 0.00 57.07 55.26 1lxm s TYR 635 Cb -0.12 0.04 0.02 0.00 0.35 0.00 0.00 41.96 42.25 1lxm s TYR 635 CO 0.02 -0.14 -0.04 -0.47 -1.34 0.00 0.00 175.55 173.58 1lxm s TYR 636 N 0.51 0.90 -0.42 4.97 5.04 0.80 0.17 117.35 129.32 1lxm s TYR 636 Ca -0.03 -0.31 -0.08 0.00 -2.44 0.00 0.00 57.07 54.20 1lxm s TYR 636 Cb -0.05 -0.84 0.09 0.00 0.35 0.00 0.00 41.96 41.51 1lxm s TYR 636 CO -0.03 -0.30 0.26 1.21 -1.34 0.00 0.00 175.55 175.36 1lxm s ASN 637 N 1.36 5.59 0.28 4.32 3.84 -0.23 -0.95 114.94 129.14 1lxm s ASN 637 Ca -0.04 -1.62 -0.02 0.00 0.21 0.00 0.00 52.86 51.39 1lxm s ASN 637 Cb -0.13 -1.97 0.39 0.00 -0.55 0.00 0.00 41.25 38.99 1lxm s ASN 637 CO -0.03 -0.56 1.85 0.00 -2.79 0.00 0.00 177.10 175.57 1lxm h ALA 638 N 8.37 1.23 0.62 1.71 0.00 -1.86 0.50 119.26 129.83 1lxm h ALA 638 Ca -0.22 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.49 1lxm h ALA 638 Cb 1.08 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1lxm h ALA 638 CO 0.77 0.55 -0.47 -0.22 0.00 0.00 0.00 179.25 179.87 1lxm h LYS 639 N 0.88 -1.01 -0.01 0.00 3.64 -1.93 -2.87 116.57 115.28 1lxm h LYS 639 Ca 0.20 0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 1lxm h LYS 639 Cb 0.22 0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 1lxm h LYS 639 CO -0.01 -0.68 -0.19 1.63 -2.27 0.00 0.00 179.45 177.93 1lxm n LYS 640 N -5.37 0.78 -2.98 1.90 4.76 -1.22 -5.00 118.16 111.04 1lxm n LYS 640 Ca -0.13 -0.38 -0.13 0.00 -2.87 0.00 0.00 58.31 54.80 1lxm n LYS 640 Cb 0.46 -1.49 0.01 0.00 -1.84 0.00 0.00 35.03 32.17 1lxm n LYS 640 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1lxm n ASP 641 N -0.78 -7.52 -3.61 4.39 4.64 0.17 -4.91 116.55 108.94 1lxm n ASP 641 Ca 0.13 0.39 -0.09 0.00 -1.38 0.00 0.00 54.79 53.84 1lxm n ASP 641 Cb 0.32 -4.73 -0.06 0.00 -1.04 0.00 0.00 41.12 35.60 1lxm n ASP 641 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 1lxm s PHE 642 N -2.43 -0.40 0.34 -0.67 -0.12 -0.90 -4.75 117.98 109.06 1lxm s PHE 642 Ca 0.26 0.87 0.07 0.00 -0.05 0.00 0.00 56.93 58.09 1lxm s PHE 642 Cb -0.06 0.41 -0.01 0.00 -0.63 0.00 0.00 43.02 42.72 1lxm s PHE 642 CO 0.79 -0.26 0.43 0.20 -0.05 0.00 0.00 175.22 176.33 1lxm s GLY 643 N -0.33 1.66 -0.15 1.99 0.00 -0.24 -1.07 107.32 109.17 1lxm s GLY 643 Ca 0.02 -1.52 -0.11 0.00 0.00 0.00 0.00 44.72 43.11 1lxm s GLY 643 CO -0.04 -1.43 0.38 -0.12 0.00 0.00 0.00 173.10 171.90 1lxm s PHE 644 N -2.21 -0.48 0.05 1.90 5.36 0.45 -1.87 117.98 121.17 1lxm s PHE 644 Ca 0.44 1.11 0.05 0.00 -0.96 0.00 0.00 56.93 57.58 1lxm s PHE 644 Cb -0.09 0.18 -0.03 0.00 -0.34 0.00 0.00 43.02 42.75 1lxm s PHE 644 CO 0.30 -0.26 -0.15 0.00 -1.46 0.00 0.00 175.22 173.65 1lxm s ALA 645 N 0.75 1.24 -0.08 11.12 0.00 -0.68 0.16 121.76 134.27 1lxm s ALA 645 Ca -0.04 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1lxm s ALA 645 Cb -0.05 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.92 1lxm s ALA 645 CO -0.05 0.22 -0.06 -0.51 0.00 0.00 0.00 175.76 175.36 1lxm s LEU 646 N -1.39 1.14 -0.26 0.00 1.43 0.10 -1.39 118.68 118.31 1lxm s LEU 646 Ca 0.01 -0.21 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 1lxm s LEU 646 Cb -0.09 -0.65 0.06 0.00 0.03 0.00 0.00 46.19 45.54 1lxm s LEU 646 CO 0.02 -0.10 -0.11 -0.94 0.23 0.00 0.00 176.35 175.45 1lxm s SER 647 N 1.44 4.39 0.29 2.29 1.04 -0.77 -1.27 113.70 121.11 1lxm s SER 647 Ca -0.02 -1.33 0.00 0.00 0.48 0.00 0.00 55.95 55.09 1lxm s SER 647 Cb -0.13 -1.56 -0.00 0.00 0.10 0.00 0.00 66.02 64.42 1lxm s SER 647 CO -0.04 -0.18 0.00 0.18 0.98 0.00 0.00 173.24 174.18 1lxm n LEU 648 N 4.47 0.00 -3.62 2.42 4.77 -0.82 -2.54 117.00 121.68 1lxm n LEU 648 Ca -0.14 -1.83 -0.16 0.00 -0.03 0.00 0.00 56.01 53.85 1lxm n LEU 648 Cb 0.43 0.21 -0.07 0.00 -2.33 0.00 0.00 43.42 41.66 1lxm n LEU 648 CO 0.22 -0.26 0.26 -1.38 -1.33 0.00 0.00 177.39 174.90 1lxm s HIS 649 N -2.06 -0.44 0.00 -1.77 -3.43 -1.22 -4.77 115.29 101.60 1lxm s HIS 649 Ca 0.00 0.69 0.00 0.00 -0.80 0.00 0.00 55.06 54.95 1lxm s HIS 649 Cb 0.00 0.29 0.00 0.00 -1.43 0.00 0.00 32.58 31.44 1lxm s HIS 649 CO 0.00 -0.54 0.00 -1.13 -2.00 0.00 0.00 174.74 171.07 1lxm n SER 650 N 0.93 0.20 0.24 7.38 3.41 -1.23 -4.62 113.62 119.92 1lxm n SER 650 Ca -0.20 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.53 1lxm n SER 650 Cb 0.57 0.00 0.57 0.00 -0.26 0.00 0.00 64.21 65.09 1lxm n SER 650 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1lxm h LYS 651 N 0.00 0.00 0.00 4.33 1.57 -1.54 1.59 116.57 122.52 1lxm h LYS 651 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1lxm h LYS 651 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1lxm h LYS 651 CO 0.00 0.18 -0.39 0.54 -0.57 0.00 0.00 179.45 179.21 1lxm n ARG 652 N -3.44 0.17 -3.96 3.15 1.74 -1.26 -4.65 116.66 108.41 1lxm n ARG 652 Ca -0.00 0.08 -0.10 0.00 -0.77 0.00 0.00 57.85 57.05 1lxm n ARG 652 Cb 0.36 -1.64 -0.12 0.00 -1.02 0.00 0.00 32.46 30.05 1lxm n ARG 652 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1lxm s THR 653 N -3.09 0.10 0.46 0.55 -4.23 -1.09 -4.74 115.64 103.60 1lxm s THR 653 Ca 0.09 -0.71 -0.21 0.00 -1.18 0.00 0.00 61.69 59.68 1lxm s THR 653 Cb 0.15 -0.22 -0.09 0.00 1.34 0.00 0.00 72.50 73.68 1lxm s THR 653 CO 0.66 -0.38 1.02 -0.22 -0.54 0.00 0.00 174.62 175.17 1lxm s LEU 654 N -1.13 3.93 0.30 4.79 2.96 -0.75 -3.50 118.68 125.28 1lxm s LEU 654 Ca -0.12 1.91 0.06 0.00 -0.22 0.00 0.00 54.13 55.76 1lxm s LEU 654 Cb -0.08 -4.47 0.47 0.00 0.50 0.00 0.00 46.19 42.61 1lxm s LEU 654 CO -0.01 -0.65 1.72 -0.55 -1.32 0.00 0.00 176.35 175.55 1lxm h ASN 655 N 1.83 0.28 -5.13 3.68 -1.07 -1.70 -3.47 115.58 110.00 1lxm h ASN 655 Ca -0.49 -0.11 0.26 0.00 0.07 0.00 0.00 56.30 56.03 1lxm h ASN 655 Cb 1.21 -0.08 -0.14 0.00 -2.07 0.00 0.00 38.32 37.25 1lxm h ASN 655 CO 0.60 0.63 0.74 -0.72 0.07 0.00 0.00 177.43 178.75 1lxm s TYR 656 N -4.23 -0.11 -0.17 4.14 1.13 -1.26 -3.24 117.35 113.60 1lxm s TYR 656 Ca -0.05 -0.01 -0.00 0.00 -1.41 0.00 0.00 57.07 55.60 1lxm s TYR 656 Cb 0.14 0.55 0.04 0.00 -1.10 0.00 0.00 41.96 41.58 1lxm s TYR 656 CO 0.77 -0.36 -0.07 -2.00 -2.51 0.00 0.00 175.55 171.38 1lxm s GLU 657 N -2.62 1.66 -0.35 -3.49 2.12 -1.26 -4.82 118.70 109.95 1lxm s GLU 657 Ca 0.11 -0.59 -0.05 0.00 0.36 0.00 0.00 54.97 54.80 1lxm s GLU 657 Cb 0.02 -2.10 0.06 0.00 0.26 0.00 0.00 34.13 32.36 1lxm s GLU 657 CO -0.04 -0.41 0.11 0.20 -0.54 0.00 0.00 175.26 174.59 1lxm s GLY 658 N 1.56 1.85 0.01 -1.50 0.00 -1.26 -3.96 107.32 104.02 1lxm s GLY 658 Ca 0.01 -1.90 0.00 0.00 0.00 0.00 0.00 44.72 42.83 1lxm s GLY 658 CO -0.08 0.81 -0.02 -0.29 0.00 0.00 0.00 173.10 173.52 1lxm s MET 659 N 1.33 0.17 -1.40 2.90 0.00 -0.99 -4.86 119.30 116.45 1lxm s MET 659 Ca -0.01 -0.31 -0.06 0.00 0.00 0.00 0.00 55.69 55.31 1lxm s MET 659 Cb -0.20 0.04 0.03 0.00 0.00 0.00 0.00 34.83 34.70 1lxm s MET 659 CO 0.01 -0.02 0.84 0.09 0.00 0.00 0.00 175.02 175.94 1lxm n ASN 660 N 2.33 -2.84 -2.85 1.11 3.02 -1.26 -1.62 115.26 113.15 1lxm n ASN 660 Ca -0.18 -0.79 -0.21 0.00 -0.03 0.00 0.00 54.58 53.37 1lxm n ASN 660 Cb 0.57 -4.04 0.04 0.00 -0.61 0.00 0.00 39.78 35.74 1lxm n ASN 660 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1lxm n ASP 661 N -2.97 -5.85 -4.24 6.41 9.92 -1.26 -4.77 116.55 113.79 1lxm n ASP 661 Ca -0.15 -0.28 -0.24 0.00 -0.53 0.00 0.00 54.79 53.59 1lxm n ASP 661 Cb 0.61 -4.65 -0.13 0.00 -0.64 0.00 0.00 41.12 36.31 1lxm n ASP 661 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 1lxm s GLU 662 N -5.66 1.19 -1.31 -1.24 2.02 -0.64 -1.41 118.70 111.65 1lxm s GLU 662 Ca 0.30 -1.00 -0.03 0.00 0.02 0.00 0.00 54.97 54.26 1lxm s GLU 662 Cb -0.13 -1.34 0.01 0.00 0.10 0.00 0.00 34.13 32.77 1lxm s GLU 662 CO 0.37 0.33 0.91 -1.71 0.02 0.00 0.00 175.26 175.18 1lxm n ASN 663 N 1.53 -2.73 0.15 -0.19 4.05 -0.85 -2.36 115.26 114.87 1lxm n ASN 663 Ca -0.18 -0.70 0.11 0.00 0.45 0.00 0.00 54.58 54.25 1lxm n ASN 663 Cb 0.54 -4.54 0.56 0.00 1.23 0.00 0.00 39.78 37.56 1lxm n ASN 663 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 1lxm n THR 664 N -4.39 0.97 -0.20 -0.44 -2.24 -1.05 -2.16 114.28 104.77 1lxm n THR 664 Ca -0.20 0.57 0.00 0.00 -2.27 0.00 0.00 64.05 62.15 1lxm n THR 664 Cb 0.64 -1.55 0.00 0.00 -2.10 0.00 0.00 70.33 67.31 1lxm n THR 664 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1lxm n ARG 665 N -2.26 2.24 0.00 -0.78 3.00 -1.26 -0.58 116.66 117.02 1lxm n ARG 665 Ca -0.00 -1.26 0.00 0.00 -0.01 0.00 0.00 57.85 56.58 1lxm n ARG 665 Cb 0.10 -0.90 0.00 0.00 0.00 0.00 0.00 32.46 31.66 1lxm n ARG 665 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1lxm n GLY 666 N -0.38 0.65 0.30 -0.13 0.00 -0.92 -4.42 105.19 100.29 1lxm n GLY 666 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1lxm n GLY 666 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1lxm h TRP 667 N 0.40 -0.30 -0.31 1.61 6.55 -1.86 -2.98 115.95 119.07 1lxm h TRP 667 Ca 0.00 0.07 -0.11 0.00 0.95 0.00 0.00 58.89 59.80 1lxm h TRP 667 Cb 0.24 0.26 -0.07 0.00 -0.86 0.00 0.00 29.16 28.73 1lxm h TRP 667 CO 0.00 -0.33 -0.03 0.66 -1.05 0.00 0.00 178.44 177.69 1lxm n TYR 668 N -5.48 1.02 1.50 0.49 4.01 -1.26 -4.62 117.16 112.82 1lxm n TYR 668 Ca 0.13 -1.31 0.13 0.00 -0.16 0.00 0.00 57.90 56.70 1lxm n TYR 668 Cb 0.46 -0.42 0.75 0.00 -0.31 0.00 0.00 39.34 39.82 1lxm n TYR 668 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1lxm n THR 669 N -0.92 0.07 0.01 -0.72 -2.24 -1.12 -3.25 114.28 106.11 1lxm n THR 669 Ca 0.29 0.02 0.01 0.00 -2.27 0.00 0.00 64.05 62.09 1lxm n THR 669 Cb 0.98 -0.58 0.02 0.00 -2.10 0.00 0.00 70.33 68.65 1lxm n THR 669 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lxm n GLY 670 N 0.83 1.40 2.55 3.38 0.00 -1.20 -4.50 105.19 107.65 1lxm n GLY 670 Ca 0.17 -0.07 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1lxm n GLY 670 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1lxm n ASP 671 N -0.14 7.35 -1.91 1.61 8.00 -1.20 -3.37 116.55 126.89 1lxm n ASP 671 Ca 0.02 -3.31 -0.07 0.00 0.71 0.00 0.00 54.79 52.14 1lxm n ASP 671 Cb 0.20 -1.26 0.03 0.00 -0.02 0.00 0.00 41.12 40.08 1lxm n ASP 671 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lxm n GLY 672 N 0.95 0.18 3.81 0.44 0.00 -1.05 -4.29 105.19 105.23 1lxm n GLY 672 Ca 0.55 -0.26 -0.38 0.00 0.00 0.00 0.00 46.02 45.93 1lxm n GLY 672 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1lxm s MET 673 N -4.78 4.20 0.13 1.61 1.75 -1.07 -3.61 119.30 117.53 1lxm s MET 673 Ca 0.06 0.74 0.10 0.00 -1.25 0.00 0.00 55.69 55.34 1lxm s MET 673 Cb -0.03 -3.16 -0.04 0.00 2.84 0.00 0.00 34.83 34.44 1lxm s MET 673 CO 0.29 0.59 -0.25 -0.59 -0.65 0.00 0.00 175.02 174.41 1lxm s PHE 674 N -1.20 2.17 -0.02 4.11 -0.71 -0.75 -1.85 117.98 119.73 1lxm s PHE 674 Ca 0.32 -0.39 0.06 0.00 -1.04 0.00 0.00 56.93 55.88 1lxm s PHE 674 Cb -0.19 -1.16 -0.01 0.00 -1.21 0.00 0.00 43.02 40.45 1lxm s PHE 674 CO 0.20 0.33 -0.21 0.71 -1.34 0.00 0.00 175.22 174.91 1lxm s TYR 675 N -1.19 1.88 -0.18 3.49 1.51 -0.49 -4.77 117.35 117.60 1lxm s TYR 675 Ca 0.13 -0.39 0.01 0.00 -1.01 0.00 0.00 57.07 55.81 1lxm s TYR 675 Cb -0.10 -1.22 0.02 0.00 -0.11 0.00 0.00 41.96 40.56 1lxm s TYR 675 CO 0.06 -0.06 -0.18 0.42 -1.11 0.00 0.00 175.55 174.68 1lxm s ILE 676 N -0.40 2.01 -0.45 2.71 -1.09 -1.26 -1.69 121.20 121.03 1lxm s ILE 676 Ca 0.06 -0.97 -0.13 0.00 -2.23 0.00 0.00 60.65 57.37 1lxm s ILE 676 Cb -0.09 -1.85 0.07 0.00 -1.58 0.00 0.00 42.46 39.01 1lxm s ILE 676 CO -0.00 0.47 0.34 -0.31 -1.23 0.00 0.00 174.94 174.21 1lxm s TYR 677 N 1.30 3.28 0.00 3.97 2.02 -0.78 -4.95 117.35 122.18 1lxm s TYR 677 Ca 0.04 -1.13 0.00 0.00 -0.37 0.00 0.00 57.07 55.61 1lxm s TYR 677 Cb -0.14 -3.05 0.00 0.00 -0.40 0.00 0.00 41.96 38.37 1lxm s TYR 677 CO -0.12 -0.80 0.00 0.27 -1.57 0.00 0.00 175.55 173.33 1lxm n ASN 678 N 5.09 1.30 0.00 2.29 0.23 -1.26 -1.07 115.26 121.84 1lxm n ASN 678 Ca -0.12 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.01 1lxm n ASN 678 Cb 0.44 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.56 1lxm n ASN 678 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1lxm n SER 679 N 0.00 0.00 -4.40 0.53 3.41 -0.53 -4.06 113.62 108.56 1lxm n SER 679 Ca 0.00 -0.04 -0.44 0.00 -0.26 0.00 0.00 58.87 58.14 1lxm n SER 679 Cb 0.00 -0.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 1lxm n SER 679 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1lxm n ASP 680 N -1.24 5.14 0.00 4.04 4.64 -1.26 -4.84 116.55 123.03 1lxm n ASP 680 Ca 0.08 -2.98 0.00 0.00 -1.38 0.00 0.00 54.79 50.51 1lxm n ASP 680 Cb 0.12 -1.59 0.00 0.00 -1.04 0.00 0.00 41.12 38.61 1lxm n ASP 680 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1lxm n GLN 681 N 5.89 0.00 -0.35 -0.67 6.02 -1.26 -1.76 117.38 125.26 1lxm n GLN 681 Ca 0.39 0.25 0.08 0.00 -0.01 0.00 0.00 57.00 57.71 1lxm n GLN 681 Cb 0.42 -1.51 0.17 0.00 1.02 0.00 0.00 30.24 30.35 1lxm n GLN 681 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1lxm n SER 682 N -1.24 2.00 -0.17 1.08 3.41 -1.26 -4.77 113.62 112.67 1lxm n SER 682 Ca 0.00 -3.48 -0.08 0.00 -0.26 0.00 0.00 58.87 55.05 1lxm n SER 682 Cb 0.01 -0.48 0.07 0.00 -0.26 0.00 0.00 64.21 63.55 1lxm n SER 682 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1lxm h HIS 683 N 0.50 1.06 -0.01 7.33 6.17 -1.75 -2.93 115.15 125.53 1lxm h HIS 683 Ca -0.00 -0.18 0.00 0.00 0.71 0.00 0.00 60.37 60.89 1lxm h HIS 683 Cb 1.01 -0.28 0.00 0.00 2.52 0.00 0.00 27.41 30.67 1lxm h HIS 683 CO 0.38 0.96 -0.49 0.66 0.71 0.00 0.00 177.93 180.15 1lxm n TYR 684 N -4.17 0.00 -2.99 5.26 4.01 -1.26 -4.79 117.16 113.21 1lxm n TYR 684 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 1lxm n TYR 684 Cb 0.35 -0.08 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 1lxm n TYR 684 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1lxm n SER 685 N -0.69 0.33 -3.40 7.72 7.64 -1.10 -4.39 113.62 119.73 1lxm n SER 685 Ca 0.09 -0.83 -0.21 0.00 1.01 0.00 0.00 58.87 58.93 1lxm n SER 685 Cb 0.39 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.64 1lxm n SER 685 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1lxm n ASN 686 N -2.20 -6.21 -3.64 6.43 2.85 -1.26 -3.38 115.26 107.84 1lxm n ASN 686 Ca 0.00 -0.81 -0.26 0.00 -0.11 0.00 0.00 54.58 53.40 1lxm n ASN 686 Cb 0.00 -4.55 0.06 0.00 1.24 0.00 0.00 39.78 36.53 1lxm n ASN 686 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1lxm n HIS 687 N -3.54 -2.64 -0.04 1.20 8.25 -1.26 -4.93 115.22 112.26 1lxm n HIS 687 Ca -0.08 0.94 -0.16 0.00 -0.26 0.00 0.00 57.72 58.17 1lxm n HIS 687 Cb 0.61 -4.66 -0.13 0.00 1.12 0.00 0.00 29.99 26.93 1lxm n HIS 687 CO 0.00 0.00 0.00 0.35 0.64 0.00 0.00 176.34 177.33 1lxm h PHE 688 N -2.40 0.16 -0.40 4.41 3.57 -1.76 -3.19 116.94 117.33 1lxm h PHE 688 Ca -0.57 -0.11 -0.03 0.00 3.53 0.00 0.00 57.97 60.79 1lxm h PHE 688 Cb 1.37 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 40.08 1lxm h PHE 688 CO 0.53 1.07 0.11 -1.49 -2.23 0.00 0.00 178.31 176.29 1lxm h TRP 689 N -0.80 0.58 0.00 0.41 4.06 -1.89 0.55 115.95 118.86 1lxm h TRP 689 Ca -0.04 -0.03 0.00 0.00 2.06 0.00 0.00 58.89 60.88 1lxm h TRP 689 Cb 1.16 -0.18 0.00 0.00 -1.00 0.00 0.00 29.16 29.14 1lxm h TRP 689 CO 0.25 0.50 -0.24 -1.00 -3.56 0.00 0.00 178.44 174.39 1lxm h PRO 690 N 0.57 0.00 0.00 0.49 0.13 -1.88 -3.30 132.00 128.01 1lxm h PRO 690 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1lxm h PRO 690 Cb 0.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.33 1lxm h PRO 690 CO -0.01 0.00 -0.94 0.25 -0.23 0.00 0.00 178.00 177.07 1lxm n THR 691 N -2.43 0.00 -2.39 1.56 -2.24 -0.95 -3.82 114.28 104.00 1lxm n THR 691 Ca 0.04 -0.18 -0.36 0.00 -2.27 0.00 0.00 64.05 61.28 1lxm n THR 691 Cb 0.46 0.82 -0.02 0.00 -2.10 0.00 0.00 70.33 69.49 1lxm n THR 691 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1lxm s VAL 692 N -2.60 3.42 -0.69 2.28 0.11 0.19 -4.44 120.40 118.68 1lxm s VAL 692 Ca 0.03 1.00 -0.27 0.00 -2.93 0.00 0.00 61.98 59.81 1lxm s VAL 692 Cb 0.11 -3.47 0.02 0.00 -1.53 0.00 0.00 36.38 31.51 1lxm s VAL 692 CO 0.64 -0.08 1.42 0.21 -3.33 0.00 0.00 175.10 173.96 1lxm s ASN 693 N -1.62 5.97 0.67 3.54 3.04 -1.26 -4.87 114.94 120.40 1lxm s ASN 693 Ca 0.65 -0.18 0.32 0.00 0.04 0.00 0.00 52.86 53.68 1lxm s ASN 693 Cb -0.23 -2.55 1.74 0.00 -1.54 0.00 0.00 41.25 38.66 1lxm s ASN 693 CO 0.28 -1.94 1.98 1.55 -3.04 0.00 0.00 177.10 175.94 1lxm h PRO 694 N 11.23 0.00 0.05 0.43 0.13 -1.93 -1.75 132.00 140.16 1lxm h PRO 694 Ca -0.27 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.76 1lxm h PRO 694 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 1lxm h PRO 694 CO 1.25 0.00 -0.47 1.88 -0.23 0.00 0.00 178.00 180.44 1lxm h TYR 695 N 0.00 0.18 -2.09 1.56 0.05 -1.91 -3.38 116.97 111.37 1lxm h TYR 695 Ca 0.00 -0.13 -0.79 0.00 0.05 0.00 0.00 58.73 57.86 1lxm h TYR 695 Cb 0.58 -0.01 -0.22 0.00 1.01 0.00 0.00 36.73 38.09 1lxm h TYR 695 CO 0.00 1.18 1.41 1.63 -1.05 0.00 0.00 178.16 181.33 1lxm n LYS 696 N -4.41 4.60 -2.37 4.88 5.02 -0.66 -4.94 118.16 120.28 1lxm n LYS 696 Ca -0.15 -4.17 -0.41 0.00 -2.02 0.00 0.00 58.31 51.56 1lxm n LYS 696 Cb 0.63 -2.61 -0.03 0.00 -0.02 0.00 0.00 35.03 33.00 1lxm n LYS 696 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1lxm s MET 697 N -2.27 4.48 -0.08 1.97 -1.94 -1.24 -4.73 119.30 115.49 1lxm s MET 697 Ca 0.39 1.88 -0.37 0.00 -1.71 0.00 0.00 55.69 55.88 1lxm s MET 697 Cb 0.12 -3.24 -0.15 0.00 2.01 0.00 0.00 34.83 33.57 1lxm s MET 697 CO -0.01 -0.10 1.67 0.00 -0.01 0.00 0.00 175.02 176.56 1lxm n ALA 698 N 2.58 0.15 -0.12 3.03 0.00 -1.26 -2.44 120.51 122.45 1lxm n ALA 698 Ca 0.05 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.88 1lxm n ALA 698 Cb 0.45 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1lxm n ALA 698 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1lxm n GLY 699 N 3.77 2.15 3.87 0.00 0.00 0.22 -1.81 105.19 113.39 1lxm n GLY 699 Ca 0.22 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 1lxm n GLY 699 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lxm s THR 700 N -2.91 4.74 -0.26 2.61 -4.23 -1.02 -4.71 115.64 109.86 1lxm s THR 700 Ca 0.00 0.74 -0.04 0.00 -1.18 0.00 0.00 61.69 61.21 1lxm s THR 700 Cb 0.00 -3.73 0.01 0.00 1.34 0.00 0.00 72.50 70.13 1lxm s THR 700 CO 0.00 -0.54 0.00 -0.89 -0.54 0.00 0.00 174.62 172.65 1lxm s THR 701 N -2.41 3.43 0.17 3.99 2.01 -1.26 -1.29 115.64 120.28 1lxm s THR 701 Ca 0.53 -0.78 0.02 0.00 0.31 0.00 0.00 61.69 61.76 1lxm s THR 701 Cb -0.10 -2.72 -0.01 0.00 0.01 0.00 0.00 72.50 69.68 1lxm s THR 701 CO 0.31 0.19 0.19 -0.62 -0.69 0.00 0.00 174.62 174.00 1lxm n GLU 702 N 4.77 0.27 -4.26 4.92 -0.58 -0.58 -4.97 120.64 120.22 1lxm n GLU 702 Ca -0.16 -1.56 -0.25 0.00 -0.42 0.00 0.00 57.16 54.77 1lxm n GLU 702 Cb 0.48 1.37 -0.08 0.00 -0.57 0.00 0.00 31.44 32.64 1lxm n GLU 702 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1lxm s LYS 703 N -2.56 2.28 0.00 3.49 1.02 -1.26 -1.51 119.74 121.20 1lxm s LYS 703 Ca 0.18 -1.27 0.31 0.00 0.02 0.00 0.00 55.97 55.21 1lxm s LYS 703 Cb 0.00 -2.23 1.68 0.00 -0.52 0.00 0.00 37.83 36.76 1lxm s LYS 703 CO 0.13 0.41 2.10 -0.40 -0.92 0.00 0.00 175.35 176.67 1lxm n ASP 704 N -0.40 0.36 -4.63 2.83 5.75 -1.11 -4.91 116.55 114.45 1lxm n ASP 704 Ca -0.09 -1.09 -0.52 0.00 -0.01 0.00 0.00 54.79 53.08 1lxm n ASP 704 Cb 0.57 -0.01 -0.06 0.00 -1.03 0.00 0.00 41.12 40.59 1lxm n ASP 704 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1lxm n ALA 705 N -0.73 -0.44 -1.78 2.12 0.00 -1.26 -4.88 120.51 113.54 1lxm n ALA 705 Ca 0.22 0.47 -0.41 0.00 0.00 0.00 0.00 53.44 53.73 1lxm n ALA 705 Cb 0.17 -2.16 -0.00 0.00 0.00 0.00 0.00 19.45 17.46 1lxm n ALA 705 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1lxm s LYS 706 N 1.30 4.14 0.28 0.00 2.47 -1.26 -5.03 119.74 121.63 1lxm s LYS 706 Ca 0.87 2.54 0.09 0.00 -1.56 0.00 0.00 55.97 57.91 1lxm s LYS 706 Cb -0.93 -2.98 -0.04 0.00 -1.46 0.00 0.00 37.83 32.42 1lxm s LYS 706 CO 0.50 -0.50 0.01 1.03 0.16 0.00 0.00 175.35 176.54 1lxm s ARG 707 N -2.03 2.27 -0.09 4.03 1.81 -1.26 -5.13 118.95 118.54 1lxm s ARG 707 Ca 0.53 -1.47 -0.01 0.00 -1.72 0.00 0.00 55.73 53.06 1lxm s ARG 707 Cb -0.46 -2.13 -0.03 0.00 -0.45 0.00 0.00 34.95 31.88 1lxm s ARG 707 CO 0.62 0.32 -0.05 -2.00 -0.68 0.00 0.00 175.30 173.51 1lxm s GLU 708 N -3.69 3.02 0.45 3.54 2.56 -1.26 -5.09 118.70 118.23 1lxm s GLU 708 Ca 0.32 -0.52 -0.25 0.00 0.00 0.00 0.00 54.97 54.52 1lxm s GLU 708 Cb -0.05 -2.70 -0.09 0.00 2.00 0.00 0.00 34.13 33.29 1lxm s GLU 708 CO 0.20 0.56 1.30 -0.25 -0.56 0.00 0.00 175.26 176.51 1lxm n ASP 709 N 2.54 2.63 -4.50 -1.70 10.43 -1.26 -4.90 116.55 119.79 1lxm n ASP 709 Ca -0.18 1.09 -0.42 0.00 2.57 0.00 0.00 54.79 57.84 1lxm n ASP 709 Cb 0.53 -1.52 -0.03 0.00 1.84 0.00 0.00 41.12 41.94 1lxm n ASP 709 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1lxm s THR 710 N -1.22 4.25 0.13 -3.53 2.01 0.25 -5.00 115.64 112.53 1lxm s THR 710 Ca 0.63 -0.86 0.05 0.00 0.31 0.00 0.00 61.69 61.82 1lxm s THR 710 Cb -0.48 -4.89 -0.04 0.00 0.01 0.00 0.00 72.50 67.10 1lxm s THR 710 CO 0.57 -1.70 0.07 -0.89 -0.69 0.00 0.00 174.62 171.97 1lxm s THR 711 N 4.11 4.27 0.17 -0.82 2.01 -1.26 -4.27 115.64 119.83 1lxm s THR 711 Ca 0.36 -1.06 -0.15 0.00 0.31 0.00 0.00 61.69 61.16 1lxm s THR 711 Cb -0.05 -3.12 0.04 0.00 0.01 0.00 0.00 72.50 69.38 1lxm s THR 711 CO -0.04 -0.01 1.80 0.50 -0.69 0.00 0.00 174.62 176.17 1lxm h LYS 712 N 2.86 0.48 -3.77 4.92 3.64 -1.93 -3.46 116.57 119.31 1lxm h LYS 712 Ca -0.47 -0.03 -0.48 0.00 -1.27 0.00 0.00 60.65 58.40 1lxm h LYS 712 Cb 1.19 -0.11 0.03 0.00 -0.41 0.00 0.00 32.23 32.92 1lxm h LYS 712 CO 0.62 0.32 2.55 -0.85 -2.27 0.00 0.00 179.45 179.82 1lxm n GLU 713 N -4.86 1.95 0.00 1.90 -0.00 -1.26 -5.03 120.64 113.33 1lxm n GLU 713 Ca 0.02 -1.63 0.00 0.00 -0.00 0.00 0.00 57.16 55.56 1lxm n GLU 713 Cb 0.08 -2.63 0.00 0.00 -0.00 0.00 0.00 31.44 28.90 1lxm n GLU 713 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1lxm n ALA 722 N 5.28 1.33 -0.01 -1.84 0.00 -1.26 -5.24 120.51 118.76 1lxm n ALA 722 Ca 0.47 0.00 0.20 0.00 0.00 0.00 0.00 53.44 54.11 1lxm n ALA 722 Cb 0.23 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.36 1lxm n ALA 722 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1lxm h LYS 723 N 0.00 0.02 -0.76 0.00 1.57 -1.99 -0.68 116.57 114.74 1lxm h LYS 723 Ca 0.00 -0.00 0.12 0.00 -1.87 0.00 0.00 60.65 58.90 1lxm h LYS 723 Cb 0.00 -0.00 -0.13 0.00 0.08 0.00 0.00 32.23 32.17 1lxm h LYS 723 CO 0.00 0.01 -0.37 0.93 -0.57 0.00 0.00 179.45 179.45 1lxm h GLU 724 N 0.02 -0.10 -7.24 3.15 5.08 -1.98 -1.40 114.58 112.12 1lxm h GLU 724 Ca 0.26 0.01 -0.46 0.00 -1.00 0.00 0.00 59.36 58.17 1lxm h GLU 724 Cb 1.02 0.02 0.10 0.00 0.50 0.00 0.00 28.75 30.39 1lxm h GLU 724 CO -0.01 -0.06 0.16 0.21 -1.00 0.00 0.00 179.01 178.31 1lxm s LYS 725 N -5.95 1.52 0.00 2.33 2.47 -0.26 -3.84 119.74 116.00 1lxm s LYS 725 Ca -0.14 -0.96 0.00 0.00 -1.56 0.00 0.00 55.97 53.31 1lxm s LYS 725 Cb 0.17 -2.24 0.00 0.00 -1.46 0.00 0.00 37.83 34.30 1lxm s LYS 725 CO 0.70 -1.61 0.00 0.25 0.16 0.00 0.00 175.35 174.85 1lxm n THR 726 N -3.00 0.00 -2.55 3.43 -2.24 -1.26 -3.89 114.28 104.77 1lxm n THR 726 Ca 0.15 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.73 1lxm n THR 726 Cb 0.60 -0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 1lxm n THR 726 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lxm n GLY 727 N -1.79 -0.41 3.29 3.38 0.00 -1.24 -4.91 105.19 103.51 1lxm n GLY 727 Ca 0.00 -0.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.54 1lxm n GLY 727 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1lxm s GLN 728 N -5.15 4.01 0.39 1.61 -0.21 -0.53 -4.83 119.66 114.94 1lxm s GLN 728 Ca 0.09 -3.21 0.04 0.00 0.02 0.00 0.00 55.36 52.30 1lxm s GLN 728 Cb -0.04 -4.44 -0.06 0.00 1.00 0.00 0.00 33.01 29.48 1lxm s GLN 728 CO 0.11 -1.25 0.05 0.14 -2.12 0.00 0.00 175.29 172.22 1lxm s VAL 729 N -1.24 1.32 0.56 1.09 -7.23 -1.26 -4.51 120.40 109.13 1lxm s VAL 729 Ca 0.30 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.48 1lxm s VAL 729 Cb -0.10 -2.70 0.04 0.00 0.56 0.00 0.00 36.38 34.19 1lxm s VAL 729 CO -0.09 0.00 0.78 0.42 -0.31 0.00 0.00 175.10 175.90 1lxm s THR 730 N -3.06 2.63 0.85 5.32 -4.23 -1.26 -1.80 115.64 114.08 1lxm s THR 730 Ca 0.30 -0.68 -0.11 0.00 -1.18 0.00 0.00 61.69 60.02 1lxm s THR 730 Cb 0.07 -2.95 0.10 0.00 1.34 0.00 0.00 72.50 71.06 1lxm s THR 730 CO 0.14 0.00 1.09 -0.83 -0.54 0.00 0.00 174.62 174.49 1lxm s GLY 731 N -4.45 1.62 -0.01 3.99 0.00 0.54 -4.86 107.32 104.15 1lxm s GLY 731 Ca 0.58 -0.12 0.19 0.00 0.00 0.00 0.00 44.72 45.38 1lxm s GLY 731 CO 0.39 0.34 0.63 -1.30 0.00 0.00 0.00 173.10 173.16 1lxm n THR 732 N -3.67 0.00 -4.16 0.90 -2.24 -1.26 -3.37 114.28 100.48 1lxm n THR 732 Ca 0.07 -0.24 -0.28 0.00 -2.27 0.00 0.00 64.05 61.33 1lxm n THR 732 Cb 0.56 0.56 -0.08 0.00 -2.10 0.00 0.00 70.33 69.27 1lxm n THR 732 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1lxm s SER 733 N -3.47 4.95 0.02 3.42 0.15 -1.26 -4.89 113.70 112.62 1lxm s SER 733 Ca 0.00 -0.27 0.22 0.00 0.70 0.00 0.00 55.95 56.60 1lxm s SER 733 Cb 0.13 -1.13 -0.06 0.00 -1.71 0.00 0.00 66.02 63.25 1lxm s SER 733 CO 0.79 0.12 0.94 0.47 1.20 0.00 0.00 173.24 176.77 1lxm n ASP 734 N 0.16 0.66 -4.02 5.45 10.43 -1.26 -3.00 116.55 124.96 1lxm n ASP 734 Ca -0.10 -0.47 -0.42 0.00 2.57 0.00 0.00 54.79 56.37 1lxm n ASP 734 Cb 0.54 0.98 0.00 0.00 1.84 0.00 0.00 41.12 44.48 1lxm n ASP 734 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 1lxm n PHE 735 N -1.79 3.92 -3.72 1.24 7.35 -1.26 -3.04 117.46 120.15 1lxm n PHE 735 Ca 0.02 -2.93 -0.12 0.00 -0.76 0.00 0.00 57.45 53.65 1lxm n PHE 735 Cb 0.41 -2.57 -0.13 0.00 0.35 0.00 0.00 39.48 37.54 1lxm n PHE 735 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1lxm s VAL 736 N 3.46 -0.07 0.00 -2.13 1.01 -1.26 -1.57 120.40 119.84 1lxm s VAL 736 Ca 0.49 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.63 1lxm s VAL 736 Cb 0.10 -0.40 0.00 0.00 0.00 0.00 0.00 36.38 36.09 1lxm s VAL 736 CO -0.03 0.06 0.00 0.61 0.00 0.00 0.00 175.10 175.74 1lxm n GLY 737 N 4.32 -0.45 3.22 4.51 0.00 -0.22 -4.71 105.19 111.86 1lxm n GLY 737 Ca -0.24 -1.11 -0.11 0.00 0.00 0.00 0.00 46.02 44.56 1lxm n GLY 737 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lxm s SER 738 N 0.00 -0.06 -0.03 1.61 1.04 -1.26 -0.31 113.70 114.69 1lxm s SER 738 Ca 0.00 -0.25 -0.05 0.00 0.48 0.00 0.00 55.95 56.13 1lxm s SER 738 Cb 0.00 0.32 0.01 0.00 0.10 0.00 0.00 66.02 66.45 1lxm s SER 738 CO 0.00 -0.58 0.12 0.54 0.98 0.00 0.00 173.24 174.30 1lxm s VAL 739 N -2.46 0.02 -0.02 5.02 0.11 0.57 -4.91 120.40 118.73 1lxm s VAL 739 Ca -0.06 -0.20 0.06 0.00 -2.93 0.00 0.00 61.98 58.86 1lxm s VAL 739 Cb -0.01 -0.24 -0.02 0.00 -1.53 0.00 0.00 36.38 34.57 1lxm s VAL 739 CO -0.03 -0.11 -0.21 -1.59 -3.33 0.00 0.00 175.10 169.83 1lxm s LYS 740 N -0.32 2.23 -0.12 1.54 -2.85 -1.26 -0.18 119.74 118.78 1lxm s LYS 740 Ca -0.04 -0.86 -0.25 0.00 -1.00 0.00 0.00 55.97 53.82 1lxm s LYS 740 Cb -0.03 -2.18 -0.27 0.00 -2.06 0.00 0.00 37.83 33.29 1lxm s LYS 740 CO 0.00 0.58 0.72 1.25 0.10 0.00 0.00 175.35 178.01 1lxm h LEU 741 N 5.29 0.15 0.00 2.77 6.46 -1.07 -3.49 115.31 125.42 1lxm h LEU 741 Ca -0.45 -0.92 -0.04 0.00 -0.12 0.00 0.00 57.88 56.35 1lxm h LEU 741 Cb 1.14 -0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 41.02 1lxm h LEU 741 CO 0.48 1.20 0.09 -0.46 -0.62 0.00 0.00 178.44 179.13 1lxm n ASN 742 N -4.41 -0.97 -0.13 1.25 0.23 -1.13 -4.99 115.26 105.11 1lxm n ASN 742 Ca -0.15 -1.76 0.00 0.00 -0.53 0.00 0.00 54.58 52.15 1lxm n ASN 742 Cb 0.62 1.64 0.00 0.00 -2.08 0.00 0.00 39.78 39.96 1lxm n ASN 742 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 1lxm n ASP 743 N -1.37 0.10 0.00 0.53 8.00 -1.26 -2.37 116.55 120.18 1lxm n ASP 743 Ca -0.03 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.67 1lxm n ASP 743 Cb 0.27 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.32 1lxm n ASP 743 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1lxm n HIS 744 N -0.29 0.00 -4.23 1.24 8.25 -1.26 -4.26 115.22 114.67 1lxm n HIS 744 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.24 1lxm n HIS 744 Cb 0.03 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 30.97 1lxm n HIS 744 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1lxm s PHE 745 N -0.20 0.96 0.16 4.41 0.40 -1.00 -0.88 117.98 121.83 1lxm s PHE 745 Ca 0.00 -0.31 -0.16 0.00 -0.60 0.00 0.00 56.93 55.85 1lxm s PHE 745 Cb 0.00 -0.80 0.03 0.00 0.51 0.00 0.00 43.02 42.76 1lxm s PHE 745 CO 0.00 -0.24 0.45 0.00 0.70 0.00 0.00 175.22 176.13 1lxm s ALA 746 N 0.95 -0.90 -0.03 5.36 0.00 -1.08 -0.34 121.76 125.72 1lxm s ALA 746 Ca -0.10 -0.15 0.01 0.00 0.00 0.00 0.00 51.96 51.73 1lxm s ALA 746 Cb -0.14 0.77 0.01 0.00 0.00 0.00 0.00 23.12 23.76 1lxm s ALA 746 CO 0.00 -0.71 -0.05 -1.17 0.00 0.00 0.00 175.76 173.83 1lxm s LEU 747 N -2.84 1.56 0.02 0.00 2.96 0.74 -1.38 118.68 119.74 1lxm s LEU 747 Ca 0.06 -0.13 0.04 0.00 -0.22 0.00 0.00 54.13 53.88 1lxm s LEU 747 Cb 0.01 -0.42 -0.01 0.00 0.50 0.00 0.00 46.19 46.26 1lxm s LEU 747 CO -0.08 -0.01 -0.11 0.00 -1.32 0.00 0.00 176.35 174.83 1lxm s ALA 748 N 0.54 0.93 0.02 5.97 0.00 0.01 -0.32 121.76 128.91 1lxm s ALA 748 Ca -0.07 -0.62 0.01 0.00 0.00 0.00 0.00 51.96 51.28 1lxm s ALA 748 Cb -0.11 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 1lxm s ALA 748 CO 0.00 0.18 -0.04 0.00 0.00 0.00 0.00 175.76 175.91 1lxm s ALA 749 N -0.59 0.25 -0.11 0.00 0.00 0.58 -0.19 121.76 121.69 1lxm s ALA 749 Ca 0.01 -0.46 -0.04 0.00 0.00 0.00 0.00 51.96 51.48 1lxm s ALA 749 Cb -0.06 0.06 0.05 0.00 0.00 0.00 0.00 23.12 23.17 1lxm s ALA 749 CO 0.00 -0.05 0.14 1.41 0.00 0.00 0.00 175.76 177.26 1lxm s MET 750 N -0.99 0.04 -0.56 0.00 1.75 0.11 -1.05 119.30 118.60 1lxm s MET 750 Ca -0.09 0.33 -0.28 0.00 -1.25 0.00 0.00 55.69 54.40 1lxm s MET 750 Cb -0.07 -0.81 0.03 0.00 2.84 0.00 0.00 34.83 36.82 1lxm s MET 750 CO -0.00 -0.45 1.20 -0.51 -0.65 0.00 0.00 175.02 174.61 1lxm s ASP 751 N 2.24 6.46 -0.16 1.11 -0.00 -0.61 -1.53 116.67 124.19 1lxm s ASP 751 Ca 0.04 0.18 -0.12 0.00 -0.00 0.00 0.00 52.55 52.64 1lxm s ASP 751 Cb -0.13 -2.55 -0.05 0.00 -0.00 0.00 0.00 42.92 40.19 1lxm s ASP 751 CO -0.07 -1.46 0.25 0.12 -0.00 0.00 0.00 175.17 174.01 1lxm s PHE 752 N 4.94 3.48 -0.07 4.23 5.36 0.17 -4.67 117.98 131.43 1lxm s PHE 752 Ca 0.44 0.55 -0.01 0.00 -0.96 0.00 0.00 56.93 56.95 1lxm s PHE 752 Cb -0.08 -2.26 0.03 0.00 -0.34 0.00 0.00 43.02 40.37 1lxm s PHE 752 CO 0.26 0.32 -0.01 -0.08 -1.46 0.00 0.00 175.22 174.25 1lxm s THR 753 N 0.22 0.44 0.97 0.12 -1.32 -1.26 -0.16 115.64 114.64 1lxm s THR 753 Ca 0.15 0.06 -0.12 0.00 -1.21 0.00 0.00 61.69 60.57 1lxm s THR 753 Cb -0.13 -0.57 0.17 0.00 -1.51 0.00 0.00 72.50 70.47 1lxm s THR 753 CO 0.03 0.26 1.09 0.54 -2.21 0.00 0.00 174.62 174.33 1lxm s ASN 754 N 1.78 2.71 0.32 8.08 6.03 0.72 -4.86 114.94 129.72 1lxm s ASN 754 Ca 0.02 1.62 0.10 0.00 -1.03 0.00 0.00 52.86 53.57 1lxm s ASN 754 Cb -0.13 -2.27 0.93 0.00 -3.03 0.00 0.00 41.25 36.76 1lxm s ASN 754 CO -0.05 -3.14 1.68 4.11 -2.03 0.00 0.00 177.10 177.67 1lxm h TRP 755 N -1.89 0.80 -0.69 1.54 5.08 -1.91 -0.58 115.95 118.30 1lxm h TRP 755 Ca -0.51 0.04 -0.38 0.00 1.08 0.00 0.00 58.89 59.12 1lxm h TRP 755 Cb 1.29 -0.20 -0.22 0.00 -3.00 0.00 0.00 29.16 27.04 1lxm h TRP 755 CO 0.39 -0.12 0.27 -0.40 -1.28 0.00 0.00 178.44 177.31 1lxm n ASP 756 N -5.05 3.48 -3.50 0.11 5.68 -1.26 -4.95 116.55 111.05 1lxm n ASP 756 Ca 0.28 -3.72 -0.23 0.00 -0.50 0.00 0.00 54.79 50.62 1lxm n ASP 756 Cb 0.84 -0.74 -0.04 0.00 -1.14 0.00 0.00 41.12 40.04 1lxm n ASP 756 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1lxm n ARG 757 N -1.11 -1.62 -0.07 0.11 5.12 -0.23 -4.75 116.66 114.12 1lxm n ARG 757 Ca 0.47 0.08 0.02 0.00 -1.93 0.00 0.00 57.85 56.49 1lxm n ARG 757 Cb 1.28 -4.29 0.06 0.00 -1.16 0.00 0.00 32.46 28.35 1lxm n ARG 757 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1lxm n THR 758 N -3.18 0.92 -3.68 0.55 -2.24 -1.26 -4.80 114.28 100.59 1lxm n THR 758 Ca 0.06 -0.96 -0.12 0.00 -2.27 0.00 0.00 64.05 60.76 1lxm n THR 758 Cb 0.44 0.55 -0.12 0.00 -2.10 0.00 0.00 70.33 69.09 1lxm n THR 758 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1lxm s LEU 759 N -0.95 -0.12 0.18 3.22 2.96 -1.26 -1.43 118.68 121.28 1lxm s LEU 759 Ca 0.09 0.66 0.09 0.00 -0.22 0.00 0.00 54.13 54.75 1lxm s LEU 759 Cb 0.05 0.87 -0.04 0.00 0.50 0.00 0.00 46.19 47.56 1lxm s LEU 759 CO 0.06 -0.21 -0.18 0.42 -1.32 0.00 0.00 176.35 175.12 1lxm s THR 760 N 2.00 1.90 -0.21 3.68 -4.23 0.99 -0.20 115.64 119.58 1lxm s THR 760 Ca -0.03 -2.01 -0.31 0.00 -1.18 0.00 0.00 61.69 58.16 1lxm s THR 760 Cb -0.11 -1.93 0.16 0.00 1.34 0.00 0.00 72.50 71.95 1lxm s THR 760 CO -0.10 -0.35 1.19 0.00 -0.54 0.00 0.00 174.62 174.83 1lxm s ALA 761 N -2.19 -2.04 -0.34 3.99 0.00 0.77 -0.62 121.76 121.35 1lxm s ALA 761 Ca 0.18 1.70 -0.07 0.00 0.00 0.00 0.00 51.96 53.78 1lxm s ALA 761 Cb -0.05 -0.89 0.03 0.00 0.00 0.00 0.00 23.12 22.21 1lxm s ALA 761 CO 0.08 -0.35 0.11 -0.65 0.00 0.00 0.00 175.76 174.94 1lxm s GLN 762 N -1.40 2.69 -0.07 0.00 -0.21 -0.04 0.43 119.66 121.06 1lxm s GLN 762 Ca 0.05 -1.13 0.01 0.00 0.02 0.00 0.00 55.36 54.31 1lxm s GLN 762 Cb -0.01 -3.47 -0.03 0.00 1.00 0.00 0.00 33.01 30.50 1lxm s GLN 762 CO -0.04 -0.64 -0.06 0.15 -2.12 0.00 0.00 175.29 172.58 1lxm s LYS 763 N 1.43 2.79 0.03 2.91 1.02 -0.58 -1.04 119.74 126.30 1lxm s LYS 763 Ca -0.01 -0.54 0.01 0.00 0.02 0.00 0.00 55.97 55.45 1lxm s LYS 763 Cb -0.19 -2.61 -0.02 0.00 -0.52 0.00 0.00 37.83 34.48 1lxm s LYS 763 CO 0.03 0.65 -0.05 0.20 -0.92 0.00 0.00 175.35 175.26 1lxm s GLY 764 N -0.77 0.34 -0.01 -3.33 0.00 0.27 0.06 107.32 103.90 1lxm s GLY 764 Ca 0.12 -0.67 0.04 0.00 0.00 0.00 0.00 44.72 44.21 1lxm s GLY 764 CO 0.02 -0.73 -0.12 -0.98 0.00 0.00 0.00 173.10 171.29 1lxm s TRP 765 N -1.47 1.04 -0.21 1.90 0.51 0.73 0.07 118.94 121.51 1lxm s TRP 765 Ca -0.13 -0.21 -0.01 0.00 -2.12 0.00 0.00 56.10 53.63 1lxm s TRP 765 Cb -0.10 -0.67 0.06 0.00 -0.81 0.00 0.00 33.47 31.95 1lxm s TRP 765 CO -0.01 -0.01 -0.02 0.08 -0.51 0.00 0.00 176.95 176.47 1lxm s VAL 766 N -0.32 1.15 -0.63 4.03 1.01 -0.30 -0.81 120.40 124.53 1lxm s VAL 766 Ca 0.04 -0.93 -0.23 0.00 0.00 0.00 0.00 61.98 60.86 1lxm s VAL 766 Cb -0.05 -1.49 0.06 0.00 0.00 0.00 0.00 36.38 34.91 1lxm s VAL 766 CO -0.00 -0.11 0.96 -0.63 0.00 0.00 0.00 175.10 175.31 1lxm s ILE 767 N 1.57 4.34 -1.10 2.22 1.01 -0.48 0.61 121.20 129.37 1lxm s ILE 767 Ca -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 60.65 60.40 1lxm s ILE 767 Cb -0.18 -4.64 0.27 0.00 0.01 0.00 0.00 42.46 37.92 1lxm s ILE 767 CO -0.07 -1.36 1.96 0.18 0.00 0.00 0.00 174.94 175.64 1lxm n LEU 768 N 7.64 7.51 0.00 2.97 4.77 0.90 -2.65 117.00 138.15 1lxm n LEU 768 Ca -0.02 -5.26 0.00 0.00 -0.03 0.00 0.00 56.01 50.69 1lxm n LEU 768 Cb 0.46 -1.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.33 1lxm n LEU 768 CO 0.64 2.04 0.00 -3.20 -1.33 0.00 0.00 177.39 175.54 1lxm n ASN 769 N 0.42 0.00 -0.54 -1.43 5.15 -0.06 -2.70 115.26 116.11 1lxm n ASN 769 Ca 0.50 0.00 0.07 0.00 -0.60 0.00 0.00 54.58 54.55 1lxm n ASN 769 Cb 0.26 0.00 0.05 0.00 -0.53 0.00 0.00 39.78 39.56 1lxm n ASN 769 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 1lxm n ASP 770 N 0.91 2.09 -4.05 1.20 3.85 -1.26 -4.95 116.55 114.35 1lxm n ASP 770 Ca 0.00 -1.55 -0.15 0.00 -0.71 0.00 0.00 54.79 52.39 1lxm n ASP 770 Cb 0.00 0.06 -0.12 0.00 -1.35 0.00 0.00 41.12 39.71 1lxm n ASP 770 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1lxm s LYS 771 N -1.25 0.56 -0.11 0.11 1.02 -1.10 -4.41 119.74 114.56 1lxm s LYS 771 Ca 0.16 -0.64 0.03 0.00 0.02 0.00 0.00 55.97 55.54 1lxm s LYS 771 Cb 0.12 -0.42 -0.00 0.00 -0.52 0.00 0.00 37.83 37.01 1lxm s LYS 771 CO 0.20 0.09 -0.22 0.42 -0.92 0.00 0.00 175.35 174.92 1lxm s ILE 772 N -1.03 2.26 -0.13 2.17 -1.09 -0.61 -0.07 121.20 122.69 1lxm s ILE 772 Ca -0.06 -0.94 -0.09 0.00 -2.23 0.00 0.00 60.65 57.33 1lxm s ILE 772 Cb -0.08 -1.88 -0.04 0.00 -1.58 0.00 0.00 42.46 38.87 1lxm s ILE 772 CO 0.00 0.55 0.18 -0.69 -1.23 0.00 0.00 174.94 173.75 1lxm s VAL 773 N 0.40 5.42 -0.23 2.92 1.01 0.20 -0.31 120.40 129.81 1lxm s VAL 773 Ca -0.16 0.30 -0.03 0.00 0.00 0.00 0.00 61.98 62.09 1lxm s VAL 773 Cb -0.17 -3.47 0.01 0.00 0.00 0.00 0.00 36.38 32.74 1lxm s VAL 773 CO 0.07 0.55 -0.06 -0.36 0.00 0.00 0.00 175.10 175.30 1lxm s PHE 774 N -0.54 2.97 -0.02 5.22 0.40 0.29 -1.15 117.98 125.15 1lxm s PHE 774 Ca 0.14 -1.22 0.08 0.00 -0.60 0.00 0.00 56.93 55.33 1lxm s PHE 774 Cb -0.12 -2.07 -0.02 0.00 0.51 0.00 0.00 43.02 41.32 1lxm s PHE 774 CO 0.03 -0.64 -0.25 -0.51 0.70 0.00 0.00 175.22 174.55 1lxm s LEU 775 N 1.41 2.05 -0.07 -0.37 1.02 0.11 -0.77 118.68 122.06 1lxm s LEU 775 Ca 0.04 -0.46 -0.03 0.00 0.02 0.00 0.00 54.13 53.70 1lxm s LEU 775 Cb -0.15 -1.30 0.04 0.00 0.02 0.00 0.00 46.19 44.80 1lxm s LEU 775 CO -0.05 0.30 0.15 -0.83 0.02 0.00 0.00 176.35 175.94 1lxm s GLY 776 N -0.53 -0.05 0.09 -3.19 0.00 0.19 -0.56 107.32 103.27 1lxm s GLY 776 Ca 0.08 0.66 -0.11 0.00 0.00 0.00 0.00 44.72 45.35 1lxm s GLY 776 CO -0.00 0.92 0.25 -1.35 0.00 0.00 0.00 173.10 172.92 1lxm s SER 777 N 1.03 0.01 -1.37 1.64 1.04 -0.20 0.22 113.70 116.08 1lxm s SER 777 Ca -0.08 -0.53 -0.08 0.00 0.48 0.00 0.00 55.95 55.74 1lxm s SER 777 Cb -0.10 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.41 1lxm s SER 777 CO -0.05 -0.75 1.12 -3.20 0.98 0.00 0.00 173.24 171.35 1lxm n ASN 778 N -0.03 -5.52 -4.55 7.02 2.85 -1.26 -0.86 115.26 112.90 1lxm n ASN 778 Ca -0.16 -0.59 -0.40 0.00 -0.11 0.00 0.00 54.58 53.32 1lxm n ASN 778 Cb 0.62 -4.85 -0.03 0.00 1.24 0.00 0.00 39.78 36.76 1lxm n ASN 778 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1lxm s ILE 779 N -3.33 3.69 -0.05 -1.44 1.01 -1.26 -3.98 121.20 115.83 1lxm s ILE 779 Ca 0.52 0.12 -0.02 0.00 0.00 0.00 0.00 60.65 61.26 1lxm s ILE 779 Cb -0.23 -4.74 -0.04 0.00 0.01 0.00 0.00 42.46 37.46 1lxm s ILE 779 CO 0.75 -1.68 0.08 -0.54 0.00 0.00 0.00 174.94 173.55 1lxm s LYS 780 N 5.87 3.14 -0.92 2.79 1.02 0.21 -4.95 119.74 126.91 1lxm s LYS 780 Ca 0.44 -0.38 -0.01 0.00 0.02 0.00 0.00 55.97 56.04 1lxm s LYS 780 Cb -0.07 -2.92 0.26 0.00 -0.52 0.00 0.00 37.83 34.58 1lxm s LYS 780 CO 0.10 0.69 1.04 -1.71 -0.92 0.00 0.00 175.35 174.56 1lxm n ASN 781 N 1.60 4.97 -4.50 2.83 2.85 -1.26 -0.01 115.26 121.74 1lxm n ASN 781 Ca -0.16 -3.30 -0.15 0.00 -0.11 0.00 0.00 54.58 50.87 1lxm n ASN 781 Cb 0.53 -1.06 -0.12 0.00 1.24 0.00 0.00 39.78 40.38 1lxm n ASN 781 CO 0.00 0.00 0.00 0.41 -2.11 0.00 0.00 177.26 175.56 1lxm n THR 782 N 1.64 0.00 0.00 -0.44 -1.04 -0.51 -3.44 114.28 110.49 1lxm n THR 782 Ca 0.25 -0.43 0.00 0.00 -2.04 0.00 0.00 64.05 61.83 1lxm n THR 782 Cb 0.37 -1.30 0.00 0.00 -1.82 0.00 0.00 70.33 67.58 1lxm n THR 782 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1lxm n ASN 783 N 14.26 0.00 -0.06 8.00 4.05 -1.26 -4.36 115.26 135.90 1lxm n ASN 783 Ca 0.48 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.51 1lxm n ASN 783 Cb 0.36 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.37 1lxm n ASN 783 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1lxm n GLY 784 N 0.47 0.00 3.71 8.20 0.00 -1.22 -4.71 105.19 111.63 1lxm n GLY 784 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1lxm n GLY 784 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1lxm s ILE 785 N -0.23 5.07 0.00 -0.61 -4.36 -1.26 -4.93 121.20 114.88 1lxm s ILE 785 Ca 0.00 1.30 0.00 0.00 -0.26 0.00 0.00 60.65 61.69 1lxm s ILE 785 Cb 0.00 -3.98 0.00 0.00 1.25 0.00 0.00 42.46 39.73 1lxm s ILE 785 CO 0.00 0.23 0.00 0.61 0.24 0.00 0.00 174.94 176.02 1lxm n GLY 786 N 3.28 1.25 3.20 6.27 0.00 -1.26 -5.00 105.19 112.92 1lxm n GLY 786 Ca -0.02 -1.93 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 1lxm n GLY 786 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1lxm s ASN 787 N -0.41 3.33 -0.07 1.61 0.01 -1.26 -5.00 114.94 113.14 1lxm s ASN 787 Ca 0.00 -0.56 -0.16 0.00 -0.71 0.00 0.00 52.86 51.43 1lxm s ASN 787 Cb 0.00 -1.50 -0.05 0.00 0.41 0.00 0.00 41.25 40.11 1lxm s ASN 787 CO 0.00 0.06 0.41 -0.69 -1.51 0.00 0.00 177.10 175.37 1lxm s VAL 788 N 0.92 5.14 0.10 1.60 1.01 -1.26 -2.74 120.40 125.17 1lxm s VAL 788 Ca -0.04 0.82 -0.08 0.00 0.00 0.00 0.00 61.98 62.68 1lxm s VAL 788 Cb -0.15 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.50 1lxm s VAL 788 CO -0.03 0.46 0.19 -0.94 0.00 0.00 0.00 175.10 174.78 1lxm s SER 789 N -0.22 0.13 -0.04 3.32 1.04 -0.57 -1.10 113.70 116.25 1lxm s SER 789 Ca 0.23 -0.73 0.06 0.00 0.48 0.00 0.00 55.95 55.99 1lxm s SER 789 Cb -0.15 0.35 -0.01 0.00 0.10 0.00 0.00 66.02 66.30 1lxm s SER 789 CO 0.10 -0.75 -0.23 -0.89 0.98 0.00 0.00 173.24 172.45 1lxm s THR 790 N -3.89 1.84 -0.43 2.02 2.01 -0.35 -1.53 115.64 115.31 1lxm s THR 790 Ca 0.08 -0.96 -0.23 0.00 0.31 0.00 0.00 61.69 60.89 1lxm s THR 790 Cb 0.05 -1.56 0.02 0.00 0.01 0.00 0.00 72.50 71.02 1lxm s THR 790 CO -0.08 0.52 0.76 -0.89 -0.69 0.00 0.00 174.62 174.23 1lxm s THR 791 N -0.20 4.69 0.03 -0.82 2.01 -0.41 -0.33 115.64 120.60 1lxm s THR 791 Ca -0.01 0.44 -0.22 0.00 0.31 0.00 0.00 61.69 62.21 1lxm s THR 791 Cb -0.12 -4.28 -0.16 0.00 0.01 0.00 0.00 72.50 67.95 1lxm s THR 791 CO 0.02 -0.65 1.36 0.40 -0.69 0.00 0.00 174.62 175.06 1lxm h ILE 792 N 5.93 1.33 -1.63 1.82 5.03 -1.22 0.62 117.51 129.39 1lxm h ILE 792 Ca -0.25 -1.12 0.06 0.00 -0.12 0.00 0.00 64.86 63.42 1lxm h ILE 792 Cb 1.09 1.86 -0.24 0.00 -3.03 0.00 0.00 36.82 36.50 1lxm h ILE 792 CO 0.94 0.32 0.46 -0.62 -0.68 0.00 0.00 178.15 178.57 1lxm s ASP 793 N -5.90 -0.44 -0.38 1.72 -1.08 -0.98 -4.17 116.67 105.44 1lxm s ASP 793 Ca -0.15 0.67 0.01 0.00 -0.52 0.00 0.00 52.55 52.56 1lxm s ASP 793 Cb 0.04 0.61 0.12 0.00 -1.46 0.00 0.00 42.92 42.23 1lxm s ASP 793 CO 0.72 -0.28 0.16 -1.58 0.52 0.00 0.00 175.17 174.71 1lxm s GLN 794 N -0.49 1.14 -0.21 4.34 0.74 -1.26 -0.68 119.66 123.24 1lxm s GLN 794 Ca -0.00 -1.68 -0.04 0.00 0.05 0.00 0.00 55.36 53.68 1lxm s GLN 794 Cb -0.03 -2.37 -0.02 0.00 1.10 0.00 0.00 33.01 31.70 1lxm s GLN 794 CO -0.01 -1.07 -0.02 0.50 -0.55 0.00 0.00 175.29 174.14 1lxm s ARG 795 N 0.85 3.50 0.02 1.67 6.06 -0.59 -4.87 118.95 125.60 1lxm s ARG 795 Ca 0.14 -0.57 -0.30 0.00 -2.50 0.00 0.00 55.73 52.50 1lxm s ARG 795 Cb -0.21 -3.05 -0.08 0.00 0.06 0.00 0.00 34.95 31.68 1lxm s ARG 795 CO -0.10 -0.09 1.74 0.21 -2.50 0.00 0.00 175.30 174.57 1lxm s LYS 796 N 1.23 4.17 0.92 5.12 2.20 -1.26 -0.96 119.74 131.16 1lxm s LYS 796 Ca 0.03 2.37 -0.13 0.00 -0.36 0.00 0.00 55.97 57.89 1lxm s LYS 796 Cb -0.14 -3.87 0.14 0.00 -1.51 0.00 0.00 37.83 32.44 1lxm s LYS 796 CO 0.00 -0.84 1.14 0.34 -0.36 0.00 0.00 175.35 175.64 1lxm s ASP 797 N 3.26 3.44 -0.15 1.43 -1.08 0.20 -4.92 116.67 118.84 1lxm s ASP 797 Ca 0.78 0.92 -0.07 0.00 -0.52 0.00 0.00 52.55 53.66 1lxm s ASP 797 Cb -0.39 -1.46 -0.04 0.00 -1.46 0.00 0.00 42.92 39.57 1lxm s ASP 797 CO 0.34 -2.59 0.10 -0.62 0.52 0.00 0.00 175.17 172.92 1lxm s ASP 798 N -4.07 5.97 0.04 -0.34 3.68 -1.26 -4.70 116.67 115.99 1lxm s ASP 798 Ca 0.64 0.25 -0.28 0.00 2.13 0.00 0.00 52.55 55.30 1lxm s ASP 798 Cb -0.14 -1.97 -0.17 0.00 -1.45 0.00 0.00 42.92 39.19 1lxm s ASP 798 CO 0.53 0.28 1.40 0.28 0.13 0.00 0.00 175.17 177.79 1lxm h SER 799 N 5.94 -0.50 0.00 -0.34 0.02 -1.97 -3.19 113.55 113.52 1lxm h SER 799 Ca -0.45 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.42 1lxm h SER 799 Cb 1.19 0.13 0.00 0.00 0.14 0.00 0.00 62.40 63.85 1lxm h SER 799 CO 0.66 -0.22 0.00 1.17 -1.14 0.00 0.00 176.83 177.30 1lxm n LYS 800 N -5.27 0.00 -3.55 3.45 4.81 -1.26 -4.47 118.16 111.87 1lxm n LYS 800 Ca -0.11 0.06 -0.40 0.00 -0.87 0.00 0.00 58.31 56.99 1lxm n LYS 800 Cb 0.29 -1.03 -0.05 0.00 0.02 0.00 0.00 35.03 34.26 1lxm n LYS 800 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1lxm s THR 801 N -1.10 4.70 0.79 3.15 2.01 -1.26 -5.08 115.64 118.85 1lxm s THR 801 Ca 0.00 -3.19 -0.15 0.00 0.31 0.00 0.00 61.69 58.66 1lxm s THR 801 Cb 0.00 -3.93 0.02 0.00 0.01 0.00 0.00 72.50 68.60 1lxm s THR 801 CO 0.00 -1.02 0.85 -0.81 -0.69 0.00 0.00 174.62 172.95 1lxm n PRO 802 N 3.13 0.22 -1.97 4.92 -0.04 -1.20 -4.60 135.00 135.46 1lxm n PRO 802 Ca 0.16 0.13 -0.32 0.00 -0.04 0.00 0.00 63.50 63.44 1lxm n PRO 802 Cb 0.40 -2.14 0.01 0.00 -0.04 0.00 0.00 33.50 31.73 1lxm n PRO 802 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1lxm s TYR 803 N -2.03 3.39 -0.26 0.54 2.02 -1.26 -4.53 117.35 115.21 1lxm s TYR 803 Ca 0.69 1.39 0.02 0.00 -0.37 0.00 0.00 57.07 58.81 1lxm s TYR 803 Cb -0.31 -2.81 0.06 0.00 -0.40 0.00 0.00 41.96 38.50 1lxm s TYR 803 CO 0.55 -0.78 -0.09 0.99 -1.57 0.00 0.00 175.55 174.65 1lxm s THR 804 N -2.91 2.02 -0.18 -0.71 2.01 0.18 -4.92 115.64 111.13 1lxm s THR 804 Ca 0.58 -1.55 -0.23 0.00 0.31 0.00 0.00 61.69 60.79 1lxm s THR 804 Cb -0.12 -2.17 -0.02 0.00 0.01 0.00 0.00 72.50 70.20 1lxm s THR 804 CO 0.46 -0.06 0.73 0.28 -0.69 0.00 0.00 174.62 175.34 1lxm s THR 805 N 1.17 4.95 -0.05 -0.82 -1.32 -1.26 -1.37 115.64 116.93 1lxm s THR 805 Ca -0.08 1.41 0.02 0.00 -1.21 0.00 0.00 61.69 61.84 1lxm s THR 805 Cb -0.20 -4.04 -0.03 0.00 -1.51 0.00 0.00 72.50 66.72 1lxm s THR 805 CO -0.05 0.07 -0.11 -0.31 -2.21 0.00 0.00 174.62 172.01 1lxm s TYR 806 N 2.01 2.82 -0.08 9.09 1.51 0.86 -1.83 117.35 131.72 1lxm s TYR 806 Ca 0.34 -0.07 0.02 0.00 -1.01 0.00 0.00 57.07 56.35 1lxm s TYR 806 Cb -0.16 -1.66 0.01 0.00 -0.11 0.00 0.00 41.96 40.04 1lxm s TYR 806 CO 0.11 0.27 -0.14 0.54 -1.11 0.00 0.00 175.55 175.22 1lxm s VAL 807 N -0.79 1.35 -1.78 0.71 0.11 0.37 -0.62 120.40 119.75 1lxm s VAL 807 Ca 0.12 -0.59 -0.21 0.00 -2.93 0.00 0.00 61.98 58.38 1lxm s VAL 807 Cb -0.11 -1.23 0.19 0.00 -1.53 0.00 0.00 36.38 33.71 1lxm s VAL 807 CO 0.01 0.41 0.69 0.59 -3.33 0.00 0.00 175.10 173.47 1lxm n ASN 808 N 3.92 -2.58 0.00 3.54 4.13 -0.22 -1.52 115.26 122.53 1lxm n ASN 808 Ca -0.21 -1.12 0.00 0.00 1.68 0.00 0.00 54.58 54.93 1lxm n ASN 808 Cb 0.52 -2.24 0.00 0.00 -1.54 0.00 0.00 39.78 36.52 1lxm n ASN 808 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1lxm n GLY 809 N -1.27 2.94 3.95 7.41 0.00 -1.26 -4.98 105.19 111.98 1lxm n GLY 809 Ca 0.09 -0.79 -0.27 0.00 0.00 0.00 0.00 46.02 45.05 1lxm n GLY 809 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lxm s LYS 810 N 0.00 1.46 0.12 1.61 3.01 -0.57 -5.01 119.74 120.35 1lxm s LYS 810 Ca 0.00 -0.55 -0.03 0.00 -1.01 0.00 0.00 55.97 54.38 1lxm s LYS 810 Cb 0.00 -2.09 -0.05 0.00 -1.01 0.00 0.00 37.83 34.68 1lxm s LYS 810 CO 0.00 -1.75 0.33 0.99 0.51 0.00 0.00 175.35 175.43 1lxm s THR 811 N -3.47 5.24 0.22 2.17 2.01 -1.26 -0.48 115.64 120.07 1lxm s THR 811 Ca 0.67 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 62.55 1lxm s THR 811 Cb -0.07 -3.63 -0.00 0.00 0.01 0.00 0.00 72.50 68.81 1lxm s THR 811 CO 0.48 0.05 0.03 2.30 -0.69 0.00 0.00 174.62 176.80 1lxm n ILE 812 N 0.10 0.00 0.00 1.82 -5.35 -0.76 -4.83 119.36 110.34 1lxm n ILE 812 Ca -0.03 -1.14 0.00 0.00 -0.27 0.00 0.00 62.75 61.30 1lxm n ILE 812 Cb 0.52 0.31 0.00 0.00 -1.74 0.00 0.00 39.64 38.73 1lxm n ILE 812 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 1lxm n SER 819 N -1.45 0.00 0.00 7.28 7.64 -1.26 -5.02 113.62 120.80 1lxm n SER 819 Ca -0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.81 1lxm n SER 819 Cb 0.30 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 1lxm n SER 819 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1lxm n GLN 820 N 0.00 3.24 -3.70 1.43 1.13 -1.26 -4.77 117.38 113.46 1lxm n GLN 820 Ca 0.00 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.93 1lxm n GLN 820 Cb 0.00 -0.54 -0.13 0.00 0.11 0.00 0.00 30.24 29.67 1lxm n GLN 820 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 1lxm s GLN 821 N -0.86 0.17 -0.15 -1.09 0.74 -1.26 -1.00 119.66 116.21 1lxm s GLN 821 Ca 0.00 0.61 0.01 0.00 0.05 0.00 0.00 55.36 56.03 1lxm s GLN 821 Cb 0.00 -0.10 0.01 0.00 1.10 0.00 0.00 33.01 34.02 1lxm s GLN 821 CO 0.00 -0.22 -0.19 -0.06 -0.55 0.00 0.00 175.29 174.27 1lxm s PHE 822 N 1.76 2.73 0.20 1.67 0.08 0.10 -4.99 117.98 119.54 1lxm s PHE 822 Ca -0.05 -1.25 -0.13 0.00 0.12 0.00 0.00 56.93 55.62 1lxm s PHE 822 Cb -0.11 -1.86 -0.07 0.00 -0.57 0.00 0.00 43.02 40.40 1lxm s PHE 822 CO -0.08 -0.58 0.58 0.95 -0.10 0.00 0.00 175.22 175.99 1lxm s THR 823 N 0.88 4.84 -1.10 0.64 -4.23 -1.26 -0.89 115.64 114.52 1lxm s THR 823 Ca -0.05 0.76 -0.18 0.00 -1.18 0.00 0.00 61.69 61.05 1lxm s THR 823 Cb -0.15 -3.69 -0.02 0.00 1.34 0.00 0.00 72.50 69.98 1lxm s THR 823 CO -0.02 0.10 0.81 0.47 -0.54 0.00 0.00 174.62 175.43 1lxm n ASP 824 N 0.37 -5.61 -4.80 3.99 10.43 -1.06 -4.92 116.55 114.95 1lxm n ASP 824 Ca -0.02 -0.94 -0.38 0.00 2.57 0.00 0.00 54.79 56.01 1lxm n ASP 824 Cb 0.52 -3.66 -0.06 0.00 1.84 0.00 0.00 41.12 39.76 1lxm n ASP 824 CO 0.00 0.00 0.00 -0.89 -1.07 0.00 0.00 177.20 175.24 1lxm s THR 825 N -3.43 4.97 -0.27 -3.53 2.01 0.52 -4.69 115.64 111.22 1lxm s THR 825 Ca 0.45 0.98 -0.10 0.00 0.31 0.00 0.00 61.69 63.34 1lxm s THR 825 Cb -0.15 -3.79 -0.13 0.00 0.01 0.00 0.00 72.50 68.44 1lxm s THR 825 CO 0.84 0.52 -0.33 0.29 -0.69 0.00 0.00 174.62 175.25 1lxm n LYS 826 N 2.18 0.61 -4.12 4.92 5.02 -1.26 -2.35 118.16 123.15 1lxm n LYS 826 Ca -0.11 0.23 -0.08 0.00 -2.02 0.00 0.00 58.31 56.32 1lxm n LYS 826 Cb 0.52 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.93 1lxm n LYS 826 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1lxm s SER 827 N -7.25 0.59 -0.02 4.39 1.04 -1.26 -1.12 113.70 110.08 1lxm s SER 827 Ca -0.38 -1.05 0.00 0.00 0.48 0.00 0.00 55.95 55.01 1lxm s SER 827 Cb 0.13 0.20 0.02 0.00 0.10 0.00 0.00 66.02 66.47 1lxm s SER 827 CO 0.52 -0.60 0.01 -0.69 0.98 0.00 0.00 173.24 173.46 1lxm s VAL 828 N -3.89 0.07 -0.04 5.02 1.01 0.65 -1.06 120.40 122.17 1lxm s VAL 828 Ca 0.12 0.10 -0.01 0.00 0.00 0.00 0.00 61.98 62.19 1lxm s VAL 828 Cb 0.07 -0.15 0.03 0.00 0.00 0.00 0.00 36.38 36.33 1lxm s VAL 828 CO -0.06 0.09 0.03 0.12 0.00 0.00 0.00 175.10 175.29 1lxm s PHE 829 N 0.78 0.16 -0.40 5.22 5.36 0.20 0.44 117.98 129.75 1lxm s PHE 829 Ca -0.07 0.13 -0.12 0.00 -0.96 0.00 0.00 56.93 55.91 1lxm s PHE 829 Cb -0.10 -0.43 0.03 0.00 -0.34 0.00 0.00 43.02 42.18 1lxm s PHE 829 CO -0.02 -0.16 0.25 -0.51 -1.46 0.00 0.00 175.22 173.32 1lxm s LEU 830 N 1.63 4.94 -0.14 6.12 1.43 0.14 -0.10 118.68 132.71 1lxm s LEU 830 Ca -0.02 -1.03 -0.00 0.00 -1.03 0.00 0.00 54.13 52.05 1lxm s LEU 830 Cb -0.13 -2.07 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 1lxm s LEU 830 CO -0.03 -0.44 -0.13 -0.70 0.23 0.00 0.00 176.35 175.28 1lxm s GLU 831 N 1.59 3.37 0.22 1.70 2.12 -0.47 -2.14 118.70 125.09 1lxm s GLU 831 Ca 0.03 -0.69 0.12 0.00 0.36 0.00 0.00 54.97 54.79 1lxm s GLU 831 Cb -0.20 -2.65 -0.05 0.00 0.26 0.00 0.00 34.13 31.50 1lxm s GLU 831 CO 0.07 0.18 -0.23 0.45 -0.54 0.00 0.00 175.26 175.20 1lxm s SER 832 N 0.44 3.48 0.49 -1.70 0.15 -1.26 0.48 113.70 115.78 1lxm s SER 832 Ca -0.10 -0.92 0.29 0.00 0.70 0.00 0.00 55.95 55.92 1lxm s SER 832 Cb -0.16 -0.27 0.88 0.00 -1.71 0.00 0.00 66.02 64.77 1lxm s SER 832 CO 0.05 0.10 1.81 0.11 1.20 0.00 0.00 173.24 176.50 1lxm h LYS 833 N 2.91 0.00 -6.20 5.44 1.79 -1.83 -3.43 116.57 115.25 1lxm h LYS 833 Ca -0.44 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.46 1lxm h LYS 833 Cb 1.22 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.83 1lxm h LYS 833 CO 0.52 0.00 0.68 -1.21 -1.08 0.00 0.00 179.45 178.36 1lxm s GLU 834 N -3.44 4.35 0.78 3.15 0.41 -1.26 -5.01 118.70 117.67 1lxm s GLU 834 Ca 0.04 1.44 -0.15 0.00 -0.41 0.00 0.00 54.97 55.89 1lxm s GLU 834 Cb 0.07 -3.59 0.02 0.00 -1.78 0.00 0.00 34.13 28.85 1lxm s GLU 834 CO 0.60 -0.46 0.86 -2.30 -0.49 0.00 0.00 175.26 173.47 1lxm n PRO 835 N 5.55 0.25 -2.82 0.39 -0.02 -1.26 -3.22 135.00 133.88 1lxm n PRO 835 Ca 0.10 0.14 -0.22 0.00 -2.02 0.00 0.00 63.50 61.51 1lxm n PRO 835 Cb 0.47 -2.14 0.02 0.00 -0.02 0.00 0.00 33.50 31.83 1lxm n PRO 835 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lxm n GLY 836 N 1.12 -0.52 0.00 -1.23 0.00 -1.26 -4.74 105.19 98.56 1lxm n GLY 836 Ca 0.12 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1lxm n GLY 836 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lxm n ARG 837 N -3.72 0.57 -2.43 1.61 3.00 -1.20 -1.45 116.66 113.05 1lxm n ARG 837 Ca -0.16 -0.22 -0.37 0.00 -0.01 0.00 0.00 57.85 57.09 1lxm n ARG 837 Cb 0.64 -0.67 -0.03 0.00 0.00 0.00 0.00 32.46 32.40 1lxm n ARG 837 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.63 176.83 1lxm s ASN 838 N -0.15 6.60 -0.08 0.55 -0.87 -1.26 -4.73 114.94 115.01 1lxm s ASN 838 Ca 0.00 2.16 -0.03 0.00 -1.57 0.00 0.00 52.86 53.42 1lxm s ASN 838 Cb 0.00 -2.60 0.04 0.00 -0.02 0.00 0.00 41.25 38.68 1lxm s ASN 838 CO 0.00 -0.61 0.17 -0.63 -2.57 0.00 0.00 177.10 173.46 1lxm s ILE 839 N -1.57 -0.13 0.07 0.60 1.01 -0.91 0.01 121.20 120.30 1lxm s ILE 839 Ca 0.58 0.23 0.08 0.00 0.00 0.00 0.00 60.65 61.55 1lxm s ILE 839 Cb -0.25 -0.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.90 1lxm s ILE 839 CO 0.32 0.10 -0.22 -0.83 0.00 0.00 0.00 174.94 174.30 1lxm s GLY 840 N 1.56 1.23 -0.04 6.18 0.00 -0.40 -0.68 107.32 115.17 1lxm s GLY 840 Ca -0.05 -1.18 0.04 0.00 0.00 0.00 0.00 44.72 43.52 1lxm s GLY 840 CO -0.06 -1.14 -0.15 -0.19 0.00 0.00 0.00 173.10 171.56 1lxm s TYR 841 N -0.96 1.49 -0.07 1.90 1.51 0.17 -0.54 117.35 120.86 1lxm s TYR 841 Ca 0.08 -0.43 0.02 0.00 -1.01 0.00 0.00 57.07 55.74 1lxm s TYR 841 Cb -0.09 -1.02 0.01 0.00 -0.11 0.00 0.00 41.96 40.75 1lxm s TYR 841 CO 0.03 -0.16 -0.12 0.42 -1.11 0.00 0.00 175.55 174.61 1lxm s ILE 842 N 0.13 1.16 -0.15 2.71 1.01 -0.10 -0.25 121.20 125.70 1lxm s ILE 842 Ca -0.04 -0.49 -0.07 0.00 0.00 0.00 0.00 60.65 60.04 1lxm s ILE 842 Cb -0.11 -1.06 -0.04 0.00 0.01 0.00 0.00 42.46 41.26 1lxm s ILE 842 CO 0.02 0.36 0.10 -0.36 0.00 0.00 0.00 174.94 175.06 1lxm s PHE 843 N 0.68 3.40 0.44 3.97 0.40 -0.27 0.33 117.98 126.94 1lxm s PHE 843 Ca -0.14 0.31 0.16 0.00 -0.60 0.00 0.00 56.93 56.66 1lxm s PHE 843 Cb -0.16 -2.02 1.05 0.00 0.51 0.00 0.00 43.02 42.41 1lxm s PHE 843 CO 0.04 0.42 2.00 0.74 0.70 0.00 0.00 175.22 179.12 1lxm h PHE 844 N 5.93 0.00 -3.93 0.36 0.04 -1.78 -3.42 116.94 114.15 1lxm h PHE 844 Ca -0.46 0.00 -0.46 0.00 2.80 0.00 0.00 57.97 59.85 1lxm h PHE 844 Cb 1.19 0.00 -0.30 0.00 2.20 0.00 0.00 35.95 39.03 1lxm h PHE 844 CO 0.64 0.18 -0.80 0.15 -0.60 0.00 0.00 178.31 177.88 1lxm s LYS 845 N -4.58 1.13 0.24 1.51 -0.14 -1.26 -5.04 119.74 111.60 1lxm s LYS 845 Ca -0.04 -0.40 -0.31 0.00 -1.36 0.00 0.00 55.97 53.86 1lxm s LYS 845 Cb 0.15 -1.05 -0.14 0.00 -1.68 0.00 0.00 37.83 35.12 1lxm s LYS 845 CO 0.68 0.18 1.33 0.09 -0.76 0.00 0.00 175.35 176.88 1lxm n ASN 846 N 3.12 2.42 -4.05 2.83 3.02 -1.26 -4.93 115.26 116.41 1lxm n ASN 846 Ca -0.17 1.15 -0.10 0.00 -0.03 0.00 0.00 54.58 55.43 1lxm n ASN 846 Cb 0.54 -1.39 -0.08 0.00 -0.61 0.00 0.00 39.78 38.25 1lxm n ASN 846 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1lxm s SER 847 N 0.14 0.08 -0.48 6.41 1.04 -0.99 -4.77 113.70 115.13 1lxm s SER 847 Ca 0.67 -1.05 -0.23 0.00 0.48 0.00 0.00 55.95 55.82 1lxm s SER 847 Cb -0.68 0.44 0.03 0.00 0.10 0.00 0.00 66.02 65.91 1lxm s SER 847 CO 0.52 -0.91 0.79 -0.89 0.98 0.00 0.00 173.24 173.72 1lxm s THR 848 N -4.04 4.64 -0.04 2.02 2.01 -1.26 -0.36 115.64 118.61 1lxm s THR 848 Ca 0.24 0.24 0.02 0.00 0.31 0.00 0.00 61.69 62.50 1lxm s THR 848 Cb 0.04 -4.36 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 1lxm s THR 848 CO 0.05 -0.81 -0.06 -0.63 -0.69 0.00 0.00 174.62 172.48 1lxm s ILE 849 N 3.31 3.73 -0.12 1.82 -1.09 -0.07 -4.33 121.20 124.44 1lxm s ILE 849 Ca 0.27 -0.57 -0.08 0.00 -2.23 0.00 0.00 60.65 58.04 1lxm s ILE 849 Cb -0.13 -2.56 -0.04 0.00 -1.58 0.00 0.00 42.46 38.14 1lxm s ILE 849 CO 0.20 0.53 0.17 -1.81 -1.23 0.00 0.00 174.94 172.79 1lxm s ASP 850 N -1.04 6.40 -0.13 3.58 1.01 0.81 0.03 116.67 127.33 1lxm s ASP 850 Ca 0.14 0.47 -0.02 0.00 0.71 0.00 0.00 52.55 53.86 1lxm s ASP 850 Cb -0.11 -2.09 0.04 0.00 1.01 0.00 0.00 42.92 41.77 1lxm s ASP 850 CO 0.04 0.35 -0.00 -0.63 0.21 0.00 0.00 175.17 175.14 1lxm s ILE 851 N -0.74 0.58 -0.01 0.77 1.01 -0.17 -0.86 121.20 121.78 1lxm s ILE 851 Ca 0.15 -0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.62 1lxm s ILE 851 Cb -0.12 -0.84 -0.02 0.00 0.01 0.00 0.00 42.46 41.49 1lxm s ILE 851 CO 0.04 0.10 -0.20 -0.70 0.00 0.00 0.00 174.94 174.18 1lxm s GLU 852 N 1.87 1.57 -0.06 2.79 2.12 0.62 -4.00 118.70 123.61 1lxm s GLU 852 Ca 0.03 -0.71 0.01 0.00 0.36 0.00 0.00 54.97 54.65 1lxm s GLU 852 Cb -0.14 -1.53 0.02 0.00 0.26 0.00 0.00 34.13 32.74 1lxm s GLU 852 CO -0.07 0.42 -0.06 0.50 -0.54 0.00 0.00 175.26 175.51 1lxm s ARG 853 N -0.51 1.05 -0.12 4.30 3.00 -1.26 0.97 118.95 126.39 1lxm s ARG 853 Ca 0.07 -0.15 -0.31 0.00 -1.00 0.00 0.00 55.73 54.34 1lxm s ARG 853 Cb -0.08 -1.05 0.12 0.00 0.00 0.00 0.00 34.95 33.95 1lxm s ARG 853 CO -0.01 -0.11 1.03 -1.59 0.00 0.00 0.00 175.30 174.62 1lxm s LYS 854 N 1.09 0.58 -0.33 5.12 -2.85 -0.95 -4.99 119.74 117.41 1lxm s LYS 854 Ca -0.08 -0.09 -0.29 0.00 -1.00 0.00 0.00 55.97 54.52 1lxm s LYS 854 Cb -0.14 0.27 0.02 0.00 -2.06 0.00 0.00 37.83 35.92 1lxm s LYS 854 CO -0.01 -0.23 1.07 -2.00 0.10 0.00 0.00 175.35 174.28 1lxm s GLU 855 N -2.15 4.04 -0.13 1.78 2.56 -1.26 -1.59 118.70 121.95 1lxm s GLU 855 Ca 0.04 1.02 -0.07 0.00 0.00 0.00 0.00 54.97 55.96 1lxm s GLU 855 Cb -0.01 -3.75 -0.04 0.00 2.00 0.00 0.00 34.13 32.33 1lxm s GLU 855 CO -0.04 -0.93 0.12 -0.65 -0.56 0.00 0.00 175.26 173.20 1lxm s GLN 856 N 3.68 3.49 0.34 4.30 -0.21 0.62 -4.85 119.66 127.03 1lxm s GLN 856 Ca 0.45 -0.18 0.10 0.00 0.02 0.00 0.00 55.36 55.75 1lxm s GLN 856 Cb -0.12 -3.17 -0.06 0.00 1.00 0.00 0.00 33.01 30.66 1lxm s GLN 856 CO 0.16 0.70 -0.08 0.99 -2.12 0.00 0.00 175.29 174.94 1lxm s THR 857 N -0.82 2.36 -0.03 -0.19 2.01 -1.26 0.44 115.64 118.16 1lxm s THR 857 Ca 0.14 -2.18 -0.15 0.00 0.31 0.00 0.00 61.69 59.81 1lxm s THR 857 Cb -0.12 -2.64 0.05 0.00 0.01 0.00 0.00 72.50 69.80 1lxm s THR 857 CO 0.03 -0.23 0.66 0.61 -0.69 0.00 0.00 174.62 175.00 1lxm n GLY 858 N -0.81 0.35 2.99 4.40 0.00 0.18 -4.69 105.19 107.61 1lxm n GLY 858 Ca -0.05 -0.93 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 1lxm n GLY 858 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lxm s THR 859 N -2.05 0.08 0.33 2.61 -4.23 -1.26 -0.50 115.64 110.62 1lxm s THR 859 Ca 0.16 -0.66 0.02 0.00 -1.18 0.00 0.00 61.69 60.02 1lxm s THR 859 Cb -0.00 -0.24 0.22 0.00 1.34 0.00 0.00 72.50 73.82 1lxm s THR 859 CO -0.01 -0.36 1.95 -0.50 -0.54 0.00 0.00 174.62 175.16 1lxm h TRP 860 N 4.92 0.78 0.00 3.99 4.06 -1.75 -1.48 115.95 126.47 1lxm h TRP 860 Ca -0.30 -0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.61 1lxm h TRP 860 Cb 1.21 -0.25 -0.00 0.00 -1.00 0.00 0.00 29.16 29.11 1lxm h TRP 860 CO 0.59 0.56 -0.10 -0.97 -3.56 0.00 0.00 178.44 174.97 1lxm h ASN 861 N 0.80 0.00 -0.26 -3.49 -1.24 -1.42 0.24 115.58 110.22 1lxm h ASN 861 Ca 0.20 0.00 -0.05 0.00 0.71 0.00 0.00 56.30 57.16 1lxm h ASN 861 Cb 0.05 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.09 1lxm h ASN 861 CO -0.03 0.10 -0.03 0.77 -1.29 0.00 0.00 177.43 176.94 1lxm h SER 862 N 0.00 0.48 0.82 1.15 4.64 -1.55 -2.67 113.55 116.41 1lxm h SER 862 Ca -0.00 -0.34 0.00 0.00 -0.47 0.00 0.00 61.79 60.98 1lxm h SER 862 Cb 0.32 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1lxm h SER 862 CO 0.01 0.70 -0.46 2.30 -0.87 0.00 0.00 176.83 178.52 1lxm n ILE 863 N -4.58 0.22 -3.47 0.95 -5.35 -0.94 -4.66 119.36 101.54 1lxm n ILE 863 Ca -0.03 -0.16 -0.23 0.00 -0.27 0.00 0.00 62.75 62.06 1lxm n ILE 863 Cb 0.28 -0.09 -0.12 0.00 -1.74 0.00 0.00 39.64 37.96 1lxm n ILE 863 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1lxm s ASN 864 N -3.72 2.63 0.00 7.28 3.84 0.81 -2.00 114.94 123.77 1lxm s ASN 864 Ca 0.09 -1.06 0.05 0.00 0.21 0.00 0.00 52.86 52.16 1lxm s ASN 864 Cb 0.15 0.06 0.22 0.00 -0.55 0.00 0.00 41.25 41.14 1lxm s ASN 864 CO 0.68 -0.41 1.14 0.54 -2.79 0.00 0.00 177.10 176.26 1lxm n ARG 865 N 5.25 0.01 -0.25 0.43 5.12 -0.50 -1.55 116.66 125.17 1lxm n ARG 865 Ca -0.04 0.39 0.10 0.00 -1.93 0.00 0.00 57.85 56.37 1lxm n ARG 865 Cb 0.44 -1.50 0.26 0.00 -1.16 0.00 0.00 32.46 30.50 1lxm n ARG 865 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1lxm n THR 866 N -1.47 0.67 -3.72 0.55 -1.04 -1.26 -4.90 114.28 103.11 1lxm n THR 866 Ca 0.01 -0.72 -0.35 0.00 -2.04 0.00 0.00 64.05 60.95 1lxm n THR 866 Cb 0.06 0.49 -0.08 0.00 -1.82 0.00 0.00 70.33 68.97 1lxm n THR 866 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1lxm s SER 867 N -1.14 6.19 -0.08 8.00 0.15 -0.60 -4.97 113.70 121.25 1lxm s SER 867 Ca 0.38 0.21 0.02 0.00 0.70 0.00 0.00 55.95 57.25 1lxm s SER 867 Cb 0.20 -2.09 0.16 0.00 -1.71 0.00 0.00 66.02 62.58 1lxm s SER 867 CO 0.27 0.16 1.02 0.29 1.20 0.00 0.00 173.24 176.18 1lxm n LYS 868 N 3.68 1.51 -3.99 5.44 5.02 -1.26 -4.55 118.16 124.02 1lxm n LYS 868 Ca -0.16 -0.67 -0.31 0.00 -2.02 0.00 0.00 58.31 55.16 1lxm n LYS 868 Cb 0.52 -1.43 -0.15 0.00 -0.02 0.00 0.00 35.03 33.96 1lxm n LYS 868 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1lxm s ASN 869 N 0.22 4.63 -0.20 4.39 2.47 -1.26 -4.89 114.94 120.30 1lxm s ASN 869 Ca 0.12 -2.45 0.15 0.00 0.42 0.00 0.00 52.86 51.10 1lxm s ASN 869 Cb 0.10 -1.64 0.70 0.00 -1.45 0.00 0.00 41.25 38.96 1lxm s ASN 869 CO 0.03 -0.33 1.62 0.35 -3.72 0.00 0.00 177.10 175.04 1lxm n THR 870 N 3.86 2.49 -1.87 -5.21 -2.24 -1.26 -1.68 114.28 108.37 1lxm n THR 870 Ca 0.04 -1.55 -0.42 0.00 -2.27 0.00 0.00 64.05 59.85 1lxm n THR 870 Cb 0.39 -0.22 -0.03 0.00 -2.10 0.00 0.00 70.33 68.37 1lxm n THR 870 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1lxm s SER 871 N -1.21 6.51 -0.84 3.42 0.01 -1.26 -4.88 113.70 115.44 1lxm s SER 871 Ca 0.49 2.73 -0.24 0.00 1.31 0.00 0.00 55.95 60.24 1lxm s SER 871 Cb 0.38 -2.60 0.06 0.00 0.21 0.00 0.00 66.02 64.06 1lxm s SER 871 CO 0.14 -0.86 1.26 -0.63 0.41 0.00 0.00 173.24 173.56 1lxm s ILE 872 N 0.88 4.02 0.08 1.44 1.01 -1.26 -4.34 121.20 123.03 1lxm s ILE 872 Ca 0.69 -0.36 -0.12 0.00 0.00 0.00 0.00 60.65 60.86 1lxm s ILE 872 Cb -0.46 -4.91 -0.06 0.00 0.01 0.00 0.00 42.46 37.04 1lxm s ILE 872 CO 0.35 -1.77 0.44 0.68 0.00 0.00 0.00 174.94 174.63 1lxm s VAL 873 N 4.82 5.02 0.19 2.92 -7.23 0.34 -4.86 120.40 121.60 1lxm s VAL 873 Ca 0.36 0.62 0.09 0.00 -1.81 0.00 0.00 61.98 61.24 1lxm s VAL 873 Cb -0.06 -3.68 -0.04 0.00 0.56 0.00 0.00 36.38 33.15 1lxm s VAL 873 CO 0.03 0.32 -0.19 -0.55 -0.31 0.00 0.00 175.10 174.40 1lxm s SER 874 N -1.64 2.93 -0.21 4.85 0.15 -1.26 -0.65 113.70 117.87 1lxm s SER 874 Ca 0.33 -0.91 -0.12 0.00 0.70 0.00 0.00 55.95 55.95 1lxm s SER 874 Cb -0.15 -0.19 0.07 0.00 -1.71 0.00 0.00 66.02 64.04 1lxm s SER 874 CO 0.18 -0.01 0.51 0.20 1.20 0.00 0.00 173.24 175.32 1lxm s ASN 875 N -2.87 -0.67 0.07 5.45 0.02 0.17 -4.95 114.94 112.16 1lxm s ASN 875 Ca 0.20 1.12 -0.30 0.00 -1.02 0.00 0.00 52.86 52.85 1lxm s ASN 875 Cb -0.05 1.00 -0.05 0.00 0.02 0.00 0.00 41.25 42.17 1lxm s ASN 875 CO 0.08 -0.21 1.14 -2.16 0.02 0.00 0.00 177.10 175.98 1lxm s PRO 876 N 1.43 4.48 -0.00 -0.60 0.04 -1.26 -0.28 135.00 138.82 1lxm s PRO 876 Ca -0.09 1.70 0.03 0.00 0.04 0.00 0.00 61.00 62.68 1lxm s PRO 876 Cb -0.07 -3.36 -0.01 0.00 0.04 0.00 0.00 34.50 31.11 1lxm s PRO 876 CO -0.15 -0.16 -0.10 -0.06 0.04 0.00 0.00 177.00 176.57 1lxm s PHE 877 N 0.82 0.91 -0.26 0.56 0.08 -0.62 0.59 117.98 120.06 1lxm s PHE 877 Ca 0.56 -0.19 -0.07 0.00 0.12 0.00 0.00 56.93 57.34 1lxm s PHE 877 Cb -0.28 -0.58 -0.02 0.00 -0.57 0.00 0.00 43.02 41.57 1lxm s PHE 877 CO 0.30 -0.01 0.08 0.42 -0.10 0.00 0.00 175.22 175.91 1lxm s ILE 878 N -0.32 4.27 -0.19 0.64 1.01 -0.13 -2.25 121.20 124.22 1lxm s ILE 878 Ca 0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.37 1lxm s ILE 878 Cb -0.04 -3.05 0.01 0.00 0.01 0.00 0.00 42.46 39.38 1lxm s ILE 878 CO -0.00 0.26 -0.13 -0.89 0.00 0.00 0.00 174.94 174.19 1lxm s THR 879 N 1.59 2.71 -0.16 2.92 2.01 0.27 -1.55 115.64 123.43 1lxm s THR 879 Ca 0.06 -0.72 -0.05 0.00 0.31 0.00 0.00 61.69 61.28 1lxm s THR 879 Cb -0.16 -2.19 -0.03 0.00 0.01 0.00 0.00 72.50 70.13 1lxm s THR 879 CO 0.04 0.49 0.00 -0.63 -0.69 0.00 0.00 174.62 173.82 1lxm s ILE 880 N 1.31 4.24 0.07 1.82 1.01 0.14 -0.27 121.20 129.52 1lxm s ILE 880 Ca 0.04 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.46 1lxm s ILE 880 Cb -0.14 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 1lxm s ILE 880 CO -0.07 0.49 -0.04 -0.44 0.00 0.00 0.00 174.94 174.87 1lxm s SER 881 N 0.32 0.75 -0.12 3.58 0.01 -0.04 -0.64 113.70 117.56 1lxm s SER 881 Ca -0.01 -1.00 -0.00 0.00 1.31 0.00 0.00 55.95 56.25 1lxm s SER 881 Cb -0.13 0.16 0.03 0.00 0.21 0.00 0.00 66.02 66.28 1lxm s SER 881 CO 0.02 -0.54 -0.08 -1.58 0.41 0.00 0.00 173.24 171.46 1lxm s GLN 882 N -3.87 1.61 0.11 12.44 0.74 0.55 -0.13 119.66 131.11 1lxm s GLN 882 Ca 0.09 -0.32 -0.31 0.00 0.05 0.00 0.00 55.36 54.87 1lxm s GLN 882 Cb 0.07 -1.70 -0.07 0.00 1.10 0.00 0.00 33.01 32.41 1lxm s GLN 882 CO -0.08 -0.28 1.28 0.15 -0.55 0.00 0.00 175.29 175.81 1lxm s LYS 883 N 1.67 4.39 0.23 1.67 1.02 -1.26 -1.21 119.74 126.25 1lxm s LYS 883 Ca 0.04 1.93 0.06 0.00 0.02 0.00 0.00 55.97 58.03 1lxm s LYS 883 Cb -0.13 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 1lxm s LYS 883 CO -0.08 -0.31 0.22 -1.01 -0.92 0.00 0.00 175.35 173.25 1lxm s HIS 884 N 0.84 3.20 -0.04 3.18 3.76 -0.26 -4.95 115.29 121.01 1lxm s HIS 884 Ca 0.60 -0.07 0.05 0.00 -0.15 0.00 0.00 55.06 55.50 1lxm s HIS 884 Cb -0.33 -1.46 -0.08 0.00 1.11 0.00 0.00 32.58 31.82 1lxm s HIS 884 CO 0.31 0.51 0.05 -0.25 -0.85 0.00 0.00 174.74 174.51 1lxm n ASP 885 N -1.06 3.63 0.00 1.40 8.00 -1.26 -4.61 116.55 122.65 1lxm n ASP 885 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 1lxm n ASP 885 Cb 0.57 0.84 0.00 0.00 -0.02 0.00 0.00 41.12 42.51 1lxm n ASP 885 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1lxm n SER 890 N -2.05 0.00 -3.81 -2.24 7.64 0.61 -4.94 113.62 108.83 1lxm n SER 890 Ca -0.07 0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.70 1lxm n SER 890 Cb 0.51 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.63 1lxm n SER 890 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1lxm s TYR 891 N -1.37 -0.02 -0.29 1.43 -0.85 0.84 -4.96 117.35 112.14 1lxm s TYR 891 Ca 0.00 -0.13 -0.06 0.00 -0.52 0.00 0.00 57.07 56.36 1lxm s TYR 891 Cb 0.00 0.02 0.15 0.00 0.38 0.00 0.00 41.96 42.51 1lxm s TYR 891 CO 0.00 -0.44 0.60 0.20 -1.52 0.00 0.00 175.55 174.38 1lxm s GLY 892 N -1.97 -0.79 0.16 5.49 0.00 -1.25 0.56 107.32 109.52 1lxm s GLY 892 Ca -0.06 2.00 -0.14 0.00 0.00 0.00 0.00 44.72 46.52 1lxm s GLY 892 CO -0.03 3.11 0.39 -2.52 0.00 0.00 0.00 173.10 174.05 1lxm s TYR 893 N 2.84 0.04 -0.05 1.90 1.13 0.05 -2.29 117.35 120.98 1lxm s TYR 893 Ca 0.06 -0.39 0.06 0.00 -1.41 0.00 0.00 57.07 55.39 1lxm s TYR 893 Cb -0.13 0.18 -0.02 0.00 -1.10 0.00 0.00 41.96 40.89 1lxm s TYR 893 CO -0.19 -0.77 -0.24 1.41 -2.51 0.00 0.00 175.55 173.26 1lxm s MET 894 N -3.88 2.41 -0.13 -3.49 1.75 0.15 0.11 119.30 116.21 1lxm s MET 894 Ca 0.10 -0.88 -0.01 0.00 -1.25 0.00 0.00 55.69 53.65 1lxm s MET 894 Cb 0.02 -2.16 -0.02 0.00 2.84 0.00 0.00 34.83 35.51 1lxm s MET 894 CO -0.05 0.47 -0.12 1.41 -0.65 0.00 0.00 175.02 176.09 1lxm s MET 895 N -0.39 3.43 -0.29 4.11 1.75 0.57 -0.92 119.30 127.57 1lxm s MET 895 Ca 0.03 -0.66 0.01 0.00 -1.25 0.00 0.00 55.69 53.83 1lxm s MET 895 Cb -0.12 -2.68 0.08 0.00 2.84 0.00 0.00 34.83 34.96 1lxm s MET 895 CO 0.02 0.21 0.02 0.08 -0.65 0.00 0.00 175.02 174.70 1lxm s VAL 896 N 0.37 1.61 0.36 10.11 1.01 0.30 -1.58 120.40 132.57 1lxm s VAL 896 Ca -0.10 -1.63 -0.09 0.00 0.00 0.00 0.00 61.98 60.16 1lxm s VAL 896 Cb -0.16 -2.05 -0.06 0.00 0.00 0.00 0.00 36.38 34.11 1lxm s VAL 896 CO 0.05 -0.41 0.70 -2.16 0.00 0.00 0.00 175.10 173.28 1lxm s PRO 897 N 1.29 3.75 -1.45 2.72 0.05 -1.26 -1.27 135.00 138.84 1lxm s PRO 897 Ca 0.04 0.34 -0.09 0.00 0.05 0.00 0.00 61.00 61.34 1lxm s PRO 897 Cb -0.18 -2.48 0.05 0.00 0.05 0.00 0.00 34.50 31.94 1lxm s PRO 897 CO -0.12 0.06 0.93 0.09 0.05 0.00 0.00 177.00 178.01 1lxm n ASN 898 N -1.09 -3.93 -4.50 6.66 3.02 0.10 -4.96 115.26 110.57 1lxm n ASN 898 Ca 0.01 -0.76 -0.30 0.00 -0.03 0.00 0.00 54.58 53.50 1lxm n ASN 898 Cb 0.54 -4.09 -0.11 0.00 -0.61 0.00 0.00 39.78 35.51 1lxm n ASN 898 CO 0.00 0.00 0.00 -0.51 -2.62 0.00 0.00 177.26 174.13 1lxm s ILE 899 N -3.41 3.01 0.47 2.41 2.07 -1.26 -4.96 121.20 119.52 1lxm s ILE 899 Ca 0.46 -1.25 -0.19 0.00 -1.41 0.00 0.00 60.65 58.26 1lxm s ILE 899 Cb -0.23 -2.33 -0.10 0.00 0.13 0.00 0.00 42.46 39.93 1lxm s ILE 899 CO 0.81 0.23 0.97 1.51 -1.91 0.00 0.00 174.94 176.56 1lxm s ASP 900 N -1.78 6.76 0.25 4.50 1.47 -1.26 -4.80 116.67 121.80 1lxm s ASP 900 Ca 0.17 1.67 -0.04 0.00 1.18 0.00 0.00 52.55 55.53 1lxm s ASP 900 Cb -0.11 -2.53 0.40 0.00 -0.34 0.00 0.00 42.92 40.34 1lxm s ASP 900 CO 0.09 -0.49 1.81 -0.09 0.68 0.00 0.00 175.17 177.17 1lxm h ARG 901 N 1.53 0.79 -0.53 2.11 2.43 -1.99 0.41 114.38 119.13 1lxm h ARG 901 Ca -0.48 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 58.52 1lxm h ARG 901 Cb 1.19 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 30.54 1lxm h ARG 901 CO 0.61 0.52 -0.14 1.79 -1.51 0.00 0.00 179.97 181.24 1lxm h THR 902 N 0.81 1.27 0.00 0.20 1.35 -2.00 -1.80 112.91 112.74 1lxm h THR 902 Ca 0.40 -1.31 -0.13 0.00 -0.55 0.00 0.00 66.41 64.82 1lxm h THR 902 Cb 0.36 1.01 -0.02 0.00 -1.73 0.00 0.00 68.15 67.77 1lxm h THR 902 CO -0.24 0.46 -0.64 -1.28 -0.25 0.00 0.00 175.52 173.57 1lxm h SER 903 N 0.90 0.00 -0.03 5.36 0.87 -1.88 -3.05 113.55 115.72 1lxm h SER 903 Ca 0.13 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.68 1lxm h SER 903 Cb 0.72 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1lxm h SER 903 CO 0.06 0.64 -0.01 0.15 -0.53 0.00 0.00 176.83 177.14 1lxm h PHE 904 N 0.00 0.06 -0.55 2.24 3.57 -0.73 -2.37 116.94 119.17 1lxm h PHE 904 Ca -0.01 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.54 1lxm h PHE 904 Cb 1.26 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.93 1lxm h PHE 904 CO 0.00 0.41 0.25 -0.44 -2.23 0.00 0.00 178.31 176.30 1lxm h ASP 905 N -0.30 0.33 -0.59 0.41 3.32 -1.37 -0.17 116.42 118.04 1lxm h ASP 905 Ca 0.01 0.05 0.09 0.00 0.02 0.00 0.00 57.03 57.19 1lxm h ASP 905 Cb 0.39 -0.01 -0.07 0.00 0.22 0.00 0.00 39.33 39.86 1lxm h ASP 905 CO 0.00 0.22 0.21 0.11 -1.72 0.00 0.00 179.24 178.06 1lxm h LYS 906 N 0.48 0.38 -0.25 3.56 1.57 -1.49 0.55 116.57 121.36 1lxm h LYS 906 Ca 0.25 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.99 1lxm h LYS 906 Cb 0.22 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1lxm h LYS 906 CO -0.21 0.25 0.06 1.25 -0.57 0.00 0.00 179.45 180.23 1lxm h LEU 907 N 0.39 0.32 0.04 2.94 5.85 -0.55 -2.97 115.31 121.32 1lxm h LEU 907 Ca 0.30 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 1lxm h LEU 907 Cb 0.37 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1lxm h LEU 907 CO -0.31 0.33 -0.02 0.00 -0.34 0.00 0.00 178.44 178.11 1lxm h ALA 908 N 1.72 -0.05 0.00 1.25 0.00 0.60 -3.24 119.26 119.53 1lxm h ALA 908 Ca 0.09 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1lxm h ALA 908 Cb 0.14 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1lxm h ALA 908 CO -0.00 -0.17 0.00 0.09 0.00 0.00 0.00 179.25 179.17 1lxm n ASN 909 N -4.78 3.64 -4.03 0.00 3.02 -0.03 -4.76 115.26 108.32 1lxm n ASN 909 Ca -0.09 -2.10 -0.08 0.00 -0.03 0.00 0.00 54.58 52.29 1lxm n ASN 909 Cb 0.33 -0.67 -0.10 0.00 -0.61 0.00 0.00 39.78 38.72 1lxm n ASN 909 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1lxm s SER 910 N 1.29 0.38 -0.83 6.41 1.04 -1.13 -4.99 113.70 115.87 1lxm s SER 910 Ca 0.00 -0.85 -0.02 0.00 0.48 0.00 0.00 55.95 55.56 1lxm s SER 910 Cb 0.00 0.21 0.35 0.00 0.10 0.00 0.00 66.02 66.68 1lxm s SER 910 CO 0.00 -0.57 2.04 0.29 0.98 0.00 0.00 173.24 175.98 1lxm n LYS 911 N 0.34 2.74 0.01 4.02 5.02 -1.26 -4.72 118.16 124.31 1lxm n LYS 911 Ca -0.16 -3.48 -0.11 0.00 -2.02 0.00 0.00 58.31 52.54 1lxm n LYS 911 Cb 0.60 -2.27 -0.06 0.00 -0.02 0.00 0.00 35.03 33.29 1lxm n LYS 911 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1lxm h GLU 912 N 2.92 0.11 -6.73 1.97 4.57 -1.94 -3.43 114.58 112.05 1lxm h GLU 912 Ca 0.57 -0.01 -0.69 0.00 -1.18 0.00 0.00 59.36 58.05 1lxm h GLU 912 Cb 0.09 -0.02 -0.27 0.00 -0.16 0.00 0.00 28.75 28.39 1lxm h GLU 912 CO 1.44 0.08 -0.88 0.54 -1.18 0.00 0.00 179.01 179.01 1lxm s VAL 913 N -6.16 2.13 -0.03 0.32 0.11 -1.26 -1.59 120.40 113.92 1lxm s VAL 913 Ca -0.13 -1.37 0.01 0.00 -2.93 0.00 0.00 61.98 57.55 1lxm s VAL 913 Cb 0.07 -1.82 0.02 0.00 -1.53 0.00 0.00 36.38 33.12 1lxm s VAL 913 CO 0.67 0.38 -0.02 -1.61 -3.33 0.00 0.00 175.10 171.19 1lxm s GLU 914 N -1.20 0.54 -0.86 1.54 2.02 0.04 -4.98 118.70 115.80 1lxm s GLU 914 Ca 0.12 -0.01 -0.18 0.00 0.02 0.00 0.00 54.97 54.91 1lxm s GLU 914 Cb -0.10 -0.63 0.14 0.00 0.10 0.00 0.00 34.13 33.64 1lxm s GLU 914 CO 0.02 -0.10 1.00 -1.17 0.02 0.00 0.00 175.26 175.02 1lxm s LEU 915 N 0.93 5.42 0.28 1.80 2.96 -1.26 -1.25 118.68 127.56 1lxm s LEU 915 Ca -0.11 -2.05 0.02 0.00 -0.22 0.00 0.00 54.13 51.77 1lxm s LEU 915 Cb -0.14 -2.35 0.42 0.00 0.50 0.00 0.00 46.19 44.62 1lxm s LEU 915 CO -0.01 -0.99 1.75 -0.07 -1.32 0.00 0.00 176.35 175.71 1lxm h LEU 916 N 9.85 0.54 -7.18 -0.68 4.07 -1.55 -3.45 115.31 116.92 1lxm h LEU 916 Ca 0.07 -0.16 -0.09 0.00 0.08 0.00 0.00 57.88 57.78 1lxm h LEU 916 Cb 1.04 -0.15 -0.22 0.00 1.08 0.00 0.00 40.66 42.41 1lxm h LEU 916 CO 1.03 0.73 -0.07 -0.70 -1.08 0.00 0.00 178.44 178.36 1lxm s GLU 917 N -4.65 0.67 -0.31 1.13 2.12 -1.14 -4.96 118.70 111.56 1lxm s GLU 917 Ca -0.07 0.66 0.18 0.00 0.36 0.00 0.00 54.97 56.09 1lxm s GLU 917 Cb 0.14 0.33 0.47 0.00 0.26 0.00 0.00 34.13 35.33 1lxm s GLU 917 CO 0.79 -0.10 1.01 -1.71 -0.54 0.00 0.00 175.26 174.71 1lxm n ASN 918 N 2.54 1.82 -4.18 -1.70 5.15 -1.24 0.19 115.26 117.83 1lxm n ASN 918 Ca -0.14 -2.62 -0.28 0.00 -0.60 0.00 0.00 54.58 50.93 1lxm n ASN 918 Cb 0.56 -0.51 0.18 0.00 -0.53 0.00 0.00 39.78 39.49 1lxm n ASN 918 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1lxm s SER 919 N -3.36 3.25 0.00 1.20 1.04 -0.17 -4.78 113.70 110.88 1lxm s SER 919 Ca 0.29 -0.04 0.29 0.00 0.48 0.00 0.00 55.95 56.97 1lxm s SER 919 Cb 0.42 -0.01 1.37 0.00 0.10 0.00 0.00 66.02 67.90 1lxm s SER 919 CO 0.00 -2.62 1.94 -1.54 0.98 0.00 0.00 173.24 172.00 1lxm n SER 920 N -3.56 0.45 -0.10 7.02 3.41 -1.26 -3.39 113.62 116.20 1lxm n SER 920 Ca 0.17 -0.73 -0.18 0.00 -0.26 0.00 0.00 58.87 57.87 1lxm n SER 920 Cb 0.60 -0.07 -0.13 0.00 -0.26 0.00 0.00 64.21 64.35 1lxm n SER 920 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1lxm n LYS 921 N -0.86 0.67 -3.51 4.33 4.81 -1.26 -4.55 118.16 117.79 1lxm n LYS 921 Ca 0.17 0.17 -0.10 0.00 -0.87 0.00 0.00 58.31 57.67 1lxm n LYS 921 Cb 0.25 -1.56 -0.03 0.00 0.02 0.00 0.00 35.03 33.70 1lxm n LYS 921 CO 0.00 0.00 0.00 1.14 1.17 0.00 0.00 177.40 179.71 1lxm s GLN 922 N -2.53 0.84 -0.13 1.64 -2.07 -1.22 -1.23 119.66 114.97 1lxm s GLN 922 Ca -0.30 -0.15 0.01 0.00 -1.82 0.00 0.00 55.36 53.10 1lxm s GLN 922 Cb 0.08 0.39 0.02 0.00 -1.09 0.00 0.00 33.01 32.41 1lxm s GLN 922 CO 0.65 -0.34 -0.15 -0.65 -1.32 0.00 0.00 175.29 173.48 1lxm s GLN 923 N -2.48 2.31 -0.04 9.60 -0.21 0.09 -1.00 119.66 127.93 1lxm s GLN 923 Ca 0.01 -0.58 0.02 0.00 0.02 0.00 0.00 55.36 54.83 1lxm s GLN 923 Cb -0.01 -2.03 0.01 0.00 1.00 0.00 0.00 33.01 31.99 1lxm s GLN 923 CO -0.05 -0.14 -0.07 0.54 -2.12 0.00 0.00 175.29 173.45 1lxm s VAL 924 N 1.19 0.73 0.10 1.09 0.11 0.13 -0.00 120.40 123.75 1lxm s VAL 924 Ca -0.02 -0.27 0.08 0.00 -2.93 0.00 0.00 61.98 58.85 1lxm s VAL 924 Cb -0.14 -0.69 -0.03 0.00 -1.53 0.00 0.00 36.38 33.98 1lxm s VAL 924 CO -0.06 0.26 -0.19 -0.63 -3.33 0.00 0.00 175.10 171.14 1lxm s ILE 925 N 0.64 1.61 -0.04 7.04 1.01 -0.41 -1.25 121.20 129.80 1lxm s ILE 925 Ca -0.10 -1.53 -0.01 0.00 0.00 0.00 0.00 60.65 59.01 1lxm s ILE 925 Cb -0.13 -1.49 0.03 0.00 0.01 0.00 0.00 42.46 40.88 1lxm s ILE 925 CO 0.01 -0.11 0.02 -0.47 0.00 0.00 0.00 174.94 174.39 1lxm s TYR 926 N -1.26 0.26 -0.48 3.97 5.04 -0.38 -1.47 117.35 123.04 1lxm s TYR 926 Ca 0.06 0.06 -0.13 0.00 -2.44 0.00 0.00 57.07 54.62 1lxm s TYR 926 Cb -0.10 -0.47 0.10 0.00 0.35 0.00 0.00 41.96 41.84 1lxm s TYR 926 CO 0.04 -0.18 0.39 0.34 -1.34 0.00 0.00 175.55 174.81 1lxm s ASP 927 N 1.52 5.96 0.35 4.32 2.15 -0.59 -0.78 116.67 129.60 1lxm s ASP 927 Ca -0.03 -1.66 0.06 0.00 0.43 0.00 0.00 52.55 51.36 1lxm s ASP 927 Cb -0.13 -2.11 0.73 0.00 -0.30 0.00 0.00 42.92 41.11 1lxm s ASP 927 CO -0.03 -0.71 1.90 0.11 -0.17 0.00 0.00 175.17 176.28 1lxm h LYS 928 N 8.66 0.76 0.05 4.34 1.57 -1.60 0.25 116.57 130.60 1lxm h LYS 928 Ca -0.26 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1lxm h LYS 928 Cb 1.09 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.23 1lxm h LYS 928 CO 0.91 0.50 -0.02 -0.97 -0.57 0.00 0.00 179.45 179.30 1lxm h ASN 929 N 0.78 -0.05 -0.01 0.86 -0.73 -1.92 -2.93 115.58 111.57 1lxm h ASN 929 Ca 0.40 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.55 1lxm h ASN 929 Cb 0.47 0.01 0.00 0.00 0.27 0.00 0.00 38.32 39.08 1lxm h ASN 929 CO -0.16 -0.02 -0.05 -1.54 -0.37 0.00 0.00 177.43 175.29 1lxm n SER 930 N -5.11 2.28 -3.56 1.15 3.41 -1.08 -4.95 113.62 105.76 1lxm n SER 930 Ca -0.08 -1.73 -0.21 0.00 -0.26 0.00 0.00 58.87 56.60 1lxm n SER 930 Cb 0.06 0.04 0.05 0.00 -0.26 0.00 0.00 64.21 64.10 1lxm n SER 930 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1lxm n GLN 931 N 0.72 -3.92 -4.79 4.33 6.02 0.86 -4.51 117.38 116.09 1lxm n GLN 931 Ca 0.15 0.68 -0.26 0.00 -0.01 0.00 0.00 57.00 57.56 1lxm n GLN 931 Cb 0.49 -5.23 -0.15 0.00 1.02 0.00 0.00 30.24 26.37 1lxm n GLN 931 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1lxm s THR 932 N -3.53 1.62 -0.11 5.09 2.01 -0.98 -1.26 115.64 118.49 1lxm s THR 932 Ca 0.19 -1.04 0.02 0.00 0.31 0.00 0.00 61.69 61.17 1lxm s THR 932 Cb -0.04 -1.38 -0.01 0.00 0.01 0.00 0.00 72.50 71.07 1lxm s THR 932 CO 0.79 0.31 -0.18 0.26 -0.69 0.00 0.00 174.62 175.12 1lxm s TRP 933 N -0.65 2.69 -0.15 4.92 0.52 0.13 -1.54 118.94 124.86 1lxm s TRP 933 Ca 0.08 -0.75 0.00 0.00 0.02 0.00 0.00 56.10 55.45 1lxm s TRP 933 Cb -0.08 -1.76 0.02 0.00 -1.15 0.00 0.00 33.47 30.50 1lxm s TRP 933 CO 0.01 -0.25 -0.15 0.00 0.02 0.00 0.00 176.95 176.57 1lxm s ALA 934 N 0.22 1.90 -0.08 0.98 0.00 -0.54 -0.68 121.76 123.57 1lxm s ALA 934 Ca -0.11 -0.93 0.01 0.00 0.00 0.00 0.00 51.96 50.92 1lxm s ALA 934 Cb -0.16 -1.06 0.02 0.00 0.00 0.00 0.00 23.12 21.92 1lxm s ALA 934 CO 0.06 -0.37 -0.08 0.08 0.00 0.00 0.00 175.76 175.46 1lxm s VAL 935 N 1.45 0.88 -0.48 0.00 1.01 0.22 -1.29 120.40 122.19 1lxm s VAL 935 Ca 0.05 -0.27 -0.14 0.00 0.00 0.00 0.00 61.98 61.61 1lxm s VAL 935 Cb -0.13 -0.88 0.10 0.00 0.00 0.00 0.00 36.38 35.47 1lxm s VAL 935 CO -0.11 0.32 0.40 -0.63 0.00 0.00 0.00 175.10 175.08 1lxm s ILE 936 N 1.19 4.95 -0.40 2.22 1.01 1.00 -1.09 121.20 130.08 1lxm s ILE 936 Ca -0.05 -1.34 -0.18 0.00 0.00 0.00 0.00 60.65 59.08 1lxm s ILE 936 Cb -0.14 -4.07 0.01 0.00 0.01 0.00 0.00 42.46 38.27 1lxm s ILE 936 CO -0.02 -0.68 0.48 -0.75 0.00 0.00 0.00 174.94 173.97 1lxm s LYS 937 N 1.56 3.32 -0.01 2.79 2.20 0.53 -0.73 119.74 129.40 1lxm s LYS 937 Ca 0.04 -0.51 0.02 0.00 -0.36 0.00 0.00 55.97 55.16 1lxm s LYS 937 Cb -0.26 -3.90 -0.25 0.00 -1.51 0.00 0.00 37.83 31.90 1lxm s LYS 937 CO 0.04 -0.78 0.79 0.45 -0.36 0.00 0.00 175.35 175.49 1lxm h HIS 938 N 8.65 0.29 -2.74 4.03 3.86 -1.45 0.36 115.15 128.14 1lxm h HIS 938 Ca -0.27 -0.21 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 1lxm h HIS 938 Cb 1.12 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.57 1lxm h HIS 938 CO 0.67 1.29 0.00 -0.40 0.86 0.00 0.00 177.93 180.35 1lxm n ASP 939 N -3.34 0.00 -0.28 2.45 5.75 -1.10 -4.85 116.55 115.19 1lxm n ASP 939 Ca -0.17 -0.05 0.01 0.00 -0.01 0.00 0.00 54.79 54.57 1lxm n ASP 939 Cb 1.03 0.00 0.01 0.00 -1.03 0.00 0.00 41.12 41.13 1lxm n ASP 939 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1lxm n ASN 940 N -0.14 0.20 -4.56 -1.12 5.03 -1.26 -3.04 115.26 110.37 1lxm n ASN 940 Ca 0.00 -1.69 -0.39 0.00 0.87 0.00 0.00 54.58 53.37 1lxm n ASN 940 Cb 0.00 -0.13 -0.03 0.00 -1.02 0.00 0.00 39.78 38.60 1lxm n ASN 940 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 1lxm s GLN 941 N -0.19 3.42 -0.34 3.52 -1.52 -1.26 -4.68 119.66 118.61 1lxm s GLN 941 Ca 0.02 -0.90 -0.31 0.00 -1.95 0.00 0.00 55.36 52.21 1lxm s GLN 941 Cb 0.01 -5.18 -0.13 0.00 -0.22 0.00 0.00 33.01 27.50 1lxm s GLN 941 CO 0.00 -2.33 1.25 -0.85 -0.25 0.00 0.00 175.29 173.10 1lxm n GLU 942 N 8.95 0.00 -4.18 2.91 0.28 -1.26 -4.92 120.64 122.42 1lxm n GLU 942 Ca 0.30 0.00 -0.22 0.00 -0.16 0.00 0.00 57.16 57.08 1lxm n GLU 942 Cb 0.50 -1.02 -0.05 0.00 1.43 0.00 0.00 31.44 32.29 1lxm n GLU 942 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1lxm s SER 943 N 2.90 5.14 -0.18 -1.84 1.04 0.24 -4.93 113.70 116.08 1lxm s SER 943 Ca 0.76 -0.41 0.01 0.00 0.48 0.00 0.00 55.95 56.79 1lxm s SER 943 Cb -1.02 -1.18 0.01 0.00 0.10 0.00 0.00 66.02 63.93 1lxm s SER 943 CO 0.51 -0.03 -0.18 -0.22 0.98 0.00 0.00 173.24 174.30 1lxm s LEU 944 N -3.78 2.25 -0.21 2.42 2.96 -1.26 -0.73 118.68 120.33 1lxm s LEU 944 Ca 0.32 -0.60 -0.15 0.00 -0.22 0.00 0.00 54.13 53.49 1lxm s LEU 944 Cb -0.07 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 45.06 1lxm s LEU 944 CO 0.23 0.02 0.37 -0.63 -1.32 0.00 0.00 176.35 175.02 1lxm s ILE 945 N 1.20 5.21 -1.51 6.68 -1.09 0.15 -4.18 121.20 127.66 1lxm s ILE 945 Ca 0.02 0.64 -0.04 0.00 -2.23 0.00 0.00 60.65 59.04 1lxm s ILE 945 Cb -0.14 -3.70 0.02 0.00 -1.58 0.00 0.00 42.46 37.06 1lxm s ILE 945 CO -0.09 0.25 0.43 -3.20 -1.23 0.00 0.00 174.94 171.11 1lxm n ASN 946 N 4.52 -5.49 -0.08 3.58 5.15 -1.26 -0.75 115.26 120.93 1lxm n ASN 946 Ca -0.09 -0.22 -0.01 0.00 -0.60 0.00 0.00 54.58 53.66 1lxm n ASN 946 Cb 0.51 -4.49 -0.00 0.00 -0.53 0.00 0.00 39.78 35.27 1lxm n ASN 946 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1lxm n ASN 947 N -2.34 -4.71 0.00 1.20 4.13 -1.26 -4.69 115.26 107.60 1lxm n ASN 947 Ca -0.12 0.02 0.00 0.00 1.68 0.00 0.00 54.58 56.16 1lxm n ASN 947 Cb 0.62 -2.93 0.00 0.00 -1.54 0.00 0.00 39.78 35.93 1lxm n ASN 947 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1lxm n GLN 948 N 0.63 2.12 -3.88 3.52 10.64 -0.41 -5.04 117.38 124.96 1lxm n GLN 948 Ca -0.01 0.00 -0.36 0.00 -1.83 0.00 0.00 57.00 54.81 1lxm n GLN 948 Cb 0.40 -0.90 -0.11 0.00 -0.86 0.00 0.00 30.24 28.77 1lxm n GLN 948 CO 0.00 0.00 0.00 -0.06 -1.83 0.00 0.00 177.06 175.17 1lxm s PHE 949 N -1.80 3.21 -0.35 2.61 0.08 0.08 -4.91 117.98 116.88 1lxm s PHE 949 Ca 0.00 -0.04 -0.20 0.00 0.12 0.00 0.00 56.93 56.81 1lxm s PHE 949 Cb 0.00 -2.17 0.00 0.00 -0.57 0.00 0.00 43.02 40.29 1lxm s PHE 949 CO 0.00 -0.02 0.62 0.15 -0.10 0.00 0.00 175.22 175.87 1lxm s LYS 950 N 0.89 3.68 -0.04 0.44 1.02 -1.26 0.30 119.74 124.77 1lxm s LYS 950 Ca 0.04 0.03 0.05 0.00 0.02 0.00 0.00 55.97 56.12 1lxm s LYS 950 Cb -0.14 -3.81 -0.01 0.00 -0.52 0.00 0.00 37.83 33.36 1lxm s LYS 950 CO 0.03 -0.72 -0.21 -1.64 -0.92 0.00 0.00 175.35 171.89 1lxm s MET 951 N 2.66 2.04 0.00 1.68 -1.94 0.09 -4.52 119.30 119.30 1lxm s MET 951 Ca 0.24 -0.75 0.00 0.00 -1.71 0.00 0.00 55.69 53.46 1lxm s MET 951 Cb -0.15 -1.80 0.00 0.00 2.01 0.00 0.00 34.83 34.90 1lxm s MET 951 CO 0.14 0.35 0.00 0.27 -0.01 0.00 0.00 175.02 175.77 1lxm n ASN 952 N 2.93 0.39 -4.79 3.03 2.04 -1.26 0.80 115.26 118.41 1lxm n ASN 952 Ca -0.17 0.00 -0.35 0.00 -0.44 0.00 0.00 54.58 53.62 1lxm n ASN 952 Cb 0.52 0.00 -0.04 0.00 -2.53 0.00 0.00 39.78 37.74 1lxm n ASN 952 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1lxm s LYS 953 N -1.85 3.94 0.51 -3.83 1.02 -1.26 -4.10 119.74 114.17 1lxm s LYS 953 Ca 0.00 1.45 -0.20 0.00 0.02 0.00 0.00 55.97 57.24 1lxm s LYS 953 Cb 0.00 -2.29 -0.07 0.00 -0.52 0.00 0.00 37.83 34.95 1lxm s LYS 953 CO 0.00 -0.32 1.07 0.00 -0.92 0.00 0.00 175.35 175.18 1lxm s ALA 954 N -1.82 2.80 0.00 5.17 0.00 -1.17 -4.86 121.76 121.88 1lxm s ALA 954 Ca 0.63 0.67 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1lxm s ALA 954 Cb -0.19 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1lxm s ALA 954 CO 0.24 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 175.91 1lxm n GLY 955 N -0.16 0.41 3.40 0.00 0.00 0.13 -4.82 105.19 104.15 1lxm n GLY 955 Ca 0.10 -1.64 -0.34 0.00 0.00 0.00 0.00 46.02 44.14 1lxm n GLY 955 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1lxm s LEU 956 N 0.00 3.03 -0.03 0.99 1.43 -0.45 -0.35 118.68 123.30 1lxm s LEU 956 Ca 0.00 -0.27 0.06 0.00 -1.03 0.00 0.00 54.13 52.89 1lxm s LEU 956 Cb 0.00 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 1lxm s LEU 956 CO 0.00 0.08 -0.21 -0.31 0.23 0.00 0.00 176.35 176.14 1lxm s TYR 957 N 0.87 1.95 -0.11 0.29 1.51 -0.25 -0.34 117.35 121.28 1lxm s TYR 957 Ca -0.01 -0.46 -0.01 0.00 -1.01 0.00 0.00 57.07 55.57 1lxm s TYR 957 Cb -0.15 -1.28 0.04 0.00 -0.11 0.00 0.00 41.96 40.46 1lxm s TYR 957 CO 0.01 -0.10 -0.01 -0.51 -1.11 0.00 0.00 175.55 173.83 1lxm s LEU 958 N -0.29 0.92 -0.11 -1.29 1.43 -0.72 -0.61 118.68 118.01 1lxm s LEU 958 Ca 0.03 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.80 1lxm s LEU 958 Cb -0.10 -0.59 0.02 0.00 0.03 0.00 0.00 46.19 45.55 1lxm s LEU 958 CO 0.01 -0.20 -0.11 -0.69 0.23 0.00 0.00 176.35 175.58 1lxm s VAL 959 N 1.87 1.24 0.04 -1.59 1.01 0.14 -1.20 120.40 121.91 1lxm s VAL 959 Ca 0.03 -0.47 0.06 0.00 0.00 0.00 0.00 61.98 61.61 1lxm s VAL 959 Cb -0.14 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.04 1lxm s VAL 959 CO -0.07 0.40 -0.18 -1.58 0.00 0.00 0.00 175.10 173.67 1lxm s GLN 960 N 1.25 1.23 -0.09 2.72 0.74 0.17 0.21 119.66 125.88 1lxm s GLN 960 Ca -0.02 -0.84 -0.30 0.00 0.05 0.00 0.00 55.36 54.24 1lxm s GLN 960 Cb -0.14 -1.29 -0.03 0.00 1.10 0.00 0.00 33.01 32.65 1lxm s GLN 960 CO -0.04 0.33 1.28 0.21 -0.55 0.00 0.00 175.29 176.52 1lxm s LYS 961 N -1.09 4.28 -0.29 1.67 2.20 -0.39 -0.46 119.74 125.66 1lxm s LYS 961 Ca 0.05 1.74 -0.03 0.00 -0.36 0.00 0.00 55.97 57.37 1lxm s LYS 961 Cb -0.08 -3.66 0.10 0.00 -1.51 0.00 0.00 37.83 32.67 1lxm s LYS 961 CO 0.01 -0.59 0.13 0.54 -0.36 0.00 0.00 175.35 175.08 1lxm s VAL 962 N 2.84 0.06 0.00 4.02 0.11 -0.47 -4.92 120.40 122.04 1lxm s VAL 962 Ca 0.58 -0.87 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 1lxm s VAL 962 Cb -0.25 -1.07 0.00 0.00 -1.53 0.00 0.00 36.38 33.53 1lxm s VAL 962 CO 0.20 -0.73 0.00 0.61 -3.33 0.00 0.00 175.10 171.85 1lxm n GLY 963 N 5.17 0.82 2.01 6.54 0.00 -1.26 -3.06 105.19 115.40 1lxm n GLY 963 Ca -0.05 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 44.97 1lxm n GLY 963 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1lxm n ASN 964 N 6.28 5.22 -1.93 1.61 3.02 -1.26 -4.99 115.26 123.21 1lxm n ASN 964 Ca 0.00 -3.76 -0.07 0.00 -0.03 0.00 0.00 54.58 50.72 1lxm n ASN 964 Cb 0.00 -0.45 -0.01 0.00 -0.61 0.00 0.00 39.78 38.71 1lxm n ASN 964 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1lxm n ASP 965 N -0.77 -0.71 -3.95 6.41 8.00 -1.17 -5.18 116.55 119.18 1lxm n ASP 965 Ca 0.46 -1.87 -0.20 0.00 0.71 0.00 0.00 54.79 53.88 1lxm n ASP 965 Cb 0.91 1.30 -0.16 0.00 -0.02 0.00 0.00 41.12 43.16 1lxm n ASP 965 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1lxm s TYR 966 N -4.31 0.88 0.05 1.24 1.51 -1.26 -1.37 117.35 114.09 1lxm s TYR 966 Ca 0.13 -0.25 0.00 0.00 -1.01 0.00 0.00 57.07 55.95 1lxm s TYR 966 Cb -0.01 -0.69 -0.04 0.00 -0.11 0.00 0.00 41.96 41.11 1lxm s TYR 966 CO 0.09 -0.15 0.16 -1.14 -1.11 0.00 0.00 175.55 173.40 1lxm s GLN 967 N 0.54 3.28 0.20 -0.62 0.74 0.39 -4.90 119.66 119.28 1lxm s GLN 967 Ca -0.08 -0.49 -0.19 0.00 0.05 0.00 0.00 55.36 54.65 1lxm s GLN 967 Cb -0.12 -2.96 0.04 0.00 1.10 0.00 0.00 33.01 31.07 1lxm s GLN 967 CO 0.01 0.61 0.56 0.54 -0.55 0.00 0.00 175.29 176.46 1lxm s ASN 968 N -2.34 -0.33 -0.01 6.67 2.20 -1.26 0.42 114.94 120.29 1lxm s ASN 968 Ca 0.32 -0.38 -0.03 0.00 -0.94 0.00 0.00 52.86 51.83 1lxm s ASN 968 Cb -0.13 0.60 0.00 0.00 -2.00 0.00 0.00 41.25 39.72 1lxm s ASN 968 CO 0.24 -1.07 0.06 0.68 -2.94 0.00 0.00 177.10 174.08 1lxm s VAL 969 N -3.85 0.03 0.00 3.54 -7.23 -0.34 -1.06 120.40 111.49 1lxm s VAL 969 Ca 0.07 -0.28 0.04 0.00 -1.81 0.00 0.00 61.98 60.01 1lxm s VAL 969 Cb -0.02 -0.19 -0.01 0.00 0.56 0.00 0.00 36.38 36.73 1lxm s VAL 969 CO -0.04 -0.15 -0.14 -0.47 -0.31 0.00 0.00 175.10 173.99 1lxm s TYR 970 N -0.46 1.21 -0.05 2.82 5.04 0.20 -1.76 117.35 124.35 1lxm s TYR 970 Ca -0.05 -0.26 0.02 0.00 -2.44 0.00 0.00 57.07 54.34 1lxm s TYR 970 Cb -0.03 -0.77 0.01 0.00 0.35 0.00 0.00 41.96 41.52 1lxm s TYR 970 CO 0.00 -0.01 -0.11 -0.47 -1.34 0.00 0.00 175.55 173.63 1lxm s TYR 971 N -0.45 1.23 -0.48 4.97 5.04 0.54 0.11 117.35 128.32 1lxm s TYR 971 Ca 0.04 -0.40 -0.15 0.00 -2.44 0.00 0.00 57.07 54.12 1lxm s TYR 971 Cb -0.06 -0.91 0.08 0.00 0.35 0.00 0.00 41.96 41.42 1lxm s TYR 971 CO -0.00 -0.21 0.40 -1.14 -1.34 0.00 0.00 175.55 173.26 1lxm s GLN 972 N 0.54 2.93 0.19 4.97 -0.44 0.15 -1.34 119.66 126.66 1lxm s GLN 972 Ca -0.11 -1.43 -0.12 0.00 -2.50 0.00 0.00 55.36 51.21 1lxm s GLN 972 Cb -0.14 -4.12 0.22 0.00 -1.64 0.00 0.00 33.01 27.33 1lxm s GLN 972 CO 0.02 -1.07 1.72 -1.35 0.50 0.00 0.00 175.29 175.11 1lxm h PRO 973 N 8.73 0.25 0.78 1.67 0.11 -1.86 0.18 132.00 141.86 1lxm h PRO 973 Ca -0.28 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.78 1lxm h PRO 973 Cb 1.10 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1lxm h PRO 973 CO 0.89 0.17 -0.44 0.37 -0.21 0.00 0.00 178.00 178.78 1lxm h GLN 974 N 0.26 -1.09 -0.02 1.05 4.15 -1.82 -2.98 115.11 114.66 1lxm h GLN 974 Ca 0.27 0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.76 1lxm h GLN 974 Cb 0.36 0.25 0.00 0.00 0.21 0.00 0.00 27.48 28.29 1lxm h GLN 974 CO -0.33 -0.73 0.00 0.25 -1.93 0.00 0.00 178.83 176.09 1lxm n THR 975 N -5.26 0.02 -3.65 2.39 -2.24 -1.23 -4.95 114.28 99.37 1lxm n THR 975 Ca -0.14 -0.10 -0.27 0.00 -2.27 0.00 0.00 64.05 61.27 1lxm n THR 975 Cb 0.46 -0.11 0.04 0.00 -2.10 0.00 0.00 70.33 68.62 1lxm n THR 975 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1lxm n MET 976 N -0.52 -2.08 -5.13 -0.78 2.81 0.59 -5.01 117.12 107.00 1lxm n MET 976 Ca 0.20 0.53 -0.31 0.00 -1.81 0.00 0.00 57.70 56.32 1lxm n MET 976 Cb 0.19 -4.55 -0.17 0.00 -0.71 0.00 0.00 33.22 27.99 1lxm n MET 976 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1lxm s THR 977 N -3.53 1.90 -0.24 2.03 2.01 -0.97 -4.94 115.64 111.90 1lxm s THR 977 Ca 0.36 -0.94 -0.08 0.00 0.31 0.00 0.00 61.69 61.34 1lxm s THR 977 Cb -0.11 -1.64 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 1lxm s THR 977 CO 0.84 0.53 0.09 -0.75 -0.69 0.00 0.00 174.62 174.63 1lxm s LYS 978 N 0.22 3.76 -0.20 4.92 2.47 -1.26 -0.68 119.74 128.97 1lxm s LYS 978 Ca -0.13 -0.43 -0.03 0.00 -1.56 0.00 0.00 55.97 53.82 1lxm s LYS 978 Cb -0.16 -3.36 -0.01 0.00 -1.46 0.00 0.00 37.83 32.84 1lxm s LYS 978 CO 0.06 -0.10 -0.06 0.99 0.16 0.00 0.00 175.35 176.41 1lxm s THR 979 N 1.40 3.36 -0.24 3.43 2.01 0.31 -4.94 115.64 120.96 1lxm s THR 979 Ca 0.06 -0.51 -0.11 0.00 0.31 0.00 0.00 61.69 61.44 1lxm s THR 979 Cb -0.15 -2.50 -0.05 0.00 0.01 0.00 0.00 72.50 69.81 1lxm s THR 979 CO 0.04 0.44 0.18 -1.81 -0.69 0.00 0.00 174.62 172.79 1lxm s ASP 980 N 1.22 6.13 -0.85 3.53 1.11 -1.26 0.60 116.67 127.15 1lxm s ASP 980 Ca 0.03 0.13 -0.04 0.00 0.18 0.00 0.00 52.55 52.85 1lxm s ASP 980 Cb -0.14 -2.12 -0.04 0.00 1.07 0.00 0.00 42.92 41.69 1lxm s ASP 980 CO -0.02 0.04 0.73 0.00 1.18 0.00 0.00 175.17 177.11 1lxm n GLN 981 N 4.40 -2.57 -2.73 8.23 1.13 -0.23 -4.99 117.38 120.62 1lxm n GLN 981 Ca -0.14 0.68 -0.32 0.00 -1.94 0.00 0.00 57.00 55.27 1lxm n GLN 981 Cb 0.52 -4.95 -0.05 0.00 0.11 0.00 0.00 30.24 25.87 1lxm n GLN 981 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1lxm s LEU 982 N -5.00 3.83 -0.18 1.08 1.98 -1.26 -4.94 118.68 114.20 1lxm s LEU 982 Ca 0.27 1.50 -0.31 0.00 -2.89 0.00 0.00 54.13 52.70 1lxm s LEU 982 Cb -0.04 -4.37 -0.08 0.00 0.66 0.00 0.00 46.19 42.36 1lxm s LEU 982 CO 0.58 -0.42 2.11 0.00 -1.89 0.00 0.00 176.35 176.73 1lxm n ALA 983 N -1.02 1.45 -0.39 5.97 0.00 -1.26 -5.02 120.51 120.25 1lxm n ALA 983 Ca 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1lxm n ALA 983 Cb 0.54 -2.74 0.00 0.00 0.00 0.00 0.00 19.45 17.25 1lxm n ALA 983 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01