#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k62 n PRO 169 N 0.00 2.04 -0.25 3.23 -0.04 -1.26 -4.89 135.00 133.82 3k62 n PRO 169 Ca 0.00 0.72 0.03 0.00 -0.04 0.00 0.00 63.50 64.21 3k62 n PRO 169 Cb 0.00 -2.36 0.26 0.00 -0.04 0.00 0.00 33.50 31.36 3k62 n PRO 169 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k62 h THR 170 N 2.31 1.10 -0.18 0.52 1.03 -2.03 -1.60 112.91 114.06 3k62 h THR 170 Ca -0.47 -0.33 0.05 0.00 -0.01 0.00 0.00 66.41 65.65 3k62 h THR 170 Cb 1.29 0.04 -0.01 0.00 -1.07 0.00 0.00 68.15 68.40 3k62 h THR 170 CO 0.61 0.18 0.30 4.11 -0.01 0.00 0.00 175.52 180.71 3k62 h TRP 171 N 0.98 0.00 -0.33 0.00 5.08 -2.02 -0.69 115.95 118.97 3k62 h TRP 171 Ca 0.34 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.31 3k62 h TRP 171 Cb 0.11 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.27 3k62 h TRP 171 CO -0.00 0.00 0.00 -1.13 -1.28 0.00 0.00 178.44 176.03 3k62 n SER 172 N -3.44 3.14 -4.71 0.11 3.41 -0.60 -4.94 113.62 106.59 3k62 n SER 172 Ca 0.02 -1.95 -0.31 0.00 -0.26 0.00 0.00 58.87 56.37 3k62 n SER 172 Cb 0.41 -0.21 -0.08 0.00 -0.26 0.00 0.00 64.21 64.07 3k62 n SER 172 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3k62 s LEU 173 N -1.54 3.55 0.00 1.04 1.43 -0.27 -0.72 118.68 122.16 3k62 s LEU 173 Ca 0.37 -0.10 -0.00 0.00 -1.03 0.00 0.00 54.13 53.36 3k62 s LEU 173 Cb 0.22 -2.22 0.01 0.00 0.03 0.00 0.00 46.19 44.24 3k62 s LEU 173 CO 0.31 0.20 0.09 -0.90 0.23 0.00 0.00 176.35 176.28 3k62 n ASP 174 N 0.74 0.08 0.00 2.29 3.85 0.08 -4.77 116.55 118.82 3k62 n ASP 174 Ca -0.11 -1.08 0.12 0.00 -0.71 0.00 0.00 54.79 53.00 3k62 n ASP 174 Cb 0.52 -0.06 0.64 0.00 -1.35 0.00 0.00 41.12 40.87 3k62 n ASP 174 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3k62 n SER 175 N -3.02 0.00 -0.86 -1.12 7.64 -1.26 -2.49 113.62 112.51 3k62 n SER 175 Ca 0.01 -0.42 0.12 0.00 1.01 0.00 0.00 58.87 59.60 3k62 n SER 175 Cb 0.05 -0.13 0.18 0.00 -1.01 0.00 0.00 64.21 63.30 3k62 n SER 175 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3k62 n ASN 176 N -1.13 2.70 -1.33 6.43 3.02 -1.26 -4.94 115.26 118.75 3k62 n ASN 176 Ca 0.15 -1.90 -0.09 0.00 -0.03 0.00 0.00 54.58 52.71 3k62 n ASN 176 Cb 0.13 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.31 3k62 n ASN 176 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k62 n GLY 177 N 1.32 0.22 2.95 7.41 0.00 -1.04 -5.04 105.19 111.01 3k62 n GLY 177 Ca 0.15 -0.43 -0.12 0.00 0.00 0.00 0.00 46.02 45.63 3k62 n GLY 177 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3k62 s GLU 178 N -4.99 0.25 -0.00 1.61 2.12 -1.26 -4.93 118.70 111.50 3k62 s GLU 178 Ca 0.12 -0.34 -0.36 0.00 0.36 0.00 0.00 54.97 54.75 3k62 s GLU 178 Cb -0.05 -0.08 -0.15 0.00 0.26 0.00 0.00 34.13 34.12 3k62 s GLU 178 CO 0.15 0.01 1.61 -0.12 -0.54 0.00 0.00 175.26 176.37 3k62 n MET 179 N 2.33 1.67 -1.77 4.30 0.00 -1.26 -0.74 117.12 121.65 3k62 n MET 179 Ca -0.18 0.61 -0.41 0.00 -0.00 0.00 0.00 57.70 57.72 3k62 n MET 179 Cb 0.57 -2.34 -0.01 0.00 0.00 0.00 0.00 33.22 31.45 3k62 n MET 179 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 175.97 177.00 3k62 s ARG 180 N 2.02 4.10 0.54 2.12 0.52 0.10 -4.78 118.95 123.57 3k62 s ARG 180 Ca 0.87 2.60 -0.08 0.00 -0.52 0.00 0.00 55.73 58.61 3k62 s ARG 180 Cb -0.84 -2.99 -0.04 0.00 0.52 0.00 0.00 34.95 31.61 3k62 s ARG 180 CO 0.49 -0.60 0.89 -1.54 0.02 0.00 0.00 175.30 174.56 3k62 s SER 181 N 0.17 6.22 0.00 0.23 1.04 -1.26 -4.01 113.70 116.08 3k62 s SER 181 Ca 0.58 1.13 0.00 0.00 0.48 0.00 0.00 55.95 58.14 3k62 s SER 181 Cb -0.48 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 63.32 3k62 s SER 181 CO 0.57 -0.72 0.00 -1.14 0.98 0.00 0.00 173.24 172.93 3k62 n ARG 182 N -2.48 0.00 -2.27 4.02 0.63 -1.26 -5.03 116.66 110.27 3k62 n ARG 182 Ca 0.03 0.10 -0.39 0.00 -0.92 0.00 0.00 57.85 56.67 3k62 n ARG 182 Cb 0.55 -3.15 -0.02 0.00 0.45 0.00 0.00 32.46 30.28 3k62 n ARG 182 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 3k62 s LEU 183 N 0.00 4.23 0.12 6.15 1.98 -1.26 -5.05 118.68 124.86 3k62 s LEU 183 Ca 0.00 2.40 0.03 0.00 -2.89 0.00 0.00 54.13 53.66 3k62 s LEU 183 Cb 0.00 -3.96 -0.04 0.00 0.66 0.00 0.00 46.19 42.85 3k62 s LEU 183 CO 0.00 -0.66 0.19 -0.94 -1.89 0.00 0.00 176.35 173.05 3k62 s SER 184 N -1.04 5.94 0.21 3.68 1.04 -1.26 -5.01 113.70 117.26 3k62 s SER 184 Ca 0.56 0.06 -0.10 0.00 0.48 0.00 0.00 55.95 56.95 3k62 s SER 184 Cb -0.32 -1.70 0.15 0.00 0.10 0.00 0.00 66.02 64.25 3k62 s SER 184 CO 0.41 0.10 1.85 0.25 0.98 0.00 0.00 173.24 176.83 3k62 h LEU 185 N 2.62 0.89 -1.00 2.42 5.85 -1.97 -2.90 115.31 121.23 3k62 h LEU 185 Ca -0.47 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.13 3k62 h LEU 185 Cb 1.18 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.96 3k62 h LEU 185 CO 0.68 0.69 0.10 0.28 -0.34 0.00 0.00 178.44 179.85 3k62 h SER 186 N 1.02 0.78 -0.39 1.25 0.02 -1.98 -0.12 113.55 114.12 3k62 h SER 186 Ca 0.27 -0.15 0.05 0.00 -0.84 0.00 0.00 61.79 61.12 3k62 h SER 186 Cb -0.04 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.25 3k62 h SER 186 CO -0.05 0.78 0.13 -0.33 -1.14 0.00 0.00 176.83 176.22 3k62 h GLU 187 N 0.79 0.27 -0.26 3.45 5.08 -1.93 0.19 114.58 122.18 3k62 h GLU 187 Ca 0.17 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 3k62 h GLU 187 Cb 0.33 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3k62 h GLU 187 CO 0.00 0.18 0.07 0.28 -1.00 0.00 0.00 179.01 178.54 3k62 h VAL 188 N 0.28 1.21 -0.83 3.13 2.07 -1.25 -1.98 116.25 118.88 3k62 h VAL 188 Ca 0.18 -0.69 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 3k62 h VAL 188 Cb 0.17 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3k62 h VAL 188 CO -0.20 0.22 0.50 -0.07 0.02 0.00 0.00 177.57 178.05 3k62 h LEU 189 N 0.25 0.99 -1.06 2.57 3.38 -0.75 -2.73 115.31 117.95 3k62 h LEU 189 Ca 0.08 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 3k62 h LEU 189 Cb 0.28 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 3k62 h LEU 189 CO 0.00 0.76 -0.42 0.44 0.09 0.00 0.00 178.44 179.32 3k62 h ASP 190 N 1.13 0.00 1.12 -0.43 3.45 -0.53 -3.31 116.42 117.85 3k62 h ASP 190 Ca 0.30 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.72 3k62 h ASP 190 Cb -0.05 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.72 3k62 h ASP 190 CO -0.06 0.42 -0.19 0.77 -1.57 0.00 0.00 179.24 178.61 3k62 h SER 191 N 0.00 0.00 0.00 6.45 4.64 -1.03 -3.46 113.55 120.15 3k62 h SER 191 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3k62 h SER 191 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 3k62 h SER 191 CO 0.05 0.19 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 3k62 n GLY 192 N 0.35 0.72 1.23 -0.77 0.00 -1.25 -4.92 105.19 100.55 3k62 n GLY 192 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.14 3k62 n GLY 192 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3k62 n ASP 193 N 0.00 3.79 -0.33 1.61 10.43 -1.26 -4.65 116.55 126.14 3k62 n ASP 193 Ca 0.00 -2.00 0.14 0.00 2.57 0.00 0.00 54.79 55.50 3k62 n ASP 193 Cb 0.00 -0.45 0.33 0.00 1.84 0.00 0.00 41.12 42.85 3k62 n ASP 193 CO 0.00 0.00 0.00 0.25 -1.07 0.00 0.00 177.20 176.38 3k62 h LEU 194 N 3.90 0.62 -1.95 0.64 6.46 -1.91 -0.57 115.31 122.50 3k62 h LEU 194 Ca 0.00 0.12 -0.02 0.00 -0.12 0.00 0.00 57.88 57.86 3k62 h LEU 194 Cb 0.95 0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.91 3k62 h LEU 194 CO 0.00 0.14 -0.10 0.24 -0.62 0.00 0.00 178.44 178.10 3k62 h MET 195 N 0.60 0.00 -0.17 1.25 2.86 -1.94 0.29 114.93 117.82 3k62 h MET 195 Ca 0.59 0.00 -0.19 0.00 -2.06 0.00 0.00 59.70 58.03 3k62 h MET 195 Cb 1.04 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.70 3k62 h MET 195 CO -0.45 0.10 -0.67 0.87 1.06 0.00 0.00 176.91 177.82 3k62 h LYS 196 N 0.00 0.68 -0.41 1.72 1.57 -1.46 -3.19 116.57 115.48 3k62 h LYS 196 Ca -0.00 -0.50 -0.14 0.00 -1.87 0.00 0.00 60.65 58.14 3k62 h LYS 196 Cb 0.20 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3k62 h LYS 196 CO 0.01 1.12 -0.30 0.74 -0.57 0.00 0.00 179.45 180.46 3k62 h PHE 197 N 0.49 1.09 0.00 -1.35 0.04 -1.14 -3.29 116.94 112.77 3k62 h PHE 197 Ca -0.02 -0.30 -0.03 0.00 2.80 0.00 0.00 57.97 60.42 3k62 h PHE 197 Cb 1.27 -0.24 -0.00 0.00 2.20 0.00 0.00 35.95 39.18 3k62 h PHE 197 CO 0.07 1.11 -0.14 0.00 -0.60 0.00 0.00 178.31 178.75 3k62 h ALA 198 N 0.80 1.10 -0.71 2.45 0.00 -1.03 -0.56 119.26 121.31 3k62 h ALA 198 Ca 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3k62 h ALA 198 Cb 0.88 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3k62 h ALA 198 CO 0.08 0.17 0.00 1.33 0.00 0.00 0.00 179.25 180.83 3k62 n VAL 199 N -3.39 1.02 -4.52 0.00 0.24 -1.21 -2.94 118.33 107.54 3k62 n VAL 199 Ca -0.01 -1.01 -0.34 0.00 -2.04 0.00 0.00 64.34 60.95 3k62 n VAL 199 Cb 0.33 0.49 -0.11 0.00 -1.47 0.00 0.00 33.84 33.08 3k62 n VAL 199 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3k62 s ASP 200 N -1.00 4.83 0.11 -1.34 2.15 -0.91 -4.90 116.67 115.61 3k62 s ASP 200 Ca 0.47 0.00 -0.28 0.00 0.43 0.00 0.00 52.55 53.18 3k62 s ASP 200 Cb 0.25 -1.37 -0.09 0.00 -0.30 0.00 0.00 42.92 41.41 3k62 s ASP 200 CO 0.32 0.33 1.63 0.50 -0.17 0.00 0.00 175.17 177.78 3k62 h LYS 201 N 5.50 -0.50 -0.54 4.34 3.64 -1.91 0.11 116.57 127.21 3k62 h LYS 201 Ca -0.46 0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 58.87 3k62 h LYS 201 Cb 1.18 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 33.10 3k62 h LYS 201 CO 0.55 -0.33 -0.01 1.15 -2.27 0.00 0.00 179.45 178.54 3k62 h THR 202 N -0.52 1.26 -0.55 1.00 2.02 -1.96 -1.80 112.91 112.36 3k62 h THR 202 Ca 0.03 -1.12 -0.07 0.00 0.77 0.00 0.00 66.41 66.01 3k62 h THR 202 Cb 0.54 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 67.84 3k62 h THR 202 CO -0.15 0.40 0.06 1.23 0.37 0.00 0.00 175.52 177.42 3k62 h GLY 203 N 0.84 1.00 1.61 2.16 0.00 -1.67 -2.33 103.07 104.68 3k62 h GLY 203 Ca 0.15 -0.69 -0.17 0.00 0.00 0.00 0.00 47.33 46.62 3k62 h GLY 203 CO 0.03 0.64 -0.65 0.00 0.00 0.00 0.00 176.54 176.56 3k62 h GLN 205 N 0.29 0.58 0.19 0.00 4.15 -1.24 0.18 115.11 119.25 3k62 h GLN 205 Ca -0.01 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.36 3k62 h GLN 205 Cb 1.20 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.76 3k62 h GLN 205 CO 0.11 0.38 -0.09 0.35 -1.93 0.00 0.00 178.83 177.65 3k62 h PHE 206 N 0.59 -0.23 -0.67 3.99 3.57 -1.14 -2.27 116.94 120.77 3k62 h PHE 206 Ca 0.25 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.81 3k62 h PHE 206 Cb 0.14 0.08 -0.06 0.00 2.79 0.00 0.00 35.95 38.90 3k62 h PHE 206 CO -0.09 -0.09 0.37 -0.07 -2.23 0.00 0.00 178.31 176.20 3k62 h LEU 207 N -0.32 0.55 -0.89 0.59 3.38 -1.02 0.13 115.31 117.73 3k62 h LEU 207 Ca -0.03 0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3k62 h LEU 207 Cb 0.24 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 3k62 h LEU 207 CO 0.04 0.36 0.59 -0.33 0.09 0.00 0.00 178.44 179.19 3k62 h GLU 208 N 0.69 1.16 -0.14 1.13 4.39 -0.54 0.07 114.58 121.34 3k62 h GLU 208 Ca 0.30 -0.07 -0.15 0.00 0.34 0.00 0.00 59.36 59.78 3k62 h GLU 208 Cb 0.19 -0.26 0.01 0.00 -0.10 0.00 0.00 28.75 28.58 3k62 h GLU 208 CO -0.18 0.76 -0.50 -0.22 -1.16 0.00 0.00 179.01 177.71 3k62 h LYS 209 N 1.19 0.59 -0.89 2.33 1.63 -1.06 -3.24 116.57 117.11 3k62 h LYS 209 Ca 0.33 -0.45 0.02 0.00 -0.85 0.00 0.00 60.65 59.71 3k62 h LYS 209 Cb -0.11 0.08 -0.05 0.00 -0.60 0.00 0.00 32.23 31.55 3k62 h LYS 209 CO -0.08 1.07 0.59 0.00 -3.45 0.00 0.00 179.45 177.58 3k62 h ALA 210 N 0.52 1.40 -0.00 5.00 0.00 -0.46 -2.56 119.26 123.17 3k62 h ALA 210 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3k62 h ALA 210 Cb 1.13 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.59 3k62 h ALA 210 CO 0.11 0.53 -0.02 1.33 0.00 0.00 0.00 179.25 181.19 3k62 n VAL 211 N -4.42 0.00 1.14 0.00 0.24 -0.03 -2.62 118.33 112.63 3k62 n VAL 211 Ca 0.11 -0.02 0.13 0.00 -2.04 0.00 0.00 64.34 62.53 3k62 n VAL 211 Cb 0.07 -0.41 0.41 0.00 -1.47 0.00 0.00 33.84 32.44 3k62 n VAL 211 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3k62 n LYS 212 N -1.13 0.32 -0.42 7.34 5.02 -0.96 -4.93 118.16 123.39 3k62 n LYS 212 Ca 0.17 -0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 3k62 n LYS 212 Cb 0.22 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.73 3k62 n LYS 212 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k62 n GLY 213 N 1.42 1.10 3.73 0.72 0.00 -1.08 -5.02 105.19 106.06 3k62 n GLY 213 Ca 0.09 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.72 3k62 n GLY 213 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k62 s SER 214 N -1.00 6.68 -0.04 1.61 0.01 -1.26 -5.02 113.70 114.69 3k62 s SER 214 Ca 0.00 2.56 0.06 0.00 1.31 0.00 0.00 55.95 59.88 3k62 s SER 214 Cb 0.00 -2.60 -0.01 0.00 0.21 0.00 0.00 66.02 63.61 3k62 s SER 214 CO 0.00 -0.72 -0.23 -0.76 0.41 0.00 0.00 173.24 171.94 3k62 s LEU 215 N 0.52 2.03 0.67 2.44 1.43 -1.26 -5.04 118.68 119.47 3k62 s LEU 215 Ca 0.64 -0.44 -0.11 0.00 -1.03 0.00 0.00 54.13 53.19 3k62 s LEU 215 Cb -0.41 -1.21 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 3k62 s LEU 215 CO 0.36 0.24 1.05 0.42 0.23 0.00 0.00 176.35 178.65 3k62 s THR 216 N -0.26 4.22 0.23 5.49 -4.23 -1.26 -4.88 115.64 114.95 3k62 s THR 216 Ca 0.01 0.73 -0.08 0.00 -1.18 0.00 0.00 61.69 61.17 3k62 s THR 216 Cb -0.11 -3.54 0.24 0.00 1.34 0.00 0.00 72.50 70.43 3k62 s THR 216 CO 0.02 -0.94 1.65 -1.28 -0.54 0.00 0.00 174.62 173.53 3k62 h SER 217 N -0.59 -0.25 -0.11 3.99 0.87 -2.00 -1.82 113.55 113.63 3k62 h SER 217 Ca -0.44 0.17 -0.13 0.00 -1.23 0.00 0.00 61.79 60.16 3k62 h SER 217 Cb 1.20 0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 63.44 3k62 h SER 217 CO 0.58 -0.13 -0.38 0.22 -0.53 0.00 0.00 176.83 176.60 3k62 h TYR 218 N 0.14 0.75 -0.60 2.24 3.20 -1.99 -0.24 116.97 120.48 3k62 h TYR 218 Ca 0.38 -0.21 0.03 0.00 3.14 0.00 0.00 58.73 62.07 3k62 h TYR 218 Cb 0.65 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.72 3k62 h TYR 218 CO -0.37 0.92 0.36 1.96 -1.64 0.00 0.00 178.16 179.39 3k62 h GLN 219 N 0.53 0.70 -0.38 1.82 4.20 -1.79 -0.69 115.11 119.50 3k62 h GLN 219 Ca 0.05 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3k62 h GLN 219 Cb 0.89 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.49 3k62 h GLN 219 CO 0.08 0.46 0.24 0.87 -0.67 0.00 0.00 178.83 179.81 3k62 h LYS 220 N 0.72 0.50 -0.57 1.46 1.57 -1.03 -1.56 116.57 117.67 3k62 h LYS 220 Ca 0.24 -0.04 0.09 0.00 -1.87 0.00 0.00 60.65 59.07 3k62 h LYS 220 Cb 0.02 -0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.15 3k62 h LYS 220 CO -0.10 0.35 0.18 0.35 -0.57 0.00 0.00 179.45 179.66 3k62 h PHE 221 N 0.50 0.30 -0.35 -1.35 3.57 -0.37 0.22 116.94 119.47 3k62 h PHE 221 Ca 0.14 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 3k62 h PHE 221 Cb -0.03 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 3k62 h PHE 221 CO -0.04 0.05 0.05 1.96 -2.23 0.00 0.00 178.31 178.10 3k62 h GLN 222 N 0.34 0.59 -0.68 1.11 4.20 -0.97 -1.60 115.11 118.09 3k62 h GLN 222 Ca 0.29 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.84 3k62 h GLN 222 Cb 0.37 -0.07 -0.03 0.00 0.30 0.00 0.00 27.48 28.05 3k62 h GLN 222 CO -0.32 0.66 0.44 -0.07 -0.67 0.00 0.00 178.83 178.88 3k62 h LEU 223 N 0.42 0.79 -0.67 1.46 3.38 -0.70 0.27 115.31 120.25 3k62 h LEU 223 Ca 0.11 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.08 3k62 h LEU 223 Cb 0.36 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 3k62 h LEU 223 CO 0.01 0.58 0.42 -0.26 0.09 0.00 0.00 178.44 179.28 3k62 h PHE 224 N 0.92 0.78 -0.26 1.13 0.04 -0.35 -0.06 116.94 119.14 3k62 h PHE 224 Ca 0.25 0.02 -0.10 0.00 2.80 0.00 0.00 57.97 60.94 3k62 h PHE 224 Cb -0.09 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 37.80 3k62 h PHE 224 CO -0.02 0.44 -0.24 0.93 -0.60 0.00 0.00 178.31 178.82 3k62 h GLU 225 N 0.81 0.63 0.00 1.51 5.08 -0.94 -0.14 114.58 121.53 3k62 h GLU 225 Ca 0.27 -0.32 -0.19 0.00 -1.00 0.00 0.00 59.36 58.12 3k62 h GLU 225 Cb 0.03 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 3k62 h GLU 225 CO -0.11 0.92 -1.26 1.96 -1.00 0.00 0.00 179.01 179.51 3k62 h GLN 226 N 0.35 0.00 0.00 2.33 4.20 -0.79 -3.03 115.11 118.17 3k62 h GLN 226 Ca 0.04 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.41 3k62 h GLN 226 Cb 0.80 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.52 3k62 h GLN 226 CO 0.06 0.46 -2.28 0.28 -0.67 0.00 0.00 178.83 176.68 3k62 n VAL 227 N -3.04 1.28 -1.14 -0.54 0.31 -0.05 -4.69 118.33 110.46 3k62 n VAL 227 Ca -0.08 -0.47 0.06 0.00 -0.01 0.00 0.00 64.34 63.85 3k62 n VAL 227 Cb 0.88 -1.37 0.09 0.00 -0.91 0.00 0.00 33.84 32.53 3k62 n VAL 227 CO 0.00 0.00 0.00 2.30 -1.32 0.00 0.00 176.83 177.81 3k62 n ILE 228 N -3.28 1.31 -0.09 2.52 -5.35 -1.05 -4.08 119.36 109.34 3k62 n ILE 228 Ca -0.41 -1.55 -0.08 0.00 -0.27 0.00 0.00 62.75 60.44 3k62 n ILE 228 Cb 0.91 0.05 -0.16 0.00 -1.74 0.00 0.00 39.64 38.70 3k62 n ILE 228 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3k62 n GLY 229 N -0.97 -1.00 3.19 3.28 0.00 -0.09 -4.74 105.19 104.86 3k62 n GLY 229 Ca 0.10 -0.36 -0.27 0.00 0.00 0.00 0.00 46.02 45.49 3k62 n GLY 229 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3k62 s ARG 230 N -2.61 1.82 0.14 1.61 1.70 -1.24 -5.00 118.95 115.37 3k62 s ARG 230 Ca -0.10 -0.71 -0.19 0.00 -0.47 0.00 0.00 55.73 54.27 3k62 s ARG 230 Cb 0.07 -1.66 0.01 0.00 -0.57 0.00 0.00 34.95 32.81 3k62 s ARG 230 CO 0.84 0.36 1.71 -0.22 -1.08 0.00 0.00 175.30 176.91 3k62 h LYS 231 N 5.91 0.07 -0.12 3.89 3.64 -1.97 -0.48 116.57 127.51 3k62 h LYS 231 Ca -0.36 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.01 3k62 h LYS 231 Cb 1.16 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 3k62 h LYS 231 CO 0.48 0.05 0.04 -0.44 -2.27 0.00 0.00 179.45 177.31 3k62 h ASP 232 N 0.08 0.17 -0.46 4.20 3.32 -1.99 -1.33 116.42 120.40 3k62 h ASP 232 Ca 0.13 -0.18 -0.09 0.00 0.02 0.00 0.00 57.03 56.91 3k62 h ASP 232 Cb 0.17 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 3k62 h ASP 232 CO -0.22 0.30 -0.06 0.44 -1.72 0.00 0.00 179.24 177.99 3k62 h ASP 233 N 0.03 0.89 -0.47 6.45 3.32 -1.91 -0.35 116.42 124.37 3k62 h ASP 233 Ca 0.04 -0.26 0.05 0.00 0.02 0.00 0.00 57.03 56.88 3k62 h ASP 233 Cb 0.19 -0.24 -0.05 0.00 0.22 0.00 0.00 39.33 39.45 3k62 h ASP 233 CO -0.00 0.98 0.21 0.15 -1.72 0.00 0.00 179.24 178.86 3k62 h PHE 234 N 0.82 0.38 -0.51 4.55 3.57 -0.94 -0.77 116.94 124.05 3k62 h PHE 234 Ca 0.14 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.54 3k62 h PHE 234 Cb 0.57 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 3k62 h PHE 234 CO 0.03 0.17 -0.17 -0.07 -2.23 0.00 0.00 178.31 176.05 3k62 h LEU 235 N 0.42 1.02 -0.67 0.59 3.38 -0.98 -0.12 115.31 118.94 3k62 h LEU 235 Ca 0.21 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 3k62 h LEU 235 Cb 0.16 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 3k62 h LEU 235 CO -0.18 1.17 0.33 0.50 0.09 0.00 0.00 178.44 180.35 3k62 h LYS 236 N 0.87 0.96 -0.03 1.13 3.64 -0.77 -1.83 116.57 120.55 3k62 h LYS 236 Ca 0.12 -0.14 -0.23 0.00 -1.27 0.00 0.00 60.65 59.13 3k62 h LYS 236 Cb 0.75 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 32.40 3k62 h LYS 236 CO 0.06 0.75 -0.93 -0.07 -2.27 0.00 0.00 179.45 176.99 3k62 h LEU 237 N 0.93 0.71 -1.57 5.20 3.38 -1.09 -3.13 115.31 119.75 3k62 h LEU 237 Ca 0.23 -0.54 -0.02 0.00 0.09 0.00 0.00 57.88 57.64 3k62 h LEU 237 Cb 0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3k62 h LEU 237 CO -0.03 1.34 0.06 0.28 0.09 0.00 0.00 178.44 180.18 3k62 h SER 238 N 0.34 0.30 -0.56 -0.43 0.02 -0.81 -1.12 113.55 111.30 3k62 h SER 238 Ca -0.09 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.83 3k62 h SER 238 Cb 1.56 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 64.02 3k62 h SER 238 CO 0.17 0.31 0.00 0.35 -1.14 0.00 0.00 176.83 176.53 3k62 n THR 239 N -4.40 1.12 -4.09 -2.27 -2.24 -0.71 -1.86 114.28 99.83 3k62 n THR 239 Ca 0.01 -0.86 -0.35 0.00 -2.27 0.00 0.00 64.05 60.57 3k62 n THR 239 Cb 0.15 0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.53 3k62 n THR 239 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3k62 s ASN 240 N -0.91 5.85 0.36 3.42 3.84 -0.64 -4.81 114.94 122.05 3k62 s ASN 240 Ca 0.40 0.28 0.07 0.00 0.21 0.00 0.00 52.86 53.82 3k62 s ASN 240 Cb 0.23 -1.77 0.76 0.00 -0.55 0.00 0.00 41.25 39.92 3k62 s ASN 240 CO 0.23 0.35 1.93 -0.29 -2.79 0.00 0.00 177.10 176.54 3k62 h ILE 241 N 3.75 0.97 0.01 -5.21 2.10 -1.91 -2.19 117.51 115.03 3k62 h ILE 241 Ca -0.52 -0.26 -0.40 0.00 1.08 0.00 0.00 64.86 64.76 3k62 h ILE 241 Cb 1.20 0.16 -0.06 0.00 -1.09 0.00 0.00 36.82 37.03 3k62 h ILE 241 CO 0.59 0.14 -2.32 0.49 -1.08 0.00 0.00 178.15 175.96 3k62 n PHE 242 N -4.50 0.25 0.22 2.19 3.72 -1.26 -4.58 117.46 113.50 3k62 n PHE 242 Ca 0.13 0.08 0.13 0.00 -0.05 0.00 0.00 57.45 57.73 3k62 n PHE 242 Cb 0.29 -1.03 0.73 0.00 -0.94 0.00 0.00 39.48 38.54 3k62 n PHE 242 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3k62 h GLY 243 N 0.19 0.00 1.93 1.37 0.00 -1.45 -2.46 103.07 102.66 3k62 h GLY 243 Ca -0.60 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 46.71 3k62 h GLY 243 CO -0.24 0.00 -0.09 3.45 0.00 0.00 0.00 176.54 179.66 3k62 h ASN 244 N 0.00 0.08 -0.39 0.19 7.08 -0.59 -0.34 115.58 121.61 3k62 h ASN 244 Ca 0.05 -0.01 -0.06 0.00 -3.08 0.00 0.00 56.30 53.20 3k62 h ASN 244 Cb 0.24 -0.02 -0.01 0.00 -2.08 0.00 0.00 38.32 36.44 3k62 h ASN 244 CO -0.00 0.19 0.01 1.88 -2.08 0.00 0.00 177.43 177.42 3k62 h TYR 245 N 0.09 0.74 -0.73 4.14 0.05 -1.72 -1.81 116.97 117.73 3k62 h TYR 245 Ca 0.02 -0.13 -0.06 0.00 0.05 0.00 0.00 58.73 58.61 3k62 h TYR 245 Cb 0.22 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.74 3k62 h TYR 245 CO 0.00 0.76 0.21 1.25 -1.05 0.00 0.00 178.16 179.33 3k62 h LEU 246 N 0.51 1.08 -0.40 3.88 5.85 -1.38 -1.46 115.31 123.39 3k62 h LEU 246 Ca 0.11 -0.22 0.01 0.00 0.84 0.00 0.00 57.88 58.62 3k62 h LEU 246 Cb 0.46 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 3k62 h LEU 246 CO 0.02 1.02 0.25 0.58 -0.34 0.00 0.00 178.44 179.96 3k62 h VAL 247 N 1.09 1.07 -0.73 1.05 2.07 -0.98 -0.68 116.25 119.14 3k62 h VAL 247 Ca 0.23 -0.17 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 3k62 h VAL 247 Cb 0.34 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.59 3k62 h VAL 247 CO -0.00 0.09 0.40 1.56 0.02 0.00 0.00 177.57 179.64 3k62 h GLN 248 N 0.51 1.01 -0.57 1.57 4.20 -1.09 0.07 115.11 120.81 3k62 h GLN 248 Ca 0.15 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.73 3k62 h GLN 248 Cb -0.03 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 27.53 3k62 h GLN 248 CO -0.05 0.76 0.32 0.77 -0.67 0.00 0.00 178.83 179.95 3k62 h SER 249 N 1.00 0.71 0.08 1.46 0.02 -0.96 -2.14 113.55 113.73 3k62 h SER 249 Ca 0.26 -0.09 -0.15 0.00 -0.84 0.00 0.00 61.79 60.96 3k62 h SER 249 Cb 0.04 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3k62 h SER 249 CO -0.04 0.59 -0.54 0.58 -1.14 0.00 0.00 176.83 176.29 3k62 h VAL 250 N 0.77 1.33 -0.77 2.27 2.07 -0.79 -1.62 116.25 119.50 3k62 h VAL 250 Ca 0.20 -1.79 0.04 0.00 0.82 0.00 0.00 66.70 65.97 3k62 h VAL 250 Cb 0.04 1.78 -0.05 0.00 -1.52 0.00 0.00 31.29 31.54 3k62 h VAL 250 CO -0.03 0.55 0.48 0.40 0.02 0.00 0.00 177.57 178.99 3k62 h ILE 251 N 0.38 1.08 -0.49 4.57 2.04 -0.85 0.61 117.51 124.84 3k62 h ILE 251 Ca 0.01 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 3k62 h ILE 251 Cb 1.06 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 3k62 h ILE 251 CO 0.10 0.17 0.29 1.23 0.00 0.00 0.00 178.15 179.93 3k62 h GLY 252 N 0.92 0.73 1.02 5.37 0.00 -0.94 -0.92 103.07 109.24 3k62 h GLY 252 Ca 0.32 -0.31 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 3k62 h GLY 252 CO -0.13 0.30 0.18 -2.22 0.00 0.00 0.00 176.54 174.67 3k62 h ILE 253 N 0.66 1.25 -0.45 2.60 2.04 -0.99 -1.81 117.51 120.81 3k62 h ILE 253 Ca 0.18 -0.87 0.05 0.00 1.00 0.00 0.00 64.86 65.22 3k62 h ILE 253 Cb 0.02 0.64 -0.04 0.00 -0.74 0.00 0.00 36.82 36.69 3k62 h ILE 253 CO -0.03 0.33 0.19 -1.28 0.00 0.00 0.00 178.15 177.36 3k62 h SER 254 N 0.89 0.25 0.48 1.72 0.87 -0.51 -1.66 113.55 115.59 3k62 h SER 254 Ca 0.20 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.75 3k62 h SER 254 Cb 0.31 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 3k62 h SER 254 CO -0.00 0.18 -0.21 -0.07 -0.53 0.00 0.00 176.83 176.20 3k62 h LEU 255 N 0.39 0.00 -0.07 2.23 3.38 -0.97 -2.63 115.31 117.65 3k62 h LEU 255 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 3k62 h LEU 255 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 3k62 h LEU 255 CO -0.18 0.21 -0.24 0.00 0.09 0.00 0.00 178.44 178.32 3k62 n ALA 256 N -2.32 2.95 -3.60 1.53 0.00 -0.69 -4.74 120.51 113.65 3k62 n ALA 256 Ca -0.01 -0.25 -0.40 0.00 0.00 0.00 0.00 53.44 52.78 3k62 n ALA 256 Cb 0.32 -1.28 -0.08 0.00 0.00 0.00 0.00 19.45 18.40 3k62 n ALA 256 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3k62 s THR 257 N -2.87 4.14 -0.34 0.00 2.01 -0.81 -4.98 115.64 112.79 3k62 s THR 257 Ca 0.16 -2.19 -0.04 0.00 0.31 0.00 0.00 61.69 59.93 3k62 s THR 257 Cb 0.19 -3.71 0.00 0.00 0.01 0.00 0.00 72.50 68.99 3k62 s THR 257 CO 0.59 -0.82 2.88 0.59 -0.69 0.00 0.00 174.62 177.17 3k62 n ASN 258 N 4.41 6.19 -3.23 3.53 4.13 -1.26 -4.56 115.26 124.46 3k62 n ASN 258 Ca -0.01 -3.03 -0.14 0.00 1.68 0.00 0.00 54.58 53.08 3k62 n ASN 258 Cb 0.41 -1.26 0.09 0.00 -1.54 0.00 0.00 39.78 37.48 3k62 n ASN 258 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 3k62 n ASP 259 N 1.19 0.42 0.31 6.41 5.68 -1.26 -4.94 116.55 124.35 3k62 n ASP 259 Ca 0.45 -1.45 0.21 0.00 -0.50 0.00 0.00 54.79 53.49 3k62 n ASP 259 Cb 0.63 -0.45 1.01 0.00 -1.14 0.00 0.00 41.12 41.17 3k62 n ASP 259 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 3k62 h ASP 260 N -0.63 0.00 0.35 -1.12 3.58 -2.05 -2.25 116.42 114.29 3k62 h ASP 260 Ca -0.21 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.24 3k62 h ASP 260 Cb 0.66 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.71 3k62 h ASP 260 CO 0.18 0.00 -0.15 0.61 -2.88 0.00 0.00 179.24 177.00 3k62 n GLY 261 N -0.69 -0.88 0.40 -0.78 0.00 -1.26 -4.45 105.19 97.53 3k62 n GLY 261 Ca -0.02 -0.30 -0.15 0.00 0.00 0.00 0.00 46.02 45.56 3k62 n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3k62 h TYR 262 N 0.70 -1.12 -0.32 1.61 3.20 -1.64 -1.43 116.97 117.97 3k62 h TYR 262 Ca 0.00 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.94 3k62 h TYR 262 Cb 0.40 0.47 -0.04 0.00 1.54 0.00 0.00 36.73 39.10 3k62 h TYR 262 CO 0.00 -0.51 0.06 1.15 -1.64 0.00 0.00 178.16 177.22 3k62 h THR 263 N -0.67 0.85 -0.73 1.81 2.02 -1.83 -1.98 112.91 112.38 3k62 h THR 263 Ca 0.01 -0.06 -0.06 0.00 0.77 0.00 0.00 66.41 67.08 3k62 h THR 263 Cb 0.67 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.71 3k62 h THR 263 CO -0.21 0.03 0.23 0.11 0.37 0.00 0.00 175.52 176.05 3k62 h LYS 264 N 0.18 1.13 -0.75 6.66 1.57 -1.80 -1.21 116.57 122.35 3k62 h LYS 264 Ca 0.15 -0.24 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 3k62 h LYS 264 Cb 0.16 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.27 3k62 h LYS 264 CO -0.20 0.96 0.44 0.00 -0.57 0.00 0.00 179.45 180.09 3k62 h ARG 265 N 1.09 1.02 -0.02 3.15 3.08 -0.83 -1.17 114.38 120.70 3k62 h ARG 265 Ca 0.24 -0.10 -0.19 0.00 0.07 0.00 0.00 59.98 60.00 3k62 h ARG 265 Cb 0.30 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 3k62 h ARG 265 CO -0.01 0.73 -0.82 0.37 -1.07 0.00 0.00 179.97 179.17 3k62 h GLN 266 N 1.02 0.24 -0.45 0.04 4.15 -1.05 -1.74 115.11 117.31 3k62 h GLN 266 Ca 0.27 -0.23 -0.07 0.00 0.77 0.00 0.00 58.65 59.39 3k62 h GLN 266 Cb -0.02 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 3k62 h GLN 266 CO -0.05 0.93 0.01 1.49 -1.93 0.00 0.00 178.83 179.29 3k62 h GLU 267 N 0.14 0.79 -0.23 1.69 4.57 -1.12 -0.97 114.58 119.46 3k62 h GLU 267 Ca -0.04 -0.25 0.04 0.00 -1.18 0.00 0.00 59.36 57.93 3k62 h GLU 267 Cb 1.43 -0.08 -0.03 0.00 -0.16 0.00 0.00 28.75 29.91 3k62 h GLU 267 CO 0.13 0.84 0.02 -0.22 -1.18 0.00 0.00 179.01 178.60 3k62 h LYS 268 N 0.64 0.09 -0.45 1.92 3.64 -1.10 0.01 116.57 121.33 3k62 h LYS 268 Ca 0.13 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3k62 h LYS 268 Cb 0.48 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.25 3k62 h LYS 268 CO 0.02 0.06 0.28 1.25 -2.27 0.00 0.00 179.45 178.80 3k62 h LEU 269 N 0.10 0.52 -0.67 5.20 5.85 -1.14 0.59 115.31 125.76 3k62 h LEU 269 Ca 0.11 -0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.84 3k62 h LEU 269 Cb 0.12 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 3k62 h LEU 269 CO -0.17 0.40 0.39 0.50 -0.34 0.00 0.00 178.44 179.23 3k62 h LYS 270 N 0.60 0.71 -0.50 1.25 3.11 -0.87 -1.93 116.57 118.94 3k62 h LYS 270 Ca 0.16 -0.04 -0.10 0.00 -2.81 0.00 0.00 60.65 57.86 3k62 h LYS 270 Cb -0.04 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.02 3k62 h LYS 270 CO -0.03 0.47 -0.07 -0.91 -2.81 0.00 0.00 179.45 176.09 3k62 h ASN 271 N 0.73 0.94 0.02 4.20 2.35 -0.31 -0.99 115.58 122.51 3k62 h ASN 271 Ca 0.29 -0.34 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3k62 h ASN 271 Cb 0.13 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.25 3k62 h ASN 271 CO -0.16 1.06 -0.01 -0.26 -1.65 0.00 0.00 177.43 176.41 3k62 h PHE 272 N 0.80 -0.03 -0.17 1.19 0.04 -0.67 -2.00 116.94 116.10 3k62 h PHE 272 Ca 0.13 -0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.88 3k62 h PHE 272 Cb 0.62 0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.77 3k62 h PHE 272 CO 0.05 0.03 0.01 0.82 -0.60 0.00 0.00 178.31 178.61 3k62 h ILE 273 N -0.07 1.24 -0.66 -0.55 2.04 -1.35 -3.17 117.51 114.99 3k62 h ILE 273 Ca -0.00 -0.81 0.03 0.00 1.00 0.00 0.00 64.86 65.08 3k62 h ILE 273 Cb 0.06 1.45 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 3k62 h ILE 273 CO 0.00 0.24 0.41 0.28 0.00 0.00 0.00 178.15 179.08 3k62 h SER 274 N 0.06 0.66 0.43 1.72 0.02 -1.14 -0.19 113.55 115.11 3k62 h SER 274 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3k62 h SER 274 Cb 0.36 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.76 3k62 h SER 274 CO 0.01 0.46 0.00 0.77 -1.14 0.00 0.00 176.83 176.92 3k62 h SER 275 N 0.79 0.00 0.00 3.07 4.64 -1.34 -2.64 113.55 118.07 3k62 h SER 275 Ca 0.27 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.51 3k62 h SER 275 Cb 0.03 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 61.96 3k62 h SER 275 CO -0.11 0.00 -0.69 0.00 -0.87 0.00 0.00 176.83 175.16 3k62 n GLN 276 N -2.96 0.82 -0.04 4.77 1.13 -0.62 -4.95 117.38 115.52 3k62 n GLN 276 Ca -0.01 -2.58 -0.08 0.00 -1.94 0.00 0.00 57.00 52.39 3k62 n GLN 276 Cb 0.17 -0.88 -0.02 0.00 0.11 0.00 0.00 30.24 29.62 3k62 n GLN 276 CO 0.00 0.00 0.00 1.98 -1.44 0.00 0.00 177.06 177.60 3k62 h MET 277 N 0.87 -0.15 -0.18 -1.09 4.05 -0.68 -0.95 114.93 116.79 3k62 h MET 277 Ca -0.09 0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.32 3k62 h MET 277 Cb 1.39 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 32.22 3k62 h MET 277 CO 0.04 -0.10 0.06 1.15 0.23 0.00 0.00 176.91 178.29 3k62 h THR 278 N -0.16 1.18 -0.52 -0.77 2.02 -1.87 -0.22 112.91 112.58 3k62 h THR 278 Ca 0.13 -0.58 0.04 0.00 0.77 0.00 0.00 66.41 66.78 3k62 h THR 278 Cb 0.35 1.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.95 3k62 h THR 278 CO -0.32 0.18 0.27 0.44 0.37 0.00 0.00 175.52 176.46 3k62 h ASP 279 N 0.11 0.39 -0.58 4.18 3.45 -1.92 -1.61 116.42 120.45 3k62 h ASP 279 Ca 0.06 0.03 -0.09 0.00 0.43 0.00 0.00 57.03 57.45 3k62 h ASP 279 Cb 0.23 -0.05 -0.02 0.00 -0.56 0.00 0.00 39.33 38.93 3k62 h ASP 279 CO -0.00 0.27 0.00 0.24 -1.57 0.00 0.00 179.24 178.18 3k62 h MET 280 N 0.52 1.02 -0.83 3.56 2.86 -0.96 -2.80 114.93 118.30 3k62 h MET 280 Ca 0.23 -0.33 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 3k62 h MET 280 Cb 0.12 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.65 3k62 h MET 280 CO -0.15 1.01 0.45 0.00 1.06 0.00 0.00 176.91 179.28 3k62 h LEU 282 N 1.17 0.00 -9.57 0.00 3.38 -1.21 -3.26 115.31 105.81 3k62 h LEU 282 Ca 0.29 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.74 3k62 h LEU 282 Cb 0.03 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3k62 h LEU 282 CO -0.05 0.00 0.29 -0.62 0.09 0.00 0.00 178.44 178.15 3k62 s ASP 283 N -4.67 7.41 0.36 -0.43 -1.08 -0.96 -4.75 116.67 112.56 3k62 s ASP 283 Ca 0.07 1.69 0.07 0.00 -0.52 0.00 0.00 52.55 53.86 3k62 s ASP 283 Cb 0.10 -2.55 0.75 0.00 -1.46 0.00 0.00 42.92 39.77 3k62 s ASP 283 CO 0.53 -0.02 1.93 0.50 0.52 0.00 0.00 175.17 178.63 3k62 h LYS 284 N 5.51 0.73 0.04 4.34 3.64 -1.86 -1.92 116.57 127.04 3k62 h LYS 284 Ca -0.43 -0.04 -0.37 0.00 -1.27 0.00 0.00 60.65 58.53 3k62 h LYS 284 Cb 1.21 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.82 3k62 h LYS 284 CO 0.71 0.48 -2.16 1.19 -2.27 0.00 0.00 179.45 177.40 3k62 n PHE 285 N -4.50 0.58 0.25 1.91 3.72 -1.26 -4.35 117.46 113.81 3k62 n PHE 285 Ca 0.13 0.15 0.13 0.00 -0.05 0.00 0.00 57.45 57.81 3k62 n PHE 285 Cb 0.29 -1.07 0.64 0.00 -0.94 0.00 0.00 39.48 38.40 3k62 n PHE 285 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3k62 h ALA 286 N -0.19 1.10 0.00 4.37 0.00 -1.36 -1.77 119.26 121.41 3k62 h ALA 286 Ca -0.52 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.25 3k62 h ALA 286 Cb 1.83 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.59 3k62 h ALA 286 CO -0.10 0.17 -0.13 0.00 0.00 0.00 0.00 179.25 179.19 3k62 h ARG 288 N 0.00 0.87 -0.73 0.00 2.47 -1.52 -1.75 114.38 113.72 3k62 h ARG 288 Ca -0.00 -0.55 0.02 0.00 -1.26 0.00 0.00 59.98 58.19 3k62 h ARG 288 Cb 0.41 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.75 3k62 h ARG 288 CO 0.02 1.18 0.47 0.28 0.56 0.00 0.00 179.97 182.48 3k62 h VAL 289 N 0.67 1.14 -0.19 2.04 2.07 -1.33 -1.71 116.25 118.93 3k62 h VAL 289 Ca 0.02 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 3k62 h VAL 289 Cb 1.15 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3k62 h VAL 289 CO 0.12 0.17 0.09 0.40 0.02 0.00 0.00 177.57 178.37 3k62 h ILE 290 N 0.94 1.13 -0.60 4.57 2.04 -1.12 -1.65 117.51 122.83 3k62 h ILE 290 Ca 0.28 -0.38 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 3k62 h ILE 290 Cb -0.04 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 3k62 h ILE 290 CO -0.09 0.13 0.27 1.56 0.00 0.00 0.00 178.15 180.02 3k62 h GLN 291 N 0.18 0.87 -0.10 2.37 4.20 -1.16 -0.79 115.11 120.68 3k62 h GLN 291 Ca 0.07 -0.14 -0.13 0.00 0.06 0.00 0.00 58.65 58.51 3k62 h GLN 291 Cb 0.12 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.73 3k62 h GLN 291 CO -0.01 0.72 -0.52 0.66 -0.67 0.00 0.00 178.83 179.01 3k62 h SER 292 N 0.82 0.31 -0.55 1.46 4.64 -1.24 -2.79 113.55 116.20 3k62 h SER 292 Ca 0.20 -0.16 -0.04 0.00 -0.47 0.00 0.00 61.79 61.33 3k62 h SER 292 Cb 0.14 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 3k62 h SER 292 CO -0.02 0.78 0.20 0.28 -0.87 0.00 0.00 176.83 177.19 3k62 h SER 293 N 0.23 0.77 -0.87 4.97 0.02 -0.87 -1.46 113.55 116.34 3k62 h SER 293 Ca 0.01 -0.19 0.07 0.00 -0.84 0.00 0.00 61.79 60.84 3k62 h SER 293 Cb 0.99 -0.20 -0.06 0.00 0.14 0.00 0.00 62.40 63.27 3k62 h SER 293 CO 0.08 0.75 0.57 -0.07 -1.14 0.00 0.00 176.83 177.02 3k62 h LEU 294 N 0.75 0.85 0.00 5.07 3.38 -0.93 -0.95 115.31 123.49 3k62 h LEU 294 Ca 0.18 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3k62 h LEU 294 Cb 0.24 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.81 3k62 h LEU 294 CO -0.01 0.54 -1.24 0.00 0.09 0.00 0.00 178.44 177.82 3k62 n GLN 295 N -4.49 0.57 -0.09 1.13 10.64 -1.07 -4.50 117.38 119.56 3k62 n GLN 295 Ca 0.13 0.03 -0.10 0.00 -1.83 0.00 0.00 57.00 55.24 3k62 n GLN 295 Cb 0.22 -1.72 -0.12 0.00 -0.86 0.00 0.00 30.24 27.76 3k62 n GLN 295 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 3k62 n ASN 296 N -2.46 1.27 -4.73 2.61 3.02 -0.56 -5.00 115.26 109.40 3k62 n ASN 296 Ca -0.01 -0.03 -0.31 0.00 -0.03 0.00 0.00 54.58 54.21 3k62 n ASN 296 Cb 0.54 0.63 0.12 0.00 -0.61 0.00 0.00 39.78 40.45 3k62 n ASN 296 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 3k62 s MET 297 N -2.40 1.81 0.30 3.52 -1.94 -0.37 -4.92 119.30 115.30 3k62 s MET 297 Ca -0.13 1.31 -0.28 0.00 -1.71 0.00 0.00 55.69 54.88 3k62 s MET 297 Cb 0.05 -1.84 -0.14 0.00 2.01 0.00 0.00 34.83 34.92 3k62 s MET 297 CO 0.63 -2.00 1.08 -0.25 -0.01 0.00 0.00 175.02 174.47 3k62 n ASP 298 N -3.78 1.63 -0.28 3.03 8.00 -1.26 -4.67 116.55 119.22 3k62 n ASP 298 Ca 0.10 1.18 -0.02 0.00 0.71 0.00 0.00 54.79 56.76 3k62 n ASP 298 Cb 0.53 -1.33 0.10 0.00 -0.02 0.00 0.00 41.12 40.39 3k62 n ASP 298 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3k62 h LEU 299 N 2.16 0.79 -1.43 0.64 5.85 -1.94 -0.71 115.31 120.67 3k62 h LEU 299 Ca -0.41 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.35 3k62 h LEU 299 Cb 1.33 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.15 3k62 h LEU 299 CO 0.61 0.54 0.43 0.28 -0.34 0.00 0.00 178.44 179.96 3k62 h SER 300 N 0.93 0.63 0.27 1.25 0.02 -2.00 0.13 113.55 114.79 3k62 h SER 300 Ca 0.31 -0.00 -0.28 0.00 -0.84 0.00 0.00 61.79 60.98 3k62 h SER 300 Cb 0.04 -0.14 0.02 0.00 0.14 0.00 0.00 62.40 62.46 3k62 h SER 300 CO -0.12 0.43 -1.17 -0.07 -1.14 0.00 0.00 176.83 174.76 3k62 h LEU 301 N 0.73 0.71 -1.04 5.07 3.38 -1.64 -3.18 115.31 119.33 3k62 h LEU 301 Ca 0.27 -0.65 0.05 0.00 0.09 0.00 0.00 57.88 57.63 3k62 h LEU 301 Cb 0.14 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.61 3k62 h LEU 301 CO -0.08 1.47 0.64 0.00 0.09 0.00 0.00 178.44 180.56 3k62 h ALA 302 N 0.46 1.39 -0.54 1.53 0.00 -0.39 -1.69 119.26 120.01 3k62 h ALA 302 Ca -0.15 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.76 3k62 h ALA 302 Cb 1.84 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 3k62 h ALA 302 CO 0.21 0.50 0.36 0.00 0.00 0.00 0.00 179.25 180.32 3k62 h LYS 304 N 0.61 0.46 -0.73 0.00 1.57 -1.30 -2.35 116.57 114.83 3k62 h LYS 304 Ca 0.22 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 3k62 h LYS 304 Cb 0.12 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 3k62 h LYS 304 CO -0.06 0.63 0.42 -0.07 -0.57 0.00 0.00 179.45 179.80 3k62 h LEU 305 N 0.42 0.89 -1.01 2.94 3.38 -1.11 -2.49 115.31 118.34 3k62 h LEU 305 Ca 0.07 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3k62 h LEU 305 Cb 0.56 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 3k62 h LEU 305 CO 0.04 0.72 0.51 0.58 0.09 0.00 0.00 178.44 180.38 3k62 h VAL 306 N 1.00 1.25 0.00 1.22 2.07 -1.23 -1.12 116.25 119.44 3k62 h VAL 306 Ca 0.26 -0.56 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 3k62 h VAL 306 Cb 0.00 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 29.80 3k62 h VAL 306 CO -0.04 0.26 -0.00 -0.61 0.02 0.00 0.00 177.57 177.20 3k62 h GLN 307 N 1.21 0.00 -0.00 1.57 4.15 -0.99 -1.84 115.11 119.22 3k62 h GLN 307 Ca 0.31 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.73 3k62 h GLN 307 Cb -0.03 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.66 3k62 h GLN 307 CO -0.06 0.00 -0.03 0.00 -1.93 0.00 0.00 178.83 176.82 3k62 n ALA 308 N -2.36 2.46 -1.76 3.38 0.00 -0.43 -4.84 120.51 116.97 3k62 n ALA 308 Ca -0.03 -0.14 -0.39 0.00 0.00 0.00 0.00 53.44 52.88 3k62 n ALA 308 Cb 0.09 -1.46 0.03 0.00 0.00 0.00 0.00 19.45 18.11 3k62 n ALA 308 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3k62 s LEU 309 N -2.81 4.01 0.72 0.00 1.43 -0.69 -4.74 118.68 116.60 3k62 s LEU 309 Ca 0.20 2.84 -0.11 0.00 -1.03 0.00 0.00 54.13 56.03 3k62 s LEU 309 Cb 0.19 -4.07 0.03 0.00 0.03 0.00 0.00 46.19 42.37 3k62 s LEU 309 CO 0.51 -1.32 1.08 -2.16 0.23 0.00 0.00 176.35 174.69 3k62 s PRO 310 N -2.63 2.62 0.00 1.29 0.04 -1.26 -4.98 135.00 130.08 3k62 s PRO 310 Ca 0.65 1.13 0.02 0.00 0.04 0.00 0.00 61.00 62.84 3k62 s PRO 310 Cb -0.42 -1.94 0.05 0.00 0.04 0.00 0.00 34.50 32.23 3k62 s PRO 310 CO 0.52 -1.35 0.87 0.54 0.04 0.00 0.00 177.00 177.62 3k62 n ARG 311 N -3.15 1.57 0.00 4.56 5.12 -1.26 -4.51 116.66 119.00 3k62 n ARG 311 Ca 0.09 -1.25 0.00 0.00 -1.93 0.00 0.00 57.85 54.76 3k62 n ARG 311 Cb 0.53 -1.06 0.00 0.00 -1.16 0.00 0.00 32.46 30.77 3k62 n ARG 311 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 3k62 n ASP 312 N -0.11 0.58 0.04 0.55 5.68 -1.26 -4.90 116.55 117.12 3k62 n ASP 312 Ca 0.02 0.00 0.21 0.00 -0.50 0.00 0.00 54.79 54.53 3k62 n ASP 312 Cb 0.20 0.00 0.73 0.00 -1.14 0.00 0.00 41.12 40.92 3k62 n ASP 312 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k62 h ALA 313 N 0.34 2.30 0.00 2.12 0.00 -2.02 0.96 119.26 122.95 3k62 h ALA 313 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3k62 h ALA 313 Cb 0.00 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3k62 h ALA 313 CO 0.00 -0.71 -0.07 0.00 0.00 0.00 0.00 179.25 178.46 3k62 h ARG 314 N 0.00 0.00 -0.18 0.00 3.08 -1.93 -2.35 114.38 112.99 3k62 h ARG 314 Ca 0.24 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.12 3k62 h ARG 314 Cb 1.15 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.19 3k62 h ARG 314 CO -0.00 0.07 -0.58 1.25 -1.07 0.00 0.00 179.97 179.64 3k62 h LEU 315 N 0.00 0.64 -0.33 3.04 5.85 -1.03 -0.58 115.31 122.90 3k62 h LEU 315 Ca -0.00 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 58.36 3k62 h LEU 315 Cb 0.16 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 3k62 h LEU 315 CO 0.01 1.08 0.21 0.40 -0.34 0.00 0.00 178.44 179.80 3k62 h ILE 316 N 0.43 1.10 -0.91 4.05 2.04 -1.54 -1.17 117.51 121.51 3k62 h ILE 316 Ca 0.00 -0.20 0.07 0.00 1.00 0.00 0.00 64.86 65.73 3k62 h ILE 316 Cb 1.13 0.64 -0.07 0.00 -0.74 0.00 0.00 36.82 37.78 3k62 h ILE 316 CO 0.11 0.10 0.57 0.00 0.00 0.00 0.00 178.15 178.92 3k62 h ALA 317 N 1.10 1.26 -0.22 1.87 0.00 -1.07 -1.60 119.26 120.61 3k62 h ALA 317 Ca 0.12 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 3k62 h ALA 317 Cb -0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3k62 h ALA 317 CO -0.02 0.30 0.04 0.82 0.00 0.00 0.00 179.25 180.38 3k62 h ILE 318 N 1.01 1.22 -0.12 0.00 2.04 -0.86 -2.51 117.51 118.30 3k62 h ILE 318 Ca 0.40 -0.74 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 3k62 h ILE 318 Cb 0.21 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.59 3k62 h ILE 318 CO -0.19 0.23 0.05 0.00 0.00 0.00 0.00 178.15 178.25 3k62 n VAL 320 N -4.50 0.39 -2.72 0.00 0.24 -0.68 -3.24 118.33 107.83 3k62 n VAL 320 Ca -0.01 -0.70 -0.40 0.00 -2.04 0.00 0.00 64.34 61.19 3k62 n VAL 320 Cb 0.10 1.08 -0.06 0.00 -1.47 0.00 0.00 33.84 33.50 3k62 n VAL 320 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3k62 s ASP 321 N -1.51 7.58 0.47 -1.34 2.15 -0.95 -4.66 116.67 118.41 3k62 s ASP 321 Ca 0.34 1.95 0.13 0.00 0.43 0.00 0.00 52.55 55.40 3k62 s ASP 321 Cb 0.21 -2.61 1.09 0.00 -0.30 0.00 0.00 42.92 41.31 3k62 s ASP 321 CO 0.29 0.08 2.07 0.06 -0.17 0.00 0.00 175.17 177.50 3k62 h GLN 322 N 4.42 0.27 0.00 4.34 3.07 -1.91 -2.17 115.11 123.12 3k62 h GLN 322 Ca -0.45 -0.02 -0.17 0.00 0.09 0.00 0.00 58.65 58.11 3k62 h GLN 322 Cb 1.20 -0.06 -0.03 0.00 0.08 0.00 0.00 27.48 28.68 3k62 h GLN 322 CO 0.69 0.18 -1.14 0.09 0.09 0.00 0.00 178.83 178.74 3k62 n ASN 323 N -4.49 1.86 0.25 0.06 3.02 -1.26 -4.60 115.26 110.09 3k62 n ASN 323 Ca 0.03 0.48 0.12 0.00 -0.03 0.00 0.00 54.58 55.18 3k62 n ASN 323 Cb 0.19 -0.91 0.62 0.00 -0.61 0.00 0.00 39.78 39.07 3k62 n ASN 323 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k62 h ALA 324 N -0.73 1.12 -0.13 5.41 0.00 -1.59 -2.27 119.26 121.06 3k62 h ALA 324 Ca -0.26 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.54 3k62 h ALA 324 Cb 1.07 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3k62 h ALA 324 CO -0.16 0.19 0.09 -2.95 0.00 0.00 0.00 179.25 176.43 3k62 h ASN 325 N 0.00 0.05 0.79 0.00 -1.07 -1.13 0.00 115.58 114.23 3k62 h ASN 325 Ca -0.00 -0.00 -0.04 0.00 0.07 0.00 0.00 56.30 56.33 3k62 h ASN 325 Cb 0.52 -0.01 -0.01 0.00 -2.07 0.00 0.00 38.32 36.76 3k62 h ASN 325 CO 0.02 0.04 -0.17 0.45 0.07 0.00 0.00 177.43 177.83 3k62 h HIS 326 N 0.06 0.00 -0.27 4.14 3.86 -1.67 -1.77 115.15 119.50 3k62 h HIS 326 Ca 0.06 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.22 3k62 h HIS 326 Cb 0.17 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.63 3k62 h HIS 326 CO -0.00 0.17 -0.04 0.28 0.86 0.00 0.00 177.93 179.20 3k62 h VAL 327 N 0.00 1.27 -0.65 2.45 2.07 -1.14 -0.84 116.25 119.41 3k62 h VAL 327 Ca -0.00 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.44 3k62 h VAL 327 Cb 0.61 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 3k62 h VAL 327 CO 0.02 0.32 0.20 0.40 0.02 0.00 0.00 177.57 178.54 3k62 h ILE 328 N 0.26 1.25 -0.53 4.57 1.08 -1.32 -0.91 117.51 121.91 3k62 h ILE 328 Ca 0.07 -0.86 -0.03 0.00 -0.39 0.00 0.00 64.86 63.66 3k62 h ILE 328 Cb 0.49 0.58 -0.03 0.00 -3.07 0.00 0.00 36.82 34.79 3k62 h ILE 328 CO 0.02 0.33 0.22 1.56 -0.69 0.00 0.00 178.15 179.59 3k62 h GLN 329 N 0.94 0.76 -0.40 2.37 4.20 -1.31 -1.56 115.11 120.12 3k62 h GLN 329 Ca 0.21 -0.11 -0.06 0.00 0.06 0.00 0.00 58.65 58.75 3k62 h GLN 329 Cb 0.29 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.92 3k62 h GLN 329 CO -0.01 0.62 0.00 -0.22 -0.67 0.00 0.00 178.83 178.56 3k62 h LYS 330 N 0.76 0.70 -0.29 1.46 1.63 -0.70 -2.31 116.57 117.82 3k62 h LYS 330 Ca 0.18 -0.22 0.05 0.00 -0.85 0.00 0.00 60.65 59.81 3k62 h LYS 330 Cb 0.14 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 31.66 3k62 h LYS 330 CO -0.02 0.79 -0.02 0.28 -3.45 0.00 0.00 179.45 177.03 3k62 h VAL 331 N 0.52 0.77 -0.81 2.00 2.07 -0.81 -0.78 116.25 119.21 3k62 h VAL 331 Ca 0.11 -0.02 0.09 0.00 0.82 0.00 0.00 66.70 67.70 3k62 h VAL 331 Cb 0.47 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.89 3k62 h VAL 331 CO 0.02 0.01 0.53 0.58 0.02 0.00 0.00 177.57 178.73 3k62 h VAL 332 N 0.06 0.97 -0.04 2.57 2.07 -1.22 -1.81 116.25 118.84 3k62 h VAL 332 Ca 0.14 -0.27 -0.25 0.00 0.82 0.00 0.00 66.70 67.14 3k62 h VAL 332 Cb 0.19 0.11 0.02 0.00 -1.52 0.00 0.00 31.29 30.09 3k62 h VAL 332 CO -0.25 0.14 -0.94 0.00 0.02 0.00 0.00 177.57 176.55 3k62 h ALA 333 N 1.58 0.17 -0.04 1.67 0.00 -0.68 -3.39 119.26 118.57 3k62 h ALA 333 Ca 0.37 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3k62 h ALA 333 Cb 0.40 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3k62 h ALA 333 CO -0.14 0.65 0.00 1.33 0.00 0.00 0.00 179.25 181.09 3k62 n VAL 334 N -3.91 0.52 -5.05 0.00 0.24 -0.41 -5.01 118.33 104.72 3k62 n VAL 334 Ca -0.10 -0.76 -0.28 0.00 -2.04 0.00 0.00 64.34 61.16 3k62 n VAL 334 Cb 0.83 0.77 -0.16 0.00 -1.47 0.00 0.00 33.84 33.81 3k62 n VAL 334 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3k62 s ILE 335 N -0.62 1.70 0.60 1.34 -1.09 -0.70 -4.96 121.20 117.47 3k62 s ILE 335 Ca 0.04 -0.90 -0.18 0.00 -2.23 0.00 0.00 60.65 57.38 3k62 s ILE 335 Cb 0.02 -1.43 -0.03 0.00 -1.58 0.00 0.00 42.46 39.45 3k62 s ILE 335 CO 0.03 0.48 1.21 -2.84 -1.23 0.00 0.00 174.94 172.60 3k62 s PRO 336 N -0.33 2.90 0.38 2.79 0.02 -1.26 -4.79 135.00 134.71 3k62 s PRO 336 Ca 0.04 1.83 0.10 0.00 0.02 0.00 0.00 61.00 62.99 3k62 s PRO 336 Cb -0.10 -1.92 0.87 0.00 0.02 0.00 0.00 34.50 33.38 3k62 s PRO 336 CO 0.01 -1.26 1.92 1.25 -0.33 0.00 0.00 177.00 178.58 3k62 h LEU 337 N 0.78 0.56 -1.29 -5.54 5.85 -1.95 -2.19 115.31 111.54 3k62 h LEU 337 Ca -0.50 0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.33 3k62 h LEU 337 Cb 1.30 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 42.18 3k62 h LEU 337 CO 0.55 0.32 0.54 0.50 -0.34 0.00 0.00 178.44 180.00 3k62 h LYS 338 N 0.62 0.78 -0.00 1.25 1.63 -1.99 0.19 116.57 119.03 3k62 h LYS 338 Ca 0.37 -0.05 -0.07 0.00 -0.85 0.00 0.00 60.65 60.06 3k62 h LYS 338 Cb 0.60 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.05 3k62 h LYS 338 CO -0.14 0.51 -0.32 -0.91 -3.45 0.00 0.00 179.45 175.15 3k62 h ASN 339 N 0.80 0.01 -0.10 4.20 2.35 -1.75 -3.22 115.58 117.86 3k62 h ASN 339 Ca 0.37 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 3k62 h ASN 339 Cb 0.39 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 3k62 h ASN 339 CO -0.15 0.32 0.00 -2.67 -1.65 0.00 0.00 177.43 173.29 3k62 n TRP 340 N -4.16 0.21 -0.10 1.19 4.27 -0.24 -4.64 117.44 113.96 3k62 n TRP 340 Ca -0.02 -0.68 0.12 0.00 -3.89 0.00 0.00 57.50 53.03 3k62 n TRP 340 Cb 0.36 -0.11 0.49 0.00 -1.36 0.00 0.00 31.31 30.69 3k62 n TRP 340 CO 0.00 0.00 0.00 1.49 -2.29 0.00 0.00 177.69 176.89 3k62 h GLU 341 N 0.61 0.42 -0.32 -2.67 4.81 -0.72 0.67 114.58 117.38 3k62 h GLU 341 Ca 0.00 -0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.29 3k62 h GLU 341 Cb 0.80 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 3k62 h GLU 341 CO 0.03 0.28 0.23 0.27 -0.73 0.00 0.00 179.01 179.09 3k62 h PHE 342 N 0.44 0.03 -0.36 0.92 -5.15 -1.83 -1.26 116.94 109.73 3k62 h PHE 342 Ca 0.29 0.00 -0.16 0.00 -0.20 0.00 0.00 57.97 57.90 3k62 h PHE 342 Cb 0.56 -0.01 -0.00 0.00 0.22 0.00 0.00 35.95 36.71 3k62 h PHE 342 CO -0.00 0.02 -0.40 0.82 -2.00 0.00 0.00 178.31 176.74 3k62 h ILE 343 N 0.03 1.27 -0.23 0.88 2.04 -1.21 -0.29 117.51 120.01 3k62 h ILE 343 Ca 0.15 -1.58 0.03 0.00 1.00 0.00 0.00 64.86 64.47 3k62 h ILE 343 Cb 0.57 1.44 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 3k62 h ILE 343 CO -0.01 0.53 0.03 0.58 0.00 0.00 0.00 178.15 179.28 3k62 h VAL 344 N 0.72 0.88 -0.41 1.67 2.07 -1.23 0.46 116.25 120.41 3k62 h VAL 344 Ca 0.05 -0.04 -0.12 0.00 0.82 0.00 0.00 66.70 67.42 3k62 h VAL 344 Cb 1.00 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3k62 h VAL 344 CO 0.10 0.02 -0.21 0.44 0.02 0.00 0.00 177.57 177.94 3k62 h ASP 345 N 0.12 0.83 -0.05 0.57 3.32 -1.38 -0.71 116.42 119.13 3k62 h ASP 345 Ca 0.11 -0.30 0.02 0.00 0.02 0.00 0.00 57.03 56.88 3k62 h ASP 345 Cb 0.11 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 3k62 h ASP 345 CO -0.15 1.02 -0.09 0.15 -1.72 0.00 0.00 179.24 178.44 3k62 h PHE 346 N 0.72 -0.23 -0.10 4.55 3.57 -0.73 -2.70 116.94 122.01 3k62 h PHE 346 Ca 0.10 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.55 3k62 h PHE 346 Cb 0.73 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 3k62 h PHE 346 CO 0.04 -0.14 -0.22 0.28 -2.23 0.00 0.00 178.31 176.04 3k62 h VAL 347 N -0.14 1.21 0.00 1.41 2.07 -0.77 -2.67 116.25 117.36 3k62 h VAL 347 Ca 0.05 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.62 3k62 h VAL 347 Cb 0.20 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3k62 h VAL 347 CO -0.13 0.29 0.00 0.00 0.02 0.00 0.00 177.57 177.75 3k62 n ALA 348 N -2.49 2.08 -1.93 1.67 0.00 -0.28 -2.33 120.51 117.23 3k62 n ALA 348 Ca -0.01 -0.07 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 3k62 n ALA 348 Cb 0.32 -1.39 -0.03 0.00 0.00 0.00 0.00 19.45 18.35 3k62 n ALA 348 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3k62 s THR 349 N -3.03 2.66 0.25 0.00 2.01 -1.01 -4.77 115.64 111.75 3k62 s THR 349 Ca 0.11 0.44 -0.08 0.00 0.31 0.00 0.00 61.69 62.48 3k62 s THR 349 Cb 0.15 -3.28 0.31 0.00 0.01 0.00 0.00 72.50 69.68 3k62 s THR 349 CO 0.44 0.03 1.62 -0.65 -0.69 0.00 0.00 174.62 175.37 3k62 h PRO 350 N 6.97 0.06 -0.20 4.92 0.11 -1.90 0.25 132.00 142.21 3k62 h PRO 350 Ca -0.43 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.53 3k62 h PRO 350 Cb 1.20 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.29 3k62 h PRO 350 CO 0.92 0.04 -0.50 1.49 -0.21 0.00 0.00 178.00 179.73 3k62 h GLU 351 N 0.06 0.56 -0.33 1.05 4.81 -1.93 -2.15 114.58 116.65 3k62 h GLU 351 Ca 0.42 -0.33 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 3k62 h GLU 351 Cb 0.72 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 3k62 h GLU 351 CO -0.73 0.93 -0.18 0.45 -0.73 0.00 0.00 179.01 178.75 3k62 h HIS 352 N 0.44 0.82 -0.55 0.92 3.86 -1.23 -2.68 115.15 116.72 3k62 h HIS 352 Ca 0.02 -0.21 0.04 0.00 -1.16 0.00 0.00 60.37 59.06 3k62 h HIS 352 Cb 1.03 -0.19 -0.04 0.00 1.06 0.00 0.00 27.41 29.27 3k62 h HIS 352 CO 0.04 0.92 0.30 1.25 0.86 0.00 0.00 177.93 181.30 3k62 h LEU 353 N 0.47 0.44 0.04 2.43 5.85 -0.21 -0.25 115.31 124.09 3k62 h LEU 353 Ca 0.07 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3k62 h LEU 353 Cb 0.72 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 3k62 h LEU 353 CO 0.05 0.30 -0.06 -0.09 -0.34 0.00 0.00 178.44 178.31 3k62 h ARG 354 N 0.57 -0.11 -0.05 1.25 2.43 -1.35 -0.66 114.38 116.46 3k62 h ARG 354 Ca 0.24 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.41 3k62 h ARG 354 Cb 0.12 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 3k62 h ARG 354 CO -0.15 -0.08 0.02 1.96 -1.51 0.00 0.00 179.97 180.21 3k62 h GLN 355 N -0.12 0.08 -0.29 0.20 4.20 -1.21 -2.72 115.11 115.26 3k62 h GLN 355 Ca 0.01 -0.02 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 3k62 h GLN 355 Cb 0.12 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 3k62 h GLN 355 CO -0.03 0.26 -0.25 0.82 -0.67 0.00 0.00 178.83 178.96 3k62 h ILE 356 N -0.10 1.30 0.00 2.54 2.04 -1.01 -3.15 117.51 119.13 3k62 h ILE 356 Ca 0.02 -1.40 -0.06 0.00 1.00 0.00 0.00 64.86 64.42 3k62 h ILE 356 Cb 0.21 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 3k62 h ILE 356 CO -0.00 0.45 -0.27 0.00 0.00 0.00 0.00 178.15 178.33 3k62 n SER 358 N -3.52 2.48 -4.41 0.00 7.64 -1.03 -3.11 113.62 111.67 3k62 n SER 358 Ca -0.00 -2.21 -0.31 0.00 1.01 0.00 0.00 58.87 57.36 3k62 n SER 358 Cb 0.42 -0.40 -0.14 0.00 -1.01 0.00 0.00 64.21 63.08 3k62 n SER 358 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3k62 s ASP 359 N -0.69 3.57 0.18 6.43 2.15 -1.03 -4.84 116.67 122.44 3k62 s ASP 359 Ca 0.24 -0.43 -0.15 0.00 0.43 0.00 0.00 52.55 52.64 3k62 s ASP 359 Cb 0.15 -0.53 0.15 0.00 -0.30 0.00 0.00 42.92 42.38 3k62 s ASP 359 CO 0.11 0.28 1.67 0.50 -0.17 0.00 0.00 175.17 177.57 3k62 h LYS 360 N 4.91 0.04 0.16 4.34 3.64 -1.88 0.60 116.57 128.38 3k62 h LYS 360 Ca -0.46 -0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 58.58 3k62 h LYS 360 Cb 1.15 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3k62 h LYS 360 CO 0.47 0.02 -1.68 1.88 -2.27 0.00 0.00 179.45 177.88 3k62 h TYR 361 N 0.04 0.63 -0.92 1.91 0.05 -1.87 -3.31 116.97 113.49 3k62 h TYR 361 Ca 0.23 -0.46 0.03 0.00 0.05 0.00 0.00 58.73 58.58 3k62 h TYR 361 Cb 0.35 -0.03 -0.05 0.00 1.01 0.00 0.00 36.73 38.01 3k62 h TYR 361 CO -0.36 1.57 0.61 0.78 -1.05 0.00 0.00 178.16 179.70 3k62 h GLY 362 N 1.04 1.32 1.21 3.88 0.00 -1.49 -1.81 103.07 107.22 3k62 h GLY 362 Ca -0.31 -0.46 -0.03 0.00 0.00 0.00 0.00 47.33 46.53 3k62 h GLY 362 CO 0.17 0.41 0.33 0.00 0.00 0.00 0.00 176.54 177.46 3k62 h ARG 364 N 1.02 0.95 -0.33 0.00 9.65 -1.44 -1.45 114.38 122.77 3k62 h ARG 364 Ca 0.25 -0.18 -0.01 0.00 -1.10 0.00 0.00 59.98 58.93 3k62 h ARG 364 Cb 0.12 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 3k62 h ARG 364 CO -0.03 0.82 0.15 0.28 2.80 0.00 0.00 179.97 183.98 3k62 h VAL 365 N 0.92 1.17 -0.60 0.20 2.07 -0.64 -1.69 116.25 117.68 3k62 h VAL 365 Ca 0.21 -0.50 -0.08 0.00 0.82 0.00 0.00 66.70 67.15 3k62 h VAL 365 Cb 0.26 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 30.90 3k62 h VAL 365 CO -0.01 0.18 0.06 0.58 0.02 0.00 0.00 177.57 178.40 3k62 h VAL 366 N 0.39 1.26 -0.62 2.57 2.07 -1.08 -1.12 116.25 119.71 3k62 h VAL 366 Ca 0.11 -1.04 -0.05 0.00 0.82 0.00 0.00 66.70 66.54 3k62 h VAL 366 Cb 0.15 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 3k62 h VAL 366 CO -0.01 0.38 0.18 -0.61 0.02 0.00 0.00 177.57 177.53 3k62 h GLN 367 N 0.93 0.98 -0.87 1.57 4.15 -1.14 -0.95 115.11 119.79 3k62 h GLN 367 Ca 0.18 -0.22 0.01 0.00 0.77 0.00 0.00 58.65 59.39 3k62 h GLN 367 Cb 0.46 -0.14 -0.04 0.00 0.21 0.00 0.00 27.48 27.97 3k62 h GLN 367 CO 0.02 0.87 0.57 1.15 -1.93 0.00 0.00 178.83 179.51 3k62 h THR 368 N 0.90 1.21 -0.30 2.39 2.02 -1.03 -0.58 112.91 117.52 3k62 h THR 368 Ca 0.20 -0.40 -0.00 0.00 0.77 0.00 0.00 66.41 66.98 3k62 h THR 368 Cb 0.31 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.66 3k62 h THR 368 CO -0.00 0.21 0.17 0.40 0.37 0.00 0.00 175.52 176.67 3k62 h ILE 369 N 1.16 1.12 -0.58 3.11 2.04 -0.87 -1.75 117.51 121.74 3k62 h ILE 369 Ca 0.32 -0.30 0.02 0.00 1.00 0.00 0.00 64.86 65.89 3k62 h ILE 369 Cb -0.11 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 3k62 h ILE 369 CO -0.08 0.12 0.37 0.40 0.00 0.00 0.00 178.15 178.97 3k62 h ILE 370 N 0.38 1.11 -0.80 -0.67 2.04 -0.84 -1.19 117.51 117.53 3k62 h ILE 370 Ca 0.11 -0.26 0.05 0.00 1.00 0.00 0.00 64.86 65.76 3k62 h ILE 370 Cb 0.04 0.29 -0.06 0.00 -0.74 0.00 0.00 36.82 36.36 3k62 h ILE 370 CO -0.02 0.14 0.49 -0.33 0.00 0.00 0.00 178.15 178.43 3k62 h GLU 371 N 0.75 0.89 -0.03 2.37 5.08 -0.91 -1.98 114.58 120.76 3k62 h GLU 371 Ca 0.22 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.42 3k62 h GLU 371 Cb -0.04 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 28.99 3k62 h GLU 371 CO -0.07 0.59 -0.50 -0.22 -1.00 0.00 0.00 179.01 177.81 3k62 h LYS 372 N 0.92 0.08 -0.07 2.33 1.63 -0.89 -2.76 116.57 117.82 3k62 h LYS 372 Ca 0.34 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.10 3k62 h LYS 372 Cb 0.13 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.76 3k62 h LYS 372 CO -0.16 0.57 0.00 1.28 -3.45 0.00 0.00 179.45 177.69 3k62 n LEU 373 N -3.95 0.83 -4.76 5.20 4.77 -0.49 -4.88 117.00 113.72 3k62 n LEU 373 Ca -0.02 -0.34 -0.39 0.00 -0.03 0.00 0.00 56.01 55.24 3k62 n LEU 373 Cb 0.53 -0.04 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 3k62 n LEU 373 CO 0.41 0.17 0.28 -0.89 -1.33 0.00 0.00 177.39 176.03 3k62 s THR 374 N -1.91 4.92 -1.45 -5.08 2.01 -0.85 -4.77 115.64 108.51 3k62 s THR 374 Ca 0.32 1.22 -0.14 0.00 0.31 0.00 0.00 61.69 63.40 3k62 s THR 374 Cb 0.16 -3.92 0.04 0.00 0.01 0.00 0.00 72.50 68.80 3k62 s THR 374 CO 0.26 0.42 2.20 0.00 -0.69 0.00 0.00 174.62 176.81 3k62 n ALA 375 N 2.70 5.46 -3.52 7.40 0.00 -1.26 -4.71 120.51 126.58 3k62 n ALA 375 Ca -0.07 -3.88 -0.02 0.00 0.00 0.00 0.00 53.44 49.47 3k62 n ALA 375 Cb 0.51 -3.54 -0.00 0.00 0.00 0.00 0.00 19.45 16.42 3k62 n ALA 375 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3k62 n ASP 376 N 6.18 1.10 0.30 0.00 5.68 -1.26 -4.96 116.55 123.59 3k62 n ASP 376 Ca 0.52 -1.11 0.18 0.00 -0.50 0.00 0.00 54.79 53.88 3k62 n ASP 376 Cb 0.39 -0.00 0.94 0.00 -1.14 0.00 0.00 41.12 41.31 3k62 n ASP 376 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3k62 h SER 377 N 0.04 0.00 1.23 -1.12 4.64 -2.01 -1.04 113.55 115.28 3k62 h SER 377 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3k62 h SER 377 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 3k62 h SER 377 CO 0.03 0.03 0.00 0.23 -0.87 0.00 0.00 176.83 176.25 3k62 n MET 378 N -3.26 0.25 -0.35 4.77 2.81 -1.26 -3.48 117.12 116.59 3k62 n MET 378 Ca -0.02 0.30 0.08 0.00 -1.81 0.00 0.00 57.70 56.25 3k62 n MET 378 Cb 0.18 -1.84 0.24 0.00 -0.71 0.00 0.00 33.22 31.09 3k62 n MET 378 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 3k62 n ASN 379 N -2.28 3.66 0.16 7.83 5.03 -0.39 -4.62 115.26 124.64 3k62 n ASN 379 Ca 0.04 -2.31 0.12 0.00 0.87 0.00 0.00 54.58 53.31 3k62 n ASN 379 Cb 0.36 -0.40 0.56 0.00 -1.02 0.00 0.00 39.78 39.28 3k62 n ASN 379 CO 0.00 0.00 0.00 -0.37 -1.83 0.00 0.00 177.26 175.06 3k62 h VAL 380 N 2.69 0.00 0.00 2.41 -1.51 -1.62 -2.11 116.25 116.11 3k62 h VAL 380 Ca 0.00 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 65.30 3k62 h VAL 380 Cb 1.07 0.85 0.00 0.00 -2.13 0.00 0.00 31.29 31.08 3k62 h VAL 380 CO 0.10 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 175.54 3k62 n ASP 381 N -2.33 0.00 -4.77 4.19 5.75 -1.26 -4.87 116.55 113.26 3k62 n ASP 381 Ca 0.01 0.11 -0.39 0.00 -0.01 0.00 0.00 54.79 54.51 3k62 n ASP 381 Cb 0.17 -0.37 -0.01 0.00 -1.03 0.00 0.00 41.12 39.88 3k62 n ASP 381 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 3k62 s LEU 382 N -2.74 4.17 0.89 -2.12 1.43 -0.80 -5.02 118.68 114.48 3k62 s LEU 382 Ca 0.23 2.46 -0.11 0.00 -1.03 0.00 0.00 54.13 55.68 3k62 s LEU 382 Cb 0.20 -4.02 0.12 0.00 0.03 0.00 0.00 46.19 42.52 3k62 s LEU 382 CO 0.48 -0.80 1.10 0.42 0.23 0.00 0.00 176.35 177.78 3k62 s THR 383 N -1.37 2.65 0.38 5.49 -4.23 -1.26 -4.81 115.64 112.50 3k62 s THR 383 Ca 0.58 0.21 0.10 0.00 -1.18 0.00 0.00 61.69 61.40 3k62 s THR 383 Cb -0.33 -2.52 0.15 0.00 1.34 0.00 0.00 72.50 71.13 3k62 s THR 383 CO 0.42 -0.28 1.90 0.77 -0.54 0.00 0.00 174.62 176.89 3k62 h SER 384 N -1.61 0.21 -0.62 3.99 4.64 -1.98 -0.31 113.55 117.87 3k62 h SER 384 Ca -0.47 -0.05 -0.05 0.00 -0.47 0.00 0.00 61.79 60.75 3k62 h SER 384 Cb 1.27 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 63.28 3k62 h SER 384 CO 0.49 0.39 0.18 0.00 -0.87 0.00 0.00 176.83 177.03 3k62 h ALA 385 N 1.63 0.81 -0.12 5.18 0.00 -2.00 -1.54 119.26 123.22 3k62 h ALA 385 Ca 0.04 -0.21 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 3k62 h ALA 385 Cb 0.42 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3k62 h ALA 385 CO 0.03 0.50 -0.34 0.00 0.00 0.00 0.00 179.25 179.43 3k62 h ALA 386 N 1.06 1.20 -0.32 0.00 0.00 -1.71 -2.01 119.26 117.48 3k62 h ALA 386 Ca 0.20 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 3k62 h ALA 386 Cb 0.31 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3k62 h ALA 386 CO -0.00 0.54 -0.18 1.96 0.00 0.00 0.00 179.25 181.56 3k62 h GLN 387 N 0.21 0.59 -0.37 0.00 1.08 -0.72 -0.61 115.11 115.29 3k62 h GLN 387 Ca 0.03 -0.21 -0.10 0.00 -1.45 0.00 0.00 58.65 56.92 3k62 h GLN 387 Cb 0.71 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 28.09 3k62 h GLN 387 CO 0.05 0.75 -0.17 -0.97 -0.95 0.00 0.00 178.83 177.53 3k62 h ASN 388 N 0.53 0.79 -0.34 1.46 -1.24 -0.83 0.16 115.58 116.12 3k62 h ASN 388 Ca 0.09 -0.40 0.02 0.00 0.71 0.00 0.00 56.30 56.71 3k62 h ASN 388 Cb 0.61 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.42 3k62 h ASN 388 CO 0.04 1.02 0.18 0.25 -1.29 0.00 0.00 177.43 177.64 3k62 h LEU 389 N 0.56 0.29 -0.32 0.34 5.85 -1.19 -1.87 115.31 118.98 3k62 h LEU 389 Ca 0.08 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.81 3k62 h LEU 389 Cb 0.72 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 3k62 h LEU 389 CO 0.05 0.21 0.20 -0.09 -0.34 0.00 0.00 178.44 178.47 3k62 h ARG 390 N 0.38 0.42 -0.90 1.25 2.43 -0.86 -2.06 114.38 115.05 3k62 h ARG 390 Ca 0.14 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.26 3k62 h ARG 390 Cb 0.02 -0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.44 3k62 h ARG 390 CO -0.08 0.31 0.53 1.49 -1.51 0.00 0.00 179.97 180.71 3k62 h GLU 391 N 0.41 1.23 -0.32 0.20 4.57 -0.42 0.55 114.58 120.81 3k62 h GLU 391 Ca 0.11 -0.12 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 3k62 h GLU 391 Cb -0.01 -0.25 -0.01 0.00 -0.16 0.00 0.00 28.75 28.32 3k62 h GLU 391 CO -0.02 0.87 -0.15 0.00 -1.18 0.00 0.00 179.01 178.53 3k62 h ARG 392 N 1.25 0.66 -0.72 1.92 2.47 -1.23 -0.80 114.38 117.93 3k62 h ARG 392 Ca 0.32 -0.29 -0.02 0.00 -1.26 0.00 0.00 59.98 58.74 3k62 h ARG 392 Cb -0.03 -0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.24 3k62 h ARG 392 CO -0.06 0.87 0.38 0.00 0.56 0.00 0.00 179.97 181.73 3k62 h ALA 393 N 0.77 0.92 -0.44 0.04 0.00 -1.01 -1.40 119.26 118.14 3k62 h ALA 393 Ca 0.07 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 3k62 h ALA 393 Cb 0.68 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3k62 h ALA 393 CO 0.05 0.45 0.22 1.25 0.00 0.00 0.00 179.25 181.21 3k62 h LEU 394 N 0.99 0.56 -1.08 0.00 5.85 -0.78 -1.71 115.31 119.14 3k62 h LEU 394 Ca 0.25 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 3k62 h LEU 394 Cb 0.06 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3k62 h LEU 394 CO -0.04 0.52 0.26 -0.61 -0.34 0.00 0.00 178.44 178.22 3k62 h GLN 395 N 0.57 0.91 -0.41 1.25 5.75 -0.88 0.13 115.11 122.42 3k62 h GLN 395 Ca 0.15 -0.14 -0.12 0.00 -0.15 0.00 0.00 58.65 58.38 3k62 h GLN 395 Cb 0.09 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.47 3k62 h GLN 395 CO -0.02 0.74 -0.22 0.00 -2.65 0.00 0.00 178.83 176.68 3k62 h ARG 396 N 0.90 0.89 -0.37 1.69 3.08 -1.04 -1.48 114.38 118.04 3k62 h ARG 396 Ca 0.21 -0.40 -0.11 0.00 0.07 0.00 0.00 59.98 59.75 3k62 h ARG 396 Cb 0.17 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 3k62 h ARG 396 CO -0.02 1.05 -0.21 1.25 -1.07 0.00 0.00 179.97 180.96 3k62 h LEU 397 N 0.71 0.82 -1.14 3.04 5.85 -0.86 -2.94 115.31 120.78 3k62 h LEU 397 Ca 0.09 -0.42 -0.06 0.00 0.84 0.00 0.00 57.88 58.33 3k62 h LEU 397 Cb 0.79 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 3k62 h LEU 397 CO 0.07 1.06 -0.09 0.24 -0.34 0.00 0.00 178.44 179.38 3k62 h MET 398 N 0.58 0.49 -0.49 1.25 2.86 -0.72 -1.14 114.93 117.77 3k62 h MET 398 Ca 0.08 -0.13 0.01 0.00 -2.06 0.00 0.00 59.70 57.60 3k62 h MET 398 Cb 0.77 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.34 3k62 h MET 398 CO 0.06 0.59 0.31 1.15 1.06 0.00 0.00 176.91 180.08 3k62 h THR 399 N 0.46 1.09 -0.54 2.22 2.02 -1.15 0.14 112.91 117.15 3k62 h THR 399 Ca 0.09 -0.21 -0.10 0.00 0.77 0.00 0.00 66.41 66.95 3k62 h THR 399 Cb 0.44 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.24 3k62 h THR 399 CO 0.02 0.11 -0.07 0.28 0.37 0.00 0.00 175.52 176.23 3k62 h SER 400 N 0.62 0.99 -0.41 4.18 0.02 -1.26 -1.07 113.55 116.62 3k62 h SER 400 Ca 0.19 -0.34 -0.02 0.00 -0.84 0.00 0.00 61.79 60.78 3k62 h SER 400 Cb -0.03 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.23 3k62 h SER 400 CO -0.07 1.10 0.16 0.58 -1.14 0.00 0.00 176.83 177.47 3k62 h VAL 401 N 0.87 1.19 -0.53 2.27 2.07 -1.01 -2.81 116.25 118.31 3k62 h VAL 401 Ca 0.14 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 67.01 3k62 h VAL 401 Cb 0.63 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3k62 h VAL 401 CO 0.04 0.22 0.12 0.74 0.02 0.00 0.00 177.57 178.71 3k62 h THR 402 N 0.51 1.22 0.00 2.57 2.02 -0.57 -0.81 112.91 117.85 3k62 h THR 402 Ca 0.14 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.48 3k62 h THR 402 Cb 0.18 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 3k62 h THR 402 CO -0.01 0.30 -0.06 0.78 0.37 0.00 0.00 175.52 176.90 3k62 h ASN 403 N 0.78 0.00 -0.08 4.18 2.35 -1.02 -2.70 115.58 119.09 3k62 h ASN 403 Ca 0.17 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 3k62 h ASN 403 Cb 0.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.67 3k62 h ASN 403 CO -0.00 0.06 0.00 0.54 -1.65 0.00 0.00 177.43 176.38 3k62 n ARG 404 N -3.59 1.82 -0.18 0.81 1.74 -0.72 -4.85 116.66 111.69 3k62 n ARG 404 Ca -0.02 -2.65 -0.01 0.00 -0.77 0.00 0.00 57.85 54.40 3k62 n ARG 404 Cb 0.18 -1.60 0.07 0.00 -1.02 0.00 0.00 32.46 30.09 3k62 n ARG 404 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k62 h GLN 406 N 0.08 0.37 -0.71 0.00 4.15 -1.88 0.16 115.11 117.28 3k62 h GLN 406 Ca 0.28 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.65 3k62 h GLN 406 Cb 0.44 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 28.01 3k62 h GLN 406 CO -0.50 0.25 0.34 1.49 -1.93 0.00 0.00 178.83 178.47 3k62 h GLU 407 N 0.39 1.03 -0.14 1.69 4.81 -1.76 -2.81 114.58 117.78 3k62 h GLU 407 Ca 0.11 -0.15 -0.15 0.00 -0.13 0.00 0.00 59.36 59.04 3k62 h GLU 407 Cb -0.03 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.17 3k62 h GLU 407 CO -0.03 0.81 -0.49 -0.07 -0.73 0.00 0.00 179.01 178.50 3k62 h LEU 408 N 1.00 0.67 -1.68 1.64 3.38 -0.87 -3.03 115.31 116.41 3k62 h LEU 408 Ca 0.24 -0.61 0.03 0.00 0.09 0.00 0.00 57.88 57.63 3k62 h LEU 408 Cb 0.12 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 3k62 h LEU 408 CO -0.03 1.17 0.27 0.00 0.09 0.00 0.00 178.44 179.93 3k62 h ALA 409 N 0.52 1.85 -0.00 1.53 0.00 -0.65 -2.46 119.26 120.05 3k62 h ALA 409 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3k62 h ALA 409 Cb 1.12 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3k62 h ALA 409 CO 0.10 0.10 -0.41 0.25 0.00 0.00 0.00 179.25 179.30 3k62 n THR 410 N -4.48 0.00 -2.74 0.00 -2.24 -1.07 -3.38 114.28 100.37 3k62 n THR 410 Ca 0.04 -0.08 -0.37 0.00 -2.27 0.00 0.00 64.05 61.37 3k62 n THR 410 Cb 0.16 0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 68.76 3k62 n THR 410 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3k62 s ASN 411 N -2.71 7.27 0.52 3.42 2.47 -0.97 -4.60 114.94 120.34 3k62 s ASN 411 Ca 0.18 1.88 0.25 0.00 0.42 0.00 0.00 52.86 55.59 3k62 s ASN 411 Cb 0.18 -2.58 1.36 0.00 -1.45 0.00 0.00 41.25 38.76 3k62 s ASN 411 CO 0.61 -0.12 1.96 1.05 -3.72 0.00 0.00 177.10 176.88 3k62 h GLU 412 N 3.12 0.06 0.00 0.43 4.11 -1.92 -2.71 114.58 117.67 3k62 h GLU 412 Ca -0.47 -0.00 -0.18 0.00 0.07 0.00 0.00 59.36 58.78 3k62 h GLU 412 Cb 1.19 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 3k62 h GLU 412 CO 0.65 0.04 -1.65 0.66 0.07 0.00 0.00 179.01 178.78 3k62 n TYR 413 N -4.37 0.00 0.43 2.06 4.01 -1.26 -4.67 117.16 113.36 3k62 n TYR 413 Ca 0.12 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.97 3k62 n TYR 413 Cb 0.66 -0.44 0.45 0.00 -0.31 0.00 0.00 39.34 39.71 3k62 n TYR 413 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3k62 n ALA 414 N -2.93 1.68 0.28 -0.72 0.00 -1.18 -2.10 120.51 115.53 3k62 n ALA 414 Ca -0.21 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.40 3k62 n ALA 414 Cb 0.71 -1.36 0.78 0.00 0.00 0.00 0.00 19.45 19.58 3k62 n ALA 414 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 3k62 h ASN 415 N 0.00 0.00 -0.02 0.00 7.08 -1.11 -0.44 115.58 121.09 3k62 h ASN 415 Ca 0.00 0.00 -0.09 0.00 -3.08 0.00 0.00 56.30 53.13 3k62 h ASN 415 Cb 0.35 0.00 -0.01 0.00 -2.08 0.00 0.00 38.32 36.57 3k62 h ASN 415 CO 0.00 0.02 -0.24 1.88 -2.08 0.00 0.00 177.43 177.01 3k62 h TYR 416 N 0.00 0.46 -0.10 4.14 0.05 -1.72 -0.43 116.97 119.37 3k62 h TYR 416 Ca -0.00 -0.09 -0.02 0.00 0.05 0.00 0.00 58.73 58.67 3k62 h TYR 416 Cb 0.04 -0.12 -0.00 0.00 1.01 0.00 0.00 36.73 37.66 3k62 h TYR 416 CO 0.00 0.63 -0.01 0.82 -1.05 0.00 0.00 178.16 178.55 3k62 h ILE 417 N 0.37 1.27 -0.69 -2.88 1.08 -1.26 -0.11 117.51 115.29 3k62 h ILE 417 Ca 0.06 -0.85 -0.03 0.00 -0.39 0.00 0.00 64.86 63.64 3k62 h ILE 417 Cb 0.63 1.65 -0.03 0.00 -3.07 0.00 0.00 36.82 36.00 3k62 h ILE 417 CO 0.05 0.24 0.31 0.40 -0.69 0.00 0.00 178.15 178.45 3k62 h ILE 418 N -0.12 1.24 -0.85 -0.67 1.08 -1.30 -1.41 117.51 115.48 3k62 h ILE 418 Ca 0.03 -0.70 0.01 0.00 -0.39 0.00 0.00 64.86 63.80 3k62 h ILE 418 Cb 0.38 0.41 -0.04 0.00 -3.07 0.00 0.00 36.82 34.50 3k62 h ILE 418 CO 0.01 0.28 0.55 1.56 -0.69 0.00 0.00 178.15 179.86 3k62 h GLN 419 N 0.97 1.13 -0.42 2.37 4.20 -1.01 -1.37 115.11 120.98 3k62 h GLN 419 Ca 0.23 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.89 3k62 h GLN 419 Cb 0.16 -0.25 -0.03 0.00 0.30 0.00 0.00 27.48 27.66 3k62 h GLN 419 CO -0.03 0.76 0.24 1.25 -0.67 0.00 0.00 178.83 180.38 3k62 h HIS 420 N 1.15 0.45 -0.08 2.96 2.76 -0.21 -0.89 115.15 121.29 3k62 h HIS 420 Ca 0.31 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.49 3k62 h HIS 420 Cb -0.11 -0.14 -0.00 0.00 1.55 0.00 0.00 27.41 28.70 3k62 h HIS 420 CO -0.01 0.26 0.03 0.82 -1.30 0.00 0.00 177.93 177.72 3k62 h ILE 421 N 0.49 1.17 -0.64 6.26 2.04 -0.99 -2.54 117.51 123.29 3k62 h ILE 421 Ca 0.17 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.53 3k62 h ILE 421 Cb 0.02 1.36 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 3k62 h ILE 421 CO -0.08 0.14 0.42 0.58 0.00 0.00 0.00 178.15 179.21 3k62 h VAL 422 N -0.05 1.17 0.00 1.67 2.07 -1.14 -2.87 116.25 117.10 3k62 h VAL 422 Ca 0.03 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.22 3k62 h VAL 422 Cb 0.21 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3k62 h VAL 422 CO -0.00 0.17 0.00 0.28 0.02 0.00 0.00 177.57 178.04 3k62 h SER 423 N 0.88 0.00 -3.61 0.57 0.02 -1.02 -3.45 113.55 106.94 3k62 h SER 423 Ca 0.24 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 60.53 3k62 h SER 423 Cb -0.08 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 62.30 3k62 h SER 423 CO -0.05 0.00 -0.10 0.21 -1.14 0.00 0.00 176.83 175.76 3k62 s ASN 424 N -5.95 6.28 0.48 3.07 3.84 -0.97 -4.93 114.94 116.76 3k62 s ASN 424 Ca 0.08 -0.14 0.17 0.00 0.21 0.00 0.00 52.86 53.17 3k62 s ASN 424 Cb 0.06 -2.25 1.18 0.00 -0.55 0.00 0.00 41.25 39.69 3k62 s ASN 424 CO 0.66 -0.48 2.04 0.44 -2.79 0.00 0.00 177.10 176.96 3k62 h ASP 425 N 8.51 0.17 0.27 -4.21 3.32 -1.87 0.13 116.42 122.75 3k62 h ASP 425 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 3k62 h ASP 425 Cb 1.12 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.64 3k62 h ASP 425 CO 0.77 0.11 0.00 0.47 -1.72 0.00 0.00 179.24 178.87 3k62 n ASP 426 N -4.46 0.00 -0.71 6.45 10.43 -1.26 -1.91 116.55 125.08 3k62 n ASP 426 Ca 0.06 -0.02 0.04 0.00 2.57 0.00 0.00 54.79 57.44 3k62 n ASP 426 Cb 0.33 -0.25 0.20 0.00 1.84 0.00 0.00 41.12 43.24 3k62 n ASP 426 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3k62 n LEU 427 N -1.25 3.21 -0.23 0.64 4.77 0.46 -4.68 117.00 119.92 3k62 n LEU 427 Ca 0.08 -3.65 0.02 0.00 -0.03 0.00 0.00 56.01 52.43 3k62 n LEU 427 Cb 0.12 -0.55 0.13 0.00 -2.33 0.00 0.00 43.42 40.80 3k62 n LEU 427 CO 0.12 1.18 1.02 0.00 -1.33 0.00 0.00 177.39 178.38 3k62 h ALA 428 N 0.90 0.91 -0.61 -1.18 0.00 -1.39 0.38 119.26 118.27 3k62 h ALA 428 Ca 0.07 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3k62 h ALA 428 Cb 1.25 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 3k62 h ALA 428 CO 0.14 -0.15 0.40 -0.24 0.00 0.00 0.00 179.25 179.41 3k62 h VAL 429 N 0.48 1.14 0.07 0.00 3.04 -1.89 -1.64 116.25 117.45 3k62 h VAL 429 Ca 0.34 -0.28 -0.25 0.00 -1.01 0.00 0.00 66.70 65.51 3k62 h VAL 429 Cb 0.43 0.27 0.00 0.00 -2.01 0.00 0.00 31.29 29.98 3k62 h VAL 429 CO -0.31 0.15 -1.10 1.88 -1.01 0.00 0.00 177.57 177.18 3k62 h TYR 430 N 0.81 0.52 -0.74 3.17 0.05 -1.40 -2.73 116.97 116.65 3k62 h TYR 430 Ca 0.23 -0.33 0.12 0.00 0.05 0.00 0.00 58.73 58.79 3k62 h TYR 430 Cb -0.07 -0.04 -0.08 0.00 1.01 0.00 0.00 36.73 37.55 3k62 h TYR 430 CO -0.00 1.20 0.33 -0.09 -1.05 0.00 0.00 178.16 178.55 3k62 h ARG 431 N 0.14 0.50 -0.46 4.88 2.43 -0.63 -1.41 114.38 119.82 3k62 h ARG 431 Ca -0.11 -0.03 -0.13 0.00 -0.81 0.00 0.00 59.98 58.90 3k62 h ARG 431 Cb 1.78 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 31.20 3k62 h ARG 431 CO 0.18 0.33 -0.23 0.93 -1.51 0.00 0.00 179.97 179.68 3k62 h GLU 432 N 0.52 0.96 -0.35 0.20 5.08 -1.18 -1.86 114.58 117.95 3k62 h GLU 432 Ca 0.39 -0.41 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3k62 h GLU 432 Cb 0.52 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.71 3k62 h GLU 432 CO -0.34 1.08 0.16 0.00 -1.00 0.00 0.00 179.01 178.91 3k62 h ILE 434 N 0.34 1.14 -0.34 0.00 2.04 -1.06 0.24 117.51 119.87 3k62 h ILE 434 Ca 0.15 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.60 3k62 h ILE 434 Cb 0.07 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.16 3k62 h ILE 434 CO -0.11 0.14 0.21 0.40 0.00 0.00 0.00 178.15 178.78 3k62 h ILE 435 N 0.21 1.05 -0.60 -0.67 2.04 -1.18 -1.79 117.51 116.58 3k62 h ILE 435 Ca 0.07 -0.15 -0.07 0.00 1.00 0.00 0.00 64.86 65.72 3k62 h ILE 435 Cb 0.13 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 3k62 h ILE 435 CO -0.01 0.08 0.10 -0.33 0.00 0.00 0.00 178.15 177.98 3k62 h GLU 436 N 0.42 0.98 -0.02 2.37 5.08 -0.98 0.02 114.58 122.45 3k62 h GLU 436 Ca 0.13 -0.24 -0.19 0.00 -1.00 0.00 0.00 59.36 58.06 3k62 h GLU 436 Cb -0.01 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.13 3k62 h GLU 436 CO -0.05 0.90 -0.73 -0.22 -1.00 0.00 0.00 179.01 177.92 3k62 h LYS 437 N 0.92 0.53 0.00 2.33 1.63 -0.15 -3.40 116.57 118.42 3k62 h LYS 437 Ca 0.19 -0.54 0.00 0.00 -0.85 0.00 0.00 60.65 59.45 3k62 h LYS 437 Cb 0.40 0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.18 3k62 h LYS 437 CO 0.01 1.17 -0.23 0.00 -3.45 0.00 0.00 179.45 176.95 3k62 n LEU 439 N -0.51 2.13 -4.77 0.00 4.77 -1.00 -4.61 117.00 113.01 3k62 n LEU 439 Ca 0.00 0.35 -0.41 0.00 -0.03 0.00 0.00 56.01 55.91 3k62 n LEU 439 Cb 0.00 -1.01 -0.00 0.00 -2.33 0.00 0.00 43.42 40.07 3k62 n LEU 439 CO 0.00 0.48 1.18 0.23 -1.33 0.00 0.00 177.39 177.95 3k62 n MET 440 N -4.11 2.71 -0.41 3.23 2.81 -0.04 -0.89 117.12 120.43 3k62 n MET 440 Ca -0.33 0.96 0.00 0.00 -1.81 0.00 0.00 57.70 56.52 3k62 n MET 440 Cb 0.81 -2.71 0.00 0.00 -0.71 0.00 0.00 33.22 30.61 3k62 n MET 440 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3k62 n ARG 441 N 0.96 0.00 -0.06 0.03 1.74 -1.26 -4.78 116.66 113.29 3k62 n ARG 441 Ca 0.03 0.00 0.05 0.00 -0.77 0.00 0.00 57.85 57.16 3k62 n ARG 441 Cb 0.38 -2.57 0.07 0.00 -1.02 0.00 0.00 32.46 29.32 3k62 n ARG 441 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3k62 n ASN 442 N 0.00 2.01 -0.17 0.55 5.03 -0.07 -4.83 115.26 117.78 3k62 n ASN 442 Ca 0.00 -2.50 -0.10 0.00 0.87 0.00 0.00 54.58 52.85 3k62 n ASN 442 Cb 0.00 -0.22 0.00 0.00 -1.02 0.00 0.00 39.78 38.54 3k62 n ASN 442 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 3k62 h LEU 443 N 0.00 0.88 -0.32 3.41 3.38 -1.82 -0.25 115.31 120.59 3k62 h LEU 443 Ca 0.00 -0.31 -0.00 0.00 0.09 0.00 0.00 57.88 57.65 3k62 h LEU 443 Cb 0.81 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3k62 h LEU 443 CO 0.00 0.98 0.18 0.25 0.09 0.00 0.00 178.44 179.94 3k62 h LEU 444 N 0.75 0.40 -0.22 1.67 5.85 -1.91 -0.45 115.31 121.39 3k62 h LEU 444 Ca 0.14 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 3k62 h LEU 444 Cb 0.54 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 3k62 h LEU 444 CO 0.03 0.36 0.04 -1.28 -0.34 0.00 0.00 178.44 177.25 3k62 h SER 445 N 0.40 0.35 0.71 1.25 0.87 -1.87 -3.11 113.55 112.15 3k62 h SER 445 Ca 0.11 -0.25 -0.08 0.00 -1.23 0.00 0.00 61.79 60.34 3k62 h SER 445 Cb 0.05 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 3k62 h SER 445 CO -0.02 0.51 -0.39 -0.07 -0.53 0.00 0.00 176.83 176.33 3k62 h LEU 446 N 0.18 0.00 -1.18 2.23 3.38 -0.91 -2.16 115.31 116.85 3k62 h LEU 446 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3k62 h LEU 446 Cb 0.30 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.05 3k62 h LEU 446 CO 0.00 0.39 0.00 0.28 0.09 0.00 0.00 178.44 179.20 3k62 h SER 447 N 0.00 0.00 -0.44 -0.43 0.02 -1.01 -2.19 113.55 109.50 3k62 h SER 447 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3k62 h SER 447 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.39 3k62 h SER 447 CO 0.05 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.74 3k62 n GLN 448 N -2.78 2.25 -3.87 3.45 6.02 -0.81 -2.07 117.38 119.57 3k62 n GLN 448 Ca 0.01 -1.92 -0.37 0.00 -0.01 0.00 0.00 57.00 54.72 3k62 n GLN 448 Cb 0.28 -1.45 -0.06 0.00 1.02 0.00 0.00 30.24 30.03 3k62 n GLN 448 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3k62 s GLU 449 N -1.43 3.45 0.14 -1.09 2.02 -0.84 -4.85 118.70 116.10 3k62 s GLU 449 Ca 0.37 -0.14 -0.18 0.00 0.02 0.00 0.00 54.97 55.04 3k62 s GLU 449 Cb 0.20 -3.18 0.01 0.00 0.10 0.00 0.00 34.13 31.26 3k62 s GLU 449 CO 0.28 0.77 1.74 -0.22 0.02 0.00 0.00 175.26 177.85 3k62 h LYS 450 N 4.84 0.19 0.04 1.61 3.64 -1.91 -1.99 116.57 122.99 3k62 h LYS 450 Ca -0.54 -0.01 -0.23 0.00 -1.27 0.00 0.00 60.65 58.59 3k62 h LYS 450 Cb 1.22 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.98 3k62 h LYS 450 CO 0.59 0.13 -1.25 0.74 -2.27 0.00 0.00 179.45 177.40 3k62 h PHE 451 N 0.20 0.17 0.00 1.91 0.04 -1.89 -3.38 116.94 113.99 3k62 h PHE 451 Ca 0.12 -0.12 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 3k62 h PHE 451 Cb 0.10 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.25 3k62 h PHE 451 CO -0.14 1.49 -0.02 0.00 -0.60 0.00 0.00 178.31 179.03 3k62 h ALA 452 N -0.26 1.03 -0.41 2.45 0.00 -1.62 -2.63 119.26 117.82 3k62 h ALA 452 Ca -0.31 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 3k62 h ALA 452 Cb 1.47 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.24 3k62 h ALA 452 CO -0.09 0.03 0.21 0.66 0.00 0.00 0.00 179.25 180.06 3k62 h SER 453 N 0.00 0.50 -0.22 0.00 4.64 -1.13 -0.18 113.55 117.15 3k62 h SER 453 Ca -0.00 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.21 3k62 h SER 453 Cb 0.35 -0.13 -0.02 0.00 -0.31 0.00 0.00 62.40 62.30 3k62 h SER 453 CO 0.00 0.42 -0.08 0.45 -0.87 0.00 0.00 176.83 176.75 3k62 h HIS 454 N 0.57 0.62 -0.49 4.77 3.86 -1.69 -1.87 115.15 120.93 3k62 h HIS 454 Ca 0.15 -0.09 -0.08 0.00 -1.16 0.00 0.00 60.37 59.18 3k62 h HIS 454 Cb 0.04 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 28.32 3k62 h HIS 454 CO 0.00 0.65 -0.03 0.28 0.86 0.00 0.00 177.93 179.70 3k62 h VAL 455 N 0.54 1.27 -0.65 2.45 2.07 -1.20 -2.13 116.25 118.61 3k62 h VAL 455 Ca 0.10 -1.11 0.02 0.00 0.82 0.00 0.00 66.70 66.53 3k62 h VAL 455 Cb 0.47 1.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.22 3k62 h VAL 455 CO 0.03 0.39 0.41 0.58 0.02 0.00 0.00 177.57 178.99 3k62 h VAL 456 N 0.73 1.11 -0.22 2.57 2.07 -0.88 -0.99 116.25 120.64 3k62 h VAL 456 Ca 0.13 -0.28 0.02 0.00 0.82 0.00 0.00 66.70 67.39 3k62 h VAL 456 Cb 0.55 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3k62 h VAL 456 CO 0.03 0.15 0.10 -0.33 0.02 0.00 0.00 177.57 177.54 3k62 h GLU 457 N 0.81 0.21 -1.01 1.57 5.08 -1.19 -1.66 114.58 118.39 3k62 h GLU 457 Ca 0.25 -0.01 0.08 0.00 -1.00 0.00 0.00 59.36 58.68 3k62 h GLU 457 Cb -0.02 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.11 3k62 h GLU 457 CO -0.09 0.14 0.65 0.87 -1.00 0.00 0.00 179.01 179.58 3k62 h LYS 458 N 0.22 1.10 -0.39 2.33 1.79 -1.06 -0.74 116.57 119.82 3k62 h LYS 458 Ca 0.09 -0.07 -0.02 0.00 -2.18 0.00 0.00 60.65 58.48 3k62 h LYS 458 Cb 0.03 -0.25 -0.02 0.00 -1.58 0.00 0.00 32.23 30.41 3k62 h LYS 458 CO -0.07 0.73 0.18 0.00 -1.08 0.00 0.00 179.45 179.21 3k62 h ALA 459 N 1.47 0.50 -0.49 3.86 0.00 -0.69 -1.20 119.26 122.71 3k62 h ALA 459 Ca 0.45 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 55.27 3k62 h ALA 459 Cb 0.24 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3k62 h ALA 459 CO -0.20 0.07 0.30 0.74 0.00 0.00 0.00 179.25 180.16 3k62 h PHE 460 N 0.48 0.56 -0.12 0.00 -1.00 -0.77 0.18 116.94 116.28 3k62 h PHE 460 Ca 0.13 0.02 -0.06 0.00 2.81 0.00 0.00 57.97 60.86 3k62 h PHE 460 Cb 0.13 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 39.50 3k62 h PHE 460 CO -0.01 0.33 -0.21 -0.07 -1.61 0.00 0.00 178.31 176.73 3k62 h LEU 461 N 0.60 0.20 -0.46 1.54 3.38 -0.80 -3.33 115.31 116.44 3k62 h LEU 461 Ca 0.19 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3k62 h LEU 461 Cb -0.00 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3k62 h LEU 461 CO -0.08 0.42 0.00 1.41 0.09 0.00 0.00 178.44 180.29 3k62 n HIS 462 N -4.21 0.00 -1.84 1.13 8.25 -0.48 -5.04 115.22 113.03 3k62 n HIS 462 Ca -0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.04 3k62 n HIS 462 Cb 0.32 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.43 3k62 n HIS 462 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3k62 s ALA 463 N -0.54 3.57 0.73 -1.41 0.00 0.62 -4.96 121.76 119.77 3k62 s ALA 463 Ca 0.00 1.54 -0.15 0.00 0.00 0.00 0.00 51.96 53.35 3k62 s ALA 463 Cb 0.00 -3.60 0.04 0.00 0.00 0.00 0.00 23.12 19.56 3k62 s ALA 463 CO 0.00 -1.01 1.24 -1.25 0.00 0.00 0.00 175.76 174.74 3k62 s PRO 464 N -2.06 2.06 0.27 0.00 0.04 -1.26 -4.56 135.00 129.50 3k62 s PRO 464 Ca 0.52 1.88 -0.03 0.00 0.04 0.00 0.00 61.00 63.42 3k62 s PRO 464 Cb -0.46 -1.81 0.57 0.00 0.04 0.00 0.00 34.50 32.85 3k62 s PRO 464 CO 0.62 -1.92 1.64 -0.07 0.04 0.00 0.00 177.00 177.30 3k62 h LEU 465 N -0.24 -0.21 -0.84 -3.56 -0.00 -1.96 0.54 115.31 109.04 3k62 h LEU 465 Ca -0.48 0.20 -0.09 0.00 -0.00 0.00 0.00 57.88 57.51 3k62 h LEU 465 Cb 1.31 0.32 -0.02 0.00 -0.00 0.00 0.00 40.66 42.27 3k62 h LEU 465 CO 0.49 -0.18 -0.08 -0.33 -0.00 0.00 0.00 178.44 178.34 3k62 h GLU 466 N 0.15 0.78 -0.03 1.13 4.39 -1.98 -0.74 114.58 118.27 3k62 h GLU 466 Ca 0.48 -0.24 -0.23 0.00 0.34 0.00 0.00 59.36 59.71 3k62 h GLU 466 Cb 0.92 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 29.50 3k62 h GLU 466 CO -0.68 0.84 -0.90 -0.07 -1.16 0.00 0.00 179.01 177.04 3k62 h LEU 467 N 0.71 0.65 -0.97 1.33 3.38 -1.65 -2.85 115.31 115.90 3k62 h LEU 467 Ca 0.13 -0.49 0.03 0.00 0.09 0.00 0.00 57.88 57.63 3k62 h LEU 467 Cb 0.55 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3k62 h LEU 467 CO 0.03 1.28 0.64 0.25 0.09 0.00 0.00 178.44 180.73 3k62 h LEU 468 N 0.31 1.07 -0.87 1.67 5.85 -0.65 0.23 115.31 122.93 3k62 h LEU 468 Ca -0.08 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.59 3k62 h LEU 468 Cb 1.53 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 42.27 3k62 h LEU 468 CO 0.16 0.75 0.36 0.00 -0.34 0.00 0.00 178.44 179.37 3k62 h ALA 469 N 1.39 1.11 -0.51 1.25 0.00 -1.09 0.46 119.26 121.86 3k62 h ALA 469 Ca 0.38 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 3k62 h ALA 469 Cb -0.04 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3k62 h ALA 469 CO -0.11 0.65 0.14 0.93 0.00 0.00 0.00 179.25 180.86 3k62 h GLU 470 N 1.16 0.81 -0.31 0.00 5.08 -1.15 -0.81 114.58 119.35 3k62 h GLU 470 Ca 0.27 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3k62 h GLU 470 Cb 0.16 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3k62 h GLU 470 CO -0.03 0.77 0.18 0.52 -1.00 0.00 0.00 179.01 179.45 3k62 h MET 471 N 0.71 0.43 -0.46 2.33 2.86 -0.50 -0.89 114.93 119.42 3k62 h MET 471 Ca 0.16 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.75 3k62 h MET 471 Cb 0.31 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.86 3k62 h MET 471 CO -0.00 0.34 0.24 0.52 1.06 0.00 0.00 176.91 179.06 3k62 h MET 472 N 0.40 0.65 -0.46 1.72 2.86 -0.80 -2.40 114.93 116.89 3k62 h MET 472 Ca 0.11 -0.09 -0.00 0.00 -2.06 0.00 0.00 59.70 57.66 3k62 h MET 472 Cb 0.03 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.54 3k62 h MET 472 CO -0.02 0.53 0.28 -0.44 1.06 0.00 0.00 176.91 178.32 3k62 h ASP 473 N 0.60 0.54 -0.41 1.22 3.45 -0.98 -0.88 116.42 119.95 3k62 h ASP 473 Ca 0.16 -0.02 -0.06 0.00 0.43 0.00 0.00 57.03 57.53 3k62 h ASP 473 Cb 0.09 -0.14 -0.02 0.00 -0.56 0.00 0.00 39.33 38.70 3k62 h ASP 473 CO -0.02 0.42 0.02 -0.08 -1.57 0.00 0.00 179.24 178.01 3k62 h GLU 474 N 0.63 0.72 -0.18 3.56 4.81 -0.69 0.93 114.58 124.36 3k62 h GLU 474 Ca 0.17 -0.22 -0.05 0.00 -0.13 0.00 0.00 59.36 59.13 3k62 h GLU 474 Cb -0.03 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 3k62 h GLU 474 CO -0.03 0.79 -0.08 0.82 -0.73 0.00 0.00 179.01 179.77 3k62 h ILE 475 N 0.56 1.31 -0.02 2.32 1.08 -0.95 0.14 117.51 121.94 3k62 h ILE 475 Ca 0.12 -1.12 -0.14 0.00 -0.39 0.00 0.00 64.86 63.32 3k62 h ILE 475 Cb 0.45 1.68 -0.02 0.00 -3.07 0.00 0.00 36.82 35.86 3k62 h ILE 475 CO 0.02 0.34 -0.66 -0.26 -0.69 0.00 0.00 178.15 176.89 3k62 h PHE 476 N 0.05 0.09 0.00 1.37 0.04 -1.16 -3.40 116.94 113.94 3k62 h PHE 476 Ca 0.04 -0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3k62 h PHE 476 Cb 0.56 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.69 3k62 h PHE 476 CO 0.06 0.71 0.00 -3.47 -0.60 0.00 0.00 178.31 175.01 3k62 n ASP 477 N -3.78 0.00 0.03 2.17 2.03 0.29 -4.89 116.55 112.41 3k62 n ASP 477 Ca -0.02 -1.00 0.13 0.00 0.52 0.00 0.00 54.79 54.43 3k62 n ASP 477 Cb 0.65 0.00 0.46 0.00 -0.72 0.00 0.00 41.12 41.51 3k62 n ASP 477 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3k62 n GLY 478 N 0.00 -1.51 3.13 0.27 0.00 0.47 -4.88 105.19 102.68 3k62 n GLY 478 Ca 0.00 -0.13 -0.20 0.00 0.00 0.00 0.00 46.02 45.68 3k62 n GLY 478 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k62 s TYR 479 N -3.04 1.21 -0.07 1.61 2.02 -1.26 -5.04 117.35 112.78 3k62 s TYR 479 Ca 0.12 -0.33 -0.29 0.00 -0.37 0.00 0.00 57.07 56.19 3k62 s TYR 479 Cb 0.17 -0.73 -0.02 0.00 -0.40 0.00 0.00 41.96 40.98 3k62 s TYR 479 CO 0.59 0.03 0.98 0.42 -1.57 0.00 0.00 175.55 176.00 3k62 s ILE 480 N -0.77 4.82 0.82 2.71 1.09 -1.26 -4.82 121.20 123.79 3k62 s ILE 480 Ca 0.02 2.01 -0.12 0.00 -1.10 0.00 0.00 60.65 61.46 3k62 s ILE 480 Cb -0.07 -4.30 0.09 0.00 -1.06 0.00 0.00 42.46 37.12 3k62 s ILE 480 CO 0.01 0.06 1.17 -2.16 -0.10 0.00 0.00 174.94 173.92 3k62 s PRO 481 N 1.65 1.61 0.16 2.79 0.04 -1.26 -4.91 135.00 135.08 3k62 s PRO 481 Ca 0.49 1.60 -0.34 0.00 0.04 0.00 0.00 61.00 62.79 3k62 s PRO 481 Cb -0.19 -1.79 -0.15 0.00 0.04 0.00 0.00 34.50 32.41 3k62 s PRO 481 CO 0.21 -2.20 1.44 1.58 0.04 0.00 0.00 177.00 178.07 3k62 n HIS 482 N -3.54 1.96 0.29 0.56 -0.00 0.09 -4.84 115.22 109.73 3k62 n HIS 482 Ca 0.12 0.44 0.16 0.00 -0.00 0.00 0.00 57.72 58.43 3k62 n HIS 482 Cb 0.51 -2.45 0.85 0.00 -0.00 0.00 0.00 29.99 28.91 3k62 n HIS 482 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3k62 h PRO 483 N 4.98 0.00 0.00 1.57 0.13 -1.92 -0.25 132.00 136.51 3k62 h PRO 483 Ca -0.45 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.27 3k62 h PRO 483 Cb 1.29 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.36 3k62 h PRO 483 CO 0.81 0.06 -2.26 -0.25 -0.23 0.00 0.00 178.00 176.14 3k62 n ASP 484 N -3.51 1.94 0.08 1.44 8.00 -1.26 -4.71 116.55 118.53 3k62 n ASP 484 Ca -0.02 0.35 0.11 0.00 0.71 0.00 0.00 54.79 55.95 3k62 n ASP 484 Cb 0.19 -0.84 -0.02 0.00 -0.02 0.00 0.00 41.12 40.43 3k62 n ASP 484 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3k62 n THR 485 N -4.29 0.51 -0.97 -3.53 -2.24 -1.22 -4.96 114.28 97.58 3k62 n THR 485 Ca -0.49 -0.52 0.00 0.00 -2.27 0.00 0.00 64.05 60.77 3k62 n THR 485 Cb 0.83 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 3k62 n THR 485 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k62 n GLY 486 N 1.20 0.41 3.74 3.38 0.00 -0.11 -4.97 105.19 108.84 3k62 n GLY 486 Ca -0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3k62 n GLY 486 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k62 s LYS 487 N -0.57 4.16 0.39 1.61 1.02 -1.26 -4.59 119.74 120.49 3k62 s LYS 487 Ca 0.00 2.52 0.03 0.00 0.02 0.00 0.00 55.97 58.54 3k62 s LYS 487 Cb 0.00 -3.07 0.03 0.00 -0.52 0.00 0.00 37.83 34.28 3k62 s LYS 487 CO 0.00 -0.63 0.28 -0.40 -0.92 0.00 0.00 175.35 173.68 3k62 n ASP 488 N 2.93 2.30 -0.32 2.83 5.68 -1.26 -0.74 116.55 127.97 3k62 n ASP 488 Ca 0.11 -2.37 -0.03 0.00 -0.50 0.00 0.00 54.79 52.00 3k62 n ASP 488 Cb 0.37 -0.01 0.09 0.00 -1.14 0.00 0.00 41.12 40.43 3k62 n ASP 488 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k62 h ALA 489 N 0.72 1.11 -0.66 2.12 0.00 -1.88 -1.05 119.26 119.63 3k62 h ALA 489 Ca -0.25 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 3k62 h ALA 489 Cb 0.91 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 3k62 h ALA 489 CO 0.40 0.49 0.33 1.25 0.00 0.00 0.00 179.25 181.72 3k62 h LEU 490 N 1.16 0.85 -0.36 0.00 5.85 -1.95 0.17 115.31 121.04 3k62 h LEU 490 Ca 0.33 -0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.95 3k62 h LEU 490 Cb -0.11 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.67 3k62 h LEU 490 CO -0.08 0.73 0.16 0.44 -0.34 0.00 0.00 178.44 179.36 3k62 h ASP 491 N 0.91 0.23 -0.25 1.25 3.32 -1.79 -0.37 116.42 119.71 3k62 h ASP 491 Ca 0.23 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 3k62 h ASP 491 Cb 0.09 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3k62 h ASP 491 CO -0.03 0.17 0.10 0.40 -1.72 0.00 0.00 179.24 178.16 3k62 h ILE 492 N 0.34 1.17 -0.43 0.35 2.04 -0.81 -3.15 117.51 117.02 3k62 h ILE 492 Ca 0.15 -0.51 -0.14 0.00 1.00 0.00 0.00 64.86 65.36 3k62 h ILE 492 Cb 0.08 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 3k62 h ILE 492 CO -0.12 0.17 -0.29 0.24 0.00 0.00 0.00 178.15 178.15 3k62 h MET 493 N 0.26 0.95 -0.50 2.37 2.86 -0.66 -2.03 114.93 118.18 3k62 h MET 493 Ca 0.09 -0.45 0.05 0.00 -2.06 0.00 0.00 59.70 57.33 3k62 h MET 493 Cb 0.17 -0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.79 3k62 h MET 493 CO -0.01 1.11 0.33 0.52 1.06 0.00 0.00 176.91 179.93 3k62 h MET 494 N 0.78 0.44 -0.31 1.72 2.86 -1.07 0.77 114.93 120.12 3k62 h MET 494 Ca 0.09 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 3k62 h MET 494 Cb 0.87 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.43 3k62 h MET 494 CO 0.08 0.29 0.00 1.19 1.06 0.00 0.00 176.91 179.53 3k62 n PHE 495 N -4.47 0.41 -2.96 -0.22 3.72 -1.14 -4.53 117.46 108.26 3k62 n PHE 495 Ca 0.06 -0.31 -0.35 0.00 -0.05 0.00 0.00 57.45 56.81 3k62 n PHE 495 Cb 0.23 -0.01 -0.06 0.00 -0.94 0.00 0.00 39.48 38.69 3k62 n PHE 495 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 3k62 s HIS 496 N -1.12 3.54 0.54 1.38 2.46 -0.78 -4.93 115.29 116.38 3k62 s HIS 496 Ca 0.27 1.51 0.21 0.00 0.47 0.00 0.00 55.06 57.52 3k62 s HIS 496 Cb 0.16 -2.73 1.44 0.00 -0.13 0.00 0.00 32.58 31.31 3k62 s HIS 496 CO 0.21 0.16 2.15 -0.56 -2.47 0.00 0.00 174.74 174.23 3k62 h GLN 497 N 2.80 0.00 0.00 2.88 3.07 -1.91 -1.93 115.11 120.02 3k62 h GLN 497 Ca -0.48 0.00 -0.16 0.00 0.09 0.00 0.00 58.65 58.10 3k62 h GLN 497 Cb 1.19 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 28.72 3k62 h GLN 497 CO 0.64 0.00 -1.61 1.19 0.09 0.00 0.00 178.83 179.14 3k62 n PHE 498 N -4.31 0.00 0.23 0.06 3.72 -1.26 -4.67 117.46 111.23 3k62 n PHE 498 Ca -0.01 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 3k62 n PHE 498 Cb 0.17 -0.42 0.69 0.00 -0.94 0.00 0.00 39.48 38.99 3k62 n PHE 498 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 3k62 h GLY 499 N 1.01 0.00 1.63 1.37 0.00 -1.37 -2.50 103.07 103.20 3k62 h GLY 499 Ca -0.24 0.00 0.03 0.00 0.00 0.00 0.00 47.33 47.12 3k62 h GLY 499 CO -0.03 0.00 0.20 3.45 0.00 0.00 0.00 176.54 180.16 3k62 h ASN 500 N 0.00 0.25 0.39 0.19 7.08 -0.04 -1.07 115.58 122.39 3k62 h ASN 500 Ca 0.04 -0.00 -0.12 0.00 -3.08 0.00 0.00 56.30 53.13 3k62 h ASN 500 Cb 0.16 -0.06 -0.01 0.00 -2.08 0.00 0.00 38.32 36.33 3k62 h ASN 500 CO -0.00 0.18 -0.53 1.88 -2.08 0.00 0.00 177.43 176.88 3k62 h TYR 501 N 0.29 0.19 -0.26 4.14 0.05 -1.72 -1.76 116.97 117.90 3k62 h TYR 501 Ca 0.12 -0.06 -0.07 0.00 0.05 0.00 0.00 58.73 58.76 3k62 h TYR 501 Cb 0.11 -0.04 -0.01 0.00 1.01 0.00 0.00 36.73 37.81 3k62 h TYR 501 CO -0.00 0.65 -0.12 0.28 -1.05 0.00 0.00 178.16 177.92 3k62 h VAL 502 N 0.12 1.30 -0.67 -2.88 2.07 -1.30 -1.72 116.25 113.17 3k62 h VAL 502 Ca 0.00 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.27 3k62 h VAL 502 Cb 0.98 1.53 -0.03 0.00 -1.52 0.00 0.00 31.29 32.25 3k62 h VAL 502 CO 0.08 0.38 0.22 0.58 0.02 0.00 0.00 177.57 178.85 3k62 h VAL 503 N 0.27 1.24 -0.88 2.57 2.07 -1.35 -1.03 116.25 119.14 3k62 h VAL 503 Ca 0.06 -0.82 0.02 0.00 0.82 0.00 0.00 66.70 66.78 3k62 h VAL 503 Cb 0.63 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.85 3k62 h VAL 503 CO 0.04 0.32 0.58 1.56 0.02 0.00 0.00 177.57 180.09 3k62 h GLN 504 N 0.98 1.14 -0.35 1.57 4.20 -1.22 -1.41 115.11 120.02 3k62 h GLN 504 Ca 0.22 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 3k62 h GLN 504 Cb 0.26 -0.26 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 3k62 h GLN 504 CO -0.01 0.75 0.17 0.00 -0.67 0.00 0.00 178.83 179.07 3k62 h MET 506 N 0.43 0.34 -0.45 0.00 2.86 -0.78 -1.39 114.93 115.94 3k62 h MET 506 Ca 0.12 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.69 3k62 h MET 506 Cb 0.11 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.68 3k62 h MET 506 CO -0.02 0.22 0.08 1.25 1.06 0.00 0.00 176.91 179.51 3k62 h LEU 507 N 0.35 0.70 -0.79 1.22 5.85 -1.02 -2.16 115.31 119.46 3k62 h LEU 507 Ca 0.22 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 3k62 h LEU 507 Cb 0.22 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 3k62 h LEU 507 CO -0.22 0.77 0.26 0.74 -0.34 0.00 0.00 178.44 179.64 3k62 h THR 508 N 0.60 1.26 -0.14 1.05 2.02 -0.91 -0.04 112.91 116.75 3k62 h THR 508 Ca 0.14 -0.88 0.02 0.00 0.77 0.00 0.00 66.41 66.45 3k62 h THR 508 Cb 0.36 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 3k62 h THR 508 CO 0.01 0.35 0.04 0.40 0.37 0.00 0.00 175.52 176.68 3k62 h ILE 509 N 1.12 0.95 -0.66 3.11 2.04 -1.12 0.86 117.51 123.82 3k62 h ILE 509 Ca 0.25 -0.03 -0.05 0.00 1.00 0.00 0.00 64.86 66.02 3k62 h ILE 509 Cb 0.28 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 3k62 h ILE 509 CO -0.01 0.02 0.20 0.00 0.00 0.00 0.00 178.15 178.36 3k62 h ASP 512 N 0.88 0.86 -0.26 0.00 3.32 -0.51 -1.68 116.42 119.03 3k62 h ASP 512 Ca 0.15 -0.18 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 3k62 h ASP 512 Cb 0.58 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3k62 h ASP 512 CO 0.03 0.81 0.08 0.00 -1.72 0.00 0.00 179.24 178.44 3k62 h ALA 513 N 1.09 0.33 0.00 3.45 0.00 -0.89 0.83 119.26 124.07 3k62 h ALA 513 Ca 0.20 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3k62 h ALA 513 Cb 0.22 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 3k62 h ALA 513 CO -0.01 -0.04 -0.18 -0.39 0.00 0.00 0.00 179.25 178.62 3k62 h VAL 514 N 0.25 0.40 -0.01 0.00 -1.51 -1.21 -2.75 116.25 111.42 3k62 h VAL 514 Ca 0.08 -1.15 0.00 0.00 -1.23 0.00 0.00 66.70 64.41 3k62 h VAL 514 Cb 0.23 1.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.25 3k62 h VAL 514 CO -0.00 0.18 -0.20 -1.54 -1.23 0.00 0.00 177.57 174.78 3k62 n SER 515 N -3.26 1.37 0.00 4.19 3.41 -0.64 -4.95 113.62 113.74 3k62 n SER 515 Ca 0.01 -1.18 0.00 0.00 -0.26 0.00 0.00 58.87 57.44 3k62 n SER 515 Cb 0.47 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 3k62 n SER 515 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k62 n GLY 516 N 1.31 0.56 0.09 5.00 0.00 -0.86 -4.91 105.19 106.38 3k62 n GLY 516 Ca 0.14 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 46.09 3k62 n GLY 516 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k62 n ARG 517 N -2.84 0.24 -4.53 1.61 1.74 0.23 -4.77 116.66 108.34 3k62 n ARG 517 Ca 0.00 0.18 -0.24 0.00 -0.77 0.00 0.00 57.85 57.03 3k62 n ARG 517 Cb 0.00 -1.77 -0.16 0.00 -1.02 0.00 0.00 32.46 29.51 3k62 n ARG 517 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3k62 s ARG 518 N -3.10 1.51 0.12 5.56 3.52 -0.88 -4.95 118.95 120.74 3k62 s ARG 518 Ca 0.10 -0.38 -0.31 0.00 -0.13 0.00 0.00 55.73 55.01 3k62 s ARG 518 Cb 0.13 -1.28 -0.09 0.00 -1.56 0.00 0.00 34.95 32.15 3k62 s ARG 518 CO 0.61 0.05 1.48 -1.14 -0.81 0.00 0.00 175.30 175.48 3k62 s GLN 519 N 0.57 4.27 -0.00 5.12 2.00 -1.26 -4.48 119.66 125.87 3k62 s GLN 519 Ca -0.12 2.20 0.19 0.00 -2.00 0.00 0.00 55.36 55.63 3k62 s GLN 519 Cb -0.14 -3.27 -0.21 0.00 0.80 0.00 0.00 33.01 30.18 3k62 s GLN 519 CO 0.03 -0.54 0.77 0.25 -0.50 0.00 0.00 175.29 175.30 3k62 n THR 520 N 4.08 0.00 -2.94 -0.34 -2.24 -1.26 -4.93 114.28 106.64 3k62 n THR 520 Ca 0.13 -0.09 -0.40 0.00 -2.27 0.00 0.00 64.05 61.42 3k62 n THR 520 Cb 0.41 0.91 -0.05 0.00 -2.10 0.00 0.00 70.33 69.50 3k62 n THR 520 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3k62 s LYS 521 N -2.84 4.54 -0.29 -0.78 1.02 -1.26 -0.64 119.74 119.50 3k62 s LYS 521 Ca 0.06 1.14 -0.28 0.00 0.02 0.00 0.00 55.97 56.91 3k62 s LYS 521 Cb 0.14 -3.35 0.19 0.00 -0.52 0.00 0.00 37.83 34.29 3k62 s LYS 521 CO 0.78 0.32 1.37 -2.00 -0.92 0.00 0.00 175.35 174.90 3k62 s GLU 522 N -0.24 0.09 -1.50 1.68 2.12 -0.03 -4.97 118.70 115.84 3k62 s GLU 522 Ca 0.39 0.05 0.00 0.00 0.36 0.00 0.00 54.97 55.77 3k62 s GLU 522 Cb -0.21 0.04 0.00 0.00 0.26 0.00 0.00 34.13 34.22 3k62 s GLU 522 CO 0.25 -0.02 0.00 0.41 -0.54 0.00 0.00 175.26 175.35 3k62 n GLY 523 N 0.96 -0.10 2.05 -1.50 0.00 -1.26 -2.53 105.19 102.80 3k62 n GLY 523 Ca -0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 46.02 45.79 3k62 n GLY 523 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k62 n GLY 524 N -1.00 0.48 3.26 -0.02 0.00 -1.26 -5.02 105.19 101.63 3k62 n GLY 524 Ca -0.20 -0.81 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 3k62 n GLY 524 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3k62 s TYR 525 N -2.03 -0.22 -0.41 1.61 5.04 -1.05 -5.12 117.35 115.17 3k62 s TYR 525 Ca 0.00 0.33 -0.20 0.00 -2.44 0.00 0.00 57.07 54.76 3k62 s TYR 525 Cb 0.00 0.12 0.02 0.00 0.35 0.00 0.00 41.96 42.45 3k62 s TYR 525 CO 0.00 -0.41 0.62 0.34 -1.34 0.00 0.00 175.55 174.77 3k62 s ASP 526 N -1.31 6.34 -0.09 4.32 3.68 -1.26 -0.85 116.67 127.49 3k62 s ASP 526 Ca -0.13 -0.24 0.07 0.00 2.13 0.00 0.00 52.55 54.38 3k62 s ASP 526 Cb -0.05 -2.31 0.35 0.00 -1.45 0.00 0.00 42.92 39.46 3k62 s ASP 526 CO 0.05 -0.71 1.09 1.41 0.13 0.00 0.00 175.17 177.14 3k62 n HIS 527 N 6.15 0.84 -0.35 -5.34 8.25 0.19 -4.43 115.22 120.54 3k62 n HIS 527 Ca -0.02 -0.30 0.14 0.00 -0.26 0.00 0.00 57.72 57.27 3k62 n HIS 527 Cb 0.48 -0.23 0.33 0.00 1.12 0.00 0.00 29.99 31.69 3k62 n HIS 527 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3k62 h ALA 528 N 3.03 1.69 -0.72 -1.41 0.00 -1.93 0.12 119.26 120.05 3k62 h ALA 528 Ca 0.00 0.09 0.08 0.00 0.00 0.00 0.00 54.91 55.08 3k62 h ALA 528 Cb 1.03 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.72 3k62 h ALA 528 CO 0.18 -0.10 0.47 0.97 0.00 0.00 0.00 179.25 180.77 3k62 h ILE 529 N 0.71 0.97 -0.23 0.00 2.10 -1.97 -0.78 117.51 118.32 3k62 h ILE 529 Ca 0.59 -0.23 -0.06 0.00 1.08 0.00 0.00 64.86 66.24 3k62 h ILE 529 Cb 0.97 0.24 -0.01 0.00 -1.09 0.00 0.00 36.82 36.94 3k62 h ILE 529 CO -0.41 0.12 -0.11 0.28 -1.08 0.00 0.00 178.15 176.95 3k62 h SER 530 N 0.67 0.49 -0.66 2.19 0.02 -1.10 -2.16 113.55 113.00 3k62 h SER 530 Ca 0.32 -0.41 -0.04 0.00 -0.84 0.00 0.00 61.79 60.82 3k62 h SER 530 Cb 0.37 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 3k62 h SER 530 CO -0.11 0.79 0.27 -0.26 -1.14 0.00 0.00 176.83 176.38 3k62 h PHE 531 N 0.19 1.01 -0.61 3.45 0.04 -1.23 -1.31 116.94 118.49 3k62 h PHE 531 Ca 0.05 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.71 3k62 h PHE 531 Cb 0.61 -0.31 -0.03 0.00 2.20 0.00 0.00 35.95 38.42 3k62 h PHE 531 CO 0.06 0.78 0.21 1.96 -0.60 0.00 0.00 178.31 180.71 3k62 h GLN 532 N 0.98 0.91 0.06 1.51 4.20 -1.11 -0.17 115.11 121.50 3k62 h GLN 532 Ca 0.23 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 3k62 h GLN 532 Cb 0.19 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.82 3k62 h GLN 532 CO -0.02 0.77 -0.03 0.22 -0.67 0.00 0.00 178.83 179.10 3k62 h ASP 533 N 0.88 -0.07 -0.70 1.46 -0.00 -0.83 -1.22 116.42 115.95 3k62 h ASP 533 Ca 0.20 -0.26 -0.03 0.00 -0.00 0.00 0.00 57.03 56.94 3k62 h ASP 533 Cb 0.23 0.02 -0.03 0.00 -0.00 0.00 0.00 39.33 39.54 3k62 h ASP 533 CO -0.01 0.22 0.32 -0.50 -0.00 0.00 0.00 179.24 179.27 3k62 h TRP 534 N -0.37 1.05 -0.42 0.28 6.55 -1.14 -2.19 115.95 119.72 3k62 h TRP 534 Ca -0.01 -0.06 -0.01 0.00 0.95 0.00 0.00 58.89 59.77 3k62 h TRP 534 Cb 0.32 -0.32 -0.02 0.00 -0.86 0.00 0.00 29.16 28.28 3k62 h TRP 534 CO 0.02 0.78 0.23 1.25 -1.05 0.00 0.00 178.44 179.67 3k62 h LEU 535 N 1.03 0.53 -1.35 -4.49 5.85 -0.92 -1.63 115.31 114.33 3k62 h LEU 535 Ca 0.25 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3k62 h LEU 535 Cb 0.15 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 3k62 h LEU 535 CO -0.03 0.48 0.40 0.11 -0.34 0.00 0.00 178.44 179.06 3k62 h LYS 536 N 0.55 0.84 -0.25 1.25 1.57 -0.83 0.32 116.57 120.01 3k62 h LYS 536 Ca 0.15 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.81 3k62 h LYS 536 Cb 0.07 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 3k62 h LYS 536 CO -0.02 0.57 -0.06 0.87 -0.57 0.00 0.00 179.45 180.23 3k62 h LYS 537 N 0.86 0.49 -0.71 3.15 1.57 -1.04 -0.80 116.57 120.10 3k62 h LYS 537 Ca 0.23 -0.19 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 3k62 h LYS 537 Cb -0.07 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 3k62 h LYS 537 CO -0.05 0.71 0.24 -0.07 -0.57 0.00 0.00 179.45 179.71 3k62 h LEU 538 N 0.24 1.02 -0.62 2.94 3.38 -0.80 -1.85 115.31 119.61 3k62 h LEU 538 Ca 0.06 -0.20 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 3k62 h LEU 538 Cb 0.53 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3k62 h LEU 538 CO 0.03 0.95 0.08 -0.74 0.09 0.00 0.00 178.44 178.85 3k62 h HIS 539 N 1.04 1.11 -0.61 1.13 2.76 -0.26 -0.29 115.15 120.03 3k62 h HIS 539 Ca 0.23 -0.16 -0.06 0.00 -2.20 0.00 0.00 60.37 58.18 3k62 h HIS 539 Cb 0.28 -0.30 -0.02 0.00 1.55 0.00 0.00 27.41 28.91 3k62 h HIS 539 CO 0.02 0.95 0.14 1.03 -1.30 0.00 0.00 177.93 178.78 3k62 h SER 540 N 0.94 0.92 -0.24 3.26 0.87 -0.99 -0.35 113.55 117.97 3k62 h SER 540 Ca 0.19 -0.23 -0.02 0.00 -1.23 0.00 0.00 61.79 60.49 3k62 h SER 540 Cb 0.45 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 3k62 h SER 540 CO 0.02 0.92 0.06 -0.09 -0.53 0.00 0.00 176.83 177.20 3k62 h ARG 541 N 0.88 0.39 -0.53 2.24 9.65 -1.07 -1.67 114.38 124.27 3k62 h ARG 541 Ca 0.19 -0.09 -0.07 0.00 -1.10 0.00 0.00 59.98 58.90 3k62 h ARG 541 Cb 0.36 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.86 3k62 h ARG 541 CO 0.00 0.49 0.04 0.28 2.80 0.00 0.00 179.97 183.59 3k62 h VAL 542 N 0.21 1.25 0.12 0.20 2.07 -0.89 -0.43 116.25 118.78 3k62 h VAL 542 Ca 0.08 -1.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 3k62 h VAL 542 Cb 0.28 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 3k62 h VAL 542 CO 0.00 0.36 -0.06 0.74 0.02 0.00 0.00 177.57 178.63 3k62 h THR 543 N 0.82 0.91 -0.82 2.57 2.02 -1.00 -1.07 112.91 116.34 3k62 h THR 543 Ca 0.16 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 3k62 h THR 543 Cb 0.44 0.98 -0.04 0.00 -1.74 0.00 0.00 68.15 67.79 3k62 h THR 543 CO 0.02 0.03 0.47 0.11 0.37 0.00 0.00 175.52 176.51 3k62 h LYS 544 N -0.21 1.13 -0.55 6.66 1.57 -0.92 -2.98 116.57 121.27 3k62 h LYS 544 Ca -0.02 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.58 3k62 h LYS 544 Cb 0.17 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 3k62 h LYS 544 CO 0.03 0.81 0.08 0.39 -0.57 0.00 0.00 179.45 180.18 3k62 n GLU 545 N -4.35 4.04 -0.36 3.15 -0.58 -0.20 -4.69 120.64 117.65 3k62 n GLU 545 Ca 0.09 -3.08 0.07 0.00 -0.42 0.00 0.00 57.16 53.81 3k62 n GLU 545 Cb 0.09 -2.15 0.24 0.00 -0.57 0.00 0.00 31.44 29.04 3k62 n GLU 545 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 3k62 h ARG 546 N 3.04 0.98 0.07 3.49 2.43 -1.03 -0.78 114.38 122.57 3k62 h ARG 546 Ca 0.08 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.19 3k62 h ARG 546 Cb 1.96 -0.22 0.00 0.00 -0.42 0.00 0.00 29.97 31.29 3k62 h ARG 546 CO 0.50 0.65 -0.03 0.45 -1.51 0.00 0.00 179.97 180.03 3k62 h HIS 547 N 1.01 -0.09 -0.65 2.20 3.86 -1.86 -0.83 115.15 118.79 3k62 h HIS 547 Ca 0.48 -0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.66 3k62 h HIS 547 Cb 0.44 0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.91 3k62 h HIS 547 CO -0.00 0.16 0.28 0.00 0.86 0.00 0.00 177.93 179.22 3k62 h ARG 548 N -0.33 0.96 -0.27 2.45 3.08 -1.87 -3.01 114.38 115.39 3k62 h ARG 548 Ca -0.01 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.83 3k62 h ARG 548 Cb 0.29 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 3k62 h ARG 548 CO 0.02 0.79 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.62 3k62 h LEU 549 N 0.91 0.37 -0.07 3.04 3.38 -1.02 -2.23 115.31 119.69 3k62 h LEU 549 Ca 0.22 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3k62 h LEU 549 Cb 0.18 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3k62 h LEU 549 CO -0.02 0.45 0.00 -1.54 0.09 0.00 0.00 178.44 177.42 3k62 n SER 550 N -4.31 0.07 0.22 -0.43 3.41 -0.33 -1.62 113.62 110.64 3k62 n SER 550 Ca 0.01 0.52 0.15 0.00 -0.26 0.00 0.00 58.87 59.28 3k62 n SER 550 Cb 0.23 -0.53 0.56 0.00 -0.26 0.00 0.00 64.21 64.20 3k62 n SER 550 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3k62 h ARG 551 N 0.00 0.00 -6.74 4.33 3.08 -1.46 -3.44 114.38 110.15 3k62 h ARG 551 Ca 0.00 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 59.36 3k62 h ARG 551 Cb 0.26 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 30.05 3k62 h ARG 551 CO 0.00 0.00 -0.88 -0.06 -1.07 0.00 0.00 179.97 177.96 3k62 s PHE 552 N -3.48 2.30 0.25 3.04 0.08 -0.64 -5.03 117.98 114.50 3k62 s PHE 552 Ca 0.03 -0.41 -0.04 0.00 0.12 0.00 0.00 56.93 56.64 3k62 s PHE 552 Cb 0.09 -1.36 0.46 0.00 -0.57 0.00 0.00 43.02 41.63 3k62 s PHE 552 CO 0.52 0.15 1.75 0.77 -0.10 0.00 0.00 175.22 178.32 3k62 h SER 553 N 4.68 0.41 -0.81 1.36 0.02 -1.88 -0.60 113.55 116.72 3k62 h SER 553 Ca -0.47 0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 60.55 3k62 h SER 553 Cb 1.15 0.04 -0.04 0.00 0.14 0.00 0.00 62.40 63.68 3k62 h SER 553 CO 0.43 0.18 0.41 0.77 -1.14 0.00 0.00 176.83 177.49 3k62 h SER 554 N 0.54 1.04 -0.31 3.07 4.64 -1.96 -0.81 113.55 119.77 3k62 h SER 554 Ca 0.42 -0.12 -0.09 0.00 -0.47 0.00 0.00 61.79 61.53 3k62 h SER 554 Cb 0.58 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.40 3k62 h SER 554 CO -0.36 0.86 -0.17 1.23 -0.87 0.00 0.00 176.83 177.52 3k62 h GLY 555 N 1.14 0.72 1.10 -0.77 0.00 -1.44 -2.17 103.07 101.65 3k62 h GLY 555 Ca 0.28 -0.66 0.03 0.00 0.00 0.00 0.00 47.33 46.99 3k62 h GLY 555 CO -0.04 0.60 0.52 0.50 0.00 0.00 0.00 176.54 178.12 3k62 h LYS 556 N 0.42 0.95 -0.68 4.80 1.57 -0.97 -1.61 116.57 121.04 3k62 h LYS 556 Ca 0.07 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 3k62 h LYS 556 Cb 0.70 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.77 3k62 h LYS 556 CO 0.05 0.63 0.25 -0.22 -0.57 0.00 0.00 179.45 179.59 3k62 h LYS 557 N 0.98 1.03 -0.36 3.15 3.64 -0.87 -0.65 116.57 123.50 3k62 h LYS 557 Ca 0.32 -0.20 -0.15 0.00 -1.27 0.00 0.00 60.65 59.34 3k62 h LYS 557 Cb 0.04 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3k62 h LYS 557 CO -0.09 0.87 -0.38 0.52 -2.27 0.00 0.00 179.45 178.10 3k62 h MET 558 N 0.98 0.87 -0.62 1.90 2.86 -1.01 0.21 114.93 120.12 3k62 h MET 558 Ca 0.22 -0.45 -0.02 0.00 -2.06 0.00 0.00 59.70 57.40 3k62 h MET 558 Cb 0.24 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.89 3k62 h MET 558 CO -0.01 1.09 0.32 0.82 1.06 0.00 0.00 176.91 180.20 3k62 h ILE 559 N 0.71 1.20 -0.57 -1.22 2.04 -1.14 -1.22 117.51 117.31 3k62 h ILE 559 Ca 0.06 -0.54 -0.10 0.00 1.00 0.00 0.00 64.86 65.28 3k62 h ILE 559 Cb 0.96 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.45 3k62 h ILE 559 CO 0.09 0.23 -0.03 -0.08 0.00 0.00 0.00 178.15 178.36 3k62 h GLU 560 N 0.84 1.03 -0.42 2.37 4.81 -0.95 -0.87 114.58 121.38 3k62 h GLU 560 Ca 0.22 -0.34 0.03 0.00 -0.13 0.00 0.00 59.36 59.13 3k62 h GLU 560 Cb 0.07 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.33 3k62 h GLU 560 CO -0.03 1.03 0.22 1.15 -0.73 0.00 0.00 179.01 180.65 3k62 h THR 561 N 0.92 0.98 -0.34 0.32 2.02 -0.64 0.53 112.91 116.69 3k62 h THR 561 Ca 0.16 -0.15 -0.12 0.00 0.77 0.00 0.00 66.41 67.06 3k62 h THR 561 Cb 0.59 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 3k62 h THR 561 CO 0.04 0.08 -0.30 -0.07 0.37 0.00 0.00 175.52 175.64 3k62 h LEU 562 N 0.44 0.74 -0.50 2.58 3.38 -1.07 -2.63 115.31 118.24 3k62 h LEU 562 Ca 0.18 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3k62 h LEU 562 Cb 0.08 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3k62 h LEU 562 CO -0.12 0.99 0.26 0.00 0.09 0.00 0.00 178.44 179.66 3k62 h ALA 563 N 1.06 0.64 0.00 1.53 0.00 -0.78 -2.73 119.26 118.98 3k62 h ALA 563 Ca 0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3k62 h ALA 563 Cb 0.81 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3k62 h ALA 563 CO 0.07 0.18 -0.17 -0.91 0.00 0.00 0.00 179.25 178.42 3k62 h ASN 564 N 0.66 0.00 -0.16 0.00 -0.26 -0.77 -2.82 115.58 112.24 3k62 h ASN 564 Ca 0.17 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.87 3k62 h ASN 564 Cb 0.08 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.34 3k62 h ASN 564 CO -0.03 0.17 -0.08 0.25 -1.06 0.00 0.00 177.43 176.69 3k62 h LEU 565 N 0.00 0.34 -1.29 1.61 5.85 -1.18 -2.89 115.31 117.75 3k62 h LEU 565 Ca -0.00 -0.42 0.17 0.00 0.84 0.00 0.00 57.88 58.47 3k62 h LEU 565 Cb 0.31 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.17 3k62 h LEU 565 CO 0.02 0.68 0.59 0.03 -0.34 0.00 0.00 178.44 179.42 3k62 h ARG 566 N -0.00 0.62 0.00 1.25 3.08 -1.27 -3.52 114.38 114.54 3k62 h ARG 566 Ca 0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3k62 h ARG 566 Cb 0.55 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3k62 h ARG 566 CO 0.02 0.41 0.00 0.45 -1.07 0.00 0.00 179.97 179.78