#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mtl n GLU 163 N 0.00 1.88 -0.00 0.03 1.02 -1.26 -4.79 120.64 117.51 3mtl n GLU 163 Ca 0.00 0.00 0.06 0.00 -0.02 0.00 0.00 57.16 57.20 3mtl n GLU 163 Cb 0.00 -0.97 -0.07 0.00 -0.02 0.00 0.00 31.44 30.37 3mtl n GLU 163 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3mtl n THR 164 N -1.65 0.00 -4.37 2.62 -2.24 -1.26 -4.99 114.28 102.40 3mtl n THR 164 Ca 0.00 -0.23 -0.24 0.00 -2.27 0.00 0.00 64.05 61.32 3mtl n THR 164 Cb 0.21 0.87 -0.11 0.00 -2.10 0.00 0.00 70.33 69.20 3mtl n THR 164 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 3mtl s TYR 165 N -2.27 1.99 -0.28 4.78 2.02 -1.26 -0.91 117.35 121.42 3mtl s TYR 165 Ca 0.03 -0.43 -0.05 0.00 -0.37 0.00 0.00 57.07 56.26 3mtl s TYR 165 Cb 0.09 -0.99 0.02 0.00 -0.40 0.00 0.00 41.96 40.68 3mtl s TYR 165 CO 0.50 0.40 0.03 0.42 -1.57 0.00 0.00 175.55 175.32 3mtl s ILE 166 N -1.91 3.50 -0.03 2.71 -1.09 -0.22 -4.86 121.20 119.30 3mtl s ILE 166 Ca 0.17 -0.89 -0.30 0.00 -2.23 0.00 0.00 60.65 57.40 3mtl s ILE 166 Cb -0.07 -2.82 -0.04 0.00 -1.58 0.00 0.00 42.46 37.95 3mtl s ILE 166 CO 0.08 0.09 1.33 -0.75 -1.23 0.00 0.00 174.94 174.46 3mtl s LYS 167 N 1.41 4.30 0.00 2.79 2.20 -1.26 -2.52 119.74 126.67 3mtl s LYS 167 Ca 0.01 1.85 0.00 0.00 -0.36 0.00 0.00 55.97 57.47 3mtl s LYS 167 Cb -0.17 -3.59 0.00 0.00 -1.51 0.00 0.00 37.83 32.56 3mtl s LYS 167 CO -0.00 -0.55 0.00 1.28 -0.36 0.00 0.00 175.35 175.72 3mtl n LEU 168 N 5.43 0.00 -4.79 5.43 4.77 -0.13 -5.02 117.00 122.69 3mtl n LEU 168 Ca 0.13 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.77 3mtl n LEU 168 Cb 0.45 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.53 3mtl n LEU 168 CO 0.57 0.00 0.74 1.51 -1.33 0.00 0.00 177.39 178.88 3mtl s ASP 169 N -0.18 5.84 0.07 -1.43 -4.77 -1.26 -4.63 116.67 110.32 3mtl s ASP 169 Ca 0.00 1.99 -0.31 0.00 -3.30 0.00 0.00 52.55 50.93 3mtl s ASP 169 Cb 0.00 -2.56 -0.07 0.00 -1.09 0.00 0.00 42.92 39.20 3mtl s ASP 169 CO 0.00 -1.13 1.32 -0.75 0.70 0.00 0.00 175.17 175.31 3mtl s LYS 170 N -3.57 4.36 -0.12 2.11 2.20 -1.26 -0.94 119.74 122.52 3mtl s LYS 170 Ca 0.68 1.94 0.14 0.00 -0.36 0.00 0.00 55.97 58.36 3mtl s LYS 170 Cb -0.19 -3.34 -0.24 0.00 -1.51 0.00 0.00 37.83 32.55 3mtl s LYS 170 CO 0.29 -0.39 0.38 1.28 -0.36 0.00 0.00 175.35 176.55 3mtl n LEU 171 N 4.17 0.66 0.00 5.43 4.77 0.04 -4.89 117.00 127.18 3mtl n LEU 171 Ca 0.11 0.22 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 3mtl n LEU 171 Cb 0.44 0.22 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 3mtl n LEU 171 CO 0.57 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.72 3mtl n GLY 172 N 1.68 -0.01 3.12 -0.72 0.00 -1.13 -5.02 105.19 103.11 3mtl n GLY 172 Ca -0.25 -0.87 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 3mtl n GLY 172 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mtl s GLU 173 N -2.00 0.71 0.30 1.61 2.02 -1.26 -0.85 118.70 119.23 3mtl s GLU 173 Ca 0.00 -1.27 -0.06 0.00 0.02 0.00 0.00 54.97 53.66 3mtl s GLU 173 Cb 0.00 0.03 -0.00 0.00 0.10 0.00 0.00 34.13 34.26 3mtl s GLU 173 CO 0.00 -0.07 0.45 0.20 0.02 0.00 0.00 175.26 175.86 3mtl s GLY 174 N -2.97 1.12 0.24 -1.39 0.00 0.83 -4.97 107.32 100.17 3mtl s GLY 174 Ca 0.09 -1.29 0.09 0.00 0.00 0.00 0.00 44.72 43.61 3mtl s GLY 174 CO -0.08 -0.89 1.55 -0.91 0.00 0.00 0.00 173.10 172.78 3mtl h THR 175 N 2.20 1.48 0.00 0.90 1.35 -2.02 -3.32 112.91 113.50 3mtl h THR 175 Ca -0.28 -2.31 -0.22 0.00 -0.55 0.00 0.00 66.41 63.05 3mtl h THR 175 Cb 1.24 2.24 -0.04 0.00 -1.73 0.00 0.00 68.15 69.87 3mtl h THR 175 CO 0.39 0.66 -1.96 -1.22 -0.25 0.00 0.00 175.52 173.14 3mtl n TYR 176 N -3.74 0.37 -3.57 4.73 4.02 -1.26 -4.97 117.16 112.74 3mtl n TYR 176 Ca -0.01 0.12 -0.11 0.00 -0.01 0.00 0.00 57.90 57.90 3mtl n TYR 176 Cb 0.67 -0.93 -0.03 0.00 -0.02 0.00 0.00 39.34 39.03 3mtl n TYR 176 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3mtl s ALA 177 N -2.86 -1.32 -0.01 -0.72 0.00 -1.25 -1.99 121.76 113.61 3mtl s ALA 177 Ca -0.07 0.17 0.07 0.00 0.00 0.00 0.00 51.96 52.12 3mtl s ALA 177 Cb 0.09 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 24.04 3mtl s ALA 177 CO 0.84 -0.79 -0.22 -0.08 0.00 0.00 0.00 175.76 175.51 3mtl s THR 178 N -3.80 1.75 -0.09 0.00 -1.32 -0.71 -0.12 115.64 111.34 3mtl s THR 178 Ca 0.04 -0.97 0.01 0.00 -1.21 0.00 0.00 61.69 59.56 3mtl s THR 178 Cb -0.01 -1.46 -0.02 0.00 -1.51 0.00 0.00 72.50 69.50 3mtl s THR 178 CO -0.08 0.47 -0.13 0.68 -2.21 0.00 0.00 174.62 173.35 3mtl s VAL 179 N -0.54 3.15 0.07 5.08 -7.23 -0.03 -0.32 120.40 120.57 3mtl s VAL 179 Ca 0.09 -0.66 0.07 0.00 -1.81 0.00 0.00 61.98 59.67 3mtl s VAL 179 Cb -0.09 -2.28 -0.03 0.00 0.56 0.00 0.00 36.38 34.54 3mtl s VAL 179 CO -0.01 0.56 -0.19 -0.31 -0.31 0.00 0.00 175.10 174.84 3mtl s TYR 180 N -0.20 1.62 0.28 2.82 2.02 -0.90 -0.78 117.35 122.22 3mtl s TYR 180 Ca 0.01 -0.40 -0.29 0.00 -0.37 0.00 0.00 57.07 56.02 3mtl s TYR 180 Cb -0.13 -0.93 -0.09 0.00 -0.40 0.00 0.00 41.96 40.40 3mtl s TYR 180 CO 0.03 0.12 1.06 0.21 -1.57 0.00 0.00 175.55 175.40 3mtl s LYS 181 N -1.50 4.64 0.25 -0.62 2.20 -0.12 -1.00 119.74 123.60 3mtl s LYS 181 Ca 0.05 1.71 0.01 0.00 -0.36 0.00 0.00 55.97 57.37 3mtl s LYS 181 Cb -0.09 -3.14 -0.05 0.00 -1.51 0.00 0.00 37.83 33.04 3mtl s LYS 181 CO 0.03 0.25 0.11 0.20 -0.36 0.00 0.00 175.35 175.57 3mtl s GLY 182 N -1.01 1.73 -0.04 5.54 0.00 0.50 -0.95 107.32 113.08 3mtl s GLY 182 Ca 0.45 -1.82 -0.06 0.00 0.00 0.00 0.00 44.72 43.29 3mtl s GLY 182 CO 0.38 -1.56 0.15 1.25 0.00 0.00 0.00 173.10 173.32 3mtl s LYS 183 N -4.03 0.30 0.09 2.90 2.20 -1.05 -0.87 119.74 119.28 3mtl s LYS 183 Ca 0.38 -0.03 -0.23 0.00 -0.36 0.00 0.00 55.97 55.73 3mtl s LYS 183 Cb 0.07 0.13 -0.07 0.00 -1.51 0.00 0.00 37.83 36.46 3mtl s LYS 183 CO 0.14 -0.06 0.69 0.45 -0.36 0.00 0.00 175.35 176.21 3mtl s SER 184 N -0.50 7.20 0.24 1.43 0.15 -0.62 -1.06 113.70 120.54 3mtl s SER 184 Ca -0.06 1.42 0.25 0.00 0.70 0.00 0.00 55.95 58.27 3mtl s SER 184 Cb -0.04 -2.43 0.86 0.00 -1.71 0.00 0.00 66.02 62.70 3mtl s SER 184 CO 0.01 0.17 1.76 0.07 1.20 0.00 0.00 173.24 176.45 3mtl h LYS 185 N 4.86 0.00 0.00 5.44 -0.00 -1.37 -2.34 116.57 123.16 3mtl h LYS 185 Ca -0.47 0.00 -0.21 0.00 -0.00 0.00 0.00 60.65 59.98 3mtl h LYS 185 Cb 1.21 0.00 -0.03 0.00 -0.00 0.00 0.00 32.23 33.41 3mtl h LYS 185 CO 0.67 0.00 -1.26 1.28 -0.00 0.00 0.00 179.45 180.14 3mtl n LEU 186 N -2.31 1.86 -0.02 7.07 4.77 -1.26 -4.68 117.00 122.44 3mtl n LEU 186 Ca 0.04 0.45 0.05 0.00 -0.03 0.00 0.00 56.01 56.53 3mtl n LEU 186 Cb 0.37 -0.92 -0.14 0.00 -2.33 0.00 0.00 43.42 40.39 3mtl n LEU 186 CO 0.27 0.14 -0.74 0.35 -1.33 0.00 0.00 177.39 176.08 3mtl n THR 187 N -4.45 0.50 -0.94 -5.08 -2.24 -1.26 -5.00 114.28 95.82 3mtl n THR 187 Ca -0.29 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 60.88 3mtl n THR 187 Cb 0.62 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 3mtl n THR 187 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3mtl n ASP 188 N -2.47 -1.89 -4.78 3.42 10.43 -0.88 -5.01 116.55 115.37 3mtl n ASP 188 Ca -0.11 0.00 -0.37 0.00 2.57 0.00 0.00 54.79 56.88 3mtl n ASP 188 Cb 0.73 -0.90 -0.03 0.00 1.84 0.00 0.00 41.12 42.76 3mtl n ASP 188 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 3mtl s ASN 189 N -2.37 6.59 0.33 -2.24 0.01 -1.26 -4.66 114.94 111.34 3mtl s ASN 189 Ca 0.00 2.12 -0.23 0.00 -0.71 0.00 0.00 52.86 54.03 3mtl s ASN 189 Cb 0.00 -2.59 -0.10 0.00 0.41 0.00 0.00 41.25 38.97 3mtl s ASN 189 CO 0.00 -0.61 0.90 -0.76 -1.51 0.00 0.00 177.10 175.12 3mtl s LEU 190 N -2.75 4.22 0.25 0.60 1.02 -1.26 -1.59 118.68 119.17 3mtl s LEU 190 Ca 0.59 1.70 0.01 0.00 0.02 0.00 0.00 54.13 56.45 3mtl s LEU 190 Cb -0.24 -4.08 -0.05 0.00 0.02 0.00 0.00 46.19 41.84 3mtl s LEU 190 CO 0.30 -0.13 0.11 0.68 0.02 0.00 0.00 176.35 177.32 3mtl s VAL 191 N -1.77 0.41 -0.13 -1.59 -7.23 -0.05 -4.27 120.40 105.77 3mtl s VAL 191 Ca 0.52 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.70 3mtl s VAL 191 Cb -0.15 -2.60 -0.01 0.00 0.56 0.00 0.00 36.38 34.18 3mtl s VAL 191 CO 0.20 0.00 -0.17 0.00 -0.31 0.00 0.00 175.10 174.83 3mtl s ALA 192 N -3.83 2.46 -0.55 1.32 0.00 0.09 -0.37 121.76 120.87 3mtl s ALA 192 Ca 0.38 -0.97 -0.10 0.00 0.00 0.00 0.00 51.96 51.26 3mtl s ALA 192 Cb 0.07 -1.12 0.14 0.00 0.00 0.00 0.00 23.12 22.22 3mtl s ALA 192 CO 0.14 0.15 0.45 -0.51 0.00 0.00 0.00 175.76 175.98 3mtl s LEU 193 N 0.53 5.90 -0.59 0.00 1.43 -0.17 0.20 118.68 125.97 3mtl s LEU 193 Ca -0.11 -2.10 -0.25 0.00 -1.03 0.00 0.00 54.13 50.64 3mtl s LEU 193 Cb -0.16 -2.06 0.04 0.00 0.03 0.00 0.00 46.19 44.04 3mtl s LEU 193 CO 0.04 -0.67 1.01 -0.75 0.23 0.00 0.00 176.35 176.21 3mtl s LYS 194 N 1.08 3.31 -0.61 1.70 2.20 0.66 -2.12 119.74 125.96 3mtl s LYS 194 Ca 0.08 -0.28 -0.27 0.00 -0.36 0.00 0.00 55.97 55.14 3mtl s LYS 194 Cb -0.24 -4.09 0.03 0.00 -1.51 0.00 0.00 37.83 32.03 3mtl s LYS 194 CO -0.02 -1.63 1.15 -2.00 -0.36 0.00 0.00 175.35 172.49 3mtl s GLU 195 N 4.29 3.39 -0.29 4.03 2.12 0.56 -1.06 118.70 131.74 3mtl s GLU 195 Ca 0.31 -0.01 -0.29 0.00 0.36 0.00 0.00 54.97 55.34 3mtl s GLU 195 Cb -0.12 -4.07 0.01 0.00 0.26 0.00 0.00 34.13 30.21 3mtl s GLU 195 CO 0.18 -1.74 1.18 0.42 -0.54 0.00 0.00 175.26 174.75 3mtl s ILE 196 N 4.86 4.36 -0.41 -3.70 1.01 -0.02 -1.74 121.20 125.55 3mtl s ILE 196 Ca 0.38 1.56 -0.28 0.00 0.00 0.00 0.00 60.65 62.31 3mtl s ILE 196 Cb -0.09 -4.27 0.00 0.00 0.01 0.00 0.00 42.46 38.11 3mtl s ILE 196 CO 0.21 -0.43 1.54 0.00 0.00 0.00 0.00 174.94 176.26 3mtl s ARG 197 N 3.81 3.44 0.00 2.79 1.04 -0.84 -3.98 118.95 125.20 3mtl s ARG 197 Ca 0.50 1.00 0.00 0.00 -1.04 0.00 0.00 55.73 56.20 3mtl s ARG 197 Cb -0.15 -4.10 0.00 0.00 -2.04 0.00 0.00 34.95 28.66 3mtl s ARG 197 CO 0.18 -1.73 0.00 1.28 -0.04 0.00 0.00 175.30 174.98 3mtl n LEU 198 N 9.46 0.00 -0.13 -1.89 4.77 -1.26 -4.83 117.00 123.12 3mtl n LEU 198 Ca 0.18 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 56.03 3mtl n LEU 198 Cb 0.48 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.48 3mtl n LEU 198 CO 0.70 -0.09 0.52 1.55 -1.33 0.00 0.00 177.39 178.74 3mtl h PRO 205 N 0.00 -0.37 -6.17 3.23 0.13 -2.07 -3.48 132.00 123.27 3mtl h PRO 205 Ca 0.00 0.03 -0.66 0.00 -0.87 0.00 0.00 66.00 64.50 3mtl h PRO 205 Cb 0.00 0.08 -0.13 0.00 0.13 0.00 0.00 31.00 31.09 3mtl h PRO 205 CO 0.00 -0.25 -0.63 0.00 -0.23 0.00 0.00 178.00 176.89 3mtl s THR 207 N -1.15 1.13 -0.13 0.00 2.01 -1.26 -5.12 115.64 111.11 3mtl s THR 207 Ca 0.22 -0.40 -0.27 0.00 0.31 0.00 0.00 61.69 61.55 3mtl s THR 207 Cb -0.12 -1.09 -0.02 0.00 0.01 0.00 0.00 72.50 71.29 3mtl s THR 207 CO 0.13 0.37 0.88 0.00 -0.69 0.00 0.00 174.62 175.31 3mtl s ALA 208 N 1.26 3.45 -0.26 7.40 0.00 -1.26 -5.04 121.76 127.32 3mtl s ALA 208 Ca -0.03 0.17 -0.10 0.00 0.00 0.00 0.00 51.96 52.00 3mtl s ALA 208 Cb -0.14 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 3mtl s ALA 208 CO -0.04 -0.56 0.14 0.42 0.00 0.00 0.00 175.76 175.72 3mtl s ILE 209 N 1.93 4.99 -1.47 0.00 -1.09 -1.26 -4.99 121.20 119.30 3mtl s ILE 209 Ca 0.42 0.06 0.12 0.00 -2.23 0.00 0.00 60.65 59.02 3mtl s ILE 209 Cb -0.17 -3.35 0.13 0.00 -1.58 0.00 0.00 42.46 37.49 3mtl s ILE 209 CO 0.15 0.30 0.95 0.54 -1.23 0.00 0.00 174.94 175.65 3mtl n ARG 210 N 4.87 1.04 -1.06 2.79 5.12 -1.26 -5.01 116.66 123.14 3mtl n ARG 210 Ca -0.15 -1.37 -0.41 0.00 -1.93 0.00 0.00 57.85 53.99 3mtl n ARG 210 Cb 0.52 -1.25 -0.06 0.00 -1.16 0.00 0.00 32.46 30.51 3mtl n ARG 210 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3mtl n GLU 211 N 0.69 0.00 0.24 5.56 -0.58 -1.26 -4.72 120.64 120.57 3mtl n GLU 211 Ca 0.08 0.00 0.09 0.00 -0.42 0.00 0.00 57.16 56.91 3mtl n GLU 211 Cb 0.33 -0.92 0.61 0.00 -0.57 0.00 0.00 31.44 30.89 3mtl n GLU 211 CO 0.00 0.00 0.00 -0.24 -0.48 0.00 0.00 177.13 176.41 3mtl h VAL 212 N 2.98 0.80 0.00 2.62 3.04 -1.97 -0.56 116.25 123.16 3mtl h VAL 212 Ca -0.27 -0.69 0.00 0.00 -1.01 0.00 0.00 66.70 64.73 3mtl h VAL 212 Cb 0.84 1.41 0.00 0.00 -2.01 0.00 0.00 31.29 31.53 3mtl h VAL 212 CO 0.59 0.17 0.00 0.77 -1.01 0.00 0.00 177.57 178.09 3mtl h SER 213 N 0.00 0.00 0.00 3.17 4.64 -1.88 -2.10 113.55 117.38 3mtl h SER 213 Ca -0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 3mtl h SER 213 Cb 0.40 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.42 3mtl h SER 213 CO 0.02 0.00 -2.40 0.18 -0.87 0.00 0.00 176.83 173.76 3mtl n LEU 214 N -2.64 2.64 -0.22 5.97 4.77 -0.76 -4.49 117.00 122.27 3mtl n LEU 214 Ca 0.03 -0.12 0.14 0.00 -0.03 0.00 0.00 56.01 56.03 3mtl n LEU 214 Cb 0.36 -0.71 0.60 0.00 -2.33 0.00 0.00 43.42 41.34 3mtl n LEU 214 CO 0.27 0.87 0.87 0.18 -1.33 0.00 0.00 177.39 178.25 3mtl n LEU 215 N -3.17 0.76 0.00 2.23 4.77 -0.29 -4.87 117.00 116.43 3mtl n LEU 215 Ca -0.42 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 3mtl n LEU 215 Cb 0.98 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.98 3mtl n LEU 215 CO 0.27 0.13 0.00 0.29 -1.33 0.00 0.00 177.39 176.75 3mtl n LYS 216 N -0.61 0.37 -2.73 3.23 5.02 -0.79 -5.04 118.16 117.60 3mtl n LYS 216 Ca 0.17 0.00 -0.05 0.00 -2.02 0.00 0.00 58.31 56.41 3mtl n LYS 216 Cb 0.28 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.32 3mtl n LYS 216 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3mtl n ASP 217 N 0.00 -2.80 -3.95 4.39 5.68 -1.26 -4.79 116.55 113.81 3mtl n ASP 217 Ca 0.00 -2.53 -0.39 0.00 -0.50 0.00 0.00 54.79 51.38 3mtl n ASP 217 Cb 0.00 1.50 -0.06 0.00 -1.14 0.00 0.00 41.12 41.42 3mtl n ASP 217 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3mtl n LEU 218 N 2.51 3.81 -4.45 -2.12 4.77 -1.26 -4.87 117.00 115.39 3mtl n LEU 218 Ca 0.14 -3.02 -0.44 0.00 -0.03 0.00 0.00 56.01 52.66 3mtl n LEU 218 Cb 0.60 -1.33 -0.01 0.00 -2.33 0.00 0.00 43.42 40.34 3mtl n LEU 218 CO -0.03 -0.80 1.13 -0.54 -1.33 0.00 0.00 177.39 175.81 3mtl s LYS 219 N 5.43 3.81 -0.01 3.23 -0.14 -1.26 -4.81 119.74 125.99 3mtl s LYS 219 Ca 0.61 -2.15 -0.02 0.00 -1.36 0.00 0.00 55.97 53.05 3mtl s LYS 219 Cb 0.09 -4.95 0.00 0.00 -1.68 0.00 0.00 37.83 31.29 3mtl s LYS 219 CO 0.12 -1.74 0.05 -1.58 -0.76 0.00 0.00 175.35 171.43 3mtl s HIS 220 N 2.08 -0.00 -0.13 3.18 5.04 -1.26 -4.47 115.29 119.72 3mtl s HIS 220 Ca 0.36 0.02 0.17 0.00 -1.54 0.00 0.00 55.06 54.07 3mtl s HIS 220 Cb -0.04 -0.02 0.92 0.00 0.04 0.00 0.00 32.58 33.48 3mtl s HIS 220 CO -0.06 -0.07 1.47 0.00 -2.34 0.00 0.00 174.74 173.74 3mtl n ALA 221 N 2.72 0.84 -1.60 1.58 0.00 -0.28 -1.93 120.51 121.85 3mtl n ALA 221 Ca -0.15 0.16 0.06 0.00 0.00 0.00 0.00 53.44 53.51 3mtl n ALA 221 Cb 0.59 -1.06 0.19 0.00 0.00 0.00 0.00 19.45 19.17 3mtl n ALA 221 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3mtl n ASN 222 N -2.13 1.73 -3.99 0.00 4.13 -1.26 -4.86 115.26 108.88 3mtl n ASN 222 Ca -0.01 -3.70 -0.19 0.00 1.68 0.00 0.00 54.58 52.36 3mtl n ASN 222 Cb 0.16 -0.50 -0.15 0.00 -1.54 0.00 0.00 39.78 37.75 3mtl n ASN 222 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3mtl s ILE 223 N -2.99 0.69 0.35 2.41 1.01 -0.81 -1.90 121.20 119.96 3mtl s ILE 223 Ca 0.37 -0.32 -0.28 0.00 0.00 0.00 0.00 60.65 60.41 3mtl s ILE 223 Cb 0.36 -0.61 -0.12 0.00 0.01 0.00 0.00 42.46 42.10 3mtl s ILE 223 CO -0.06 0.22 1.43 1.33 0.00 0.00 0.00 174.94 177.85 3mtl n VAL 224 N 3.24 1.84 -3.51 2.92 0.24 -0.92 -4.67 118.33 117.46 3mtl n VAL 224 Ca -0.17 -0.46 -0.37 0.00 -2.04 0.00 0.00 64.34 61.29 3mtl n VAL 224 Cb 0.55 -1.82 -0.08 0.00 -1.47 0.00 0.00 33.84 31.02 3mtl n VAL 224 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3mtl s THR 225 N -0.93 5.28 0.02 3.34 2.01 -1.26 -4.94 115.64 119.15 3mtl s THR 225 Ca 0.56 0.48 -0.30 0.00 0.31 0.00 0.00 61.69 62.74 3mtl s THR 225 Cb -0.52 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 3mtl s THR 225 CO 0.61 0.31 1.02 -0.22 -0.69 0.00 0.00 174.62 175.64 3mtl s LEU 226 N 1.09 4.38 -0.12 4.42 2.96 -1.26 -1.81 118.68 128.35 3mtl s LEU 226 Ca 0.14 1.74 0.04 0.00 -0.22 0.00 0.00 54.13 55.83 3mtl s LEU 226 Cb -0.14 -3.57 -0.10 0.00 0.50 0.00 0.00 46.19 42.88 3mtl s LEU 226 CO 0.06 -0.27 -0.06 1.41 -1.32 0.00 0.00 176.35 176.17 3mtl n HIS 227 N 3.77 0.00 -3.74 5.38 8.25 0.78 -4.99 115.22 124.68 3mtl n HIS 227 Ca 0.06 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.42 3mtl n HIS 227 Cb 0.50 -0.51 -0.04 0.00 1.12 0.00 0.00 29.99 31.06 3mtl n HIS 227 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3mtl s ASP 228 N -4.88 -0.22 -0.05 0.41 2.15 -0.95 -5.00 116.67 108.13 3mtl s ASP 228 Ca -0.13 -0.49 0.02 0.00 0.43 0.00 0.00 52.55 52.38 3mtl s ASP 228 Cb 0.04 0.54 0.01 0.00 -0.30 0.00 0.00 42.92 43.21 3mtl s ASP 228 CO 0.35 -0.99 -0.09 -0.63 -0.17 0.00 0.00 175.17 173.64 3mtl s ILE 229 N -3.87 0.91 -0.09 4.11 1.01 -1.26 -0.75 121.20 121.26 3mtl s ILE 229 Ca 0.09 -0.36 0.04 0.00 0.00 0.00 0.00 60.65 60.42 3mtl s ILE 229 Cb 0.00 -0.85 -0.00 0.00 0.01 0.00 0.00 42.46 41.62 3mtl s ILE 229 CO -0.05 0.30 -0.24 -0.63 0.00 0.00 0.00 174.94 174.32 3mtl s ILE 230 N 0.67 2.04 -0.17 2.92 1.01 0.40 -4.98 121.20 123.09 3mtl s ILE 230 Ca -0.12 -1.02 -0.04 0.00 0.00 0.00 0.00 60.65 59.46 3mtl s ILE 230 Cb -0.15 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.54 3mtl s ILE 230 CO 0.02 0.56 -0.02 -2.28 0.00 0.00 0.00 174.94 173.22 3mtl s HIS 231 N 0.24 3.04 0.27 3.97 5.65 -1.26 -0.90 115.29 126.30 3mtl s HIS 231 Ca -0.16 -0.33 0.11 0.00 0.25 0.00 0.00 55.06 54.93 3mtl s HIS 231 Cb -0.17 -2.01 -0.05 0.00 -1.18 0.00 0.00 32.58 29.17 3mtl s HIS 231 CO 0.08 -0.09 -0.18 0.95 -0.65 0.00 0.00 174.74 174.85 3mtl s THR 232 N 0.57 2.26 0.43 0.89 -4.23 -0.24 -4.94 115.64 110.38 3mtl s THR 232 Ca -0.02 -2.34 0.32 0.00 -1.18 0.00 0.00 61.69 58.47 3mtl s THR 232 Cb -0.14 -2.26 0.34 0.00 1.34 0.00 0.00 72.50 71.78 3mtl s THR 232 CO 0.02 -0.43 2.13 1.05 -0.54 0.00 0.00 174.62 176.85 3mtl h GLU 233 N 2.33 0.00 0.00 3.99 9.09 -2.06 -3.07 114.58 124.86 3mtl h GLU 233 Ca -0.40 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.01 3mtl h GLU 233 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.35 3mtl h GLU 233 CO 0.61 0.07 -1.49 0.36 0.05 0.00 0.00 179.01 178.62 3mtl n LYS 234 N -3.48 0.82 -4.01 1.06 2.85 -1.26 -5.07 118.16 109.08 3mtl n LYS 234 Ca -0.02 -0.11 -0.11 0.00 -1.05 0.00 0.00 58.31 57.02 3mtl n LYS 234 Cb 0.20 -1.36 -0.04 0.00 -0.65 0.00 0.00 35.03 33.18 3mtl n LYS 234 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 3mtl s SER 235 N -3.54 0.23 -0.16 -5.58 1.04 -1.16 -4.64 113.70 99.89 3mtl s SER 235 Ca -0.03 -1.13 -0.01 0.00 0.48 0.00 0.00 55.95 55.26 3mtl s SER 235 Cb 0.11 0.64 0.04 0.00 0.10 0.00 0.00 66.02 66.91 3mtl s SER 235 CO 0.69 -1.25 -0.04 -0.22 0.98 0.00 0.00 173.24 173.39 3mtl s LEU 236 N -3.09 1.47 -0.22 2.42 2.96 -1.26 -1.08 118.68 119.89 3mtl s LEU 236 Ca 0.24 -0.61 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 3mtl s LEU 236 Cb -0.01 -0.84 -0.02 0.00 0.50 0.00 0.00 46.19 45.82 3mtl s LEU 236 CO 0.13 -0.19 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.06 3mtl s THR 237 N 1.68 3.66 -0.23 3.68 2.01 -0.08 -0.84 115.64 125.52 3mtl s THR 237 Ca 0.01 -0.40 -0.15 0.00 0.31 0.00 0.00 61.69 61.46 3mtl s THR 237 Cb -0.15 -2.67 -0.04 0.00 0.01 0.00 0.00 72.50 69.65 3mtl s THR 237 CO -0.08 0.41 0.38 -0.76 -0.69 0.00 0.00 174.62 173.89 3mtl s LEU 238 N 1.36 4.11 -0.37 4.42 1.02 -0.22 -0.45 118.68 128.54 3mtl s LEU 238 Ca 0.04 0.42 -0.14 0.00 0.02 0.00 0.00 54.13 54.47 3mtl s LEU 238 Cb -0.14 -2.47 -0.00 0.00 0.02 0.00 0.00 46.19 43.60 3mtl s LEU 238 CO -0.01 -0.12 0.31 -0.69 0.02 0.00 0.00 176.35 175.86 3mtl s VAL 239 N 1.61 5.23 0.46 -1.59 1.01 0.07 -0.24 120.40 126.95 3mtl s VAL 239 Ca 0.17 -0.32 0.07 0.00 0.00 0.00 0.00 61.98 61.90 3mtl s VAL 239 Cb -0.15 -3.84 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 3mtl s VAL 239 CO 0.08 -0.17 0.32 -0.36 0.00 0.00 0.00 175.10 174.97 3mtl s PHE 240 N 1.81 2.31 0.60 5.22 0.40 0.13 -0.15 117.98 128.29 3mtl s PHE 240 Ca 0.07 -0.65 -0.17 0.00 -0.60 0.00 0.00 56.93 55.59 3mtl s PHE 240 Cb -0.18 -2.01 -0.03 0.00 0.51 0.00 0.00 43.02 41.31 3mtl s PHE 240 CO 0.11 -0.13 1.09 -1.83 0.70 0.00 0.00 175.22 175.15 3mtl s GLU 241 N -4.10 3.19 -0.08 0.44 -1.05 -0.75 -0.73 118.70 115.61 3mtl s GLU 241 Ca 0.40 1.37 0.00 0.00 -0.15 0.00 0.00 54.97 56.60 3mtl s GLU 241 Cb -0.00 -2.00 -0.03 0.00 -0.44 0.00 0.00 34.13 31.65 3mtl s GLU 241 CO 0.24 -0.94 -0.07 -0.47 0.95 0.00 0.00 175.26 174.97 3mtl s TYR 242 N -2.22 2.95 -0.08 4.83 6.14 -1.26 -4.19 117.35 123.51 3mtl s TYR 242 Ca 0.67 -0.03 0.01 0.00 0.64 0.00 0.00 57.07 58.36 3mtl s TYR 242 Cb -0.19 -1.74 0.02 0.00 0.42 0.00 0.00 41.96 40.46 3mtl s TYR 242 CO 0.35 0.27 -0.10 -0.51 0.64 0.00 0.00 175.55 176.20 3mtl s LEU 243 N -0.64 1.48 0.21 6.97 1.02 -1.26 -4.99 118.68 121.47 3mtl s LEU 243 Ca 0.10 -0.30 0.25 0.00 0.02 0.00 0.00 54.13 54.20 3mtl s LEU 243 Cb -0.12 -0.82 0.90 0.00 0.02 0.00 0.00 46.19 46.17 3mtl s LEU 243 CO 0.02 -0.02 1.74 -0.90 0.02 0.00 0.00 176.35 177.21 3mtl n ASP 244 N 4.23 0.67 -3.85 2.29 3.85 -1.26 -4.84 116.55 117.64 3mtl n ASP 244 Ca -0.19 0.61 -0.12 0.00 -0.71 0.00 0.00 54.79 54.37 3mtl n ASP 244 Cb 0.51 -0.77 -0.13 0.00 -1.35 0.00 0.00 41.12 39.38 3mtl n ASP 244 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3mtl s LYS 245 N -3.19 0.16 0.32 0.11 1.02 -1.23 -5.06 119.74 111.87 3mtl s LYS 245 Ca 0.08 0.04 0.01 0.00 0.02 0.00 0.00 55.97 56.12 3mtl s LYS 245 Cb 0.11 0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 37.46 3mtl s LYS 245 CO 0.49 -0.03 0.52 0.16 -0.92 0.00 0.00 175.35 175.57 3mtl s ASP 246 N -0.18 6.31 0.33 2.83 1.47 -1.26 -0.23 116.67 125.95 3mtl s ASP 246 Ca -0.02 0.42 0.11 0.00 1.18 0.00 0.00 52.55 54.23 3mtl s ASP 246 Cb -0.02 -2.02 0.91 0.00 -0.34 0.00 0.00 42.92 41.45 3mtl s ASP 246 CO 0.00 -0.25 1.75 0.25 0.68 0.00 0.00 175.17 177.60 3mtl h LEU 247 N 0.94 0.64 -0.28 2.11 5.85 -0.78 0.29 115.31 124.08 3mtl h LEU 247 Ca -0.50 0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.30 3mtl h LEU 247 Cb 1.22 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 42.25 3mtl h LEU 247 CO 0.62 0.13 0.03 0.11 -0.34 0.00 0.00 178.44 178.99 3mtl h LYS 248 N 0.57 0.48 -0.81 1.25 1.79 -1.85 -1.14 116.57 116.86 3mtl h LYS 248 Ca 0.62 -0.14 -0.03 0.00 -2.18 0.00 0.00 60.65 58.92 3mtl h LYS 248 Cb 1.23 -0.05 -0.04 0.00 -1.58 0.00 0.00 32.23 31.79 3mtl h LYS 248 CO -0.42 0.61 0.40 1.96 -1.08 0.00 0.00 179.45 180.92 3mtl h GLN 249 N 0.29 1.16 -0.21 3.15 4.20 -1.45 -1.61 115.11 120.63 3mtl h GLN 249 Ca 0.08 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 3mtl h GLN 249 Cb 0.38 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 3mtl h GLN 249 CO 0.01 0.89 0.05 -0.92 -0.67 0.00 0.00 178.83 178.19 3mtl h TYR 250 N 1.14 0.34 0.47 2.96 3.20 -0.92 -1.25 116.97 122.92 3mtl h TYR 250 Ca 0.28 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.10 3mtl h TYR 250 Cb 0.11 -0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.26 3mtl h TYR 250 CO 0.01 0.44 -0.48 -0.07 -1.64 0.00 0.00 178.16 176.42 3mtl h LEU 251 N 0.15 -1.32 -1.29 2.82 3.38 -1.01 -2.83 115.31 115.21 3mtl h LEU 251 Ca 0.06 0.11 0.15 0.00 0.09 0.00 0.00 57.88 58.29 3mtl h LEU 251 Cb 0.26 0.44 -0.07 0.00 0.09 0.00 0.00 40.66 41.38 3mtl h LEU 251 CO 0.00 -0.64 0.58 -0.78 0.09 0.00 0.00 178.44 177.69 3mtl h ASP 252 N -0.96 0.64 0.03 -0.43 1.82 -1.28 0.34 116.42 116.58 3mtl h ASP 252 Ca -0.05 0.04 -0.08 0.00 -0.39 0.00 0.00 57.03 56.54 3mtl h ASP 252 Cb 0.84 -0.08 -0.01 0.00 0.68 0.00 0.00 39.33 40.76 3mtl h ASP 252 CO -0.07 0.32 -0.25 0.44 -1.61 0.00 0.00 179.24 178.07 3mtl h ASP 253 N 0.68 0.36 -0.60 2.28 3.45 -0.98 -2.84 116.42 118.76 3mtl h ASP 253 Ca 0.46 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.80 3mtl h ASP 253 Cb 0.76 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.43 3mtl h ASP 253 CO -0.21 0.61 0.00 0.00 -1.57 0.00 0.00 179.24 178.07 3mtl n GLY 255 N 0.80 -0.03 2.40 0.00 0.00 -1.07 -3.43 105.19 103.84 3mtl n GLY 255 Ca 0.27 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 3mtl n GLY 255 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3mtl n ASN 256 N -0.28 -4.65 -3.88 1.61 3.02 0.12 -4.96 115.26 106.23 3mtl n ASN 256 Ca -0.10 0.33 -0.30 0.00 -0.03 0.00 0.00 54.58 54.48 3mtl n ASN 256 Cb 0.59 -3.38 -0.14 0.00 -0.61 0.00 0.00 39.78 36.24 3mtl n ASN 256 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3mtl s ILE 257 N -2.52 2.25 0.03 2.41 -1.09 -1.22 -3.81 121.20 117.24 3mtl s ILE 257 Ca 0.00 -3.09 -0.23 0.00 -2.23 0.00 0.00 60.65 55.09 3mtl s ILE 257 Cb 0.00 -2.57 -0.05 0.00 -1.58 0.00 0.00 42.46 38.26 3mtl s ILE 257 CO 0.00 -0.82 0.71 -0.63 -1.23 0.00 0.00 174.94 172.97 3mtl s ILE 258 N -0.09 4.80 0.16 2.92 1.01 -1.26 -4.90 121.20 123.83 3mtl s ILE 258 Ca 0.17 1.50 -0.34 0.00 0.00 0.00 0.00 60.65 61.98 3mtl s ILE 258 Cb -0.25 -4.05 -0.14 0.00 0.01 0.00 0.00 42.46 38.02 3mtl s ILE 258 CO -0.00 0.38 1.54 -3.20 0.00 0.00 0.00 174.94 173.66 3mtl n ASN 259 N 2.81 2.91 -0.27 3.58 2.85 -1.26 -4.82 115.26 121.06 3mtl n ASN 259 Ca -0.04 1.09 0.05 0.00 -0.11 0.00 0.00 54.58 55.57 3mtl n ASN 259 Cb 0.50 -1.40 0.19 0.00 1.24 0.00 0.00 39.78 40.31 3mtl n ASN 259 CO 0.00 0.00 0.00 0.24 -2.11 0.00 0.00 177.26 175.39 3mtl h MET 260 N 5.67 0.51 -0.94 1.20 2.86 -1.96 -1.90 114.93 120.37 3mtl h MET 260 Ca -0.45 -0.03 0.08 0.00 -2.06 0.00 0.00 59.70 57.24 3mtl h MET 260 Cb 1.26 -0.12 -0.07 0.00 0.06 0.00 0.00 31.60 32.74 3mtl h MET 260 CO 0.87 0.34 0.59 1.25 1.06 0.00 0.00 176.91 181.02 3mtl h HIS 261 N 0.53 1.08 -0.58 -0.22 -0.00 -2.00 -2.09 115.15 111.87 3mtl h HIS 261 Ca 0.42 0.03 -0.09 0.00 -0.00 0.00 0.00 60.37 60.73 3mtl h HIS 261 Cb 0.59 -0.35 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 3mtl h HIS 261 CO -0.13 0.50 0.01 -0.91 -0.00 0.00 0.00 177.93 177.40 3mtl h ASN 262 N 1.02 1.00 -0.57 3.26 2.35 -1.72 -2.61 115.58 118.31 3mtl h ASN 262 Ca 0.43 -0.30 0.11 0.00 -0.55 0.00 0.00 56.30 55.99 3mtl h ASN 262 Cb 0.29 -0.27 -0.09 0.00 0.05 0.00 0.00 38.32 38.31 3mtl h ASN 262 CO -0.21 1.06 0.09 0.58 -1.65 0.00 0.00 177.43 177.30 3mtl h VAL 263 N 0.92 0.63 -0.63 2.81 2.07 -0.86 0.34 116.25 121.52 3mtl h VAL 263 Ca 0.17 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 67.60 3mtl h VAL 263 Cb 0.54 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 3mtl h VAL 263 CO 0.03 0.04 0.36 0.50 0.02 0.00 0.00 177.57 178.52 3mtl h LYS 264 N 0.22 0.88 -0.32 1.57 3.64 -1.46 0.11 116.57 121.21 3mtl h LYS 264 Ca 0.30 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.43 3mtl h LYS 264 Cb 0.44 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3mtl h LYS 264 CO -0.41 0.65 -0.41 -0.07 -2.27 0.00 0.00 179.45 176.94 3mtl h LEU 265 N 0.86 0.85 -0.36 5.20 3.38 -0.86 -1.08 115.31 123.29 3mtl h LEU 265 Ca 0.22 -0.39 -0.12 0.00 0.09 0.00 0.00 57.88 57.68 3mtl h LEU 265 Cb 0.02 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3mtl h LEU 265 CO -0.04 1.15 -0.26 -0.26 0.09 0.00 0.00 178.44 179.12 3mtl h PHE 266 N 0.64 0.96 -0.42 1.13 0.04 -0.20 -2.62 116.94 116.47 3mtl h PHE 266 Ca 0.05 -0.26 -0.04 0.00 2.80 0.00 0.00 57.97 60.51 3mtl h PHE 266 Cb 0.97 -0.21 -0.02 0.00 2.20 0.00 0.00 35.95 38.89 3mtl h PHE 266 CO 0.05 1.04 0.09 1.25 -0.60 0.00 0.00 178.31 180.14 3mtl h LEU 267 N 0.61 0.65 -0.49 1.54 5.85 -0.69 -1.56 115.31 121.22 3mtl h LEU 267 Ca 0.07 -0.24 0.01 0.00 0.84 0.00 0.00 57.88 58.56 3mtl h LEU 267 Cb 0.83 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 3mtl h LEU 267 CO 0.07 0.73 0.31 0.15 -0.34 0.00 0.00 178.44 179.36 3mtl h PHE 268 N 0.55 0.59 -0.18 1.25 3.57 -1.17 -1.62 116.94 119.94 3mtl h PHE 268 Ca 0.13 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.65 3mtl h PHE 268 Cb 0.34 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 3mtl h PHE 268 CO 0.02 0.36 0.12 1.96 -2.23 0.00 0.00 178.31 178.54 3mtl h GLN 269 N 0.64 0.23 -0.70 1.11 4.20 -1.37 -1.51 115.11 117.72 3mtl h GLN 269 Ca 0.19 -0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.86 3mtl h GLN 269 Cb -0.04 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.65 3mtl h GLN 269 CO -0.06 0.15 0.33 1.25 -0.67 0.00 0.00 178.83 179.84 3mtl h LEU 270 N 0.24 0.90 -1.11 1.46 5.85 -1.03 -1.69 115.31 119.93 3mtl h LEU 270 Ca 0.07 -0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.60 3mtl h LEU 270 Cb -0.02 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.77 3mtl h LEU 270 CO -0.02 0.76 -0.43 -0.07 -0.34 0.00 0.00 178.44 178.34 3mtl h LEU 271 N 0.99 0.00 0.48 2.25 3.38 -1.00 -2.58 115.31 118.83 3mtl h LEU 271 Ca 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 3mtl h LEU 271 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 3mtl h LEU 271 CO -0.03 0.43 -0.23 0.03 0.09 0.00 0.00 178.44 178.73 3mtl h ARG 272 N 0.00 -0.62 -0.57 1.13 3.08 -0.36 -1.44 114.38 115.60 3mtl h ARG 272 Ca -0.00 0.04 0.10 0.00 0.07 0.00 0.00 59.98 60.19 3mtl h ARG 272 Cb 0.79 0.14 -0.08 0.00 0.08 0.00 0.00 29.97 30.90 3mtl h ARG 272 CO 0.06 -0.32 0.12 0.78 -1.07 0.00 0.00 179.97 179.54 3mtl h GLY 273 N -1.02 0.71 0.88 0.04 0.00 -1.46 -1.57 103.07 100.66 3mtl h GLY 273 Ca -0.07 -0.03 -0.05 0.00 0.00 0.00 0.00 47.33 47.19 3mtl h GLY 273 CO 0.11 -0.09 0.00 1.41 0.00 0.00 0.00 176.54 177.97 3mtl h LEU 274 N 0.26 0.52 -2.43 3.11 3.38 -1.54 -1.91 115.31 116.69 3mtl h LEU 274 Ca 0.29 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3mtl h LEU 274 Cb 0.42 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 3mtl h LEU 274 CO -0.37 0.70 -0.03 0.00 0.09 0.00 0.00 178.44 178.82 3mtl h ALA 275 N 0.84 1.29 0.09 1.53 0.00 -0.69 -0.54 119.26 121.78 3mtl h ALA 275 Ca 0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 3mtl h ALA 275 Cb 0.43 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.23 3mtl h ALA 275 CO 0.01 0.04 -0.51 -0.92 0.00 0.00 0.00 179.25 177.87 3mtl h TYR 276 N 0.00 0.34 -0.04 0.00 3.20 -0.99 -2.87 116.97 116.61 3mtl h TYR 276 Ca -0.00 -0.25 0.04 0.00 3.14 0.00 0.00 58.73 61.66 3mtl h TYR 276 Cb 0.11 -0.01 -0.05 0.00 1.54 0.00 0.00 36.73 38.31 3mtl h TYR 276 CO 0.00 1.19 -0.26 0.00 -1.64 0.00 0.00 178.16 177.45 3mtl h HIS 278 N -0.37 0.51 -0.96 0.00 3.86 -1.09 0.42 115.15 117.52 3mtl h HIS 278 Ca 0.08 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.32 3mtl h HIS 278 Cb 0.48 -0.14 -0.05 0.00 1.06 0.00 0.00 27.41 28.76 3mtl h HIS 278 CO -0.31 0.20 0.63 -0.09 0.86 0.00 0.00 177.93 179.22 3mtl h ARG 279 N 0.52 1.25 -0.09 2.45 2.43 -1.17 -1.45 114.38 118.31 3mtl h ARG 279 Ca 0.29 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 3mtl h ARG 279 Cb 0.28 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3mtl h ARG 279 CO -0.24 0.83 0.00 1.04 -1.51 0.00 0.00 179.97 180.09 3mtl n GLN 280 N -4.43 1.27 -2.90 0.20 6.02 0.03 -4.92 117.38 112.66 3mtl n GLN 280 Ca 0.11 -0.41 -0.20 0.00 -0.01 0.00 0.00 57.00 56.49 3mtl n GLN 280 Cb 0.02 -1.23 0.03 0.00 1.02 0.00 0.00 30.24 30.08 3mtl n GLN 280 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3mtl n LYS 281 N -0.29 -4.24 -4.21 -1.09 4.01 -0.22 -5.02 118.16 107.10 3mtl n LYS 281 Ca 0.10 0.84 -0.35 0.00 -0.51 0.00 0.00 58.31 58.40 3mtl n LYS 281 Cb 0.13 -5.53 -0.10 0.00 -0.51 0.00 0.00 35.03 29.03 3mtl n LYS 281 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 3mtl s VAL 282 N -3.11 4.53 0.18 -0.18 1.01 0.13 -2.57 120.40 120.38 3mtl s VAL 282 Ca 0.25 -0.15 0.10 0.00 0.00 0.00 0.00 61.98 62.18 3mtl s VAL 282 Cb -0.11 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3mtl s VAL 282 CO 0.31 0.55 -0.15 -0.76 0.00 0.00 0.00 175.10 175.05 3mtl s LEU 283 N -0.35 2.77 -0.42 3.92 1.43 0.16 -3.26 118.68 122.94 3mtl s LEU 283 Ca 0.08 -0.67 -0.14 0.00 -1.03 0.00 0.00 54.13 52.38 3mtl s LEU 283 Cb -0.12 -1.49 0.04 0.00 0.03 0.00 0.00 46.19 44.65 3mtl s LEU 283 CO 0.02 0.12 0.29 -2.28 0.23 0.00 0.00 176.35 174.73 3mtl s HIS 284 N -1.62 3.25 0.06 0.29 2.46 -1.26 -0.18 115.29 118.29 3mtl s HIS 284 Ca 0.23 -0.84 0.19 0.00 0.47 0.00 0.00 55.06 55.11 3mtl s HIS 284 Cb -0.09 -2.71 0.58 0.00 -0.13 0.00 0.00 32.58 30.24 3mtl s HIS 284 CO 0.13 -0.67 1.68 0.00 -2.47 0.00 0.00 174.74 173.41 3mtl h ARG 285 N 8.59 0.00 -1.30 2.88 -0.00 -1.65 -3.39 114.38 119.51 3mtl h ARG 285 Ca -0.27 0.00 -0.44 0.00 -0.50 0.00 0.00 59.98 58.77 3mtl h ARG 285 Cb 1.11 0.00 -0.30 0.00 0.00 0.00 0.00 29.97 30.78 3mtl h ARG 285 CO 0.75 0.36 -0.89 -3.47 0.00 0.00 0.00 179.97 176.71 3mtl n ASP 286 N -3.40 -0.90 -4.70 7.04 4.64 -1.26 -5.12 116.55 112.85 3mtl n ASP 286 Ca 0.01 -2.91 -0.42 0.00 -1.38 0.00 0.00 54.79 50.08 3mtl n ASP 286 Cb 0.55 0.23 -0.03 0.00 -1.04 0.00 0.00 41.12 40.83 3mtl n ASP 286 CO 0.00 0.00 0.00 -0.22 -0.82 0.00 0.00 177.20 176.16 3mtl s LEU 287 N -1.04 4.34 0.04 -2.67 2.96 -1.26 -4.92 118.68 116.13 3mtl s LEU 287 Ca 0.34 2.03 -0.27 0.00 -0.22 0.00 0.00 54.13 56.01 3mtl s LEU 287 Cb 0.19 -3.57 0.08 0.00 0.50 0.00 0.00 46.19 43.39 3mtl s LEU 287 CO -0.16 -0.58 0.71 -1.59 -1.32 0.00 0.00 176.35 173.41 3mtl s LYS 288 N 1.63 1.08 0.49 1.98 -2.85 -1.26 -4.80 119.74 116.00 3mtl s LYS 288 Ca 0.60 -0.16 0.37 0.00 -1.00 0.00 0.00 55.97 55.78 3mtl s LYS 288 Cb -0.30 0.50 1.52 0.00 -2.06 0.00 0.00 37.83 37.49 3mtl s LYS 288 CO 0.27 -0.42 1.66 -1.35 0.10 0.00 0.00 175.35 175.61 3mtl h PRO 289 N 2.37 0.07 0.00 1.78 0.11 -1.95 -1.01 132.00 133.37 3mtl h PRO 289 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3mtl h PRO 289 Cb 1.23 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3mtl h PRO 289 CO 0.37 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.20 3mtl n GLN 290 N -4.35 0.20 -0.06 1.05 0.00 -1.26 -2.74 117.38 110.23 3mtl n GLN 290 Ca 0.36 0.29 0.12 0.00 0.00 0.00 0.00 57.00 57.77 3mtl n GLN 290 Cb 1.52 -1.80 0.20 0.00 0.00 0.00 0.00 30.24 30.17 3mtl n GLN 290 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 3mtl n ASN 291 N -2.16 2.85 -4.35 2.61 3.02 -0.38 -4.85 115.26 112.00 3mtl n ASN 291 Ca 0.04 -1.92 -0.34 0.00 -0.03 0.00 0.00 54.58 52.33 3mtl n ASN 291 Cb 0.32 -0.07 -0.14 0.00 -0.61 0.00 0.00 39.78 39.28 3mtl n ASN 291 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3mtl s LEU 292 N -1.84 2.89 0.08 3.41 1.43 -1.11 -1.48 118.68 122.07 3mtl s LEU 292 Ca 0.32 -0.34 0.06 0.00 -1.03 0.00 0.00 54.13 53.15 3mtl s LEU 292 Cb 0.21 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.68 3mtl s LEU 292 CO 0.31 0.06 -0.09 -0.76 0.23 0.00 0.00 176.35 176.09 3mtl s LEU 293 N 1.02 3.06 -0.07 1.79 1.43 -0.58 -0.80 118.68 124.53 3mtl s LEU 293 Ca 0.00 -0.34 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3mtl s LEU 293 Cb -0.15 -1.84 0.02 0.00 0.03 0.00 0.00 46.19 44.25 3mtl s LEU 293 CO -0.00 0.20 -0.07 -0.63 0.23 0.00 0.00 176.35 176.07 3mtl s ILE 294 N -1.17 0.82 0.61 -0.59 1.01 0.68 -2.09 121.20 120.47 3mtl s ILE 294 Ca 0.21 -0.25 0.06 0.00 0.00 0.00 0.00 60.65 60.67 3mtl s ILE 294 Cb -0.11 -0.82 0.09 0.00 0.01 0.00 0.00 42.46 41.63 3mtl s ILE 294 CO 0.13 0.30 0.84 0.54 0.00 0.00 0.00 174.94 176.75 3mtl s ASN 295 N 1.13 4.91 0.59 3.58 2.20 -0.97 -3.57 114.94 122.80 3mtl s ASN 295 Ca -0.07 -0.61 0.38 0.00 -0.94 0.00 0.00 52.86 51.62 3mtl s ASN 295 Cb -0.14 0.05 1.81 0.00 -2.00 0.00 0.00 41.25 40.97 3mtl s ASN 295 CO -0.01 -1.45 2.14 -0.08 -2.94 0.00 0.00 177.10 174.75 3mtl h GLU 296 N -0.02 0.00 0.00 3.55 4.81 -2.00 -2.59 114.58 118.34 3mtl h GLU 296 Ca -0.33 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3mtl h GLU 296 Cb 1.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.66 3mtl h GLU 296 CO 0.41 0.00 -0.24 -0.09 -0.73 0.00 0.00 179.01 178.36 3mtl h ARG 297 N 0.00 0.00 0.00 1.92 2.43 -2.04 -3.47 114.38 113.22 3mtl h ARG 297 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3mtl h ARG 297 Cb 0.29 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 3mtl h ARG 297 CO 0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 3mtl n GLY 298 N 1.17 1.22 3.76 2.80 0.00 -0.97 -4.66 105.19 108.51 3mtl n GLY 298 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3mtl n GLY 298 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3mtl s GLU 299 N -0.21 4.58 -0.13 1.61 2.02 -1.26 -4.86 118.70 120.44 3mtl s GLU 299 Ca 0.00 1.18 -0.01 0.00 0.02 0.00 0.00 54.97 56.16 3mtl s GLU 299 Cb 0.00 -3.31 -0.02 0.00 0.10 0.00 0.00 34.13 30.90 3mtl s GLU 299 CO 0.00 0.43 -0.12 -1.17 0.02 0.00 0.00 175.26 174.43 3mtl s LEU 300 N -0.65 2.79 0.02 1.80 0.20 -1.26 -2.30 118.68 119.27 3mtl s LEU 300 Ca 0.38 -0.30 0.01 0.00 0.69 0.00 0.00 54.13 54.91 3mtl s LEU 300 Cb -0.22 -1.64 -0.02 0.00 -0.43 0.00 0.00 46.19 43.88 3mtl s LEU 300 CO 0.26 0.16 -0.05 -0.54 -0.29 0.00 0.00 176.35 175.89 3mtl s LYS 301 N 0.37 0.36 -0.06 1.98 1.02 -0.89 -4.59 119.74 117.94 3mtl s LYS 301 Ca -0.10 -0.53 -0.30 0.00 0.02 0.00 0.00 55.97 55.06 3mtl s LYS 301 Cb -0.16 -0.11 -0.03 0.00 -0.52 0.00 0.00 37.83 37.01 3mtl s LYS 301 CO 0.05 0.01 1.19 -0.51 -0.92 0.00 0.00 175.35 175.18 3mtl s LEU 302 N -1.15 4.27 0.57 3.17 2.01 -0.80 -1.53 118.68 125.23 3mtl s LEU 302 Ca -0.10 1.80 -0.16 0.00 0.01 0.00 0.00 54.13 55.68 3mtl s LEU 302 Cb -0.08 -3.56 -0.05 0.00 0.01 0.00 0.00 46.19 42.52 3mtl s LEU 302 CO -0.00 -0.58 1.05 0.00 1.01 0.00 0.00 176.35 177.82 3mtl s ALA 303 N 2.24 2.80 -1.24 4.21 0.00 -0.55 -2.17 121.76 127.05 3mtl s ALA 303 Ca 0.55 0.38 -0.13 0.00 0.00 0.00 0.00 51.96 52.76 3mtl s ALA 303 Cb -0.24 -3.22 0.16 0.00 0.00 0.00 0.00 23.12 19.82 3mtl s ALA 303 CO 0.22 -0.69 1.56 -3.47 0.00 0.00 0.00 175.76 173.38 3mtl n ASP 304 N -1.89 5.16 -3.52 0.00 2.03 -1.26 -4.80 116.55 112.26 3mtl n ASP 304 Ca 0.08 -3.00 -0.05 0.00 0.52 0.00 0.00 54.79 52.34 3mtl n ASP 304 Cb 0.53 -1.56 -0.07 0.00 -0.72 0.00 0.00 41.12 39.30 3mtl n ASP 304 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 3mtl s PHE 305 N 1.49 -1.02 -0.21 -0.67 2.19 -1.26 -4.89 117.98 113.60 3mtl s PHE 305 Ca 0.43 1.57 0.00 0.00 0.33 0.00 0.00 56.93 59.26 3mtl s PHE 305 Cb 0.01 0.38 0.00 0.00 -1.31 0.00 0.00 43.02 42.10 3mtl s PHE 305 CO 0.01 -0.62 0.00 0.41 1.83 0.00 0.00 175.22 176.84 3mtl n GLY 306 N 5.40 0.49 3.78 13.12 0.00 -1.26 -4.93 105.19 121.79 3mtl n GLY 306 Ca -0.07 -0.96 -0.37 0.00 0.00 0.00 0.00 46.02 44.62 3mtl n GLY 306 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3mtl s LEU 307 N -0.49 4.35 -0.08 0.99 1.43 -1.26 -1.58 118.68 122.04 3mtl s LEU 307 Ca 0.00 0.75 -0.12 0.00 -1.03 0.00 0.00 54.13 53.73 3mtl s LEU 307 Cb 0.00 -2.51 0.03 0.00 0.03 0.00 0.00 46.19 43.74 3mtl s LEU 307 CO 0.00 0.18 0.30 0.00 0.23 0.00 0.00 176.35 177.07 3mtl s ALA 308 N -0.19 -0.75 0.59 4.21 0.00 0.75 -4.72 121.76 121.65 3mtl s ALA 308 Ca 0.21 0.66 -0.19 0.00 0.00 0.00 0.00 51.96 52.64 3mtl s ALA 308 Cb -0.15 -0.30 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 3mtl s ALA 308 CO 0.09 -0.19 1.26 1.03 0.00 0.00 0.00 175.76 177.96 3mtl s ARG 309 N -0.37 2.92 -1.16 0.00 3.00 -1.26 0.40 118.95 122.48 3mtl s ARG 309 Ca -0.05 1.98 -0.21 0.00 0.00 0.00 0.00 55.73 57.45 3mtl s ARG 309 Cb -0.03 -2.00 0.03 0.00 0.00 0.00 0.00 34.95 32.95 3mtl s ARG 309 CO 0.02 -1.28 1.69 0.00 0.00 0.00 0.00 175.30 175.72 3mtl s ALA 310 N -1.47 2.79 0.00 2.13 0.00 -1.06 -4.78 121.76 119.37 3mtl s ALA 310 Ca 0.77 -2.49 0.00 0.00 0.00 0.00 0.00 51.96 50.24 3mtl s ALA 310 Cb -0.35 -4.61 0.00 0.00 0.00 0.00 0.00 23.12 18.17 3mtl s ALA 310 CO 0.38 -3.78 0.00 0.36 0.00 0.00 0.00 175.76 172.72 3mtl n LYS 311 N 8.59 0.00 -2.68 0.00 -0.00 -1.26 -5.11 118.16 117.69 3mtl n LYS 311 Ca 0.42 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.72 3mtl n LYS 311 Cb 0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 35.03 35.49 3mtl n LYS 311 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.40 175.03 3mtl n THR 324 N 0.00 -5.40 0.65 0.58 5.66 -1.26 -5.25 114.28 109.25 3mtl n THR 324 Ca 0.00 1.11 0.13 0.00 -3.05 0.00 0.00 64.05 62.24 3mtl n THR 324 Cb 0.24 -3.81 0.44 0.00 -1.55 0.00 0.00 70.33 65.66 3mtl n THR 324 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 175.07 171.91 3mtl n LEU 325 N 2.15 0.67 -0.06 1.09 7.94 -1.26 -4.24 117.00 123.29 3mtl n LEU 325 Ca -0.12 0.58 0.01 0.00 -1.11 0.00 0.00 56.01 55.37 3mtl n LEU 325 Cb 0.18 -0.38 0.32 0.00 0.53 0.00 0.00 43.42 44.07 3mtl n LEU 325 CO 0.11 -0.20 1.10 -0.50 -1.11 0.00 0.00 177.39 176.78 3mtl h TRP 326 N 0.00 0.66 -0.59 1.96 4.06 -1.82 -3.04 115.95 117.18 3mtl h TRP 326 Ca 0.00 -0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.93 3mtl h TRP 326 Cb 0.65 -0.21 0.00 0.00 -1.00 0.00 0.00 29.16 28.60 3mtl h TRP 326 CO 0.00 0.49 0.00 0.66 -3.56 0.00 0.00 178.44 176.03 3mtl n TYR 327 N -4.39 1.23 -3.03 0.49 4.01 -1.26 -4.58 117.16 109.64 3mtl n TYR 327 Ca 0.04 -0.61 -0.40 0.00 -0.16 0.00 0.00 57.90 56.78 3mtl n TYR 327 Cb 0.12 -0.19 -0.05 0.00 -0.31 0.00 0.00 39.34 38.92 3mtl n TYR 327 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3mtl s ARG 328 N -1.70 4.44 0.70 -0.72 0.52 -1.15 -4.07 118.95 116.97 3mtl s ARG 328 Ca 0.46 0.92 -0.13 0.00 -0.52 0.00 0.00 55.73 56.46 3mtl s ARG 328 Cb 0.29 -3.44 0.02 0.00 0.52 0.00 0.00 34.95 32.35 3mtl s ARG 328 CO 0.23 0.09 1.10 -2.14 0.02 0.00 0.00 175.30 174.60 3mtl s PRO 329 N 0.70 2.60 0.22 3.54 0.02 -1.26 -4.93 135.00 135.90 3mtl s PRO 329 Ca 0.38 1.28 -0.04 0.00 0.02 0.00 0.00 61.00 62.64 3mtl s PRO 329 Cb -0.18 -1.93 0.22 0.00 0.02 0.00 0.00 34.50 32.63 3mtl s PRO 329 CO 0.19 -1.39 1.65 -1.35 -0.33 0.00 0.00 177.00 175.77 3mtl h PRO 330 N -0.46 0.75 -0.84 5.54 0.11 -1.92 -2.68 132.00 132.50 3mtl h PRO 330 Ca -0.45 -0.29 -0.02 0.00 0.11 0.00 0.00 66.00 65.35 3mtl h PRO 330 Cb 1.24 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 3mtl h PRO 330 CO 0.53 0.89 0.45 0.38 -0.21 0.00 0.00 178.00 180.05 3mtl h ASP 331 N 0.66 1.06 -0.42 -2.05 -0.00 -1.94 -0.74 116.42 112.99 3mtl h ASP 331 Ca 0.10 -0.10 -0.07 0.00 -0.00 0.00 0.00 57.03 56.96 3mtl h ASP 331 Cb 0.70 -0.27 -0.02 0.00 -0.00 0.00 0.00 39.33 39.74 3mtl h ASP 331 CO 0.05 0.86 -0.00 0.40 -0.00 0.00 0.00 179.24 180.55 3mtl h ILE 332 N 1.18 1.26 -0.71 4.15 5.03 -1.87 -2.62 117.51 123.93 3mtl h ILE 332 Ca 0.30 -1.03 -0.04 0.00 -0.12 0.00 0.00 64.86 63.97 3mtl h ILE 332 Cb 0.04 1.09 -0.03 0.00 -3.03 0.00 0.00 36.82 34.89 3mtl h ILE 332 CO -0.05 0.35 0.29 -0.07 -0.68 0.00 0.00 178.15 177.99 3mtl h LEU 333 N 0.58 0.96 -2.42 1.44 3.38 -1.20 -2.67 115.31 115.37 3mtl h LEU 333 Ca 0.12 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 3mtl h LEU 333 Cb 0.49 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 3mtl h LEU 333 CO 0.02 0.85 0.15 0.18 0.09 0.00 0.00 178.44 179.73 3mtl n LEU 334 N -4.30 3.74 -1.87 1.67 4.77 -0.31 -4.89 117.00 115.81 3mtl n LEU 334 Ca 0.06 -1.93 -0.01 0.00 -0.03 0.00 0.00 56.01 54.10 3mtl n LEU 334 Cb 0.18 -0.60 0.00 0.00 -2.33 0.00 0.00 43.42 40.66 3mtl n LEU 334 CO 0.40 0.58 -0.06 0.61 -1.33 0.00 0.00 177.39 177.59 3mtl n GLY 335 N 0.03 -1.99 3.22 -0.72 0.00 -1.01 -4.93 105.19 99.79 3mtl n GLY 335 Ca 0.17 0.13 -0.32 0.00 0.00 0.00 0.00 46.02 46.01 3mtl n GLY 335 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3mtl s SER 336 N -1.00 3.04 0.00 1.61 0.15 -1.14 -4.90 113.70 111.46 3mtl s SER 336 Ca 0.04 -0.55 0.27 0.00 0.70 0.00 0.00 55.95 56.41 3mtl s SER 336 Cb -0.01 -1.33 0.79 0.00 -1.71 0.00 0.00 66.02 63.76 3mtl s SER 336 CO 0.22 0.17 1.61 0.35 1.20 0.00 0.00 173.24 176.79 3mtl n THR 337 N 3.46 0.00 -3.08 6.45 -2.24 -1.26 -4.83 114.28 112.78 3mtl n THR 337 Ca -0.19 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.16 3mtl n THR 337 Cb 0.53 -0.02 -0.06 0.00 -2.10 0.00 0.00 70.33 68.67 3mtl n THR 337 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3mtl s ASP 338 N -2.98 6.35 -0.89 3.42 1.01 -1.26 -4.99 116.67 117.33 3mtl s ASP 338 Ca 0.13 -0.24 -0.05 0.00 0.71 0.00 0.00 52.55 53.10 3mtl s ASP 338 Cb 0.18 -2.33 0.22 0.00 1.01 0.00 0.00 42.92 42.00 3mtl s ASP 338 CO 0.63 -0.79 0.79 -0.31 0.21 0.00 0.00 175.17 175.71 3mtl s TYR 339 N 2.91 3.88 0.46 4.23 2.02 -1.26 -4.98 117.35 124.61 3mtl s TYR 339 Ca 0.24 -2.81 0.05 0.00 -0.37 0.00 0.00 57.07 54.18 3mtl s TYR 339 Cb -0.14 -3.41 -0.04 0.00 -0.40 0.00 0.00 41.96 37.97 3mtl s TYR 339 CO 0.19 -0.82 0.06 -1.54 -1.57 0.00 0.00 175.55 171.87 3mtl s SER 340 N 0.50 4.11 0.59 2.29 1.04 -1.26 -4.97 113.70 116.00 3mtl s SER 340 Ca 0.26 -1.42 0.29 0.00 0.48 0.00 0.00 55.95 55.55 3mtl s SER 340 Cb -0.10 -0.01 1.49 0.00 0.10 0.00 0.00 66.02 67.49 3mtl s SER 340 CO -0.10 -0.66 1.92 0.71 0.98 0.00 0.00 173.24 176.09 3mtl h THR 341 N 1.49 0.39 -0.09 2.02 1.35 -1.96 -1.89 112.91 114.22 3mtl h THR 341 Ca -0.43 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.39 3mtl h THR 341 Cb 1.27 0.64 -0.01 0.00 -1.73 0.00 0.00 68.15 68.32 3mtl h THR 341 CO 0.75 0.00 -0.12 1.56 -0.25 0.00 0.00 175.52 177.46 3mtl h GLN 342 N 0.00 0.13 -0.20 4.72 1.08 -1.96 -2.92 115.11 115.96 3mtl h GLN 342 Ca 0.21 -0.02 0.04 0.00 -1.45 0.00 0.00 58.65 57.43 3mtl h GLN 342 Cb 1.13 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 28.50 3mtl h GLN 342 CO -0.00 0.26 -0.05 0.82 -0.95 0.00 0.00 178.83 178.90 3mtl h ILE 343 N 0.13 0.80 -0.56 2.54 2.04 -1.70 -1.81 117.51 118.95 3mtl h ILE 343 Ca 0.03 -0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.02 3mtl h ILE 343 Cb 0.29 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 3mtl h ILE 343 CO 0.02 0.00 0.39 0.44 0.00 0.00 0.00 178.15 179.00 3mtl h ASP 344 N 0.00 0.14 0.49 1.72 5.19 -1.70 -2.11 116.42 120.16 3mtl h ASP 344 Ca 0.10 0.01 -0.10 0.00 -0.62 0.00 0.00 57.03 56.41 3mtl h ASP 344 Cb 0.15 -0.02 -0.01 0.00 0.18 0.00 0.00 39.33 39.62 3mtl h ASP 344 CO -0.21 0.08 -0.48 0.24 -3.12 0.00 0.00 179.24 175.76 3mtl h MET 345 N 0.16 0.00 -0.21 3.56 2.86 -1.36 -1.74 114.93 118.20 3mtl h MET 345 Ca 0.27 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.70 3mtl h MET 345 Cb 0.84 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.51 3mtl h MET 345 CO -0.04 0.48 -0.68 2.35 1.06 0.00 0.00 176.91 180.08 3mtl h TRP 346 N 0.00 1.07 -0.23 -0.22 2.91 -1.39 -2.60 115.95 115.49 3mtl h TRP 346 Ca -0.00 -0.43 -0.05 0.00 1.13 0.00 0.00 58.89 59.54 3mtl h TRP 346 Cb 0.85 -0.18 -0.01 0.00 -0.51 0.00 0.00 29.16 29.30 3mtl h TRP 346 CO 0.00 1.26 -0.06 0.78 -1.03 0.00 0.00 178.44 179.39 3mtl h GLY 347 N 0.64 0.39 0.87 2.65 0.00 -1.50 -1.39 103.07 104.74 3mtl h GLY 347 Ca -0.02 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.04 3mtl h GLY 347 CO 0.14 0.21 0.03 -2.08 0.00 0.00 0.00 176.54 174.85 3mtl h VAL 348 N 0.35 1.24 -0.19 4.60 2.07 -1.02 -1.47 116.25 121.83 3mtl h VAL 348 Ca 0.07 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 66.79 3mtl h VAL 348 Cb 0.33 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3mtl h VAL 348 CO 0.01 0.27 -0.03 1.23 0.02 0.00 0.00 177.57 179.08 3mtl h GLY 349 N 0.28 0.15 0.59 2.17 0.00 -1.10 0.11 103.07 105.26 3mtl h GLY 349 Ca 0.08 0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.48 3mtl h GLY 349 CO 0.01 -0.06 -0.16 0.00 0.00 0.00 0.00 176.54 176.34 3mtl h ILE 351 N -0.25 1.26 -0.24 0.00 2.04 -1.11 -1.41 117.51 117.81 3mtl h ILE 351 Ca 0.06 -0.85 0.05 0.00 1.00 0.00 0.00 64.86 65.11 3mtl h ILE 351 Cb 0.33 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 36.73 3mtl h ILE 351 CO -0.17 0.34 -0.03 0.15 0.00 0.00 0.00 178.15 178.44 3mtl h PHE 352 N 1.13 -0.07 -0.26 1.37 3.57 -0.58 0.68 116.94 122.77 3mtl h PHE 352 Ca 0.25 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.77 3mtl h PHE 352 Cb 0.25 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 3mtl h PHE 352 CO 0.02 -0.07 0.14 -0.92 -2.23 0.00 0.00 178.31 175.25 3mtl h TYR 353 N 0.04 0.36 -0.55 0.41 3.20 -1.16 -1.20 116.97 118.07 3mtl h TYR 353 Ca 0.12 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 62.03 3mtl h TYR 353 Cb 0.17 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 3mtl h TYR 353 CO -0.22 0.31 0.36 1.49 -1.64 0.00 0.00 178.16 178.46 3mtl h GLU 354 N 0.31 0.53 -0.02 1.82 4.81 -0.81 -0.11 114.58 121.12 3mtl h GLU 354 Ca 0.09 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.22 3mtl h GLU 354 Cb 0.07 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.33 3mtl h GLU 354 CO -0.01 0.35 -0.28 0.52 -0.73 0.00 0.00 179.01 178.86 3mtl h MET 355 N 0.55 0.22 -0.19 1.92 2.86 -0.53 0.39 114.93 120.15 3mtl h MET 355 Ca 0.23 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.61 3mtl h MET 355 Cb 0.22 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.92 3mtl h MET 355 CO -0.06 0.91 -0.11 0.00 1.06 0.00 0.00 176.91 178.71 3mtl h ALA 356 N 0.31 1.46 0.00 6.32 0.00 -0.83 -3.33 119.26 123.19 3mtl h ALA 356 Ca -0.03 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.67 3mtl h ALA 356 Cb 1.00 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.69 3mtl h ALA 356 CO 0.06 0.38 -1.07 0.25 0.00 0.00 0.00 179.25 178.87 3mtl n THR 357 N -4.27 0.00 -1.05 0.00 -2.24 -0.09 -4.78 114.28 101.86 3mtl n THR 357 Ca -0.00 -0.22 -0.02 0.00 -2.27 0.00 0.00 64.05 61.54 3mtl n THR 357 Cb 0.27 0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 69.01 3mtl n THR 357 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3mtl n GLY 358 N 1.82 0.54 3.06 3.38 0.00 0.12 -4.95 105.19 109.16 3mtl n GLY 358 Ca -0.01 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.40 3mtl n GLY 358 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3mtl s ARG 359 N -1.39 0.40 0.42 1.61 1.70 -1.19 -4.92 118.95 115.57 3mtl s ARG 359 Ca 0.00 -0.38 -0.26 0.00 -0.47 0.00 0.00 55.73 54.62 3mtl s ARG 359 Cb 0.00 0.16 -0.09 0.00 -0.57 0.00 0.00 34.95 34.46 3mtl s ARG 359 CO 0.00 -0.09 1.32 -1.25 -1.08 0.00 0.00 175.30 174.20 3mtl s PRO 360 N -1.22 3.91 0.03 3.89 0.04 -1.26 -3.90 135.00 136.48 3mtl s PRO 360 Ca -0.13 2.18 -0.21 0.00 0.04 0.00 0.00 61.00 62.88 3mtl s PRO 360 Cb -0.07 -2.73 -0.16 0.00 0.04 0.00 0.00 34.50 31.58 3mtl s PRO 360 CO 0.01 -0.55 1.31 1.25 0.04 0.00 0.00 177.00 179.06 3mtl h LEU 361 N 2.59 0.34 -6.59 -3.56 5.85 -1.93 -3.41 115.31 108.60 3mtl h LEU 361 Ca -0.50 -0.50 -0.60 0.00 0.84 0.00 0.00 57.88 57.12 3mtl h LEU 361 Cb 1.25 -0.10 -0.39 0.00 0.37 0.00 0.00 40.66 41.79 3mtl h LEU 361 CO 0.62 0.78 -0.85 -0.36 -0.34 0.00 0.00 178.44 178.29 3mtl s PHE 362 N -4.20 1.77 -1.49 1.25 0.08 -1.26 -4.99 117.98 109.14 3mtl s PHE 362 Ca -0.14 -2.57 -0.09 0.00 0.12 0.00 0.00 56.93 54.25 3mtl s PHE 362 Cb 0.05 -1.44 0.01 0.00 -0.57 0.00 0.00 43.02 41.07 3mtl s PHE 362 CO 0.75 -0.75 2.65 -0.35 -0.10 0.00 0.00 175.22 177.41 3mtl n PRO 363 N 2.70 3.98 -2.27 0.24 -0.04 -1.26 -4.45 135.00 133.90 3mtl n PRO 363 Ca 0.25 -2.77 -0.34 0.00 -0.04 0.00 0.00 63.50 60.61 3mtl n PRO 363 Cb 0.43 -2.78 -0.01 0.00 -0.04 0.00 0.00 33.50 31.11 3mtl n PRO 363 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3mtl s GLY 364 N 1.49 2.36 -0.02 0.55 0.00 -1.26 -5.00 107.32 105.45 3mtl s GLY 364 Ca 0.61 0.55 0.14 0.00 0.00 0.00 0.00 44.72 46.02 3mtl s GLY 364 CO -0.07 0.88 0.37 -1.26 0.00 0.00 0.00 173.10 173.02 3mtl n SER 365 N -1.49 1.53 -4.17 1.64 2.88 -1.26 -4.65 113.62 108.11 3mtl n SER 365 Ca 0.09 -0.18 -0.10 0.00 -1.33 0.00 0.00 58.87 57.35 3mtl n SER 365 Cb 0.52 1.50 -0.10 0.00 -0.75 0.00 0.00 64.21 65.39 3mtl n SER 365 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3mtl s THR 366 N -2.83 0.53 0.21 2.46 -4.23 -1.26 -5.03 115.64 105.49 3mtl s THR 366 Ca -0.03 -1.92 -0.10 0.00 -1.18 0.00 0.00 61.69 58.47 3mtl s THR 366 Cb 0.09 -1.77 0.14 0.00 1.34 0.00 0.00 72.50 72.30 3mtl s THR 366 CO 0.58 -0.78 1.77 0.58 -0.54 0.00 0.00 174.62 176.23 3mtl h VAL 367 N 2.94 0.85 0.31 2.29 2.07 -1.99 0.52 116.25 123.23 3mtl h VAL 367 Ca -0.35 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 66.98 3mtl h VAL 367 Cb 1.17 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 3mtl h VAL 367 CO 0.64 0.09 -0.15 -0.08 0.02 0.00 0.00 177.57 178.09 3mtl h GLU 368 N 0.50 -0.41 -0.37 1.57 4.81 -1.99 -2.48 114.58 116.22 3mtl h GLU 368 Ca 0.30 0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.54 3mtl h GLU 368 Cb 0.30 0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.76 3mtl h GLU 368 CO -0.25 -0.27 0.17 1.49 -0.73 0.00 0.00 179.01 179.42 3mtl h GLU 369 N -0.42 0.53 -0.31 1.92 4.81 -1.87 -2.20 114.58 117.04 3mtl h GLU 369 Ca -0.04 -0.08 0.07 0.00 -0.13 0.00 0.00 59.36 59.18 3mtl h GLU 369 Cb 0.33 -0.09 -0.08 0.00 0.63 0.00 0.00 28.75 29.54 3mtl h GLU 369 CO 0.06 0.48 -0.21 0.37 -0.73 0.00 0.00 179.01 178.98 3mtl h GLN 370 N 0.46 -0.18 -0.70 1.92 5.75 -0.86 -0.01 115.11 121.49 3mtl h GLN 370 Ca 0.13 0.01 0.06 0.00 -0.15 0.00 0.00 58.65 58.70 3mtl h GLN 370 Cb 0.13 0.04 -0.06 0.00 1.07 0.00 0.00 27.48 28.66 3mtl h GLN 370 CO -0.02 -0.12 0.40 -0.07 -2.65 0.00 0.00 178.83 176.38 3mtl h LEU 371 N -0.18 0.60 -0.05 -2.39 3.38 -1.26 -0.98 115.31 114.43 3mtl h LEU 371 Ca 0.16 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.17 3mtl h LEU 371 Cb 0.43 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3mtl h LEU 371 CO -0.42 0.38 -0.01 -0.74 0.09 0.00 0.00 178.44 177.75 3mtl h HIS 372 N 0.73 -0.01 -0.73 1.13 2.76 -0.70 -0.32 115.15 118.01 3mtl h HIS 372 Ca 0.31 0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.56 3mtl h HIS 372 Cb 0.19 0.01 -0.05 0.00 1.55 0.00 0.00 27.41 29.12 3mtl h HIS 372 CO -0.07 -0.01 0.48 0.74 -1.30 0.00 0.00 177.93 177.76 3mtl h PHE 373 N 0.01 0.72 -0.00 5.26 -1.00 -0.55 -1.13 116.94 120.25 3mtl h PHE 373 Ca 0.02 0.02 -0.01 0.00 2.81 0.00 0.00 57.97 60.81 3mtl h PHE 373 Cb 0.03 -0.24 0.00 0.00 3.61 0.00 0.00 35.95 39.35 3mtl h PHE 373 CO -0.11 0.37 -0.03 0.82 -1.61 0.00 0.00 178.31 177.75 3mtl h ILE 374 N 0.70 1.54 0.00 -0.55 2.04 -0.83 -3.27 117.51 117.13 3mtl h ILE 374 Ca 0.32 -1.61 -0.04 0.00 1.00 0.00 0.00 64.86 64.53 3mtl h ILE 374 Cb 0.35 2.61 -0.01 0.00 -0.74 0.00 0.00 36.82 39.03 3mtl h ILE 374 CO -0.11 0.42 -0.20 -0.26 0.00 0.00 0.00 178.15 178.00 3mtl h PHE 375 N -0.64 0.00 0.00 1.37 0.04 -0.72 0.06 116.94 117.06 3mtl h PHE 375 Ca -0.00 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.70 3mtl h PHE 375 Cb 0.70 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.85 3mtl h PHE 375 CO 0.16 0.20 -0.31 0.00 -0.60 0.00 0.00 178.31 177.76 3mtl h ARG 376 N 0.00 0.00 0.00 1.51 3.08 -1.29 0.32 114.38 118.00 3mtl h ARG 376 Ca -0.00 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.74 3mtl h ARG 376 Cb 0.42 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.43 3mtl h ARG 376 CO 0.03 0.31 -1.72 -0.89 -1.07 0.00 0.00 179.97 176.62 3mtl n ILE 377 N -4.08 1.53 0.25 2.04 2.08 -0.73 -4.60 119.36 115.84 3mtl n ILE 377 Ca -0.02 -0.15 0.12 0.00 0.56 0.00 0.00 62.75 63.26 3mtl n ILE 377 Cb 0.36 -2.00 0.08 0.00 -0.75 0.00 0.00 39.64 37.33 3mtl n ILE 377 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 3mtl h LEU 378 N -1.00 0.00 0.00 1.39 3.38 -1.09 -2.49 115.31 115.50 3mtl h LEU 378 Ca -0.47 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.45 3mtl h LEU 378 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 3mtl h LEU 378 CO -0.28 0.03 0.00 0.61 0.09 0.00 0.00 178.44 178.88 3mtl n GLY 379 N 1.21 2.37 3.70 0.83 0.00 0.11 -4.34 105.19 109.08 3mtl n GLY 379 Ca 0.02 -1.83 -0.42 0.00 0.00 0.00 0.00 46.02 43.79 3mtl n GLY 379 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mtl s THR 380 N -2.49 4.54 0.44 2.61 2.01 -0.40 -4.49 115.64 117.87 3mtl s THR 380 Ca 0.00 1.83 -0.26 0.00 0.31 0.00 0.00 61.69 63.57 3mtl s THR 380 Cb 0.00 -4.17 -0.09 0.00 0.01 0.00 0.00 72.50 68.25 3mtl s THR 380 CO 0.00 0.10 1.45 -2.84 -0.69 0.00 0.00 174.62 172.63 3mtl s PRO 381 N 1.38 3.72 0.28 4.92 0.02 -1.26 -4.80 135.00 139.26 3mtl s PRO 381 Ca 0.54 2.46 0.11 0.00 0.02 0.00 0.00 61.00 64.12 3mtl s PRO 381 Cb -0.23 -2.69 -0.05 0.00 0.02 0.00 0.00 34.50 31.55 3mtl s PRO 381 CO 0.26 -0.81 -0.16 0.95 -0.33 0.00 0.00 177.00 176.91 3mtl s THR 382 N -1.19 2.28 0.23 0.99 -4.23 -1.26 -4.96 115.64 107.51 3mtl s THR 382 Ca 0.60 -2.32 0.25 0.00 -1.18 0.00 0.00 61.69 59.04 3mtl s THR 382 Cb -0.45 -2.36 0.25 0.00 1.34 0.00 0.00 72.50 71.29 3mtl s THR 382 CO 0.58 -0.37 1.74 -0.33 -0.54 0.00 0.00 174.62 175.69 3mtl h GLU 383 N 2.25 0.00 0.01 3.99 4.39 -1.97 -0.04 114.58 123.21 3mtl h GLU 383 Ca -0.40 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.30 3mtl h GLU 383 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 3mtl h GLU 383 CO 0.63 0.00 -0.00 1.49 -1.16 0.00 0.00 179.01 179.97 3mtl h GLU 384 N 0.00 -0.01 0.00 2.33 4.81 -1.99 -3.25 114.58 116.46 3mtl h GLU 384 Ca 0.00 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 3mtl h GLU 384 Cb 0.35 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 3mtl h GLU 384 CO 0.00 0.77 -0.70 1.79 -0.73 0.00 0.00 179.01 180.14 3mtl h THR 385 N -0.97 1.23 -2.41 0.32 1.35 -1.73 -3.41 112.91 107.30 3mtl h THR 385 Ca -0.00 -2.64 -0.49 0.00 -0.55 0.00 0.00 66.41 62.73 3mtl h THR 385 Cb 0.78 2.54 -0.37 0.00 -1.73 0.00 0.00 68.15 69.38 3mtl h THR 385 CO 0.00 0.68 -0.77 0.86 -0.25 0.00 0.00 175.52 176.04 3mtl s TRP 386 N -2.94 0.26 0.13 4.73 -0.11 -0.11 -4.92 118.94 115.97 3mtl s TRP 386 Ca 0.02 -1.13 -0.31 0.00 1.22 0.00 0.00 56.10 55.90 3mtl s TRP 386 Cb 0.09 -0.73 -0.08 0.00 -1.50 0.00 0.00 33.47 31.25 3mtl s TRP 386 CO 0.77 -0.88 1.41 -2.14 -4.62 0.00 0.00 176.95 171.49 3mtl s PRO 387 N 1.48 4.31 0.00 5.86 0.02 -1.23 -2.88 135.00 142.56 3mtl s PRO 387 Ca 0.15 2.12 0.00 0.00 0.02 0.00 0.00 61.00 63.29 3mtl s PRO 387 Cb -0.19 -3.23 0.00 0.00 0.02 0.00 0.00 34.50 31.10 3mtl s PRO 387 CO -0.10 -0.45 0.00 0.41 -0.33 0.00 0.00 177.00 176.53 3mtl n GLY 388 N 3.41 2.28 0.19 0.52 0.00 -1.26 -5.01 105.19 105.32 3mtl n GLY 388 Ca 0.11 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.09 3mtl n GLY 388 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 3mtl h ILE 389 N 0.00 0.54 0.00 -0.61 -0.00 -1.87 -2.08 117.51 113.48 3mtl h ILE 389 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 64.86 64.86 3mtl h ILE 389 Cb 0.00 0.54 -0.00 0.00 -0.00 0.00 0.00 36.82 37.36 3mtl h ILE 389 CO 0.00 0.00 -0.00 -0.07 -0.00 0.00 0.00 178.15 178.08 3mtl h LEU 390 N -0.02 0.00 0.00 0.16 3.38 -1.94 0.20 115.31 117.09 3mtl h LEU 390 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3mtl h LEU 390 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3mtl h LEU 390 CO -0.46 0.00 -0.26 -1.20 0.09 0.00 0.00 178.44 176.61 3mtl n SER 391 N -3.14 0.30 -4.68 -0.43 7.64 -0.79 -4.83 113.62 107.69 3mtl n SER 391 Ca -0.03 0.15 -0.43 0.00 1.01 0.00 0.00 58.87 59.58 3mtl n SER 391 Cb 0.10 -0.14 -0.02 0.00 -1.01 0.00 0.00 64.21 63.13 3mtl n SER 391 CO 0.00 0.00 0.00 0.21 -3.01 0.00 0.00 175.04 172.24 3mtl s ASN 392 N -3.14 7.18 0.05 6.43 3.84 0.71 -4.96 114.94 125.05 3mtl s ASN 392 Ca 0.12 1.50 -0.23 0.00 0.21 0.00 0.00 52.86 54.45 3mtl s ASN 392 Cb 0.18 -2.55 -0.16 0.00 -0.55 0.00 0.00 41.25 38.17 3mtl s ASN 392 CO 0.62 -0.54 1.57 1.05 -2.79 0.00 0.00 177.10 177.01 3mtl h GLU 393 N 7.26 0.05 -0.18 0.43 -0.00 -1.88 -2.84 114.58 117.42 3mtl h GLU 393 Ca -0.27 -0.01 -0.07 0.00 -0.00 0.00 0.00 59.36 59.02 3mtl h GLU 393 Cb 1.12 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 29.85 3mtl h GLU 393 CO 0.90 0.21 -0.18 0.93 -0.00 0.00 0.00 179.01 180.87 3mtl h GLU 394 N -0.13 0.30 -0.02 1.06 5.08 -1.93 -2.88 114.58 116.07 3mtl h GLU 394 Ca 0.01 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3mtl h GLU 394 Cb 0.19 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 3mtl h GLU 394 CO -0.00 0.48 -0.01 0.35 -1.00 0.00 0.00 179.01 178.84 3mtl h PHE 395 N 0.28 0.05 -0.87 4.33 3.57 -1.87 -3.27 116.94 119.16 3mtl h PHE 395 Ca 0.05 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.62 3mtl h PHE 395 Cb 0.49 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.15 3mtl h PHE 395 CO 0.01 0.41 0.52 0.87 -2.23 0.00 0.00 178.31 177.90 3mtl h LYS 396 N -0.34 0.88 0.00 1.11 1.79 -1.44 -2.58 116.57 116.00 3mtl h LYS 396 Ca 0.00 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 3mtl h LYS 396 Cb 0.40 -0.20 -0.00 0.00 -1.58 0.00 0.00 32.23 30.85 3mtl h LYS 396 CO 0.00 0.58 -0.04 1.79 -1.08 0.00 0.00 179.45 180.71 3mtl h THR 397 N 0.91 0.22 -0.00 -0.16 1.35 -1.56 -3.09 112.91 110.58 3mtl h THR 397 Ca 0.40 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.98 3mtl h THR 397 Cb 0.29 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 3mtl h THR 397 CO -0.22 0.04 -0.17 -1.22 -0.25 0.00 0.00 175.52 173.70 3mtl n TYR 398 N -3.32 0.00 -3.76 4.73 4.01 -0.97 -5.01 117.16 112.85 3mtl n TYR 398 Ca -0.02 0.00 -0.27 0.00 -0.16 0.00 0.00 57.90 57.46 3mtl n TYR 398 Cb 0.18 -0.30 0.00 0.00 -0.31 0.00 0.00 39.34 38.92 3mtl n TYR 398 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3mtl n ASN 399 N -1.26 -4.81 -4.77 7.72 3.02 -1.17 -4.95 115.26 109.04 3mtl n ASN 399 Ca 0.10 -0.88 -0.39 0.00 -0.03 0.00 0.00 54.58 53.38 3mtl n ASN 399 Cb 0.31 -1.57 -0.06 0.00 -0.61 0.00 0.00 39.78 37.85 3mtl n ASN 399 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3mtl s TYR 400 N -2.79 3.86 0.47 3.10 2.02 -1.26 -5.05 117.35 117.70 3mtl s TYR 400 Ca 0.05 1.57 -0.23 0.00 -0.37 0.00 0.00 57.07 58.09 3mtl s TYR 400 Cb -0.00 -2.76 -0.07 0.00 -0.40 0.00 0.00 41.96 38.73 3mtl s TYR 400 CO 0.89 0.47 1.18 -2.14 -1.57 0.00 0.00 175.55 174.38 3mtl s PRO 401 N -0.91 3.70 -0.93 -1.71 0.02 -1.26 -4.88 135.00 129.02 3mtl s PRO 401 Ca 0.36 1.82 -0.24 0.00 0.02 0.00 0.00 61.00 62.95 3mtl s PRO 401 Cb -0.22 -2.39 -0.05 0.00 0.02 0.00 0.00 34.50 31.86 3mtl s PRO 401 CO 0.25 -0.61 1.93 -1.59 -0.33 0.00 0.00 177.00 176.65 3mtl s LYS 402 N -2.72 2.58 0.15 5.54 0.00 -1.26 -4.71 119.74 119.32 3mtl s LYS 402 Ca 0.64 -0.40 -0.30 0.00 0.00 0.00 0.00 55.97 55.92 3mtl s LYS 402 Cb -0.30 -5.09 -0.07 0.00 0.00 0.00 0.00 37.83 32.38 3mtl s LYS 402 CO 0.36 -3.41 0.94 0.71 0.00 0.00 0.00 175.35 173.94 3mtl s TYR 403 N 10.05 3.87 -0.10 1.78 2.02 -1.26 -4.91 117.35 128.80 3mtl s TYR 403 Ca 0.69 1.81 -0.11 0.00 -0.37 0.00 0.00 57.07 59.10 3mtl s TYR 403 Cb -0.06 -3.01 -0.05 0.00 -0.40 0.00 0.00 41.96 38.45 3mtl s TYR 403 CO 0.00 0.30 0.25 -0.98 -1.57 0.00 0.00 175.55 173.55 3mtl s ARG 404 N -0.42 3.80 0.27 -0.62 1.70 -1.26 -1.27 118.95 121.15 3mtl s ARG 404 Ca 0.44 0.06 -0.30 0.00 -0.47 0.00 0.00 55.73 55.46 3mtl s ARG 404 Cb -0.24 -3.26 -0.12 0.00 -0.57 0.00 0.00 34.95 30.75 3mtl s ARG 404 CO 0.30 0.61 1.49 0.00 -1.08 0.00 0.00 175.30 176.62 3mtl n ALA 405 N 2.38 1.83 -2.82 7.88 0.00 -1.26 -4.61 120.51 123.90 3mtl n ALA 405 Ca -0.16 0.39 -0.35 0.00 0.00 0.00 0.00 53.44 53.31 3mtl n ALA 405 Cb 0.53 -2.37 -0.10 0.00 0.00 0.00 0.00 19.45 17.52 3mtl n ALA 405 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3mtl s GLU 406 N -0.55 3.93 -0.17 0.00 2.02 -0.94 -4.97 118.70 118.03 3mtl s GLU 406 Ca 0.65 -0.35 -0.37 0.00 0.02 0.00 0.00 54.97 54.92 3mtl s GLU 406 Cb -0.57 -3.32 -0.14 0.00 0.10 0.00 0.00 34.13 30.20 3mtl s GLU 406 CO 0.50 0.12 1.78 0.00 0.02 0.00 0.00 175.26 177.68 3mtl n ALA 407 N 4.01 0.26 -0.27 5.21 0.00 -1.26 -4.80 120.51 123.66 3mtl n ALA 407 Ca -0.16 0.35 -0.02 0.00 0.00 0.00 0.00 53.44 53.61 3mtl n ALA 407 Cb 0.52 -2.33 0.16 0.00 0.00 0.00 0.00 19.45 17.80 3mtl n ALA 407 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3mtl h LEU 408 N 7.86 0.99 -1.79 0.00 3.38 -1.93 -2.28 115.31 121.54 3mtl h LEU 408 Ca -0.47 -0.07 0.14 0.00 0.09 0.00 0.00 57.88 57.57 3mtl h LEU 408 Cb 1.30 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.76 3mtl h LEU 408 CO 0.95 0.78 0.43 0.25 0.09 0.00 0.00 178.44 180.93 3mtl h LEU 409 N 1.13 0.20 -1.09 1.67 5.85 -1.90 0.13 115.31 121.30 3mtl h LEU 409 Ca 0.29 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.93 3mtl h LEU 409 Cb -0.01 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 3mtl h LEU 409 CO -0.05 0.11 -0.39 -1.28 -0.34 0.00 0.00 178.44 176.49 3mtl h SER 410 N 0.22 0.12 1.29 1.25 0.87 -1.79 -2.96 113.55 112.55 3mtl h SER 410 Ca 0.30 -0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 60.68 3mtl h SER 410 Cb 0.88 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.78 3mtl h SER 410 CO -0.06 0.51 -0.74 0.45 -0.53 0.00 0.00 176.83 176.46 3mtl h HIS 411 N 0.10 0.00 -2.12 2.24 3.86 -0.78 -3.39 115.15 115.06 3mtl h HIS 411 Ca 0.01 0.00 -0.58 0.00 -1.16 0.00 0.00 60.37 58.64 3mtl h HIS 411 Cb 0.74 0.00 -0.40 0.00 1.06 0.00 0.00 27.41 28.81 3mtl h HIS 411 CO 0.01 0.56 -0.93 0.00 0.86 0.00 0.00 177.93 178.43 3mtl n ALA 412 N -2.27 2.99 0.26 2.45 0.00 -0.71 -5.00 120.51 118.22 3mtl n ALA 412 Ca -0.01 -3.84 0.18 0.00 0.00 0.00 0.00 53.44 49.78 3mtl n ALA 412 Cb 0.78 -0.84 0.91 0.00 0.00 0.00 0.00 19.45 20.30 3mtl n ALA 412 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3mtl h PRO 413 N 4.20 0.00 0.00 0.00 0.11 -1.74 -1.67 132.00 132.90 3mtl h PRO 413 Ca 0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.24 3mtl h PRO 413 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 3mtl h PRO 413 CO 0.58 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.37 3mtl h ARG 414 N 0.00 0.00 -7.26 1.05 3.08 -1.87 -3.44 114.38 105.94 3mtl h ARG 414 Ca 0.05 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.61 3mtl h ARG 414 Cb 0.39 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.48 3mtl h ARG 414 CO -0.00 0.00 0.39 -1.17 -1.07 0.00 0.00 179.97 178.12 3mtl s LEU 415 N -5.97 3.45 0.46 3.04 2.96 -0.63 -5.04 118.68 116.95 3mtl s LEU 415 Ca 0.01 1.54 0.08 0.00 -0.22 0.00 0.00 54.13 55.53 3mtl s LEU 415 Cb 0.09 -4.50 0.01 0.00 0.50 0.00 0.00 46.19 42.30 3mtl s LEU 415 CO 0.50 -0.77 0.51 1.51 -1.32 0.00 0.00 176.35 176.79 3mtl s ASP 416 N -3.47 5.20 0.22 3.68 -4.77 -1.26 -4.94 116.67 111.33 3mtl s ASP 416 Ca 0.58 -0.72 -0.09 0.00 -3.30 0.00 0.00 52.55 49.02 3mtl s ASP 416 Cb -0.11 -0.33 0.34 0.00 -1.09 0.00 0.00 42.92 41.74 3mtl s ASP 416 CO 0.41 -0.86 1.69 0.77 0.70 0.00 0.00 175.17 177.87 3mtl h SER 417 N 0.72 -0.08 -0.32 2.11 4.64 -1.99 -1.21 113.55 117.41 3mtl h SER 417 Ca -0.38 0.14 -0.08 0.00 -0.47 0.00 0.00 61.79 60.99 3mtl h SER 417 Cb 1.28 0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 63.55 3mtl h SER 417 CO 0.51 -0.04 -0.09 0.44 -0.87 0.00 0.00 176.83 176.77 3mtl h ASP 418 N 0.22 0.72 -0.39 4.97 3.32 -1.96 -1.12 116.42 122.17 3mtl h ASP 418 Ca 0.35 -0.20 0.01 0.00 0.02 0.00 0.00 57.03 57.21 3mtl h ASP 418 Cb 0.56 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 3mtl h ASP 418 CO -0.48 0.84 0.24 1.23 -1.72 0.00 0.00 179.24 179.36 3mtl h GLY 419 N 0.97 0.55 1.28 2.75 0.00 -1.65 -0.06 103.07 106.91 3mtl h GLY 419 Ca 0.12 -0.18 -0.12 0.00 0.00 0.00 0.00 47.33 47.15 3mtl h GLY 419 CO 0.03 0.17 -0.20 0.00 0.00 0.00 0.00 176.54 176.54 3mtl h ALA 420 N 1.16 0.85 -0.61 3.60 0.00 -1.13 -2.04 119.26 121.10 3mtl h ALA 420 Ca 0.15 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3mtl h ALA 420 Cb -0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3mtl h ALA 420 CO -0.06 0.64 0.05 0.22 0.00 0.00 0.00 179.25 180.10 3mtl h ASP 421 N 0.73 1.00 -0.56 0.00 1.82 -0.70 -0.29 116.42 118.42 3mtl h ASP 421 Ca 0.10 -0.28 -0.06 0.00 -0.39 0.00 0.00 57.03 56.40 3mtl h ASP 421 Cb 0.73 -0.27 -0.02 0.00 0.68 0.00 0.00 39.33 40.45 3mtl h ASP 421 CO 0.06 1.04 0.13 0.25 -1.61 0.00 0.00 179.24 179.10 3mtl h LEU 422 N 0.94 0.85 -0.23 2.28 5.85 -0.91 -1.82 115.31 122.27 3mtl h LEU 422 Ca 0.18 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.69 3mtl h LEU 422 Cb 0.49 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 3mtl h LEU 422 CO 0.02 0.87 0.05 0.25 -0.34 0.00 0.00 178.44 179.30 3mtl h LEU 423 N 0.80 0.03 -0.09 2.25 5.85 -1.15 -1.72 115.31 121.28 3mtl h LEU 423 Ca 0.17 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.97 3mtl h LEU 423 Cb 0.36 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 3mtl h LEU 423 CO 0.00 0.05 -0.22 0.74 -0.34 0.00 0.00 178.44 178.68 3mtl h THR 424 N 0.15 0.48 0.00 1.05 2.02 -0.82 -0.81 112.91 114.97 3mtl h THR 424 Ca 0.10 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.27 3mtl h THR 424 Cb 0.09 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 3mtl h THR 424 CO -0.13 0.00 -0.04 0.11 0.37 0.00 0.00 175.52 175.83 3mtl h LYS 425 N -0.29 0.00 0.12 6.66 1.57 -1.06 -2.76 116.57 120.81 3mtl h LYS 425 Ca 0.09 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.67 3mtl h LYS 425 Cb 0.42 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.74 3mtl h LYS 425 CO -0.26 0.04 -0.95 -0.07 -0.57 0.00 0.00 179.45 177.65 3mtl h LEU 426 N 0.00 0.41 -5.64 2.94 3.38 -0.76 -2.42 115.31 113.23 3mtl h LEU 426 Ca -0.00 -0.92 -0.74 0.00 0.09 0.00 0.00 57.88 56.32 3mtl h LEU 426 Cb 0.13 -0.13 -0.14 0.00 0.09 0.00 0.00 40.66 40.61 3mtl h LEU 426 CO 0.01 1.44 2.21 0.18 0.09 0.00 0.00 178.44 182.37 3mtl n LEU 427 N -4.10 7.93 -4.81 1.67 4.77 -0.36 -4.27 117.00 117.83 3mtl n LEU 427 Ca -0.17 -4.89 -0.38 0.00 -0.03 0.00 0.00 56.01 50.54 3mtl n LEU 427 Cb 0.82 -1.34 -0.06 0.00 -2.33 0.00 0.00 43.42 40.52 3mtl n LEU 427 CO 0.45 2.05 0.09 -1.58 -1.33 0.00 0.00 177.39 177.07 3mtl s GLN 428 N -1.45 3.98 0.24 3.23 2.00 -1.25 -4.93 119.66 121.48 3mtl s GLN 428 Ca 0.53 0.36 -0.05 0.00 -2.00 0.00 0.00 55.36 54.20 3mtl s GLN 428 Cb 0.20 -3.27 0.44 0.00 0.80 0.00 0.00 33.01 31.18 3mtl s GLN 428 CO -0.11 0.59 1.73 0.74 -0.50 0.00 0.00 175.29 177.74 3mtl h PHE 429 N 5.16 0.48 -3.88 1.67 0.04 -1.93 -3.40 116.94 115.08 3mtl h PHE 429 Ca -0.49 0.04 -0.64 0.00 2.80 0.00 0.00 57.97 59.67 3mtl h PHE 429 Cb 1.21 -0.10 -0.17 0.00 2.20 0.00 0.00 35.95 39.09 3mtl h PHE 429 CO 0.69 0.05 -0.49 -2.00 -0.60 0.00 0.00 178.31 175.96 3mtl s GLU 430 N -6.03 3.96 0.30 1.51 2.56 -1.26 -3.66 118.70 116.09 3mtl s GLU 430 Ca -0.12 -0.28 0.06 0.00 0.00 0.00 0.00 54.97 54.63 3mtl s GLU 430 Cb 0.20 -3.66 0.81 0.00 2.00 0.00 0.00 34.13 33.48 3mtl s GLU 430 CO 0.76 -0.19 1.70 0.78 -0.56 0.00 0.00 175.26 177.75 3mtl h GLY 431 N 8.38 1.67 1.69 -1.50 0.00 -1.92 -1.35 103.07 110.05 3mtl h GLY 431 Ca -0.35 -0.20 0.04 0.00 0.00 0.00 0.00 47.33 46.82 3mtl h GLY 431 CO 0.56 -0.29 0.12 0.07 0.00 0.00 0.00 176.54 177.00 3mtl h ARG 432 N 0.42 0.00 0.00 4.80 -0.00 -1.95 -1.75 114.38 115.90 3mtl h ARG 432 Ca 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.58 3mtl h ARG 432 Cb 1.17 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.14 3mtl h ARG 432 CO -0.53 0.00 -0.98 0.09 -0.00 0.00 0.00 179.97 178.54 3mtl n ASN 433 N -4.03 0.64 -4.71 0.08 3.02 -0.52 -4.91 115.26 104.83 3mtl n ASN 433 Ca 0.00 -0.35 -0.42 0.00 -0.03 0.00 0.00 54.58 53.79 3mtl n ASN 433 Cb 0.23 0.80 -0.03 0.00 -0.61 0.00 0.00 39.78 40.17 3mtl n ASN 433 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3mtl s ARG 434 N -3.15 4.26 0.54 3.52 0.52 -0.66 -4.93 118.95 119.06 3mtl s ARG 434 Ca 0.05 2.21 -0.21 0.00 -0.52 0.00 0.00 55.73 57.26 3mtl s ARG 434 Cb 0.15 -3.27 -0.07 0.00 0.52 0.00 0.00 34.95 32.28 3mtl s ARG 434 CO 0.80 -0.55 0.99 1.51 0.02 0.00 0.00 175.30 178.07 3mtl n ILE 435 N 4.09 3.19 -1.73 1.52 3.06 -0.91 -5.00 119.36 123.58 3mtl n ILE 435 Ca 0.13 -0.50 -0.31 0.00 -2.50 0.00 0.00 62.75 59.57 3mtl n ILE 435 Cb 0.41 -1.17 0.04 0.00 0.54 0.00 0.00 39.64 39.46 3mtl n ILE 435 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3mtl s SER 436 N -1.04 5.56 0.30 9.51 1.04 -1.26 -4.88 113.70 122.92 3mtl s SER 436 Ca 0.71 1.41 0.03 0.00 0.48 0.00 0.00 55.95 58.57 3mtl s SER 436 Cb -0.46 -2.31 0.47 0.00 0.10 0.00 0.00 66.02 63.83 3mtl s SER 436 CO 0.51 -1.30 1.78 0.00 0.98 0.00 0.00 173.24 175.21 3mtl h ALA 437 N -0.62 1.20 0.28 5.32 0.00 -1.94 0.58 119.26 124.07 3mtl h ALA 437 Ca -0.45 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.17 3mtl h ALA 437 Cb 1.22 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3mtl h ALA 437 CO 0.60 0.51 -0.14 0.93 0.00 0.00 0.00 179.25 181.16 3mtl h GLU 438 N 0.49 -0.37 -0.43 0.00 5.08 -1.93 -3.05 114.58 114.37 3mtl h GLU 438 Ca 0.09 0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.39 3mtl h GLU 438 Cb 0.52 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3mtl h GLU 438 CO 0.03 -0.15 -0.07 -0.44 -1.00 0.00 0.00 179.01 177.38 3mtl h ASP 439 N -0.51 0.72 -0.77 1.42 3.32 -1.92 -2.75 116.42 115.94 3mtl h ASP 439 Ca -0.04 -0.20 0.18 0.00 0.02 0.00 0.00 57.03 56.99 3mtl h ASP 439 Cb 0.38 -0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.69 3mtl h ASP 439 CO 0.06 0.84 0.52 0.00 -1.72 0.00 0.00 179.24 178.94 3mtl h ALA 440 N 1.24 2.30 0.00 3.45 0.00 -0.84 0.27 119.26 125.68 3mtl h ALA 440 Ca 0.12 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3mtl h ALA 440 Cb 0.53 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 3mtl h ALA 440 CO 0.03 -0.52 -0.11 0.52 0.00 0.00 0.00 179.25 179.17 3mtl h MET 441 N 0.29 0.00 -0.39 0.00 2.86 -1.38 -3.21 114.93 113.10 3mtl h MET 441 Ca 0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.02 3mtl h MET 441 Cb 1.07 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.73 3mtl h MET 441 CO -0.10 0.11 0.00 1.63 1.06 0.00 0.00 176.91 179.61 3mtl n LYS 442 N -3.15 2.33 -2.41 1.72 5.02 0.07 -4.85 118.16 116.88 3mtl n LYS 442 Ca 0.03 -2.02 -0.38 0.00 -2.02 0.00 0.00 58.31 53.92 3mtl n LYS 442 Cb 0.52 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 34.02 3mtl n LYS 442 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3mtl s HIS 443 N -1.49 3.27 0.33 2.13 2.46 -1.12 -4.95 115.29 115.92 3mtl s HIS 443 Ca 0.38 1.62 0.26 0.00 0.47 0.00 0.00 55.06 57.79 3mtl s HIS 443 Cb 0.21 -3.29 1.42 0.00 -0.13 0.00 0.00 32.58 30.79 3mtl s HIS 443 CO 0.30 -0.91 1.77 -1.35 -2.47 0.00 0.00 174.74 172.08 3mtl h PRO 444 N 2.96 0.00 -0.30 2.88 0.11 -1.93 -2.41 132.00 133.32 3mtl h PRO 444 Ca -0.48 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.69 3mtl h PRO 444 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3mtl h PRO 444 CO 0.64 0.00 0.20 0.35 -0.21 0.00 0.00 178.00 178.98 3mtl h PHE 445 N 0.00 0.15 -0.02 0.65 3.57 -1.92 -2.57 116.94 116.79 3mtl h PHE 445 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3mtl h PHE 445 Cb 0.42 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.12 3mtl h PHE 445 CO 0.00 0.08 -0.05 1.19 -2.23 0.00 0.00 178.31 177.30 3mtl n PHE 446 N -4.48 0.00 -0.26 0.41 3.72 -0.91 -4.54 117.46 111.41 3mtl n PHE 446 Ca 0.03 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.50 3mtl n PHE 446 Cb 0.27 -0.01 0.19 0.00 -0.94 0.00 0.00 39.48 38.99 3mtl n PHE 446 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 3mtl h LEU 447 N 3.28 -0.19 -2.02 4.37 5.85 -1.61 -1.10 115.31 123.89 3mtl h LEU 447 Ca 0.00 0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.99 3mtl h LEU 447 Cb 0.73 0.29 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 3mtl h LEU 447 CO 0.00 -0.14 0.39 0.77 -0.34 0.00 0.00 178.44 179.12 3mtl h SER 448 N 0.16 0.00 0.93 1.25 4.64 -1.82 -1.14 113.55 117.57 3mtl h SER 448 Ca 0.44 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.67 3mtl h SER 448 Cb 0.80 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.88 3mtl h SER 448 CO -0.63 0.00 -0.44 -0.07 -0.87 0.00 0.00 176.83 174.82 3mtl h LEU 449 N 0.00 0.00 0.00 5.97 3.38 -1.54 -3.50 115.31 119.61 3mtl h LEU 449 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3mtl h LEU 449 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3mtl h LEU 449 CO -0.00 0.44 0.00 0.61 0.09 0.00 0.00 178.44 179.58 3mtl n GLY 450 N 0.43 0.82 0.13 0.83 0.00 -0.43 -4.75 105.19 102.22 3mtl n GLY 450 Ca 0.00 -2.07 0.07 0.00 0.00 0.00 0.00 46.02 44.02 3mtl n GLY 450 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3mtl h GLU 451 N 0.00 0.00 0.00 1.61 5.08 -1.95 -3.37 114.58 115.94 3mtl h GLU 451 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3mtl h GLU 451 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 3mtl h GLU 451 CO 0.00 0.18 -0.00 0.00 -1.00 0.00 0.00 179.01 178.18 3mtl h ARG 452 N 0.00 0.00 0.00 2.33 3.08 -2.01 -2.93 114.38 114.85 3mtl h ARG 452 Ca -0.05 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 59.97 3mtl h ARG 452 Cb 1.24 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.29 3mtl h ARG 452 CO 0.03 0.00 -0.13 -0.84 -1.07 0.00 0.00 179.97 177.96 3mtl h ILE 453 N 0.00 0.25 0.00 2.04 -0.00 -1.86 -3.21 117.51 114.73 3mtl h ILE 453 Ca -0.00 -1.17 -0.01 0.00 -0.00 0.00 0.00 64.86 63.68 3mtl h ILE 453 Cb 0.38 1.96 -0.00 0.00 -0.00 0.00 0.00 36.82 39.15 3mtl h ILE 453 CO 0.00 0.13 -0.21 0.45 -0.00 0.00 0.00 178.15 178.52 3mtl h HIS 454 N 0.00 0.00 -0.00 0.16 3.86 -1.78 -3.30 115.15 114.09 3mtl h HIS 454 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3mtl h HIS 454 Cb 0.95 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.42 3mtl h HIS 454 CO 0.00 0.06 -0.56 1.63 0.86 0.00 0.00 177.93 179.92 3mtl n LYS 455 N -3.05 0.09 -2.02 2.45 4.01 -1.21 -4.96 118.16 113.46 3mtl n LYS 455 Ca 0.03 -0.05 -0.41 0.00 -0.51 0.00 0.00 58.31 57.37 3mtl n LYS 455 Cb 0.56 -1.50 -0.02 0.00 -0.51 0.00 0.00 35.03 33.56 3mtl n LYS 455 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 3mtl s LEU 456 N -2.95 4.39 0.67 -0.35 1.43 -1.24 -5.01 118.68 115.62 3mtl s LEU 456 Ca 0.12 2.72 -0.13 0.00 -1.03 0.00 0.00 54.13 55.80 3mtl s LEU 456 Cb 0.17 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.76 3mtl s LEU 456 CO 0.71 -0.67 1.08 -2.84 0.23 0.00 0.00 176.35 174.86 3mtl s PRO 457 N -1.02 2.91 0.34 1.29 0.02 -1.26 -4.92 135.00 132.36 3mtl s PRO 457 Ca 0.55 1.17 0.13 0.00 0.02 0.00 0.00 61.00 62.88 3mtl s PRO 457 Cb -0.42 -1.98 1.11 0.00 0.02 0.00 0.00 34.50 33.23 3mtl s PRO 457 CO 0.49 -1.14 1.59 -0.44 -0.33 0.00 0.00 177.00 177.16 3mtl h ASP 458 N -0.24 0.07 1.50 2.53 3.32 -1.95 -2.19 116.42 119.46 3mtl h ASP 458 Ca -0.45 0.26 0.00 0.00 0.02 0.00 0.00 57.03 56.85 3mtl h ASP 458 Cb 1.23 0.33 0.00 0.00 0.22 0.00 0.00 39.33 41.10 3mtl h ASP 458 CO 0.55 -0.37 -0.13 0.71 -1.72 0.00 0.00 179.24 178.29 3mtl h THR 459 N 0.04 0.00 -3.23 0.35 1.35 -1.92 -0.73 112.91 108.78 3mtl h THR 459 Ca 0.75 -0.63 -0.58 0.00 -0.55 0.00 0.00 66.41 65.39 3mtl h THR 459 Cb 1.82 1.55 -0.07 0.00 -1.73 0.00 0.00 68.15 69.72 3mtl h THR 459 CO -0.80 0.00 -0.14 0.42 -0.25 0.00 0.00 175.52 174.75 3mtl s THR 460 N -3.15 5.08 0.54 6.82 -4.23 -0.82 -4.38 115.64 115.50 3mtl s THR 460 Ca 0.09 0.96 -0.22 0.00 -1.18 0.00 0.00 61.69 61.33 3mtl s THR 460 Cb 0.11 -3.80 -0.06 0.00 1.34 0.00 0.00 72.50 70.09 3mtl s THR 460 CO 0.64 0.43 1.29 -0.24 -0.54 0.00 0.00 174.62 176.20 3mtl n SER 461 N 2.89 2.40 0.16 3.99 2.88 -1.26 -4.79 113.62 119.89 3mtl n SER 461 Ca -0.09 0.97 0.01 0.00 -1.33 0.00 0.00 58.87 58.43 3mtl n SER 461 Cb 0.52 -1.54 0.26 0.00 -0.75 0.00 0.00 64.21 62.69 3mtl n SER 461 CO 0.00 0.00 0.00 0.16 -1.23 0.00 0.00 175.04 173.97 3mtl h ILE 462 N 1.39 1.33 0.00 2.46 3.07 -1.97 -3.03 117.51 120.76 3mtl h ILE 462 Ca -0.50 -1.75 -0.00 0.00 1.55 0.00 0.00 64.86 64.16 3mtl h ILE 462 Cb 1.31 1.95 -0.00 0.00 -0.27 0.00 0.00 36.82 39.81 3mtl h ILE 462 CO 0.57 0.50 -0.00 -0.26 -1.05 0.00 0.00 178.15 177.90 3mtl h PHE 463 N 0.00 0.00 -0.98 0.16 0.04 -1.93 -3.03 116.94 111.21 3mtl h PHE 463 Ca -0.01 0.00 0.28 0.00 2.80 0.00 0.00 57.97 61.05 3mtl h PHE 463 Cb 0.91 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.02 3mtl h PHE 463 CO 0.00 0.00 0.71 0.00 -0.60 0.00 0.00 178.31 178.42 3mtl h ALA 464 N 2.00 2.92 -2.61 2.45 0.00 -1.84 -3.41 119.26 118.77 3mtl h ALA 464 Ca -0.00 -0.03 -0.53 0.00 0.00 0.00 0.00 54.91 54.35 3mtl h ALA 464 Cb 0.12 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3mtl h ALA 464 CO 0.00 -1.21 0.29 -0.51 0.00 0.00 0.00 179.25 177.81 3mtl s LEU 465 N -8.43 4.49 0.24 0.00 2.01 -1.14 -4.97 118.68 110.88 3mtl s LEU 465 Ca -0.05 1.68 -0.07 0.00 0.01 0.00 0.00 54.13 55.70 3mtl s LEU 465 Cb 0.22 -3.46 0.24 0.00 0.01 0.00 0.00 46.19 43.20 3mtl s LEU 465 CO 0.78 -0.02 1.91 0.07 1.01 0.00 0.00 176.35 180.09 3mtl h LYS 466 N 5.53 1.29 -0.39 1.70 2.10 -1.92 -2.58 116.57 122.30 3mtl h LYS 466 Ca -0.43 -0.10 0.06 0.00 -2.00 0.00 0.00 60.65 58.18 3mtl h LYS 466 Cb 1.21 -0.28 -0.02 0.00 -0.90 0.00 0.00 32.23 32.24 3mtl h LYS 466 CO 0.71 0.88 0.26 1.05 -2.00 0.00 0.00 179.45 180.35 3mtl h GLU 467 N 1.32 0.25 -4.92 0.07 4.11 -1.93 -3.40 114.58 110.08 3mtl h GLU 467 Ca 0.35 -0.02 -0.65 0.00 0.07 0.00 0.00 59.36 59.12 3mtl h GLU 467 Cb -0.10 -0.06 -0.17 0.00 0.50 0.00 0.00 28.75 28.92 3mtl h GLU 467 CO -0.07 0.17 -0.43 0.42 0.07 0.00 0.00 179.01 179.17 3mtl s ILE 468 N -5.26 5.26 -0.20 -1.06 1.09 -0.97 -5.04 121.20 115.02 3mtl s ILE 468 Ca -0.07 0.15 -0.20 0.00 -1.10 0.00 0.00 60.65 59.43 3mtl s ILE 468 Cb 0.18 -3.64 0.05 0.00 -1.06 0.00 0.00 42.46 38.00 3mtl s ILE 468 CO 0.72 0.13 0.56 0.00 -0.10 0.00 0.00 174.94 176.26 3mtl s GLN 469 N 1.85 0.69 0.21 2.79 -2.07 -1.26 -4.69 119.66 117.18 3mtl s GLN 469 Ca 0.09 0.72 -0.31 0.00 -1.82 0.00 0.00 55.36 54.04 3mtl s GLN 469 Cb -0.16 0.33 -0.10 0.00 -1.09 0.00 0.00 33.01 31.99 3mtl s GLN 469 CO 0.11 -0.10 1.54 -1.17 -1.32 0.00 0.00 175.29 174.35 3mtl s LEU 470 N 0.16 4.37 0.00 2.60 2.96 -1.26 -4.98 118.68 122.53 3mtl s LEU 470 Ca -0.01 2.70 -0.14 0.00 -0.22 0.00 0.00 54.13 56.45 3mtl s LEU 470 Cb -0.04 -3.61 -0.06 0.00 0.50 0.00 0.00 46.19 42.99 3mtl s LEU 470 CO 0.01 -0.80 0.40 -1.10 -1.32 0.00 0.00 176.35 173.55 3mtl s GLN 471 N 0.38 3.90 0.24 1.98 -1.52 -1.26 -5.06 119.66 118.33 3mtl s GLN 471 Ca 0.66 0.40 -0.30 0.00 -1.95 0.00 0.00 55.36 54.16 3mtl s GLN 471 Cb -0.44 -3.21 -0.10 0.00 -0.22 0.00 0.00 33.01 29.04 3mtl s GLN 471 CO 0.38 0.69 1.44 -1.59 -0.25 0.00 0.00 175.29 175.96 3mtl s LYS 472 N -1.10 4.27 0.00 2.91 -2.85 -1.26 -4.93 119.74 116.77 3mtl s LYS 472 Ca 0.24 2.30 0.13 0.00 -1.00 0.00 0.00 55.97 57.64 3mtl s LYS 472 Cb -0.17 -3.11 0.76 0.00 -2.06 0.00 0.00 37.83 33.25 3mtl s LYS 472 CO 0.13 -0.43 1.19 0.39 0.10 0.00 0.00 175.35 176.73