#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xah s SER 172 N 0.00 0.22 0.00 2.55 1.04 -1.26 -4.55 113.70 111.70 2xah s SER 172 Ca 0.00 -1.27 0.00 0.00 0.48 0.00 0.00 55.95 55.16 2xah s SER 172 Cb 0.00 0.83 0.00 0.00 0.10 0.00 0.00 66.02 66.95 2xah s SER 172 CO 0.00 -1.66 0.00 0.61 0.98 0.00 0.00 173.24 173.17 2xah n GLY 173 N -0.55 0.98 0.13 7.32 0.00 -1.26 -4.18 105.19 107.63 2xah n GLY 173 Ca -0.07 -1.63 0.12 0.00 0.00 0.00 0.00 46.02 44.44 2xah n GLY 173 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2xah h VAL 174 N 0.00 0.00 0.00 1.61 -1.51 -1.99 -3.31 116.25 111.04 2xah h VAL 174 Ca 0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 2xah h VAL 174 Cb 0.00 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 2xah h VAL 174 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 177.57 176.01 2xah h GLU 175 N 0.00 0.00 0.07 5.19 5.08 -1.93 -3.04 114.58 119.95 2xah h GLU 175 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2xah h GLU 175 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.21 2xah h GLU 175 CO 0.00 0.00 -0.04 0.78 -1.00 0.00 0.00 179.01 178.75 2xah h GLY 176 N 3.08 -0.10 -0.46 -3.84 0.00 -1.73 -2.76 103.07 97.26 2xah h GLY 176 Ca 0.00 0.04 0.25 0.00 0.00 0.00 0.00 47.33 47.62 2xah h GLY 176 CO 0.00 -0.04 0.31 0.00 0.00 0.00 0.00 176.54 176.82 2xah h ALA 177 N 0.11 1.43 -0.51 3.60 0.00 -1.69 1.46 119.26 123.66 2xah h ALA 177 Ca -0.01 0.22 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2xah h ALA 177 Cb 0.57 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 2xah h ALA 177 CO 0.02 -0.48 0.24 0.00 0.00 0.00 0.00 179.25 179.02 2xah h ALA 178 N 1.80 0.66 0.00 0.00 0.00 -1.49 -1.81 119.26 118.42 2xah h ALA 178 Ca 0.59 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 55.38 2xah h ALA 178 Cb 1.24 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2xah h ALA 178 CO -0.64 0.23 -0.00 0.35 0.00 0.00 0.00 179.25 179.19 2xah h PHE 179 N 0.68 -0.00 0.00 0.00 3.57 -0.85 0.61 116.94 120.95 2xah h PHE 179 Ca 0.18 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.68 2xah h PHE 179 Cb 0.13 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.87 2xah h PHE 179 CO -0.00 0.52 0.00 0.94 -2.23 0.00 0.00 178.31 177.54 2xah n GLN 180 N -4.84 0.11 -0.15 1.11 -0.06 0.48 0.01 117.38 114.05 2xah n GLN 180 Ca -0.09 0.16 0.07 0.00 -2.00 0.00 0.00 57.00 55.15 2xah n GLN 180 Cb 0.27 -1.50 0.14 0.00 -4.06 0.00 0.00 30.24 25.09 2xah n GLN 180 CO 0.00 0.00 0.00 0.43 -0.20 0.00 0.00 177.06 177.29 2xah n SER 181 N -1.20 2.67 -1.64 1.69 7.64 -0.69 -4.39 113.62 117.70 2xah n SER 181 Ca 0.03 -2.79 -0.16 0.00 1.01 0.00 0.00 58.87 56.96 2xah n SER 181 Cb 0.04 -0.36 -0.03 0.00 -1.01 0.00 0.00 64.21 62.85 2xah n SER 181 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2xah n ARG 182 N -0.91 -1.25 -5.07 1.43 1.74 0.10 -5.00 116.66 107.70 2xah n ARG 182 Ca 0.14 0.91 -0.29 0.00 -0.77 0.00 0.00 57.85 57.84 2xah n ARG 182 Cb 0.61 -5.24 -0.15 0.00 -1.02 0.00 0.00 32.46 26.65 2xah n ARG 182 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2xah s LEU 183 N -4.36 2.09 -0.05 0.55 1.43 0.21 -5.00 118.68 113.55 2xah s LEU 183 Ca 0.00 -0.48 -0.30 0.00 -1.03 0.00 0.00 54.13 52.32 2xah s LEU 183 Cb 0.00 -1.22 -0.06 0.00 0.03 0.00 0.00 46.19 44.93 2xah s LEU 183 CO 0.00 0.27 1.80 -2.16 0.23 0.00 0.00 176.35 176.49 2xah s PRO 184 N -0.79 4.07 0.64 1.29 0.04 -1.26 -3.40 135.00 135.58 2xah s PRO 184 Ca 0.10 2.29 0.41 0.00 0.04 0.00 0.00 61.00 63.83 2xah s PRO 184 Cb -0.09 -4.08 2.17 0.00 0.04 0.00 0.00 34.50 32.54 2xah s PRO 184 CO 0.00 -1.00 2.29 1.12 0.04 0.00 0.00 177.00 179.45 2xah h HIS 185 N 10.37 0.00 0.00 0.56 2.07 -1.87 -3.13 115.15 123.15 2xah h HIS 185 Ca -0.43 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.07 2xah h HIS 185 Cb 1.20 0.00 -0.06 0.00 2.57 0.00 0.00 27.41 31.13 2xah h HIS 185 CO 0.92 0.01 -0.39 -0.40 -3.07 0.00 0.00 177.93 174.99 2xah n ASP 186 N -3.20 1.58 -3.79 3.10 5.75 -1.26 -4.90 116.55 113.82 2xah n ASP 186 Ca -0.02 -3.04 -0.11 0.00 -0.01 0.00 0.00 54.79 51.60 2xah n ASP 186 Cb 0.11 -0.41 -0.08 0.00 -1.03 0.00 0.00 41.12 39.72 2xah n ASP 186 CO 0.00 0.00 0.00 -0.60 -0.11 0.00 0.00 177.20 176.49 2xah s ARG 187 N -2.14 0.74 -0.05 0.11 3.52 -1.18 -5.11 118.95 114.83 2xah s ARG 187 Ca 0.29 -0.52 -0.17 0.00 -0.13 0.00 0.00 55.73 55.21 2xah s ARG 187 Cb 0.28 0.32 -0.05 0.00 -1.56 0.00 0.00 34.95 33.94 2xah s ARG 187 CO -0.04 -0.23 0.46 -1.64 -0.81 0.00 0.00 175.30 173.05 2xah s MET 188 N -2.40 4.17 0.61 5.12 -1.94 -1.26 -4.70 119.30 118.90 2xah s MET 188 Ca -0.06 0.46 -0.12 0.00 -1.71 0.00 0.00 55.69 54.26 2xah s MET 188 Cb -0.02 -3.33 -0.04 0.00 2.01 0.00 0.00 34.83 33.45 2xah s MET 188 CO -0.03 0.41 1.03 0.95 -0.01 0.00 0.00 175.02 177.37 2xah s THR 189 N -0.22 4.66 0.36 2.05 -4.23 -1.26 -4.85 115.64 112.16 2xah s THR 189 Ca 0.25 0.91 0.10 0.00 -1.18 0.00 0.00 61.69 61.78 2xah s THR 189 Cb -0.16 -3.83 0.33 0.00 1.34 0.00 0.00 72.50 70.18 2xah s THR 189 CO 0.12 -1.08 1.86 -1.28 -0.54 0.00 0.00 174.62 173.70 2xah h SER 190 N -0.18 0.61 0.12 3.99 0.87 -1.99 -0.62 113.55 116.36 2xah h SER 190 Ca -0.44 0.05 -0.05 0.00 -1.23 0.00 0.00 61.79 60.11 2xah h SER 190 Cb 1.19 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 63.07 2xah h SER 190 CO 0.62 0.29 -0.19 -0.61 -0.53 0.00 0.00 176.83 176.40 2xah h GLN 191 N 0.64 0.15 0.00 2.24 4.15 -2.00 -2.09 115.11 118.20 2xah h GLN 191 Ca 0.47 -0.04 -0.03 0.00 0.77 0.00 0.00 58.65 59.82 2xah h GLN 191 Cb 0.83 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.51 2xah h GLN 191 CO -0.22 0.35 -0.12 0.93 -1.93 0.00 0.00 178.83 177.84 2xah h GLU 192 N 0.14 0.07 -1.26 1.69 5.08 -1.53 -3.04 114.58 115.72 2xah h GLU 192 Ca 0.03 -0.08 0.36 0.00 -1.00 0.00 0.00 59.36 58.67 2xah h GLU 192 Cb 0.43 0.02 -0.07 0.00 0.50 0.00 0.00 28.75 29.64 2xah h GLU 192 CO 0.03 0.88 0.88 0.00 -1.00 0.00 0.00 179.01 179.80 2xah h ALA 193 N 0.19 2.98 -0.25 3.43 0.00 -1.16 -0.77 119.26 123.68 2xah h ALA 193 Ca -0.02 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 2xah h ALA 193 Cb 0.93 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 2xah h ALA 193 CO 0.02 -1.39 -0.22 0.00 0.00 0.00 0.00 179.25 177.66 2xah h ALA 194 N 1.43 0.37 -0.56 0.00 0.00 -1.27 -3.04 119.26 116.19 2xah h ALA 194 Ca 0.64 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2xah h ALA 194 Cb 2.31 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 20.02 2xah h ALA 194 CO -0.11 0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.46 2xah n PHE 196 N 0.77 -0.39 0.29 0.00 3.01 -0.44 -4.61 117.46 116.09 2xah n PHE 196 Ca 0.25 -2.02 0.14 0.00 1.01 0.00 0.00 57.45 56.83 2xah n PHE 196 Cb 0.91 0.62 0.85 0.00 -0.01 0.00 0.00 39.48 41.86 2xah n PHE 196 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2xah h PRO 197 N 1.96 0.00 -0.04 -1.08 0.13 -1.74 0.13 132.00 131.35 2xah h PRO 197 Ca -0.27 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.87 2xah h PRO 197 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 2xah h PRO 197 CO 0.04 0.02 -0.05 0.38 -0.23 0.00 0.00 178.00 178.16 2xah h ASP 198 N 0.00 -0.15 0.11 1.44 2.03 -1.92 -2.31 116.42 115.63 2xah h ASP 198 Ca -0.00 0.03 -0.01 0.00 -0.73 0.00 0.00 57.03 56.32 2xah h ASP 198 Cb 0.05 0.07 0.00 0.00 -0.83 0.00 0.00 39.33 38.62 2xah h ASP 198 CO 0.00 -0.07 -0.05 0.40 -1.03 0.00 0.00 179.24 178.49 2xah h ILE 199 N -0.07 1.08 -0.04 4.15 2.04 -1.17 -2.87 117.51 120.64 2xah h ILE 199 Ca 0.04 -0.79 -0.09 0.00 1.00 0.00 0.00 64.86 65.02 2xah h ILE 199 Cb 0.12 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 2xah h ILE 199 CO -0.08 0.19 -0.38 -0.29 0.00 0.00 0.00 178.15 177.58 2xah h ILE 200 N -0.52 1.29 -0.02 -0.67 2.10 -1.51 -1.13 117.51 117.05 2xah h ILE 200 Ca -0.01 -1.37 0.00 0.00 1.08 0.00 0.00 64.86 64.55 2xah h ILE 200 Cb 0.42 1.69 0.00 0.00 -1.09 0.00 0.00 36.82 37.84 2xah h ILE 200 CO 0.02 0.40 0.00 -1.54 -1.08 0.00 0.00 178.15 175.95 2xah n SER 201 N -4.07 0.90 -2.36 2.19 3.41 -0.87 -4.87 113.62 107.96 2xah n SER 201 Ca -0.02 -1.33 0.00 0.00 -0.26 0.00 0.00 58.87 57.26 2xah n SER 201 Cb 0.43 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.37 2xah n SER 201 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xah n GLY 202 N 1.09 -0.47 3.85 5.00 0.00 -0.43 -5.07 105.19 109.17 2xah n GLY 202 Ca 0.20 -1.71 -0.32 0.00 0.00 0.00 0.00 46.02 44.19 2xah n GLY 202 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2xah s PRO 203 N -0.73 3.97 0.57 1.61 0.04 -1.26 -4.97 135.00 134.23 2xah s PRO 203 Ca 0.00 0.59 0.27 0.00 0.04 0.00 0.00 61.00 61.91 2xah s PRO 203 Cb 0.00 -2.50 1.50 0.00 0.04 0.00 0.00 34.50 33.55 2xah s PRO 203 CO 0.00 0.20 2.00 1.96 0.04 0.00 0.00 177.00 181.20 2xah h GLN 204 N 2.37 0.00 0.37 4.56 1.08 -1.96 -0.70 115.11 120.83 2xah h GLN 204 Ca -0.48 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 56.71 2xah h GLN 204 Cb 1.17 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.61 2xah h GLN 204 CO 0.66 0.00 -0.18 0.37 -0.95 0.00 0.00 178.83 178.73 2xah h GLN 205 N 0.00 -0.48 -0.96 1.46 5.75 -1.98 -2.63 115.11 116.27 2xah h GLN 205 Ca 0.19 0.03 0.07 0.00 -0.15 0.00 0.00 58.65 58.79 2xah h GLN 205 Cb 0.90 0.11 -0.07 0.00 1.07 0.00 0.00 27.48 29.49 2xah h GLN 205 CO -0.00 -0.18 0.61 1.79 -2.65 0.00 0.00 178.83 178.39 2xah h THR 206 N -0.79 1.06 -0.76 2.39 1.35 -1.51 -2.36 112.91 112.29 2xah h THR 206 Ca -0.05 -0.37 0.11 0.00 -0.55 0.00 0.00 66.41 65.55 2xah h THR 206 Cb 0.52 -0.13 -0.08 0.00 -1.73 0.00 0.00 68.15 66.73 2xah h THR 206 CO 0.08 0.20 0.38 1.56 -0.25 0.00 0.00 175.52 177.49 2xah h GLN 207 N 1.09 0.58 -0.14 4.72 4.20 -1.39 -0.32 115.11 123.86 2xah h GLN 207 Ca 0.42 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 59.04 2xah h GLN 207 Cb 0.20 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2xah h GLN 207 CO -0.18 0.39 -0.15 0.87 -0.67 0.00 0.00 178.83 179.09 2xah h LYS 208 N 0.60 0.22 -0.13 1.46 1.57 -1.04 0.19 116.57 119.44 2xah h LYS 208 Ca 0.39 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 59.05 2xah h LYS 208 Cb 0.47 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 2xah h LYS 208 CO -0.31 0.38 -0.17 0.28 -0.57 0.00 0.00 179.45 179.06 2xah h VAL 209 N 0.21 1.36 0.34 0.50 2.07 -1.02 -0.40 116.25 119.32 2xah h VAL 209 Ca 0.04 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.18 2xah h VAL 209 Cb 0.39 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 2xah h VAL 209 CO 0.02 0.40 -0.26 0.15 0.02 0.00 0.00 177.57 177.90 2xah h PHE 210 N -0.06 -0.70 -0.45 1.57 3.57 -0.79 0.16 116.94 120.24 2xah h PHE 210 Ca 0.01 -0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.58 2xah h PHE 210 Cb 0.72 0.26 -0.06 0.00 2.79 0.00 0.00 35.95 39.67 2xah h PHE 210 CO 0.09 -0.40 0.13 -0.07 -2.23 0.00 0.00 178.31 175.83 2xah h LEU 211 N -0.61 0.09 -0.42 0.59 3.38 -0.97 0.21 115.31 117.58 2xah h LEU 211 Ca -0.03 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.04 2xah h LEU 211 Cb 0.53 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 2xah h LEU 211 CO -0.01 0.08 0.21 0.15 0.09 0.00 0.00 178.44 178.97 2xah h PHE 212 N 0.28 0.39 0.41 1.13 3.57 -0.62 0.38 116.94 122.48 2xah h PHE 212 Ca 0.22 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 2xah h PHE 212 Cb 0.25 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 2xah h PHE 212 CO -0.18 0.20 -0.24 0.82 -2.23 0.00 0.00 178.31 176.67 2xah h ILE 213 N 0.42 0.50 -0.24 1.41 2.04 0.66 0.18 117.51 122.49 2xah h ILE 213 Ca 0.18 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.06 2xah h ILE 213 Cb 0.09 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 2xah h ILE 213 CO -0.13 0.00 -0.14 -0.09 0.00 0.00 0.00 178.15 177.79 2xah h ARG 214 N -0.62 -0.00 -0.74 2.37 1.12 -0.78 0.20 114.38 115.92 2xah h ARG 214 Ca -0.05 0.00 0.10 0.00 -1.11 0.00 0.00 59.98 58.92 2xah h ARG 214 Cb 0.50 0.00 -0.07 0.00 -0.01 0.00 0.00 29.97 30.39 2xah h ARG 214 CO 0.05 -0.00 0.38 -0.91 -3.11 0.00 0.00 179.97 176.38 2xah h ASN 215 N -0.00 0.50 -0.65 -3.80 2.35 -0.65 -1.37 115.58 111.96 2xah h ASN 215 Ca 0.04 0.06 -0.06 0.00 -0.55 0.00 0.00 56.30 55.78 2xah h ASN 215 Cb 0.10 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.41 2xah h ASN 215 CO -0.22 0.28 0.15 -0.09 -1.65 0.00 0.00 177.43 175.90 2xah h ARG 216 N 0.64 1.05 -0.45 0.81 9.65 0.35 -0.48 114.38 125.94 2xah h ARG 216 Ca 0.36 -0.25 -0.00 0.00 -1.10 0.00 0.00 59.98 58.99 2xah h ARG 216 Cb 0.38 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.80 2xah h ARG 216 CO -0.27 0.94 0.27 1.15 2.80 0.00 0.00 179.97 184.86 2xah h THR 217 N 0.97 1.14 0.04 0.20 2.02 0.08 -1.93 112.91 115.44 2xah h THR 217 Ca 0.20 -0.34 0.02 0.00 0.77 0.00 0.00 66.41 67.07 2xah h THR 217 Cb 0.37 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 2xah h THR 217 CO 0.00 0.15 -0.18 -0.07 0.37 0.00 0.00 175.52 175.79 2xah h LEU 218 N 0.59 -0.51 -0.50 2.58 3.38 -0.57 -1.53 115.31 118.76 2xah h LEU 218 Ca 0.16 0.07 0.08 0.00 0.09 0.00 0.00 57.88 58.28 2xah h LEU 218 Cb 0.00 0.20 -0.10 0.00 0.09 0.00 0.00 40.66 40.86 2xah h LEU 218 CO -0.03 -0.25 -0.42 -0.61 0.09 0.00 0.00 178.44 177.22 2xah h GLN 219 N -0.31 -0.26 -0.33 1.13 4.15 -0.92 0.23 115.11 118.80 2xah h GLN 219 Ca 0.04 0.02 0.07 0.00 0.77 0.00 0.00 58.65 59.55 2xah h GLN 219 Cb 0.36 0.06 -0.08 0.00 0.21 0.00 0.00 27.48 28.03 2xah h GLN 219 CO -0.14 -0.17 -0.25 -0.07 -1.93 0.00 0.00 178.83 176.27 2xah h LEU 220 N -0.27 -0.82 -0.19 -2.39 3.38 -0.70 0.39 115.31 114.70 2xah h LEU 220 Ca 0.16 0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.32 2xah h LEU 220 Cb 0.57 0.40 -0.03 0.00 0.09 0.00 0.00 40.66 41.69 2xah h LEU 220 CO -0.63 -0.28 -0.00 -0.25 0.09 0.00 0.00 178.44 177.37 2xah h TRP 221 N -0.21 -0.02 -0.60 1.13 2.91 -0.27 -2.98 115.95 115.91 2xah h TRP 221 Ca 0.17 0.01 -0.00 0.00 1.13 0.00 0.00 58.89 60.20 2xah h TRP 221 Cb 0.47 0.04 -0.03 0.00 -0.51 0.00 0.00 29.16 29.13 2xah h TRP 221 CO -0.45 -0.03 0.37 -0.07 -1.03 0.00 0.00 178.44 177.24 2xah h LEU 222 N 0.06 0.72 -1.45 0.65 3.38 0.11 -1.43 115.31 117.35 2xah h LEU 222 Ca 0.09 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.01 2xah h LEU 222 Cb 0.12 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2xah h LEU 222 CO -0.16 0.56 0.18 0.44 0.09 0.00 0.00 178.44 179.55 2xah h ASP 223 N 0.82 0.00 -0.30 -0.43 3.32 -0.15 -3.34 116.42 116.34 2xah h ASP 223 Ca 0.22 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 57.14 2xah h ASP 223 Cb -0.04 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 39.37 2xah h ASP 223 CO -0.04 0.00 -0.34 -3.20 -1.72 0.00 0.00 179.24 173.94 2xah n ASN 224 N -2.36 -2.49 -1.82 6.45 5.15 -0.56 -5.02 115.26 114.61 2xah n ASN 224 Ca -0.01 -2.50 -0.03 0.00 -0.60 0.00 0.00 54.58 51.44 2xah n ASN 224 Cb 0.21 1.40 0.28 0.00 -0.53 0.00 0.00 39.78 41.14 2xah n ASN 224 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2xah n PRO 225 N 2.13 3.57 0.00 1.20 -0.04 -1.05 -3.75 135.00 137.06 2xah n PRO 225 Ca 0.10 -2.66 0.12 0.00 -0.04 0.00 0.00 63.50 61.01 2xah n PRO 225 Cb 0.63 -2.11 0.14 0.00 -0.04 0.00 0.00 33.50 32.12 2xah n PRO 225 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2xah n LYS 226 N 0.04 0.26 -4.11 0.54 4.76 -1.26 -4.62 118.16 113.77 2xah n LYS 226 Ca 0.33 -0.18 -0.15 0.00 -2.87 0.00 0.00 58.31 55.44 2xah n LYS 226 Cb 1.22 -1.50 -0.14 0.00 -1.84 0.00 0.00 35.03 32.77 2xah n LYS 226 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2xah s ILE 227 N -2.86 0.34 0.64 -0.18 -4.36 -1.25 -1.59 121.20 111.94 2xah s ILE 227 Ca 0.13 -0.18 -0.18 0.00 -0.26 0.00 0.00 60.65 60.16 2xah s ILE 227 Cb 0.17 -0.29 -0.03 0.00 1.25 0.00 0.00 42.46 43.56 2xah s ILE 227 CO 0.70 0.10 1.06 1.67 0.24 0.00 0.00 174.94 178.71 2xah n GLN 228 N 2.99 0.89 -3.99 0.37 7.27 -0.43 -4.85 117.38 119.63 2xah n GLN 228 Ca -0.13 0.35 -0.33 0.00 0.07 0.00 0.00 57.00 56.96 2xah n GLN 228 Cb 0.58 -2.28 -0.14 0.00 2.41 0.00 0.00 30.24 30.81 2xah n GLN 228 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 2xah s LEU 229 N -2.89 4.03 0.55 1.69 2.96 -1.26 -4.91 118.68 118.85 2xah s LEU 229 Ca 0.78 -1.59 -0.06 0.00 -0.22 0.00 0.00 54.13 53.05 2xah s LEU 229 Cb -0.39 -1.64 -0.01 0.00 0.50 0.00 0.00 46.19 44.65 2xah s LEU 229 CO 0.45 -0.28 0.86 0.42 -1.32 0.00 0.00 176.35 176.48 2xah s THR 230 N 1.10 4.11 0.17 3.68 -4.23 -1.26 -4.94 115.64 114.27 2xah s THR 230 Ca -0.02 0.09 -0.15 0.00 -1.18 0.00 0.00 61.69 60.43 2xah s THR 230 Cb -0.20 -3.60 0.05 0.00 1.34 0.00 0.00 72.50 70.08 2xah s THR 230 CO -0.04 -0.61 1.77 0.15 -0.54 0.00 0.00 174.62 175.34 2xah h PHE 231 N -0.04 0.34 0.00 3.99 3.57 -1.99 -2.20 116.94 120.62 2xah h PHE 231 Ca -0.46 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.06 2xah h PHE 231 Cb 1.24 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.88 2xah h PHE 231 CO 0.51 0.16 0.00 0.39 -2.23 0.00 0.00 178.31 177.15 2xah n GLU 232 N -4.95 0.00 -0.37 1.11 4.71 -1.26 -1.94 120.64 117.93 2xah n GLU 232 Ca 0.03 0.24 0.32 0.00 -0.01 0.00 0.00 57.16 57.74 2xah n GLU 232 Cb 0.13 -1.04 0.49 0.00 -1.01 0.00 0.00 31.44 30.01 2xah n GLU 232 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2xah n ALA 233 N -0.85 1.13 0.07 0.62 0.00 -1.21 0.03 120.51 120.31 2xah n ALA 233 Ca 0.00 0.39 -0.04 0.00 0.00 0.00 0.00 53.44 53.79 2xah n ALA 233 Cb 0.00 -0.68 -0.02 0.00 0.00 0.00 0.00 19.45 18.75 2xah n ALA 233 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2xah h THR 234 N 0.00 0.00 -0.46 0.00 2.02 -1.08 -3.18 112.91 110.21 2xah h THR 234 Ca 0.56 -0.53 0.08 0.00 0.77 0.00 0.00 66.41 67.29 2xah h THR 234 Cb 2.56 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 68.90 2xah h THR 234 CO -0.01 0.00 0.07 0.25 0.37 0.00 0.00 175.52 176.20 2xah h LEU 235 N -0.78 -0.05 -0.49 2.58 5.85 0.28 0.58 115.31 123.28 2xah h LEU 235 Ca -0.02 0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.89 2xah h LEU 235 Cb 0.19 0.14 -0.09 0.00 0.37 0.00 0.00 40.66 41.26 2xah h LEU 235 CO 0.04 0.00 -0.08 1.67 -0.34 0.00 0.00 178.44 179.73 2xah n GLN 236 N -5.14 -0.04 -0.13 1.25 -0.06 -0.22 -0.94 117.38 112.10 2xah n GLN 236 Ca 0.05 0.75 0.11 0.00 -2.00 0.00 0.00 57.00 55.91 2xah n GLN 236 Cb 0.23 -1.14 0.28 0.00 -4.06 0.00 0.00 30.24 25.56 2xah n GLN 236 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 2xah n GLN 237 N -4.72 2.13 -2.56 3.69 3.00 0.20 -4.97 117.38 114.15 2xah n GLN 237 Ca 0.09 -1.70 -0.22 0.00 -0.01 0.00 0.00 57.00 55.16 2xah n GLN 237 Cb 0.28 -1.45 0.05 0.00 0.00 0.00 0.00 30.24 29.12 2xah n GLN 237 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 2xah s LEU 238 N -1.56 3.16 0.39 1.08 1.02 -0.12 -5.10 118.68 117.55 2xah s LEU 238 Ca 0.35 0.02 0.08 0.00 0.02 0.00 0.00 54.13 54.60 2xah s LEU 238 Cb 0.20 -2.80 -0.07 0.00 0.02 0.00 0.00 46.19 43.54 2xah s LEU 238 CO 0.29 -1.31 0.02 -1.61 0.02 0.00 0.00 176.35 173.76 2xah s GLU 239 N -4.89 1.99 0.59 1.70 0.41 -1.26 -4.73 118.70 112.51 2xah s GLU 239 Ca 0.59 -1.98 -0.18 0.00 -0.41 0.00 0.00 54.97 52.98 2xah s GLU 239 Cb -0.10 -1.75 -0.04 0.00 -1.78 0.00 0.00 34.13 30.47 2xah s GLU 239 CO 0.40 0.00 1.14 0.00 -0.49 0.00 0.00 175.26 176.31 2xah s ALA 240 N -2.65 2.59 -1.69 5.21 0.00 -1.26 0.23 121.76 124.19 2xah s ALA 240 Ca 0.35 0.78 0.00 0.00 0.00 0.00 0.00 51.96 53.10 2xah s ALA 240 Cb 0.06 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.81 2xah s ALA 240 CO 0.19 -1.00 0.81 -2.30 0.00 0.00 0.00 175.76 173.46 2xah n PRO 241 N -1.68 0.96 -0.10 0.00 -0.02 -1.26 -4.82 135.00 128.07 2xah n PRO 241 Ca 0.12 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.40 2xah n PRO 241 Cb 0.51 -1.15 -0.10 0.00 -0.02 0.00 0.00 33.50 32.74 2xah n PRO 241 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2xah n TYR 242 N -0.34 0.97 1.00 6.00 4.01 0.25 -3.52 117.16 125.53 2xah n TYR 242 Ca 0.00 0.42 0.05 0.00 -0.16 0.00 0.00 57.90 58.21 2xah n TYR 242 Cb 0.07 -1.04 0.27 0.00 -0.31 0.00 0.00 39.34 38.33 2xah n TYR 242 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 2xah n ASN 243 N -4.46 0.00 0.00 7.72 6.94 0.62 -3.61 115.26 122.46 2xah n ASN 243 Ca -0.29 -0.71 0.00 0.00 -0.02 0.00 0.00 54.58 53.56 2xah n ASN 243 Cb 0.62 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.04 2xah n ASN 243 CO 0.00 0.00 0.00 -0.24 -1.03 0.00 0.00 177.26 175.99 2xah n SER 244 N -0.79 0.00 -4.66 0.53 2.88 -1.23 -4.63 113.62 105.72 2xah n SER 244 Ca 0.07 0.65 -0.42 0.00 -1.33 0.00 0.00 58.87 57.83 2xah n SER 244 Cb 0.03 -0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 63.31 2xah n SER 244 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2xah s ASP 245 N -2.42 7.03 -0.02 -3.46 -1.08 -1.24 -4.95 116.67 110.53 2xah s ASP 245 Ca 0.00 1.29 0.21 0.00 -0.52 0.00 0.00 52.55 53.52 2xah s ASP 245 Cb 0.00 -2.51 -0.30 0.00 -1.46 0.00 0.00 42.92 38.65 2xah s ASP 245 CO 0.00 -0.59 0.53 0.35 0.52 0.00 0.00 175.17 175.98 2xah n THR 246 N 5.18 0.00 0.13 1.71 -2.24 -1.26 -2.98 114.28 114.82 2xah n THR 246 Ca 0.09 -0.39 -0.14 0.00 -2.27 0.00 0.00 64.05 61.35 2xah n THR 246 Cb 0.47 0.21 -0.08 0.00 -2.10 0.00 0.00 70.33 68.83 2xah n THR 246 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2xah h VAL 247 N 0.00 0.84 -0.07 2.28 -1.51 -1.99 -0.67 116.25 115.12 2xah h VAL 247 Ca 0.00 -0.15 0.01 0.00 -1.23 0.00 0.00 66.70 65.33 2xah h VAL 247 Cb 0.85 0.93 -0.01 0.00 -2.13 0.00 0.00 31.29 30.93 2xah h VAL 247 CO 0.00 0.03 -0.06 0.25 -1.23 0.00 0.00 177.57 176.56 2xah h LEU 248 N -0.34 -0.22 -0.96 4.19 5.85 -2.00 0.21 115.31 122.05 2xah h LEU 248 Ca -0.03 0.03 0.31 0.00 0.84 0.00 0.00 57.88 59.03 2xah h LEU 248 Cb 0.26 0.09 -0.16 0.00 0.37 0.00 0.00 40.66 41.23 2xah h LEU 248 CO 0.04 -0.04 0.39 0.58 -0.34 0.00 0.00 178.44 179.08 2xah h VAL 249 N -0.02 0.21 -0.22 1.05 2.07 -1.52 0.35 116.25 118.16 2xah h VAL 249 Ca 0.01 -0.06 -0.10 0.00 0.82 0.00 0.00 66.70 67.37 2xah h VAL 249 Cb 0.06 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 29.83 2xah h VAL 249 CO -0.08 0.03 -0.25 -0.74 0.02 0.00 0.00 177.57 176.55 2xah h HIS 250 N 0.19 0.68 -0.05 1.57 -0.00 -0.18 -1.78 115.15 115.59 2xah h HIS 250 Ca 0.68 -0.21 0.04 0.00 -0.00 0.00 0.00 60.37 60.88 2xah h HIS 250 Cb 1.55 -0.14 -0.06 0.00 -0.00 0.00 0.00 27.41 28.76 2xah h HIS 250 CO -0.15 0.92 -0.38 0.00 -0.00 0.00 0.00 177.93 178.32 2xah h ARG 251 N 0.25 -0.49 0.08 5.26 3.08 0.14 -1.92 114.38 120.79 2xah h ARG 251 Ca 0.03 0.03 0.02 0.00 0.07 0.00 0.00 59.98 60.14 2xah h ARG 251 Cb 0.82 0.11 -0.04 0.00 0.08 0.00 0.00 29.97 30.93 2xah h ARG 251 CO 0.06 -0.32 -0.31 0.28 -1.07 0.00 0.00 179.97 178.61 2xah h VAL 252 N -0.50 0.34 -0.95 2.04 2.07 -1.16 -1.37 116.25 116.71 2xah h VAL 252 Ca 0.07 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.71 2xah h VAL 252 Cb 0.61 0.34 -0.08 0.00 -1.52 0.00 0.00 31.29 30.64 2xah h VAL 252 CO -0.33 0.00 0.60 -0.74 0.02 0.00 0.00 177.57 177.13 2xah h HIS 253 N -0.51 0.99 -0.05 1.57 -0.00 -1.25 -2.06 115.15 113.85 2xah h HIS 253 Ca 0.04 0.03 -0.15 0.00 -0.00 0.00 0.00 60.37 60.29 2xah h HIS 253 Cb 0.55 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 27.64 2xah h HIS 253 CO -0.29 0.38 -0.64 0.77 -0.00 0.00 0.00 177.93 178.15 2xah h SER 254 N 0.86 0.23 0.69 3.26 0.02 -0.51 -1.44 113.55 116.67 2xah h SER 254 Ca 0.47 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 61.24 2xah h SER 254 Cb 0.58 -0.07 0.01 0.00 0.14 0.00 0.00 62.40 63.06 2xah h SER 254 CO -0.24 0.81 -0.33 0.22 -1.14 0.00 0.00 176.83 176.16 2xah h TYR 255 N 0.15 -0.86 -1.29 3.45 3.20 -0.63 -2.27 116.97 118.72 2xah h TYR 255 Ca -0.01 -0.02 0.37 0.00 3.14 0.00 0.00 58.73 62.21 2xah h TYR 255 Cb 1.16 0.28 -0.07 0.00 1.54 0.00 0.00 36.73 39.65 2xah h TYR 255 CO 0.02 -0.54 0.90 -0.07 -1.64 0.00 0.00 178.16 176.83 2xah h LEU 256 N -1.14 0.11 0.22 2.82 3.38 -1.33 0.35 115.31 119.72 2xah h LEU 256 Ca -0.09 0.03 -0.33 0.00 0.09 0.00 0.00 57.88 57.58 2xah h LEU 256 Cb 0.71 0.02 0.03 0.00 0.09 0.00 0.00 40.66 41.51 2xah h LEU 256 CO 0.16 -0.01 -1.42 -0.08 0.09 0.00 0.00 178.44 177.18 2xah h GLU 257 N 0.09 0.54 -0.37 1.13 4.81 -1.18 -2.21 114.58 117.37 2xah h GLU 257 Ca 0.65 -0.87 -0.07 0.00 -0.13 0.00 0.00 59.36 58.94 2xah h GLU 257 Cb 2.37 0.32 -0.01 0.00 0.63 0.00 0.00 28.75 32.06 2xah h GLU 257 CO -0.11 1.41 -0.06 -0.09 -0.73 0.00 0.00 179.01 179.43 2xah h ARG 258 N 0.17 0.70 -0.83 1.92 9.65 -0.36 -2.65 114.38 122.97 2xah h ARG 258 Ca -0.23 -0.25 -0.14 0.00 -1.10 0.00 0.00 59.98 58.25 2xah h ARG 258 Cb 2.11 -0.05 -0.09 0.00 -1.39 0.00 0.00 29.97 30.55 2xah h ARG 258 CO 0.26 0.83 0.18 0.72 2.80 0.00 0.00 179.97 184.77 2xah n HIS 259 N -4.41 1.70 -1.42 2.20 8.25 -0.58 -4.00 115.22 116.96 2xah n HIS 259 Ca -0.02 -0.87 -0.15 0.00 -0.26 0.00 0.00 57.72 56.42 2xah n HIS 259 Cb 0.33 -0.52 -0.07 0.00 1.12 0.00 0.00 29.99 30.85 2xah n HIS 259 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2xah n GLY 260 N 0.00 1.45 0.20 -1.41 0.00 -1.00 -4.80 105.19 99.63 2xah n GLY 260 Ca 0.28 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.30 2xah n GLY 260 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2xah h LEU 261 N 0.00 0.19 -8.57 0.99 3.38 -1.70 -3.42 115.31 106.18 2xah h LEU 261 Ca -0.31 -0.07 -0.39 0.00 0.09 0.00 0.00 57.88 57.20 2xah h LEU 261 Cb 1.15 -0.05 -0.18 0.00 0.09 0.00 0.00 40.66 41.67 2xah h LEU 261 CO 0.46 0.54 -0.75 0.27 0.09 0.00 0.00 178.44 179.05 2xah s ILE 262 N -4.24 1.23 -0.99 1.22 -4.36 -0.88 -4.87 121.20 108.31 2xah s ILE 262 Ca -0.04 -1.72 -0.14 0.00 -0.26 0.00 0.00 60.65 58.49 2xah s ILE 262 Cb 0.14 -1.51 0.01 0.00 1.25 0.00 0.00 42.46 42.34 2xah s ILE 262 CO 0.75 -0.47 0.69 0.59 0.24 0.00 0.00 174.94 176.74 2xah n ASN 263 N 0.49 -5.21 -4.43 4.36 3.02 -1.26 -4.55 115.26 107.68 2xah n ASN 263 Ca -0.15 -0.94 -0.25 0.00 -0.03 0.00 0.00 54.58 53.20 2xah n ASN 263 Cb 0.57 -2.60 -0.11 0.00 -0.61 0.00 0.00 39.78 37.03 2xah n ASN 263 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2xah s PHE 264 N -3.24 2.25 0.00 3.10 -0.12 -1.26 -4.91 117.98 113.79 2xah s PHE 264 Ca 0.25 -0.36 0.00 0.00 -0.05 0.00 0.00 56.93 56.77 2xah s PHE 264 Cb -0.11 -1.07 0.00 0.00 -0.63 0.00 0.00 43.02 41.21 2xah s PHE 264 CO 0.89 0.56 0.00 0.41 -0.05 0.00 0.00 175.22 177.03 2xah n GLY 265 N -0.05 0.83 3.12 1.99 0.00 -1.26 -4.68 105.19 105.13 2xah n GLY 265 Ca -0.10 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.26 2xah n GLY 265 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xah s ILE 266 N 0.00 3.17 0.31 -0.61 1.01 -1.26 -5.02 121.20 118.80 2xah s ILE 266 Ca 0.00 -2.03 0.11 0.00 0.00 0.00 0.00 60.65 58.73 2xah s ILE 266 Cb 0.00 -3.16 -0.06 0.00 0.01 0.00 0.00 42.46 39.25 2xah s ILE 266 CO 0.00 -0.64 -0.15 -0.72 0.00 0.00 0.00 174.94 173.44 2xah s TYR 267 N 1.13 2.36 -0.19 3.97 1.13 -1.26 -4.76 117.35 119.72 2xah s TYR 267 Ca 0.07 -0.39 -0.25 0.00 -1.41 0.00 0.00 57.07 55.10 2xah s TYR 267 Cb -0.22 -1.16 -0.01 0.00 -1.10 0.00 0.00 41.96 39.46 2xah s TYR 267 CO -0.04 0.66 0.81 0.21 -2.51 0.00 0.00 175.55 174.67 2xah s LYS 268 N -3.56 4.26 0.29 -3.49 2.36 -0.62 -4.90 119.74 114.08 2xah s LYS 268 Ca 0.31 0.95 -0.29 0.00 -2.55 0.00 0.00 55.97 54.39 2xah s LYS 268 Cb -0.02 -3.59 -0.09 0.00 -1.05 0.00 0.00 37.83 33.07 2xah s LYS 268 CO 0.16 -0.36 1.04 0.50 1.55 0.00 0.00 175.35 178.24 2xah s ARG 269 N 2.27 4.63 -0.13 4.03 3.52 -1.26 -1.32 118.95 130.70 2xah s ARG 269 Ca 0.36 1.66 -0.16 0.00 -0.13 0.00 0.00 55.73 57.47 2xah s ARG 269 Cb -0.16 -3.11 -0.25 0.00 -1.56 0.00 0.00 34.95 29.86 2xah s ARG 269 CO 0.11 0.25 0.47 0.82 -0.81 0.00 0.00 175.30 176.14 2xah h ILE 270 N 2.97 0.97 -3.62 4.11 2.04 -1.96 -3.43 117.51 118.58 2xah h ILE 270 Ca -0.46 -2.34 -0.77 0.00 1.00 0.00 0.00 64.86 62.28 2xah h ILE 270 Cb 1.21 2.61 -0.29 0.00 -0.74 0.00 0.00 36.82 39.60 2xah h ILE 270 CO 0.66 0.66 0.17 -0.54 0.00 0.00 0.00 178.15 179.10 2xah s LYS 271 N -2.46 3.70 0.29 2.37 1.02 -1.26 -5.06 119.74 118.34 2xah s LYS 271 Ca -0.22 -2.91 -0.16 0.00 0.02 0.00 0.00 55.97 52.71 2xah s LYS 271 Cb 0.05 -4.34 -0.11 0.00 -0.52 0.00 0.00 37.83 32.90 2xah s LYS 271 CO 0.73 -1.26 0.07 -2.30 -0.92 0.00 0.00 175.35 171.68 2xah n PRO 272 N 3.15 0.00 -1.62 -1.68 -0.02 -1.26 -4.50 135.00 129.07 2xah n PRO 272 Ca 0.19 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.23 2xah n PRO 272 Cb 0.41 -0.73 -0.03 0.00 -0.02 0.00 0.00 33.50 33.13 2xah n PRO 272 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2xah n LEU 273 N 1.70 3.62 0.00 2.45 4.77 -1.26 -4.88 117.00 123.40 2xah n LEU 273 Ca 0.08 0.54 0.00 0.00 -0.03 0.00 0.00 56.01 56.60 2xah n LEU 273 Cb 0.29 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 39.85 2xah n LEU 273 CO 0.40 -0.28 0.00 -2.65 -1.33 0.00 0.00 177.39 173.53 2xah n PRO 274 N 8.13 0.00 -0.03 3.23 -0.02 -1.26 -4.80 135.00 140.25 2xah n PRO 274 Ca 0.26 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.57 2xah n PRO 274 Cb 0.42 0.00 -0.08 0.00 -0.02 0.00 0.00 33.50 33.82 2xah n PRO 274 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2xah h THR 275 N 0.00 1.30 -3.58 3.45 1.03 -2.01 -3.42 112.91 109.68 2xah h THR 275 Ca 0.00 -1.92 -0.67 0.00 -0.01 0.00 0.00 66.41 63.81 2xah h THR 275 Cb 0.00 2.04 -0.16 0.00 -1.07 0.00 0.00 68.15 68.95 2xah h THR 275 CO 0.00 0.60 -0.71 -0.75 -0.01 0.00 0.00 175.52 174.65 2xah s LYS 276 N -3.74 2.46 0.41 0.00 2.20 -1.26 -5.13 119.74 114.67 2xah s LYS 276 Ca -0.11 -0.80 0.02 0.00 -0.36 0.00 0.00 55.97 54.72 2xah s LYS 276 Cb 0.08 -2.46 -0.01 0.00 -1.51 0.00 0.00 37.83 33.93 2xah s LYS 276 CO 0.88 0.58 0.61 0.15 -0.36 0.00 0.00 175.35 177.20 2xah s LYS 277 N -1.65 3.16 -0.06 4.03 1.02 -1.26 -5.02 119.74 119.96 2xah s LYS 277 Ca 0.19 -0.56 0.03 0.00 0.02 0.00 0.00 55.97 55.65 2xah s LYS 277 Cb -0.11 -2.63 0.00 0.00 -0.52 0.00 0.00 37.83 34.57 2xah s LYS 277 CO 0.10 -0.12 -0.15 0.99 -0.92 0.00 0.00 175.35 175.24 2xah s THR 278 N -2.43 1.35 0.28 2.17 2.01 -1.17 -4.94 115.64 112.91 2xah s THR 278 Ca 0.46 -0.63 0.00 0.00 0.31 0.00 0.00 61.69 61.83 2xah s THR 278 Cb -0.10 -1.19 0.00 0.00 0.01 0.00 0.00 72.50 71.22 2xah s THR 278 CO 0.36 0.40 0.00 0.61 -0.69 0.00 0.00 174.62 175.30 2xah n GLY 279 N 3.49 -3.03 2.82 4.40 0.00 -1.26 -3.95 105.19 107.66 2xah n GLY 279 Ca -0.20 -1.25 -0.18 0.00 0.00 0.00 0.00 46.02 44.39 2xah n GLY 279 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2xah s LYS 280 N -3.73 0.42 -0.09 1.61 2.47 -1.26 -1.37 119.74 117.78 2xah s LYS 280 Ca 0.00 0.06 0.03 0.00 -1.56 0.00 0.00 55.97 54.50 2xah s LYS 280 Cb 0.00 -0.61 0.01 0.00 -1.46 0.00 0.00 37.83 35.77 2xah s LYS 280 CO 0.00 -0.15 -0.19 0.08 0.16 0.00 0.00 175.35 175.25 2xah s VAL 281 N 1.16 1.66 -0.17 4.02 1.01 0.53 -1.05 120.40 127.56 2xah s VAL 281 Ca -0.08 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 2xah s VAL 281 Cb -0.13 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 2xah s VAL 281 CO -0.02 0.47 0.33 -0.63 0.00 0.00 0.00 175.10 175.25 2xah s ILE 282 N 0.59 5.27 -0.26 2.22 -1.09 -0.63 -2.09 121.20 125.21 2xah s ILE 282 Ca -0.15 0.60 -0.04 0.00 -2.23 0.00 0.00 60.65 58.84 2xah s ILE 282 Cb -0.17 -3.67 0.02 0.00 -1.58 0.00 0.00 42.46 37.06 2xah s ILE 282 CO 0.05 0.34 -0.00 -0.63 -1.23 0.00 0.00 174.94 173.46 2xah s ILE 283 N 0.76 3.33 -0.35 2.92 1.01 -0.04 -0.60 121.20 128.23 2xah s ILE 283 Ca 0.17 -0.86 -0.27 0.00 0.00 0.00 0.00 60.65 59.70 2xah s ILE 283 Cb -0.14 -2.69 0.01 0.00 0.01 0.00 0.00 42.46 39.66 2xah s ILE 283 CO 0.06 0.17 0.96 -0.63 0.00 0.00 0.00 174.94 175.49 2xah s ILE 284 N 1.40 4.57 0.00 2.92 1.01 -0.11 -1.27 121.20 129.72 2xah s ILE 284 Ca 0.01 1.34 0.00 0.00 0.00 0.00 0.00 60.65 62.00 2xah s ILE 284 Cb -0.17 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 37.96 2xah s ILE 284 CO -0.02 -0.51 0.00 0.61 0.00 0.00 0.00 174.94 175.02 2xah n GLY 285 N 4.25 -0.23 2.28 6.18 0.00 -0.40 -1.77 105.19 115.49 2xah n GLY 285 Ca 0.08 -1.26 -0.32 0.00 0.00 0.00 0.00 46.02 44.52 2xah n GLY 285 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2xah n SER 286 N -0.25 6.83 -3.87 1.61 3.41 -1.26 -4.28 113.62 115.81 2xah n SER 286 Ca 0.00 -3.78 -0.28 0.00 -0.26 0.00 0.00 58.87 54.55 2xah n SER 286 Cb 0.00 -0.79 0.24 0.00 -0.26 0.00 0.00 64.21 63.40 2xah n SER 286 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xah n GLY 287 N -0.83 -2.90 0.30 5.00 0.00 -1.26 -0.77 105.19 104.73 2xah n GLY 287 Ca 0.56 -1.25 -0.05 0.00 0.00 0.00 0.00 46.02 45.28 2xah n GLY 287 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2xah h VAL 288 N -2.96 1.21 0.04 1.61 2.07 -1.94 0.51 116.25 116.80 2xah h VAL 288 Ca -0.48 -0.46 0.02 0.00 0.82 0.00 0.00 66.70 66.60 2xah h VAL 288 Cb 1.25 0.17 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 2xah h VAL 288 CO 0.34 0.22 -0.15 0.77 0.02 0.00 0.00 177.57 178.77 2xah h SER 289 N 1.02 -0.41 0.21 0.57 4.64 -1.92 0.35 113.55 118.00 2xah h SER 289 Ca 0.27 0.06 0.01 0.00 -0.47 0.00 0.00 61.79 61.65 2xah h SER 289 Cb -0.04 0.17 -0.04 0.00 -0.31 0.00 0.00 62.40 62.18 2xah h SER 289 CO -0.05 -0.21 -0.50 1.23 -0.87 0.00 0.00 176.83 176.43 2xah h GLY 290 N -0.27 -1.12 0.27 -0.77 0.00 -1.69 -1.91 103.07 97.59 2xah h GLY 290 Ca 0.04 0.61 0.04 0.00 0.00 0.00 0.00 47.33 48.01 2xah h GLY 290 CO -0.11 -0.29 -0.32 1.41 0.00 0.00 0.00 176.54 177.23 2xah h LEU 291 N -0.79 -0.96 -1.57 3.11 3.38 -0.43 -0.44 115.31 117.60 2xah h LEU 291 Ca -0.01 0.13 0.15 0.00 0.09 0.00 0.00 57.88 58.23 2xah h LEU 291 Cb 0.77 0.39 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 2xah h LEU 291 CO -0.23 -0.38 0.50 0.00 0.09 0.00 0.00 178.44 178.43 2xah h ALA 292 N 0.29 2.10 -0.06 1.53 0.00 -0.21 -0.90 119.26 122.02 2xah h ALA 292 Ca 0.07 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2xah h ALA 292 Cb 0.55 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2xah h ALA 292 CO -0.28 -0.31 -0.20 0.00 0.00 0.00 0.00 179.25 178.46 2xah h ALA 293 N 1.65 0.11 0.13 0.00 0.00 -0.31 -3.10 119.26 117.72 2xah h ALA 293 Ca 0.37 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2xah h ALA 293 Cb 0.84 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.57 2xah h ALA 293 CO -0.12 0.07 -0.53 0.00 0.00 0.00 0.00 179.25 178.67 2xah h ALA 294 N 0.44 -1.00 -0.93 0.00 0.00 0.16 -1.39 119.26 116.53 2xah h ALA 294 Ca -0.01 -0.11 0.20 0.00 0.00 0.00 0.00 54.91 54.99 2xah h ALA 294 Cb 0.83 0.90 -0.18 0.00 0.00 0.00 0.00 17.79 19.35 2xah h ALA 294 CO 0.04 -1.13 -0.18 0.00 0.00 0.00 0.00 179.25 177.98 2xah h ARG 295 N -0.76 0.01 -0.38 0.00 3.08 -1.37 0.15 114.38 115.11 2xah h ARG 295 Ca -0.01 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2xah h ARG 295 Cb 0.76 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.79 2xah h ARG 295 CO -0.28 0.00 0.24 1.96 -1.07 0.00 0.00 179.97 180.82 2xah h GLN 296 N 0.01 0.51 0.00 0.04 1.08 -1.26 0.73 115.11 116.22 2xah h GLN 296 Ca 0.47 -0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.63 2xah h GLN 296 Cb 0.77 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 2xah h GLN 296 CO -0.94 0.36 -0.00 -0.07 -0.95 0.00 0.00 178.83 177.24 2xah h LEU 297 N 0.51 -0.00 -0.34 1.46 3.38 0.26 0.24 115.31 120.81 2xah h LEU 297 Ca 0.14 -0.45 0.07 0.00 0.09 0.00 0.00 57.88 57.73 2xah h LEU 297 Cb -0.02 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.65 2xah h LEU 297 CO -0.03 0.45 -0.19 -0.61 0.09 0.00 0.00 178.44 178.15 2xah h GLN 298 N -0.45 -0.14 -0.87 1.13 4.15 -1.10 0.20 115.11 118.03 2xah h GLN 298 Ca -0.00 0.01 0.25 0.00 0.77 0.00 0.00 58.65 59.68 2xah h GLN 298 Cb 0.45 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.14 2xah h GLN 298 CO 0.00 -0.09 0.65 1.03 -1.93 0.00 0.00 178.83 178.49 2xah h SER 299 N -0.15 0.00 -0.35 -0.69 0.87 -0.49 0.37 113.55 113.12 2xah h SER 299 Ca 0.17 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2xah h SER 299 Cb 0.41 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 2xah h SER 299 CO -0.43 0.00 0.00 0.49 -0.53 0.00 0.00 176.83 176.36 2xah n PHE 300 N -4.17 0.75 -3.30 2.24 3.72 0.81 -4.93 117.46 112.57 2xah n PHE 300 Ca 0.18 -0.30 -0.09 0.00 -0.05 0.00 0.00 57.45 57.18 2xah n PHE 300 Cb 0.96 -0.13 0.01 0.00 -0.94 0.00 0.00 39.48 39.37 2xah n PHE 300 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2xah n GLY 301 N 0.78 -1.24 3.38 1.37 0.00 0.13 -4.96 105.19 104.64 2xah n GLY 301 Ca 0.13 0.51 -0.19 0.00 0.00 0.00 0.00 46.02 46.47 2xah n GLY 301 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2xah s MET 302 N -3.78 1.42 -0.36 1.61 -1.94 -0.80 -3.03 119.30 112.42 2xah s MET 302 Ca 0.07 -1.69 -0.23 0.00 -1.71 0.00 0.00 55.69 52.12 2xah s MET 302 Cb -0.02 -0.99 0.01 0.00 2.01 0.00 0.00 34.83 35.84 2xah s MET 302 CO 0.79 0.04 0.78 0.34 -0.01 0.00 0.00 175.02 176.97 2xah s ASP 303 N -3.36 6.56 -0.07 3.03 -1.08 -0.47 -4.30 116.67 116.97 2xah s ASP 303 Ca 0.27 0.38 0.05 0.00 -0.52 0.00 0.00 52.55 52.72 2xah s ASP 303 Cb 0.03 -2.40 -0.01 0.00 -1.46 0.00 0.00 42.92 39.08 2xah s ASP 303 CO 0.09 -0.72 -0.21 -0.69 0.52 0.00 0.00 175.17 174.16 2xah s VAL 304 N 3.08 2.40 -0.04 1.11 1.01 -1.26 -0.35 120.40 126.36 2xah s VAL 304 Ca 0.31 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 61.36 2xah s VAL 304 Cb -0.13 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.36 2xah s VAL 304 CO 0.16 0.57 -0.03 -0.89 0.00 0.00 0.00 175.10 174.92 2xah s THR 305 N -0.20 0.38 -0.05 3.92 2.01 -0.89 -4.34 115.64 116.47 2xah s THR 305 Ca -0.02 -0.04 -0.03 0.00 0.31 0.00 0.00 61.69 61.91 2xah s THR 305 Cb -0.13 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.91 2xah s THR 305 CO 0.03 0.19 0.12 -0.76 -0.69 0.00 0.00 174.62 173.51 2xah s LEU 306 N 0.91 4.16 -0.29 4.42 1.02 -0.02 -0.86 118.68 128.01 2xah s LEU 306 Ca -0.11 0.31 0.03 0.00 0.02 0.00 0.00 54.13 54.38 2xah s LEU 306 Cb -0.14 -2.26 0.08 0.00 0.02 0.00 0.00 46.19 43.89 2xah s LEU 306 CO -0.01 0.32 -0.03 -0.76 0.02 0.00 0.00 176.35 175.90 2xah s LEU 307 N -1.48 3.92 -0.15 1.79 1.43 -0.40 -0.88 118.68 122.91 2xah s LEU 307 Ca 0.21 -1.72 -0.05 0.00 -1.03 0.00 0.00 54.13 51.53 2xah s LEU 307 Cb -0.12 -1.54 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 2xah s LEU 307 CO 0.11 -0.28 0.04 -0.70 0.23 0.00 0.00 176.35 175.75 2xah s GLU 308 N 1.05 3.64 0.05 1.70 2.56 -0.71 -1.28 118.70 125.72 2xah s GLU 308 Ca 0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 54.97 54.49 2xah s GLU 308 Cb -0.19 -3.06 -0.32 0.00 2.00 0.00 0.00 34.13 32.56 2xah s GLU 308 CO -0.07 0.42 1.07 0.00 -0.56 0.00 0.00 175.26 176.12 2xah h ALA 309 N 6.15 -0.05 -2.35 6.30 0.00 -1.85 0.52 119.26 127.99 2xah h ALA 309 Ca -0.41 -0.85 -0.45 0.00 0.00 0.00 0.00 54.91 53.20 2xah h ALA 309 Cb 1.18 0.11 0.16 0.00 0.00 0.00 0.00 17.79 19.25 2xah h ALA 309 CO 0.64 0.78 0.18 1.03 0.00 0.00 0.00 179.25 181.88 2xah s ARG 310 N -2.70 0.25 -0.29 0.00 0.52 -1.26 -3.72 118.95 111.75 2xah s ARG 310 Ca -0.07 0.48 0.06 0.00 -0.52 0.00 0.00 55.73 55.68 2xah s ARG 310 Cb 0.05 -1.72 0.57 0.00 0.52 0.00 0.00 34.95 34.38 2xah s ARG 310 CO 0.93 -2.84 1.63 -0.40 0.02 0.00 0.00 175.30 174.63 2xah n ASP 311 N -4.25 4.03 -3.58 0.23 5.75 -1.26 -0.97 116.55 116.51 2xah n ASP 311 Ca 0.05 -3.06 -0.11 0.00 -0.01 0.00 0.00 54.79 51.66 2xah n ASP 311 Cb 0.57 -0.72 -0.03 0.00 -1.03 0.00 0.00 41.12 39.91 2xah n ASP 311 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2xah s ARG 312 N -2.51 1.35 0.71 0.11 1.70 -1.26 -4.96 118.95 114.08 2xah s ARG 312 Ca 0.44 -0.66 -0.11 0.00 -0.47 0.00 0.00 55.73 54.93 2xah s ARG 312 Cb 0.36 0.56 0.02 0.00 -0.57 0.00 0.00 34.95 35.32 2xah s ARG 312 CO 0.10 -0.58 1.08 0.14 -1.08 0.00 0.00 175.30 174.96 2xah s VAL 313 N -3.81 3.66 0.00 4.99 -7.23 -1.26 -4.62 120.40 112.13 2xah s VAL 313 Ca 0.04 0.54 0.00 0.00 -1.81 0.00 0.00 61.98 60.76 2xah s VAL 313 Cb -0.01 -3.45 0.00 0.00 0.56 0.00 0.00 36.38 33.47 2xah s VAL 313 CO -0.08 -0.71 0.00 0.61 -0.31 0.00 0.00 175.10 174.62 2xah n GLY 314 N -2.66 0.85 7.00 2.32 0.00 0.05 -4.94 105.19 107.81 2xah n GLY 314 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2xah n GLY 314 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xah n GLY 315 N -1.88 2.81 0.00 -0.02 0.00 -1.26 0.91 105.19 105.75 2xah n GLY 315 Ca 0.00 0.32 0.08 0.00 0.00 0.00 0.00 46.02 46.42 2xah n GLY 315 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2xah n ARG 316 N 8.52 0.84 -3.31 1.61 1.74 -1.26 -3.87 116.66 120.93 2xah n ARG 316 Ca 0.00 0.00 -0.47 0.00 -0.77 0.00 0.00 57.85 56.61 2xah n ARG 316 Cb 0.00 -1.31 -0.03 0.00 -1.02 0.00 0.00 32.46 30.10 2xah n ARG 316 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2xah s VAL 317 N -2.00 5.48 0.10 1.55 1.01 0.26 -2.57 120.40 124.23 2xah s VAL 317 Ca 0.25 -2.19 0.07 0.00 0.00 0.00 0.00 61.98 60.11 2xah s VAL 317 Cb 0.12 -4.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 2xah s VAL 317 CO 0.19 -1.00 -0.10 0.00 0.00 0.00 0.00 175.10 174.19 2xah s ALA 318 N 0.62 2.96 -0.15 5.51 0.00 -1.25 -4.63 121.76 124.82 2xah s ALA 318 Ca 0.15 -1.24 -0.04 0.00 0.00 0.00 0.00 51.96 50.82 2xah s ALA 318 Cb -0.15 -0.90 0.06 0.00 0.00 0.00 0.00 23.12 22.13 2xah s ALA 318 CO -0.06 0.64 0.15 0.99 0.00 0.00 0.00 175.76 177.49 2xah s THR 319 N -1.22 -0.22 0.00 0.00 2.01 -1.26 -2.07 115.64 112.88 2xah s THR 319 Ca 0.21 0.05 -0.30 0.00 0.31 0.00 0.00 61.69 61.96 2xah s THR 319 Cb -0.11 -0.49 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 2xah s THR 319 CO 0.14 -0.10 1.11 0.12 -0.69 0.00 0.00 174.62 175.21 2xah s PHE 320 N 2.25 3.46 -0.01 4.92 5.36 0.13 -4.90 117.98 129.19 2xah s PHE 320 Ca 0.04 1.43 0.02 0.00 -0.96 0.00 0.00 56.93 57.46 2xah s PHE 320 Cb -0.14 -3.31 -0.00 0.00 -0.34 0.00 0.00 43.02 39.23 2xah s PHE 320 CO -0.09 -0.80 -0.06 1.03 -1.46 0.00 0.00 175.22 173.84 2xah s ARG 321 N 1.37 0.53 -0.30 10.12 0.52 -1.26 -1.10 118.95 128.83 2xah s ARG 321 Ca 0.55 -0.20 -0.16 0.00 -0.52 0.00 0.00 55.73 55.40 2xah s ARG 321 Cb -0.25 -0.52 0.19 0.00 0.52 0.00 0.00 34.95 34.90 2xah s ARG 321 CO 0.26 0.11 1.19 0.21 0.02 0.00 0.00 175.30 177.09 2xah s LYS 322 N -0.01 0.13 3.34 3.54 2.20 -0.77 -5.02 119.74 123.14 2xah s LYS 322 Ca 0.01 0.24 0.00 0.00 -0.36 0.00 0.00 55.97 55.85 2xah s LYS 322 Cb -0.04 0.05 0.00 0.00 -1.51 0.00 0.00 37.83 36.33 2xah s LYS 322 CO -0.00 -0.03 0.00 0.41 -0.36 0.00 0.00 175.35 175.37 2xah n GLY 323 N 3.47 3.03 0.96 5.54 0.00 -1.26 0.06 105.19 116.98 2xah n GLY 323 Ca -0.16 0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.09 2xah n GLY 323 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2xah n ASN 324 N 3.79 3.01 -4.72 1.61 3.02 -1.26 -4.91 115.26 115.80 2xah n ASN 324 Ca 0.00 -1.96 -0.42 0.00 -0.03 0.00 0.00 54.58 52.17 2xah n ASN 324 Cb 0.00 -0.05 -0.03 0.00 -0.61 0.00 0.00 39.78 39.09 2xah n ASN 324 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 2xah s TYR 325 N -1.81 3.43 -0.23 3.10 2.02 0.11 -4.84 117.35 119.14 2xah s TYR 325 Ca 0.29 1.31 -0.03 0.00 -0.37 0.00 0.00 57.07 58.27 2xah s TYR 325 Cb 0.20 -3.43 0.11 0.00 -0.40 0.00 0.00 41.96 38.44 2xah s TYR 325 CO 0.29 -1.30 0.29 0.08 -1.57 0.00 0.00 175.55 173.34 2xah s VAL 326 N 0.89 -0.45 -0.08 0.71 1.01 -1.26 -1.85 120.40 119.37 2xah s VAL 326 Ca 0.58 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 2xah s VAL 326 Cb -0.30 -0.76 0.02 0.00 0.00 0.00 0.00 36.38 35.34 2xah s VAL 326 CO 0.30 -0.19 0.21 0.00 0.00 0.00 0.00 175.10 175.43 2xah s ALA 327 N 2.42 -0.52 0.07 5.51 0.00 -0.26 -4.87 121.76 124.11 2xah s ALA 327 Ca 0.09 0.64 -0.26 0.00 0.00 0.00 0.00 51.96 52.43 2xah s ALA 327 Cb -0.15 -0.38 -0.06 0.00 0.00 0.00 0.00 23.12 22.53 2xah s ALA 327 CO -0.15 -0.11 0.80 -0.51 0.00 0.00 0.00 175.76 175.79 2xah s ASP 328 N 0.25 7.28 0.00 0.00 1.01 -1.26 0.20 116.67 124.14 2xah s ASP 328 Ca -0.01 1.52 0.27 0.00 0.71 0.00 0.00 52.55 55.04 2xah s ASP 328 Cb -0.03 -2.49 0.87 0.00 1.01 0.00 0.00 42.92 42.28 2xah s ASP 328 CO -0.01 0.01 1.64 0.18 0.21 0.00 0.00 175.17 177.20 2xah n LEU 329 N 2.72 1.07 0.00 1.23 4.77 -0.88 -4.90 117.00 121.02 2xah n LEU 329 Ca -0.02 -0.29 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 2xah n LEU 329 Cb 0.50 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.49 2xah n LEU 329 CO 0.48 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 2xah n GLY 330 N 1.30 4.48 3.57 -0.72 0.00 -1.20 -4.77 105.19 107.85 2xah n GLY 330 Ca 0.14 -1.17 -0.38 0.00 0.00 0.00 0.00 46.02 44.61 2xah n GLY 330 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xah n ALA 331 N -3.00 -0.22 0.00 4.61 0.00 -1.06 -4.90 120.51 115.94 2xah n ALA 331 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2xah n ALA 331 Cb 0.00 -2.02 0.00 0.00 0.00 0.00 0.00 19.45 17.43 2xah n ALA 331 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 2xah n MET 332 N -0.65 0.40 -5.19 0.00 1.56 -1.26 -4.74 117.12 107.24 2xah n MET 332 Ca 0.13 0.00 -0.32 0.00 -0.27 0.00 0.00 57.70 57.24 2xah n MET 332 Cb 0.47 -0.19 -0.15 0.00 2.15 0.00 0.00 33.22 35.50 2xah n MET 332 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 2xah s VAL 333 N -0.82 2.32 -0.27 1.12 1.01 -1.26 -2.94 120.40 119.56 2xah s VAL 333 Ca 0.00 -1.00 -0.17 0.00 0.00 0.00 0.00 61.98 60.81 2xah s VAL 333 Cb 0.00 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2xah s VAL 333 CO 0.00 0.58 0.45 -0.69 0.00 0.00 0.00 175.10 175.44 2xah s VAL 334 N -0.60 5.11 -1.09 2.92 1.01 0.21 -4.91 120.40 123.06 2xah s VAL 334 Ca 0.09 0.69 -0.05 0.00 0.00 0.00 0.00 61.98 62.71 2xah s VAL 334 Cb -0.11 -3.79 0.09 0.00 0.00 0.00 0.00 36.38 32.58 2xah s VAL 334 CO -0.00 0.09 2.53 0.35 0.00 0.00 0.00 175.10 178.07 2xah n THR 335 N 5.17 4.70 0.00 3.92 -2.24 -1.26 -0.88 114.28 123.68 2xah n THR 335 Ca -0.06 -3.87 0.00 0.00 -2.27 0.00 0.00 64.05 57.85 2xah n THR 335 Cb 0.50 -1.98 0.00 0.00 -2.10 0.00 0.00 70.33 66.75 2xah n THR 335 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xah n GLY 336 N 1.61 1.07 0.18 3.38 0.00 -1.25 -4.30 105.19 105.87 2xah n GLY 336 Ca 0.59 -1.40 0.14 0.00 0.00 0.00 0.00 46.02 45.36 2xah n GLY 336 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2xah n LEU 337 N -0.12 0.63 -3.99 0.99 4.77 -1.20 -4.57 117.00 113.50 2xah n LEU 337 Ca 0.00 -0.11 -0.42 0.00 -0.03 0.00 0.00 56.01 55.44 2xah n LEU 337 Cb 0.00 -0.11 -0.00 0.00 -2.33 0.00 0.00 43.42 40.98 2xah n LEU 337 CO 0.00 0.11 2.47 0.61 -1.33 0.00 0.00 177.39 179.25 2xah n GLY 338 N 1.21 3.85 0.00 -0.72 0.00 0.91 -2.83 105.19 107.60 2xah n GLY 338 Ca 0.17 -1.55 0.00 0.00 0.00 0.00 0.00 46.02 44.64 2xah n GLY 338 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xah n GLY 339 N 4.51 1.80 3.48 -0.02 0.00 -1.26 -3.07 105.19 110.62 2xah n GLY 339 Ca 0.51 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.13 2xah n GLY 339 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2xah s ASN 340 N -2.00 5.88 0.40 1.61 3.84 -1.13 -4.62 114.94 118.92 2xah s ASN 340 Ca 0.00 -0.58 0.23 0.00 0.21 0.00 0.00 52.86 52.72 2xah s ASN 340 Cb 0.00 -2.09 1.28 0.00 -0.55 0.00 0.00 41.25 39.89 2xah s ASN 340 CO 0.00 -0.27 1.65 1.55 -2.79 0.00 0.00 177.10 177.25 2xah h PRO 341 N 8.46 0.18 -0.22 0.43 0.13 -1.92 0.42 132.00 139.50 2xah h PRO 341 Ca -0.30 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.83 2xah h PRO 341 Cb 1.14 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 2xah h PRO 341 CO 0.64 0.12 0.14 0.52 -0.23 0.00 0.00 178.00 179.20 2xah h MET 342 N 0.19 0.24 -0.51 0.86 2.86 -1.93 -0.28 114.93 116.35 2xah h MET 342 Ca 0.76 -0.01 0.10 0.00 -2.06 0.00 0.00 59.70 58.49 2xah h MET 342 Cb 2.14 -0.05 -0.10 0.00 0.06 0.00 0.00 31.60 33.65 2xah h MET 342 CO -0.47 0.16 -0.12 0.00 1.06 0.00 0.00 176.91 177.53 2xah h ALA 343 N 1.87 0.34 -0.19 6.32 0.00 -0.45 -0.18 119.26 126.97 2xah h ALA 343 Ca 0.08 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2xah h ALA 343 Cb 0.03 0.39 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2xah h ALA 343 CO -0.02 -0.44 0.12 0.28 0.00 0.00 0.00 179.25 179.20 2xah h VAL 344 N 0.00 1.06 -0.61 0.00 2.07 -1.12 -2.87 116.25 114.78 2xah h VAL 344 Ca 0.25 -0.12 0.08 0.00 0.82 0.00 0.00 66.70 67.73 2xah h VAL 344 Cb 0.38 0.80 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 2xah h VAL 344 CO -0.53 0.06 0.41 0.58 0.02 0.00 0.00 177.57 178.11 2xah h VAL 345 N 0.25 0.94 0.00 2.57 2.07 -0.97 -1.70 116.25 119.42 2xah h VAL 345 Ca 0.07 -0.17 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 2xah h VAL 345 Cb -0.01 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.14 2xah h VAL 345 CO -0.01 0.09 -0.22 0.77 0.02 0.00 0.00 177.57 178.21 2xah h SER 346 N 0.50 0.00 1.51 0.57 4.64 -0.85 -0.45 113.55 119.47 2xah h SER 346 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2xah h SER 346 Cb 0.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 2xah h SER 346 CO -0.08 0.22 0.00 0.11 -0.87 0.00 0.00 176.83 176.21 2xah h LYS 347 N 0.00 0.00 0.00 4.77 1.57 -1.20 -3.27 116.57 118.44 2xah h LYS 347 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2xah h LYS 347 Cb 0.97 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 2xah h LYS 347 CO 0.03 0.00 -1.39 1.04 -0.57 0.00 0.00 179.45 178.56 2xah n GLN 348 N -2.74 0.63 -3.84 3.15 6.02 -0.46 -4.89 117.38 115.25 2xah n GLN 348 Ca 0.04 0.05 -0.19 0.00 -0.01 0.00 0.00 57.00 56.88 2xah n GLN 348 Cb 0.42 -1.73 -0.17 0.00 1.02 0.00 0.00 30.24 29.78 2xah n GLN 348 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2xah s VAL 349 N -3.30 0.17 -1.14 5.09 1.01 -0.30 -4.96 120.40 116.96 2xah s VAL 349 Ca -0.03 0.17 -0.22 0.00 0.00 0.00 0.00 61.98 61.89 2xah s VAL 349 Cb 0.10 -0.31 -0.05 0.00 0.00 0.00 0.00 36.38 36.12 2xah s VAL 349 CO 0.83 0.18 1.89 0.21 0.00 0.00 0.00 175.10 178.20 2xah s ASN 350 N 1.50 5.38 0.27 3.32 2.47 -1.26 -4.45 114.94 122.18 2xah s ASN 350 Ca -0.03 -1.59 -0.13 0.00 0.42 0.00 0.00 52.86 51.53 2xah s ASN 350 Cb -0.13 -2.58 -0.08 0.00 -1.45 0.00 0.00 41.25 37.01 2xah s ASN 350 CO -0.03 -2.67 0.65 -0.04 -3.72 0.00 0.00 177.10 171.30 2xah s MET 351 N 6.17 3.93 -0.47 0.43 -1.94 -1.26 -4.98 119.30 121.18 2xah s MET 351 Ca 0.66 0.52 -0.16 0.00 -1.71 0.00 0.00 55.69 54.99 2xah s MET 351 Cb -0.01 -2.55 0.06 0.00 2.01 0.00 0.00 34.83 34.34 2xah s MET 351 CO 0.09 0.24 0.44 -2.00 -0.01 0.00 0.00 175.02 173.78 2xah s GLU 352 N -2.83 3.02 -0.39 2.03 2.12 -1.26 -4.96 118.70 116.41 2xah s GLU 352 Ca 0.50 -1.19 -0.18 0.00 0.36 0.00 0.00 54.97 54.46 2xah s GLU 352 Cb -0.11 -4.10 0.01 0.00 0.26 0.00 0.00 34.13 30.19 2xah s GLU 352 CO 0.19 -1.03 0.51 -0.51 -0.54 0.00 0.00 175.26 173.87 2xah s LEU 353 N 1.88 4.56 -0.11 2.70 1.43 -1.26 0.16 118.68 128.05 2xah s LEU 353 Ca 0.07 -0.34 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 2xah s LEU 353 Cb -0.22 -2.53 -0.02 0.00 0.03 0.00 0.00 46.19 43.45 2xah s LEU 353 CO 0.08 -0.57 -0.12 0.00 0.23 0.00 0.00 176.35 175.97 2xah s ALA 354 N 2.38 2.68 0.62 4.21 0.00 -1.05 -4.91 121.76 125.68 2xah s ALA 354 Ca 0.17 -0.90 -0.16 0.00 0.00 0.00 0.00 51.96 51.07 2xah s ALA 354 Cb -0.16 -1.19 -0.02 0.00 0.00 0.00 0.00 23.12 21.76 2xah s ALA 354 CO 0.15 0.33 1.09 0.15 0.00 0.00 0.00 175.76 177.48 2xah s LYS 355 N 0.06 3.04 -0.22 0.00 1.02 -1.26 -0.72 119.74 121.66 2xah s LYS 355 Ca -0.04 1.36 -0.06 0.00 0.02 0.00 0.00 55.97 57.25 2xah s LYS 355 Cb -0.14 -1.98 -0.02 0.00 -0.52 0.00 0.00 37.83 35.16 2xah s LYS 355 CO 0.04 -1.05 0.02 0.42 -0.92 0.00 0.00 175.35 173.85 2xah s ILE 356 N -2.30 3.99 -0.06 2.17 1.01 -1.03 -4.85 121.20 120.12 2xah s ILE 356 Ca 0.67 -0.29 -0.30 0.00 0.00 0.00 0.00 60.65 60.73 2xah s ILE 356 Cb -0.19 -2.83 -0.03 0.00 0.01 0.00 0.00 42.46 39.42 2xah s ILE 356 CO 0.38 0.40 1.19 -0.54 0.00 0.00 0.00 174.94 176.38 2xah s LYS 357 N 1.22 4.35 0.62 2.79 1.02 -1.26 -4.77 119.74 123.71 2xah s LYS 357 Ca 0.04 1.66 0.35 0.00 0.02 0.00 0.00 55.97 58.04 2xah s LYS 357 Cb -0.15 -3.56 2.04 0.00 -0.52 0.00 0.00 37.83 35.65 2xah s LYS 357 CO 0.02 -0.45 2.30 1.96 -0.92 0.00 0.00 175.35 178.26 2xah h GLN 358 N 7.46 0.00 -6.41 1.68 1.08 -2.00 -3.42 115.11 113.51 2xah h GLN 358 Ca -0.34 0.00 -0.54 0.00 -1.45 0.00 0.00 58.65 56.32 2xah h GLN 358 Cb 1.16 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.60 2xah h GLN 358 CO 0.88 0.00 0.94 0.21 -0.95 0.00 0.00 178.83 179.91 2xah s LYS 359 N -4.47 4.23 -0.39 1.46 2.20 -1.26 -4.97 119.74 116.54 2xah s LYS 359 Ca -0.05 2.18 0.01 0.00 -0.36 0.00 0.00 55.97 57.75 2xah s LYS 359 Cb 0.14 -3.62 0.13 0.00 -1.51 0.00 0.00 37.83 32.97 2xah s LYS 359 CO 0.50 -0.68 0.20 0.00 -0.36 0.00 0.00 175.35 175.00 2xah s PRO 361 N 0.81 4.25 0.40 0.00 0.04 -1.26 -4.65 135.00 134.58 2xah s PRO 361 Ca 0.16 2.08 -0.07 0.00 0.04 0.00 0.00 61.00 63.21 2xah s PRO 361 Cb -0.22 -3.62 -0.05 0.00 0.04 0.00 0.00 34.50 30.65 2xah s PRO 361 CO -0.06 -0.65 0.72 -0.51 0.04 0.00 0.00 177.00 176.54 2xah s LEU 362 N 2.63 3.82 -0.25 -3.56 1.43 -1.26 -1.50 118.68 120.00 2xah s LEU 362 Ca 0.67 0.95 -0.03 0.00 -1.03 0.00 0.00 54.13 54.69 2xah s LEU 362 Cb -0.34 -3.84 0.10 0.00 0.03 0.00 0.00 46.19 42.14 2xah s LEU 362 CO 0.28 -0.41 0.19 -0.31 0.23 0.00 0.00 176.35 176.34 2xah s TYR 363 N -2.42 -0.07 1.07 0.29 1.51 -1.04 -2.97 117.35 113.72 2xah s TYR 363 Ca 0.48 -0.31 -0.21 0.00 -1.01 0.00 0.00 57.07 56.02 2xah s TYR 363 Cb -0.10 -0.61 0.02 0.00 -0.11 0.00 0.00 41.96 41.16 2xah s TYR 363 CO 0.35 -0.74 -0.43 0.39 -1.11 0.00 0.00 175.55 174.01 2xah n GLU 364 N 5.29 -1.21 -0.21 -0.62 1.02 -0.86 -2.23 120.64 121.83 2xah n GLU 364 Ca -0.05 -0.34 0.02 0.00 -0.02 0.00 0.00 57.16 56.77 2xah n GLU 364 Cb 0.46 -1.46 0.13 0.00 -0.02 0.00 0.00 31.44 30.55 2xah n GLU 364 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2xah h ALA 365 N -1.83 0.80 -1.01 0.62 0.00 -1.83 -1.54 119.26 114.47 2xah h ALA 365 Ca -0.46 0.13 0.24 0.00 0.00 0.00 0.00 54.91 54.82 2xah h ALA 365 Cb 1.30 0.16 -0.11 0.00 0.00 0.00 0.00 17.79 19.14 2xah h ALA 365 CO 0.31 -0.29 0.62 -2.95 0.00 0.00 0.00 179.25 176.94 2xah h ASN 366 N 0.30 0.63 0.00 0.00 7.08 -1.91 -3.46 115.58 118.22 2xah h ASN 366 Ca 0.34 0.11 0.00 0.00 -3.08 0.00 0.00 56.30 53.68 2xah h ASN 366 Cb 0.52 0.01 0.00 0.00 -2.08 0.00 0.00 38.32 36.77 2xah h ASN 366 CO -0.41 0.13 0.00 0.61 -2.08 0.00 0.00 177.43 175.68 2xah n GLY 367 N -1.36 1.90 2.96 9.14 0.00 -0.58 -4.93 105.19 112.32 2xah n GLY 367 Ca 0.26 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.16 2xah n GLY 367 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2xah s GLN 368 N -0.14 0.28 0.18 1.61 -0.21 -1.26 -4.40 119.66 115.72 2xah s GLN 368 Ca 0.00 -0.42 -0.32 0.00 0.02 0.00 0.00 55.36 54.64 2xah s GLN 368 Cb 0.00 -0.06 -0.16 0.00 1.00 0.00 0.00 33.01 33.79 2xah s GLN 368 CO 0.00 0.00 1.04 0.00 -2.12 0.00 0.00 175.29 174.22 2xah n ALA 369 N 2.15 -1.27 -2.27 6.09 0.00 -1.26 -2.02 120.51 121.93 2xah n ALA 369 Ca -0.19 0.46 -0.42 0.00 0.00 0.00 0.00 53.44 53.29 2xah n ALA 369 Cb 0.57 -1.94 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 2xah n ALA 369 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2xah s VAL 370 N -0.40 3.59 0.31 0.00 1.01 -1.16 -4.79 120.40 118.95 2xah s VAL 370 Ca 0.72 1.14 -0.25 0.00 0.00 0.00 0.00 61.98 63.59 2xah s VAL 370 Cb -0.88 -3.73 -0.10 0.00 0.00 0.00 0.00 36.38 31.67 2xah s VAL 370 CO 0.54 0.09 0.90 -2.84 0.00 0.00 0.00 175.10 173.79 2xah s PRO 371 N 1.08 4.52 0.32 2.72 0.02 -1.26 -4.68 135.00 137.72 2xah s PRO 371 Ca 0.62 1.24 0.14 0.00 0.02 0.00 0.00 61.00 63.03 2xah s PRO 371 Cb -0.34 -2.81 1.08 0.00 0.02 0.00 0.00 34.50 32.45 2xah s PRO 371 CO 0.30 0.30 1.44 1.63 -0.33 0.00 0.00 177.00 180.33 2xah n LYS 372 N 0.58 -0.06 -0.15 5.54 5.02 -1.26 -0.09 118.16 127.74 2xah n LYS 372 Ca 0.01 1.29 -0.14 0.00 -2.02 0.00 0.00 58.31 57.46 2xah n LYS 372 Cb 0.50 -2.24 -0.10 0.00 -0.02 0.00 0.00 35.03 33.18 2xah n LYS 372 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2xah h GLU 373 N 0.00 -0.36 0.10 1.97 4.39 -2.00 -2.41 114.58 116.26 2xah h GLU 373 Ca 0.71 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 60.43 2xah h GLU 373 Cb 1.80 0.08 0.00 0.00 -0.10 0.00 0.00 28.75 30.53 2xah h GLU 373 CO -0.75 -0.24 -0.05 0.87 -1.16 0.00 0.00 179.01 177.68 2xah h LYS 374 N -0.37 -0.13 -0.60 2.33 1.57 -0.87 -3.09 116.57 115.41 2xah h LYS 374 Ca 0.08 0.01 0.11 0.00 -1.87 0.00 0.00 60.65 58.98 2xah h LYS 374 Cb 0.59 0.03 -0.10 0.00 0.08 0.00 0.00 32.23 32.82 2xah h LYS 374 CO -0.62 0.35 -0.19 -3.47 -0.57 0.00 0.00 179.45 174.95 2xah n ASP 375 N -4.84 -0.30 -0.05 0.86 -0.08 -0.91 0.71 116.55 111.94 2xah n ASP 375 Ca -0.07 1.03 -0.12 0.00 -1.51 0.00 0.00 54.79 54.13 2xah n ASP 375 Cb 0.27 -0.27 0.02 0.00 2.34 0.00 0.00 41.12 43.47 2xah n ASP 375 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2xah h GLU 376 N 0.00 0.74 -0.61 -0.67 5.08 -1.51 -2.89 114.58 114.72 2xah h GLU 376 Ca 0.25 -0.44 -0.08 0.00 -1.00 0.00 0.00 59.36 58.09 2xah h GLU 376 Cb 0.40 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2xah h GLU 376 CO -0.60 1.06 0.05 1.98 -1.00 0.00 0.00 179.01 180.50 2xah h MET 377 N 0.58 1.03 0.43 2.33 4.05 0.37 -1.78 114.93 121.96 2xah h MET 377 Ca 0.03 -0.30 -0.02 0.00 -0.28 0.00 0.00 59.70 59.12 2xah h MET 377 Cb 1.06 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.75 2xah h MET 377 CO 0.10 0.99 -0.21 0.28 0.23 0.00 0.00 176.91 178.31 2xah h VAL 378 N 0.94 0.27 -0.63 -5.77 2.07 -1.31 -1.15 116.25 110.67 2xah h VAL 378 Ca 0.18 -0.60 0.11 0.00 0.82 0.00 0.00 66.70 67.21 2xah h VAL 378 Cb 0.49 0.42 -0.12 0.00 -1.52 0.00 0.00 31.29 30.56 2xah h VAL 378 CO 0.02 0.06 -0.33 -0.08 0.02 0.00 0.00 177.57 177.26 2xah h GLU 379 N -1.05 -0.13 -0.11 1.57 4.81 -1.58 0.44 114.58 118.53 2xah h GLU 379 Ca -0.06 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2xah h GLU 379 Cb 0.54 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 2xah h GLU 379 CO 0.10 -0.09 0.06 0.37 -0.73 0.00 0.00 179.01 178.72 2xah h GLN 380 N -0.14 0.14 0.00 1.92 4.15 -1.29 0.33 115.11 120.23 2xah h GLN 380 Ca 0.25 -0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.66 2xah h GLN 380 Cb 0.55 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.21 2xah h GLN 380 CO -0.71 0.10 -0.00 1.49 -1.93 0.00 0.00 178.83 177.79 2xah h GLU 381 N 0.15 -0.00 -0.99 1.69 4.57 0.92 -2.65 114.58 118.27 2xah h GLU 381 Ca 0.04 0.00 0.13 0.00 -1.18 0.00 0.00 59.36 58.35 2xah h GLU 381 Cb -0.00 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 28.45 2xah h GLU 381 CO -0.01 0.71 -0.48 0.35 -1.18 0.00 0.00 179.01 178.41 2xah h PHE 382 N -0.73 -1.44 -0.94 0.92 3.57 0.25 0.63 116.94 119.20 2xah h PHE 382 Ca -0.00 0.12 0.11 0.00 3.53 0.00 0.00 57.97 61.72 2xah h PHE 382 Cb 0.72 0.77 -0.07 0.00 2.79 0.00 0.00 35.95 40.15 2xah h PHE 382 CO 0.18 -0.39 0.60 -0.91 -2.23 0.00 0.00 178.31 175.56 2xah h ASN 383 N -0.01 0.85 -0.07 0.41 2.35 -0.92 -0.78 115.58 117.42 2xah h ASN 383 Ca 0.26 0.03 -0.21 0.00 -0.55 0.00 0.00 56.30 55.84 2xah h ASN 383 Cb 0.52 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.75 2xah h ASN 383 CO -0.96 0.48 -0.72 0.03 -1.65 0.00 0.00 177.43 174.60 2xah h ARG 384 N 0.93 0.71 -0.80 0.81 3.08 -0.71 -2.61 114.38 115.79 2xah h ARG 384 Ca 0.45 -0.55 0.05 0.00 0.07 0.00 0.00 59.98 60.00 2xah h ARG 384 Cb 0.45 0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.56 2xah h ARG 384 CO -0.21 1.17 0.49 -0.07 -1.07 0.00 0.00 179.97 180.28 2xah h LEU 385 N 0.50 0.78 0.75 3.04 3.38 0.12 -1.40 115.31 122.48 2xah h LEU 385 Ca -0.04 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 2xah h LEU 385 Cb 1.34 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.94 2xah h LEU 385 CO 0.15 0.52 -0.36 -0.07 0.09 0.00 0.00 178.44 178.76 2xah h LEU 386 N 0.92 -0.85 -0.96 1.67 3.38 -1.00 -2.59 115.31 115.88 2xah h LEU 386 Ca 0.34 0.03 0.30 0.00 0.09 0.00 0.00 57.88 58.64 2xah h LEU 386 Cb 0.12 0.22 -0.17 0.00 0.09 0.00 0.00 40.66 40.92 2xah h LEU 386 CO -0.15 -0.57 0.28 -0.33 0.09 0.00 0.00 178.44 177.76 2xah h GLU 387 N -1.09 0.10 -0.60 1.13 5.08 -1.45 0.30 114.58 118.06 2xah h GLU 387 Ca -0.10 -0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.36 2xah h GLU 387 Cb 0.77 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.91 2xah h GLU 387 CO 0.17 0.07 0.15 0.00 -1.00 0.00 0.00 179.01 178.39 2xah h ALA 388 N 1.91 0.72 -0.55 3.43 0.00 -1.07 0.24 119.26 123.95 2xah h ALA 388 Ca 0.66 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.66 2xah h ALA 388 Cb 1.50 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 2xah h ALA 388 CO -0.77 -0.28 0.21 1.79 0.00 0.00 0.00 179.25 180.20 2xah h THR 389 N 0.29 1.22 -0.33 0.00 1.35 -0.03 0.52 112.91 115.93 2xah h THR 389 Ca 0.31 -0.71 0.02 0.00 -0.55 0.00 0.00 66.41 65.48 2xah h THR 389 Cb 0.45 0.67 -0.02 0.00 -1.73 0.00 0.00 68.15 67.51 2xah h THR 389 CO -0.38 0.27 0.18 -1.28 -0.25 0.00 0.00 175.52 174.06 2xah h SER 390 N 0.75 0.28 -0.61 5.36 0.87 -0.48 0.12 113.55 119.84 2xah h SER 390 Ca 0.18 0.01 0.05 0.00 -1.23 0.00 0.00 61.79 60.80 2xah h SER 390 Cb 0.22 -0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 62.08 2xah h SER 390 CO -0.01 0.21 0.34 0.22 -0.53 0.00 0.00 176.83 177.06 2xah h TYR 391 N 0.37 0.63 -0.79 2.24 5.03 -0.42 -0.97 116.97 123.05 2xah h TYR 391 Ca 0.13 0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.50 2xah h TYR 391 Cb 0.02 -0.19 -0.05 0.00 1.55 0.00 0.00 36.73 38.06 2xah h TYR 391 CO -0.09 0.32 0.52 1.25 -1.32 0.00 0.00 178.16 178.84 2xah h LEU 392 N 0.65 0.83 0.04 2.82 6.46 0.30 -0.29 115.31 126.11 2xah h LEU 392 Ca 0.27 -0.01 -0.00 0.00 -0.12 0.00 0.00 57.88 58.02 2xah h LEU 392 Cb 0.13 -0.19 0.00 0.00 -0.73 0.00 0.00 40.66 39.87 2xah h LEU 392 CO -0.16 0.57 -0.02 -1.28 -0.62 0.00 0.00 178.44 176.93 2xah h SER 393 N 0.96 -0.04 0.22 1.25 0.87 -0.26 -2.27 113.55 114.28 2xah h SER 393 Ca 0.32 -0.65 -0.31 0.00 -1.23 0.00 0.00 61.79 59.92 2xah h SER 393 Cb 0.07 0.01 0.03 0.00 -0.44 0.00 0.00 62.40 62.07 2xah h SER 393 CO -0.10 0.72 -1.33 0.45 -0.53 0.00 0.00 176.83 176.05 2xah h HIS 394 N -0.90 0.97 0.00 2.24 3.86 -1.15 -2.75 115.15 117.42 2xah h HIS 394 Ca -0.00 -0.65 -0.12 0.00 -1.16 0.00 0.00 60.37 58.44 2xah h HIS 394 Cb 0.69 -0.06 -0.02 0.00 1.06 0.00 0.00 27.41 29.08 2xah h HIS 394 CO 0.17 1.49 -0.75 1.96 0.86 0.00 0.00 177.93 181.66 2xah h GLN 395 N 0.22 0.00 0.00 2.45 1.08 -1.25 -3.38 115.11 114.23 2xah h GLN 395 Ca -0.21 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.99 2xah h GLN 395 Cb 2.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 29.44 2xah h GLN 395 CO 0.25 0.67 -0.33 1.28 -0.95 0.00 0.00 178.83 179.75 2xah n LEU 396 N -4.54 0.52 -2.53 1.46 4.77 -1.15 -4.94 117.00 110.58 2xah n LEU 396 Ca -0.19 0.30 -0.19 0.00 -0.03 0.00 0.00 56.01 55.90 2xah n LEU 396 Cb 0.48 -0.30 0.03 0.00 -2.33 0.00 0.00 43.42 41.31 2xah n LEU 396 CO 0.18 -0.02 -0.02 -0.67 -1.33 0.00 0.00 177.39 175.53 2xah n ASP 397 N -1.85 -5.41 -4.52 -1.43 2.03 -0.88 -4.91 116.55 99.57 2xah n ASP 397 Ca 0.05 -0.23 -0.43 0.00 0.52 0.00 0.00 54.79 54.70 2xah n ASP 397 Cb 0.39 -4.26 -0.00 0.00 -0.72 0.00 0.00 41.12 36.52 2xah n ASP 397 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 2xah s PHE 398 N -3.07 3.06 0.00 -0.67 5.36 -1.03 -4.57 117.98 117.06 2xah s PHE 398 Ca 0.24 -1.74 0.00 0.00 -0.96 0.00 0.00 56.93 54.47 2xah s PHE 398 Cb -0.11 -4.55 0.00 0.00 -0.34 0.00 0.00 43.02 38.03 2xah s PHE 398 CO 0.30 -1.64 0.00 0.09 -1.46 0.00 0.00 175.22 172.51 2xah n ASN 399 N 7.24 4.20 -4.62 6.13 3.02 -1.26 -4.72 115.26 125.26 2xah n ASN 399 Ca 0.41 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.63 2xah n ASN 399 Cb 0.45 0.60 -0.10 0.00 -0.61 0.00 0.00 39.78 40.12 2xah n ASN 399 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2xah s VAL 400 N -1.77 3.87 -0.24 2.41 1.01 -1.26 -0.97 120.40 123.44 2xah s VAL 400 Ca 0.00 -0.53 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 2xah s VAL 400 Cb 0.00 -2.64 0.08 0.00 0.00 0.00 0.00 36.38 33.83 2xah s VAL 400 CO 0.00 0.51 0.11 -0.22 0.00 0.00 0.00 175.10 175.50 2xah s LEU 401 N -1.09 0.66 -1.09 3.92 2.96 0.20 -4.84 118.68 119.39 2xah s LEU 401 Ca 0.15 -1.05 -0.25 0.00 -0.22 0.00 0.00 54.13 52.76 2xah s LEU 401 Cb -0.11 -0.37 0.03 0.00 0.50 0.00 0.00 46.19 46.24 2xah s LEU 401 CO 0.04 -0.40 0.65 -0.46 -1.32 0.00 0.00 176.35 174.87 2xah n ASN 402 N 5.21 -4.29 0.00 3.68 0.23 -1.26 -3.17 115.26 115.67 2xah n ASN 402 Ca -0.06 -1.21 0.00 0.00 -0.53 0.00 0.00 54.58 52.77 2xah n ASN 402 Cb 0.45 -1.58 0.00 0.00 -2.08 0.00 0.00 39.78 36.57 2xah n ASN 402 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 2xah n ASN 403 N -2.27 0.00 -4.76 0.53 4.13 -1.26 -4.97 115.26 106.66 2xah n ASN 403 Ca -0.18 0.00 -0.40 0.00 1.68 0.00 0.00 54.58 55.68 2xah n ASN 403 Cb 0.60 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.78 2xah n ASN 403 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2xah s LYS 404 N 0.00 4.73 0.31 3.52 1.02 -1.19 -5.02 119.74 123.11 2xah s LYS 404 Ca 0.00 1.35 -0.30 0.00 0.02 0.00 0.00 55.97 57.04 2xah s LYS 404 Cb 0.00 -3.28 -0.11 0.00 -0.52 0.00 0.00 37.83 33.92 2xah s LYS 404 CO 0.00 0.53 1.56 -1.25 -0.92 0.00 0.00 175.35 175.27 2xah s PRO 405 N -1.11 4.13 0.15 -1.68 0.04 -1.26 -0.63 135.00 134.63 2xah s PRO 405 Ca 0.39 2.55 -0.30 0.00 0.04 0.00 0.00 61.00 63.68 2xah s PRO 405 Cb -0.25 -3.02 -0.08 0.00 0.04 0.00 0.00 34.50 31.20 2xah s PRO 405 CO 0.29 -0.59 1.29 0.08 0.04 0.00 0.00 177.00 178.11 2xah s VAL 406 N -0.23 3.46 0.61 -0.36 1.01 -0.14 -4.84 120.40 119.90 2xah s VAL 406 Ca 0.61 1.13 -0.05 0.00 0.00 0.00 0.00 61.98 63.67 2xah s VAL 406 Cb -0.47 -3.72 0.03 0.00 0.00 0.00 0.00 36.38 32.22 2xah s VAL 406 CO 0.51 0.13 0.90 -0.94 0.00 0.00 0.00 175.10 175.70 2xah s SER 407 N 0.65 5.32 0.21 3.32 1.04 -1.26 -2.65 113.70 120.32 2xah s SER 407 Ca 0.59 0.50 -0.10 0.00 0.48 0.00 0.00 55.95 57.42 2xah s SER 407 Cb -0.34 -1.39 0.22 0.00 0.10 0.00 0.00 66.02 64.60 2xah s SER 407 CO 0.34 -1.22 1.82 0.25 0.98 0.00 0.00 173.24 175.41 2xah h LEU 408 N -0.24 0.63 0.45 2.42 5.85 -1.49 -2.62 115.31 120.31 2xah h LEU 408 Ca -0.45 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.28 2xah h LEU 408 Cb 1.28 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 2xah h LEU 408 CO 0.59 0.42 -0.49 1.23 -0.34 0.00 0.00 178.44 179.85 2xah h GLY 409 N 0.76 -1.24 -0.91 3.75 0.00 -0.85 0.11 103.07 104.68 2xah h GLY 409 Ca 0.29 0.59 0.12 0.00 0.00 0.00 0.00 47.33 48.33 2xah h GLY 409 CO -0.15 -0.36 -0.46 1.46 0.00 0.00 0.00 176.54 177.02 2xah h GLN 410 N -0.95 -0.04 -0.19 4.80 4.20 -1.82 -1.55 115.11 119.57 2xah h GLN 410 Ca -0.06 0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.69 2xah h GLN 410 Cb 0.83 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.59 2xah h GLN 410 CO -0.08 -0.02 -0.00 0.00 -0.67 0.00 0.00 178.83 178.06 2xah h ALA 411 N 0.97 0.16 -0.70 3.87 0.00 -1.11 -0.40 119.26 122.04 2xah h ALA 411 Ca 0.26 0.05 0.15 0.00 0.00 0.00 0.00 54.91 55.37 2xah h ALA 411 Cb 0.53 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.29 2xah h ALA 411 CO -0.92 -0.44 0.09 -0.07 0.00 0.00 0.00 179.25 177.91 2xah h LEU 412 N 0.06 -0.14 0.58 0.00 3.38 0.02 -0.64 115.31 118.57 2xah h LEU 412 Ca 0.09 0.16 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 2xah h LEU 412 Cb 0.11 0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.11 2xah h LEU 412 CO -0.15 -0.09 -0.28 -0.33 0.09 0.00 0.00 178.44 177.69 2xah h GLU 413 N 0.19 -0.75 -1.43 1.13 5.08 -0.69 -0.61 114.58 117.50 2xah h GLU 413 Ca 0.39 0.05 0.41 0.00 -1.00 0.00 0.00 59.36 59.21 2xah h GLU 413 Cb 0.66 0.17 -0.06 0.00 0.50 0.00 0.00 28.75 30.02 2xah h GLU 413 CO -0.55 -0.50 1.24 0.28 -1.00 0.00 0.00 179.01 178.49 2xah h VAL 414 N -0.78 0.05 0.03 3.13 2.07 -0.78 0.36 116.25 120.34 2xah h VAL 414 Ca -0.08 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.32 2xah h VAL 414 Cb 0.59 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 2xah h VAL 414 CO 0.13 0.00 -0.64 0.58 0.02 0.00 0.00 177.57 177.66 2xah h VAL 415 N 0.00 1.41 -0.25 2.57 2.07 -0.73 -2.85 116.25 118.46 2xah h VAL 415 Ca 0.68 -2.32 0.04 0.00 0.82 0.00 0.00 66.70 65.92 2xah h VAL 415 Cb 3.16 2.94 -0.04 0.00 -1.52 0.00 0.00 31.29 35.83 2xah h VAL 415 CO -0.01 0.55 -0.00 0.40 0.02 0.00 0.00 177.57 178.52 2xah h ILE 416 N -0.85 0.81 -0.47 4.57 2.04 0.11 0.16 117.51 123.88 2xah h ILE 416 Ca -0.16 -0.02 0.05 0.00 1.00 0.00 0.00 64.86 65.73 2xah h ILE 416 Cb 1.25 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 38.00 2xah h ILE 416 CO -0.04 0.01 -0.42 1.56 0.00 0.00 0.00 178.15 179.27 2xah h GLN 417 N 0.07 -0.16 -0.46 2.37 4.20 -0.62 0.32 115.11 120.83 2xah h GLN 417 Ca 0.12 0.01 0.13 0.00 0.06 0.00 0.00 58.65 58.97 2xah h GLN 417 Cb 0.16 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.96 2xah h GLN 417 CO -0.21 -0.11 0.39 -0.07 -0.67 0.00 0.00 178.83 178.16 2xah h LEU 418 N -0.17 0.00 -0.01 1.46 4.07 -1.15 0.20 115.31 119.71 2xah h LEU 418 Ca 0.08 0.00 -0.10 0.00 0.08 0.00 0.00 57.88 57.93 2xah h LEU 418 Cb 0.38 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.12 2xah h LEU 418 CO -0.54 0.00 -0.40 1.56 -1.08 0.00 0.00 178.44 177.98 2xah h GLN 419 N 0.00 0.29 -0.40 1.13 1.08 0.23 -2.12 115.11 115.31 2xah h GLN 419 Ca 0.22 -0.30 0.08 0.00 -1.45 0.00 0.00 58.65 57.20 2xah h GLN 419 Cb 0.99 0.08 -0.08 0.00 -0.05 0.00 0.00 27.48 28.42 2xah h GLN 419 CO -0.00 0.99 -0.17 0.93 -0.95 0.00 0.00 178.83 179.63 2xah h GLU 420 N -0.29 -0.09 0.15 1.46 5.08 0.20 -2.30 114.58 118.79 2xah h GLU 420 Ca -0.05 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2xah h GLU 420 Cb 1.12 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 2xah h GLU 420 CO 0.08 -0.06 -0.31 -0.22 -1.00 0.00 0.00 179.01 177.50 2xah h LYS 421 N -0.09 -0.48 -1.01 2.33 3.64 -0.61 -2.21 116.57 118.14 2xah h LYS 421 Ca 0.20 0.03 0.22 0.00 -1.27 0.00 0.00 60.65 59.84 2xah h LYS 421 Cb 0.40 0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 32.21 2xah h LYS 421 CO -0.47 -0.32 0.60 1.25 -2.27 0.00 0.00 179.45 178.25 2xah h HIS 422 N -0.50 1.03 -0.46 1.91 2.76 -1.32 0.12 115.15 118.69 2xah h HIS 422 Ca -0.02 0.03 0.09 0.00 -2.20 0.00 0.00 60.37 58.28 2xah h HIS 422 Cb 0.48 -0.30 -0.09 0.00 1.55 0.00 0.00 27.41 29.05 2xah h HIS 422 CO -0.32 0.13 -0.12 0.28 -1.30 0.00 0.00 177.93 176.60 2xah h VAL 423 N 0.65 0.52 0.29 5.26 2.07 -0.81 -0.29 116.25 123.93 2xah h VAL 423 Ca 0.62 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 68.12 2xah h VAL 423 Cb 1.10 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2xah h VAL 423 CO -0.43 0.00 -0.14 0.11 0.02 0.00 0.00 177.57 177.13 2xah h LYS 424 N -0.01 -0.37 -0.20 1.57 1.57 -0.44 -2.27 116.57 116.41 2xah h LYS 424 Ca 0.22 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 59.11 2xah h LYS 424 Cb 0.35 0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 2xah h LYS 424 CO -0.48 -0.25 0.09 -0.25 -0.57 0.00 0.00 179.45 177.99 2xah n ASP 425 N -3.07 0.06 -0.06 0.86 10.43 -0.27 -0.82 116.55 123.68 2xah n ASP 425 Ca -0.05 0.33 -0.15 0.00 2.57 0.00 0.00 54.79 57.49 2xah n ASP 425 Cb 0.15 -0.16 -0.13 0.00 1.84 0.00 0.00 41.12 42.83 2xah n ASP 425 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 2xah h GLU 426 N 0.00 0.04 -0.27 -1.24 4.39 -0.73 -2.73 114.58 114.04 2xah h GLU 426 Ca 0.16 -0.06 0.06 0.00 0.34 0.00 0.00 59.36 59.87 2xah h GLU 426 Cb 0.42 0.02 -0.08 0.00 -0.10 0.00 0.00 28.75 29.02 2xah h GLU 426 CO -0.16 1.03 -0.29 1.96 -1.16 0.00 0.00 179.01 180.39 2xah h GLN 427 N -0.93 -0.27 -0.39 2.33 4.20 -0.40 -2.05 115.11 117.60 2xah h GLN 427 Ca -0.03 0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.74 2xah h GLN 427 Cb 1.09 0.06 -0.07 0.00 0.30 0.00 0.00 27.48 28.86 2xah h GLN 427 CO 0.01 -0.18 -0.43 0.82 -0.67 0.00 0.00 178.83 178.38 2xah h ILE 428 N -0.28 0.00 0.00 2.54 2.04 -1.21 -0.56 117.51 120.03 2xah h ILE 428 Ca 0.14 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.00 2xah h ILE 428 Cb 0.51 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 2xah h ILE 428 CO -0.43 0.00 0.00 -1.84 0.00 0.00 0.00 178.15 175.88 2xah n GLU 429 N -4.74 0.01 -0.01 2.37 -0.00 -1.03 -1.13 120.64 116.11 2xah n GLU 429 Ca -0.02 0.26 -0.17 0.00 -0.00 0.00 0.00 57.16 57.23 2xah n GLU 429 Cb 0.25 -1.50 -0.13 0.00 -0.00 0.00 0.00 31.44 30.06 2xah n GLU 429 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 2xah h HIS 430 N 0.00 0.31 -0.37 -1.84 2.76 -0.39 -2.91 115.15 112.71 2xah h HIS 430 Ca 0.00 -0.20 -0.11 0.00 -2.20 0.00 0.00 60.37 57.85 2xah h HIS 430 Cb 0.23 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.15 2xah h HIS 430 CO 0.00 1.09 -0.22 -1.49 -1.30 0.00 0.00 177.93 176.01 2xah h TRP 431 N -0.55 0.93 -0.91 5.26 4.06 -1.23 -2.60 115.95 120.91 2xah h TRP 431 Ca -0.06 -0.24 0.26 0.00 2.06 0.00 0.00 58.89 60.91 2xah h TRP 431 Cb 1.23 -0.21 -0.04 0.00 -1.00 0.00 0.00 29.16 29.14 2xah h TRP 431 CO 0.21 1.00 0.91 0.87 -3.56 0.00 0.00 178.44 177.87 2xah h LYS 432 N 0.59 0.00 0.15 0.49 1.57 -1.21 0.30 116.57 118.46 2xah h LYS 432 Ca 0.08 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.52 2xah h LYS 432 Cb 0.77 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.08 2xah h LYS 432 CO 0.06 0.00 -1.74 -0.22 -0.57 0.00 0.00 179.45 176.98 2xah h LYS 433 N 0.00 0.32 0.56 3.15 3.64 -1.26 -3.19 116.57 119.80 2xah h LYS 433 Ca 0.43 -0.54 -0.02 0.00 -1.27 0.00 0.00 60.65 59.25 2xah h LYS 433 Cb 2.25 0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 34.27 2xah h LYS 433 CO -0.00 1.21 -0.38 0.82 -2.27 0.00 0.00 179.45 178.82 2xah h ILE 434 N 0.09 0.23 -0.24 2.00 2.04 -0.13 -2.82 117.51 118.68 2xah h ILE 434 Ca -0.33 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.58 2xah h ILE 434 Cb 2.06 0.23 -0.05 0.00 -0.74 0.00 0.00 36.82 38.33 2xah h ILE 434 CO 0.15 0.00 -0.08 -0.37 0.00 0.00 0.00 178.15 177.86 2xah h VAL 435 N -0.91 0.72 -0.75 1.67 -1.51 -1.31 0.72 116.25 114.88 2xah h VAL 435 Ca -0.07 0.00 0.17 0.00 -1.23 0.00 0.00 66.70 65.57 2xah h VAL 435 Cb 0.75 0.72 -0.05 0.00 -2.13 0.00 0.00 31.29 30.58 2xah h VAL 435 CO 0.05 0.00 0.51 0.50 -1.23 0.00 0.00 177.57 177.40 2xah h LYS 436 N -0.03 0.28 0.02 5.19 3.64 -1.59 -2.64 116.57 121.44 2xah h LYS 436 Ca 0.12 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.33 2xah h LYS 436 Cb 0.21 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 2xah h LYS 436 CO -0.26 0.19 -0.82 1.15 -2.27 0.00 0.00 179.45 177.44 2xah h THR 437 N 0.29 1.26 0.00 1.00 2.02 -0.96 -2.94 112.91 113.58 2xah h THR 437 Ca 0.37 -2.28 0.00 0.00 0.77 0.00 0.00 66.41 65.27 2xah h THR 437 Cb 1.02 2.73 0.00 0.00 -1.74 0.00 0.00 68.15 70.16 2xah h THR 437 CO -0.09 0.48 0.00 1.67 0.37 0.00 0.00 175.52 177.95 2xah n GLN 438 N -4.42 0.22 0.00 6.66 -0.06 0.24 -1.74 117.38 118.28 2xah n GLN 438 Ca -0.23 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.77 2xah n GLN 438 Cb 0.64 -1.31 0.00 0.00 -4.06 0.00 0.00 30.24 25.52 2xah n GLN 438 CO 0.00 0.00 0.00 -1.91 -0.20 0.00 0.00 177.06 174.95 2xah n GLU 439 N 0.74 2.01 -0.02 3.69 2.13 -1.02 -4.28 120.64 123.90 2xah n GLU 439 Ca 0.00 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.78 2xah n GLU 439 Cb 0.09 -0.17 0.19 0.00 0.27 0.00 0.00 31.44 31.82 2xah n GLU 439 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 2xah h GLU 440 N 0.00 0.57 -0.23 5.31 4.81 -1.17 -3.06 114.58 120.82 2xah h GLU 440 Ca 0.00 -0.20 -0.06 0.00 -0.13 0.00 0.00 59.36 58.98 2xah h GLU 440 Cb 0.00 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2xah h GLU 440 CO 0.00 0.73 -0.08 1.25 -0.73 0.00 0.00 179.01 180.18 2xah h LEU 441 N 0.51 0.46 0.14 1.64 5.85 -1.58 -2.43 115.31 119.90 2xah h LEU 441 Ca 0.08 -0.38 0.00 0.00 0.84 0.00 0.00 57.88 58.42 2xah h LEU 441 Cb 0.62 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2xah h LEU 441 CO 0.04 0.74 -0.36 0.50 -0.34 0.00 0.00 178.44 179.03 2xah h LYS 442 N 0.18 -0.53 -1.14 1.25 3.64 -1.74 -0.70 116.57 117.54 2xah h LYS 442 Ca 0.06 0.04 0.32 0.00 -1.27 0.00 0.00 60.65 59.79 2xah h LYS 442 Cb 0.55 0.12 -0.09 0.00 -0.41 0.00 0.00 32.23 32.41 2xah h LYS 442 CO 0.03 -0.35 0.76 0.93 -2.27 0.00 0.00 179.45 178.54 2xah h GLU 443 N -0.55 0.22 -0.10 1.90 5.08 -1.47 0.83 114.58 120.49 2xah h GLU 443 Ca -0.01 -0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.24 2xah h GLU 443 Cb 0.53 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.74 2xah h GLU 443 CO -0.17 0.15 -0.31 1.25 -1.00 0.00 0.00 179.01 178.93 2xah h LEU 444 N 0.23 0.44 -1.10 1.33 5.85 -1.06 -2.58 115.31 118.42 2xah h LEU 444 Ca 0.62 -0.61 0.04 0.00 0.84 0.00 0.00 57.88 58.78 2xah h LEU 444 Cb 1.92 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 42.77 2xah h LEU 444 CO -0.23 0.97 0.61 -0.07 -0.34 0.00 0.00 178.44 179.38 2xah h LEU 445 N -0.06 0.99 0.11 2.25 3.38 0.64 0.19 115.31 122.81 2xah h LEU 445 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2xah h LEU 445 Cb 0.93 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 2xah h LEU 445 CO 0.07 0.67 -0.10 0.78 0.09 0.00 0.00 178.44 179.94 2xah h ASN 446 N 1.14 -0.27 -0.66 -0.43 4.21 -1.12 0.12 115.58 118.58 2xah h ASN 446 Ca 0.38 0.03 0.08 0.00 1.21 0.00 0.00 56.30 57.99 2xah h ASN 446 Cb 0.05 0.10 -0.06 0.00 -1.12 0.00 0.00 38.32 37.29 2xah h ASN 446 CO -0.12 -0.16 0.32 0.50 -1.29 0.00 0.00 177.43 176.68 2xah h LYS 447 N -0.23 0.56 -0.85 0.81 3.64 -1.03 -2.69 116.57 116.77 2xah h LYS 447 Ca 0.00 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.32 2xah h LYS 447 Cb 0.22 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 2xah h LYS 447 CO -0.03 0.37 0.41 0.52 -2.27 0.00 0.00 179.45 178.46 2xah h MET 448 N 0.58 1.21 0.91 1.90 2.86 0.17 -2.11 114.93 120.46 2xah h MET 448 Ca 0.31 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.74 2xah h MET 448 Cb 0.29 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 31.73 2xah h MET 448 CO -0.24 0.93 -0.49 0.28 1.06 0.00 0.00 176.91 178.45 2xah h VAL 449 N 1.20 0.02 -0.33 -2.22 2.07 -0.47 -2.07 116.25 114.45 2xah h VAL 449 Ca 0.29 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.91 2xah h VAL 449 Cb 0.11 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.88 2xah h VAL 449 CO -0.04 0.00 0.60 0.78 0.02 0.00 0.00 177.57 178.93 2xah h ASN 450 N -1.28 0.00 0.00 0.57 4.21 -1.38 0.20 115.58 117.89 2xah h ASN 450 Ca -0.12 0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.28 2xah h ASN 450 Cb 1.00 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 38.19 2xah h ASN 450 CO 0.17 0.00 -0.58 0.25 -1.29 0.00 0.00 177.43 175.98 2xah h LEU 451 N 0.00 0.00 -1.68 1.61 5.85 -1.25 -2.82 115.31 117.02 2xah h LEU 451 Ca 0.16 -0.73 0.05 0.00 0.84 0.00 0.00 57.88 58.20 2xah h LEU 451 Cb 1.36 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.38 2xah h LEU 451 CO -0.00 1.20 0.50 0.50 -0.34 0.00 0.00 178.44 180.30 2xah h LYS 452 N -1.00 0.00 0.23 1.25 3.64 -0.42 0.20 116.57 120.47 2xah h LYS 452 Ca -0.16 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.21 2xah h LYS 452 Cb 1.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2xah h LYS 452 CO -0.10 0.00 -0.11 1.49 -2.27 0.00 0.00 179.45 178.46 2xah h GLU 453 N 0.00 -0.30 -0.97 1.90 4.57 -0.68 -2.30 114.58 116.80 2xah h GLU 453 Ca 0.08 0.02 0.15 0.00 -1.18 0.00 0.00 59.36 58.43 2xah h GLU 453 Cb 1.08 0.07 -0.09 0.00 -0.16 0.00 0.00 28.75 29.66 2xah h GLU 453 CO -0.00 -0.20 0.61 0.87 -1.18 0.00 0.00 179.01 179.11 2xah h LYS 454 N -1.06 0.77 0.52 1.92 1.57 -1.05 -2.39 116.57 116.85 2xah h LYS 454 Ca -0.03 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 2xah h LYS 454 Cb 0.24 -0.17 0.01 0.00 0.08 0.00 0.00 32.23 32.38 2xah h LYS 454 CO 0.05 0.51 -0.25 0.82 -0.57 0.00 0.00 179.45 180.02 2xah h ILE 455 N 0.80 0.48 -0.76 1.86 2.04 -0.72 0.03 117.51 121.24 2xah h ILE 455 Ca 0.51 -0.09 0.15 0.00 1.00 0.00 0.00 64.86 66.42 2xah h ILE 455 Cb 0.73 0.52 -0.14 0.00 -0.74 0.00 0.00 36.82 37.19 2xah h ILE 455 CO -0.27 0.02 -0.24 0.50 0.00 0.00 0.00 178.15 178.16 2xah h LYS 456 N -0.76 -0.03 -0.20 2.37 3.64 -0.90 -0.48 116.57 120.22 2xah h LYS 456 Ca -0.07 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.16 2xah h LYS 456 Cb 0.56 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 2xah h LYS 456 CO 0.12 -0.02 -0.51 1.49 -2.27 0.00 0.00 179.45 178.26 2xah h GLU 457 N -0.03 0.55 -0.20 1.90 4.81 -1.41 -2.98 114.58 117.22 2xah h GLU 457 Ca 0.35 -0.33 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 2xah h GLU 457 Cb 0.57 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.97 2xah h GLU 457 CO -0.80 0.93 -0.29 -0.07 -0.73 0.00 0.00 179.01 178.05 2xah h LEU 458 N 0.43 0.39 -0.12 1.64 3.38 0.39 -2.08 115.31 119.34 2xah h LEU 458 Ca 0.02 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 2xah h LEU 458 Cb 1.04 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 2xah h LEU 458 CO 0.10 0.67 0.04 -0.74 0.09 0.00 0.00 178.44 178.59 2xah h HIS 459 N 0.34 0.19 -0.54 1.13 2.76 -1.09 -1.30 115.15 116.64 2xah h HIS 459 Ca 0.05 -0.02 0.06 0.00 -2.20 0.00 0.00 60.37 58.26 2xah h HIS 459 Cb 0.68 -0.06 -0.09 0.00 1.55 0.00 0.00 27.41 29.50 2xah h HIS 459 CO 0.02 0.32 -0.55 0.37 -1.30 0.00 0.00 177.93 176.79 2xah h GLN 460 N 0.02 -0.29 -0.29 5.26 5.75 -1.39 0.50 115.11 124.66 2xah h GLN 460 Ca 0.04 0.02 0.07 0.00 -0.15 0.00 0.00 58.65 58.63 2xah h GLN 460 Cb 0.21 0.07 -0.07 0.00 1.07 0.00 0.00 27.48 28.75 2xah h GLN 460 CO -0.00 -0.19 -0.22 1.96 -2.65 0.00 0.00 178.83 177.72 2xah h GLN 461 N -0.30 -0.19 -0.50 1.69 4.20 -1.18 -0.23 115.11 118.59 2xah h GLN 461 Ca 0.10 0.01 0.04 0.00 0.06 0.00 0.00 58.65 58.86 2xah h GLN 461 Cb 0.56 0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.34 2xah h GLN 461 CO -0.67 -0.13 0.27 -0.92 -0.67 0.00 0.00 178.83 176.71 2xah h TYR 462 N -0.20 0.50 -0.12 2.96 5.03 -0.87 -1.87 116.97 122.40 2xah h TYR 462 Ca 0.16 0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.52 2xah h TYR 462 Cb 0.44 -0.15 -0.04 0.00 1.55 0.00 0.00 36.73 38.53 2xah h TYR 462 CO -0.40 0.26 -0.11 -0.22 -1.32 0.00 0.00 178.16 176.37 2xah h LYS 463 N 0.53 -0.13 -0.03 1.82 1.63 0.11 -0.49 116.57 120.01 2xah h LYS 463 Ca 0.21 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.03 2xah h LYS 463 Cb 0.09 0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 31.74 2xah h LYS 463 CO -0.13 -0.08 0.03 0.93 -3.45 0.00 0.00 179.45 176.75 2xah h GLU 464 N -0.13 0.00 0.00 1.90 5.08 -0.83 -0.28 114.58 120.31 2xah h GLU 464 Ca 0.08 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.37 2xah h GLU 464 Cb 0.25 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 2xah h GLU 464 CO -0.20 0.00 -0.60 0.00 -1.00 0.00 0.00 179.01 177.21 2xah h ALA 465 N 1.97 0.73 0.02 3.43 0.00 -0.54 -3.27 119.26 121.60 2xah h ALA 465 Ca 0.02 -0.35 -0.20 0.00 0.00 0.00 0.00 54.91 54.37 2xah h ALA 465 Cb 0.07 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2xah h ALA 465 CO -0.00 0.44 -0.92 0.77 0.00 0.00 0.00 179.25 179.54 2xah h SER 466 N 0.00 0.18 0.82 0.00 0.02 0.52 -3.33 113.55 111.77 2xah h SER 466 Ca -0.03 -0.16 -0.07 0.00 -0.84 0.00 0.00 61.79 60.69 2xah h SER 466 Cb 1.28 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 2xah h SER 466 CO 0.04 1.00 -0.34 -0.33 -1.14 0.00 0.00 176.83 176.06 2xah h GLU 467 N 0.07 0.00 -5.34 3.45 4.39 -1.37 -3.39 114.58 112.38 2xah h GLU 467 Ca -0.04 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.36 2xah h GLU 467 Cb 1.58 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.20 2xah h GLU 467 CO 0.13 0.34 1.17 0.28 -1.16 0.00 0.00 179.01 179.78 2xah n VAL 468 N -3.54 -0.03 -2.07 3.13 0.31 -1.24 -4.90 118.33 109.99 2xah n VAL 468 Ca -0.00 -0.54 -0.38 0.00 -0.01 0.00 0.00 64.34 63.41 2xah n VAL 468 Cb 0.48 -1.78 0.01 0.00 -0.91 0.00 0.00 33.84 31.64 2xah n VAL 468 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2xah s LYS 469 N 8.44 3.55 0.84 5.55 -0.14 -1.26 -4.98 119.74 131.74 2xah s LYS 469 Ca 1.07 1.97 -0.12 0.00 -1.36 0.00 0.00 55.97 57.53 2xah s LYS 469 Cb -0.43 -2.38 0.11 0.00 -1.68 0.00 0.00 37.83 33.46 2xah s LYS 469 CO 0.28 -0.78 1.20 -1.25 -0.76 0.00 0.00 175.35 174.04 2xah s PRO 470 N -2.74 1.63 0.29 -1.68 0.04 -1.26 -4.69 135.00 126.60 2xah s PRO 470 Ca 0.66 -0.09 -0.28 0.00 0.04 0.00 0.00 61.00 61.33 2xah s PRO 470 Cb -0.33 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 2xah s PRO 470 CO 0.40 -1.77 0.98 -1.25 0.04 0.00 0.00 177.00 175.40 2xah s PRO 471 N -5.62 4.65 0.26 0.56 0.04 -1.26 -5.19 135.00 128.44 2xah s PRO 471 Ca 0.65 1.49 0.11 0.00 0.04 0.00 0.00 61.00 63.30 2xah s PRO 471 Cb -0.09 -3.02 -0.05 0.00 0.04 0.00 0.00 34.50 31.39 2xah s PRO 471 CO 0.49 0.31 -0.17 -0.98 0.04 0.00 0.00 177.00 176.69 2xah s ARG 472 N -1.67 1.77 0.73 4.56 1.70 -1.26 -5.13 118.95 119.64 2xah s ARG 472 Ca 0.47 -1.65 -0.11 0.00 -0.47 0.00 0.00 55.73 53.97 2xah s ARG 472 Cb -0.24 -1.86 0.03 0.00 -0.57 0.00 0.00 34.95 32.31 2xah s ARG 472 CO 0.30 0.35 1.10 0.16 -1.08 0.00 0.00 175.30 176.14 2xah s ASP 473 N -3.35 5.16 0.46 -2.89 1.47 -1.26 -4.85 116.67 111.40 2xah s ASP 473 Ca 0.28 0.97 0.13 0.00 1.18 0.00 0.00 52.55 55.12 2xah s ASP 473 Cb -0.06 -1.69 1.05 0.00 -0.34 0.00 0.00 42.92 41.88 2xah s ASP 473 CO 0.15 -1.50 2.06 -0.29 0.68 0.00 0.00 175.17 176.27 2xah h ILE 474 N -0.74 1.08 -0.17 2.11 6.09 -2.00 -1.87 117.51 122.01 2xah h ILE 474 Ca -0.45 -0.29 -0.12 0.00 -1.37 0.00 0.00 64.86 62.63 2xah h ILE 474 Cb 1.28 1.00 -0.01 0.00 0.47 0.00 0.00 36.82 39.56 2xah h ILE 474 CO 0.64 0.10 -0.40 0.71 -3.07 0.00 0.00 178.15 176.13 2xah h THR 475 N 0.15 1.30 0.00 2.19 1.35 -1.98 0.10 112.91 116.02 2xah h THR 475 Ca 0.04 -1.53 -0.02 0.00 -0.55 0.00 0.00 66.41 64.34 2xah h THR 475 Cb 0.12 1.62 -0.00 0.00 -1.73 0.00 0.00 68.15 68.15 2xah h THR 475 CO 0.00 0.47 -0.10 0.00 -0.25 0.00 0.00 175.52 175.64 2xah h ALA 476 N 1.26 0.95 0.16 6.62 0.00 -1.73 -1.98 119.26 124.54 2xah h ALA 476 Ca 0.03 -0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.61 2xah h ALA 476 Cb 0.84 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.64 2xah h ALA 476 CO 0.07 0.13 -1.01 1.49 0.00 0.00 0.00 179.25 179.93 2xah h GLU 477 N 0.00 0.40 -0.80 0.00 4.57 -0.94 -3.17 114.58 114.65 2xah h GLU 477 Ca -0.00 -0.65 0.08 0.00 -1.18 0.00 0.00 59.36 57.61 2xah h GLU 477 Cb 0.93 0.23 -0.07 0.00 -0.16 0.00 0.00 28.75 29.69 2xah h GLU 477 CO 0.01 1.30 0.47 0.35 -1.18 0.00 0.00 179.01 179.96 2xah h PHE 478 N -0.16 0.86 -0.22 0.92 3.57 -0.80 -1.92 116.94 119.19 2xah h PHE 478 Ca -0.17 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.40 2xah h PHE 478 Cb 1.78 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 40.21 2xah h PHE 478 CO 0.17 0.39 -0.01 1.25 -2.23 0.00 0.00 178.31 177.88 2xah h LEU 479 N 0.82 -0.11 0.08 0.59 5.85 -1.39 0.81 115.31 121.97 2xah h LEU 479 Ca 0.37 0.05 0.01 0.00 0.84 0.00 0.00 57.88 59.15 2xah h LEU 479 Cb 0.26 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2xah h LEU 479 CO -0.21 -0.03 -0.16 0.58 -0.34 0.00 0.00 178.44 178.29 2xah h VAL 480 N 0.05 0.64 0.54 1.05 2.07 -1.41 -1.80 116.25 117.40 2xah h VAL 480 Ca 0.10 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 2xah h VAL 480 Cb 0.14 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 2xah h VAL 480 CO -0.18 0.00 -0.50 0.11 0.02 0.00 0.00 177.57 177.02 2xah h LYS 481 N -0.30 -0.99 0.00 1.57 1.79 -0.84 -1.24 116.57 116.56 2xah h LYS 481 Ca 0.03 0.07 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 2xah h LYS 481 Cb 0.32 0.22 0.00 0.00 -1.58 0.00 0.00 32.23 31.20 2xah h LYS 481 CO -0.09 -0.66 0.00 0.45 -1.08 0.00 0.00 179.45 178.07 2xah n SER 482 N -5.47 0.00 -0.35 0.86 2.88 0.28 -0.38 113.62 111.44 2xah n SER 482 Ca -0.12 0.85 0.35 0.00 -1.33 0.00 0.00 58.87 58.62 2xah n SER 482 Cb 0.46 -0.36 0.73 0.00 -0.75 0.00 0.00 64.21 64.29 2xah n SER 482 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2xah h LYS 483 N 0.00 0.04 0.31 -1.46 1.79 -1.29 -0.13 116.57 115.83 2xah h LYS 483 Ca 0.00 -0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 2xah h LYS 483 Cb 0.00 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 2xah h LYS 483 CO 0.00 0.03 -0.15 1.25 -1.08 0.00 0.00 179.45 179.50 2xah h HIS 484 N 0.05 -0.38 0.43 -1.35 2.76 0.55 -1.05 115.15 116.16 2xah h HIS 484 Ca 0.59 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.74 2xah h HIS 484 Cb 2.27 0.13 -0.02 0.00 1.55 0.00 0.00 27.41 31.33 2xah h HIS 484 CO -0.00 -0.05 -0.49 -0.09 -1.30 0.00 0.00 177.93 176.00 2xah h ARG 485 N -0.78 -0.90 -1.55 5.26 2.43 -0.01 -1.90 114.38 116.94 2xah h ARG 485 Ca -0.04 0.06 0.51 0.00 -0.81 0.00 0.00 59.98 59.69 2xah h ARG 485 Cb 0.51 0.20 -0.12 0.00 -0.42 0.00 0.00 29.97 30.14 2xah h ARG 485 CO 0.07 -0.60 1.03 -0.44 -1.51 0.00 0.00 179.97 178.52 2xah h ASP 486 N -0.94 0.14 0.18 -3.80 5.19 -1.23 0.31 116.42 116.28 2xah h ASP 486 Ca -0.05 0.11 -0.26 0.00 -0.62 0.00 0.00 57.03 56.21 2xah h ASP 486 Cb 0.82 0.12 0.03 0.00 0.18 0.00 0.00 39.33 40.48 2xah h ASP 486 CO -0.09 -0.19 -1.14 0.25 -3.12 0.00 0.00 179.24 174.95 2xah h LEU 487 N 0.00 0.68 -0.90 1.55 5.85 -0.47 -3.06 115.31 118.97 2xah h LEU 487 Ca 0.90 -0.92 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 2xah h LEU 487 Cb 3.10 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 43.89 2xah h LEU 487 CO -0.35 1.55 0.06 0.71 -0.34 0.00 0.00 178.44 180.07 2xah h THR 488 N -0.07 1.24 -0.61 1.05 1.35 0.27 -1.89 112.91 114.26 2xah h THR 488 Ca -0.20 -0.97 0.13 0.00 -0.55 0.00 0.00 66.41 64.82 2xah h THR 488 Cb 1.89 0.77 -0.10 0.00 -1.73 0.00 0.00 68.15 68.98 2xah h THR 488 CO 0.22 0.35 0.02 0.00 -0.25 0.00 0.00 175.52 175.86 2xah h ALA 489 N 1.24 0.62 -0.00 6.62 0.00 -1.14 0.19 119.26 126.78 2xah h ALA 489 Ca 0.17 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.25 2xah h ALA 489 Cb 0.41 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2xah h ALA 489 CO 0.01 -0.38 -0.01 1.28 0.00 0.00 0.00 179.25 180.15 2xah n LEU 490 N -5.25 0.26 -0.07 0.00 4.77 -1.01 -2.64 117.00 113.06 2xah n LEU 490 Ca 0.09 -0.04 -0.03 0.00 -0.03 0.00 0.00 56.01 56.00 2xah n LEU 490 Cb 0.35 -0.05 -0.16 0.00 -2.33 0.00 0.00 43.42 41.23 2xah n LEU 490 CO 0.12 0.04 -1.01 0.00 -1.33 0.00 0.00 177.39 175.21 2xah h LYS 492 N 0.00 -0.45 0.44 0.00 3.64 -0.55 -2.64 116.57 117.00 2xah h LYS 492 Ca -0.36 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.04 2xah h LYS 492 Cb 1.81 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 33.73 2xah h LYS 492 CO 0.02 -0.30 -0.34 0.93 -2.27 0.00 0.00 179.45 177.49 2xah h GLU 493 N -0.47 -0.72 0.00 1.90 5.08 -1.66 0.25 114.58 118.96 2xah h GLU 493 Ca -0.03 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 2xah h GLU 493 Cb 0.39 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2xah h GLU 493 CO 0.03 -0.48 0.00 0.98 -1.00 0.00 0.00 179.01 178.54 2xah n TYR 494 N -4.48 0.00 -0.12 4.33 9.36 -1.22 -0.83 117.16 124.20 2xah n TYR 494 Ca -0.09 0.00 -0.17 0.00 3.32 0.00 0.00 57.90 60.96 2xah n TYR 494 Cb 0.33 0.00 -0.12 0.00 -0.63 0.00 0.00 39.34 38.92 2xah n TYR 494 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2xah n ASP 495 N -0.62 1.88 0.23 2.98 8.00 -0.01 -3.82 116.55 125.19 2xah n ASP 495 Ca 0.01 -0.12 0.09 0.00 0.71 0.00 0.00 54.79 55.48 2xah n ASP 495 Cb 0.00 -0.27 0.57 0.00 -0.02 0.00 0.00 41.12 41.40 2xah n ASP 495 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2xah h GLU 496 N 0.00 0.00 0.14 -1.24 5.08 -0.05 -2.15 114.58 116.36 2xah h GLU 496 Ca -0.56 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.52 2xah h GLU 496 Cb 1.90 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.16 2xah h GLU 496 CO -0.08 0.21 -1.25 -0.07 -1.00 0.00 0.00 179.01 176.82 2xah h LEU 497 N 0.00 0.57 -1.67 1.33 4.07 -1.36 -2.34 115.31 115.92 2xah h LEU 497 Ca -0.00 -0.58 -0.04 0.00 0.08 0.00 0.00 57.88 57.33 2xah h LEU 497 Cb 0.50 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.05 2xah h LEU 497 CO 0.03 1.44 -0.19 0.00 -1.08 0.00 0.00 178.44 178.63 2xah h ALA 498 N 0.48 1.38 -2.07 1.53 0.00 -1.63 0.69 119.26 119.65 2xah h ALA 498 Ca -0.16 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2xah h ALA 498 Cb 1.96 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2xah h ALA 498 CO 0.22 0.24 0.00 -1.91 0.00 0.00 0.00 179.25 177.80 2xah n GLU 499 N -3.87 0.00 -0.24 0.00 4.07 -0.82 -2.43 120.64 117.35 2xah n GLU 499 Ca -0.02 0.17 0.00 0.00 -0.06 0.00 0.00 57.16 57.25 2xah n GLU 499 Cb 0.29 -1.16 0.04 0.00 -0.06 0.00 0.00 31.44 30.55 2xah n GLU 499 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 2xah n THR 500 N -0.98 -0.32 -0.31 6.31 -1.04 -0.89 0.05 114.28 117.11 2xah n THR 500 Ca 0.00 1.47 0.11 0.00 -2.04 0.00 0.00 64.05 63.59 2xah n THR 500 Cb 0.00 -1.96 0.28 0.00 -1.82 0.00 0.00 70.33 66.83 2xah n THR 500 CO 0.00 0.00 0.00 -0.61 -0.64 0.00 0.00 175.07 173.82 2xah h GLN 501 N 0.00 0.55 -0.64 -2.82 4.15 -0.88 -2.15 115.11 113.31 2xah h GLN 501 Ca 0.24 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.58 2xah h GLN 501 Cb 0.40 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 2xah h GLN 501 CO -0.63 0.36 0.22 0.78 -1.93 0.00 0.00 178.83 177.63 2xah h GLY 502 N 0.56 1.06 0.97 2.39 0.00 -0.03 -2.19 103.07 105.84 2xah h GLY 502 Ca 0.53 -0.61 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 2xah h GLY 502 CO -0.43 0.58 -0.28 0.50 0.00 0.00 0.00 176.54 176.90 2xah h LYS 503 N 0.92 -0.74 0.00 4.80 1.57 -1.27 -2.78 116.57 119.07 2xah h LYS 503 Ca 0.21 0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2xah h LYS 503 Cb 0.27 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 2xah h LYS 503 CO -0.01 -0.49 -0.01 -0.07 -0.57 0.00 0.00 179.45 178.29 2xah h LEU 504 N -0.77 0.00 0.00 2.94 3.38 -1.42 -0.72 115.31 118.72 2xah h LEU 504 Ca -0.07 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.74 2xah h LEU 504 Cb 0.60 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 2xah h LEU 504 CO 0.11 0.01 -0.98 -0.33 0.09 0.00 0.00 178.44 177.34 2xah h GLU 505 N 0.00 0.00 0.12 1.13 5.08 -1.22 -3.31 114.58 116.38 2xah h GLU 505 Ca -0.00 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 2xah h GLU 505 Cb 0.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2xah h GLU 505 CO 0.00 0.50 -1.74 1.05 -1.00 0.00 0.00 179.01 177.82 2xah h GLU 506 N 0.00 0.26 0.00 2.33 4.11 -1.17 -3.26 114.58 116.84 2xah h GLU 506 Ca -0.08 -0.44 0.00 0.00 0.07 0.00 0.00 59.36 58.91 2xah h GLU 506 Cb 1.55 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.97 2xah h GLU 506 CO 0.07 1.21 0.00 1.17 0.07 0.00 0.00 179.01 181.53 2xah n LYS 507 N -3.72 0.00 0.00 1.06 4.81 -0.32 -0.69 118.16 119.31 2xah n LYS 507 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.15 2xah n LYS 507 Cb 0.98 -1.34 0.00 0.00 0.02 0.00 0.00 35.03 34.68 2xah n LYS 507 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 2xah n LEU 508 N -0.63 0.00 0.04 3.14 0.00 -1.24 -3.90 117.00 114.41 2xah n LEU 508 Ca 0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 56.01 55.79 2xah n LEU 508 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 43.42 43.33 2xah n LEU 508 CO 0.00 0.00 -0.18 1.56 0.00 0.00 0.00 177.39 178.77 2xah h GLN 509 N 0.00 0.00 0.00 1.96 4.20 -0.95 -3.17 115.11 117.15 2xah h GLN 509 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2xah h GLN 509 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2xah h GLN 509 CO 0.00 0.47 0.00 -1.91 -0.67 0.00 0.00 178.83 176.72 2xah n GLU 510 N -3.04 0.00 -0.31 1.46 4.07 -0.13 -2.30 120.64 120.38 2xah n GLU 510 Ca -0.08 0.01 0.16 0.00 -0.06 0.00 0.00 57.16 57.18 2xah n GLU 510 Cb 0.89 -0.51 0.34 0.00 -0.06 0.00 0.00 31.44 32.10 2xah n GLU 510 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2xah h LEU 511 N 0.00 0.19 0.00 4.31 3.38 -1.75 0.18 115.31 121.62 2xah h LEU 511 Ca 0.00 0.19 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2xah h LEU 511 Cb 0.00 0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2xah h LEU 511 CO 0.00 -0.12 0.00 1.21 0.09 0.00 0.00 178.44 179.62 2xah n GLU 512 N -5.15 0.49 -0.06 1.13 2.13 -1.20 -3.22 120.64 114.76 2xah n GLU 512 Ca 0.24 0.05 -0.05 0.00 0.66 0.00 0.00 57.16 58.06 2xah n GLU 512 Cb 0.75 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.84 2xah n GLU 512 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2xah n ALA 513 N -1.14 1.78 -3.62 4.31 0.00 0.63 -4.71 120.51 117.76 2xah n ALA 513 Ca 0.13 -0.90 -0.35 0.00 0.00 0.00 0.00 53.44 52.32 2xah n ALA 513 Cb 0.12 -0.14 -0.07 0.00 0.00 0.00 0.00 19.45 19.36 2xah n ALA 513 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2xah n ASN 514 N -2.48 4.20 -4.81 0.00 6.94 -1.20 -5.09 115.26 112.83 2xah n ASN 514 Ca -0.21 -3.17 -0.32 0.00 -0.02 0.00 0.00 54.58 50.86 2xah n ASN 514 Cb 0.90 -1.02 0.03 0.00 -2.36 0.00 0.00 39.78 37.33 2xah n ASN 514 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 2xah s PRO 515 N -1.52 3.07 1.23 -0.53 0.04 -1.26 -4.95 135.00 131.08 2xah s PRO 515 Ca 0.28 1.06 -0.21 0.00 0.04 0.00 0.00 61.00 62.18 2xah s PRO 515 Cb -0.05 -2.01 0.31 0.00 0.04 0.00 0.00 34.50 32.79 2xah s PRO 515 CO -0.11 -1.00 1.06 -0.35 0.04 0.00 0.00 177.00 176.64 2xah n PRO 516 N -2.69 -3.26 -2.42 0.56 -0.04 -1.26 -5.00 135.00 120.90 2xah n PRO 516 Ca 0.08 -1.71 -0.34 0.00 -0.04 0.00 0.00 63.50 61.49 2xah n PRO 516 Cb 0.53 -1.64 -0.02 0.00 -0.04 0.00 0.00 33.50 32.33 2xah n PRO 516 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2xah s SER 517 N -4.32 6.17 0.02 3.54 0.01 -1.26 -4.98 113.70 112.88 2xah s SER 517 Ca 0.70 1.94 -0.19 0.00 1.31 0.00 0.00 55.95 59.71 2xah s SER 517 Cb -0.07 -2.56 -0.19 0.00 0.21 0.00 0.00 66.02 63.41 2xah s SER 517 CO 0.54 -0.90 1.19 -0.78 0.41 0.00 0.00 173.24 173.70 2xah h ASP 518 N 1.32 0.52 -4.78 2.44 1.82 -1.95 -3.46 116.42 112.32 2xah h ASP 518 Ca -0.49 -0.66 -0.19 0.00 -0.39 0.00 0.00 57.03 55.30 2xah h ASP 518 Cb 1.23 -0.15 -0.22 0.00 0.68 0.00 0.00 39.33 40.86 2xah h ASP 518 CO 0.58 1.10 -0.71 0.68 -1.61 0.00 0.00 179.24 179.28 2xah s VAL 519 N -3.59 0.15 0.04 2.25 -7.23 -1.26 -5.00 120.40 105.76 2xah s VAL 519 Ca -0.13 -0.80 -0.27 0.00 -1.81 0.00 0.00 61.98 58.96 2xah s VAL 519 Cb 0.04 -0.27 -0.17 0.00 0.56 0.00 0.00 36.38 36.55 2xah s VAL 519 CO 0.80 -0.41 1.45 0.22 -0.31 0.00 0.00 175.10 176.85 2xah h TYR 520 N 4.85 -0.46 -2.93 2.82 3.20 -1.90 -3.46 116.97 119.08 2xah h TYR 520 Ca -0.31 -0.01 -0.14 0.00 3.14 0.00 0.00 58.73 61.40 2xah h TYR 520 Cb 1.21 0.15 -0.25 0.00 1.54 0.00 0.00 36.73 39.39 2xah h TYR 520 CO 0.62 -0.19 -0.33 -0.51 -1.64 0.00 0.00 178.16 176.11 2xah s LEU 521 N -9.80 0.73 0.00 2.82 1.43 -1.26 -5.07 118.68 107.54 2xah s LEU 521 Ca -0.15 0.65 -0.07 0.00 -1.03 0.00 0.00 54.13 53.53 2xah s LEU 521 Cb 0.03 1.14 0.10 0.00 0.03 0.00 0.00 46.19 47.49 2xah s LEU 521 CO 0.59 -0.13 0.49 -1.54 0.23 0.00 0.00 176.35 176.00 2xah n SER 522 N 2.85 -0.36 0.08 2.29 3.41 -1.26 -4.73 113.62 115.90 2xah n SER 522 Ca -0.13 -1.07 -0.07 0.00 -0.26 0.00 0.00 58.87 57.33 2xah n SER 522 Cb 0.58 -0.40 -0.05 0.00 -0.26 0.00 0.00 64.21 64.08 2xah n SER 522 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2xah h SER 523 N -0.95 0.09 0.11 4.04 0.02 -2.02 -1.63 113.55 113.21 2xah h SER 523 Ca -0.17 -0.09 -0.19 0.00 -0.84 0.00 0.00 61.79 60.50 2xah h SER 523 Cb 0.47 -0.03 -0.00 0.00 0.14 0.00 0.00 62.40 62.98 2xah h SER 523 CO 0.11 0.97 -0.72 -0.09 -1.14 0.00 0.00 176.83 175.97 2xah h ARG 524 N 0.03 0.54 0.31 3.45 2.43 -1.99 -2.90 114.38 116.24 2xah h ARG 524 Ca -0.03 -0.43 -0.02 0.00 -0.81 0.00 0.00 59.98 58.70 2xah h ARG 524 Cb 1.62 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.26 2xah h ARG 524 CO 0.13 1.05 -0.15 -0.44 -1.51 0.00 0.00 179.97 179.06 2xah h ASP 525 N 0.38 -0.35 -1.39 -3.80 3.32 -1.89 -2.50 116.42 110.18 2xah h ASP 525 Ca -0.03 0.01 0.45 0.00 0.02 0.00 0.00 57.03 57.48 2xah h ASP 525 Cb 1.31 0.09 -0.12 0.00 0.22 0.00 0.00 39.33 40.83 2xah h ASP 525 CO 0.13 -0.21 0.92 0.03 -1.72 0.00 0.00 179.24 178.39 2xah h ARG 526 N -0.49 0.07 -0.32 3.56 2.47 -1.39 0.71 114.38 118.99 2xah h ARG 526 Ca -0.04 -0.00 -0.11 0.00 -1.26 0.00 0.00 59.98 58.56 2xah h ARG 526 Cb 0.32 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.61 2xah h ARG 526 CO 0.07 0.05 -0.24 1.96 0.56 0.00 0.00 179.97 182.37 2xah h GLN 527 N 0.07 0.73 -0.11 0.04 4.20 -1.48 -1.92 115.11 116.64 2xah h GLN 527 Ca 0.82 -0.36 -0.09 0.00 0.06 0.00 0.00 58.65 59.08 2xah h GLN 527 Cb 2.70 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 30.48 2xah h GLN 527 CO -0.35 0.97 -0.30 0.82 -0.67 0.00 0.00 178.83 179.30 2xah h ILE 528 N 0.50 1.38 -1.04 2.54 2.04 0.85 -2.60 117.51 121.19 2xah h ILE 528 Ca 0.06 -1.60 0.26 0.00 1.00 0.00 0.00 64.86 64.58 2xah h ILE 528 Cb 0.80 2.12 -0.09 0.00 -0.74 0.00 0.00 36.82 38.91 2xah h ILE 528 CO 0.06 0.47 0.67 0.25 0.00 0.00 0.00 178.15 179.60 2xah h LEU 529 N -0.03 0.45 -1.02 1.44 5.85 -1.30 0.11 115.31 120.80 2xah h LEU 529 Ca -0.00 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 2xah h LEU 529 Cb 0.91 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 2xah h LEU 529 CO 0.06 0.09 0.53 0.44 -0.34 0.00 0.00 178.44 179.22 2xah h ASP 530 N 0.40 1.06 -0.50 1.25 3.32 -0.96 -1.21 116.42 119.78 2xah h ASP 530 Ca 0.59 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.57 2xah h ASP 530 Cb 1.49 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 2xah h ASP 530 CO -0.29 0.82 0.27 -0.25 -1.72 0.00 0.00 179.24 178.06 2xah h TRP 531 N 1.22 0.69 -0.99 4.55 7.01 -0.62 0.17 115.95 127.98 2xah h TRP 531 Ca 0.32 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.36 2xah h TRP 531 Cb -0.05 -0.22 -0.07 0.00 -2.10 0.00 0.00 29.16 26.73 2xah h TRP 531 CO 0.01 0.51 0.64 0.45 -2.79 0.00 0.00 178.44 177.26 2xah h HIS 532 N 0.66 1.18 -0.51 2.65 3.86 -1.13 0.14 115.15 122.00 2xah h HIS 532 Ca 0.17 0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.42 2xah h HIS 532 Cb 0.06 -0.39 -0.03 0.00 1.06 0.00 0.00 27.41 28.11 2xah h HIS 532 CO -0.02 0.62 0.34 0.74 0.86 0.00 0.00 177.93 180.47 2xah h PHE 533 N 1.17 0.64 -0.57 2.45 0.04 -0.23 -2.26 116.94 118.17 2xah h PHE 533 Ca 0.42 0.02 0.05 0.00 2.80 0.00 0.00 57.97 61.26 2xah h PHE 533 Cb 0.14 -0.21 -0.05 0.00 2.20 0.00 0.00 35.95 38.03 2xah h PHE 533 CO -0.01 0.40 0.30 0.00 -0.60 0.00 0.00 178.31 178.40 2xah h ALA 534 N 1.19 0.74 -0.61 2.45 0.00 0.33 0.16 119.26 123.53 2xah h ALA 534 Ca 0.19 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.22 2xah h ALA 534 Cb -0.07 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.56 2xah h ALA 534 CO -0.05 -0.04 0.19 -0.97 0.00 0.00 0.00 179.25 178.38 2xah h ASN 535 N 0.57 0.13 -0.68 0.00 -0.00 -0.41 0.70 115.58 115.89 2xah h ASN 535 Ca 0.25 0.09 -0.05 0.00 -0.00 0.00 0.00 56.30 56.60 2xah h ASN 535 Cb 0.15 0.10 -0.03 0.00 -0.00 0.00 0.00 38.32 38.55 2xah h ASN 535 CO -0.17 0.08 0.23 0.25 -0.00 0.00 0.00 177.43 177.82 2xah h LEU 536 N 0.34 0.97 -2.44 0.34 5.85 -0.74 -1.89 115.31 117.74 2xah h LEU 536 Ca 0.31 -0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2xah h LEU 536 Cb 0.43 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.21 2xah h LEU 536 CO -0.35 0.91 0.01 -0.33 -0.34 0.00 0.00 178.44 178.33 2xah h GLU 537 N 0.98 0.00 0.05 1.25 5.08 0.42 -2.41 114.58 119.95 2xah h GLU 537 Ca 0.22 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2xah h GLU 537 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2xah h GLU 537 CO -0.01 0.00 -0.03 0.35 -1.00 0.00 0.00 179.01 178.32 2xah h PHE 538 N 0.00 -0.07 -1.26 4.33 3.57 -0.20 0.14 116.94 123.46 2xah h PHE 538 Ca 0.00 -0.00 0.45 0.00 3.53 0.00 0.00 57.97 61.95 2xah h PHE 538 Cb 0.01 0.02 -0.14 0.00 2.79 0.00 0.00 35.95 38.63 2xah h PHE 538 CO 0.00 0.25 0.79 0.00 -2.23 0.00 0.00 178.31 177.12 2xah n ALA 539 N -2.71 1.26 -0.15 2.41 0.00 -0.78 -0.52 120.51 120.01 2xah n ALA 539 Ca -0.04 0.87 0.07 0.00 0.00 0.00 0.00 53.44 54.34 2xah n ALA 539 Cb 0.17 -1.02 0.18 0.00 0.00 0.00 0.00 19.45 18.79 2xah n ALA 539 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2xah n ASN 540 N -4.76 3.10 -4.37 0.00 3.02 -0.93 -4.97 115.26 106.35 2xah n ASN 540 Ca 0.39 -1.96 -0.34 0.00 -0.03 0.00 0.00 54.58 52.63 2xah n ASN 540 Cb 1.46 -0.27 -0.09 0.00 -0.61 0.00 0.00 39.78 40.27 2xah n ASN 540 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2xah n ALA 541 N 0.80 -1.76 -3.63 5.41 0.00 0.32 -4.73 120.51 116.91 2xah n ALA 541 Ca 0.14 -0.35 -0.04 0.00 0.00 0.00 0.00 53.44 53.18 2xah n ALA 541 Cb 0.46 -1.30 -0.06 0.00 0.00 0.00 0.00 19.45 18.56 2xah n ALA 541 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2xah s THR 542 N -4.04 0.00 -0.31 0.00 -1.32 -0.02 -1.20 115.64 108.75 2xah s THR 542 Ca 0.25 0.00 -0.43 0.00 -1.21 0.00 0.00 61.69 60.30 2xah s THR 542 Cb -0.14 -1.00 -0.18 0.00 -1.51 0.00 0.00 72.50 69.66 2xah s THR 542 CO 1.00 0.00 1.55 -2.65 -2.21 0.00 0.00 174.62 172.31 2xah n PRO 543 N 1.13 0.46 0.10 7.08 -0.02 -1.26 -4.47 135.00 138.02 2xah n PRO 543 Ca -0.07 0.17 0.06 0.00 -2.02 0.00 0.00 63.50 61.64 2xah n PRO 543 Cb 0.58 -1.74 0.31 0.00 -0.02 0.00 0.00 33.50 32.63 2xah n PRO 543 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2xah n LEU 544 N 3.98 0.29 -0.01 2.45 4.77 -1.26 -0.19 117.00 127.03 2xah n LEU 544 Ca 0.27 0.58 0.15 0.00 -0.03 0.00 0.00 56.01 56.98 2xah n LEU 544 Cb 0.04 -0.60 0.71 0.00 -2.33 0.00 0.00 43.42 41.24 2xah n LEU 544 CO 0.81 -0.68 0.98 -1.54 -1.33 0.00 0.00 177.39 175.63 2xah n SER 545 N -1.89 0.07 -0.08 -1.43 3.41 -1.26 -0.16 113.62 112.28 2xah n SER 545 Ca -0.01 -0.11 -0.09 0.00 -0.26 0.00 0.00 58.87 58.41 2xah n SER 545 Cb 0.12 -0.28 -0.12 0.00 -0.26 0.00 0.00 64.21 63.67 2xah n SER 545 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2xah n THR 546 N -1.28 1.12 -1.70 6.66 -2.24 0.74 -4.75 114.28 112.83 2xah n THR 546 Ca 0.13 -0.65 -0.38 0.00 -2.27 0.00 0.00 64.05 60.88 2xah n THR 546 Cb 0.26 -0.67 0.06 0.00 -2.10 0.00 0.00 70.33 67.88 2xah n THR 546 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2xah n LEU 547 N -2.68 5.20 -4.74 3.22 4.77 -1.21 0.26 117.00 121.82 2xah n LEU 547 Ca -0.28 0.86 -0.41 0.00 -0.03 0.00 0.00 56.01 56.15 2xah n LEU 547 Cb 1.01 -1.51 -0.05 0.00 -2.33 0.00 0.00 43.42 40.54 2xah n LEU 547 CO 0.32 -1.16 0.74 -0.55 -1.33 0.00 0.00 177.39 175.41 2xah s SER 548 N -1.23 7.39 0.05 -1.43 0.15 -0.05 -2.74 113.70 115.84 2xah s SER 548 Ca 0.78 2.05 -0.29 0.00 0.70 0.00 0.00 55.95 59.18 2xah s SER 548 Cb -0.40 -2.61 -0.16 0.00 -1.71 0.00 0.00 66.02 61.14 2xah s SER 548 CO 0.44 -0.09 1.44 0.25 1.20 0.00 0.00 173.24 176.48 2xah h LEU 549 N 4.70 -0.90 -2.37 3.45 5.85 -1.75 -1.02 115.31 123.28 2xah h LEU 549 Ca -0.45 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.30 2xah h LEU 549 Cb 1.21 0.23 -0.00 0.00 0.37 0.00 0.00 40.66 42.47 2xah h LEU 549 CO 0.70 -0.63 -0.01 0.50 -0.34 0.00 0.00 178.44 178.65 2xah h LYS 550 N -1.05 0.00 0.00 1.25 3.64 -1.94 -3.33 116.57 115.15 2xah h LYS 550 Ca -0.11 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 2xah h LYS 550 Cb 0.80 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.62 2xah h LYS 550 CO 0.17 0.01 -0.12 0.72 -2.27 0.00 0.00 179.45 177.96 2xah n HIS 551 N -3.89 0.00 -0.39 1.91 8.25 -1.23 -4.79 115.22 115.08 2xah n HIS 551 Ca -0.03 0.00 0.38 0.00 -0.26 0.00 0.00 57.72 57.81 2xah n HIS 551 Cb 0.10 0.00 0.68 0.00 1.12 0.00 0.00 29.99 31.89 2xah n HIS 551 CO 0.00 0.00 0.00 0.11 0.64 0.00 0.00 176.34 177.09 2xah h TRP 552 N 0.00 0.00 -0.12 4.41 5.08 -1.29 0.42 115.95 124.45 2xah h TRP 552 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2xah h TRP 552 Cb 0.00 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.16 2xah h TRP 552 CO 0.00 0.00 0.00 -0.40 -1.28 0.00 0.00 178.44 176.76 2xah n ASP 553 N -3.75 3.04 -0.21 0.11 5.75 -1.26 -4.74 116.55 115.49 2xah n ASP 553 Ca 0.30 -3.00 0.30 0.00 -0.01 0.00 0.00 54.79 52.38 2xah n ASP 553 Cb 1.55 -0.46 0.73 0.00 -1.03 0.00 0.00 41.12 41.91 2xah n ASP 553 CO 0.00 0.00 0.00 0.06 -0.11 0.00 0.00 177.20 177.15 2xah h GLN 554 N 0.85 0.00 -0.72 0.11 -0.00 -0.46 0.77 115.11 115.65 2xah h GLN 554 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2xah h GLN 554 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.66 2xah h GLN 554 CO 0.10 0.00 0.00 -0.40 -0.00 0.00 0.00 178.83 178.53 2xah n ASP 555 N -4.19 2.43 -0.08 0.06 5.75 -1.26 -4.43 116.55 114.83 2xah n ASP 555 Ca 0.20 -2.26 -0.13 0.00 -0.01 0.00 0.00 54.79 52.59 2xah n ASP 555 Cb 1.04 -0.48 -0.01 0.00 -1.03 0.00 0.00 41.12 40.64 2xah n ASP 555 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 2xah h ASP 556 N 1.47 0.92 0.17 -1.12 3.58 -1.22 -3.03 116.42 117.18 2xah h ASP 556 Ca 0.00 -0.46 0.00 0.00 0.42 0.00 0.00 57.03 56.99 2xah h ASP 556 Cb 0.89 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.67 2xah h ASP 556 CO 0.14 1.24 0.00 0.44 -2.88 0.00 0.00 179.24 178.18 2xah h ASP 557 N 0.67 0.00 -0.39 2.28 3.32 -1.82 -3.09 116.42 117.40 2xah h ASP 557 Ca 0.04 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.00 2xah h ASP 557 Cb 1.06 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.56 2xah h ASP 557 CO 0.11 0.00 0.04 0.49 -1.72 0.00 0.00 179.24 178.16 2xah n PHE 558 N -2.54 1.32 -1.99 4.55 3.72 -1.14 -4.98 117.46 116.40 2xah n PHE 558 Ca -0.01 -1.09 -0.38 0.00 -0.05 0.00 0.00 57.45 55.92 2xah n PHE 558 Cb 0.09 -0.44 0.02 0.00 -0.94 0.00 0.00 39.48 38.21 2xah n PHE 558 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 2xah s GLU 559 N -2.95 3.36 0.89 -1.08 2.02 -1.17 -5.01 118.70 114.75 2xah s GLU 559 Ca 0.46 2.01 -0.12 0.00 0.02 0.00 0.00 54.97 57.34 2xah s GLU 559 Cb 0.38 -2.27 0.12 0.00 0.10 0.00 0.00 34.13 32.46 2xah s GLU 559 CO 0.08 -0.95 1.13 -0.06 0.02 0.00 0.00 175.26 175.48 2xah s PHE 560 N -1.43 2.57 0.09 1.61 0.08 -1.26 -5.04 117.98 114.60 2xah s PHE 560 Ca 0.69 0.93 0.05 0.00 0.12 0.00 0.00 56.93 58.73 2xah s PHE 560 Cb -0.35 -3.32 -0.04 0.00 -0.57 0.00 0.00 43.02 38.75 2xah s PHE 560 CO 0.41 -2.25 -0.02 0.95 -0.10 0.00 0.00 175.22 174.21 2xah s THR 561 N -3.23 3.88 0.00 0.64 -4.23 -1.17 -4.88 115.64 106.64 2xah s THR 561 Ca 0.63 -1.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.10 2xah s THR 561 Cb -0.15 -2.84 0.00 0.00 1.34 0.00 0.00 72.50 70.86 2xah s THR 561 CO 0.54 0.13 0.00 0.61 -0.54 0.00 0.00 174.62 175.35 2xah n GLY 562 N 0.63 2.53 3.78 3.99 0.00 -1.26 -0.07 105.19 114.79 2xah n GLY 562 Ca -0.11 -2.05 -0.37 0.00 0.00 0.00 0.00 46.02 43.49 2xah n GLY 562 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2xah s SER 563 N 0.00 7.10 0.76 1.61 0.01 -1.26 -4.41 113.70 117.52 2xah s SER 563 Ca 0.00 1.91 -0.13 0.00 1.31 0.00 0.00 55.95 59.04 2xah s SER 563 Cb 0.00 -2.58 0.06 0.00 0.21 0.00 0.00 66.02 63.71 2xah s SER 563 CO 0.00 -0.24 1.15 -1.00 0.41 0.00 0.00 173.24 173.56 2xah s HIS 564 N -1.66 2.20 0.05 2.43 0.09 -1.26 -3.88 115.29 113.26 2xah s HIS 564 Ca 0.54 1.62 -0.01 0.00 -0.00 0.00 0.00 55.06 57.21 2xah s HIS 564 Cb -0.19 -3.29 -0.04 0.00 -0.00 0.00 0.00 32.58 29.06 2xah s HIS 564 CO 0.25 -2.28 -0.03 -0.51 -0.00 0.00 0.00 174.74 172.18 2xah s LEU 565 N -5.55 2.46 0.10 0.89 1.02 -0.06 -2.48 118.68 115.07 2xah s LEU 565 Ca 0.68 -1.00 0.08 0.00 0.02 0.00 0.00 54.13 53.91 2xah s LEU 565 Cb -0.23 0.21 -0.04 0.00 0.02 0.00 0.00 46.19 46.15 2xah s LEU 565 CO 0.49 -0.60 -0.14 0.42 0.02 0.00 0.00 176.35 176.54 2xah s THR 566 N -3.92 3.14 -0.95 5.49 -4.23 0.10 -0.62 115.64 114.66 2xah s THR 566 Ca 0.07 -1.35 -0.15 0.00 -1.18 0.00 0.00 61.69 59.08 2xah s THR 566 Cb 0.08 -2.45 0.19 0.00 1.34 0.00 0.00 72.50 71.66 2xah s THR 566 CO -0.10 0.12 1.02 -0.69 -0.54 0.00 0.00 174.62 174.44 2xah s VAL 567 N -1.17 5.27 0.41 2.29 1.01 -1.15 -2.54 120.40 124.52 2xah s VAL 567 Ca 0.20 -2.28 0.10 0.00 0.00 0.00 0.00 61.98 59.99 2xah s VAL 567 Cb -0.11 -4.65 0.29 0.00 0.00 0.00 0.00 36.38 31.91 2xah s VAL 567 CO 0.12 -1.30 2.01 -0.09 0.00 0.00 0.00 175.10 175.84 2xah h ARG 568 N 7.96 0.51 -0.78 2.72 2.43 -0.65 0.25 114.38 126.82 2xah h ARG 568 Ca 0.16 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.27 2xah h ARG 568 Cb 0.99 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 2xah h ARG 568 CO 0.97 0.34 0.03 0.27 -1.51 0.00 0.00 179.97 180.07 2xah n ASN 569 N -4.47 3.77 0.00 -3.80 6.94 -1.26 -4.86 115.26 111.57 2xah n ASN 569 Ca 0.07 -2.58 0.00 0.00 -0.02 0.00 0.00 54.58 52.04 2xah n ASN 569 Cb 0.20 -0.62 0.00 0.00 -2.36 0.00 0.00 39.78 37.01 2xah n ASN 569 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2xah n GLY 570 N 0.29 -2.32 0.29 4.83 0.00 0.89 -4.69 105.19 104.48 2xah n GLY 570 Ca 0.18 -1.09 0.17 0.00 0.00 0.00 0.00 46.02 45.28 2xah n GLY 570 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2xah h TYR 571 N 0.00 0.00 -0.64 1.61 5.03 -1.85 -2.91 116.97 118.21 2xah h TYR 571 Ca 0.00 0.00 0.12 0.00 2.58 0.00 0.00 58.73 61.43 2xah h TYR 571 Cb 0.00 0.00 -0.04 0.00 1.55 0.00 0.00 36.73 38.24 2xah h TYR 571 CO 0.00 0.05 0.43 0.66 -1.32 0.00 0.00 178.16 177.98 2xah h SER 572 N 0.00 0.32 -0.16 -2.11 4.64 -1.86 0.17 113.55 114.54 2xah h SER 572 Ca -0.00 0.01 0.05 0.00 -0.47 0.00 0.00 61.79 61.38 2xah h SER 572 Cb 0.27 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 2xah h SER 572 CO 0.01 0.18 0.85 0.00 -0.87 0.00 0.00 176.83 176.99 2xah h VAL 574 N 0.00 0.17 -0.83 0.00 2.07 -0.93 -2.95 116.25 113.79 2xah h VAL 574 Ca 0.08 -1.18 0.19 0.00 0.82 0.00 0.00 66.70 66.61 2xah h VAL 574 Cb 1.77 0.37 -0.12 0.00 -1.52 0.00 0.00 31.29 31.79 2xah h VAL 574 CO -0.00 0.06 0.30 -0.65 0.02 0.00 0.00 177.57 177.30 2xah h PRO 575 N -1.00 0.36 -0.27 1.57 0.11 -1.61 -0.16 132.00 131.00 2xah h PRO 575 Ca -0.03 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.05 2xah h PRO 575 Cb 0.46 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 2xah h PRO 575 CO -0.02 0.24 0.17 0.28 -0.21 0.00 0.00 178.00 178.45 2xah h VAL 576 N 0.37 1.09 -0.77 3.15 2.07 -1.51 0.16 116.25 120.81 2xah h VAL 576 Ca 0.49 -0.20 0.12 0.00 0.82 0.00 0.00 66.70 67.92 2xah h VAL 576 Cb 0.87 0.74 -0.08 0.00 -1.52 0.00 0.00 31.29 31.30 2xah h VAL 576 CO -0.51 0.09 0.38 0.00 0.02 0.00 0.00 177.57 177.55 2xah h ALA 577 N 1.07 1.10 -0.18 1.67 0.00 -1.18 -2.72 119.26 119.03 2xah h ALA 577 Ca 0.10 0.07 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 2xah h ALA 577 Cb -0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 2xah h ALA 577 CO -0.02 -0.08 -0.61 -0.07 0.00 0.00 0.00 179.25 178.48 2xah h LEU 578 N 0.60 0.69 -1.57 0.00 3.38 -0.12 -3.09 115.31 115.19 2xah h LEU 578 Ca 0.40 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2xah h LEU 578 Cb 0.50 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2xah h LEU 578 CO -0.32 1.13 0.00 0.00 0.09 0.00 0.00 178.44 179.34 2xah h ALA 579 N 0.87 1.00 -2.22 1.53 0.00 -0.39 -3.44 119.26 116.61 2xah h ALA 579 Ca -0.01 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.34 2xah h ALA 579 Cb 1.18 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2xah h ALA 579 CO 0.12 0.00 0.85 -2.00 0.00 0.00 0.00 179.25 178.22 2xah s GLU 580 N -3.62 4.27 0.00 0.00 -6.30 -1.17 -2.41 118.70 109.46 2xah s GLU 580 Ca -0.01 1.72 0.00 0.00 -2.50 0.00 0.00 54.97 54.18 2xah s GLU 580 Cb 0.08 -3.70 0.00 0.00 0.00 0.00 0.00 34.13 30.51 2xah s GLU 580 CO 0.31 -0.63 0.00 0.41 0.02 0.00 0.00 175.26 175.37 2xah n GLY 581 N 3.57 0.92 3.34 -1.50 0.00 -1.26 -5.09 105.19 105.17 2xah n GLY 581 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 2xah n GLY 581 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2xah s LEU 582 N 0.00 2.26 -0.86 0.99 1.43 -1.01 -5.06 118.68 116.42 2xah s LEU 582 Ca 0.00 -0.67 -0.25 0.00 -1.03 0.00 0.00 54.13 52.18 2xah s LEU 582 Cb 0.00 -1.14 0.03 0.00 0.03 0.00 0.00 46.19 45.11 2xah s LEU 582 CO 0.00 0.17 1.42 -0.62 0.23 0.00 0.00 176.35 177.55 2xah s ASP 583 N -1.70 6.21 -0.19 2.29 2.15 -1.26 -4.96 116.67 119.21 2xah s ASP 583 Ca 0.11 -0.84 -0.00 0.00 0.43 0.00 0.00 52.55 52.24 2xah s ASP 583 Cb -0.10 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 39.97 2xah s ASP 583 CO 0.04 -1.77 -0.16 -0.63 -0.17 0.00 0.00 175.17 172.48 2xah s ILE 584 N 5.80 2.40 -0.60 4.11 1.01 -1.26 -0.84 121.20 131.82 2xah s ILE 584 Ca 0.43 -0.83 -0.19 0.00 0.00 0.00 0.00 60.65 60.06 2xah s ILE 584 Cb -0.05 -2.04 0.10 0.00 0.01 0.00 0.00 42.46 40.49 2xah s ILE 584 CO 0.04 0.51 0.73 -0.54 0.00 0.00 0.00 174.94 175.68 2xah s LYS 585 N 1.34 3.05 0.68 2.79 -0.14 -0.06 -4.99 119.74 122.40 2xah s LYS 585 Ca 0.05 -1.28 -0.11 0.00 -1.36 0.00 0.00 55.97 53.26 2xah s LYS 585 Cb -0.13 -4.27 -0.00 0.00 -1.68 0.00 0.00 37.83 31.74 2xah s LYS 585 CO -0.10 -1.57 1.07 -0.51 -0.76 0.00 0.00 175.35 173.48 2xah s LEU 586 N 2.81 3.02 -1.44 3.17 1.43 -1.26 -1.73 118.68 124.67 2xah s LEU 586 Ca 0.13 1.23 -0.09 0.00 -1.03 0.00 0.00 54.13 54.37 2xah s LEU 586 Cb -0.23 -4.12 0.03 0.00 0.03 0.00 0.00 46.19 41.89 2xah s LEU 586 CO 0.06 -1.18 0.97 0.59 0.23 0.00 0.00 176.35 177.03 2xah n ASN 587 N -2.92 -5.91 -3.85 2.29 3.02 -0.14 -4.88 115.26 102.88 2xah n ASN 587 Ca 0.07 -0.51 -0.30 0.00 -0.03 0.00 0.00 54.58 53.80 2xah n ASN 587 Cb 0.56 -4.70 -0.15 0.00 -0.61 0.00 0.00 39.78 34.88 2xah n ASN 587 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2xah s THR 588 N -3.26 1.40 -0.54 3.41 2.01 0.17 -2.14 115.64 116.69 2xah s THR 588 Ca 0.52 -1.69 -0.19 0.00 0.31 0.00 0.00 61.69 60.64 2xah s THR 588 Cb -0.24 -2.01 0.07 0.00 0.01 0.00 0.00 72.50 70.33 2xah s THR 588 CO 0.65 -0.60 0.68 0.00 -0.69 0.00 0.00 174.62 174.66 2xah s ALA 589 N 1.36 3.37 0.19 7.40 0.00 0.26 -3.44 121.76 130.90 2xah s ALA 589 Ca 0.09 -1.85 -0.33 0.00 0.00 0.00 0.00 51.96 49.87 2xah s ALA 589 Cb -0.18 -3.44 -0.14 0.00 0.00 0.00 0.00 23.12 19.36 2xah s ALA 589 CO -0.18 -2.15 1.43 0.28 0.00 0.00 0.00 175.76 175.15 2xah n VAL 590 N 5.64 0.52 -0.01 0.00 0.31 -1.26 -1.90 118.33 121.62 2xah n VAL 590 Ca -0.07 -0.13 -0.01 0.00 -0.01 0.00 0.00 64.34 64.13 2xah n VAL 590 Cb 0.45 -1.35 -0.01 0.00 -0.91 0.00 0.00 33.84 32.01 2xah n VAL 590 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2xah n ARG 591 N 2.52 3.40 -3.81 5.55 5.12 0.12 -4.72 116.66 124.84 2xah n ARG 591 Ca 0.14 -0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.93 2xah n ARG 591 Cb 0.28 -1.04 -0.14 0.00 -1.16 0.00 0.00 32.46 30.40 2xah n ARG 591 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 2xah s GLN 592 N -2.05 0.04 -0.23 5.56 0.74 -0.74 -1.52 119.66 121.46 2xah s GLN 592 Ca -0.01 0.17 -0.01 0.00 0.05 0.00 0.00 55.36 55.57 2xah s GLN 592 Cb 0.01 -0.10 0.02 0.00 1.10 0.00 0.00 33.01 34.04 2xah s GLN 592 CO 0.06 -0.09 -0.09 0.08 -0.55 0.00 0.00 175.29 174.70 2xah s VAL 593 N 0.59 2.70 -0.06 1.34 1.01 0.70 -1.19 120.40 125.50 2xah s VAL 593 Ca -0.05 -1.00 0.05 0.00 0.00 0.00 0.00 61.98 60.99 2xah s VAL 593 Cb -0.07 -2.33 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 2xah s VAL 593 CO -0.02 0.28 -0.22 0.00 0.00 0.00 0.00 175.10 175.14 2xah s ARG 594 N 1.32 2.54 -0.09 2.72 1.70 -0.52 0.03 118.95 126.65 2xah s ARG 594 Ca 0.01 -0.84 -0.06 0.00 -0.47 0.00 0.00 55.73 54.37 2xah s ARG 594 Cb -0.16 -2.23 0.04 0.00 -0.57 0.00 0.00 34.95 32.03 2xah s ARG 594 CO -0.06 0.45 0.23 1.52 -1.08 0.00 0.00 175.30 176.36 2xah s TYR 595 N -0.32 -0.28 0.14 5.89 1.13 -0.49 -0.63 117.35 122.79 2xah s TYR 595 Ca 0.01 0.69 -0.07 0.00 -1.41 0.00 0.00 57.07 56.29 2xah s TYR 595 Cb -0.13 0.05 -0.01 0.00 -1.10 0.00 0.00 41.96 40.77 2xah s TYR 595 CO 0.02 -0.18 0.22 0.95 -2.51 0.00 0.00 175.55 174.05 2xah s THR 596 N 0.81 0.09 0.53 -3.49 -4.23 0.15 -4.32 115.64 105.19 2xah s THR 596 Ca -0.06 -1.45 0.47 0.00 -1.18 0.00 0.00 61.69 59.47 2xah s THR 596 Cb -0.07 -1.79 0.69 0.00 1.34 0.00 0.00 72.50 72.67 2xah s THR 596 CO -0.05 -0.40 1.47 0.00 -0.54 0.00 0.00 174.62 175.10 2xah n ALA 597 N -0.16 1.77 0.40 3.99 0.00 -1.26 0.34 120.51 125.60 2xah n ALA 597 Ca -0.08 0.61 0.06 0.00 0.00 0.00 0.00 53.44 54.02 2xah n ALA 597 Cb 0.63 -1.06 0.06 0.00 0.00 0.00 0.00 19.45 19.07 2xah n ALA 597 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2xah n SER 598 N -3.79 2.01 0.00 0.00 3.41 -1.26 -4.90 113.62 109.09 2xah n SER 598 Ca 0.42 -1.51 0.00 0.00 -0.26 0.00 0.00 58.87 57.52 2xah n SER 598 Cb 1.90 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 65.83 2xah n SER 598 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xah n GLY 599 N 0.61 0.34 3.04 5.00 0.00 0.15 -4.94 105.19 109.40 2xah n GLY 599 Ca 0.07 -1.75 -0.18 0.00 0.00 0.00 0.00 46.02 44.16 2xah n GLY 599 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xah s GLU 601 N -0.51 1.90 -0.13 0.00 -1.05 0.20 -0.48 118.70 118.63 2xah s GLU 601 Ca 0.01 -0.99 0.01 0.00 -0.15 0.00 0.00 54.97 53.86 2xah s GLU 601 Cb -0.05 -1.94 -0.01 0.00 -0.44 0.00 0.00 34.13 31.69 2xah s GLU 601 CO 0.00 0.52 -0.17 0.08 0.95 0.00 0.00 175.26 176.63 2xah s VAL 602 N -0.69 2.61 -0.24 1.83 1.01 0.39 -1.44 120.40 123.87 2xah s VAL 602 Ca 0.10 -0.82 -0.05 0.00 0.00 0.00 0.00 61.98 61.22 2xah s VAL 602 Cb -0.10 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.21 2xah s VAL 602 CO 0.00 0.53 0.01 -0.63 0.00 0.00 0.00 175.10 175.02 2xah s ILE 603 N 0.46 3.72 0.33 2.22 1.01 -0.33 -0.55 121.20 128.06 2xah s ILE 603 Ca -0.12 -0.45 0.09 0.00 0.00 0.00 0.00 60.65 60.17 2xah s ILE 603 Cb -0.16 -2.75 -0.06 0.00 0.01 0.00 0.00 42.46 39.49 2xah s ILE 603 CO 0.05 0.34 -0.08 0.00 0.00 0.00 0.00 174.94 175.25 2xah s ALA 604 N 1.52 2.82 0.40 9.38 0.00 -0.87 0.11 121.76 135.11 2xah s ALA 604 Ca 0.05 -2.06 0.04 0.00 0.00 0.00 0.00 51.96 49.99 2xah s ALA 604 Cb -0.15 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 2xah s ALA 604 CO -0.00 0.03 0.07 0.14 0.00 0.00 0.00 175.76 175.99 2xah s VAL 605 N -2.72 1.09 -0.23 0.00 -7.23 -0.80 -1.12 120.40 109.39 2xah s VAL 605 Ca 0.32 -2.00 -0.18 0.00 -1.81 0.00 0.00 61.98 58.31 2xah s VAL 605 Cb 0.03 -2.56 -0.03 0.00 0.56 0.00 0.00 36.38 34.38 2xah s VAL 605 CO 0.15 0.00 0.52 0.21 -0.31 0.00 0.00 175.10 175.67 2xah s ASN 606 N -3.62 6.50 0.55 4.85 2.47 -1.09 -0.57 114.94 124.03 2xah s ASN 606 Ca 0.27 0.60 0.26 0.00 0.42 0.00 0.00 52.86 54.41 2xah s ASN 606 Cb 0.06 -2.29 1.59 0.00 -1.45 0.00 0.00 41.25 39.16 2xah s ASN 606 CO 0.13 -0.24 2.18 0.71 -3.72 0.00 0.00 177.10 176.17 2xah h THR 607 N 5.26 0.66 0.12 -5.21 1.35 -1.76 -2.85 112.91 110.48 2xah h THR 607 Ca -0.31 -0.17 -0.01 0.00 -0.55 0.00 0.00 66.41 65.37 2xah h THR 607 Cb 1.15 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.67 2xah h THR 607 CO 0.73 0.04 -0.06 0.03 -0.25 0.00 0.00 175.52 176.01 2xah h ARG 608 N 0.00 -0.15 -4.67 4.72 3.08 -1.93 -3.41 114.38 112.02 2xah h ARG 608 Ca -0.00 0.01 -0.68 0.00 0.07 0.00 0.00 59.98 59.38 2xah h ARG 608 Cb 0.10 0.04 -0.35 0.00 0.08 0.00 0.00 29.97 29.84 2xah h ARG 608 CO 0.01 0.12 -0.66 -1.54 -1.07 0.00 0.00 179.97 176.83 2xah s SER 609 N -5.50 4.97 0.00 7.04 1.04 -1.18 -5.01 113.70 115.06 2xah s SER 609 Ca -0.07 -1.66 0.31 0.00 0.48 0.00 0.00 55.95 55.01 2xah s SER 609 Cb -0.00 -1.73 1.85 0.00 0.10 0.00 0.00 66.02 66.24 2xah s SER 609 CO 0.25 -0.37 2.19 0.35 0.98 0.00 0.00 173.24 176.65 2xah n THR 610 N 4.55 0.00 0.46 2.02 -2.24 -1.08 -2.13 114.28 115.86 2xah n THR 610 Ca -0.07 -0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.83 2xah n THR 610 Cb 0.42 -0.48 0.13 0.00 -2.10 0.00 0.00 70.33 68.30 2xah n THR 610 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 2xah h SER 611 N 0.00 0.00 -2.18 3.42 4.64 -1.95 -3.44 113.55 114.04 2xah h SER 611 Ca 0.00 -0.17 -0.55 0.00 -0.47 0.00 0.00 61.79 60.60 2xah h SER 611 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 2xah h SER 611 CO 0.00 0.09 1.12 -1.58 -0.87 0.00 0.00 176.83 175.59 2xah s GLN 612 N -3.21 3.23 0.24 4.77 -0.44 -0.90 -5.01 119.66 118.33 2xah s GLN 612 Ca 0.05 -0.33 -0.05 0.00 -2.50 0.00 0.00 55.36 52.53 2xah s GLN 612 Cb 0.12 -4.34 -0.05 0.00 -1.64 0.00 0.00 33.01 27.10 2xah s GLN 612 CO 0.74 -2.18 0.50 0.99 0.50 0.00 0.00 175.29 175.84 2xah s THR 613 N 5.74 5.06 0.03 -0.34 2.01 -1.26 -2.68 115.64 124.20 2xah s THR 613 Ca 0.37 0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.43 2xah s THR 613 Cb -0.07 -3.70 -0.02 0.00 0.01 0.00 0.00 72.50 68.72 2xah s THR 613 CO 0.12 -0.21 -0.08 -0.36 -0.69 0.00 0.00 174.62 173.40 2xah s PHE 614 N -1.95 0.72 -0.03 4.92 0.08 -0.28 -5.00 117.98 116.44 2xah s PHE 614 Ca 0.43 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 57.14 2xah s PHE 614 Cb -0.11 -0.43 0.02 0.00 -0.57 0.00 0.00 43.02 41.92 2xah s PHE 614 CO 0.28 -0.04 -0.05 0.42 -0.10 0.00 0.00 175.22 175.73 2xah s ILE 615 N -0.91 0.54 -0.13 0.64 -1.09 -1.26 -2.05 121.20 116.93 2xah s ILE 615 Ca -0.04 -0.16 0.03 0.00 -2.23 0.00 0.00 60.65 58.24 2xah s ILE 615 Cb -0.07 -0.54 0.01 0.00 -1.58 0.00 0.00 42.46 40.28 2xah s ILE 615 CO 0.00 0.21 -0.21 -0.31 -1.23 0.00 0.00 174.94 173.40 2xah s TYR 616 N 0.66 2.59 -0.14 3.97 1.51 0.28 -4.96 117.35 121.26 2xah s TYR 616 Ca -0.09 -1.28 -0.08 0.00 -1.01 0.00 0.00 57.07 54.61 2xah s TYR 616 Cb -0.12 -1.77 -0.04 0.00 -0.11 0.00 0.00 41.96 39.92 2xah s TYR 616 CO 0.00 -0.59 0.14 0.15 -1.11 0.00 0.00 175.55 174.14 2xah s LYS 617 N 0.80 3.65 0.02 -0.62 -0.14 -1.26 -0.46 119.74 121.72 2xah s LYS 617 Ca -0.08 -0.16 -0.28 0.00 -1.36 0.00 0.00 55.97 54.10 2xah s LYS 617 Cb -0.16 -3.25 0.10 0.00 -1.68 0.00 0.00 37.83 32.84 2xah s LYS 617 CO -0.01 0.64 0.83 0.00 -0.76 0.00 0.00 175.35 176.06 2xah h ASP 619 N 2.04 0.59 -4.68 0.00 3.32 -1.37 0.68 116.42 117.00 2xah h ASP 619 Ca -0.24 -0.32 -0.15 0.00 0.02 0.00 0.00 57.03 56.33 2xah h ASP 619 Cb 1.25 -0.17 -0.22 0.00 0.22 0.00 0.00 39.33 40.41 2xah h ASP 619 CO 0.32 1.03 -0.48 0.00 -1.72 0.00 0.00 179.24 178.40 2xah s ALA 620 N -3.93 -0.39 -0.13 3.45 0.00 -1.15 -4.61 121.76 115.00 2xah s ALA 620 Ca -0.07 0.06 0.03 0.00 0.00 0.00 0.00 51.96 51.98 2xah s ALA 620 Cb 0.11 0.00 0.01 0.00 0.00 0.00 0.00 23.12 23.24 2xah s ALA 620 CO 0.84 -0.18 -0.23 0.08 0.00 0.00 0.00 175.76 176.27 2xah s VAL 621 N -1.01 2.07 -0.30 0.00 1.01 -0.82 -1.60 120.40 119.75 2xah s VAL 621 Ca -0.11 -0.99 -0.10 0.00 0.00 0.00 0.00 61.98 60.78 2xah s VAL 621 Cb -0.06 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 2xah s VAL 621 CO 0.01 0.55 0.16 -0.22 0.00 0.00 0.00 175.10 175.60 2xah s LEU 622 N 0.65 4.05 -0.30 3.92 2.96 0.23 -0.47 118.68 129.72 2xah s LEU 622 Ca -0.11 -0.41 -0.14 0.00 -0.22 0.00 0.00 54.13 53.25 2xah s LEU 622 Cb -0.16 -2.02 -0.03 0.00 0.50 0.00 0.00 46.19 44.48 2xah s LEU 622 CO 0.02 -0.16 0.30 0.00 -1.32 0.00 0.00 176.35 175.19 2xah n THR 624 N 5.14 2.16 -1.72 0.00 -2.24 -0.73 -1.88 114.28 115.02 2xah n THR 624 Ca -0.11 -2.25 -0.43 0.00 -2.27 0.00 0.00 64.05 58.99 2xah n THR 624 Cb 0.51 -0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.45 2xah n THR 624 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2xah n LEU 625 N -1.01 3.91 -4.51 3.22 4.77 -1.26 -4.84 117.00 117.28 2xah n LEU 625 Ca 0.21 1.09 -0.40 0.00 -0.03 0.00 0.00 56.01 56.88 2xah n LEU 625 Cb 0.80 -1.55 0.03 0.00 -2.33 0.00 0.00 43.42 40.36 2xah n LEU 625 CO 0.09 0.07 0.24 -2.65 -1.33 0.00 0.00 177.39 173.81 2xah n PRO 626 N 3.36 0.75 -0.21 3.23 -0.02 -1.26 -4.74 135.00 136.11 2xah n PRO 626 Ca 0.14 0.28 -0.04 0.00 -2.02 0.00 0.00 63.50 61.87 2xah n PRO 626 Cb 0.34 -1.79 0.14 0.00 -0.02 0.00 0.00 33.50 32.17 2xah n PRO 626 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2xah h LEU 627 N 0.67 0.93 -0.92 2.45 5.85 -1.92 -1.02 115.31 121.35 2xah h LEU 627 Ca -0.45 -0.14 0.16 0.00 0.84 0.00 0.00 57.88 58.29 2xah h LEU 627 Cb 1.38 -0.24 -0.10 0.00 0.37 0.00 0.00 40.66 42.07 2xah h LEU 627 CO 0.51 0.84 0.51 1.23 -0.34 0.00 0.00 178.44 181.19 2xah h GLY 628 N 1.06 1.55 0.66 3.75 0.00 -1.81 0.15 103.07 108.44 2xah h GLY 628 Ca 0.23 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 2xah h GLY 628 CO -0.02 -0.03 -0.15 -2.08 0.00 0.00 0.00 176.54 174.26 2xah h VAL 629 N 0.70 0.69 0.00 4.60 2.07 -1.29 -2.94 116.25 120.08 2xah h VAL 629 Ca 0.51 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2xah h VAL 629 Cb 0.73 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2xah h VAL 629 CO -0.37 0.11 0.29 -0.07 0.02 0.00 0.00 177.57 177.56 2xah h LEU 630 N -0.76 0.00 0.00 2.57 3.38 -0.19 -0.43 115.31 119.88 2xah h LEU 630 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2xah h LEU 630 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2xah h LEU 630 CO 0.07 0.00 -0.46 0.11 0.09 0.00 0.00 178.44 178.25 2xah h LYS 631 N 0.00 0.00 -6.74 1.13 1.57 -0.55 -3.49 116.57 108.49 2xah h LYS 631 Ca 0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.23 2xah h LYS 631 Cb 0.57 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.97 2xah h LYS 631 CO 0.00 0.00 0.78 1.04 -0.57 0.00 0.00 179.45 180.70 2xah n GLN 632 N -2.54 2.48 -4.30 3.15 6.02 -0.17 -4.98 117.38 117.04 2xah n GLN 632 Ca 0.03 0.88 -0.33 0.00 -0.01 0.00 0.00 57.00 57.58 2xah n GLN 632 Cb 0.49 -2.62 -0.16 0.00 1.02 0.00 0.00 30.24 28.97 2xah n GLN 632 CO 0.00 0.00 0.00 -1.14 -1.01 0.00 0.00 177.06 174.91 2xah s GLN 633 N -0.60 2.93 0.50 -1.09 2.00 -1.26 -2.64 119.66 119.49 2xah s GLN 633 Ca 0.64 -0.81 0.00 0.00 -2.00 0.00 0.00 55.36 53.19 2xah s GLN 633 Cb -0.54 -2.48 0.01 0.00 0.80 0.00 0.00 33.01 30.80 2xah s GLN 633 CO 0.50 -0.15 0.73 -1.25 -0.50 0.00 0.00 175.29 174.62 2xah s PRO 634 N 1.14 2.87 0.31 1.67 0.05 -1.26 -5.10 135.00 134.69 2xah s PRO 634 Ca 0.01 -0.54 -0.26 0.00 0.05 0.00 0.00 61.00 60.26 2xah s PRO 634 Cb -0.14 -2.51 -0.14 0.00 0.05 0.00 0.00 34.50 31.76 2xah s PRO 634 CO -0.09 -0.46 0.69 -2.30 0.05 0.00 0.00 177.00 174.90 2xah n PRO 635 N -2.21 0.68 0.08 0.56 -0.02 -1.08 -4.94 135.00 128.07 2xah n PRO 635 Ca 0.04 0.24 0.11 0.00 -2.02 0.00 0.00 63.50 61.87 2xah n PRO 635 Cb 0.58 -1.48 -0.04 0.00 -0.02 0.00 0.00 33.50 32.55 2xah n PRO 635 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2xah n ALA 636 N -0.24 2.54 -3.69 3.55 0.00 -1.26 -4.82 120.51 116.58 2xah n ALA 636 Ca 0.13 -0.31 -0.24 0.00 0.00 0.00 0.00 53.44 53.01 2xah n ALA 636 Cb 0.33 -1.02 -0.17 0.00 0.00 0.00 0.00 19.45 18.59 2xah n ALA 636 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2xah s VAL 637 N -3.37 0.92 -0.04 0.00 1.01 -1.26 -4.66 120.40 113.00 2xah s VAL 637 Ca -0.02 -0.29 -0.23 0.00 0.00 0.00 0.00 61.98 61.44 2xah s VAL 637 Cb 0.10 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 2xah s VAL 637 CO 0.82 0.33 0.69 -1.10 0.00 0.00 0.00 175.10 175.83 2xah s GLN 638 N 1.24 4.43 -0.18 2.72 -0.21 -0.57 -4.97 119.66 122.11 2xah s GLN 638 Ca -0.04 0.88 -0.08 0.00 0.02 0.00 0.00 55.36 56.14 2xah s GLN 638 Cb -0.14 -3.42 -0.04 0.00 1.00 0.00 0.00 33.01 30.41 2xah s GLN 638 CO -0.02 0.14 0.08 -0.06 -2.12 0.00 0.00 175.29 173.30 2xah s PHE 639 N 0.53 3.29 -0.29 0.91 0.08 -1.26 -0.21 117.98 121.02 2xah s PHE 639 Ca 0.37 0.13 0.01 0.00 0.12 0.00 0.00 56.93 57.55 2xah s PHE 639 Cb -0.18 -2.09 0.09 0.00 -0.57 0.00 0.00 43.02 40.26 2xah s PHE 639 CO 0.19 0.19 0.04 0.08 -0.10 0.00 0.00 175.22 175.61 2xah s VAL 640 N 0.34 1.39 0.89 -0.44 1.01 0.10 -2.14 120.40 121.55 2xah s VAL 640 Ca 0.04 -1.53 -0.14 0.00 0.00 0.00 0.00 61.98 60.35 2xah s VAL 640 Cb -0.12 -1.92 0.14 0.00 0.00 0.00 0.00 36.38 34.49 2xah s VAL 640 CO -0.00 -0.46 1.25 -2.16 0.00 0.00 0.00 175.10 173.72 2xah s PRO 641 N 1.39 1.26 0.75 2.72 0.04 -1.26 -1.40 135.00 138.51 2xah s PRO 641 Ca 0.05 -0.19 -0.15 0.00 0.04 0.00 0.00 61.00 60.75 2xah s PRO 641 Cb -0.18 -1.90 0.03 0.00 0.04 0.00 0.00 34.50 32.48 2xah s PRO 641 CO -0.14 -2.02 1.03 -2.30 0.04 0.00 0.00 177.00 173.60 2xah n PRO 642 N -3.54 0.43 -2.27 0.56 -0.02 -0.91 -4.91 135.00 124.34 2xah n PRO 642 Ca 0.12 0.21 -0.40 0.00 -2.02 0.00 0.00 63.50 61.41 2xah n PRO 642 Cb 0.60 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.77 2xah n PRO 642 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2xah s LEU 643 N -3.77 4.39 0.48 2.45 1.43 -1.26 -4.95 118.68 117.45 2xah s LEU 643 Ca 0.73 2.47 -0.23 0.00 -1.03 0.00 0.00 54.13 56.07 2xah s LEU 643 Cb -0.33 -3.76 -0.08 0.00 0.03 0.00 0.00 46.19 42.04 2xah s LEU 643 CO 0.51 -0.48 1.08 -0.81 0.23 0.00 0.00 176.35 176.87 2xah n PRO 644 N 0.67 1.38 0.02 1.29 -0.04 -1.26 -4.73 135.00 132.33 2xah n PRO 644 Ca 0.01 0.50 0.06 0.00 -0.04 0.00 0.00 63.50 64.04 2xah n PRO 644 Cb 0.44 -2.19 0.47 0.00 -0.04 0.00 0.00 33.50 32.19 2xah n PRO 644 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 2xah h GLU 645 N 1.38 0.43 -0.37 0.54 -0.00 -2.00 -0.22 114.58 114.33 2xah h GLU 645 Ca -0.47 -0.03 0.11 0.00 -0.00 0.00 0.00 59.36 58.98 2xah h GLU 645 Cb 1.33 -0.10 -0.01 0.00 -0.00 0.00 0.00 28.75 29.97 2xah h GLU 645 CO 0.56 0.28 0.33 0.11 -0.00 0.00 0.00 179.01 180.29 2xah h TRP 646 N 0.44 0.00 0.14 2.06 5.08 -2.00 -1.04 115.95 120.62 2xah h TRP 646 Ca 0.15 0.00 -0.31 0.00 1.08 0.00 0.00 58.89 59.81 2xah h TRP 646 Cb 0.07 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.23 2xah h TRP 646 CO -0.00 0.00 -1.62 -0.22 -1.28 0.00 0.00 178.44 175.32 2xah h LYS 647 N 0.00 0.29 -0.28 0.12 1.63 -1.38 -3.28 116.57 113.66 2xah h LYS 647 Ca 0.18 -0.50 -0.11 0.00 -0.85 0.00 0.00 60.65 59.37 2xah h LYS 647 Cb 0.83 0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.63 2xah h LYS 647 CO -0.00 1.24 -0.27 1.79 -3.45 0.00 0.00 179.45 178.75 2xah h THR 648 N -0.13 1.27 -0.58 1.00 1.35 -1.12 -1.72 112.91 112.99 2xah h THR 648 Ca -0.34 -1.34 0.03 0.00 -0.55 0.00 0.00 66.41 64.21 2xah h THR 648 Cb 1.90 1.36 -0.04 0.00 -1.73 0.00 0.00 68.15 69.64 2xah h THR 648 CO 0.09 0.43 0.35 0.28 -0.25 0.00 0.00 175.52 176.43 2xah h SER 649 N 0.49 0.58 -0.74 5.36 0.02 -1.38 0.60 113.55 118.48 2xah h SER 649 Ca 0.07 0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.11 2xah h SER 649 Cb 0.72 -0.12 -0.07 0.00 0.14 0.00 0.00 62.40 63.07 2xah h SER 649 CO 0.06 0.41 0.38 0.00 -1.14 0.00 0.00 176.83 176.53 2xah h ALA 650 N 1.25 1.03 -0.20 3.77 0.00 -1.49 0.28 119.26 123.89 2xah h ALA 650 Ca 0.23 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 2xah h ALA 650 Cb 0.02 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2xah h ALA 650 CO -0.10 -0.01 0.03 0.28 0.00 0.00 0.00 179.25 179.45 2xah h VAL 651 N 0.65 1.23 0.81 0.00 2.07 -0.58 -2.35 116.25 118.08 2xah h VAL 651 Ca 0.36 -0.76 -0.04 0.00 0.82 0.00 0.00 66.70 67.08 2xah h VAL 651 Cb 0.36 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 2xah h VAL 651 CO -0.26 0.23 -0.49 1.56 0.02 0.00 0.00 177.57 178.63 2xah h GLN 652 N 0.12 -1.18 -0.85 1.57 4.20 -0.42 -3.29 115.11 115.27 2xah h GLN 652 Ca 0.06 0.08 0.18 0.00 0.06 0.00 0.00 58.65 59.03 2xah h GLN 652 Cb 0.33 0.27 -0.11 0.00 0.30 0.00 0.00 27.48 28.27 2xah h GLN 652 CO 0.01 -0.78 0.38 0.00 -0.67 0.00 0.00 178.83 177.76 2xah h ARG 653 N -1.22 0.47 -7.27 1.46 3.08 -0.47 -3.43 114.38 107.00 2xah h ARG 653 Ca -0.11 -0.03 -0.52 0.00 0.07 0.00 0.00 59.98 59.39 2xah h ARG 653 Cb 0.97 -0.11 0.16 0.00 0.08 0.00 0.00 29.97 31.08 2xah h ARG 653 CO 0.12 0.31 0.29 -1.64 -1.07 0.00 0.00 179.97 177.98 2xah s MET 654 N -5.95 1.73 -0.12 0.04 -1.94 -0.89 -4.54 119.30 107.64 2xah s MET 654 Ca -0.12 1.44 -0.05 0.00 -1.71 0.00 0.00 55.69 55.26 2xah s MET 654 Cb 0.23 -1.82 -0.04 0.00 2.01 0.00 0.00 34.83 35.22 2xah s MET 654 CO 0.78 -2.08 0.06 0.20 -0.01 0.00 0.00 175.02 173.96 2xah s GLY 655 N -2.81 1.96 -0.32 -0.03 0.00 -1.00 -4.84 107.32 100.28 2xah s GLY 655 Ca 0.66 -0.74 0.01 0.00 0.00 0.00 0.00 44.72 44.65 2xah s GLY 655 CO 0.54 -0.38 0.08 -0.12 0.00 0.00 0.00 173.10 173.22 2xah s PHE 656 N -0.67 2.57 0.00 1.90 5.36 -1.26 -0.34 117.98 125.53 2xah s PHE 656 Ca 0.12 -2.26 0.00 0.00 -0.96 0.00 0.00 56.93 53.82 2xah s PHE 656 Cb -0.12 -2.22 0.00 0.00 -0.34 0.00 0.00 43.02 40.34 2xah s PHE 656 CO 0.02 -0.91 0.00 0.41 -1.46 0.00 0.00 175.22 173.29 2xah n GLY 657 N 4.60 0.27 3.33 13.12 0.00 0.17 -4.78 105.19 121.89 2xah n GLY 657 Ca 0.00 -1.80 -0.15 0.00 0.00 0.00 0.00 46.02 44.08 2xah n GLY 657 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2xah s ASN 658 N -1.00 -0.33 -0.28 1.61 2.47 -0.34 0.74 114.94 117.81 2xah s ASN 658 Ca 0.00 0.25 -0.23 0.00 0.42 0.00 0.00 52.86 53.29 2xah s ASN 658 Cb 0.00 0.39 0.11 0.00 -1.45 0.00 0.00 41.25 40.30 2xah s ASN 658 CO 0.00 -0.52 0.94 -0.22 -3.72 0.00 0.00 177.10 173.58 2xah s LEU 659 N -1.38 -0.55 0.17 3.21 2.96 -1.26 -4.21 118.68 117.61 2xah s LEU 659 Ca -0.12 1.03 0.07 0.00 -0.22 0.00 0.00 54.13 54.89 2xah s LEU 659 Cb -0.03 2.02 -0.04 0.00 0.50 0.00 0.00 46.19 48.64 2xah s LEU 659 CO 0.05 -0.17 -0.14 0.20 -1.32 0.00 0.00 176.35 174.96 2xah s ASN 660 N 0.49 2.31 0.08 3.68 0.01 -0.89 -4.73 114.94 115.89 2xah s ASN 660 Ca 0.00 -0.93 0.10 0.00 -0.71 0.00 0.00 52.86 51.32 2xah s ASN 660 Cb -0.05 -0.10 -0.03 0.00 0.41 0.00 0.00 41.25 41.48 2xah s ASN 660 CO -0.07 -0.16 -0.26 -0.54 -1.51 0.00 0.00 177.10 174.56 2xah s LYS 661 N -3.24 1.65 -0.16 -0.60 1.02 -1.26 -0.80 119.74 116.36 2xah s LYS 661 Ca 0.17 -1.20 0.01 0.00 0.02 0.00 0.00 55.97 54.96 2xah s LYS 661 Cb -0.02 -1.97 0.00 0.00 -0.52 0.00 0.00 37.83 35.32 2xah s LYS 661 CO 0.05 0.49 -0.17 0.08 -0.92 0.00 0.00 175.35 174.87 2xah s VAL 662 N -0.94 2.43 -0.35 3.17 1.01 -0.35 -2.16 120.40 123.22 2xah s VAL 662 Ca 0.13 -0.84 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 2xah s VAL 662 Cb -0.10 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.27 2xah s VAL 662 CO 0.04 0.52 0.21 -0.69 0.00 0.00 0.00 175.10 175.18 2xah s VAL 663 N 0.94 4.87 -0.33 2.92 1.01 0.33 -1.07 120.40 129.07 2xah s VAL 663 Ca -0.03 -0.50 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 2xah s VAL 663 Cb -0.15 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.68 2xah s VAL 663 CO -0.03 -0.07 0.12 -0.76 0.00 0.00 0.00 175.10 174.35 2xah s LEU 664 N 1.64 4.18 -0.29 3.92 1.43 0.29 -2.41 118.68 127.45 2xah s LEU 664 Ca 0.04 -0.90 -0.07 0.00 -1.03 0.00 0.00 54.13 52.18 2xah s LEU 664 Cb -0.18 -1.91 0.01 0.00 0.03 0.00 0.00 46.19 44.14 2xah s LEU 664 CO 0.08 -0.27 0.07 0.00 0.23 0.00 0.00 176.35 176.46 2xah s PHE 666 N 1.50 2.48 -0.71 0.00 0.08 -0.52 0.40 117.98 121.22 2xah s PHE 666 Ca 0.03 -0.48 0.26 0.00 0.12 0.00 0.00 56.93 56.85 2xah s PHE 666 Cb -0.17 -1.47 0.68 0.00 -0.57 0.00 0.00 43.02 41.49 2xah s PHE 666 CO 0.02 0.51 1.65 -0.40 -0.10 0.00 0.00 175.22 176.90 2xah n ASP 667 N -0.89 0.78 -3.78 1.36 5.75 -1.26 -4.45 116.55 114.06 2xah n ASP 667 Ca -0.04 0.44 -0.13 0.00 -0.01 0.00 0.00 54.79 55.05 2xah n ASP 667 Cb 0.63 -0.52 -0.11 0.00 -1.03 0.00 0.00 41.12 40.08 2xah n ASP 667 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2xah s ARG 668 N -3.12 0.32 0.22 0.11 3.03 -1.26 -4.97 118.95 113.27 2xah s ARG 668 Ca 0.09 0.38 -0.32 0.00 2.03 0.00 0.00 55.73 57.91 2xah s ARG 668 Cb 0.13 0.15 -0.13 0.00 -1.03 0.00 0.00 34.95 34.07 2xah s ARG 668 CO 0.63 -0.04 1.56 0.28 -1.13 0.00 0.00 175.30 176.60 2xah n VAL 669 N 2.94 0.46 -1.50 4.99 0.31 -1.26 -4.88 118.33 119.38 2xah n VAL 669 Ca -0.13 -0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2xah n VAL 669 Cb 0.58 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.84 2xah n VAL 669 CO 0.00 0.00 0.00 2.22 -1.32 0.00 0.00 176.83 177.73 2xah n PHE 670 N 2.84 0.00 -4.45 3.52 1.16 -1.26 -5.09 117.46 114.18 2xah n PHE 670 Ca 0.14 -0.01 -0.25 0.00 -1.87 0.00 0.00 57.45 55.46 2xah n PHE 670 Cb 0.32 -0.03 -0.04 0.00 -1.61 0.00 0.00 39.48 38.12 2xah n PHE 670 CO 0.00 0.00 0.00 -2.67 -1.87 0.00 0.00 176.76 172.22 2xah n TRP 671 N -0.02 0.60 -2.64 2.97 2.14 -1.26 -4.99 117.44 114.24 2xah n TRP 671 Ca 0.00 -1.97 -0.42 0.00 2.07 0.00 0.00 57.50 57.18 2xah n TRP 671 Cb 0.60 -0.29 -0.03 0.00 -0.81 0.00 0.00 31.31 30.79 2xah n TRP 671 CO 0.00 0.00 0.00 0.34 2.07 0.00 0.00 177.69 180.10 2xah s ASP 672 N -3.29 6.35 0.48 -0.67 -1.08 -1.26 -4.88 116.67 112.32 2xah s ASP 672 Ca 0.05 -0.17 0.36 0.00 -0.52 0.00 0.00 52.55 52.28 2xah s ASP 672 Cb -0.00 -2.52 1.52 0.00 -1.46 0.00 0.00 42.92 40.45 2xah s ASP 672 CO 0.03 -1.50 1.64 -0.65 0.52 0.00 0.00 175.17 175.21 2xah h PRO 673 N 9.60 0.06 -0.58 4.34 0.11 -1.99 0.27 132.00 143.80 2xah h PRO 673 Ca -0.26 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 2xah h PRO 673 Cb 1.06 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.16 2xah h PRO 673 CO 1.19 0.04 0.00 -1.13 -0.21 0.00 0.00 178.00 177.89 2xah n SER 674 N -4.41 3.30 -4.25 -2.05 3.41 -1.26 -4.81 113.62 103.56 2xah n SER 674 Ca 0.37 -2.15 -0.33 0.00 -0.26 0.00 0.00 58.87 56.50 2xah n SER 674 Cb 1.54 -0.43 -0.15 0.00 -0.26 0.00 0.00 64.21 64.91 2xah n SER 674 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2xah s VAL 675 N -1.49 2.58 -0.09 -3.33 1.01 0.94 -5.01 120.40 115.01 2xah s VAL 675 Ca 0.38 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.57 2xah s VAL 675 Cb 0.22 -2.08 -0.25 0.00 0.00 0.00 0.00 36.38 34.26 2xah s VAL 675 CO 0.22 0.52 0.47 0.59 0.00 0.00 0.00 175.10 176.90 2xah n ASN 676 N 4.10 1.64 -3.96 3.32 5.03 -1.26 -4.52 115.26 119.62 2xah n ASN 676 Ca -0.19 0.28 -0.11 0.00 0.87 0.00 0.00 54.58 55.43 2xah n ASN 676 Cb 0.52 -0.54 -0.12 0.00 -1.02 0.00 0.00 39.78 38.61 2xah n ASN 676 CO 0.00 0.00 0.00 -1.48 -1.83 0.00 0.00 177.26 173.95 2xah s LEU 677 N -6.67 2.16 -0.11 3.41 2.34 -1.26 0.87 118.68 119.43 2xah s LEU 677 Ca -0.16 -0.33 -0.08 0.00 0.06 0.00 0.00 54.13 53.62 2xah s LEU 677 Cb 0.07 0.01 0.04 0.00 -0.56 0.00 0.00 46.19 45.75 2xah s LEU 677 CO 0.79 -0.18 0.27 0.72 -1.06 0.00 0.00 176.35 176.90 2xah s PHE 678 N -0.93 -0.33 0.42 3.48 -0.71 -0.82 -4.10 117.98 114.99 2xah s PHE 678 Ca -0.09 0.79 -0.08 0.00 -1.04 0.00 0.00 56.93 56.51 2xah s PHE 678 Cb -0.07 0.10 -0.05 0.00 -1.21 0.00 0.00 43.02 41.79 2xah s PHE 678 CO -0.00 -0.19 0.76 0.20 -1.34 0.00 0.00 175.22 174.64 2xah s GLY 679 N 0.63 1.75 -0.08 1.99 0.00 -0.56 -1.66 107.32 109.40 2xah s GLY 679 Ca -0.04 -0.36 0.04 0.00 0.00 0.00 0.00 44.72 44.36 2xah s GLY 679 CO -0.04 -0.19 -0.20 -1.58 0.00 0.00 0.00 173.10 171.10 2xah s HIS 680 N -2.49 2.09 -0.17 1.90 5.04 -0.99 -2.49 115.29 118.17 2xah s HIS 680 Ca 0.49 -0.77 -0.19 0.00 -1.54 0.00 0.00 55.06 53.04 2xah s HIS 680 Cb -0.10 -1.42 -0.03 0.00 0.04 0.00 0.00 32.58 31.06 2xah s HIS 680 CO 0.37 -0.31 0.55 0.08 -2.34 0.00 0.00 174.74 173.09 2xah s VAL 681 N 0.32 5.10 0.98 0.89 1.01 -0.95 -4.53 120.40 123.22 2xah s VAL 681 Ca -0.13 1.05 -0.14 0.00 0.00 0.00 0.00 61.98 62.76 2xah s VAL 681 Cb -0.16 -3.88 0.18 0.00 0.00 0.00 0.00 36.38 32.52 2xah s VAL 681 CO 0.06 0.20 1.16 -0.83 0.00 0.00 0.00 175.10 175.69 2xah s GLY 682 N 1.03 1.61 -0.02 4.51 0.00 -1.26 -3.26 107.32 109.93 2xah s GLY 682 Ca 0.27 -0.72 0.06 0.00 0.00 0.00 0.00 44.72 44.33 2xah s GLY 682 CO 0.11 -0.06 0.77 1.48 0.00 0.00 0.00 173.10 175.40 2xah h SER 683 N -1.75 0.12 -1.97 1.64 4.64 -1.95 -3.43 113.55 110.85 2xah h SER 683 Ca -0.49 -0.22 -0.61 0.00 -0.47 0.00 0.00 61.79 60.01 2xah h SER 683 Cb 1.31 -0.04 -0.13 0.00 -0.31 0.00 0.00 62.40 63.23 2xah h SER 683 CO 0.52 1.19 -0.68 -0.89 -0.87 0.00 0.00 176.83 176.11 2xah s THR 684 N -2.62 2.36 0.11 2.95 2.01 -1.26 -4.99 115.64 114.20 2xah s THR 684 Ca -0.07 -2.18 -0.22 0.00 0.31 0.00 0.00 61.69 59.54 2xah s THR 684 Cb 0.08 -2.64 -0.09 0.00 0.01 0.00 0.00 72.50 69.85 2xah s THR 684 CO 0.82 -0.23 1.72 0.74 -0.69 0.00 0.00 174.62 176.98 2xah h THR 685 N 2.00 0.87 -0.27 -0.82 2.02 -1.95 -3.06 112.91 111.70 2xah h THR 685 Ca -0.42 0.00 0.08 0.00 0.77 0.00 0.00 66.41 66.84 2xah h THR 685 Cb 1.25 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 68.52 2xah h THR 685 CO 0.68 0.00 0.45 0.00 0.37 0.00 0.00 175.52 177.03 2xah h ALA 686 N 1.00 1.85 0.00 6.16 0.00 -2.02 -1.80 119.26 124.45 2xah h ALA 686 Ca 0.04 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.86 2xah h ALA 686 Cb 0.11 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 17.75 2xah h ALA 686 CO -0.09 -0.59 -0.71 -1.13 0.00 0.00 0.00 179.25 176.73 2xah n SER 687 N -3.34 1.36 -0.23 0.00 3.41 -1.19 -4.66 113.62 108.98 2xah n SER 687 Ca 0.04 -2.97 0.20 0.00 -0.26 0.00 0.00 58.87 55.88 2xah n SER 687 Cb 0.58 -0.41 0.54 0.00 -0.26 0.00 0.00 64.21 64.66 2xah n SER 687 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 2xah h ARG 688 N 0.91 0.33 0.00 4.33 0.11 -1.22 -1.20 114.38 117.63 2xah h ARG 688 Ca -0.10 -0.02 -0.03 0.00 0.10 0.00 0.00 59.98 59.94 2xah h ARG 688 Cb 1.40 -0.07 -0.00 0.00 1.11 0.00 0.00 29.97 32.40 2xah h ARG 688 CO 0.04 0.22 -0.13 0.78 0.10 0.00 0.00 179.97 180.99 2xah h GLY 689 N 0.34 0.00 -6.05 0.08 0.00 -1.85 -3.41 103.07 92.19 2xah h GLY 689 Ca 0.46 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.23 2xah h GLY 689 CO -0.15 0.00 1.18 1.85 0.00 0.00 0.00 176.54 179.42 2xah s GLU 690 N -3.59 3.77 -0.49 4.80 2.12 -0.46 -2.33 118.70 122.53 2xah s GLU 690 Ca 0.02 1.83 -0.02 0.00 0.36 0.00 0.00 54.97 57.15 2xah s GLU 690 Cb 0.09 -4.09 0.02 0.00 0.26 0.00 0.00 34.13 30.42 2xah s GLU 690 CO 0.61 -1.33 0.08 1.28 -0.54 0.00 0.00 175.26 175.35 2xah n LEU 691 N 8.67 -0.46 0.00 2.70 4.77 -1.02 -4.77 117.00 126.90 2xah n LEU 691 Ca 0.20 0.24 0.04 0.00 -0.03 0.00 0.00 56.01 56.46 2xah n LEU 691 Cb 0.45 -1.41 0.23 0.00 -2.33 0.00 0.00 43.42 40.35 2xah n LEU 691 CO 0.65 -0.01 0.43 2.22 -1.33 0.00 0.00 177.39 179.35 2xah n PHE 692 N -2.93 0.00 -3.64 -1.77 -1.74 -1.12 -4.61 117.46 101.65 2xah n PHE 692 Ca -0.03 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.76 2xah n PHE 692 Cb 0.53 0.00 -0.07 0.00 1.52 0.00 0.00 39.48 41.46 2xah n PHE 692 CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 2xah s LEU 693 N -1.68 -0.52 0.00 5.98 2.96 -1.26 -2.35 118.68 121.81 2xah s LEU 693 Ca 0.12 1.00 0.06 0.00 -0.22 0.00 0.00 54.13 55.09 2xah s LEU 693 Cb 0.05 2.01 -0.02 0.00 0.50 0.00 0.00 46.19 48.73 2xah s LEU 693 CO 0.09 -0.17 -0.20 -0.36 -1.32 0.00 0.00 176.35 174.39 2xah s PHE 694 N 0.32 1.77 -0.18 5.38 0.40 -0.66 -1.56 117.98 123.44 2xah s PHE 694 Ca 0.02 -0.34 -0.01 0.00 -0.60 0.00 0.00 56.93 56.00 2xah s PHE 694 Cb -0.05 -1.11 0.00 0.00 0.51 0.00 0.00 43.02 42.37 2xah s PHE 694 CO -0.05 0.00 -0.14 -1.58 0.70 0.00 0.00 175.22 174.15 2xah s TRP 695 N -0.56 2.82 -0.53 0.36 0.52 0.97 -1.94 118.94 120.59 2xah s TRP 695 Ca 0.07 -1.15 -0.16 0.00 0.02 0.00 0.00 56.10 54.88 2xah s TRP 695 Cb -0.08 -1.95 0.12 0.00 -1.15 0.00 0.00 33.47 30.41 2xah s TRP 695 CO -0.00 -0.56 0.49 1.21 0.02 0.00 0.00 176.95 178.10 2xah s ASN 696 N 1.07 6.18 0.00 2.95 2.47 0.25 -1.29 114.94 126.58 2xah s ASN 696 Ca -0.00 -1.68 0.00 0.00 0.42 0.00 0.00 52.86 51.59 2xah s ASN 696 Cb -0.14 -2.21 0.00 0.00 -1.45 0.00 0.00 41.25 37.45 2xah s ASN 696 CO -0.04 -0.83 0.00 0.18 -3.72 0.00 0.00 177.10 172.69 2xah n LEU 697 N 5.29 0.15 -4.98 3.21 4.77 -1.26 -4.43 117.00 119.75 2xah n LEU 697 Ca -0.13 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.64 2xah n LEU 697 Cb 0.41 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.49 2xah n LEU 697 CO 0.53 0.03 0.07 -0.31 -1.33 0.00 0.00 177.39 176.38 2xah s TYR 698 N -1.97 3.21 0.08 -1.77 1.51 -1.26 -4.99 117.35 112.17 2xah s TYR 698 Ca 0.00 -0.09 -0.34 0.00 -1.01 0.00 0.00 57.07 55.63 2xah s TYR 698 Cb 0.00 -1.95 -0.16 0.00 -0.11 0.00 0.00 41.96 39.74 2xah s TYR 698 CO 0.00 0.04 1.60 0.87 -1.11 0.00 0.00 175.55 176.95 2xah h LYS 699 N 0.88 -0.89 -6.87 -0.62 1.57 -1.96 -3.45 116.57 105.22 2xah h LYS 699 Ca -0.47 0.06 -0.54 0.00 -1.87 0.00 0.00 60.65 57.83 2xah h LYS 699 Cb 1.25 0.20 0.20 0.00 0.08 0.00 0.00 32.23 33.97 2xah h LYS 699 CO 0.55 -0.59 -0.33 0.00 -0.57 0.00 0.00 179.45 178.50 2xah n ALA 700 N -2.66 -1.88 -2.47 3.86 0.00 -1.26 -4.87 120.51 111.23 2xah n ALA 700 Ca -0.12 -0.51 -0.40 0.00 0.00 0.00 0.00 53.44 52.42 2xah n ALA 700 Cb 0.41 -1.91 -0.01 0.00 0.00 0.00 0.00 19.45 17.94 2xah n ALA 700 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2xah s PRO 701 N -3.67 3.66 -0.06 0.00 0.04 -1.26 -4.92 135.00 128.80 2xah s PRO 701 Ca 0.62 -1.82 0.05 0.00 0.04 0.00 0.00 61.00 59.88 2xah s PRO 701 Cb -0.25 -5.48 -0.01 0.00 0.04 0.00 0.00 34.50 28.81 2xah s PRO 701 CO 0.63 -2.64 -0.22 0.42 0.04 0.00 0.00 177.00 175.23 2xah s ILE 702 N 5.71 1.79 -0.08 0.56 1.01 -1.26 -1.44 121.20 127.49 2xah s ILE 702 Ca 0.57 -0.91 0.00 0.00 0.00 0.00 0.00 60.65 60.31 2xah s ILE 702 Cb 0.03 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 2xah s ILE 702 CO 0.09 0.50 -0.06 -0.76 0.00 0.00 0.00 174.94 174.71 2xah s LEU 703 N 0.01 3.19 -0.12 2.97 1.43 0.48 -4.33 118.68 122.31 2xah s LEU 703 Ca -0.06 -0.03 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2xah s LEU 703 Cb -0.14 -1.71 -0.03 0.00 0.03 0.00 0.00 46.19 44.35 2xah s LEU 703 CO 0.04 0.33 -0.05 -0.76 0.23 0.00 0.00 176.35 176.14 2xah s LEU 704 N -0.63 3.20 -0.14 1.79 1.43 -0.41 -0.54 118.68 123.37 2xah s LEU 704 Ca 0.09 -0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.12 2xah s LEU 704 Cb -0.12 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.38 2xah s LEU 704 CO 0.02 0.24 -0.19 0.00 0.23 0.00 0.00 176.35 176.65 2xah s ALA 705 N -0.08 2.07 0.44 4.21 0.00 -0.23 -0.02 121.76 128.15 2xah s ALA 705 Ca 0.01 -1.00 -0.22 0.00 0.00 0.00 0.00 51.96 50.75 2xah s ALA 705 Cb -0.13 -1.00 -0.09 0.00 0.00 0.00 0.00 23.12 21.90 2xah s ALA 705 CO 0.03 -0.16 1.06 -0.51 0.00 0.00 0.00 175.76 176.17 2xah s LEU 706 N 1.06 4.01 -0.24 0.00 1.02 -0.60 -1.21 118.68 122.72 2xah s LEU 706 Ca -0.03 2.02 0.01 0.00 0.02 0.00 0.00 54.13 56.16 2xah s LEU 706 Cb -0.14 -4.34 0.06 0.00 0.02 0.00 0.00 46.19 41.78 2xah s LEU 706 CO -0.05 -0.65 -0.07 -0.69 0.02 0.00 0.00 176.35 174.91 2xah s VAL 707 N -1.77 1.65 0.00 -1.59 1.01 0.02 -2.43 120.40 117.29 2xah s VAL 707 Ca 0.62 -1.27 0.00 0.00 0.00 0.00 0.00 61.98 61.33 2xah s VAL 707 Cb -0.20 -1.87 0.00 0.00 0.00 0.00 0.00 36.38 34.31 2xah s VAL 707 CO 0.25 -0.06 0.00 0.00 0.00 0.00 0.00 175.10 175.29 2xah n ALA 708 N 4.63 0.00 -0.74 5.51 0.00 -0.98 -2.08 120.51 126.84 2xah n ALA 708 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 2xah n ALA 708 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.89 2xah n ALA 708 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2xah n GLY 709 N 5.00 1.38 0.26 0.00 0.00 -1.26 -1.60 105.19 108.97 2xah n GLY 709 Ca 0.00 -0.53 0.11 0.00 0.00 0.00 0.00 46.02 45.60 2xah n GLY 709 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2xah h GLU 710 N 0.00 0.00 -0.39 1.61 4.39 -1.92 -2.96 114.58 115.31 2xah h GLU 710 Ca 0.00 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.61 2xah h GLU 710 Cb 0.00 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.63 2xah h GLU 710 CO 0.00 0.12 -0.12 0.00 -1.16 0.00 0.00 179.01 177.84 2xah h ALA 711 N 1.88 1.05 -0.50 3.43 0.00 -1.71 -3.25 119.26 120.16 2xah h ALA 711 Ca -0.00 -0.31 0.07 0.00 0.00 0.00 0.00 54.91 54.67 2xah h ALA 711 Cb 0.29 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.86 2xah h ALA 711 CO 0.02 0.58 0.16 0.00 0.00 0.00 0.00 179.25 180.01 2xah h ALA 712 N 1.23 0.60 -0.76 0.00 0.00 -1.12 -1.00 119.26 118.22 2xah h ALA 712 Ca 0.11 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2xah h ALA 712 Cb 0.58 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 2xah h ALA 712 CO 0.04 -0.24 0.26 0.78 0.00 0.00 0.00 179.25 180.09 2xah h GLY 713 N 0.33 1.26 1.38 0.00 0.00 -1.75 -3.18 103.07 101.10 2xah h GLY 713 Ca 0.24 -0.72 -0.26 0.00 0.00 0.00 0.00 47.33 46.59 2xah h GLY 713 CO -0.26 0.68 -1.04 -2.22 0.00 0.00 0.00 176.54 173.69 2xah h ILE 714 N 1.13 1.34 0.00 2.60 2.04 -1.52 -3.16 117.51 119.94 2xah h ILE 714 Ca 0.25 -2.40 0.00 0.00 1.00 0.00 0.00 64.86 63.71 2xah h ILE 714 Cb 0.28 2.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 2xah h ILE 714 CO -0.01 0.73 0.00 0.24 0.00 0.00 0.00 178.15 179.11 2xah h MET 715 N 0.30 0.00 0.00 2.37 2.86 -1.18 -2.73 114.93 116.55 2xah h MET 715 Ca -0.12 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.44 2xah h MET 715 Cb 1.69 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.34 2xah h MET 715 CO 0.19 0.00 -0.40 0.93 1.06 0.00 0.00 176.91 178.69 2xah h GLU 716 N 0.00 0.00 -0.14 1.72 5.08 -1.54 -2.21 114.58 117.50 2xah h GLU 716 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2xah h GLU 716 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2xah h GLU 716 CO 0.00 0.40 0.00 0.09 -1.00 0.00 0.00 179.01 178.50 2xah n ASN 717 N -3.64 0.35 -4.51 1.42 3.02 -1.03 -4.86 115.26 106.01 2xah n ASN 717 Ca -0.01 -2.01 -0.33 0.00 -0.03 0.00 0.00 54.58 52.20 2xah n ASN 717 Cb 0.50 -0.08 -0.12 0.00 -0.61 0.00 0.00 39.78 39.47 2xah n ASN 717 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2xah s ILE 718 N -1.86 3.44 0.65 2.41 1.01 -0.83 -5.09 121.20 120.92 2xah s ILE 718 Ca 0.03 -0.57 -0.17 0.00 0.00 0.00 0.00 60.65 59.94 2xah s ILE 718 Cb 0.02 -2.40 -0.04 0.00 0.01 0.00 0.00 42.46 40.05 2xah s ILE 718 CO 0.02 0.58 0.87 -1.54 0.00 0.00 0.00 174.94 174.87 2xah n SER 719 N 2.54 0.27 -0.17 3.58 3.41 -1.26 -4.84 113.62 117.15 2xah n SER 719 Ca -0.18 0.73 -0.04 0.00 -0.26 0.00 0.00 58.87 59.13 2xah n SER 719 Cb 0.53 -1.35 0.06 0.00 -0.26 0.00 0.00 64.21 63.18 2xah n SER 719 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2xah h ASP 720 N 0.15 0.34 0.50 4.04 5.19 -1.97 -2.53 116.42 122.13 2xah h ASP 720 Ca -0.48 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 55.95 2xah h ASP 720 Cb 1.36 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 40.83 2xah h ASP 720 CO 0.48 0.23 -0.37 0.44 -3.12 0.00 0.00 179.24 176.91 2xah h ASP 721 N 0.48 -0.96 -1.04 6.45 3.32 -1.98 0.26 116.42 122.95 2xah h ASP 721 Ca 0.23 0.07 0.28 0.00 0.02 0.00 0.00 57.03 57.63 2xah h ASP 721 Cb 0.16 0.30 -0.12 0.00 0.22 0.00 0.00 39.33 39.89 2xah h ASP 721 CO -0.17 -0.55 0.63 0.58 -1.72 0.00 0.00 179.24 178.01 2xah h VAL 722 N -0.85 0.45 0.21 -1.35 2.07 -1.92 0.68 116.25 115.55 2xah h VAL 722 Ca -0.05 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2xah h VAL 722 Cb 0.72 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.46 2xah h VAL 722 CO 0.01 0.08 -0.10 0.40 0.02 0.00 0.00 177.57 177.98 2xah h ILE 723 N 0.44 0.87 -0.05 4.57 2.04 -0.83 -1.52 117.51 123.02 2xah h ILE 723 Ca 0.67 -0.75 0.02 0.00 1.00 0.00 0.00 64.86 65.79 2xah h ILE 723 Cb 1.51 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 38.87 2xah h ILE 723 CO -0.45 0.16 0.05 0.58 0.00 0.00 0.00 178.15 178.49 2xah h VAL 724 N -0.68 0.65 0.00 1.67 2.07 0.21 -0.66 116.25 119.52 2xah h VAL 724 Ca -0.03 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2xah h VAL 724 Cb 0.48 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2xah h VAL 724 CO 0.05 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.25 2xah n GLY 725 N -1.41 -2.70 0.47 2.17 0.00 0.23 -0.91 105.19 103.03 2xah n GLY 725 Ca -0.02 0.18 0.39 0.00 0.00 0.00 0.00 46.02 46.58 2xah n GLY 725 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2xah h ARG 726 N 0.00 0.02 0.34 1.61 3.08 -1.05 0.31 114.38 118.69 2xah h ARG 726 Ca 0.00 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2xah h ARG 726 Cb 0.00 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2xah h ARG 726 CO 0.00 0.01 -0.24 0.00 -1.07 0.00 0.00 179.97 178.67 2xah h LEU 728 N -0.58 -0.10 -0.11 0.00 3.38 0.15 -2.61 115.31 115.44 2xah h LEU 728 Ca -0.03 -0.21 0.01 0.00 0.09 0.00 0.00 57.88 57.74 2xah h LEU 728 Cb 0.50 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2xah h LEU 728 CO 0.01 0.15 -0.06 0.00 0.09 0.00 0.00 178.44 178.63 2xah n ALA 729 N -2.27 -0.07 -0.12 1.53 0.00 -0.61 -0.73 120.51 118.24 2xah n ALA 729 Ca -0.08 0.09 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 2xah n ALA 729 Cb 0.17 0.22 0.01 0.00 0.00 0.00 0.00 19.45 19.86 2xah n ALA 729 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2xah h ILE 730 N 0.00 0.45 -0.55 0.00 2.04 -1.29 -1.02 117.51 117.13 2xah h ILE 730 Ca 0.02 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.89 2xah h ILE 730 Cb 0.04 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 36.54 2xah h ILE 730 CO -0.10 0.00 0.36 -0.07 0.00 0.00 0.00 178.15 178.34 2xah h LEU 731 N -0.10 0.61 0.34 1.44 3.38 -0.53 -1.79 115.31 118.67 2xah h LEU 731 Ca 0.20 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 2xah h LEU 731 Cb 0.41 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 2xah h LEU 731 CO -0.48 0.44 -0.47 0.11 0.09 0.00 0.00 178.44 178.13 2xah h LYS 732 N 0.73 -0.83 -0.64 1.13 1.57 -0.66 -0.67 116.57 117.20 2xah h LYS 732 Ca 0.21 0.06 0.25 0.00 -1.87 0.00 0.00 60.65 59.29 2xah h LYS 732 Cb -0.06 0.19 -0.12 0.00 0.08 0.00 0.00 32.23 32.32 2xah h LYS 732 CO -0.06 -0.55 0.28 0.41 -0.57 0.00 0.00 179.45 178.97 2xah n GLY 733 N -1.52 -0.55 0.04 3.86 0.00 -0.41 0.25 105.19 106.86 2xah n GLY 733 Ca -0.10 0.54 0.09 0.00 0.00 0.00 0.00 46.02 46.55 2xah n GLY 733 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2xah n ILE 734 N -4.51 0.29 0.00 -0.61 -0.00 -0.74 -4.46 119.36 109.33 2xah n ILE 734 Ca 0.23 -0.55 0.00 0.00 -0.00 0.00 0.00 62.75 62.43 2xah n ILE 734 Cb 0.76 -0.14 0.00 0.00 -0.00 0.00 0.00 39.64 40.26 2xah n ILE 734 CO 0.00 0.00 0.00 0.49 -0.00 0.00 0.00 176.55 177.04 2xah n PHE 735 N -2.42 0.00 0.00 1.39 3.72 0.00 -4.97 117.46 115.19 2xah n PHE 735 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 2xah n PHE 735 Cb 0.62 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.16 2xah n PHE 735 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2xah n GLY 736 N 0.98 1.82 0.08 1.37 0.00 0.14 -4.67 105.19 104.90 2xah n GLY 736 Ca 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 45.02 2xah n GLY 736 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2xah n SER 737 N 0.00 0.00 0.00 1.61 2.88 -1.23 -0.13 113.62 116.75 2xah n SER 737 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2xah n SER 737 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2xah n SER 737 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2xah n SER 738 N -0.01 0.00 0.07 -3.46 3.41 -1.26 -4.77 113.62 107.61 2xah n SER 738 Ca 0.00 -1.00 0.12 0.00 -0.26 0.00 0.00 58.87 57.73 2xah n SER 738 Cb 0.00 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.12 2xah n SER 738 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2xah h ALA 739 N 0.00 0.61 -2.55 7.33 0.00 -0.80 -3.45 119.26 120.40 2xah h ALA 739 Ca 0.00 0.00 -0.75 0.00 0.00 0.00 0.00 54.91 54.16 2xah h ALA 739 Cb 0.75 0.00 -0.27 0.00 0.00 0.00 0.00 17.79 18.27 2xah h ALA 739 CO 0.00 0.00 -0.21 0.08 0.00 0.00 0.00 179.25 179.12 2xah s VAL 740 N -3.18 4.84 0.61 0.00 1.01 -1.24 -4.83 120.40 117.61 2xah s VAL 740 Ca 0.06 -1.97 -0.10 0.00 0.00 0.00 0.00 61.98 59.97 2xah s VAL 740 Cb 0.13 -4.10 0.14 0.00 0.00 0.00 0.00 36.38 32.55 2xah s VAL 740 CO 0.72 -0.88 0.73 -0.81 0.00 0.00 0.00 175.10 174.85 2xah n PRO 741 N 4.66 -1.19 -2.34 2.72 -0.04 -1.26 -4.99 135.00 132.56 2xah n PRO 741 Ca -0.03 -1.13 -0.38 0.00 -0.04 0.00 0.00 63.50 61.92 2xah n PRO 741 Cb 0.42 -0.83 -0.02 0.00 -0.04 0.00 0.00 33.50 33.02 2xah n PRO 741 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 2xah s GLN 742 N -4.60 4.00 0.10 0.54 -1.52 -1.26 -5.01 119.66 111.90 2xah s GLN 742 Ca 0.43 1.75 -0.30 0.00 -1.95 0.00 0.00 55.36 55.28 2xah s GLN 742 Cb -0.02 -2.58 -0.06 0.00 -0.22 0.00 0.00 33.01 30.14 2xah s GLN 742 CO 0.31 -0.34 1.09 -2.14 -0.25 0.00 0.00 175.29 173.96 2xah s PRO 743 N -2.44 4.55 0.20 2.91 0.02 -1.26 -4.82 135.00 134.14 2xah s PRO 743 Ca 0.59 1.64 -0.08 0.00 0.02 0.00 0.00 61.00 63.17 2xah s PRO 743 Cb -0.28 -3.35 0.11 0.00 0.02 0.00 0.00 34.50 31.00 2xah s PRO 743 CO 0.35 -0.04 1.66 0.87 -0.33 0.00 0.00 177.00 179.51 2xah h LYS 744 N 6.06 1.04 -3.61 5.54 1.79 -0.40 -3.44 116.57 123.53 2xah h LYS 744 Ca -0.43 -0.32 -0.25 0.00 -2.18 0.00 0.00 60.65 57.47 2xah h LYS 744 Cb 1.21 -0.10 -0.30 0.00 -1.58 0.00 0.00 32.23 31.46 2xah h LYS 744 CO 0.76 1.01 -0.70 -1.21 -1.08 0.00 0.00 179.45 178.22 2xah s GLU 745 N -5.03 0.00 0.04 3.15 0.41 -1.18 -5.05 118.70 111.04 2xah s GLU 745 Ca -0.11 0.09 0.04 0.00 -0.41 0.00 0.00 54.97 54.58 2xah s GLU 745 Cb 0.14 -0.08 -0.02 0.00 -1.78 0.00 0.00 34.13 32.38 2xah s GLU 745 CO 0.85 -0.06 -0.12 0.95 -0.49 0.00 0.00 175.26 176.38 2xah s THR 746 N 0.41 0.97 0.03 3.63 -4.23 -1.26 -1.90 115.64 113.28 2xah s THR 746 Ca -0.03 -1.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.50 2xah s THR 746 Cb -0.05 -0.90 -0.02 0.00 1.34 0.00 0.00 72.50 72.87 2xah s THR 746 CO -0.01 -0.08 -0.07 -0.69 -0.54 0.00 0.00 174.62 173.22 2xah s VAL 747 N -0.94 0.54 -0.13 2.29 1.01 -1.01 -4.98 120.40 117.17 2xah s VAL 747 Ca -0.01 -0.82 -0.00 0.00 0.00 0.00 0.00 61.98 61.15 2xah s VAL 747 Cb -0.08 -0.56 0.03 0.00 0.00 0.00 0.00 36.38 35.77 2xah s VAL 747 CO 0.01 -0.21 -0.09 -0.69 0.00 0.00 0.00 175.10 174.12 2xah s VAL 748 N -0.97 1.20 0.48 2.92 1.01 -1.26 -0.51 120.40 123.27 2xah s VAL 748 Ca -0.06 -0.46 -0.23 0.00 0.00 0.00 0.00 61.98 61.23 2xah s VAL 748 Cb -0.07 -1.22 -0.07 0.00 0.00 0.00 0.00 36.38 35.02 2xah s VAL 748 CO 0.00 0.34 1.33 -0.94 0.00 0.00 0.00 175.10 175.83 2xah s SER 749 N 1.63 5.75 -0.44 3.32 1.04 -0.92 -5.01 113.70 119.06 2xah s SER 749 Ca 0.04 2.69 0.05 0.00 0.48 0.00 0.00 55.95 59.21 2xah s SER 749 Cb -0.13 -2.63 0.18 0.00 0.10 0.00 0.00 66.02 63.54 2xah s SER 749 CO -0.09 -1.24 0.39 0.54 0.98 0.00 0.00 173.24 173.83 2xah n ARG 750 N -0.55 0.48 -0.01 4.02 1.74 -1.26 -4.56 116.66 116.52 2xah n ARG 750 Ca 0.07 -3.35 -0.04 0.00 -0.77 0.00 0.00 57.85 53.77 2xah n ARG 750 Cb 0.45 -1.67 0.20 0.00 -1.02 0.00 0.00 32.46 30.41 2xah n ARG 750 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 2xah h TRP 751 N 5.32 0.61 0.00 -1.55 4.06 -1.87 -1.88 115.95 120.64 2xah h TRP 751 Ca 0.23 -0.12 -0.05 0.00 2.06 0.00 0.00 58.89 61.01 2xah h TRP 751 Cb 0.88 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 28.88 2xah h TRP 751 CO 0.33 0.71 -0.25 -0.09 -3.56 0.00 0.00 178.44 175.58 2xah h ARG 752 N 0.50 0.00 -0.01 0.49 9.65 -1.87 -0.83 114.38 122.31 2xah h ARG 752 Ca 0.08 0.00 -0.22 0.00 -1.10 0.00 0.00 59.98 58.75 2xah h ARG 752 Cb 0.60 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 29.20 2xah h ARG 752 CO 0.04 0.25 -0.84 0.00 2.80 0.00 0.00 179.97 182.22 2xah h ALA 753 N 1.75 0.12 -1.38 2.80 0.00 -1.79 -3.37 119.26 117.39 2xah h ALA 753 Ca -0.00 -0.64 -0.69 0.00 0.00 0.00 0.00 54.91 53.59 2xah h ALA 753 Cb 0.48 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 2xah h ALA 753 CO 0.03 0.54 1.19 -3.47 0.00 0.00 0.00 179.25 177.55 2xah n ASP 754 N -4.02 2.43 0.27 0.00 -0.08 -0.76 -4.81 116.55 109.58 2xah n ASP 754 Ca -0.11 0.73 0.18 0.00 -1.51 0.00 0.00 54.79 54.09 2xah n ASP 754 Cb 0.79 -1.23 0.81 0.00 2.34 0.00 0.00 41.12 43.82 2xah n ASP 754 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2xah h PRO 755 N 10.08 0.00 -0.79 -0.67 0.13 -1.87 0.35 132.00 139.23 2xah h PRO 755 Ca -0.37 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.59 2xah h PRO 755 Cb 1.31 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.34 2xah h PRO 755 CO 0.99 0.00 0.22 0.91 -0.23 0.00 0.00 178.00 179.89 2xah n TRP 756 N -2.94 2.08 0.14 1.56 5.03 -1.26 -4.43 117.44 117.62 2xah n TRP 756 Ca -0.00 -1.02 0.00 0.00 3.03 0.00 0.00 57.50 59.51 2xah n TRP 756 Cb 0.22 -0.60 0.00 0.00 -1.03 0.00 0.00 31.31 29.89 2xah n TRP 756 CO 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 177.69 177.66 2xah n ALA 757 N -0.04 1.71 -3.64 6.99 0.00 -1.00 -4.84 120.51 119.70 2xah n ALA 757 Ca 0.34 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.55 2xah n ALA 757 Cb 1.22 0.00 0.07 0.00 0.00 0.00 0.00 19.45 20.74 2xah n ALA 757 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2xah n ARG 758 N -3.25 -6.81 0.00 0.00 5.12 0.12 -3.40 116.66 108.44 2xah n ARG 758 Ca 0.00 0.76 0.00 0.00 -1.93 0.00 0.00 57.85 56.68 2xah n ARG 758 Cb 0.00 -5.72 0.00 0.00 -1.16 0.00 0.00 32.46 25.58 2xah n ARG 758 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2xah n GLY 759 N -1.69 0.84 0.94 -0.13 0.00 -0.34 -4.57 105.19 100.24 2xah n GLY 759 Ca -0.09 -2.05 -0.02 0.00 0.00 0.00 0.00 46.02 43.86 2xah n GLY 759 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2xah n SER 760 N 2.06 0.46 -3.02 1.61 3.41 0.23 -4.52 113.62 113.85 2xah n SER 760 Ca 0.00 0.07 -0.09 0.00 -0.26 0.00 0.00 58.87 58.59 2xah n SER 760 Cb 0.00 -0.16 0.02 0.00 -0.26 0.00 0.00 64.21 63.81 2xah n SER 760 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2xah s TYR 761 N -2.05 0.09 0.44 7.33 -0.85 -1.22 -4.99 117.35 116.09 2xah s TYR 761 Ca -0.03 -0.74 0.00 0.00 -0.52 0.00 0.00 57.07 55.78 2xah s TYR 761 Cb 0.01 0.83 -0.01 0.00 0.38 0.00 0.00 41.96 43.17 2xah s TYR 761 CO 0.04 -1.53 0.66 -1.54 -1.52 0.00 0.00 175.55 171.66 2xah s SER 762 N -3.06 5.90 0.22 -0.18 1.04 -1.26 -0.66 113.70 115.70 2xah s SER 762 Ca 0.15 0.33 -0.02 0.00 0.48 0.00 0.00 55.95 56.89 2xah s SER 762 Cb -0.05 -1.61 -0.03 0.00 0.10 0.00 0.00 66.02 64.42 2xah s SER 762 CO 0.11 -0.65 0.20 -0.72 0.98 0.00 0.00 173.24 173.16 2xah s TYR 763 N -2.54 1.08 -0.76 5.02 -0.85 0.54 -4.61 117.35 115.23 2xah s TYR 763 Ca 0.47 -1.30 -0.22 0.00 -0.52 0.00 0.00 57.07 55.50 2xah s TYR 763 Cb -0.10 -0.45 0.08 0.00 0.38 0.00 0.00 41.96 41.88 2xah s TYR 763 CO 0.38 -0.72 1.06 0.08 -1.52 0.00 0.00 175.55 174.83 2xah s VAL 764 N -4.06 4.38 0.77 -3.49 1.01 -1.26 -2.38 120.40 115.38 2xah s VAL 764 Ca 0.36 -0.70 -0.11 0.00 0.00 0.00 0.00 61.98 61.54 2xah s VAL 764 Cb 0.05 -4.75 0.06 0.00 0.00 0.00 0.00 36.38 31.74 2xah s VAL 764 CO 0.13 -1.52 1.08 0.00 0.00 0.00 0.00 175.10 174.79 2xah s ALA 765 N 3.82 2.25 0.03 5.51 0.00 -1.26 -0.87 121.76 131.24 2xah s ALA 765 Ca 0.27 0.14 -0.30 0.00 0.00 0.00 0.00 51.96 52.07 2xah s ALA 765 Cb -0.12 -3.22 -0.07 0.00 0.00 0.00 0.00 23.12 19.70 2xah s ALA 765 CO 0.03 -1.72 1.64 0.00 0.00 0.00 0.00 175.76 175.71 2xah s ALA 766 N -2.96 3.65 0.00 0.00 0.00 0.14 -1.23 121.76 121.36 2xah s ALA 766 Ca 0.61 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.68 2xah s ALA 766 Cb -0.16 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.25 2xah s ALA 766 CO 0.56 -1.18 0.00 0.41 0.00 0.00 0.00 175.76 175.55 2xah n GLY 767 N 4.01 0.35 0.00 0.00 0.00 -1.26 -4.91 105.19 103.38 2xah n GLY 767 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2xah n GLY 767 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2xah n SER 768 N 0.00 0.02 -2.80 1.61 2.88 -0.36 -5.00 113.62 109.97 2xah n SER 768 Ca 0.00 -0.54 -0.01 0.00 -1.33 0.00 0.00 58.87 56.98 2xah n SER 768 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 2xah n SER 768 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2xah n SER 769 N -1.62 -1.21 0.17 -3.46 3.41 -1.26 -4.93 113.62 104.72 2xah n SER 769 Ca 0.00 -1.58 0.13 0.00 -0.26 0.00 0.00 58.87 57.16 2xah n SER 769 Cb 0.00 1.96 0.44 0.00 -0.26 0.00 0.00 64.21 66.35 2xah n SER 769 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2xah h GLY 770 N 1.47 0.00 2.00 5.00 0.00 -1.96 -2.80 103.07 106.79 2xah h GLY 770 Ca -0.19 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.03 2xah h GLY 770 CO 0.26 0.00 -0.52 -0.57 0.00 0.00 0.00 176.54 175.72 2xah h ASN 771 N 0.00 0.00 -0.46 0.19 -0.73 -1.98 -2.65 115.58 109.96 2xah h ASN 771 Ca 0.00 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.15 2xah h ASN 771 Cb 0.64 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.20 2xah h ASN 771 CO 0.00 0.52 0.22 0.44 -0.37 0.00 0.00 177.43 178.24 2xah h ASP 772 N 0.00 0.63 -0.50 1.15 3.32 -1.89 0.61 116.42 119.75 2xah h ASP 772 Ca -0.01 -0.06 0.12 0.00 0.02 0.00 0.00 57.03 57.10 2xah h ASP 772 Cb 0.97 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.34 2xah h ASP 772 CO 0.07 0.56 0.35 1.88 -1.72 0.00 0.00 179.24 180.37 2xah h TYR 773 N 0.70 0.16 0.03 4.55 0.05 -1.63 0.32 116.97 121.16 2xah h TYR 773 Ca 0.17 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 58.83 2xah h TYR 773 Cb 0.10 -0.05 0.01 0.00 1.01 0.00 0.00 36.73 37.80 2xah h TYR 773 CO 0.01 0.07 -0.50 -0.44 -1.05 0.00 0.00 178.16 176.25 2xah h ASP 774 N 0.15 0.40 -0.76 3.88 3.32 -0.93 -2.95 116.42 119.53 2xah h ASP 774 Ca 0.23 -0.82 0.17 0.00 0.02 0.00 0.00 57.03 56.64 2xah h ASP 774 Cb 0.73 -0.12 -0.12 0.00 0.22 0.00 0.00 39.33 40.03 2xah h ASP 774 CO -0.03 1.17 0.12 -0.07 -1.72 0.00 0.00 179.24 178.71 2xah h LEU 775 N -0.33 -0.12 -0.84 1.55 3.38 -0.93 -1.06 115.31 116.97 2xah h LEU 775 Ca -0.07 0.17 0.12 0.00 0.09 0.00 0.00 57.88 58.19 2xah h LEU 775 Cb 1.27 0.26 -0.08 0.00 0.09 0.00 0.00 40.66 42.19 2xah h LEU 775 CO 0.10 -0.11 0.46 0.24 0.09 0.00 0.00 178.44 179.22 2xah h MET 776 N 0.20 0.69 0.00 1.13 2.86 -0.81 -2.62 114.93 116.38 2xah h MET 776 Ca 0.43 -0.04 -0.08 0.00 -2.06 0.00 0.00 59.70 57.95 2xah h MET 776 Cb 0.77 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 2xah h MET 776 CO -0.58 0.46 -0.39 0.00 1.06 0.00 0.00 176.91 177.45 2xah h ALA 777 N 1.51 0.81 -2.09 6.32 0.00 -1.04 -3.44 119.26 121.33 2xah h ALA 777 Ca 0.43 -0.36 -0.60 0.00 0.00 0.00 0.00 54.91 54.39 2xah h ALA 777 Cb 0.51 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.26 2xah h ALA 777 CO -0.31 0.49 1.12 0.94 0.00 0.00 0.00 179.25 181.49 2xah n GLN 778 N -3.29 2.29 -1.14 0.00 -0.06 -0.95 -4.30 117.38 109.92 2xah n GLN 778 Ca 0.01 0.84 -0.29 0.00 -2.00 0.00 0.00 57.00 55.57 2xah n GLN 778 Cb 0.62 -2.70 0.17 0.00 -4.06 0.00 0.00 30.24 24.27 2xah n GLN 778 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2xah s PRO 779 N 4.06 0.59 -0.18 3.69 0.04 -1.26 -4.84 135.00 137.11 2xah s PRO 779 Ca 0.92 0.62 -0.02 0.00 0.04 0.00 0.00 61.00 62.56 2xah s PRO 779 Cb -0.65 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 32.13 2xah s PRO 779 CO 0.50 -2.65 -0.09 0.42 0.04 0.00 0.00 177.00 175.22 2xah s ILE 780 N -2.93 3.18 -0.22 0.56 -1.09 0.15 -4.98 121.20 115.88 2xah s ILE 780 Ca 0.65 -0.58 -0.06 0.00 -2.23 0.00 0.00 60.65 58.42 2xah s ILE 780 Cb -0.19 -2.39 -0.03 0.00 -1.58 0.00 0.00 42.46 38.27 2xah s ILE 780 CO 0.58 0.48 0.04 -0.89 -1.23 0.00 0.00 174.94 173.92 2xah s THR 781 N 0.92 4.28 0.97 2.92 2.01 -1.26 -1.40 115.64 124.08 2xah s THR 781 Ca -0.02 -0.20 -0.12 0.00 0.31 0.00 0.00 61.69 61.67 2xah s THR 781 Cb -0.15 -2.96 0.17 0.00 0.01 0.00 0.00 72.50 69.57 2xah s THR 781 CO 0.00 0.40 1.09 -2.16 -0.69 0.00 0.00 174.62 173.26 2xah s PRO 782 N 1.10 0.65 0.80 4.92 0.04 -1.26 -4.98 135.00 136.28 2xah s PRO 782 Ca 0.03 0.70 -0.12 0.00 0.04 0.00 0.00 61.00 61.66 2xah s PRO 782 Cb -0.14 -1.75 0.08 0.00 0.04 0.00 0.00 34.50 32.72 2xah s PRO 782 CO 0.03 -2.62 1.15 0.20 0.04 0.00 0.00 177.00 175.80 2xah s GLY 783 N -3.33 1.60 0.62 0.56 0.00 -1.26 -4.71 107.32 100.80 2xah s GLY 783 Ca 0.65 -0.55 -0.15 0.00 0.00 0.00 0.00 44.72 44.67 2xah s GLY 783 CO 0.58 -0.08 1.08 2.56 0.00 0.00 0.00 173.10 177.24 2xah s PRO 784 N -5.47 3.10 0.00 2.90 0.04 -1.26 -4.06 135.00 130.25 2xah s PRO 784 Ca 0.61 1.26 0.00 0.00 0.04 0.00 0.00 61.00 62.92 2xah s PRO 784 Cb -0.12 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.42 2xah s PRO 784 CO 0.50 -0.99 0.23 0.43 0.04 0.00 0.00 177.00 177.22 2xah n SER 785 N -2.23 0.00 -4.73 6.66 7.64 -1.26 -4.69 113.62 115.01 2xah n SER 785 Ca 0.09 0.23 -0.42 0.00 1.01 0.00 0.00 58.87 59.79 2xah n SER 785 Cb 0.53 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.70 2xah n SER 785 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2xah s ILE 786 N -0.46 3.28 0.59 0.44 1.09 -1.26 -5.00 121.20 119.86 2xah s ILE 786 Ca 0.00 1.01 -0.20 0.00 -1.10 0.00 0.00 60.65 60.36 2xah s ILE 786 Cb 0.00 -3.65 -0.03 0.00 -1.06 0.00 0.00 42.46 37.72 2xah s ILE 786 CO 0.00 0.13 1.30 -2.84 -0.10 0.00 0.00 174.94 173.44 2xah s PRO 787 N 0.17 2.93 -0.70 2.79 0.02 -1.26 -2.55 135.00 136.40 2xah s PRO 787 Ca 0.58 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.69 2xah s PRO 787 Cb -0.36 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.10 2xah s PRO 787 CO 0.36 -1.31 0.00 0.41 -0.33 0.00 0.00 177.00 176.13 2xah n GLY 788 N 0.74 0.84 3.88 0.52 0.00 -1.26 -5.03 105.19 104.87 2xah n GLY 788 Ca 0.13 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 2xah n GLY 788 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xah s ALA 789 N -2.05 3.47 0.66 4.61 0.00 -1.06 -5.04 121.76 122.36 2xah s ALA 789 Ca 0.00 -0.25 -0.17 0.00 0.00 0.00 0.00 51.96 51.54 2xah s ALA 789 Cb 0.00 -2.55 -0.05 0.00 0.00 0.00 0.00 23.12 20.53 2xah s ALA 789 CO 0.00 0.28 0.65 -0.35 0.00 0.00 0.00 175.76 176.34 2xah n PRO 790 N -0.66 0.47 -1.68 0.00 -0.04 -1.26 -4.87 135.00 126.97 2xah n PRO 790 Ca 0.01 0.20 -0.51 0.00 -0.04 0.00 0.00 63.50 63.16 2xah n PRO 790 Cb 0.53 -1.90 -0.06 0.00 -0.04 0.00 0.00 33.50 32.04 2xah n PRO 790 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2xah n GLN 791 N -0.74 1.78 -2.59 0.54 -0.06 -1.26 -4.89 117.38 110.16 2xah n GLN 791 Ca 0.11 0.65 -0.35 0.00 -2.00 0.00 0.00 57.00 55.42 2xah n GLN 791 Cb 0.49 -2.43 -0.04 0.00 -4.06 0.00 0.00 30.24 24.20 2xah n GLN 791 CO 0.00 0.00 0.00 -1.25 -0.20 0.00 0.00 177.06 175.61 2xah s PRO 792 N 3.32 3.98 0.11 3.69 0.05 -1.26 -5.04 135.00 139.85 2xah s PRO 792 Ca 0.92 1.37 -0.16 0.00 0.05 0.00 0.00 61.00 63.18 2xah s PRO 792 Cb -0.83 -2.25 -0.10 0.00 0.05 0.00 0.00 34.50 31.38 2xah s PRO 792 CO 0.54 -0.27 0.30 -0.89 0.05 0.00 0.00 177.00 176.73 2xah n ILE 793 N -0.63 1.08 -2.33 0.56 -0.00 -1.26 -4.89 119.36 111.89 2xah n ILE 793 Ca 0.08 -0.27 -0.41 0.00 -0.00 0.00 0.00 62.75 62.15 2xah n ILE 793 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 39.64 40.12 2xah n ILE 793 CO 0.00 0.00 0.00 -2.84 -0.00 0.00 0.00 176.55 173.71 2xah s PRO 794 N -0.54 4.50 -0.01 0.38 0.02 -1.26 -4.50 135.00 133.58 2xah s PRO 794 Ca 0.36 1.95 0.02 0.00 0.02 0.00 0.00 61.00 63.34 2xah s PRO 794 Cb -0.52 -3.18 -0.02 0.00 0.02 0.00 0.00 34.50 30.79 2xah s PRO 794 CO 0.31 -0.03 0.01 0.54 -0.33 0.00 0.00 177.00 177.50 2xah n ARG 795 N 1.75 2.85 -4.11 5.54 5.12 -0.49 -4.96 116.66 122.35 2xah n ARG 795 Ca 0.02 -0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.61 2xah n ARG 795 Cb 0.44 -1.04 -0.16 0.00 -1.16 0.00 0.00 32.46 30.53 2xah n ARG 795 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 2xah s LEU 796 N -3.89 2.30 0.18 0.55 2.96 -0.92 -1.95 118.68 117.91 2xah s LEU 796 Ca -0.01 -0.75 0.11 0.00 -0.22 0.00 0.00 54.13 53.27 2xah s LEU 796 Cb 0.01 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.16 2xah s LEU 796 CO 0.07 -0.02 -0.22 -0.36 -1.32 0.00 0.00 176.35 174.50 2xah s PHE 797 N 1.27 2.35 -0.08 5.38 0.40 0.38 0.34 117.98 128.02 2xah s PHE 797 Ca 0.03 -0.34 0.02 0.00 -0.60 0.00 0.00 56.93 56.05 2xah s PHE 797 Cb -0.14 -1.17 0.01 0.00 0.51 0.00 0.00 43.02 42.23 2xah s PHE 797 CO -0.12 0.49 -0.14 -0.06 0.70 0.00 0.00 175.22 176.09 2xah s PHE 798 N -1.62 1.67 0.26 0.36 0.40 -1.26 0.13 117.98 117.91 2xah s PHE 798 Ca 0.21 -0.65 0.06 0.00 -0.60 0.00 0.00 56.93 55.94 2xah s PHE 798 Cb -0.08 -1.20 -0.05 0.00 0.51 0.00 0.00 43.02 42.19 2xah s PHE 798 CO 0.10 -0.32 -0.05 0.00 0.70 0.00 0.00 175.22 175.65 2xah s ALA 799 N 0.68 2.16 0.00 5.36 0.00 -0.79 -4.75 121.76 124.41 2xah s ALA 799 Ca -0.14 -1.83 0.00 0.00 0.00 0.00 0.00 51.96 49.99 2xah s ALA 799 Cb -0.16 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.19 2xah s ALA 799 CO 0.04 -0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.10 2xah n GLY 800 N -0.51 4.67 0.19 0.00 0.00 -1.26 -4.21 105.19 104.07 2xah n GLY 800 Ca -0.06 -0.87 0.16 0.00 0.00 0.00 0.00 46.02 45.25 2xah n GLY 800 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2xah n GLU 801 N -1.77 -0.01 -0.00 1.61 0.00 -1.26 0.23 120.64 119.43 2xah n GLU 801 Ca 0.00 0.46 0.04 0.00 0.00 0.00 0.00 57.16 57.67 2xah n GLU 801 Cb 0.00 -0.94 0.24 0.00 0.00 0.00 0.00 31.44 30.75 2xah n GLU 801 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.13 174.74 2xah n HIS 802 N -3.31 0.01 -0.01 4.31 1.44 -1.26 -3.66 115.22 112.74 2xah n HIS 802 Ca 0.15 -0.01 0.02 0.00 -2.01 0.00 0.00 57.72 55.88 2xah n HIS 802 Cb 0.62 0.00 0.04 0.00 0.12 0.00 0.00 29.99 30.76 2xah n HIS 802 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 2xah n THR 803 N -0.60 0.78 -3.62 0.61 -2.24 0.63 -4.68 114.28 105.17 2xah n THR 803 Ca 0.06 -0.89 -0.28 0.00 -2.27 0.00 0.00 64.05 60.67 2xah n THR 803 Cb 0.04 0.62 -0.11 0.00 -2.10 0.00 0.00 70.33 68.78 2xah n THR 803 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 2xah s ILE 804 N -0.84 1.35 0.06 2.28 2.07 -1.25 -4.41 121.20 120.46 2xah s ILE 804 Ca 0.06 -3.10 -0.02 0.00 -1.41 0.00 0.00 60.65 56.18 2xah s ILE 804 Cb 0.03 -1.91 0.10 0.00 0.13 0.00 0.00 42.46 40.81 2xah s ILE 804 CO 0.04 -1.08 0.37 -1.14 -1.91 0.00 0.00 174.94 171.22 2xah n ARG 805 N 2.77 -0.03 0.00 3.50 0.63 -1.26 -0.77 116.66 121.50 2xah n ARG 805 Ca 0.22 0.37 0.14 0.00 -0.92 0.00 0.00 57.85 57.66 2xah n ARG 805 Cb 0.41 -0.55 0.58 0.00 0.45 0.00 0.00 32.46 33.35 2xah n ARG 805 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 2xah n ASN 806 N -4.38 1.10 -2.71 6.15 4.13 -1.26 -4.42 115.26 113.87 2xah n ASN 806 Ca 0.04 -1.25 -0.05 0.00 1.68 0.00 0.00 54.58 55.00 2xah n ASN 806 Cb 0.11 0.01 0.09 0.00 -1.54 0.00 0.00 39.78 38.46 2xah n ASN 806 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2xah n TYR 807 N -0.23 -0.91 -0.69 3.10 4.01 0.05 -4.82 117.16 117.67 2xah n TYR 807 Ca 0.18 -2.10 -0.29 0.00 -0.16 0.00 0.00 57.90 55.53 2xah n TYR 807 Cb 0.31 0.83 0.25 0.00 -0.31 0.00 0.00 39.34 40.42 2xah n TYR 807 CO 0.00 0.00 0.00 -2.14 -0.46 0.00 0.00 176.86 174.26 2xah s PRO 808 N -1.26 -1.14 -1.17 -0.72 0.02 -1.04 -3.93 135.00 125.76 2xah s PRO 808 Ca 0.21 0.53 0.00 0.00 0.02 0.00 0.00 61.00 61.75 2xah s PRO 808 Cb 0.41 -1.55 0.00 0.00 0.02 0.00 0.00 34.50 33.38 2xah s PRO 808 CO -0.06 -3.79 0.00 0.00 -0.33 0.00 0.00 177.00 172.82 2xah n ALA 809 N -4.92 -0.67 -2.18 -1.55 0.00 -1.24 -4.89 120.51 105.06 2xah n ALA 809 Ca 0.06 0.12 -0.10 0.00 0.00 0.00 0.00 53.44 53.52 2xah n ALA 809 Cb 0.57 -1.54 -0.10 0.00 0.00 0.00 0.00 19.45 18.37 2xah n ALA 809 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2xah s THR 810 N -2.57 0.09 0.02 0.00 -4.23 -1.25 -4.97 115.64 102.73 2xah s THR 810 Ca 0.00 -1.91 -0.27 0.00 -1.18 0.00 0.00 61.69 58.33 2xah s THR 810 Cb 0.00 -2.11 -0.16 0.00 1.34 0.00 0.00 72.50 71.57 2xah s THR 810 CO 0.00 -0.39 1.26 0.58 -0.54 0.00 0.00 174.62 175.53 2xah h VAL 811 N 2.82 0.40 -0.65 2.29 2.07 -1.92 -2.77 116.25 118.49 2xah h VAL 811 Ca -0.35 -0.38 0.14 0.00 0.82 0.00 0.00 66.70 66.93 2xah h VAL 811 Cb 1.21 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.47 2xah h VAL 811 CO 0.58 0.05 0.44 1.12 0.02 0.00 0.00 177.57 179.78 2xah h HIS 812 N -0.94 0.30 -0.07 1.57 -0.00 -1.96 0.64 115.15 114.69 2xah h HIS 812 Ca -0.07 0.01 -0.17 0.00 -0.00 0.00 0.00 60.37 60.14 2xah h HIS 812 Cb 0.61 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 27.91 2xah h HIS 812 CO 0.00 0.12 -0.69 0.78 -0.00 0.00 0.00 177.93 178.14 2xah h GLY 813 N 0.27 0.36 0.38 6.13 0.00 -1.69 0.52 103.07 109.04 2xah h GLY 813 Ca 0.31 -0.49 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 2xah h GLY 813 CO -0.07 0.44 -0.18 0.00 0.00 0.00 0.00 176.54 176.73 2xah h ALA 814 N 1.04 -0.61 -0.54 3.60 0.00 -0.64 -2.63 119.26 119.48 2xah h ALA 814 Ca -0.02 -0.11 0.10 0.00 0.00 0.00 0.00 54.91 54.88 2xah h ALA 814 Cb 1.25 0.20 -0.10 0.00 0.00 0.00 0.00 17.79 19.14 2xah h ALA 814 CO 0.11 -0.57 -0.17 -0.11 0.00 0.00 0.00 179.25 178.52 2xah n LEU 815 N -4.55 -0.26 0.02 0.00 -0.00 -0.39 0.19 117.00 112.00 2xah n LEU 815 Ca -0.06 0.94 0.01 0.00 -0.00 0.00 0.00 56.01 56.90 2xah n LEU 815 Cb 0.20 -0.26 0.33 0.00 -0.00 0.00 0.00 43.42 43.70 2xah n LEU 815 CO 0.15 -0.88 0.97 -0.07 -0.00 0.00 0.00 177.39 177.56 2xah h LEU 816 N 0.00 0.45 -0.63 -1.96 3.38 -0.84 -2.35 115.31 113.36 2xah h LEU 816 Ca 0.23 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.98 2xah h LEU 816 Cb 0.37 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2xah h LEU 816 CO -0.55 0.50 -0.67 0.77 0.09 0.00 0.00 178.44 178.58 2xah h SER 817 N 0.47 0.07 0.25 -0.43 4.64 0.24 -0.60 113.55 118.20 2xah h SER 817 Ca 0.11 -0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 2xah h SER 817 Cb 0.27 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 2xah h SER 817 CO 0.01 0.72 -0.12 1.23 -0.87 0.00 0.00 176.83 177.79 2xah h GLY 818 N 1.90 -0.35 0.42 -0.77 0.00 -0.84 -0.91 103.07 102.52 2xah h GLY 818 Ca -0.01 0.13 0.08 0.00 0.00 0.00 0.00 47.33 47.53 2xah h GLY 818 CO 0.09 -0.13 0.17 1.41 0.00 0.00 0.00 176.54 178.09 2xah h LEU 819 N -0.54 0.14 0.16 3.11 3.38 -1.17 -2.16 115.31 118.23 2xah h LEU 819 Ca -0.03 0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.03 2xah h LEU 819 Cb 0.40 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 2xah h LEU 819 CO 0.06 0.10 -0.37 -0.09 0.09 0.00 0.00 178.44 178.23 2xah h ARG 820 N 0.34 -0.60 -0.21 1.13 2.43 -0.74 -1.53 114.38 115.21 2xah h ARG 820 Ca 0.27 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.47 2xah h ARG 820 Cb 0.33 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 2xah h ARG 820 CO -0.29 -0.40 0.10 0.93 -1.51 0.00 0.00 179.97 178.80 2xah h GLU 821 N -0.62 0.30 -0.48 0.20 4.39 -0.80 -1.86 114.58 115.71 2xah h GLU 821 Ca 0.02 -0.04 0.10 0.00 0.34 0.00 0.00 59.36 59.77 2xah h GLU 821 Cb 0.63 -0.05 -0.09 0.00 -0.10 0.00 0.00 28.75 29.14 2xah h GLU 821 CO -0.19 0.32 -0.15 0.00 -1.16 0.00 0.00 179.01 177.83 2xah h ALA 822 N 0.97 0.27 -0.46 3.43 0.00 -1.14 0.40 119.26 122.73 2xah h ALA 822 Ca 0.07 0.18 0.09 0.00 0.00 0.00 0.00 54.91 55.25 2xah h ALA 822 Cb 0.12 0.41 -0.10 0.00 0.00 0.00 0.00 17.79 18.22 2xah h ALA 822 CO -0.01 -0.47 -0.34 0.78 0.00 0.00 0.00 179.25 179.21 2xah h GLY 823 N -0.03 -0.25 1.41 0.00 0.00 -0.68 -0.61 103.07 102.90 2xah h GLY 823 Ca 0.23 0.44 -0.13 0.00 0.00 0.00 0.00 47.33 47.87 2xah h GLY 823 CO -0.51 -0.20 -0.34 -0.09 0.00 0.00 0.00 176.54 175.40 2xah h ARG 824 N -0.23 0.66 0.34 4.80 2.43 0.19 -1.46 114.38 121.10 2xah h ARG 824 Ca 0.19 -0.31 -0.02 0.00 -0.81 0.00 0.00 59.98 59.03 2xah h ARG 824 Cb 0.55 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 2xah h ARG 824 CO -0.59 0.90 -0.16 0.82 -1.51 0.00 0.00 179.97 179.43 2xah h ILE 825 N 0.55 0.68 0.40 1.20 2.04 -0.22 -2.23 117.51 119.94 2xah h ILE 825 Ca 0.06 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 2xah h ILE 825 Cb 0.85 0.80 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 2xah h ILE 825 CO 0.07 0.05 -0.48 0.00 0.00 0.00 0.00 178.15 177.79 2xah h ALA 826 N 0.05 -1.03 -0.79 1.87 0.00 -0.79 -0.49 119.26 118.08 2xah h ALA 826 Ca -0.05 -0.16 0.16 0.00 0.00 0.00 0.00 54.91 54.87 2xah h ALA 826 Cb 0.42 0.71 -0.15 0.00 0.00 0.00 0.00 17.79 18.78 2xah h ALA 826 CO 0.08 -1.12 -0.19 -0.25 0.00 0.00 0.00 179.25 177.77 2xah n ASP 827 N -5.53 -0.27 -0.22 0.00 9.92 -0.58 -0.24 116.55 119.63 2xah n ASP 827 Ca -0.11 1.37 -0.08 0.00 -0.53 0.00 0.00 54.79 55.44 2xah n ASP 827 Cb 0.44 -0.42 0.03 0.00 -0.64 0.00 0.00 41.12 40.53 2xah n ASP 827 CO 0.00 0.00 0.00 -0.61 0.13 0.00 0.00 177.20 176.72 2xah h GLN 828 N 0.00 0.97 0.00 -1.24 5.75 -0.67 -2.83 115.11 117.09 2xah h GLN 828 Ca 0.39 -0.23 -0.30 0.00 -0.15 0.00 0.00 58.65 58.35 2xah h GLN 828 Cb 0.61 -0.13 -0.06 0.00 1.07 0.00 0.00 27.48 28.97 2xah h GLN 828 CO -0.81 0.89 -2.14 1.19 -2.65 0.00 0.00 178.83 175.30 2xah n PHE 829 N -4.35 0.00 0.98 3.99 3.72 0.67 -4.32 117.46 118.15 2xah n PHE 829 Ca 0.03 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.54 2xah n PHE 829 Cb 0.24 -0.81 -0.05 0.00 -0.94 0.00 0.00 39.48 37.92 2xah n PHE 829 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 2xah n LEU 830 N -2.69 1.58 -0.59 4.37 4.77 0.32 -4.97 117.00 119.79 2xah n LEU 830 Ca -0.28 -0.65 0.00 0.00 -0.03 0.00 0.00 56.01 55.04 2xah n LEU 830 Cb 1.01 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.10 2xah n LEU 830 CO 0.33 0.32 -0.18 0.61 -1.33 0.00 0.00 177.39 177.14 2xah n GLY 831 N 1.44 -3.29 3.39 -0.72 0.00 -1.07 -4.88 105.19 100.06 2xah n GLY 831 Ca 0.07 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.54 2xah n GLY 831 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xah s ALA 832 N -4.42 3.46 0.02 4.61 0.00 -1.25 -4.76 121.76 119.43 2xah s ALA 832 Ca 0.00 -1.96 0.15 0.00 0.00 0.00 0.00 51.96 50.15 2xah s ALA 832 Cb 0.00 -2.90 0.26 0.00 0.00 0.00 0.00 23.12 20.48 2xah s ALA 832 CO 0.00 -1.60 1.53 0.52 0.00 0.00 0.00 175.76 176.21 2xah h MET 833 N 8.63 0.00 0.00 0.00 2.86 -1.97 -3.34 114.93 121.11 2xah h MET 833 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2xah h MET 833 Cb 1.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.77 2xah h MET 833 CO 0.79 0.54 0.00 2.48 1.06 0.00 0.00 176.91 181.78 2xah n TYR 834 N -3.38 0.20 0.71 -0.22 4.11 -1.26 -4.20 117.16 113.11 2xah n TYR 834 Ca 0.01 0.07 0.10 0.00 -0.00 0.00 0.00 57.90 58.07 2xah n TYR 834 Cb 0.68 -0.61 0.44 0.00 -0.00 0.00 0.00 39.34 39.86 2xah n TYR 834 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.86 177.11 2xah n THR 835 N -1.67 0.57 1.72 -3.48 -2.24 -1.26 -4.90 114.28 103.04 2xah n THR 835 Ca 0.05 0.14 0.15 0.00 -2.27 0.00 0.00 64.05 62.12 2xah n THR 835 Cb 0.28 -0.79 0.72 0.00 -2.10 0.00 0.00 70.33 68.44 2xah n THR 835 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68