#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m1e h ALA 152 N 0.00 -0.21 -0.14 2.89 0.00 -2.05 -2.73 119.26 117.02 1m1e h ALA 152 Ca 0.00 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1m1e h ALA 152 Cb 0.00 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 1m1e h ALA 152 CO 0.00 -0.63 -0.54 0.82 0.00 0.00 0.00 179.25 178.90 1m1e h ILE 153 N -0.24 0.01 -0.66 0.00 1.08 -1.98 0.42 117.51 116.15 1m1e h ILE 153 Ca 0.00 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 64.60 1m1e h ILE 153 Cb 0.22 0.01 -0.09 0.00 -3.07 0.00 0.00 36.82 33.89 1m1e h ILE 153 CO -0.02 0.00 0.17 -0.65 -0.69 0.00 0.00 178.15 176.95 1m1e h PRO 154 N -0.58 0.29 -0.11 2.37 0.11 -1.98 0.40 132.00 132.49 1m1e h PRO 154 Ca 0.04 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.12 1m1e h PRO 154 Cb 0.68 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.72 1m1e h PRO 154 CO -0.44 0.19 0.02 0.93 -0.21 0.00 0.00 178.00 178.49 1m1e h GLU 155 N 0.30 0.18 -0.81 1.05 3.07 -1.06 -1.48 114.58 115.82 1m1e h GLU 155 Ca 0.35 -0.05 0.02 0.00 -0.50 0.00 0.00 59.36 59.19 1m1e h GLU 155 Cb 0.55 -0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.39 1m1e h GLU 155 CO -0.43 0.36 0.53 -0.07 -1.40 0.00 0.00 179.01 178.01 1m1e h LEU 156 N -0.04 0.90 -0.29 1.33 3.38 0.54 0.13 115.31 121.26 1m1e h LEU 156 Ca 0.03 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1m1e h LEU 156 Cb 0.27 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1m1e h LEU 156 CO 0.00 0.64 0.14 0.74 0.09 0.00 0.00 178.44 180.05 1m1e h THR 157 N 1.06 0.99 -0.47 0.22 2.02 -0.08 -0.51 112.91 116.14 1m1e h THR 157 Ca 0.31 -0.10 -0.00 0.00 0.77 0.00 0.00 66.41 67.38 1m1e h THR 157 Cb -0.07 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 1m1e h THR 157 CO -0.08 0.05 0.28 0.11 0.37 0.00 0.00 175.52 176.25 1m1e h LYS 158 N 0.30 0.64 -0.93 6.66 6.56 -0.60 -2.63 116.57 126.57 1m1e h LYS 158 Ca 0.12 -0.06 0.03 0.00 -1.06 0.00 0.00 60.65 59.68 1m1e h LYS 158 Cb 0.04 -0.13 -0.05 0.00 -0.57 0.00 0.00 32.23 31.52 1m1e h LYS 158 CO -0.09 0.47 0.61 -0.07 -2.06 0.00 0.00 179.45 178.31 1m1e h LEU 159 N 0.63 1.02 -1.47 2.94 3.38 -0.24 -1.47 115.31 120.09 1m1e h LEU 159 Ca 0.17 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 1m1e h LEU 159 Cb -0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1m1e h LEU 159 CO -0.03 0.71 -0.27 -0.07 0.09 0.00 0.00 178.44 178.86 1m1e h LEU 160 N 1.19 0.00 -0.22 1.67 3.38 -0.75 -1.91 115.31 118.66 1m1e h LEU 160 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1m1e h LEU 160 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1m1e h LEU 160 CO -0.11 0.27 -0.26 0.59 0.09 0.00 0.00 178.44 179.03 1m1e n ASN 161 N -4.03 0.60 -4.61 -0.43 3.02 -0.63 -4.84 115.26 104.34 1m1e n ASN 161 Ca -0.02 -0.46 -0.37 0.00 -0.03 0.00 0.00 54.58 53.70 1m1e n ASN 161 Cb 0.33 0.04 0.06 0.00 -0.61 0.00 0.00 39.78 39.60 1m1e n ASN 161 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1m1e n ASP 162 N -1.08 0.58 0.21 6.41 -0.08 -0.72 -4.91 116.55 116.97 1m1e n ASP 162 Ca 0.10 0.77 0.11 0.00 -1.51 0.00 0.00 54.79 54.26 1m1e n ASP 162 Cb 0.32 -1.38 0.24 0.00 2.34 0.00 0.00 41.12 42.64 1m1e n ASP 162 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 1m1e h GLU 163 N 0.31 0.00 -6.16 -0.67 3.07 -1.91 -3.42 114.58 105.80 1m1e h GLU 163 Ca -0.48 0.00 -0.56 0.00 -0.50 0.00 0.00 59.36 57.81 1m1e h GLU 163 Cb 1.36 0.00 -0.10 0.00 -0.84 0.00 0.00 28.75 29.18 1m1e h GLU 163 CO 0.50 0.10 0.91 0.34 -1.40 0.00 0.00 179.01 179.46 1m1e s ASP 164 N -6.18 6.21 0.48 1.42 2.15 -1.26 -4.89 116.67 114.60 1m1e s ASP 164 Ca 0.05 -0.50 0.27 0.00 0.43 0.00 0.00 52.55 52.80 1m1e s ASP 164 Cb 0.06 -2.52 1.32 0.00 -0.30 0.00 0.00 42.92 41.48 1m1e s ASP 164 CO 0.66 -1.68 1.82 -0.61 -0.17 0.00 0.00 175.17 175.20 1m1e h GLN 165 N 9.83 0.18 0.00 4.34 4.15 -1.98 0.10 115.11 131.74 1m1e h GLN 165 Ca -0.28 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.11 1m1e h GLN 165 Cb 1.06 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.70 1m1e h GLN 165 CO 1.24 0.12 -0.11 0.28 -1.93 0.00 0.00 178.83 178.43 1m1e h VAL 166 N 0.19 0.92 0.10 2.39 2.07 -1.96 -2.82 116.25 117.12 1m1e h VAL 166 Ca 0.52 -0.38 -0.28 0.00 0.82 0.00 0.00 66.70 67.38 1m1e h VAL 166 Cb 1.70 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 1m1e h VAL 166 CO -0.13 0.10 -1.36 1.62 0.02 0.00 0.00 177.57 177.83 1m1e h VAL 167 N 0.00 1.34 -0.41 2.57 3.04 -1.32 -3.27 116.25 118.19 1m1e h VAL 167 Ca -0.00 -2.98 -0.02 0.00 -1.01 0.00 0.00 66.70 62.69 1m1e h VAL 167 Cb 0.21 2.82 -0.02 0.00 -2.01 0.00 0.00 31.29 32.29 1m1e h VAL 167 CO 0.01 0.85 0.18 -0.37 -1.01 0.00 0.00 177.57 177.23 1m1e h VAL 168 N 0.06 1.19 -0.58 1.51 -1.51 -1.48 0.23 116.25 115.66 1m1e h VAL 168 Ca -0.17 -0.56 0.05 0.00 -1.23 0.00 0.00 66.70 64.79 1m1e h VAL 168 Cb 1.97 0.79 -0.03 0.00 -2.13 0.00 0.00 31.29 31.88 1m1e h VAL 168 CO 0.17 0.21 0.39 0.78 -1.23 0.00 0.00 177.57 177.88 1m1e h ASN 169 N 0.52 0.52 1.47 4.19 4.21 -1.65 0.68 115.58 125.52 1m1e h ASN 169 Ca 0.14 -0.00 -0.10 0.00 1.21 0.00 0.00 56.30 57.55 1m1e h ASN 169 Cb 0.15 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.23 1m1e h ASN 169 CO -0.01 0.34 -0.49 0.50 -1.29 0.00 0.00 177.43 176.48 1m1e h LYS 170 N 0.59 0.00 0.02 0.81 3.64 -1.44 -3.01 116.57 117.18 1m1e h LYS 170 Ca 0.25 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 59.40 1m1e h LYS 170 Cb 0.22 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.02 1m1e h LYS 170 CO -0.07 0.49 -1.10 0.00 -2.27 0.00 0.00 179.45 176.50 1m1e h ALA 171 N 1.51 0.35 -0.35 5.00 0.00 0.21 -3.23 119.26 122.75 1m1e h ALA 171 Ca -0.00 -0.96 -0.07 0.00 0.00 0.00 0.00 54.91 53.88 1m1e h ALA 171 Cb 1.35 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 1m1e h ALA 171 CO 0.06 1.24 -0.07 0.00 0.00 0.00 0.00 179.25 180.49 1m1e h ALA 172 N 0.94 0.48 -0.54 0.00 0.00 0.26 -2.35 119.26 118.06 1m1e h ALA 172 Ca -0.05 -0.29 0.01 0.00 0.00 0.00 0.00 54.91 54.58 1m1e h ALA 172 Cb 1.82 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.45 1m1e h ALA 172 CO 0.14 0.31 0.35 0.28 0.00 0.00 0.00 179.25 180.33 1m1e h VAL 173 N 0.46 1.12 -0.23 0.00 2.07 -1.62 0.50 116.25 118.55 1m1e h VAL 173 Ca 0.09 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1m1e h VAL 173 Cb 0.56 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1m1e h VAL 173 CO 0.03 0.13 0.15 0.24 0.02 0.00 0.00 177.57 178.14 1m1e h MET 174 N 0.71 0.31 -0.06 1.57 2.86 -1.56 0.10 114.93 118.87 1m1e h MET 174 Ca 0.20 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1m1e h MET 174 Cb -0.05 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.54 1m1e h MET 174 CO -0.06 0.23 0.03 0.28 1.06 0.00 0.00 176.91 178.45 1m1e h VAL 175 N 0.30 1.11 -0.89 -2.22 2.07 -1.13 0.80 116.25 116.29 1m1e h VAL 175 Ca 0.08 -0.33 0.07 0.00 0.82 0.00 0.00 66.70 67.34 1m1e h VAL 175 Cb -0.01 1.23 -0.06 0.00 -1.52 0.00 0.00 31.29 30.93 1m1e h VAL 175 CO -0.02 0.10 0.58 -0.74 0.02 0.00 0.00 177.57 177.51 1m1e h HIS 176 N -0.03 1.01 -0.29 1.57 6.17 -0.76 0.12 115.15 122.95 1m1e h HIS 176 Ca 0.02 0.03 -0.11 0.00 0.71 0.00 0.00 60.37 61.01 1m1e h HIS 176 Cb 0.13 -0.33 -0.01 0.00 2.52 0.00 0.00 27.41 29.71 1m1e h HIS 176 CO -0.03 0.52 -0.30 0.37 0.71 0.00 0.00 177.93 179.20 1m1e h GLN 177 N 0.99 0.60 0.00 5.26 5.75 -0.31 -2.92 115.11 124.48 1m1e h GLN 177 Ca 0.39 -0.26 -0.10 0.00 -0.15 0.00 0.00 58.65 58.53 1m1e h GLN 177 Cb 0.24 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1m1e h GLN 177 CO -0.15 0.83 -0.48 -0.07 -2.65 0.00 0.00 178.83 176.31 1m1e h LEU 178 N 0.52 0.00 0.00 -2.39 3.38 0.78 -2.99 115.31 114.61 1m1e h LEU 178 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1m1e h LEU 178 Cb 0.77 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.52 1m1e h LEU 178 CO 0.06 0.48 0.00 -1.54 0.09 0.00 0.00 178.44 177.53 1m1e n SER 179 N -3.48 0.00 -0.11 -0.43 3.41 0.27 -2.48 113.62 110.79 1m1e n SER 179 Ca 0.00 0.41 0.14 0.00 -0.26 0.00 0.00 58.87 59.16 1m1e n SER 179 Cb 0.60 -0.46 0.54 0.00 -0.26 0.00 0.00 64.21 64.63 1m1e n SER 179 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1m1e n LYS 180 N -1.46 0.57 -4.98 4.33 5.02 -1.13 -4.67 118.16 115.84 1m1e n LYS 180 Ca 0.05 -0.22 -0.32 0.00 -2.02 0.00 0.00 58.31 55.80 1m1e n LYS 180 Cb 0.21 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.57 1m1e n LYS 180 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1m1e s LYS 181 N -2.58 3.19 0.02 1.97 1.02 -1.04 -5.04 119.74 117.28 1m1e s LYS 181 Ca 0.25 -0.77 -0.04 0.00 0.02 0.00 0.00 55.97 55.42 1m1e s LYS 181 Cb 0.20 -2.47 -0.01 0.00 -0.52 0.00 0.00 37.83 35.03 1m1e s LYS 181 CO 0.51 0.22 0.82 -1.91 -0.92 0.00 0.00 175.35 174.07 1m1e n GLU 182 N 3.46 -0.06 0.04 1.68 4.07 -1.26 -0.34 120.64 128.23 1m1e n GLU 182 Ca -0.18 0.81 -0.06 0.00 -0.06 0.00 0.00 57.16 57.67 1m1e n GLU 182 Cb 0.53 -1.21 -0.03 0.00 -0.06 0.00 0.00 31.44 30.66 1m1e n GLU 182 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1m1e h ALA 183 N -0.53 -0.70 -0.67 4.31 0.00 -1.97 -1.97 119.26 117.73 1m1e h ALA 183 Ca 0.02 -0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.04 1m1e h ALA 183 Cb 0.06 0.61 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 1m1e h ALA 183 CO -0.13 -0.75 0.46 0.66 0.00 0.00 0.00 179.25 179.49 1m1e h SER 184 N -0.26 0.29 -0.11 0.00 4.64 -1.73 -1.54 113.55 114.84 1m1e h SER 184 Ca -0.00 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 1m1e h SER 184 Cb 0.26 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1m1e h SER 184 CO -0.10 0.16 0.06 -0.09 -0.87 0.00 0.00 176.83 175.99 1m1e h ARG 185 N 0.31 0.15 -0.02 4.77 2.43 -0.31 -1.25 114.38 120.47 1m1e h ARG 185 Ca 0.32 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.44 1m1e h ARG 185 Cb 0.83 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.35 1m1e h ARG 185 CO -0.08 0.18 -0.19 0.45 -1.51 0.00 0.00 179.97 178.81 1m1e h HIS 186 N 0.08 0.03 -0.31 2.20 3.86 -0.54 -1.75 115.15 118.71 1m1e h HIS 186 Ca 0.04 -0.00 -0.13 0.00 -1.16 0.00 0.00 60.37 59.11 1m1e h HIS 186 Cb 0.07 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 1m1e h HIS 186 CO -0.05 0.22 -0.35 0.00 0.86 0.00 0.00 177.93 178.62 1m1e h ALA 187 N 1.79 0.81 0.01 2.45 0.00 -0.88 -2.70 119.26 120.73 1m1e h ALA 187 Ca 0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.49 1m1e h ALA 187 Cb 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1m1e h ALA 187 CO 0.03 0.65 -0.00 0.82 0.00 0.00 0.00 179.25 180.74 1m1e h ILE 188 N 0.58 1.27 0.00 0.00 2.04 -0.42 -3.12 117.51 117.87 1m1e h ILE 188 Ca 0.06 -0.84 0.00 0.00 1.00 0.00 0.00 64.86 65.08 1m1e h ILE 188 Cb 0.87 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.79 1m1e h ILE 188 CO 0.08 0.22 0.00 0.00 0.00 0.00 0.00 178.15 178.44 1m1e h MET 189 N -0.37 0.00 -0.18 2.37 -0.00 -1.36 -2.12 114.93 113.28 1m1e h MET 189 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1m1e h MET 189 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.96 1m1e h MET 189 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.91 177.45 1m1e n ARG 190 N -2.40 2.02 -3.80 -0.10 1.74 -1.02 -4.72 116.66 108.38 1m1e n ARG 190 Ca 0.00 -1.52 -0.36 0.00 -0.77 0.00 0.00 57.85 55.20 1m1e n ARG 190 Cb 0.16 -1.45 -0.12 0.00 -1.02 0.00 0.00 32.46 30.03 1m1e n ARG 190 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1m1e s SER 191 N -1.69 5.20 0.28 0.55 0.15 -0.80 -4.97 113.70 112.44 1m1e s SER 191 Ca 0.34 -1.99 0.02 0.00 0.70 0.00 0.00 55.95 55.02 1m1e s SER 191 Cb 0.20 -1.81 0.58 0.00 -1.71 0.00 0.00 66.02 63.28 1m1e s SER 191 CO 0.30 -0.52 1.82 -0.65 1.20 0.00 0.00 173.24 175.39 1m1e h PRO 192 N 8.02 0.93 -0.63 5.44 0.11 -1.84 -1.44 132.00 142.59 1m1e h PRO 192 Ca -0.13 -0.06 -0.05 0.00 0.11 0.00 0.00 66.00 65.88 1m1e h PRO 192 Cb 1.05 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.92 1m1e h PRO 192 CO 0.68 0.61 0.21 1.96 -0.21 0.00 0.00 178.00 181.25 1m1e h GLN 193 N 0.95 0.97 0.40 1.05 7.50 -1.94 -0.80 115.11 123.25 1m1e h GLN 193 Ca 0.51 -0.20 -0.02 0.00 0.50 0.00 0.00 58.65 59.44 1m1e h GLN 193 Cb 0.55 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.94 1m1e h GLN 193 CO -0.29 0.85 -0.19 1.98 -1.50 0.00 0.00 178.83 179.68 1m1e h MET 194 N 0.90 -0.52 -0.96 1.46 4.05 -1.61 -1.44 114.93 116.81 1m1e h MET 194 Ca 0.20 0.04 0.08 0.00 -0.28 0.00 0.00 59.70 59.74 1m1e h MET 194 Cb 0.27 0.12 -0.07 0.00 -0.80 0.00 0.00 31.60 31.12 1m1e h MET 194 CO -0.01 -0.27 0.62 0.28 0.23 0.00 0.00 176.91 177.76 1m1e h VAL 195 N -0.67 1.03 -0.63 -5.77 2.07 -1.26 -0.89 116.25 110.13 1m1e h VAL 195 Ca -0.05 -0.36 -0.09 0.00 0.82 0.00 0.00 66.70 67.01 1m1e h VAL 195 Cb 0.49 -0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 1m1e h VAL 195 CO 0.09 0.19 0.05 0.28 0.02 0.00 0.00 177.57 178.21 1m1e h SER 196 N 1.06 1.03 -0.24 0.57 0.02 -1.02 -1.26 113.55 113.71 1m1e h SER 196 Ca 0.43 -0.27 -0.01 0.00 -0.84 0.00 0.00 61.79 61.10 1m1e h SER 196 Cb 0.27 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 1m1e h SER 196 CO -0.18 1.05 0.10 0.00 -1.14 0.00 0.00 176.83 176.65 1m1e h ALA 197 N 1.06 0.32 -0.52 3.77 0.00 -0.24 -0.75 119.26 122.90 1m1e h ALA 197 Ca 0.19 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1m1e h ALA 197 Cb 0.49 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 1m1e h ALA 197 CO 0.02 -0.09 0.28 0.82 0.00 0.00 0.00 179.25 180.28 1m1e h ILE 198 N 0.24 0.99 -0.79 0.00 2.04 -1.01 0.32 117.51 119.29 1m1e h ILE 198 Ca 0.08 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 1m1e h ILE 198 Cb 0.18 0.40 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 1m1e h ILE 198 CO -0.01 0.10 0.48 0.58 0.00 0.00 0.00 178.15 179.30 1m1e h VAL 199 N 0.54 1.22 0.00 1.67 2.07 -0.97 -0.61 116.25 120.17 1m1e h VAL 199 Ca 0.22 -0.49 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1m1e h VAL 199 Cb 0.10 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 29.97 1m1e h VAL 199 CO -0.14 0.23 -0.00 0.03 0.02 0.00 0.00 177.57 177.71 1m1e h ARG 200 N 1.09 -0.00 -1.00 1.57 3.08 -0.29 -3.01 114.38 115.82 1m1e h ARG 200 Ca 0.29 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.47 1m1e h ARG 200 Cb -0.04 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 29.92 1m1e h ARG 200 CO -0.05 0.65 0.63 1.15 -1.07 0.00 0.00 179.97 181.27 1m1e h THR 201 N -0.66 0.88 0.09 2.04 2.02 -0.25 -2.51 112.91 114.53 1m1e h THR 201 Ca -0.00 -0.33 -0.00 0.00 0.77 0.00 0.00 66.41 66.85 1m1e h THR 201 Cb 0.65 -0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 1m1e h THR 201 CO 0.00 0.18 -0.04 -0.03 0.37 0.00 0.00 175.52 175.99 1m1e h MET 202 N 0.96 -0.11 -0.61 6.66 1.85 -1.15 -1.04 114.93 121.48 1m1e h MET 202 Ca 0.51 0.01 0.00 0.00 -0.61 0.00 0.00 59.70 59.61 1m1e h MET 202 Cb 0.56 0.03 0.00 0.00 0.43 0.00 0.00 31.60 32.61 1m1e h MET 202 CO -0.29 0.12 0.00 0.00 -0.40 0.00 0.00 176.91 176.35 1m1e n GLN 203 N -5.04 1.61 0.00 0.39 10.64 -1.05 -3.93 117.38 120.00 1m1e n GLN 203 Ca -0.08 -0.59 0.00 0.00 -1.83 0.00 0.00 57.00 54.50 1m1e n GLN 203 Cb 0.16 -1.44 0.00 0.00 -0.86 0.00 0.00 30.24 28.10 1m1e n GLN 203 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1m1e n ASN 204 N 0.05 2.41 -4.53 2.61 3.02 -0.97 -5.07 115.26 112.78 1m1e n ASN 204 Ca 0.05 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.26 1m1e n ASN 204 Cb 0.31 0.01 0.10 0.00 -0.61 0.00 0.00 39.78 39.59 1m1e n ASN 204 CO 0.00 0.00 0.00 1.07 -2.62 0.00 0.00 177.26 175.71 1m1e n THR 205 N -2.08 1.58 -0.27 3.41 5.66 -0.40 -4.94 114.28 117.24 1m1e n THR 205 Ca 0.00 -0.30 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 1m1e n THR 205 Cb 0.30 -0.87 0.00 0.00 -1.55 0.00 0.00 70.33 68.21 1m1e n THR 205 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1m1e n ASN 206 N -1.43 1.09 -4.47 1.09 3.02 -1.26 -4.91 115.26 108.40 1m1e n ASN 206 Ca 0.11 -1.36 -0.43 0.00 -0.03 0.00 0.00 54.58 52.86 1m1e n ASN 206 Cb 0.51 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.60 1m1e n ASN 206 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1m1e s ASP 207 N -0.36 6.21 0.21 6.41 -1.08 -1.26 -4.97 116.67 121.83 1m1e s ASP 207 Ca 0.00 -0.75 -0.09 0.00 -0.52 0.00 0.00 52.55 51.19 1m1e s ASP 207 Cb 0.00 -2.24 0.31 0.00 -1.46 0.00 0.00 42.92 39.53 1m1e s ASP 207 CO 0.00 -0.67 1.23 0.55 0.52 0.00 0.00 175.17 176.80 1m1e n VAL 208 N 5.49 -0.36 0.25 1.11 3.14 -1.26 0.83 118.33 127.54 1m1e n VAL 208 Ca -0.07 1.83 0.10 0.00 -2.96 0.00 0.00 64.34 63.23 1m1e n VAL 208 Cb 0.47 -2.49 0.66 0.00 -1.06 0.00 0.00 33.84 31.41 1m1e n VAL 208 CO 0.00 0.00 0.00 -0.08 -6.46 0.00 0.00 176.83 170.29 1m1e h GLU 209 N 0.00 0.00 0.01 1.45 4.57 -1.98 -1.27 114.58 117.36 1m1e h GLU 209 Ca 0.35 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.45 1m1e h GLU 209 Cb 0.55 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.14 1m1e h GLU 209 CO -0.81 0.12 -0.33 1.15 -1.18 0.00 0.00 179.01 177.97 1m1e h THR 210 N 0.00 1.54 -0.55 0.32 2.02 0.09 -1.88 112.91 114.44 1m1e h THR 210 Ca -0.00 -2.03 -0.02 0.00 0.77 0.00 0.00 66.41 65.12 1m1e h THR 210 Cb 0.26 2.81 -0.03 0.00 -1.74 0.00 0.00 68.15 69.46 1m1e h THR 210 CO 0.02 0.56 0.25 0.00 0.37 0.00 0.00 175.52 176.72 1m1e h ALA 211 N 0.24 1.40 -0.40 6.16 0.00 -1.23 -1.04 119.26 124.38 1m1e h ALA 211 Ca -0.04 -0.12 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 1m1e h ALA 211 Cb 1.10 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1m1e h ALA 211 CO 0.06 0.46 -0.33 -0.09 0.00 0.00 0.00 179.25 179.36 1m1e h ARG 212 N 0.78 0.91 -0.03 0.00 2.43 -1.26 -0.91 114.38 116.31 1m1e h ARG 212 Ca 0.19 -0.44 -0.18 0.00 -0.81 0.00 0.00 59.98 58.74 1m1e h ARG 212 Cb 0.11 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 1m1e h ARG 212 CO -0.02 1.10 -0.77 0.00 -1.51 0.00 0.00 179.97 178.77 1m1e h THR 214 N 0.14 1.49 -0.73 0.00 1.35 -1.18 -1.14 112.91 112.85 1m1e h THR 214 Ca -0.03 -1.90 -0.04 0.00 -0.55 0.00 0.00 66.41 63.89 1m1e h THR 214 Cb 1.34 2.62 -0.03 0.00 -1.73 0.00 0.00 68.15 70.35 1m1e h THR 214 CO 0.12 0.53 0.31 0.00 -0.25 0.00 0.00 175.52 176.23 1m1e h ALA 215 N 0.31 1.16 -0.45 6.62 0.00 -1.23 -1.54 119.26 124.14 1m1e h ALA 215 Ca -0.04 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 1m1e h ALA 215 Cb 1.04 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1m1e h ALA 215 CO 0.06 0.61 -0.03 0.78 0.00 0.00 0.00 179.25 180.68 1m1e h GLY 216 N 1.11 0.82 0.84 0.00 0.00 -1.17 -0.95 103.07 103.71 1m1e h GLY 216 Ca 0.25 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 1m1e h GLY 216 CO -0.02 0.52 0.03 -0.84 0.00 0.00 0.00 176.54 176.23 1m1e h THR 217 N 0.71 1.22 -1.00 4.70 2.02 -0.59 -1.93 112.91 118.03 1m1e h THR 217 Ca 0.13 -0.71 0.01 0.00 0.77 0.00 0.00 66.41 66.61 1m1e h THR 217 Cb 0.47 1.33 -0.05 0.00 -1.74 0.00 0.00 68.15 68.17 1m1e h THR 217 CO 0.02 0.22 0.67 -0.07 0.37 0.00 0.00 175.52 176.73 1m1e h LEU 218 N 0.11 1.15 -0.37 2.58 3.38 -1.09 -1.21 115.31 119.85 1m1e h LEU 218 Ca 0.06 -0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1m1e h LEU 218 Cb 0.30 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1m1e h LEU 218 CO 0.00 0.82 0.17 -0.74 0.09 0.00 0.00 178.44 178.78 1m1e h HIS 219 N 1.35 0.31 -0.81 1.13 2.76 -0.92 -0.62 115.15 118.35 1m1e h HIS 219 Ca 0.37 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.54 1m1e h HIS 219 Cb -0.13 -0.08 -0.04 0.00 1.55 0.00 0.00 27.41 28.70 1m1e h HIS 219 CO -0.00 0.15 0.42 -0.91 -1.30 0.00 0.00 177.93 176.29 1m1e h ASN 220 N 0.35 1.03 0.20 3.26 2.35 -0.60 -2.48 115.58 119.68 1m1e h ASN 220 Ca 0.16 -0.11 -0.08 0.00 -0.55 0.00 0.00 56.30 55.72 1m1e h ASN 220 Cb 0.09 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.18 1m1e h ASN 220 CO -0.13 0.85 -0.30 -0.07 -1.65 0.00 0.00 177.43 176.14 1m1e h LEU 221 N 1.13 0.16 0.00 1.61 3.38 -0.75 -2.88 115.31 117.96 1m1e h LEU 221 Ca 0.28 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1m1e h LEU 221 Cb 0.07 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1m1e h LEU 221 CO -0.04 0.46 0.00 -1.54 0.09 0.00 0.00 178.44 177.41 1m1e n SER 222 N -4.14 0.00 0.19 -0.43 3.41 -0.28 -1.75 113.62 110.62 1m1e n SER 222 Ca -0.01 0.17 0.13 0.00 -0.26 0.00 0.00 58.87 58.89 1m1e n SER 222 Cb 0.38 -0.28 0.33 0.00 -0.26 0.00 0.00 64.21 64.38 1m1e n SER 222 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1m1e h HIS 223 N 0.00 0.00 -3.19 7.33 6.17 -1.59 -3.43 115.15 120.44 1m1e h HIS 223 Ca 0.00 0.00 -0.64 0.00 0.71 0.00 0.00 60.37 60.44 1m1e h HIS 223 Cb 0.07 0.00 -0.14 0.00 2.52 0.00 0.00 27.41 29.86 1m1e h HIS 223 CO 0.00 0.00 -0.72 -1.01 0.71 0.00 0.00 177.93 176.91 1m1e s HIS 224 N -3.25 2.71 0.16 5.26 3.76 -0.72 -5.04 115.29 118.17 1m1e s HIS 224 Ca 0.07 -0.18 -0.14 0.00 -0.15 0.00 0.00 55.06 54.65 1m1e s HIS 224 Cb 0.08 -1.36 0.04 0.00 1.11 0.00 0.00 32.58 32.45 1m1e s HIS 224 CO 0.61 0.48 1.75 -0.09 -0.85 0.00 0.00 174.74 176.64 1m1e h ARG 225 N 3.13 0.69 -0.36 1.40 2.43 -1.87 -0.57 114.38 119.23 1m1e h ARG 225 Ca -0.48 -0.09 -0.08 0.00 -0.81 0.00 0.00 59.98 58.52 1m1e h ARG 225 Cb 1.19 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 1m1e h ARG 225 CO 0.54 0.57 -0.11 0.93 -1.51 0.00 0.00 179.97 180.39 1m1e h GLU 226 N 0.65 0.63 -0.40 0.20 5.08 -1.96 -2.02 114.58 116.75 1m1e h GLU 226 Ca 0.17 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.27 1m1e h GLU 226 Cb 0.09 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1m1e h GLU 226 CO -0.02 0.73 0.00 0.78 -1.00 0.00 0.00 179.01 179.50 1m1e h GLY 227 N 0.96 0.76 1.00 -3.84 0.00 -1.59 -1.20 103.07 99.15 1m1e h GLY 227 Ca 0.10 -0.56 0.00 0.00 0.00 0.00 0.00 47.33 46.88 1m1e h GLY 227 CO 0.03 0.51 0.33 1.41 0.00 0.00 0.00 176.54 178.83 1m1e h LEU 228 N 0.53 0.62 -0.30 3.11 3.38 -0.89 -1.18 115.31 120.58 1m1e h LEU 228 Ca 0.11 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1m1e h LEU 228 Cb 0.47 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 1m1e h LEU 228 CO 0.02 0.47 0.07 0.25 0.09 0.00 0.00 178.44 179.35 1m1e h LEU 229 N 0.71 0.45 -0.47 1.67 5.85 -1.25 -1.05 115.31 121.20 1m1e h LEU 229 Ca 0.19 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.70 1m1e h LEU 229 Cb -0.05 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.84 1m1e h LEU 229 CO -0.04 0.56 0.29 0.00 -0.34 0.00 0.00 178.44 178.91 1m1e h ALA 230 N 0.90 0.60 -0.59 1.25 0.00 -1.04 0.12 119.26 120.51 1m1e h ALA 230 Ca 0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1m1e h ALA 230 Cb 0.28 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1m1e h ALA 230 CO 0.00 -0.01 0.36 0.82 0.00 0.00 0.00 179.25 180.42 1m1e h ILE 231 N 0.58 1.17 0.29 0.00 2.04 -1.09 -0.30 117.51 120.20 1m1e h ILE 231 Ca 0.19 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.66 1m1e h ILE 231 Cb -0.00 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.44 1m1e h ILE 231 CO -0.08 0.18 -0.16 0.15 0.00 0.00 0.00 178.15 178.24 1m1e h PHE 232 N 0.79 -0.42 0.00 1.37 3.57 -0.51 0.02 116.94 121.76 1m1e h PHE 232 Ca 0.21 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1m1e h PHE 232 Cb -0.03 0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.85 1m1e h PHE 232 CO -0.02 -0.26 -0.14 0.87 -2.23 0.00 0.00 178.31 176.53 1m1e h LYS 233 N -0.43 0.00 -0.15 1.11 1.57 -0.58 -2.42 116.57 115.67 1m1e h LYS 233 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 1m1e h LYS 233 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.65 1m1e h LYS 233 CO 0.04 0.14 0.00 0.43 -0.57 0.00 0.00 179.45 179.50 1m1e n SER 234 N -3.70 0.81 -1.25 0.86 7.64 -0.14 -4.86 113.62 112.98 1m1e n SER 234 Ca -0.02 -1.98 -0.11 0.00 1.01 0.00 0.00 58.87 57.77 1m1e n SER 234 Cb 0.26 -0.10 -0.01 0.00 -1.01 0.00 0.00 64.21 63.35 1m1e n SER 234 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m1e n GLY 235 N 0.75 0.08 0.21 0.23 0.00 -0.91 -4.87 105.19 100.68 1m1e n GLY 235 Ca 0.06 -0.42 0.06 0.00 0.00 0.00 0.00 46.02 45.72 1m1e n GLY 235 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1m1e h GLY 236 N 0.00 0.00 0.93 -0.02 0.00 -1.14 -3.27 103.07 99.57 1m1e h GLY 236 Ca -0.27 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1m1e h GLY 236 CO 0.33 0.00 0.03 -2.22 0.00 0.00 0.00 176.54 174.68 1m1e h ILE 237 N 0.00 1.08 -0.69 2.60 2.04 -1.85 -0.10 117.51 120.58 1m1e h ILE 237 Ca -0.00 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 1m1e h ILE 237 Cb 0.58 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.74 1m1e h ILE 237 CO 0.04 0.06 0.42 -0.65 0.00 0.00 0.00 178.15 178.03 1m1e h PRO 238 N 0.01 0.93 -0.36 2.37 0.11 -1.89 -1.12 132.00 132.06 1m1e h PRO 238 Ca 0.02 -0.08 -0.12 0.00 0.11 0.00 0.00 66.00 65.93 1m1e h PRO 238 Cb 0.08 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 1m1e h PRO 238 CO -0.00 0.65 -0.27 0.00 -0.21 0.00 0.00 178.00 178.16 1m1e h ALA 239 N 1.52 0.85 -0.45 -0.75 0.00 -1.57 -2.40 119.26 116.47 1m1e h ALA 239 Ca 0.25 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 1m1e h ALA 239 Cb -0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1m1e h ALA 239 CO -0.05 0.63 -0.24 -0.07 0.00 0.00 0.00 179.25 179.53 1m1e h LEU 240 N 0.64 0.99 -1.20 0.00 3.38 -0.47 -2.37 115.31 116.28 1m1e h LEU 240 Ca 0.08 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1m1e h LEU 240 Cb 0.78 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 1m1e h LEU 240 CO 0.06 1.18 0.18 0.58 0.09 0.00 0.00 178.44 180.54 1m1e h VAL 241 N 0.80 1.20 -0.65 1.22 2.07 -1.12 -1.90 116.25 117.86 1m1e h VAL 241 Ca 0.10 -0.64 -0.08 0.00 0.82 0.00 0.00 66.70 66.90 1m1e h VAL 241 Cb 0.82 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.18 1m1e h VAL 241 CO 0.07 0.24 0.08 0.50 0.02 0.00 0.00 177.57 178.49 1m1e h LYS 242 N 0.73 1.10 0.00 1.57 3.64 -1.20 -2.34 116.57 120.06 1m1e h LYS 242 Ca 0.17 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.25 1m1e h LYS 242 Cb 0.18 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1m1e h LYS 242 CO -0.01 1.02 0.00 -1.33 -2.27 0.00 0.00 179.45 176.85 1m1e n MET 243 N -4.20 0.14 0.00 1.90 2.81 -0.73 -1.78 117.12 115.26 1m1e n MET 243 Ca 0.04 0.54 0.07 0.00 -1.81 0.00 0.00 57.70 56.54 1m1e n MET 243 Cb 0.31 -1.87 0.37 0.00 -0.71 0.00 0.00 33.22 31.31 1m1e n MET 243 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1m1e n LEU 244 N -2.15 0.00 -1.20 4.03 4.77 -0.88 -1.62 117.00 119.95 1m1e n LEU 244 Ca 0.00 0.28 0.11 0.00 -0.03 0.00 0.00 56.01 56.38 1m1e n LEU 244 Cb 0.10 -0.28 0.25 0.00 -2.33 0.00 0.00 43.42 41.16 1m1e n LEU 244 CO 0.12 -0.15 0.72 0.61 -1.33 0.00 0.00 177.39 177.37 1m1e n GLY 245 N -0.04 2.08 3.72 -0.72 0.00 -0.73 -4.96 105.19 104.54 1m1e n GLY 245 Ca 0.07 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.94 1m1e n GLY 245 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1m1e s SER 246 N -1.24 7.30 0.51 1.61 0.15 -0.64 -4.94 113.70 116.45 1m1e s SER 246 Ca 0.42 1.87 0.29 0.00 0.70 0.00 0.00 55.95 59.24 1m1e s SER 246 Cb 0.23 -2.58 1.19 0.00 -1.71 0.00 0.00 66.02 63.15 1m1e s SER 246 CO 0.31 -0.26 1.92 -0.65 1.20 0.00 0.00 173.24 175.77 1m1e h PRO 247 N 6.15 0.00 -6.25 5.44 0.11 -1.93 -3.43 132.00 132.09 1m1e h PRO 247 Ca -0.42 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.12 1m1e h PRO 247 Cb 1.21 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 1m1e h PRO 247 CO 0.75 0.10 0.98 0.08 -0.21 0.00 0.00 178.00 179.70 1m1e s VAL 248 N -3.69 4.07 0.27 3.15 1.01 -1.26 -4.91 120.40 119.04 1m1e s VAL 248 Ca 0.01 1.25 -0.05 0.00 0.00 0.00 0.00 61.98 63.19 1m1e s VAL 248 Cb 0.10 -3.95 0.26 0.00 0.00 0.00 0.00 36.38 32.79 1m1e s VAL 248 CO 0.58 -0.27 1.94 0.44 0.00 0.00 0.00 175.10 177.80 1m1e h ASP 249 N 9.12 1.08 -0.65 3.32 3.32 -2.00 -1.85 116.42 128.76 1m1e h ASP 249 Ca -0.29 -0.03 0.05 0.00 0.02 0.00 0.00 57.03 56.79 1m1e h ASP 249 Cb 1.12 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 40.34 1m1e h ASP 249 CO 0.99 0.78 0.37 0.77 -1.72 0.00 0.00 179.24 180.44 1m1e h SER 250 N 1.27 0.56 -0.07 6.45 4.64 -1.97 0.19 113.55 124.62 1m1e h SER 250 Ca 0.34 0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.68 1m1e h SER 250 Cb -0.14 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 61.86 1m1e h SER 250 CO -0.07 0.37 0.01 0.58 -0.87 0.00 0.00 176.83 176.84 1m1e h VAL 251 N 0.69 1.23 -0.64 0.95 2.07 -1.81 -2.63 116.25 116.10 1m1e h VAL 251 Ca 0.29 -0.70 0.07 0.00 0.82 0.00 0.00 66.70 67.18 1m1e h VAL 251 Cb 0.16 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.43 1m1e h VAL 251 CO -0.17 0.19 0.33 -0.07 0.02 0.00 0.00 177.57 177.88 1m1e h LEU 252 N -0.14 0.47 -0.43 2.57 3.38 -0.94 -0.05 115.31 120.17 1m1e h LEU 252 Ca 0.02 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1m1e h LEU 252 Cb 0.30 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1m1e h LEU 252 CO 0.00 0.30 0.14 0.15 0.09 0.00 0.00 178.44 179.12 1m1e h PHE 253 N 0.61 0.68 -0.43 1.13 3.57 -0.93 -0.24 116.94 121.32 1m1e h PHE 253 Ca 0.30 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.71 1m1e h PHE 253 Cb 0.24 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1m1e h PHE 253 CO -0.10 0.61 0.16 1.88 -2.23 0.00 0.00 178.31 178.64 1m1e h TYR 254 N 0.55 0.66 0.21 0.41 0.99 -1.15 -1.93 116.97 116.72 1m1e h TYR 254 Ca 0.14 -0.05 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 1m1e h TYR 254 Cb 0.24 -0.20 0.00 0.00 1.00 0.00 0.00 36.73 37.78 1m1e h TYR 254 CO 0.01 0.58 -0.10 0.00 -0.00 0.00 0.00 178.16 178.65 1m1e h ALA 255 N 1.01 -0.28 -0.16 3.88 0.00 -0.77 -0.72 119.26 122.21 1m1e h ALA 255 Ca 0.14 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 1m1e h ALA 255 Cb 0.21 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1m1e h ALA 255 CO -0.01 -0.63 -0.27 0.97 0.00 0.00 0.00 179.25 179.31 1m1e h ILE 256 N -0.34 1.26 -0.27 0.00 6.09 -1.07 -1.72 117.51 121.46 1m1e h ILE 256 Ca -0.03 -1.21 -0.17 0.00 -1.37 0.00 0.00 64.86 62.09 1m1e h ILE 256 Cb 0.26 1.43 -0.00 0.00 0.47 0.00 0.00 36.82 38.98 1m1e h ILE 256 CO 0.05 0.37 -0.50 0.74 -3.07 0.00 0.00 178.15 175.74 1m1e h THR 257 N 0.27 1.29 -0.43 2.19 2.02 -1.23 -0.23 112.91 116.80 1m1e h THR 257 Ca 0.04 -1.70 -0.07 0.00 0.77 0.00 0.00 66.41 65.45 1m1e h THR 257 Cb 0.63 1.62 -0.02 0.00 -1.74 0.00 0.00 68.15 68.64 1m1e h THR 257 CO 0.05 0.55 -0.01 0.74 0.37 0.00 0.00 175.52 177.22 1m1e h THR 258 N 0.59 1.26 -0.63 3.16 2.02 -0.89 -1.56 112.91 116.86 1m1e h THR 258 Ca 0.02 -1.04 -0.05 0.00 0.77 0.00 0.00 66.41 66.11 1m1e h THR 258 Cb 1.07 1.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.54 1m1e h THR 258 CO 0.11 0.36 0.20 -0.07 0.37 0.00 0.00 175.52 176.48 1m1e h LEU 259 N 0.60 0.89 -0.62 2.58 3.38 -1.24 -1.75 115.31 119.15 1m1e h LEU 259 Ca 0.12 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1m1e h LEU 259 Cb 0.50 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1m1e h LEU 259 CO 0.02 0.84 0.31 -0.74 0.09 0.00 0.00 178.44 178.96 1m1e h HIS 260 N 0.93 0.88 -0.30 1.13 2.76 -0.70 0.11 115.15 119.97 1m1e h HIS 260 Ca 0.21 -0.04 -0.10 0.00 -2.20 0.00 0.00 60.37 58.24 1m1e h HIS 260 Cb 0.27 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.94 1m1e h HIS 260 CO 0.02 0.66 -0.24 -0.91 -1.30 0.00 0.00 177.93 176.16 1m1e h ASN 261 N 0.84 0.58 -0.16 3.26 2.35 -0.90 -1.57 115.58 119.98 1m1e h ASN 261 Ca 0.21 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.73 1m1e h ASN 261 Cb 0.10 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 1m1e h ASN 261 CO -0.03 0.81 -0.03 -0.07 -1.65 0.00 0.00 177.43 176.46 1m1e h LEU 262 N 0.51 0.30 -1.22 1.61 3.38 -0.87 -1.76 115.31 117.25 1m1e h LEU 262 Ca 0.07 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1m1e h LEU 262 Cb 0.68 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 1m1e h LEU 262 CO 0.05 0.59 0.47 -0.07 0.09 0.00 0.00 178.44 179.58 1m1e h LEU 263 N 0.00 0.88 -0.26 1.67 3.38 -0.66 0.20 115.31 120.52 1m1e h LEU 263 Ca 0.04 -0.04 -0.21 0.00 0.09 0.00 0.00 57.88 57.77 1m1e h LEU 263 Cb 0.46 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1m1e h LEU 263 CO 0.01 0.65 -0.80 -0.07 0.09 0.00 0.00 178.44 178.33 1m1e h LEU 264 N 1.02 0.67 0.00 1.67 3.38 -1.22 -3.42 115.31 117.41 1m1e h LEU 264 Ca 0.27 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1m1e h LEU 264 Cb -0.08 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.47 1m1e h LEU 264 CO -0.06 1.23 -0.97 1.41 0.09 0.00 0.00 178.44 180.15 1m1e n HIS 265 N -3.85 0.00 -2.96 1.13 8.25 -0.67 -5.02 115.22 112.09 1m1e n HIS 265 Ca -0.06 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.98 1m1e n HIS 265 Cb 0.75 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.81 1m1e n HIS 265 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 1m1e s GLN 266 N -1.96 3.69 0.16 -0.41 2.00 0.69 -5.01 119.66 118.82 1m1e s GLN 266 Ca 0.00 0.23 -0.33 0.00 -2.00 0.00 0.00 55.36 53.27 1m1e s GLN 266 Cb 0.00 -3.83 -0.12 0.00 0.80 0.00 0.00 33.01 29.85 1m1e s GLN 266 CO 0.00 -0.89 1.70 -1.91 -0.50 0.00 0.00 175.29 173.69 1m1e n GLU 267 N 6.47 2.51 0.00 1.67 2.13 -1.26 -1.38 120.64 130.78 1m1e n GLU 267 Ca 0.03 0.91 0.00 0.00 0.66 0.00 0.00 57.16 58.76 1m1e n GLU 267 Cb 0.48 -2.74 0.00 0.00 0.27 0.00 0.00 31.44 29.46 1m1e n GLU 267 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1m1e n GLY 268 N 3.84 1.92 0.34 8.31 0.00 -1.26 -4.95 105.19 113.38 1m1e n GLY 268 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 1m1e n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m1e h ALA 269 N 0.00 1.11 -0.29 4.61 0.00 -1.50 -2.76 119.26 120.42 1m1e h ALA 269 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1m1e h ALA 269 Cb 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 1m1e h ALA 269 CO 0.00 0.53 0.17 0.87 0.00 0.00 0.00 179.25 180.82 1m1e h LYS 270 N 1.19 0.34 -0.45 0.00 1.57 -1.88 -0.80 116.57 116.54 1m1e h LYS 270 Ca 0.32 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1m1e h LYS 270 Cb -0.12 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.09 1m1e h LYS 270 CO -0.07 0.23 0.22 1.98 -0.57 0.00 0.00 179.45 181.24 1m1e h MET 271 N 0.35 0.65 -0.91 3.15 4.05 -1.95 -1.56 114.93 118.71 1m1e h MET 271 Ca 0.11 -0.09 0.03 0.00 -0.28 0.00 0.00 59.70 59.47 1m1e h MET 271 Cb -0.00 -0.12 -0.05 0.00 -0.80 0.00 0.00 31.60 30.63 1m1e h MET 271 CO -0.05 0.55 0.59 0.00 0.23 0.00 0.00 176.91 178.23 1m1e h ALA 272 N 1.06 1.19 -0.39 0.39 0.00 -1.23 0.04 119.26 120.33 1m1e h ALA 272 Ca 0.15 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 1m1e h ALA 272 Cb 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1m1e h ALA 272 CO -0.02 0.48 -0.27 0.28 0.00 0.00 0.00 179.25 179.72 1m1e h VAL 273 N 1.17 1.28 0.04 0.00 2.07 -0.89 -1.76 116.25 118.16 1m1e h VAL 273 Ca 0.36 -1.43 -0.00 0.00 0.82 0.00 0.00 66.70 66.44 1m1e h VAL 273 Cb -0.03 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1m1e h VAL 273 CO -0.11 0.48 -0.02 0.03 0.02 0.00 0.00 177.57 177.97 1m1e h ARG 274 N 0.67 -0.05 -0.26 1.57 3.08 -0.89 0.64 114.38 119.15 1m1e h ARG 274 Ca 0.08 0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.15 1m1e h ARG 274 Cb 0.85 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 1m1e h ARG 274 CO 0.07 0.03 0.17 -0.07 -1.07 0.00 0.00 179.97 179.11 1m1e h LEU 275 N -0.12 0.25 -0.08 3.04 3.38 -0.95 -1.08 115.31 119.74 1m1e h LEU 275 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1m1e h LEU 275 Cb 0.11 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1m1e h LEU 275 CO 0.01 0.17 -0.00 0.00 0.09 0.00 0.00 178.44 178.71 1m1e n ALA 276 N -2.51 2.67 -1.66 1.53 0.00 -0.67 -4.88 120.51 114.99 1m1e n ALA 276 Ca 0.01 -0.22 -0.00 0.00 0.00 0.00 0.00 53.44 53.24 1m1e n ALA 276 Cb 0.12 -1.49 -0.00 0.00 0.00 0.00 0.00 19.45 18.08 1m1e n ALA 276 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m1e n GLY 277 N 1.03 0.37 0.26 0.00 0.00 -0.41 -4.95 105.19 101.50 1m1e n GLY 277 Ca 0.23 -0.95 0.01 0.00 0.00 0.00 0.00 46.02 45.30 1m1e n GLY 277 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1m1e h GLY 278 N 0.00 0.48 1.00 -0.02 0.00 -1.03 -2.98 103.07 100.51 1m1e h GLY 278 Ca -0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.04 1m1e h GLY 278 CO 0.01 0.26 -0.08 1.41 0.00 0.00 0.00 176.54 178.14 1m1e h LEU 279 N 0.43 -0.18 -1.13 3.11 3.38 -1.85 -0.24 115.31 118.82 1m1e h LEU 279 Ca 0.09 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1m1e h LEU 279 Cb 0.33 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.09 1m1e h LEU 279 CO 0.01 -0.13 0.52 1.56 0.09 0.00 0.00 178.44 180.49 1m1e h GLN 280 N -0.21 1.10 -0.29 1.13 7.50 -1.90 -1.46 115.11 120.98 1m1e h GLN 280 Ca -0.02 -0.08 -0.04 0.00 0.50 0.00 0.00 58.65 59.00 1m1e h GLN 280 Cb 0.16 -0.24 -0.01 0.00 0.05 0.00 0.00 27.48 27.44 1m1e h GLN 280 CO 0.03 0.76 0.01 0.87 -1.50 0.00 0.00 178.83 179.00 1m1e h LYS 281 N 1.13 0.51 -0.49 1.46 1.79 -1.35 -2.56 116.57 117.06 1m1e h LYS 281 Ca 0.30 -0.16 -0.03 0.00 -2.18 0.00 0.00 60.65 58.58 1m1e h LYS 281 Cb -0.08 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.50 1m1e h LYS 281 CO -0.06 0.65 0.17 0.52 -1.08 0.00 0.00 179.45 179.65 1m1e h MET 282 N 0.31 0.75 -0.89 3.15 2.86 -0.70 -2.61 114.93 117.79 1m1e h MET 282 Ca 0.09 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.56 1m1e h MET 282 Cb 0.41 -0.11 -0.04 0.00 0.06 0.00 0.00 31.60 31.91 1m1e h MET 282 CO 0.01 0.69 0.50 0.28 1.06 0.00 0.00 176.91 179.45 1m1e h VAL 283 N 0.65 1.26 0.00 -2.22 2.07 -1.28 -2.13 116.25 114.60 1m1e h VAL 283 Ca 0.16 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 1m1e h VAL 283 Cb 0.24 0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.04 1m1e h VAL 283 CO -0.01 0.28 -0.10 0.00 0.02 0.00 0.00 177.57 177.77 1m1e h ALA 284 N 1.27 1.20 -0.00 1.67 0.00 -1.20 -2.07 119.26 120.13 1m1e h ALA 284 Ca 0.31 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1m1e h ALA 284 Cb 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1m1e h ALA 284 CO -0.05 0.12 -0.14 1.28 0.00 0.00 0.00 179.25 180.46 1m1e n LEU 285 N -3.50 0.39 0.00 0.00 4.77 -0.81 -3.94 117.00 113.92 1m1e n LEU 285 Ca -0.02 0.09 0.06 0.00 -0.03 0.00 0.00 56.01 56.11 1m1e n LEU 285 Cb 0.24 -0.24 0.30 0.00 -2.33 0.00 0.00 43.42 41.39 1m1e n LEU 285 CO 0.29 0.08 0.60 0.18 -1.33 0.00 0.00 177.39 177.20 1m1e n LEU 286 N -1.11 0.00 -0.67 2.23 4.77 -0.78 -1.79 117.00 119.64 1m1e n LEU 286 Ca 0.12 0.17 0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1m1e n LEU 286 Cb 0.29 -0.17 0.37 0.00 -2.33 0.00 0.00 43.42 41.58 1m1e n LEU 286 CO 0.26 -0.11 0.78 -0.46 -1.33 0.00 0.00 177.39 176.52 1m1e n ASN 287 N -1.17 2.07 -4.74 -1.43 2.04 -1.25 -4.91 115.26 105.85 1m1e n ASN 287 Ca 0.07 -1.70 -0.29 0.00 -0.44 0.00 0.00 54.58 52.21 1m1e n ASN 287 Cb 0.07 -0.04 0.14 0.00 -2.53 0.00 0.00 39.78 37.42 1m1e n ASN 287 CO 0.00 0.00 0.00 -0.54 -0.44 0.00 0.00 177.26 176.28 1m1e s LYS 288 N -1.92 1.22 0.00 -3.83 -0.14 -0.74 -5.00 119.74 109.32 1m1e s LYS 288 Ca 0.35 0.59 0.09 0.00 -1.36 0.00 0.00 55.97 55.64 1m1e s LYS 288 Cb 0.20 -1.82 -0.03 0.00 -1.68 0.00 0.00 37.83 34.50 1m1e s LYS 288 CO 0.31 -2.21 0.53 0.25 -0.76 0.00 0.00 175.35 173.48 1m1e n THR 289 N -3.83 0.00 -2.27 2.17 -2.24 -1.26 -4.94 114.28 101.91 1m1e n THR 289 Ca 0.06 -0.37 -0.43 0.00 -2.27 0.00 0.00 64.05 61.05 1m1e n THR 289 Cb 0.57 1.08 -0.02 0.00 -2.10 0.00 0.00 70.33 69.85 1m1e n THR 289 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1m1e s ASN 290 N -1.46 6.37 0.42 3.42 3.84 -1.26 -4.89 114.94 121.38 1m1e s ASN 290 Ca 0.06 1.15 0.17 0.00 0.21 0.00 0.00 52.86 54.44 1m1e s ASN 290 Cb 0.07 -2.54 0.93 0.00 -0.55 0.00 0.00 41.25 39.16 1m1e s ASN 290 CO 0.27 -1.35 1.90 -0.37 -2.79 0.00 0.00 177.10 174.77 1m1e h VAL 291 N 6.32 1.06 -0.01 -5.21 -1.51 -1.99 -0.84 116.25 114.08 1m1e h VAL 291 Ca -0.29 -1.00 -0.21 0.00 -1.23 0.00 0.00 66.70 63.96 1m1e h VAL 291 Cb 1.12 1.56 -0.00 0.00 -2.13 0.00 0.00 31.29 31.84 1m1e h VAL 291 CO 1.05 0.27 -0.90 0.11 -1.23 0.00 0.00 177.57 176.88 1m1e h LYS 292 N 0.00 0.35 -0.29 5.19 1.57 -1.99 -1.54 116.57 119.86 1m1e h LYS 292 Ca -0.00 -0.36 -0.06 0.00 -1.87 0.00 0.00 60.65 58.35 1m1e h LYS 292 Cb 0.54 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1m1e h LYS 292 CO 0.04 1.05 -0.04 0.35 -0.57 0.00 0.00 179.45 180.27 1m1e h PHE 293 N 0.20 0.61 -0.57 -1.35 3.57 -1.88 -2.69 116.94 114.83 1m1e h PHE 293 Ca -0.06 -0.12 -0.05 0.00 3.53 0.00 0.00 57.97 61.26 1m1e h PHE 293 Cb 1.52 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 40.08 1m1e h PHE 293 CO 0.05 0.72 0.15 -0.07 -2.23 0.00 0.00 178.31 176.93 1m1e h LEU 294 N 0.32 0.81 -0.63 0.59 3.38 -1.13 -1.28 115.31 117.37 1m1e h LEU 294 Ca 0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1m1e h LEU 294 Cb 0.51 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.02 1m1e h LEU 294 CO 0.02 0.79 0.37 0.00 0.09 0.00 0.00 178.44 179.71 1m1e h ALA 295 N 1.32 0.80 -0.25 1.53 0.00 -1.17 0.49 119.26 121.99 1m1e h ALA 295 Ca 0.19 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1m1e h ALA 295 Cb 0.29 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1m1e h ALA 295 CO -0.00 0.30 -0.16 0.82 0.00 0.00 0.00 179.25 180.20 1m1e h ILE 296 N 0.85 1.31 -0.26 0.00 2.04 -1.18 -1.97 117.51 118.30 1m1e h ILE 296 Ca 0.22 -1.27 -0.00 0.00 1.00 0.00 0.00 64.86 64.81 1m1e h ILE 296 Cb 0.00 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1m1e h ILE 296 CO -0.04 0.40 0.16 0.74 0.00 0.00 0.00 178.15 179.41 1m1e h THR 297 N 0.27 1.09 -0.18 -0.27 2.02 -1.03 -1.28 112.91 113.53 1m1e h THR 297 Ca 0.05 -0.21 -0.06 0.00 0.77 0.00 0.00 66.41 66.96 1m1e h THR 297 Cb 0.69 0.76 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1m1e h THR 297 CO 0.04 0.09 -0.15 0.71 0.37 0.00 0.00 175.52 176.59 1m1e h THR 298 N 0.33 1.20 -0.21 3.16 1.35 -0.92 -1.98 112.91 115.84 1m1e h THR 298 Ca 0.09 -0.90 -0.12 0.00 -0.55 0.00 0.00 66.41 64.94 1m1e h THR 298 Cb 0.01 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.65 1m1e h THR 298 CO -0.02 0.28 -0.37 -0.78 -0.25 0.00 0.00 175.52 174.39 1m1e h ASP 299 N 0.28 0.48 -0.58 5.36 -0.00 -0.79 -1.36 116.42 119.81 1m1e h ASP 299 Ca 0.05 -0.20 -0.02 0.00 -0.00 0.00 0.00 57.03 56.87 1m1e h ASP 299 Cb 0.44 -0.13 -0.03 0.00 -0.00 0.00 0.00 39.33 39.61 1m1e h ASP 299 CO 0.03 0.81 0.28 0.00 -0.00 0.00 0.00 179.24 180.36 1m1e h LEU 301 N 0.78 0.58 -0.15 0.00 3.38 -0.96 -1.32 115.31 117.62 1m1e h LEU 301 Ca 0.20 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1m1e h LEU 301 Cb 0.11 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1m1e h LEU 301 CO -0.03 0.55 0.03 -0.61 0.09 0.00 0.00 178.44 178.48 1m1e h GLN 302 N 0.63 0.24 -0.88 1.13 -0.00 -0.69 -0.65 115.11 114.90 1m1e h GLN 302 Ca 0.15 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.65 58.72 1m1e h GLN 302 Cb 0.18 -0.03 -0.04 0.00 0.00 0.00 0.00 27.48 27.59 1m1e h GLN 302 CO -0.01 0.40 0.48 0.82 0.00 0.00 0.00 178.83 180.52 1m1e h ILE 303 N 0.04 1.26 -0.02 2.39 2.04 -1.00 -0.72 117.51 121.49 1m1e h ILE 303 Ca 0.05 -0.64 -0.16 0.00 1.00 0.00 0.00 64.86 65.11 1m1e h ILE 303 Cb 0.27 0.08 -0.02 0.00 -0.74 0.00 0.00 36.82 36.41 1m1e h ILE 303 CO 0.00 0.29 -0.70 -0.07 0.00 0.00 0.00 178.15 177.67 1m1e h LEU 304 N 1.23 0.14 0.01 1.44 3.38 -1.14 -3.29 115.31 117.07 1m1e h LEU 304 Ca 0.31 -0.09 -0.26 0.00 0.09 0.00 0.00 57.88 57.92 1m1e h LEU 304 Cb 0.03 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 1m1e h LEU 304 CO -0.05 0.79 -1.43 0.00 0.09 0.00 0.00 178.44 177.84 1m1e h ALA 305 N 1.20 0.58 -1.79 1.53 0.00 -0.90 -3.43 119.26 116.46 1m1e h ALA 305 Ca -0.01 -1.24 -0.68 0.00 0.00 0.00 0.00 54.91 52.98 1m1e h ALA 305 Cb 1.24 0.23 0.02 0.00 0.00 0.00 0.00 17.79 19.29 1m1e h ALA 305 CO 0.10 1.43 0.95 0.98 0.00 0.00 0.00 179.25 182.72 1m1e n TYR 306 N -3.19 2.15 -2.31 0.00 9.36 -0.29 -1.40 117.16 121.48 1m1e n TYR 306 Ca -0.11 0.31 -0.18 0.00 3.32 0.00 0.00 57.90 61.24 1m1e n TYR 306 Cb 1.01 -2.54 -0.02 0.00 -0.63 0.00 0.00 39.34 37.16 1m1e n TYR 306 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1m1e n GLY 307 N 4.14 -0.23 2.49 2.98 0.00 -1.26 -4.94 105.19 108.38 1m1e n GLY 307 Ca 0.24 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.97 1m1e n GLY 307 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1m1e s ASN 308 N -2.11 3.17 0.29 1.61 3.84 -0.50 -5.01 114.94 116.24 1m1e s ASN 308 Ca 0.00 -1.91 0.00 0.00 0.21 0.00 0.00 52.86 51.17 1m1e s ASN 308 Cb 0.00 -0.40 0.51 0.00 -0.55 0.00 0.00 41.25 40.81 1m1e s ASN 308 CO 0.00 -0.35 1.90 -0.61 -2.79 0.00 0.00 177.10 175.25 1m1e h GLN 309 N 7.46 1.02 -0.72 0.43 5.75 -1.92 -2.10 115.11 125.03 1m1e h GLN 309 Ca -0.02 -0.06 0.04 0.00 -0.15 0.00 0.00 58.65 58.45 1m1e h GLN 309 Cb 0.98 -0.23 -0.05 0.00 1.07 0.00 0.00 27.48 29.25 1m1e h GLN 309 CO 0.32 0.68 0.45 1.49 -2.65 0.00 0.00 178.83 179.12 1m1e h GLU 310 N 1.05 0.84 -0.27 1.69 4.81 -1.94 -1.52 114.58 119.23 1m1e h GLU 310 Ca 0.41 -0.05 -0.11 0.00 -0.13 0.00 0.00 59.36 59.48 1m1e h GLU 310 Cb 0.23 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 1m1e h GLU 310 CO -0.16 0.56 -0.28 0.77 -0.73 0.00 0.00 179.01 179.16 1m1e h SER 311 N 0.87 0.56 -0.67 1.04 0.02 -1.70 -2.36 113.55 111.31 1m1e h SER 311 Ca 0.30 -0.20 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 1m1e h SER 311 Cb 0.05 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 1m1e h SER 311 CO -0.12 0.82 0.18 0.11 -1.14 0.00 0.00 176.83 176.67 1m1e h LYS 312 N 0.47 1.07 -0.22 3.45 1.57 -0.86 -1.31 116.57 120.75 1m1e h LYS 312 Ca 0.06 -0.24 -0.13 0.00 -1.87 0.00 0.00 60.65 58.47 1m1e h LYS 312 Cb 0.74 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.89 1m1e h LYS 312 CO 0.06 0.94 -0.42 -0.07 -0.57 0.00 0.00 179.45 179.38 1m1e h LEU 313 N 1.02 0.56 -0.65 2.94 3.38 -1.10 -1.84 115.31 119.63 1m1e h LEU 313 Ca 0.22 -0.26 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 1m1e h LEU 313 Cb 0.34 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1m1e h LEU 313 CO -0.00 0.92 -0.22 0.40 0.09 0.00 0.00 178.44 179.63 1m1e h ILE 314 N 0.43 1.27 -0.59 1.22 2.04 -1.14 -0.88 117.51 119.87 1m1e h ILE 314 Ca 0.03 -1.35 -0.03 0.00 1.00 0.00 0.00 64.86 64.52 1m1e h ILE 314 Cb 0.92 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 38.17 1m1e h ILE 314 CO 0.08 0.45 0.27 0.40 0.00 0.00 0.00 178.15 179.35 1m1e h ILE 315 N 0.71 1.21 -0.07 -0.67 2.04 -1.04 -1.52 117.51 118.18 1m1e h ILE 315 Ca 0.10 -0.63 -0.00 0.00 1.00 0.00 0.00 64.86 65.33 1m1e h ILE 315 Cb 0.75 0.54 -0.00 0.00 -0.74 0.00 0.00 36.82 37.37 1m1e h ILE 315 CO 0.06 0.25 0.03 0.25 0.00 0.00 0.00 178.15 178.74 1m1e h LEU 316 N 0.80 0.09 -2.48 1.44 5.85 -1.07 0.52 115.31 120.45 1m1e h LEU 316 Ca 0.20 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1m1e h LEU 316 Cb 0.14 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1m1e h LEU 316 CO -0.02 0.16 -0.02 0.00 -0.34 0.00 0.00 178.44 178.21 1m1e h ALA 317 N 0.93 1.31 -0.04 1.25 0.00 -0.90 -0.23 119.26 121.58 1m1e h ALA 317 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1m1e h ALA 317 Cb 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1m1e h ALA 317 CO -0.00 0.03 0.00 0.43 0.00 0.00 0.00 179.25 179.70 1m1e n SER 318 N -3.56 1.48 0.00 0.00 7.64 -0.59 -4.92 113.62 113.66 1m1e n SER 318 Ca -0.03 -1.52 0.00 0.00 1.01 0.00 0.00 58.87 58.34 1m1e n SER 318 Cb 0.12 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1m1e n SER 318 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m1e n GLY 319 N 1.16 0.47 0.16 0.23 0.00 -0.10 -4.86 105.19 102.25 1m1e n GLY 319 Ca 0.19 -0.89 -0.07 0.00 0.00 0.00 0.00 46.02 45.25 1m1e n GLY 319 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1m1e h GLY 320 N 0.00 0.51 -0.06 -0.02 0.00 -1.06 -2.73 103.07 99.71 1m1e h GLY 320 Ca 0.00 -0.13 0.09 0.00 0.00 0.00 0.00 47.33 47.29 1m1e h GLY 320 CO 0.00 0.09 -0.22 -2.55 0.00 0.00 0.00 176.54 173.86 1m1e h PRO 321 N 0.37 -0.13 -0.40 4.80 0.11 -1.87 0.31 132.00 135.20 1m1e h PRO 321 Ca 0.16 0.01 -0.11 0.00 0.11 0.00 0.00 66.00 66.17 1m1e h PRO 321 Cb 0.08 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.20 1m1e h PRO 321 CO -0.12 -0.08 -0.20 0.37 -0.21 0.00 0.00 178.00 177.76 1m1e h GLN 322 N -0.13 0.78 -0.50 1.05 5.75 -1.86 -0.57 115.11 119.62 1m1e h GLN 322 Ca 0.21 -0.30 -0.06 0.00 -0.15 0.00 0.00 58.65 58.34 1m1e h GLN 322 Cb 0.45 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.94 1m1e h GLN 322 CO -0.52 0.91 0.06 0.00 -2.65 0.00 0.00 178.83 176.64 1m1e h ALA 323 N 1.09 0.67 -0.44 3.38 0.00 -1.03 -0.54 119.26 122.38 1m1e h ALA 323 Ca 0.10 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1m1e h ALA 323 Cb 0.70 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1m1e h ALA 323 CO 0.05 0.42 -0.15 -0.07 0.00 0.00 0.00 179.25 179.50 1m1e h LEU 324 N 0.71 0.90 -0.70 0.00 3.38 -0.25 -2.55 115.31 116.81 1m1e h LEU 324 Ca 0.15 -0.38 -0.08 0.00 0.09 0.00 0.00 57.88 57.66 1m1e h LEU 324 Cb 0.43 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1m1e h LEU 324 CO 0.01 1.08 0.14 0.58 0.09 0.00 0.00 178.44 180.34 1m1e h VAL 325 N 0.72 1.26 -1.00 1.22 2.07 -1.00 -2.61 116.25 116.92 1m1e h VAL 325 Ca 0.11 -1.02 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1m1e h VAL 325 Cb 0.71 0.58 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 1m1e h VAL 325 CO 0.05 0.39 0.66 0.78 0.02 0.00 0.00 177.57 179.47 1m1e h ASN 326 N 1.07 1.13 -0.64 0.57 2.35 -0.97 -1.75 115.58 117.33 1m1e h ASN 326 Ca 0.21 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.93 1m1e h ASN 326 Cb 0.42 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 1m1e h ASN 326 CO 0.01 0.80 0.36 0.40 -1.65 0.00 0.00 177.43 177.35 1m1e h ILE 327 N 1.32 1.20 0.00 2.81 2.04 -1.10 -0.41 117.51 123.37 1m1e h ILE 327 Ca 0.38 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 1m1e h ILE 327 Cb -0.09 0.36 -0.00 0.00 -0.74 0.00 0.00 36.82 36.34 1m1e h ILE 327 CO -0.10 0.21 -0.16 0.24 0.00 0.00 0.00 178.15 178.35 1m1e h MET 328 N 0.87 0.00 0.00 2.37 2.86 -0.99 -1.80 114.93 118.23 1m1e h MET 328 Ca 0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1m1e h MET 328 Cb 0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.68 1m1e h MET 328 CO -0.04 0.16 -0.90 0.54 1.06 0.00 0.00 176.91 177.73 1m1e n ARG 329 N -4.20 0.32 -0.10 1.72 1.74 -0.82 -4.55 116.66 110.78 1m1e n ARG 329 Ca -0.02 0.03 -0.12 0.00 -0.77 0.00 0.00 57.85 56.97 1m1e n ARG 329 Cb 0.23 -1.64 -0.12 0.00 -1.02 0.00 0.00 32.46 29.92 1m1e n ARG 329 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1m1e n THR 330 N -2.07 1.21 -4.18 0.55 -1.04 -0.21 -5.05 114.28 103.50 1m1e n THR 330 Ca 0.02 -0.58 -0.22 0.00 -2.04 0.00 0.00 64.05 61.23 1m1e n THR 330 Cb 0.45 -0.96 -0.05 0.00 -1.82 0.00 0.00 70.33 67.94 1m1e n THR 330 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1m1e s TYR 331 N -2.43 2.96 -0.27 -1.42 1.51 -0.72 -5.04 117.35 111.95 1m1e s TYR 331 Ca -0.20 -0.15 0.03 0.00 -1.01 0.00 0.00 57.07 55.73 1m1e s TYR 331 Cb 0.06 -1.33 0.00 0.00 -0.11 0.00 0.00 41.96 40.59 1m1e s TYR 331 CO 0.59 0.56 0.42 0.25 -1.11 0.00 0.00 175.55 176.25 1m1e n THR 332 N -1.06 0.00 -1.99 -0.71 -2.24 -1.26 -4.88 114.28 102.13 1m1e n THR 332 Ca -0.07 -0.48 -0.43 0.00 -2.27 0.00 0.00 64.05 60.80 1m1e n THR 332 Cb 0.58 1.04 -0.03 0.00 -2.10 0.00 0.00 70.33 69.82 1m1e n THR 332 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1m1e s TYR 333 N -0.60 1.89 0.21 4.78 5.04 -1.26 -4.91 117.35 122.51 1m1e s TYR 333 Ca 0.02 0.37 -0.09 0.00 -2.44 0.00 0.00 57.07 54.93 1m1e s TYR 333 Cb 0.02 -3.99 0.31 0.00 0.35 0.00 0.00 41.96 38.65 1m1e s TYR 333 CO 0.06 -3.51 1.71 1.49 -1.34 0.00 0.00 175.55 173.96 1m1e h GLU 334 N 10.95 0.29 -0.84 4.97 4.22 -1.99 -1.29 114.58 130.89 1m1e h GLU 334 Ca -0.37 -0.02 -0.04 0.00 0.08 0.00 0.00 59.36 59.02 1m1e h GLU 334 Cb 1.18 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.32 1m1e h GLU 334 CO 0.98 0.19 0.38 -0.22 -2.18 0.00 0.00 179.01 178.17 1m1e h LYS 335 N 0.30 1.22 -0.22 1.92 3.64 -1.97 -0.22 116.57 121.22 1m1e h LYS 335 Ca 0.32 -0.19 -0.05 0.00 -1.27 0.00 0.00 60.65 59.47 1m1e h LYS 335 Cb 0.47 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1m1e h LYS 335 CO -0.39 0.95 -0.04 1.25 -2.27 0.00 0.00 179.45 178.95 1m1e h LEU 336 N 1.20 0.42 -0.80 5.20 5.85 -1.74 -0.15 115.31 125.28 1m1e h LEU 336 Ca 0.28 -0.35 0.02 0.00 0.84 0.00 0.00 57.88 58.67 1m1e h LEU 336 Cb 0.15 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1m1e h LEU 336 CO -0.03 0.68 0.52 -0.07 -0.34 0.00 0.00 178.44 179.20 1m1e h LEU 337 N 0.16 0.88 -0.00 2.25 3.38 -0.97 0.45 115.31 121.47 1m1e h LEU 337 Ca 0.06 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1m1e h LEU 337 Cb 0.48 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 1m1e h LEU 337 CO 0.02 0.63 0.00 -0.25 0.09 0.00 0.00 178.44 178.92 1m1e h TRP 338 N 1.04 0.00 -0.87 1.13 7.01 -0.94 -0.16 115.95 123.16 1m1e h TRP 338 Ca 0.31 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.28 1m1e h TRP 338 Cb -0.06 -0.00 -0.04 0.00 -2.10 0.00 0.00 29.16 26.96 1m1e h TRP 338 CO -0.02 0.25 0.46 1.15 -2.79 0.00 0.00 178.44 177.49 1m1e h THR 339 N -0.25 1.26 -0.44 2.65 2.02 -0.76 -1.93 112.91 115.46 1m1e h THR 339 Ca 0.00 -0.67 -0.13 0.00 0.77 0.00 0.00 66.41 66.38 1m1e h THR 339 Cb 0.25 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 1m1e h THR 339 CO 0.00 0.30 -0.24 0.74 0.37 0.00 0.00 175.52 176.69 1m1e h THR 340 N 1.23 1.27 0.00 3.16 2.02 -0.86 -2.54 112.91 117.20 1m1e h THR 340 Ca 0.30 -1.40 -0.03 0.00 0.77 0.00 0.00 66.41 66.05 1m1e h THR 340 Cb 0.06 1.22 -0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1m1e h THR 340 CO -0.05 0.48 -0.13 0.77 0.37 0.00 0.00 175.52 176.97 1m1e h SER 341 N 0.78 0.00 0.11 4.18 4.64 -0.64 -1.06 113.55 121.56 1m1e h SER 341 Ca 0.10 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.24 1m1e h SER 341 Cb 0.82 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.91 1m1e h SER 341 CO 0.07 0.13 -0.63 0.03 -0.87 0.00 0.00 176.83 175.56 1m1e h ARG 342 N 0.00 0.50 -0.16 4.77 3.08 -1.02 -0.47 114.38 121.08 1m1e h ARG 342 Ca -0.00 -0.35 -0.02 0.00 0.07 0.00 0.00 59.98 59.67 1m1e h ARG 342 Cb 0.23 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 1m1e h ARG 342 CO 0.02 0.97 0.00 0.28 -1.07 0.00 0.00 179.97 180.17 1m1e h VAL 343 N 0.37 1.25 -0.61 2.04 2.07 -0.92 -2.11 116.25 118.34 1m1e h VAL 343 Ca -0.01 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1m1e h VAL 343 Cb 1.18 1.48 -0.03 0.00 -1.52 0.00 0.00 31.29 32.40 1m1e h VAL 343 CO 0.11 0.25 0.39 -0.07 0.02 0.00 0.00 177.57 178.27 1m1e h LEU 344 N 0.03 0.71 -0.64 2.57 3.38 -1.15 -1.23 115.31 118.98 1m1e h LEU 344 Ca 0.05 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1m1e h LEU 344 Cb 0.37 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1m1e h LEU 344 CO 0.01 0.53 0.20 0.50 0.09 0.00 0.00 178.44 179.77 1m1e h LYS 345 N 0.83 1.00 -0.58 1.13 3.64 -0.84 0.14 116.57 121.90 1m1e h LYS 345 Ca 0.22 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 1m1e h LYS 345 Cb -0.07 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 1m1e h LYS 345 CO -0.05 0.88 0.15 0.28 -2.27 0.00 0.00 179.45 178.44 1m1e h VAL 346 N 0.93 1.25 0.00 2.00 2.07 -0.69 -3.00 116.25 118.81 1m1e h VAL 346 Ca 0.21 -0.89 -0.09 0.00 0.82 0.00 0.00 66.70 66.75 1m1e h VAL 346 Cb 0.30 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1m1e h VAL 346 CO -0.01 0.33 -0.41 -0.07 0.02 0.00 0.00 177.57 177.43 1m1e h LEU 347 N 0.83 0.00 -1.23 2.57 3.38 -0.97 -3.29 115.31 116.61 1m1e h LEU 347 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1m1e h LEU 347 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1m1e h LEU 347 CO 0.00 0.41 0.00 0.77 0.09 0.00 0.00 178.44 179.72 1m1e h SER 348 N 0.00 0.00 0.03 -0.43 4.64 -0.57 -2.03 113.55 115.19 1m1e h SER 348 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1m1e h SER 348 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1m1e h SER 348 CO 0.05 0.00 -0.12 1.33 -0.87 0.00 0.00 176.83 177.22 1m1e n VAL 349 N -2.35 0.00 -3.23 0.95 0.24 -1.24 -4.54 118.33 108.15 1m1e n VAL 349 Ca 0.00 -0.29 -0.39 0.00 -2.04 0.00 0.00 64.34 61.62 1m1e n VAL 349 Cb 0.14 0.85 -0.06 0.00 -1.47 0.00 0.00 33.84 33.29 1m1e n VAL 349 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1m1e h SER 351 N 7.03 0.00 0.07 0.00 4.64 -1.89 -0.41 113.55 122.99 1m1e h SER 351 Ca -0.38 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 60.63 1m1e h SER 351 Cb 1.17 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.23 1m1e h SER 351 CO 0.75 0.00 -1.72 -1.20 -0.87 0.00 0.00 176.83 173.80 1m1e n SER 352 N -3.20 2.01 -0.01 4.97 7.64 -1.26 -4.36 113.62 119.41 1m1e n SER 352 Ca -0.03 0.30 -0.09 0.00 1.01 0.00 0.00 58.87 60.06 1m1e n SER 352 Cb 0.09 -0.90 0.07 0.00 -1.01 0.00 0.00 64.21 62.46 1m1e n SER 352 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1m1e h ASN 353 N -0.40 0.65 -0.13 6.43 2.35 -1.73 -3.28 115.58 119.47 1m1e h ASN 353 Ca -0.40 -0.31 0.04 0.00 -0.55 0.00 0.00 56.30 55.07 1m1e h ASN 353 Cb 1.72 -0.18 -0.07 0.00 0.05 0.00 0.00 38.32 39.84 1m1e h ASN 353 CO -0.05 1.02 -0.43 0.50 -1.65 0.00 0.00 177.43 176.81 1m1e h LYS 354 N 0.48 -0.49 -0.90 0.81 3.64 -1.20 0.16 116.57 119.07 1m1e h LYS 354 Ca 0.03 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.47 1m1e h LYS 354 Cb 0.99 0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.88 1m1e h LYS 354 CO 0.09 -0.32 0.60 -1.35 -2.27 0.00 0.00 179.45 176.19 1m1e h PRO 355 N -0.50 1.13 -0.68 1.90 0.11 -1.76 -1.86 132.00 130.34 1m1e h PRO 355 Ca 0.07 -0.07 -0.08 0.00 0.11 0.00 0.00 66.00 66.03 1m1e h PRO 355 Cb 0.63 -0.26 -0.03 0.00 0.11 0.00 0.00 31.00 31.46 1m1e h PRO 355 CO -0.40 0.75 0.12 0.00 -0.21 0.00 0.00 178.00 178.25 1m1e h ALA 356 N 1.46 0.92 -0.36 -0.75 0.00 -1.38 -0.95 119.26 118.20 1m1e h ALA 356 Ca 0.35 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1m1e h ALA 356 Cb -0.04 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 1m1e h ALA 356 CO -0.10 0.67 0.08 0.82 0.00 0.00 0.00 179.25 180.73 1m1e h ILE 357 N 1.04 1.23 -0.16 0.00 2.04 -0.23 -1.78 117.51 119.66 1m1e h ILE 357 Ca 0.21 -0.78 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 1m1e h ILE 357 Cb 0.43 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 1m1e h ILE 357 CO 0.01 0.26 0.10 0.58 0.00 0.00 0.00 178.15 179.10 1m1e h VAL 358 N 0.44 1.07 0.00 1.67 2.07 -1.17 -0.38 116.25 119.95 1m1e h VAL 358 Ca 0.11 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 1m1e h VAL 358 Cb 0.31 0.90 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1m1e h VAL 358 CO 0.00 0.06 -0.14 -0.33 0.02 0.00 0.00 177.57 177.18 1m1e h GLU 359 N 0.18 0.00 0.00 1.57 4.39 -1.11 -1.48 114.58 118.12 1m1e h GLU 359 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1m1e h GLU 359 Cb 0.02 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.67 1m1e h GLU 359 CO -0.01 0.14 0.00 0.00 -1.16 0.00 0.00 179.01 177.98 1m1e n ALA 360 N -2.37 2.44 -0.66 3.43 0.00 -0.68 -4.86 120.51 117.81 1m1e n ALA 360 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1m1e n ALA 360 Cb 0.23 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.23 1m1e n ALA 360 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1m1e n GLY 361 N 0.95 0.98 0.35 0.00 0.00 -0.56 -4.93 105.19 101.99 1m1e n GLY 361 Ca 0.16 -0.45 -0.03 0.00 0.00 0.00 0.00 46.02 45.71 1m1e n GLY 361 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1m1e h GLY 362 N 0.00 1.23 0.96 -0.02 0.00 -1.16 -2.33 103.07 101.76 1m1e h GLY 362 Ca 0.00 -0.55 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 1m1e h GLY 362 CO 0.00 0.53 -0.11 -0.33 0.00 0.00 0.00 176.54 176.62 1m1e h MET 363 N 1.16 -0.29 -0.67 4.80 2.86 -1.82 -0.87 114.93 120.10 1m1e h MET 363 Ca 0.29 0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.92 1m1e h MET 363 Cb 0.02 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1m1e h MET 363 CO -0.05 -0.19 0.27 1.96 1.06 0.00 0.00 176.91 179.96 1m1e h GLN 364 N -0.30 0.98 -0.30 1.72 7.50 -1.89 -0.90 115.11 121.92 1m1e h GLN 364 Ca -0.02 -0.16 -0.08 0.00 0.50 0.00 0.00 58.65 58.88 1m1e h GLN 364 Cb 0.24 -0.17 -0.01 0.00 0.05 0.00 0.00 27.48 27.60 1m1e h GLN 364 CO 0.03 0.80 -0.14 0.00 -1.50 0.00 0.00 178.83 178.02 1m1e h ALA 365 N 1.33 0.42 -0.42 3.87 0.00 -1.27 -2.87 119.26 120.32 1m1e h ALA 365 Ca 0.23 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1m1e h ALA 365 Cb 0.18 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1m1e h ALA 365 CO -0.02 0.31 -0.02 -0.07 0.00 0.00 0.00 179.25 179.45 1m1e h LEU 366 N 0.38 0.65 -2.14 0.00 3.38 -0.96 -2.66 115.31 113.97 1m1e h LEU 366 Ca 0.07 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1m1e h LEU 366 Cb 0.66 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1m1e h LEU 366 CO 0.04 0.74 -0.06 1.23 0.09 0.00 0.00 178.44 180.48 1m1e h GLY 367 N 0.94 0.00 2.00 0.83 0.00 -0.96 -2.48 103.07 103.40 1m1e h GLY 367 Ca 0.13 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 1m1e h GLY 367 CO 0.02 0.00 -0.00 1.41 0.00 0.00 0.00 176.54 177.96 1m1e h LEU 368 N 0.00 0.00 -2.80 3.11 3.38 -1.27 -3.00 115.31 114.73 1m1e h LEU 368 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1m1e h LEU 368 Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 1m1e h LEU 368 CO 0.01 0.00 0.00 1.41 0.09 0.00 0.00 178.44 179.95 1m1e n HIS 369 N -3.14 0.52 0.65 1.13 8.25 -0.93 -4.62 115.22 117.07 1m1e n HIS 369 Ca -0.02 -0.48 0.07 0.00 -0.26 0.00 0.00 57.72 57.03 1m1e n HIS 369 Cb 0.12 -0.02 0.36 0.00 1.12 0.00 0.00 29.99 31.57 1m1e n HIS 369 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1m1e n LEU 370 N 0.68 0.00 -0.42 2.41 4.77 -1.14 -2.20 117.00 121.11 1m1e n LEU 370 Ca 0.13 0.37 0.06 0.00 -0.03 0.00 0.00 56.01 56.54 1m1e n LEU 370 Cb 0.45 -0.37 0.14 0.00 -2.33 0.00 0.00 43.42 41.32 1m1e n LEU 370 CO 0.09 -0.18 0.61 0.35 -1.33 0.00 0.00 177.39 176.93 1m1e n THR 371 N -1.37 1.57 -2.26 -5.08 -2.24 -1.26 -4.97 114.28 98.67 1m1e n THR 371 Ca 0.06 -1.55 -0.38 0.00 -2.27 0.00 0.00 64.05 59.91 1m1e n THR 371 Cb 0.14 0.11 -0.01 0.00 -2.10 0.00 0.00 70.33 68.47 1m1e n THR 371 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1m1e s ASP 372 N -1.72 6.32 0.52 3.42 2.15 -0.93 -4.92 116.67 121.51 1m1e s ASP 372 Ca 0.25 2.35 0.28 0.00 0.43 0.00 0.00 52.55 55.86 1m1e s ASP 372 Cb 0.19 -2.61 1.43 0.00 -0.30 0.00 0.00 42.92 41.64 1m1e s ASP 372 CO 0.07 -0.82 2.06 -0.65 -0.17 0.00 0.00 175.17 175.66 1m1e h PRO 373 N 2.32 0.00 -6.39 4.34 0.11 -1.95 -3.41 132.00 127.01 1m1e h PRO 373 Ca -0.49 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.05 1m1e h PRO 373 Cb 1.24 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.31 1m1e h PRO 373 CO 0.61 0.12 1.09 0.45 -0.21 0.00 0.00 178.00 180.07 1m1e s SER 374 N -6.10 6.35 0.30 -2.05 0.15 -1.26 -4.88 113.70 106.22 1m1e s SER 374 Ca -0.02 1.17 0.10 0.00 0.70 0.00 0.00 55.95 57.89 1m1e s SER 374 Cb 0.13 -2.54 0.48 0.00 -1.71 0.00 0.00 66.02 62.38 1m1e s SER 374 CO 0.58 -1.36 1.69 1.56 1.20 0.00 0.00 173.24 176.91 1m1e h GLN 375 N 10.74 0.06 -0.27 5.44 4.20 -2.00 -2.01 115.11 131.27 1m1e h GLN 375 Ca -0.30 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.27 1m1e h GLN 375 Cb 1.12 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.89 1m1e h GLN 375 CO 1.05 0.55 -0.28 0.07 -0.67 0.00 0.00 178.83 179.55 1m1e h ARG 376 N 0.05 0.54 -0.17 1.46 0.11 -1.96 -0.45 114.38 113.96 1m1e h ARG 376 Ca -0.00 -0.22 -0.10 0.00 0.10 0.00 0.00 59.98 59.76 1m1e h ARG 376 Cb 0.91 -0.02 -0.00 0.00 1.11 0.00 0.00 29.97 31.97 1m1e h ARG 376 CO 0.07 0.77 -0.28 1.25 0.10 0.00 0.00 179.97 181.87 1m1e h LEU 377 N 0.47 0.54 -0.20 0.08 5.85 -1.91 -2.26 115.31 117.88 1m1e h LEU 377 Ca 0.06 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 1m1e h LEU 377 Cb 0.73 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1m1e h LEU 377 CO 0.06 0.97 0.10 0.58 -0.34 0.00 0.00 178.44 179.81 1m1e h VAL 378 N 0.12 1.12 -0.66 1.05 2.07 -1.25 -1.39 116.25 117.32 1m1e h VAL 378 Ca 0.01 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 1m1e h VAL 378 Cb 0.86 0.99 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 1m1e h VAL 378 CO 0.06 0.12 0.31 -0.61 0.02 0.00 0.00 177.57 177.47 1m1e h GLN 379 N 0.20 0.96 -0.34 1.57 5.75 -1.12 -0.06 115.11 122.07 1m1e h GLN 379 Ca 0.07 -0.15 -0.08 0.00 -0.15 0.00 0.00 58.65 58.34 1m1e h GLN 379 Cb 0.10 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 28.46 1m1e h GLN 379 CO -0.01 0.77 -0.13 -0.91 -2.65 0.00 0.00 178.83 175.90 1m1e h ASN 380 N 0.92 0.58 -0.25 -0.69 2.35 -1.30 -0.48 115.58 116.71 1m1e h ASN 380 Ca 0.23 -0.16 -0.06 0.00 -0.55 0.00 0.00 56.30 55.76 1m1e h ASN 380 Cb 0.13 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.34 1m1e h ASN 380 CO -0.03 0.74 -0.07 0.00 -1.65 0.00 0.00 177.43 176.42 1m1e h LEU 382 N 0.22 0.73 -0.45 0.00 3.38 -0.68 0.17 115.31 118.68 1m1e h LEU 382 Ca 0.06 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1m1e h LEU 382 Cb 0.54 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1m1e h LEU 382 CO 0.03 0.53 0.20 -0.50 0.09 0.00 0.00 178.44 178.78 1m1e h TRP 383 N 0.86 0.67 -0.23 1.13 6.55 -1.08 -1.34 115.95 122.52 1m1e h TRP 383 Ca 0.23 -0.04 -0.01 0.00 0.95 0.00 0.00 58.89 60.02 1m1e h TRP 383 Cb -0.10 -0.20 -0.01 0.00 -0.86 0.00 0.00 29.16 27.99 1m1e h TRP 383 CO -0.03 0.56 0.10 1.15 -1.05 0.00 0.00 178.44 179.17 1m1e h THR 384 N 0.59 1.16 -0.89 1.49 2.02 -1.04 -1.63 112.91 114.60 1m1e h THR 384 Ca 0.15 -0.47 0.08 0.00 0.77 0.00 0.00 66.41 66.94 1m1e h THR 384 Cb 0.16 1.05 -0.07 0.00 -1.74 0.00 0.00 68.15 67.55 1m1e h THR 384 CO -0.02 0.16 0.55 -0.07 0.37 0.00 0.00 175.52 176.51 1m1e h LEU 385 N 0.22 0.84 -0.51 2.58 3.38 -0.52 -1.38 115.31 119.91 1m1e h LEU 385 Ca 0.08 0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.96 1m1e h LEU 385 Cb 0.15 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 1m1e h LEU 385 CO -0.01 0.51 -0.10 -0.09 0.09 0.00 0.00 178.44 178.84 1m1e h ARG 386 N 0.96 0.97 -0.48 1.13 2.43 -0.96 0.13 114.38 118.57 1m1e h ARG 386 Ca 0.40 -0.36 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1m1e h ARG 386 Cb 0.25 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1m1e h ARG 386 CO -0.20 1.03 0.10 -0.91 -1.51 0.00 0.00 179.97 178.49 1m1e h ASN 387 N 0.84 0.67 1.27 -3.80 2.35 -0.72 -2.99 115.58 113.20 1m1e h ASN 387 Ca 0.13 -0.11 -0.13 0.00 -0.55 0.00 0.00 56.30 55.64 1m1e h ASN 387 Cb 0.66 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.84 1m1e h ASN 387 CO 0.05 0.67 -0.76 -0.07 -1.65 0.00 0.00 177.43 175.67 1m1e h LEU 388 N 0.70 0.00 -1.27 1.61 3.38 -1.05 -3.40 115.31 115.29 1m1e h LEU 388 Ca 0.16 0.00 0.25 0.00 0.09 0.00 0.00 57.88 58.38 1m1e h LEU 388 Cb 0.28 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 1m1e h LEU 388 CO -0.00 0.59 0.65 0.77 0.09 0.00 0.00 178.44 180.53 1m1e h SER 389 N 0.00 0.52 0.50 -0.43 4.64 -0.59 -0.84 113.55 117.35 1m1e h SER 389 Ca -0.04 0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1m1e h SER 389 Cb 1.48 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1m1e h SER 389 CO 0.07 0.11 0.00 -0.90 -0.87 0.00 0.00 176.83 175.24 1m1e n ASP 390 N -4.69 0.60 -0.75 4.97 5.75 -1.26 -1.92 116.55 119.25 1m1e n ASP 390 Ca 0.25 0.68 0.07 0.00 -0.01 0.00 0.00 54.79 55.78 1m1e n ASP 390 Cb 0.82 -0.80 0.19 0.00 -1.03 0.00 0.00 41.12 40.30 1m1e n ASP 390 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1m1e n ALA 391 N -1.76 2.46 -0.65 2.12 0.00 -0.32 -4.59 120.51 117.77 1m1e n ALA 391 Ca 0.01 -1.52 0.06 0.00 0.00 0.00 0.00 53.44 51.99 1m1e n ALA 391 Cb 0.17 -0.54 0.10 0.00 0.00 0.00 0.00 19.45 19.18 1m1e n ALA 391 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m1e n ALA 392 N 0.22 2.23 0.68 0.00 0.00 -0.81 -4.75 120.51 118.09 1m1e n ALA 392 Ca 0.15 -1.96 0.07 0.00 0.00 0.00 0.00 53.44 51.70 1m1e n ALA 392 Cb 0.59 -0.28 0.37 0.00 0.00 0.00 0.00 19.45 20.13 1m1e n ALA 392 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1m1e n THR 393 N -0.93 0.64 0.54 0.00 -2.24 -1.26 -2.37 114.28 108.66 1m1e n THR 393 Ca 0.11 0.16 0.07 0.00 -2.27 0.00 0.00 64.05 62.11 1m1e n THR 393 Cb 0.52 -0.91 0.06 0.00 -2.10 0.00 0.00 70.33 67.89 1m1e n THR 393 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1m1e n LYS 394 N -1.32 0.83 -2.28 -0.78 4.76 -1.26 -4.70 118.16 113.42 1m1e n LYS 394 Ca 0.07 -1.29 -0.37 0.00 -2.87 0.00 0.00 58.31 53.85 1m1e n LYS 394 Cb 0.13 -1.25 -0.01 0.00 -1.84 0.00 0.00 35.03 32.06 1m1e n LYS 394 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1m1e s GLN 395 N -1.09 3.72 0.46 1.97 -1.52 -1.00 -5.06 119.66 117.14 1m1e s GLN 395 Ca 0.15 1.73 0.07 0.00 -1.95 0.00 0.00 55.36 55.36 1m1e s GLN 395 Cb 0.11 -2.35 -0.01 0.00 -0.22 0.00 0.00 33.01 30.54 1m1e s GLN 395 CO 0.16 -0.57 0.34 -1.21 -0.25 0.00 0.00 175.29 173.76 1m1e s GLU 396 N -2.78 2.35 -1.23 2.91 0.41 -1.26 -4.68 118.70 114.42 1m1e s GLU 396 Ca 0.65 -1.79 -0.03 0.00 -0.41 0.00 0.00 54.97 53.38 1m1e s GLU 396 Cb -0.27 -2.18 0.00 0.00 -1.78 0.00 0.00 34.13 29.90 1m1e s GLU 396 CO 0.33 -0.34 0.39 0.41 -0.49 0.00 0.00 175.26 175.56 1m1e n GLY 397 N -1.56 -0.25 0.93 -1.39 0.00 -1.26 -4.92 105.19 96.74 1m1e n GLY 397 Ca 0.01 -0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.04 1m1e n GLY 397 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1m1e n MET 398 N -3.15 2.26 -0.08 1.61 2.81 -1.26 -4.62 117.12 114.69 1m1e n MET 398 Ca -0.11 -1.85 -0.10 0.00 -1.81 0.00 0.00 57.70 53.84 1m1e n MET 398 Cb 0.60 -1.47 -0.04 0.00 -0.71 0.00 0.00 33.22 31.60 1m1e n MET 398 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1m1e h GLU 399 N 4.24 -0.33 -0.40 0.03 3.07 -1.98 -0.50 114.58 118.70 1m1e h GLU 399 Ca 0.00 0.02 0.04 0.00 -0.50 0.00 0.00 59.36 58.92 1m1e h GLU 399 Cb 0.91 0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.85 1m1e h GLU 399 CO 0.00 -0.22 0.16 0.78 -1.40 0.00 0.00 179.01 178.33 1m1e h GLY 400 N -0.35 0.53 0.99 -3.84 0.00 -2.00 -0.50 103.07 97.91 1m1e h GLY 400 Ca 0.13 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.36 1m1e h GLY 400 CO -0.50 0.05 0.21 -2.00 0.00 0.00 0.00 176.54 174.31 1m1e h LEU 401 N 0.34 0.40 -0.45 3.11 5.85 -1.79 -2.06 115.31 120.71 1m1e h LEU 401 Ca 0.18 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.89 1m1e h LEU 401 Cb 0.14 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 1m1e h LEU 401 CO -0.16 0.32 0.26 -0.07 -0.34 0.00 0.00 178.44 178.45 1m1e h LEU 402 N 0.45 0.42 -0.52 2.25 4.07 -0.72 -0.93 115.31 120.33 1m1e h LEU 402 Ca 0.12 0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.11 1m1e h LEU 402 Cb -0.02 -0.08 -0.03 0.00 1.08 0.00 0.00 40.66 41.61 1m1e h LEU 402 CO -0.02 0.30 0.32 1.23 -1.08 0.00 0.00 178.44 179.18 1m1e h GLY 403 N 0.53 0.73 1.04 0.83 0.00 -0.85 -2.31 103.07 103.04 1m1e h GLY 403 Ca 0.18 -0.24 -0.08 0.00 0.00 0.00 0.00 47.33 47.19 1m1e h GLY 403 CO -0.09 0.21 0.04 -0.84 0.00 0.00 0.00 176.54 175.86 1m1e h THR 404 N 0.63 1.26 -1.00 4.70 2.02 -0.99 -2.79 112.91 116.73 1m1e h THR 404 Ca 0.21 -1.06 0.02 0.00 0.77 0.00 0.00 66.41 66.35 1m1e h THR 404 Cb 0.01 0.84 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 1m1e h THR 404 CO -0.09 0.38 0.66 -0.07 0.37 0.00 0.00 175.52 176.78 1m1e h LEU 405 N 0.86 1.12 -0.67 2.58 3.38 -0.90 -0.44 115.31 121.23 1m1e h LEU 405 Ca 0.16 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1m1e h LEU 405 Cb 0.49 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.94 1m1e h LEU 405 CO 0.02 0.79 0.28 0.58 0.09 0.00 0.00 178.44 180.20 1m1e h VAL 406 N 1.31 1.24 -0.60 1.22 2.07 -1.26 -2.65 116.25 117.59 1m1e h VAL 406 Ca 0.38 -0.73 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 1m1e h VAL 406 Cb -0.08 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 1m1e h VAL 406 CO -0.10 0.29 0.23 1.56 0.02 0.00 0.00 177.57 179.57 1m1e h GLN 407 N 0.95 0.90 0.00 1.57 4.20 -1.08 -2.30 115.11 119.35 1m1e h GLN 407 Ca 0.23 -0.17 0.00 0.00 0.06 0.00 0.00 58.65 58.77 1m1e h GLN 407 Cb 0.19 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.82 1m1e h GLN 407 CO -0.02 0.77 0.00 -0.07 -0.67 0.00 0.00 178.83 178.84 1m1e h LEU 408 N 0.83 0.00 -1.58 1.46 3.38 -0.76 -1.62 115.31 117.01 1m1e h LEU 408 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1m1e h LEU 408 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1m1e h LEU 408 CO -0.01 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.45 1m1e h LEU 409 N 0.00 0.00 -1.81 1.67 3.38 -1.15 -1.98 115.31 115.42 1m1e h LEU 409 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1m1e h LEU 409 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1m1e h LEU 409 CO 0.00 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1m1e n GLY 410 N -0.43 1.16 3.74 0.83 0.00 -0.61 -4.76 105.19 105.13 1m1e n GLY 410 Ca -0.00 -0.59 -0.32 0.00 0.00 0.00 0.00 46.02 45.11 1m1e n GLY 410 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1m1e s SER 411 N -1.42 4.23 0.00 1.61 0.15 -0.75 -4.94 113.70 112.58 1m1e s SER 411 Ca 0.36 2.01 0.24 0.00 0.70 0.00 0.00 55.95 59.26 1m1e s SER 411 Cb 0.20 -2.55 0.31 0.00 -1.71 0.00 0.00 66.02 62.27 1m1e s SER 411 CO 0.28 -2.22 1.28 0.47 1.20 0.00 0.00 173.24 174.25 1m1e n ASP 412 N -3.35 1.30 -4.59 5.45 8.00 -1.26 -4.82 116.55 117.27 1m1e n ASP 412 Ca 0.11 -1.03 -0.42 0.00 0.71 0.00 0.00 54.79 54.15 1m1e n ASP 412 Cb 0.52 0.40 -0.04 0.00 -0.02 0.00 0.00 41.12 41.98 1m1e n ASP 412 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1m1e s ASP 413 N -2.64 6.60 0.26 -2.24 -1.08 -1.26 -4.95 116.67 111.36 1m1e s ASP 413 Ca 0.18 0.42 -0.02 0.00 -0.52 0.00 0.00 52.55 52.61 1m1e s ASP 413 Cb 0.18 -2.43 0.47 0.00 -1.46 0.00 0.00 42.92 39.68 1m1e s ASP 413 CO 0.62 -0.83 1.81 0.40 0.52 0.00 0.00 175.17 177.68 1m1e h ILE 414 N 5.83 0.87 -0.61 4.11 1.08 -2.00 -1.63 117.51 125.16 1m1e h ILE 414 Ca -0.24 -0.28 -0.07 0.00 -0.39 0.00 0.00 64.86 63.88 1m1e h ILE 414 Cb 1.08 -0.01 -0.03 0.00 -3.07 0.00 0.00 36.82 34.80 1m1e h ILE 414 CO 0.96 0.15 0.10 0.78 -0.69 0.00 0.00 178.15 179.45 1m1e h ASN 415 N 0.81 0.94 -0.07 1.72 -0.26 -1.99 0.20 115.58 116.93 1m1e h ASN 415 Ca 0.44 -0.21 -0.01 0.00 -0.56 0.00 0.00 56.30 55.96 1m1e h ASN 415 Cb 0.47 -0.25 -0.00 0.00 -1.06 0.00 0.00 38.32 37.48 1m1e h ASN 415 CO -0.28 0.94 0.02 0.58 -1.06 0.00 0.00 177.43 177.63 1m1e h VAL 416 N 0.93 1.20 -0.27 2.81 2.07 -1.77 -1.67 116.25 119.55 1m1e h VAL 416 Ca 0.19 -0.60 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1m1e h VAL 416 Cb 0.40 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1m1e h VAL 416 CO 0.01 0.17 0.17 0.58 0.02 0.00 0.00 177.57 178.52 1m1e h VAL 417 N -0.10 1.09 -0.51 2.57 2.07 -1.15 -0.27 116.25 119.96 1m1e h VAL 417 Ca 0.02 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.36 1m1e h VAL 417 Cb 0.25 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.72 1m1e h VAL 417 CO 0.00 0.08 0.33 0.71 0.02 0.00 0.00 177.57 178.71 1m1e h THR 418 N 0.35 1.12 -0.17 2.57 1.35 -0.92 -1.06 112.91 116.15 1m1e h THR 418 Ca 0.10 -0.23 -0.02 0.00 -0.55 0.00 0.00 66.41 65.70 1m1e h THR 418 Cb -0.01 0.39 -0.01 0.00 -1.73 0.00 0.00 68.15 66.79 1m1e h THR 418 CO -0.02 0.12 0.02 0.00 -0.25 0.00 0.00 175.52 175.39 1m1e h ALA 420 N 0.80 1.03 -0.53 0.00 0.00 -0.88 0.12 119.26 119.80 1m1e h ALA 420 Ca 0.05 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1m1e h ALA 420 Cb 0.34 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1m1e h ALA 420 CO 0.01 0.17 0.06 0.00 0.00 0.00 0.00 179.25 179.49 1m1e h ALA 421 N 1.37 0.70 -0.46 0.00 0.00 -1.09 -1.36 119.26 118.42 1m1e h ALA 421 Ca 0.33 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1m1e h ALA 421 Cb 0.17 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1m1e h ALA 421 CO -0.17 0.47 0.10 0.78 0.00 0.00 0.00 179.25 180.42 1m1e h GLY 422 N 0.77 0.80 0.91 0.00 0.00 -0.49 -1.03 103.07 104.04 1m1e h GLY 422 Ca 0.16 -0.52 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 1m1e h GLY 422 CO 0.01 0.48 0.10 -2.22 0.00 0.00 0.00 176.54 174.92 1m1e h ILE 423 N 0.62 1.20 -0.36 2.60 2.04 -0.72 -2.83 117.51 120.06 1m1e h ILE 423 Ca 0.14 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 1m1e h ILE 423 Cb 0.35 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1m1e h ILE 423 CO 0.00 0.22 0.10 -0.07 0.00 0.00 0.00 178.15 178.41 1m1e h LEU 424 N 0.36 0.47 -0.25 1.44 3.38 -1.13 -1.42 115.31 118.16 1m1e h LEU 424 Ca 0.10 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1m1e h LEU 424 Cb 0.24 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1m1e h LEU 424 CO -0.00 0.47 0.16 -1.28 0.09 0.00 0.00 178.44 177.87 1m1e h SER 425 N 0.51 0.30 -0.20 -0.43 0.87 -0.95 -2.11 113.55 111.53 1m1e h SER 425 Ca 0.12 -0.04 -0.19 0.00 -1.23 0.00 0.00 61.79 60.46 1m1e h SER 425 Cb 0.18 -0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1m1e h SER 425 CO -0.01 0.24 -0.61 0.78 -0.53 0.00 0.00 176.83 176.71 1m1e h ASN 426 N 0.32 0.89 0.76 6.23 2.35 -1.25 -3.22 115.58 121.65 1m1e h ASN 426 Ca 0.09 -0.58 -0.01 0.00 -0.55 0.00 0.00 56.30 55.25 1m1e h ASN 426 Cb -0.00 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.11 1m1e h ASN 426 CO -0.02 1.31 -0.05 -0.07 -1.65 0.00 0.00 177.43 176.96 1m1e h LEU 427 N 0.50 0.00 -1.11 1.61 3.38 -1.23 -1.91 115.31 116.55 1m1e h LEU 427 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1m1e h LEU 427 Cb 1.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1m1e h LEU 427 CO 0.13 0.05 0.00 0.35 0.09 0.00 0.00 178.44 179.06 1m1e n THR 428 N -3.20 0.25 -2.41 0.22 -2.24 -0.80 -4.62 114.28 101.48 1m1e n THR 428 Ca -0.00 -0.36 -0.43 0.00 -2.27 0.00 0.00 64.05 60.99 1m1e n THR 428 Cb 0.28 0.33 -0.02 0.00 -2.10 0.00 0.00 70.33 68.82 1m1e n THR 428 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1m1e n ASN 430 N 8.87 -5.18 -4.15 0.00 3.02 -1.26 -4.93 115.26 111.63 1m1e n ASN 430 Ca 0.14 0.33 -0.36 0.00 -0.03 0.00 0.00 54.58 54.67 1m1e n ASN 430 Cb 0.49 -4.12 -0.12 0.00 -0.61 0.00 0.00 39.78 35.41 1m1e n ASN 430 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 1m1e s ASN 431 N -2.38 5.13 0.39 6.41 3.84 -1.26 -4.97 114.94 122.10 1m1e s ASN 431 Ca 0.00 -1.69 0.15 0.00 0.21 0.00 0.00 52.86 51.53 1m1e s ASN 431 Cb 0.00 -1.79 0.82 0.00 -0.55 0.00 0.00 41.25 39.73 1m1e s ASN 431 CO 0.00 -0.42 1.85 0.10 -2.79 0.00 0.00 177.10 175.84 1m1e h TYR 432 N 8.04 0.00 -0.31 0.43 -0.00 -1.92 -1.17 116.97 122.05 1m1e h TYR 432 Ca -0.16 0.00 -0.18 0.00 0.00 0.00 0.00 58.73 58.38 1m1e h TYR 432 Cb 1.05 0.00 -0.00 0.00 0.00 0.00 0.00 36.73 37.78 1m1e h TYR 432 CO 0.58 0.33 -0.52 0.87 -0.00 0.00 0.00 178.16 179.42 1m1e h LYS 433 N 0.00 0.90 -0.49 0.10 1.57 -1.98 -0.46 116.57 116.21 1m1e h LYS 433 Ca -0.00 -0.55 -0.12 0.00 -1.87 0.00 0.00 60.65 58.10 1m1e h LYS 433 Cb 0.63 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 1m1e h LYS 433 CO 0.04 1.19 -0.17 -0.91 -0.57 0.00 0.00 179.45 179.03 1m1e h ASN 434 N 0.70 1.01 -0.43 0.86 2.35 -1.82 -1.05 115.58 117.19 1m1e h ASN 434 Ca 0.02 -0.38 -0.02 0.00 -0.55 0.00 0.00 56.30 55.37 1m1e h ASN 434 Cb 1.13 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 39.20 1m1e h ASN 434 CO 0.12 1.16 0.19 0.11 -1.65 0.00 0.00 177.43 177.36 1m1e h LYS 435 N 0.85 0.62 -0.30 0.81 1.57 -1.13 -1.26 116.57 117.73 1m1e h LYS 435 Ca 0.12 -0.10 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1m1e h LYS 435 Cb 0.75 -0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.92 1m1e h LYS 435 CO 0.06 0.55 0.12 0.52 -0.57 0.00 0.00 179.45 180.13 1m1e h MET 436 N 0.55 0.25 -0.53 3.15 2.86 -0.86 -2.02 114.93 118.33 1m1e h MET 436 Ca 0.15 -0.01 -0.06 0.00 -2.06 0.00 0.00 59.70 57.71 1m1e h MET 436 Cb 0.14 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.73 1m1e h MET 436 CO -0.02 0.16 0.08 0.52 1.06 0.00 0.00 176.91 178.72 1m1e h MET 437 N 0.26 0.87 -0.80 1.72 2.86 -1.05 -0.65 114.93 118.14 1m1e h MET 437 Ca 0.13 -0.24 -0.02 0.00 -2.06 0.00 0.00 59.70 57.52 1m1e h MET 437 Cb 0.09 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 31.61 1m1e h MET 437 CO -0.12 0.85 0.42 0.28 1.06 0.00 0.00 176.91 179.40 1m1e h VAL 438 N 0.75 1.24 -0.22 -2.22 2.07 -1.05 -2.27 116.25 114.56 1m1e h VAL 438 Ca 0.16 -0.63 -0.15 0.00 0.82 0.00 0.00 66.70 66.89 1m1e h VAL 438 Cb 0.41 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1m1e h VAL 438 CO 0.01 0.28 -0.49 0.00 0.02 0.00 0.00 177.57 177.39 1m1e h GLN 440 N 0.48 0.80 -0.74 0.00 4.15 -0.59 -2.48 115.11 116.73 1m1e h GLN 440 Ca 0.02 -0.05 -0.07 0.00 0.77 0.00 0.00 58.65 59.32 1m1e h GLN 440 Cb 1.03 -0.18 -0.04 0.00 0.21 0.00 0.00 27.48 28.50 1m1e h GLN 440 CO 0.10 0.53 0.09 1.33 -1.93 0.00 0.00 178.83 178.95 1m1e n VAL 441 N -4.45 2.23 -1.56 2.39 0.24 -0.90 -4.90 118.33 111.38 1m1e n VAL 441 Ca 0.07 -1.15 -0.01 0.00 -2.04 0.00 0.00 64.34 61.22 1m1e n VAL 441 Cb 0.07 -0.38 -0.00 0.00 -1.47 0.00 0.00 33.84 32.06 1m1e n VAL 441 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1m1e n GLY 442 N 0.26 0.38 0.32 7.63 0.00 -0.93 -4.96 105.19 107.89 1m1e n GLY 442 Ca 0.26 -0.96 0.02 0.00 0.00 0.00 0.00 46.02 45.33 1m1e n GLY 442 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1m1e h GLY 443 N 0.00 0.80 0.90 -0.02 0.00 -0.90 -2.46 103.07 101.40 1m1e h GLY 443 Ca -0.01 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 46.99 1m1e h GLY 443 CO 0.02 0.32 0.01 -2.22 0.00 0.00 0.00 176.54 174.66 1m1e h ILE 444 N 0.76 1.08 -0.46 2.60 1.08 -1.85 0.19 117.51 120.91 1m1e h ILE 444 Ca 0.20 -0.24 0.01 0.00 -0.39 0.00 0.00 64.86 64.43 1m1e h ILE 444 Cb -0.02 1.23 -0.02 0.00 -3.07 0.00 0.00 36.82 34.93 1m1e h ILE 444 CO -0.04 0.07 0.30 -0.08 -0.69 0.00 0.00 178.15 177.70 1m1e h GLU 445 N -0.08 0.58 -0.70 2.37 4.81 -1.87 -0.60 114.58 119.08 1m1e h GLU 445 Ca 0.00 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 1m1e h GLU 445 Cb 0.10 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 1m1e h GLU 445 CO -0.00 0.39 0.35 0.00 -0.73 0.00 0.00 179.01 179.02 1m1e h ALA 446 N 1.18 0.91 -0.47 2.92 0.00 -1.29 -1.08 119.26 121.42 1m1e h ALA 446 Ca 0.17 -0.13 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 1m1e h ALA 446 Cb -0.05 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1m1e h ALA 446 CO -0.05 0.46 -0.21 -0.07 0.00 0.00 0.00 179.25 179.38 1m1e h LEU 447 N 0.98 0.98 -0.55 0.00 3.38 -0.65 -0.83 115.31 118.62 1m1e h LEU 447 Ca 0.24 -0.36 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1m1e h LEU 447 Cb 0.09 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 1m1e h LEU 447 CO -0.03 1.15 0.27 0.58 0.09 0.00 0.00 178.44 180.49 1m1e h VAL 448 N 0.83 1.20 -0.52 1.22 2.07 -0.83 -1.18 116.25 119.05 1m1e h VAL 448 Ca 0.11 -0.55 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1m1e h VAL 448 Cb 0.77 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 1m1e h VAL 448 CO 0.06 0.22 0.30 0.03 0.02 0.00 0.00 177.57 178.20 1m1e h ARG 449 N 0.74 0.71 -0.82 1.57 3.08 -1.02 -0.73 114.38 117.91 1m1e h ARG 449 Ca 0.19 -0.07 0.06 0.00 0.07 0.00 0.00 59.98 60.23 1m1e h ARG 449 Cb 0.11 -0.14 -0.06 0.00 0.08 0.00 0.00 29.97 29.95 1m1e h ARG 449 CO -0.02 0.53 0.50 1.15 -1.07 0.00 0.00 179.97 181.05 1m1e h THR 450 N 0.69 1.02 -0.40 2.04 2.02 -0.76 -0.24 112.91 117.28 1m1e h THR 450 Ca 0.18 -0.31 -0.06 0.00 0.77 0.00 0.00 66.41 66.99 1m1e h THR 450 Cb 0.02 0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 66.45 1m1e h THR 450 CO -0.03 0.16 0.01 0.58 0.37 0.00 0.00 175.52 176.61 1m1e h VAL 451 N 0.90 1.26 0.04 3.16 2.07 -0.73 -1.15 116.25 121.79 1m1e h VAL 451 Ca 0.36 -1.00 0.02 0.00 0.82 0.00 0.00 66.70 66.91 1m1e h VAL 451 Cb 0.19 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.04 1m1e h VAL 451 CO -0.18 0.34 -0.20 -0.07 0.02 0.00 0.00 177.57 177.48 1m1e h LEU 452 N 0.53 -0.56 -1.04 2.57 3.38 -0.33 -2.91 115.31 116.95 1m1e h LEU 452 Ca 0.11 0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 1m1e h LEU 452 Cb 0.47 0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1m1e h LEU 452 CO 0.02 -0.27 -0.23 0.03 0.09 0.00 0.00 178.44 178.08 1m1e h ARG 453 N -0.34 0.41 0.00 1.13 3.08 -1.02 -3.12 114.38 114.53 1m1e h ARG 453 Ca 0.05 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 1m1e h ARG 453 Cb 0.39 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 1m1e h ARG 453 CO -0.16 0.62 -0.13 0.00 -1.07 0.00 0.00 179.97 179.24 1m1e h ALA 454 N 1.39 1.64 -0.93 0.04 0.00 -1.01 -3.47 119.26 116.92 1m1e h ALA 454 Ca 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1m1e h ALA 454 Cb 0.61 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1m1e h ALA 454 CO 0.04 0.16 0.00 0.41 0.00 0.00 0.00 179.25 179.86 1m1e n GLY 455 N -1.06 4.19 1.06 0.00 0.00 -1.18 -1.73 105.19 106.48 1m1e n GLY 455 Ca -0.02 0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.21 1m1e n GLY 455 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1m1e n ASP 456 N 9.07 3.07 -4.56 1.61 5.68 -1.26 -4.83 116.55 125.34 1m1e n ASP 456 Ca 0.00 -2.01 -0.40 0.00 -0.50 0.00 0.00 54.79 51.88 1m1e n ASP 456 Cb 0.00 -0.39 -0.03 0.00 -1.14 0.00 0.00 41.12 39.56 1m1e n ASP 456 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1m1e s ARG 457 N -1.26 3.30 0.54 0.11 0.52 -0.71 -4.85 118.95 116.60 1m1e s ARG 457 Ca 0.38 -0.62 0.35 0.00 -0.52 0.00 0.00 55.73 55.32 1m1e s ARG 457 Cb 0.20 -4.83 1.55 0.00 0.52 0.00 0.00 34.95 32.39 1m1e s ARG 457 CO 0.26 -2.31 2.03 0.93 0.02 0.00 0.00 175.30 176.22 1m1e h GLU 458 N 10.32 0.00 0.00 3.54 5.08 -1.89 -1.58 114.58 130.05 1m1e h GLU 458 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1m1e h GLU 458 Cb 1.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1m1e h GLU 458 CO 1.34 0.00 0.00 0.38 -1.00 0.00 0.00 179.01 179.73 1m1e h ASP 459 N 0.00 0.00 0.00 1.42 2.03 -1.99 -1.93 116.42 115.94 1m1e h ASP 459 Ca 0.00 0.00 -0.27 0.00 -0.73 0.00 0.00 57.03 56.03 1m1e h ASP 459 Cb 0.37 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.83 1m1e h ASP 459 CO 0.00 0.00 -1.88 -0.38 -1.03 0.00 0.00 179.24 175.95 1m1e n ILE 460 N -2.36 1.00 -0.15 4.15 5.41 -0.73 -4.60 119.36 122.08 1m1e n ILE 460 Ca 0.01 -0.21 -0.01 0.00 1.00 0.00 0.00 62.75 63.54 1m1e n ILE 460 Cb 0.22 -1.77 0.22 0.00 -0.71 0.00 0.00 39.64 37.60 1m1e n ILE 460 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1m1e h THR 461 N -0.63 1.21 0.49 1.39 1.35 -1.36 -2.29 112.91 113.07 1m1e h THR 461 Ca -0.41 -0.63 -0.02 0.00 -0.55 0.00 0.00 66.41 64.80 1m1e h THR 461 Cb 1.33 0.47 0.00 0.00 -1.73 0.00 0.00 68.15 68.22 1m1e h THR 461 CO -0.25 0.25 -0.23 -0.08 -0.25 0.00 0.00 175.52 174.96 1m1e h GLU 462 N 0.86 -0.63 -0.15 4.72 4.81 -1.61 0.30 114.58 122.88 1m1e h GLU 462 Ca 0.21 0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.38 1m1e h GLU 462 Cb 0.14 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 1m1e h GLU 462 CO -0.02 -0.41 -0.33 -1.00 -0.73 0.00 0.00 179.01 176.52 1m1e h PRO 463 N -0.68 0.31 -0.58 0.92 0.13 -1.77 -0.99 132.00 129.34 1m1e h PRO 463 Ca -0.07 -0.13 -0.07 0.00 -0.87 0.00 0.00 66.00 64.87 1m1e h PRO 463 Cb 0.51 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.61 1m1e h PRO 463 CO 0.11 0.61 0.10 0.00 -0.23 0.00 0.00 178.00 178.59 1m1e h ALA 464 N 1.39 0.77 -0.47 -0.56 0.00 -1.22 0.12 119.26 119.29 1m1e h ALA 464 Ca 0.03 -0.25 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 1m1e h ALA 464 Cb 0.72 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1m1e h ALA 464 CO 0.05 0.51 -0.06 0.82 0.00 0.00 0.00 179.25 180.58 1m1e h ILE 465 N 0.86 1.27 -0.78 0.00 1.08 -0.20 -1.50 117.51 118.24 1m1e h ILE 465 Ca 0.18 -1.16 -0.03 0.00 -0.39 0.00 0.00 64.86 63.46 1m1e h ILE 465 Cb 0.41 1.06 -0.04 0.00 -3.07 0.00 0.00 36.82 35.18 1m1e h ILE 465 CO 0.01 0.40 0.37 0.00 -0.69 0.00 0.00 178.15 178.25 1m1e h ALA 467 N 1.19 0.41 -0.98 0.00 0.00 -0.76 -0.31 119.26 118.81 1m1e h ALA 467 Ca 0.27 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1m1e h ALA 467 Cb 0.12 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1m1e h ALA 467 CO -0.03 -0.10 0.64 -0.07 0.00 0.00 0.00 179.25 179.69 1m1e h LEU 468 N 0.41 1.13 -0.57 0.00 3.38 -0.83 -0.48 115.31 118.36 1m1e h LEU 468 Ca 0.12 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1m1e h LEU 468 Cb 0.01 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.45 1m1e h LEU 468 CO -0.02 0.83 0.29 -0.09 0.09 0.00 0.00 178.44 179.53 1m1e h ARG 469 N 1.33 0.81 -0.77 1.13 2.43 -0.31 -1.70 114.38 117.31 1m1e h ARG 469 Ca 0.36 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.38 1m1e h ARG 469 Cb -0.14 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.23 1m1e h ARG 469 CO -0.08 0.65 0.32 0.45 -1.51 0.00 0.00 179.97 179.81 1m1e h HIS 470 N 0.77 1.14 0.00 2.20 3.86 -0.37 -2.96 115.15 119.79 1m1e h HIS 470 Ca 0.20 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1m1e h HIS 470 Cb 0.09 -0.35 0.00 0.00 1.06 0.00 0.00 27.41 28.22 1m1e h HIS 470 CO -0.01 0.85 0.00 1.28 0.86 0.00 0.00 177.93 180.91 1m1e n LEU 471 N -4.29 0.62 -1.64 2.43 4.77 -0.25 -3.09 117.00 115.54 1m1e n LEU 471 Ca 0.07 0.60 -0.04 0.00 -0.03 0.00 0.00 56.01 56.61 1m1e n LEU 471 Cb 0.17 -0.45 0.27 0.00 -2.33 0.00 0.00 43.42 41.09 1m1e n LEU 471 CO 0.40 -0.31 0.93 0.35 -1.33 0.00 0.00 177.39 177.43 1m1e n THR 472 N -2.12 2.76 -3.67 -5.08 -2.24 -0.68 -4.46 114.28 98.80 1m1e n THR 472 Ca 0.04 -1.90 -0.15 0.00 -2.27 0.00 0.00 64.05 59.78 1m1e n THR 472 Cb 0.33 -0.34 -0.08 0.00 -2.10 0.00 0.00 70.33 68.14 1m1e n THR 472 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1m1e s SER 473 N -1.50 -0.45 -1.28 3.42 0.15 -1.18 -4.78 113.70 108.08 1m1e s SER 473 Ca 0.51 0.61 -0.10 0.00 0.70 0.00 0.00 55.95 57.67 1m1e s SER 473 Cb 0.42 0.65 -0.00 0.00 -1.71 0.00 0.00 66.02 65.37 1m1e s SER 473 CO 0.10 -0.39 0.61 0.54 1.20 0.00 0.00 173.24 175.30 1m1e n ARG 474 N 1.74 -2.53 -3.54 5.44 1.74 -1.26 -4.90 116.66 113.35 1m1e n ARG 474 Ca -0.18 0.44 -0.09 0.00 -0.77 0.00 0.00 57.85 57.25 1m1e n ARG 474 Cb 0.56 -4.38 -0.03 0.00 -1.02 0.00 0.00 32.46 27.59 1m1e n ARG 474 CO 0.00 0.00 0.00 -3.38 -1.52 0.00 0.00 177.63 172.73 1m1e s HIS 475 N -3.71 -0.35 0.55 -1.55 -3.43 -1.26 -4.79 115.29 100.74 1m1e s HIS 475 Ca 0.21 0.39 0.38 0.00 -0.80 0.00 0.00 55.06 55.24 1m1e s HIS 475 Cb -0.08 0.50 1.56 0.00 -1.43 0.00 0.00 32.58 33.13 1m1e s HIS 475 CO 0.87 -0.45 1.77 0.37 -2.00 0.00 0.00 174.74 175.29 1m1e h GLN 476 N 2.24 0.00 -0.46 -0.38 4.15 -1.95 -0.88 115.11 117.84 1m1e h GLN 476 Ca -0.20 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.22 1m1e h GLN 476 Cb 1.20 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.89 1m1e h GLN 476 CO 0.31 0.00 0.00 0.39 -1.93 0.00 0.00 178.83 177.60 1m1e n GLU 477 N -4.10 3.16 -0.21 1.69 -0.58 -1.26 -4.63 120.64 114.70 1m1e n GLU 477 Ca 0.27 -2.55 -0.04 0.00 -0.42 0.00 0.00 57.16 54.42 1m1e n GLU 477 Cb 1.32 -1.62 0.06 0.00 -0.57 0.00 0.00 31.44 30.63 1m1e n GLU 477 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1m1e h ALA 478 N 2.82 0.80 -0.57 0.62 0.00 -1.37 -1.00 119.26 120.57 1m1e h ALA 478 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1m1e h ALA 478 Cb 1.15 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 1m1e h ALA 478 CO 0.12 0.11 0.35 0.93 0.00 0.00 0.00 179.25 180.77 1m1e h GLU 479 N 0.74 0.76 -0.74 0.00 5.08 -1.82 0.83 114.58 119.43 1m1e h GLU 479 Ca 0.25 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 1m1e h GLU 479 Cb 0.03 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.09 1m1e h GLU 479 CO -0.11 0.54 0.41 1.98 -1.00 0.00 0.00 179.01 180.83 1m1e h MET 480 N 0.76 1.04 -0.62 2.33 4.05 -1.80 -2.28 114.93 118.41 1m1e h MET 480 Ca 0.20 -0.12 -0.03 0.00 -0.28 0.00 0.00 59.70 59.47 1m1e h MET 480 Cb -0.03 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 30.53 1m1e h MET 480 CO -0.04 0.77 0.27 0.00 0.23 0.00 0.00 176.91 178.14 1m1e h ALA 481 N 1.21 0.80 -0.89 0.39 0.00 -0.39 0.15 119.26 120.54 1m1e h ALA 481 Ca 0.26 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.06 1m1e h ALA 481 Cb 0.03 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 1m1e h ALA 481 CO -0.04 0.39 0.56 1.96 0.00 0.00 0.00 179.25 182.13 1m1e h GLN 482 N 0.85 1.03 -0.13 0.00 4.20 -0.50 -1.71 115.11 118.86 1m1e h GLN 482 Ca 0.21 -0.06 -0.20 0.00 0.06 0.00 0.00 58.65 58.66 1m1e h GLN 482 Cb 0.17 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.72 1m1e h GLN 482 CO -0.02 0.68 -0.71 -0.91 -0.67 0.00 0.00 178.83 177.20 1m1e h ASN 483 N 1.06 0.69 -0.98 1.46 2.35 -1.02 -3.25 115.58 115.89 1m1e h ASN 483 Ca 0.37 -0.44 0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1m1e h ASN 483 Cb 0.09 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.21 1m1e h ASN 483 CO -0.15 1.20 0.64 0.00 -1.65 0.00 0.00 177.43 177.47 1m1e h ALA 484 N 0.79 1.24 -0.82 -0.83 0.00 -0.01 -1.80 119.26 117.84 1m1e h ALA 484 Ca -0.03 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 54.89 1m1e h ALA 484 Cb 1.30 -0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.64 1m1e h ALA 484 CO 0.13 0.65 0.53 0.28 0.00 0.00 0.00 179.25 180.85 1m1e h VAL 485 N 1.33 0.98 -0.02 0.00 2.07 -1.37 -1.27 116.25 117.97 1m1e h VAL 485 Ca 0.36 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.49 1m1e h VAL 485 Cb -0.14 0.10 0.01 0.00 -1.52 0.00 0.00 31.29 29.74 1m1e h VAL 485 CO -0.08 0.15 -0.42 -0.09 0.02 0.00 0.00 177.57 177.15 1m1e h ARG 486 N 0.80 0.32 -0.02 1.57 2.43 -1.51 0.10 114.38 118.07 1m1e h ARG 486 Ca 0.37 -0.32 0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1m1e h ARG 486 Cb 0.38 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 1m1e h ARG 486 CO -0.14 1.00 0.02 -0.07 -1.51 0.00 0.00 179.97 179.27 1m1e h LEU 487 N -0.24 0.00 -3.45 3.80 3.38 -0.90 -1.00 115.31 116.90 1m1e h LEU 487 Ca -0.05 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.74 1m1e h LEU 487 Cb 1.13 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.77 1m1e h LEU 487 CO 0.08 0.00 0.23 1.41 0.09 0.00 0.00 178.44 180.25 1m1e n HIS 488 N -4.19 2.18 -3.20 1.13 8.25 -0.52 -4.92 115.22 113.95 1m1e n HIS 488 Ca -0.02 -1.05 -0.23 0.00 -0.26 0.00 0.00 57.72 56.15 1m1e n HIS 488 Cb 0.11 -0.62 0.04 0.00 1.12 0.00 0.00 29.99 30.63 1m1e n HIS 488 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1m1e n TYR 489 N -0.04 -2.10 0.58 4.41 4.02 -0.38 -4.91 117.16 118.74 1m1e n TYR 489 Ca 0.36 0.60 0.12 0.00 -0.01 0.00 0.00 57.90 58.97 1m1e n TYR 489 Cb 1.26 -4.32 0.10 0.00 -0.02 0.00 0.00 39.34 36.37 1m1e n TYR 489 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1m1e n GLY 490 N -1.55 -1.31 0.25 2.72 0.00 0.36 -4.40 105.19 101.25 1m1e n GLY 490 Ca -0.07 -0.32 -0.07 0.00 0.00 0.00 0.00 46.02 45.56 1m1e n GLY 490 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1m1e h LEU 491 N 0.00 0.72 -0.70 0.99 3.38 -1.85 -1.79 115.31 116.05 1m1e h LEU 491 Ca 0.00 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 57.91 1m1e h LEU 491 Cb 0.73 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 1m1e h LEU 491 CO 0.00 0.59 0.46 -0.65 0.09 0.00 0.00 178.44 178.93 1m1e h PRO 492 N 0.79 0.90 -0.18 1.13 0.11 -1.95 -1.97 132.00 130.83 1m1e h PRO 492 Ca 0.21 -0.05 -0.19 0.00 0.11 0.00 0.00 66.00 66.08 1m1e h PRO 492 Cb 0.01 -0.20 -0.00 0.00 0.11 0.00 0.00 31.00 30.92 1m1e h PRO 492 CO -0.04 0.59 -0.63 -0.39 -0.21 0.00 0.00 178.00 177.33 1m1e h VAL 493 N 0.93 1.31 -0.22 3.15 -1.51 -1.78 -2.05 116.25 116.07 1m1e h VAL 493 Ca 0.27 -1.88 -0.00 0.00 -1.23 0.00 0.00 66.70 63.85 1m1e h VAL 493 Cb -0.07 1.84 -0.01 0.00 -2.13 0.00 0.00 31.29 30.92 1m1e h VAL 493 CO -0.07 0.59 0.13 0.58 -1.23 0.00 0.00 177.57 177.57 1m1e h VAL 494 N 0.49 1.10 -0.36 7.19 2.07 -1.12 -2.18 116.25 123.43 1m1e h VAL 494 Ca -0.01 -0.25 -0.06 0.00 0.82 0.00 0.00 66.70 67.20 1m1e h VAL 494 Cb 1.22 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.83 1m1e h VAL 494 CO 0.12 0.09 -0.04 0.58 0.02 0.00 0.00 177.57 178.35 1m1e h VAL 495 N 0.26 1.22 -0.84 2.57 2.07 -1.38 -2.64 116.25 117.50 1m1e h VAL 495 Ca 0.08 -0.93 0.03 0.00 0.82 0.00 0.00 66.70 66.70 1m1e h VAL 495 Cb 0.04 0.99 -0.05 0.00 -1.52 0.00 0.00 31.29 30.76 1m1e h VAL 495 CO -0.01 0.32 0.56 0.50 0.02 0.00 0.00 177.57 178.95 1m1e h LYS 496 N 0.56 1.05 0.00 1.57 3.64 -0.91 -1.92 116.57 120.55 1m1e h LYS 496 Ca 0.11 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1m1e h LYS 496 Cb 0.42 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 1m1e h LYS 496 CO 0.02 0.69 0.00 1.28 -2.27 0.00 0.00 179.45 179.17 1m1e n LEU 497 N -4.43 0.00 0.15 5.20 4.77 -0.86 -1.52 117.00 120.31 1m1e n LEU 497 Ca 0.11 0.42 0.13 0.00 -0.03 0.00 0.00 56.01 56.63 1m1e n LEU 497 Cb 0.08 -0.42 0.41 0.00 -2.33 0.00 0.00 43.42 41.16 1m1e n LEU 497 CO 0.35 -0.34 0.88 -0.07 -1.33 0.00 0.00 177.39 176.88 1m1e h LEU 498 N 0.00 0.00-10.26 2.23 3.38 -1.46 -3.43 115.31 105.78 1m1e h LEU 498 Ca 0.00 0.00 -0.45 0.00 0.09 0.00 0.00 57.88 57.52 1m1e h LEU 498 Cb 0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1m1e h LEU 498 CO 0.00 0.00 -0.36 -1.00 0.09 0.00 0.00 178.44 177.17 1m1e s HIS 499 N -3.22 2.98 0.83 1.13 3.76 -0.57 -4.96 115.29 115.23 1m1e s HIS 499 Ca 0.08 -0.29 -0.13 0.00 -0.15 0.00 0.00 55.06 54.56 1m1e s HIS 499 Cb 0.10 -2.02 0.07 0.00 1.11 0.00 0.00 32.58 31.84 1m1e s HIS 499 CO 0.56 -0.04 1.04 -2.30 -0.85 0.00 0.00 174.74 173.15 1m1e n PRO 500 N -1.60 0.06 -0.07 8.40 -0.02 -1.26 -2.18 135.00 138.33 1m1e n PRO 500 Ca 0.01 0.09 0.01 0.00 -2.02 0.00 0.00 63.50 61.60 1m1e n PRO 500 Cb 0.59 -2.30 0.04 0.00 -0.02 0.00 0.00 33.50 31.81 1m1e n PRO 500 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1m1e n PRO 501 N -2.96 1.30 -1.67 0.52 -0.04 -1.26 -5.05 135.00 125.83 1m1e n PRO 501 Ca 0.12 -0.34 -0.44 0.00 -0.04 0.00 0.00 63.50 62.80 1m1e n PRO 501 Cb 0.51 -1.25 -0.02 0.00 -0.04 0.00 0.00 33.50 32.70 1m1e n PRO 501 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1m1e n SER 502 N -0.13 2.68 -4.95 3.54 7.64 -0.93 -4.99 113.62 116.48 1m1e n SER 502 Ca 0.03 1.16 -0.23 0.00 1.01 0.00 0.00 58.87 60.84 1m1e n SER 502 Cb 0.18 -1.43 0.04 0.00 -1.01 0.00 0.00 64.21 61.98 1m1e n SER 502 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1m1e s HIS 503 N -0.37 2.97 0.22 1.43 3.76 -1.26 -4.87 115.29 117.16 1m1e s HIS 503 Ca 0.64 0.22 -0.09 0.00 -0.15 0.00 0.00 55.06 55.68 1m1e s HIS 503 Cb -0.63 -2.82 0.32 0.00 1.11 0.00 0.00 32.58 30.56 1m1e s HIS 503 CO 0.53 -0.95 1.70 -1.49 -0.85 0.00 0.00 174.74 173.68 1m1e h TRP 504 N -0.10 0.19 -0.59 1.40 4.06 -1.92 -1.65 115.95 117.35 1m1e h TRP 504 Ca -0.44 0.04 0.08 0.00 2.06 0.00 0.00 58.89 60.63 1m1e h TRP 504 Cb 1.29 0.01 -0.06 0.00 -1.00 0.00 0.00 29.16 29.40 1m1e h TRP 504 CO 0.38 -0.05 0.25 -1.35 -3.56 0.00 0.00 178.44 174.11 1m1e h PRO 505 N 0.25 0.45 -0.32 0.49 0.11 -1.90 0.78 132.00 131.86 1m1e h PRO 505 Ca 0.33 -0.03 -0.13 0.00 0.11 0.00 0.00 66.00 66.29 1m1e h PRO 505 Cb 0.51 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1m1e h PRO 505 CO -0.43 0.30 -0.32 1.25 -0.21 0.00 0.00 178.00 178.59 1m1e h LEU 506 N 0.46 0.71 -0.55 2.35 5.85 -1.87 -2.18 115.31 120.09 1m1e h LEU 506 Ca 0.28 -0.29 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1m1e h LEU 506 Cb 0.29 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1m1e h LEU 506 CO -0.25 0.97 0.17 0.40 -0.34 0.00 0.00 178.44 179.40 1m1e h ILE 507 N 0.58 1.23 -0.52 4.05 2.04 -0.48 -0.09 117.51 124.32 1m1e h ILE 507 Ca 0.07 -0.79 -0.01 0.00 1.00 0.00 0.00 64.86 65.13 1m1e h ILE 507 Cb 0.83 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1m1e h ILE 507 CO 0.07 0.29 0.29 0.50 0.00 0.00 0.00 178.15 179.30 1m1e h LYS 508 N 0.76 0.73 -0.60 2.37 3.64 -0.73 -0.29 116.57 122.43 1m1e h LYS 508 Ca 0.18 -0.08 -0.08 0.00 -1.27 0.00 0.00 60.65 59.39 1m1e h LYS 508 Cb 0.28 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.93 1m1e h LYS 508 CO -0.01 0.56 0.06 0.00 -2.27 0.00 0.00 179.45 177.79 1m1e h ALA 509 N 1.13 0.81 -0.62 5.00 0.00 -1.17 -2.20 119.26 122.20 1m1e h ALA 509 Ca 0.18 -0.28 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1m1e h ALA 509 Cb 0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1m1e h ALA 509 CO -0.03 0.60 0.24 1.15 0.00 0.00 0.00 179.25 181.21 1m1e h THR 510 N 0.93 1.23 -0.62 0.00 2.02 -0.65 -0.64 112.91 115.17 1m1e h THR 510 Ca 0.18 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.60 1m1e h THR 510 Cb 0.48 0.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.43 1m1e h THR 510 CO 0.02 0.29 0.34 0.58 0.37 0.00 0.00 175.52 177.11 1m1e h VAL 511 N 0.86 1.20 -0.49 3.16 2.07 -0.95 -0.17 116.25 121.94 1m1e h VAL 511 Ca 0.20 -0.52 -0.05 0.00 0.82 0.00 0.00 66.70 67.15 1m1e h VAL 511 Cb 0.22 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1m1e h VAL 511 CO -0.02 0.22 0.10 1.23 0.02 0.00 0.00 177.57 179.13 1m1e h GLY 512 N 0.85 0.80 0.94 2.17 0.00 -1.02 -1.43 103.07 105.38 1m1e h GLY 512 Ca 0.22 -0.46 -0.09 0.00 0.00 0.00 0.00 47.33 47.00 1m1e h GLY 512 CO -0.03 0.43 -0.17 -2.00 0.00 0.00 0.00 176.54 174.76 1m1e h LEU 513 N 0.72 0.70 -1.24 3.11 5.85 -0.62 -2.70 115.31 121.12 1m1e h LEU 513 Ca 0.16 -0.42 -0.02 0.00 0.84 0.00 0.00 57.88 58.44 1m1e h LEU 513 Cb 0.29 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 1m1e h LEU 513 CO 0.00 0.96 0.29 0.40 -0.34 0.00 0.00 178.44 179.75 1m1e h ILE 514 N 0.43 1.19 -0.62 4.05 2.04 -0.71 0.15 117.51 124.04 1m1e h ILE 514 Ca 0.07 -0.51 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 1m1e h ILE 514 Cb 0.71 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1m1e h ILE 514 CO 0.05 0.22 0.37 -0.09 0.00 0.00 0.00 178.15 178.70 1m1e h ARG 515 N 0.82 0.85 -0.38 2.37 1.12 -1.11 -1.01 114.38 117.03 1m1e h ARG 515 Ca 0.21 -0.08 -0.11 0.00 -1.11 0.00 0.00 59.98 58.88 1m1e h ARG 515 Cb 0.06 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 29.84 1m1e h ARG 515 CO -0.03 0.61 -0.20 -0.91 -3.11 0.00 0.00 179.97 176.33 1m1e h ASN 516 N 0.84 0.84 0.10 -3.80 2.35 -1.03 -3.02 115.58 111.87 1m1e h ASN 516 Ca 0.22 -0.41 -0.03 0.00 -0.55 0.00 0.00 56.30 55.53 1m1e h ASN 516 Cb -0.02 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.11 1m1e h ASN 516 CO -0.04 1.07 -0.13 -0.07 -1.65 0.00 0.00 177.43 176.61 1m1e h LEU 517 N 0.62 0.05 -0.31 1.61 3.38 -0.72 -1.72 115.31 118.21 1m1e h LEU 517 Ca 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1m1e h LEU 517 Cb 0.76 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.50 1m1e h LEU 517 CO 0.06 0.19 0.00 0.00 0.09 0.00 0.00 178.44 178.77 1m1e n ALA 518 N -2.51 1.69 0.28 1.53 0.00 -0.41 -2.18 120.51 118.91 1m1e n ALA 518 Ca -0.02 0.01 0.17 0.00 0.00 0.00 0.00 53.44 53.60 1m1e n ALA 518 Cb 0.21 -1.31 0.73 0.00 0.00 0.00 0.00 19.45 19.08 1m1e n ALA 518 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1m1e h LEU 519 N 0.00 0.00 -8.73 0.00 3.38 -1.35 -3.40 115.31 105.21 1m1e h LEU 519 Ca 0.00 0.00 -0.65 0.00 0.09 0.00 0.00 57.88 57.32 1m1e h LEU 519 Cb 0.32 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 40.91 1m1e h LEU 519 CO 0.00 0.04 -0.03 0.00 0.09 0.00 0.00 178.44 178.54 1m1e h PRO 521 N 8.52 0.23 0.00 0.00 0.11 -1.87 0.11 132.00 139.11 1m1e h PRO 521 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1m1e h PRO 521 Cb 1.12 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1m1e h PRO 521 CO 0.79 0.15 0.00 0.00 -0.21 0.00 0.00 178.00 178.73 1m1e n ALA 522 N -2.59 1.61 0.85 -0.75 0.00 -1.26 -1.95 120.51 116.42 1m1e n ALA 522 Ca 0.16 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.65 1m1e n ALA 522 Cb 0.68 -1.20 -0.13 0.00 0.00 0.00 0.00 19.45 18.81 1m1e n ALA 522 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1m1e n ASN 523 N -1.44 0.86 0.11 0.00 3.02 0.39 -4.60 115.26 113.61 1m1e n ASN 523 Ca 0.04 -0.86 -0.13 0.00 -0.03 0.00 0.00 54.58 53.60 1m1e n ASN 523 Cb 0.13 1.13 -0.06 0.00 -0.61 0.00 0.00 39.78 40.38 1m1e n ASN 523 CO 0.00 0.00 0.00 0.45 -2.62 0.00 0.00 177.26 175.09 1m1e h HIS 524 N 0.00 -0.69 0.01 3.10 3.86 -1.42 -1.70 115.15 118.31 1m1e h HIS 524 Ca 0.00 0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1m1e h HIS 524 Cb 0.56 0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.32 1m1e h HIS 524 CO 0.00 -0.36 -0.00 0.00 0.86 0.00 0.00 177.93 178.43 1m1e h ALA 525 N 0.27 -0.01 -0.45 2.45 0.00 -1.81 -2.26 119.26 117.44 1m1e h ALA 525 Ca 0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1m1e h ALA 525 Cb 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1m1e h ALA 525 CO -0.14 -0.33 0.23 -1.00 0.00 0.00 0.00 179.25 178.01 1m1e h PRO 526 N -0.36 0.62 -0.43 0.00 0.13 -1.81 0.26 132.00 130.41 1m1e h PRO 526 Ca -0.00 -0.06 -0.04 0.00 -0.87 0.00 0.00 66.00 65.02 1m1e h PRO 526 Cb 0.36 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 31.35 1m1e h PRO 526 CO 0.00 0.47 0.10 -0.07 -0.23 0.00 0.00 178.00 178.27 1m1e h LEU 527 N 0.62 0.65 0.07 1.56 3.38 -1.30 -1.70 115.31 118.59 1m1e h LEU 527 Ca 0.16 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1m1e h LEU 527 Cb 0.05 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 1m1e h LEU 527 CO -0.02 0.72 -0.05 -0.09 0.09 0.00 0.00 178.44 179.09 1m1e h ARG 528 N 0.56 -0.11 0.00 1.13 2.43 -0.68 -2.38 114.38 115.32 1m1e h ARG 528 Ca 0.13 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 1m1e h ARG 528 Cb 0.32 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1m1e h ARG 528 CO 0.00 -0.08 0.00 0.93 -1.51 0.00 0.00 179.97 179.32 1m1e h GLU 529 N -0.12 0.00 -0.06 0.20 5.08 -0.31 0.29 114.58 119.66 1m1e h GLU 529 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1m1e h GLU 529 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1m1e h GLU 529 CO 0.00 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.05 1m1e n GLN 530 N -2.95 1.53 -1.13 2.33 1.13 -0.66 -4.92 117.38 112.71 1m1e n GLN 530 Ca -0.03 -0.78 -0.02 0.00 -1.94 0.00 0.00 57.00 54.23 1m1e n GLN 530 Cb 0.06 -1.43 -0.01 0.00 0.11 0.00 0.00 30.24 28.97 1m1e n GLN 530 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1m1e n GLY 531 N 1.10 0.49 0.35 1.08 0.00 0.09 -4.94 105.19 103.36 1m1e n GLY 531 Ca 0.18 -1.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 1m1e n GLY 531 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m1e h ALA 532 N 0.01 1.13 -0.06 4.61 0.00 -1.67 -3.26 119.26 120.01 1m1e h ALA 532 Ca -0.03 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1m1e h ALA 532 Cb 0.19 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1m1e h ALA 532 CO 0.05 0.66 0.04 0.82 0.00 0.00 0.00 179.25 180.81 1m1e h ILE 533 N 1.19 1.06 -0.56 0.00 2.04 -1.84 0.40 117.51 119.81 1m1e h ILE 533 Ca 0.29 -0.17 -0.06 0.00 1.00 0.00 0.00 64.86 65.92 1m1e h ILE 533 Cb 0.12 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1m1e h ILE 533 CO -0.04 0.05 0.11 -0.65 0.00 0.00 0.00 178.15 177.62 1m1e h PRO 534 N 0.03 0.87 -0.42 2.37 0.11 -1.96 -1.43 132.00 131.57 1m1e h PRO 534 Ca 0.02 -0.20 -0.07 0.00 0.11 0.00 0.00 66.00 65.87 1m1e h PRO 534 Cb 0.05 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 1m1e h PRO 534 CO -0.00 0.80 -0.00 -0.09 -0.21 0.00 0.00 178.00 178.49 1m1e h ARG 535 N 0.83 0.75 -0.92 1.05 9.65 -1.56 0.06 114.38 124.24 1m1e h ARG 535 Ca 0.18 -0.24 -0.01 0.00 -1.10 0.00 0.00 59.98 58.80 1m1e h ARG 535 Cb 0.34 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 28.81 1m1e h ARG 535 CO 0.00 0.83 0.53 -0.07 2.80 0.00 0.00 179.97 184.06 1m1e h LEU 536 N 0.58 1.13 -0.46 3.80 3.38 -0.71 -0.85 115.31 122.18 1m1e h LEU 536 Ca 0.12 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.93 1m1e h LEU 536 Cb 0.49 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1m1e h LEU 536 CO 0.02 0.89 -0.00 0.58 0.09 0.00 0.00 178.44 180.02 1m1e h VAL 537 N 1.28 1.26 -0.37 1.22 2.07 -0.99 -0.77 116.25 119.96 1m1e h VAL 537 Ca 0.33 -1.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.77 1m1e h VAL 537 Cb -0.01 1.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.77 1m1e h VAL 537 CO -0.06 0.37 0.18 -0.61 0.02 0.00 0.00 177.57 177.47 1m1e h GLN 538 N 0.67 0.52 -0.71 1.57 4.15 -0.61 -0.50 115.11 120.21 1m1e h GLN 538 Ca 0.13 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.47 1m1e h GLN 538 Cb 0.51 -0.10 -0.03 0.00 0.21 0.00 0.00 27.48 28.07 1m1e h GLN 538 CO 0.02 0.46 0.41 -0.07 -1.93 0.00 0.00 178.83 177.73 1m1e h LEU 539 N 0.46 0.87 -0.18 -2.39 3.38 -1.05 -1.73 115.31 114.67 1m1e h LEU 539 Ca 0.13 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1m1e h LEU 539 Cb 0.11 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1m1e h LEU 539 CO -0.02 0.70 0.10 0.25 0.09 0.00 0.00 178.44 179.56 1m1e h LEU 540 N 0.98 0.22 -0.13 1.67 5.85 -0.83 -1.12 115.31 121.95 1m1e h LEU 540 Ca 0.25 -0.08 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 1m1e h LEU 540 Cb -0.00 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 1m1e h LEU 540 CO -0.04 0.24 0.07 0.58 -0.34 0.00 0.00 178.44 178.94 1m1e h VAL 541 N 0.18 1.11 -0.55 1.05 2.07 -0.91 -0.95 116.25 118.25 1m1e h VAL 541 Ca 0.06 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 67.24 1m1e h VAL 541 Cb 0.07 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1m1e h VAL 541 CO -0.01 0.10 0.22 0.03 0.02 0.00 0.00 177.57 177.92 1m1e h ARG 542 N 0.10 0.82 -0.55 1.57 2.47 -1.28 -1.73 114.38 115.78 1m1e h ARG 542 Ca 0.05 -0.15 -0.06 0.00 -1.26 0.00 0.00 59.98 58.55 1m1e h ARG 542 Cb 0.10 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.26 1m1e h ARG 542 CO -0.01 0.72 0.09 0.00 0.56 0.00 0.00 179.97 181.33 1m1e h ALA 543 N 1.06 1.12 -0.27 0.04 0.00 -1.10 -1.68 119.26 118.43 1m1e h ALA 543 Ca 0.18 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1m1e h ALA 543 Cb 0.21 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1m1e h ALA 543 CO -0.01 0.58 0.01 1.25 0.00 0.00 0.00 179.25 181.07 1m1e h HIS 544 N 0.83 0.51 -0.93 0.00 -0.00 -0.93 -2.10 115.15 112.52 1m1e h HIS 544 Ca 0.17 -0.09 0.01 0.00 -0.00 0.00 0.00 60.37 60.47 1m1e h HIS 544 Cb 0.37 -0.14 -0.05 0.00 -0.00 0.00 0.00 27.41 27.60 1m1e h HIS 544 CO 0.02 0.62 0.62 1.96 -0.00 0.00 0.00 177.93 181.14 1m1e h GLN 545 N 0.26 1.21 -0.41 5.26 4.20 -1.13 -1.38 115.11 123.12 1m1e h GLN 545 Ca 0.08 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1m1e h GLN 545 Cb 0.40 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 27.89 1m1e h GLN 545 CO 0.01 0.80 0.14 -0.44 -0.67 0.00 0.00 178.83 178.67 1m1e h ASP 546 N 1.25 0.54 1.54 1.46 3.45 -1.02 -1.82 116.42 121.81 1m1e h ASP 546 Ca 0.35 -0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.74 1m1e h ASP 546 Cb -0.11 -0.14 0.00 0.00 -0.56 0.00 0.00 39.33 38.52 1m1e h ASP 546 CO -0.08 0.51 0.00 0.71 -1.57 0.00 0.00 179.24 178.81 1m1e h THR 547 N 0.59 0.00 0.00 0.35 1.35 -0.58 -3.24 112.91 111.38 1m1e h THR 547 Ca 0.14 -0.77 -0.29 0.00 -0.55 0.00 0.00 66.41 64.95 1m1e h THR 547 Cb 0.16 1.77 -0.05 0.00 -1.73 0.00 0.00 68.15 68.30 1m1e h THR 547 CO -0.01 0.00 -1.66 1.56 -0.25 0.00 0.00 175.52 175.16 1m1e h GLN 548 N 0.00 0.00 0.00 4.72 1.08 -0.81 -3.52 115.11 116.58 1m1e h GLN 548 Ca 0.00 -0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.10 1m1e h GLN 548 Cb 0.77 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.19 1m1e h GLN 548 CO 0.00 0.53 -0.56 0.07 -0.95 0.00 0.00 178.83 177.92 1m1e h ARG 549 N 0.00 0.00 0.00 1.46 0.11 -1.39 -3.52 114.38 111.04 1m1e h ARG 549 Ca -0.27 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.81 1m1e h ARG 549 Cb 2.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 33.08 1m1e h ARG 549 CO 0.08 0.76 0.00 0.94 0.10 0.00 0.00 179.97 181.85 1m1e n GLN 559 N -4.56 0.00 -3.14 0.08 7.27 -1.26 -5.11 117.38 110.66 1m1e n GLN 559 Ca -0.17 0.00 -0.40 0.00 0.07 0.00 0.00 57.00 56.50 1m1e n GLN 559 Cb 0.48 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 33.07 1m1e n GLN 559 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 1m1e s PHE 560 N -0.25 3.45 -0.27 3.69 0.08 -1.26 -4.03 117.98 119.39 1m1e s PHE 560 Ca 0.00 1.00 0.03 0.00 0.12 0.00 0.00 56.93 58.08 1m1e s PHE 560 Cb 0.00 -2.75 0.07 0.00 -0.57 0.00 0.00 43.02 39.77 1m1e s PHE 560 CO 0.00 -0.04 -0.07 0.08 -0.10 0.00 0.00 175.22 175.09 1m1e s VAL 561 N 1.38 2.11 -2.01 -0.44 1.01 -0.32 -4.61 120.40 117.52 1m1e s VAL 561 Ca 0.30 -1.72 0.00 0.00 0.00 0.00 0.00 61.98 60.56 1m1e s VAL 561 Cb -0.16 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.92 1m1e s VAL 561 CO 0.12 -0.15 0.00 -0.62 0.00 0.00 0.00 175.10 174.46 1m1e n GLU 562 N 4.43 -1.57 -0.48 2.72 1.02 -1.26 -1.18 120.64 124.32 1m1e n GLU 562 Ca -0.10 1.13 0.00 0.00 -0.02 0.00 0.00 57.16 58.16 1m1e n GLU 562 Cb 0.42 -5.65 0.00 0.00 -0.02 0.00 0.00 31.44 26.19 1m1e n GLU 562 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1m1e n GLY 563 N -0.70 0.75 3.12 0.62 0.00 -1.26 -4.69 105.19 103.03 1m1e n GLY 563 Ca -0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.50 1m1e n GLY 563 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1m1e s VAL 564 N -2.33 1.64 0.17 1.61 1.01 -0.32 -5.05 120.40 117.13 1m1e s VAL 564 Ca 0.00 -0.77 -0.27 0.00 0.00 0.00 0.00 61.98 60.94 1m1e s VAL 564 Cb 0.00 -1.46 -0.08 0.00 0.00 0.00 0.00 36.38 34.85 1m1e s VAL 564 CO 0.00 0.47 0.84 -0.13 0.00 0.00 0.00 175.10 176.28 1m1e s ARG 565 N 0.59 4.65 0.35 2.72 0.52 -1.26 -1.18 118.95 125.35 1m1e s ARG 565 Ca -0.15 1.27 0.26 0.00 -0.52 0.00 0.00 55.73 56.59 1m1e s ARG 565 Cb -0.17 -3.29 1.22 0.00 0.52 0.00 0.00 34.95 33.24 1m1e s ARG 565 CO 0.05 0.49 1.78 0.52 0.02 0.00 0.00 175.30 178.16 1m1e h MET 566 N 4.55 0.00 -0.01 3.54 2.86 -1.90 -0.70 114.93 123.26 1m1e h MET 566 Ca -0.46 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.08 1m1e h MET 566 Cb 1.20 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.85 1m1e h MET 566 CO 0.68 0.00 -0.48 0.93 1.06 0.00 0.00 176.91 179.09 1m1e h GLU 567 N 0.00 0.04 -0.31 1.72 3.07 -1.92 -1.09 114.58 116.09 1m1e h GLU 567 Ca 0.00 -0.02 -0.11 0.00 -0.50 0.00 0.00 59.36 58.73 1m1e h GLU 567 Cb 0.21 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 1m1e h GLU 567 CO 0.00 0.51 -0.28 0.93 -1.40 0.00 0.00 179.01 178.77 1m1e h GLU 568 N 0.03 0.63 -0.24 2.33 5.08 -1.52 -1.05 114.58 119.85 1m1e h GLU 568 Ca -0.00 -0.27 -0.17 0.00 -1.00 0.00 0.00 59.36 57.92 1m1e h GLU 568 Cb 0.86 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1m1e h GLU 568 CO 0.06 0.85 -0.51 0.82 -1.00 0.00 0.00 179.01 179.23 1m1e h ILE 569 N 0.54 1.30 -0.04 3.13 1.08 -1.44 -0.16 117.51 121.92 1m1e h ILE 569 Ca 0.07 -1.71 0.01 0.00 -0.39 0.00 0.00 64.86 62.84 1m1e h ILE 569 Cb 0.76 1.77 -0.01 0.00 -3.07 0.00 0.00 36.82 36.27 1m1e h ILE 569 CO 0.06 0.55 -0.02 0.58 -0.69 0.00 0.00 178.15 178.63 1m1e h VAL 570 N 0.50 0.95 -0.35 1.67 2.07 -1.04 -0.15 116.25 119.89 1m1e h VAL 570 Ca 0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.51 1m1e h VAL 570 Cb 1.12 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1m1e h VAL 570 CO 0.11 0.00 0.15 -0.08 0.02 0.00 0.00 177.57 177.77 1m1e h GLU 571 N -0.01 0.52 -0.21 1.57 4.81 -1.18 -1.79 114.58 118.29 1m1e h GLU 571 Ca 0.02 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1m1e h GLU 571 Cb 0.04 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1m1e h GLU 571 CO -0.05 0.50 0.10 0.78 -0.73 0.00 0.00 179.01 179.61 1m1e h GLY 572 N 0.43 0.33 0.90 1.92 0.00 -0.81 -0.53 103.07 105.31 1m1e h GLY 572 Ca 0.12 -0.16 -0.05 0.00 0.00 0.00 0.00 47.33 47.24 1m1e h GLY 572 CO -0.01 0.15 0.02 0.00 0.00 0.00 0.00 176.54 176.70 1m1e h THR 574 N 0.36 1.20 -0.54 0.00 2.02 -1.33 -0.88 112.91 113.75 1m1e h THR 574 Ca 0.09 -0.77 -0.05 0.00 0.77 0.00 0.00 66.41 66.45 1m1e h THR 574 Cb 0.41 0.84 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1m1e h THR 574 CO 0.01 0.27 0.13 1.23 0.37 0.00 0.00 175.52 177.53 1m1e h GLY 575 N 0.87 0.93 1.12 2.16 0.00 -0.75 -0.31 103.07 107.09 1m1e h GLY 575 Ca 0.13 -0.59 -0.13 0.00 0.00 0.00 0.00 47.33 46.74 1m1e h GLY 575 CO 0.00 0.55 -0.20 0.00 0.00 0.00 0.00 176.54 176.89 1m1e h ALA 576 N 1.01 0.70 -0.21 3.60 0.00 -0.72 -2.68 119.26 120.97 1m1e h ALA 576 Ca 0.17 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 1m1e h ALA 576 Cb 0.35 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1m1e h ALA 576 CO 0.00 0.68 -0.16 -0.07 0.00 0.00 0.00 179.25 179.70 1m1e h LEU 577 N 0.87 0.34 -0.44 0.00 3.38 -1.00 -0.91 115.31 117.54 1m1e h LEU 577 Ca 0.12 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.02 1m1e h LEU 577 Cb 0.78 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1m1e h LEU 577 CO 0.06 0.52 0.25 -0.74 0.09 0.00 0.00 178.44 178.63 1m1e h HIS 578 N 0.33 0.47 -0.12 1.13 2.76 -0.73 0.70 115.15 119.69 1m1e h HIS 578 Ca 0.06 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.14 1m1e h HIS 578 Cb 0.47 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 29.28 1m1e h HIS 578 CO 0.01 0.27 -0.33 0.82 -1.30 0.00 0.00 177.93 177.40 1m1e h ILE 579 N 0.51 1.38 -0.20 6.26 1.08 -1.19 -3.12 117.51 122.23 1m1e h ILE 579 Ca 0.18 -1.63 0.02 0.00 -0.39 0.00 0.00 64.86 63.04 1m1e h ILE 579 Cb 0.02 2.11 -0.01 0.00 -3.07 0.00 0.00 36.82 35.87 1m1e h ILE 579 CO -0.09 0.48 0.13 -0.07 -0.69 0.00 0.00 178.15 177.92 1m1e h LEU 580 N 0.02 0.14 0.00 1.44 3.38 -1.02 -1.33 115.31 117.94 1m1e h LEU 580 Ca -0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1m1e h LEU 580 Cb 0.94 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.66 1m1e h LEU 580 CO 0.07 0.10 0.00 0.00 0.09 0.00 0.00 178.44 178.70 1m1e n ALA 581 N -2.53 1.68 0.29 1.53 0.00 0.23 -2.14 120.51 119.56 1m1e n ALA 581 Ca 0.01 -0.05 0.18 0.00 0.00 0.00 0.00 53.44 53.58 1m1e n ALA 581 Cb 0.16 -1.15 0.75 0.00 0.00 0.00 0.00 19.45 19.20 1m1e n ALA 581 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m1e h ARG 582 N 0.00 0.00 -5.47 0.00 3.08 -1.37 -3.43 114.38 107.20 1m1e h ARG 582 Ca 0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 1m1e h ARG 582 Cb 0.06 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.00 1m1e h ARG 582 CO 0.00 0.00 -0.35 0.34 -1.07 0.00 0.00 179.97 178.89 1m1e s ASP 583 N -5.51 6.40 0.25 7.04 -1.08 -0.91 -5.00 116.67 117.86 1m1e s ASP 583 Ca 0.00 0.47 -0.04 0.00 -0.52 0.00 0.00 52.55 52.46 1m1e s ASP 583 Cb 0.09 -2.16 0.35 0.00 -1.46 0.00 0.00 42.92 39.74 1m1e s ASP 583 CO 0.51 0.13 1.87 1.62 0.52 0.00 0.00 175.17 179.81 1m1e h VAL 584 N 4.64 1.07 -0.24 1.11 3.04 -1.89 -1.15 116.25 122.83 1m1e h VAL 584 Ca -0.42 -0.37 -0.10 0.00 -1.01 0.00 0.00 66.70 64.80 1m1e h VAL 584 Cb 1.16 -0.09 -0.01 0.00 -2.01 0.00 0.00 31.29 30.34 1m1e h VAL 584 CO 0.75 0.19 -0.30 0.45 -1.01 0.00 0.00 177.57 177.66 1m1e h HIS 585 N 1.07 0.54 -0.42 3.17 3.86 -1.95 -2.72 115.15 118.70 1m1e h HIS 585 Ca 0.39 -0.13 -0.10 0.00 -1.16 0.00 0.00 60.37 59.38 1m1e h HIS 585 Cb 0.15 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.47 1m1e h HIS 585 CO -0.02 0.73 -0.16 -0.91 0.86 0.00 0.00 177.93 178.43 1m1e h ASN 586 N 0.41 0.78 -0.96 2.45 2.35 -1.61 -2.80 115.58 116.21 1m1e h ASN 586 Ca 0.05 -0.25 0.01 0.00 -0.55 0.00 0.00 56.30 55.57 1m1e h ASN 586 Cb 0.73 -0.21 -0.05 0.00 0.05 0.00 0.00 38.32 38.84 1m1e h ASN 586 CO 0.06 0.94 0.63 0.03 -1.65 0.00 0.00 177.43 177.44 1m1e h ARG 587 N 0.70 1.24 -0.45 0.81 3.08 -0.94 0.32 114.38 119.14 1m1e h ARG 587 Ca 0.11 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1m1e h ARG 587 Cb 0.65 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 1m1e h ARG 587 CO 0.05 0.82 0.18 0.82 -1.07 0.00 0.00 179.97 180.77 1m1e h ILE 588 N 1.28 1.20 -0.10 2.04 2.04 -1.27 0.11 117.51 122.82 1m1e h ILE 588 Ca 0.36 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.59 1m1e h ILE 588 Cb -0.12 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1m1e h ILE 588 CO -0.08 0.23 0.03 0.58 0.00 0.00 0.00 178.15 178.90 1m1e h VAL 589 N 0.58 1.18 -0.35 1.67 2.07 -1.18 0.46 116.25 120.68 1m1e h VAL 589 Ca 0.15 -0.56 0.04 0.00 0.82 0.00 0.00 66.70 67.15 1m1e h VAL 589 Cb 0.18 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.29 1m1e h VAL 589 CO -0.01 0.16 0.11 0.40 0.02 0.00 0.00 177.57 178.25 1m1e h ILE 590 N -0.04 0.89 -0.40 4.57 2.04 -0.82 -2.27 117.51 121.48 1m1e h ILE 590 Ca 0.03 -0.09 -0.12 0.00 1.00 0.00 0.00 64.86 65.69 1m1e h ILE 590 Cb 0.23 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1m1e h ILE 590 CO -0.00 0.05 -0.22 -0.09 0.00 0.00 0.00 178.15 177.88 1m1e h ARG 591 N 0.25 0.79 0.00 2.37 2.43 -0.70 -2.88 114.38 116.65 1m1e h ARG 591 Ca 0.16 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 1m1e h ARG 591 Cb 0.14 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1m1e h ARG 591 CO -0.17 0.94 0.00 0.78 -1.51 0.00 0.00 179.97 180.01 1m1e h GLY 592 N 0.96 0.00 -1.49 2.80 0.00 -0.44 -1.51 103.07 103.38 1m1e h GLY 592 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.42 1m1e h GLY 592 CO 0.06 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.64 1m1e n LEU 593 N -2.32 2.17 -3.71 3.11 4.77 -0.90 -4.91 117.00 115.21 1m1e n LEU 593 Ca 0.01 -1.09 -0.26 0.00 -0.03 0.00 0.00 56.01 54.63 1m1e n LEU 593 Cb 0.17 -0.34 0.03 0.00 -2.33 0.00 0.00 43.42 40.95 1m1e n LEU 593 CO 0.17 0.43 -0.10 -3.20 -1.33 0.00 0.00 177.39 173.36 1m1e n ASN 594 N 0.39 -3.37 0.02 -1.43 5.15 -0.57 -4.93 115.26 110.52 1m1e n ASN 594 Ca 0.11 -0.94 0.11 0.00 -0.60 0.00 0.00 54.58 53.26 1m1e n ASN 594 Cb 0.40 -3.63 -0.12 0.00 -0.53 0.00 0.00 39.78 35.90 1m1e n ASN 594 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1m1e n THR 595 N -4.17 0.15 -0.23 -0.44 -2.24 -1.25 -4.53 114.28 101.57 1m1e n THR 595 Ca -0.19 -0.50 0.01 0.00 -2.27 0.00 0.00 64.05 61.11 1m1e n THR 595 Cb 0.63 -0.06 0.13 0.00 -2.10 0.00 0.00 70.33 68.93 1m1e n THR 595 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1m1e h ILE 596 N 0.00 0.78 -0.98 2.28 2.04 -1.86 -0.66 117.51 119.10 1m1e h ILE 596 Ca 0.00 -0.17 0.05 0.00 1.00 0.00 0.00 64.86 65.74 1m1e h ILE 596 Cb 0.99 0.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.26 1m1e h ILE 596 CO 0.00 0.09 0.64 -0.65 0.00 0.00 0.00 178.15 178.23 1m1e h PRO 597 N 0.48 1.17 -0.01 2.37 0.11 -1.97 -1.15 132.00 133.01 1m1e h PRO 597 Ca 0.34 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.38 1m1e h PRO 597 Cb 0.42 -0.26 -0.00 0.00 0.11 0.00 0.00 31.00 31.27 1m1e h PRO 597 CO -0.31 0.77 -0.00 1.25 -0.21 0.00 0.00 178.00 179.50 1m1e h LEU 598 N 1.21 0.02 -0.93 2.35 6.46 -1.55 -2.44 115.31 120.42 1m1e h LEU 598 Ca 0.40 -0.33 0.09 0.00 -0.12 0.00 0.00 57.88 57.93 1m1e h LEU 598 Cb 0.06 -0.01 -0.07 0.00 -0.73 0.00 0.00 40.66 39.91 1m1e h LEU 598 CO -0.14 0.34 0.58 -0.26 -0.62 0.00 0.00 178.44 178.34 1m1e h PHE 599 N -0.30 1.05 -0.76 1.25 0.04 -0.78 -0.69 116.94 116.75 1m1e h PHE 599 Ca 0.00 0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 1m1e h PHE 599 Cb 0.33 -0.34 -0.03 0.00 2.20 0.00 0.00 35.95 38.11 1m1e h PHE 599 CO 0.04 0.47 0.31 0.28 -0.60 0.00 0.00 178.31 178.80 1m1e h VAL 600 N 0.97 1.26 -0.23 -0.55 2.07 -1.15 -2.55 116.25 116.07 1m1e h VAL 600 Ca 0.44 -0.80 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 1m1e h VAL 600 Cb 0.34 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1m1e h VAL 600 CO -0.23 0.33 -0.18 1.56 0.02 0.00 0.00 177.57 179.07 1m1e h GLN 601 N 1.10 0.41 0.00 1.57 1.08 -0.68 -2.00 115.11 116.59 1m1e h GLN 601 Ca 0.26 -0.13 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 1m1e h GLN 601 Cb 0.21 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 1m1e h GLN 601 CO -0.02 0.58 0.00 -0.07 -0.95 0.00 0.00 178.83 178.37 1m1e h LEU 602 N 0.37 0.00 -1.85 1.46 3.38 -0.78 -1.51 115.31 116.39 1m1e h LEU 602 Ca 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1m1e h LEU 602 Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 1m1e h LEU 602 CO 0.04 0.00 -0.14 -0.07 0.09 0.00 0.00 178.44 178.36 1m1e h LEU 603 N 0.00 0.00 -0.44 1.67 4.07 -1.22 -1.70 115.31 117.68 1m1e h LEU 603 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1m1e h LEU 603 Cb 0.26 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.00 1m1e h LEU 603 CO 0.00 0.14 -0.01 -1.22 -1.08 0.00 0.00 178.44 176.26 1m1e n TYR 604 N -3.97 0.00 -1.74 1.13 4.02 -0.57 -4.87 117.16 111.16 1m1e n TYR 604 Ca -0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.47 1m1e n TYR 604 Cb 0.22 -0.02 0.03 0.00 -0.02 0.00 0.00 39.34 39.55 1m1e n TYR 604 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 1m1e n SER 605 N -0.49 2.84 0.02 7.72 2.88 -0.64 -4.89 113.62 121.07 1m1e n SER 605 Ca 0.21 1.04 0.13 0.00 -1.33 0.00 0.00 58.87 58.93 1m1e n SER 605 Cb 0.23 -1.57 0.51 0.00 -0.75 0.00 0.00 64.21 62.64 1m1e n SER 605 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1m1e n PRO 606 N -0.56 0.05 -2.97 -1.46 -0.04 -1.26 -4.73 135.00 124.02 1m1e n PRO 606 Ca 0.08 0.03 -0.42 0.00 -0.04 0.00 0.00 63.50 63.15 1m1e n PRO 606 Cb 0.43 -1.55 -0.05 0.00 -0.04 0.00 0.00 33.50 32.29 1m1e n PRO 606 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1m1e s ILE 607 N -3.02 4.80 0.22 0.52 -1.09 -1.26 -4.96 121.20 116.41 1m1e s ILE 607 Ca 0.13 1.12 -0.08 0.00 -2.23 0.00 0.00 60.65 59.59 1m1e s ILE 607 Cb 0.18 -4.13 0.17 0.00 -1.58 0.00 0.00 42.46 37.09 1m1e s ILE 607 CO 0.57 -0.25 1.79 -0.08 -1.23 0.00 0.00 174.94 175.74 1m1e h GLU 608 N 8.16 0.62 0.00 2.79 4.81 -2.00 -1.64 114.58 127.31 1m1e h GLU 608 Ca -0.25 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.90 1m1e h GLU 608 Cb 1.10 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.33 1m1e h GLU 608 CO 0.88 0.41 -0.22 -0.91 -0.73 0.00 0.00 179.01 178.43 1m1e h ASN 609 N 0.64 0.00 -0.05 1.04 2.35 -1.98 -1.43 115.58 116.14 1m1e h ASN 609 Ca 0.33 0.00 -0.20 0.00 -0.55 0.00 0.00 56.30 55.88 1m1e h ASN 609 Cb 0.31 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.69 1m1e h ASN 609 CO -0.24 0.22 -0.76 0.40 -1.65 0.00 0.00 177.43 175.40 1m1e h ILE 610 N 0.00 1.34 -1.00 2.81 2.04 -1.72 -2.71 117.51 118.27 1m1e h ILE 610 Ca -0.00 -2.06 0.04 0.00 1.00 0.00 0.00 64.86 63.84 1m1e h ILE 610 Cb 0.54 2.32 -0.06 0.00 -0.74 0.00 0.00 36.82 38.88 1m1e h ILE 610 CO 0.03 0.63 0.65 1.56 0.00 0.00 0.00 178.15 181.02 1m1e h GLN 611 N 0.23 1.20 0.01 2.37 4.20 -0.96 -1.33 115.11 120.84 1m1e h GLN 611 Ca -0.08 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.56 1m1e h GLN 611 Cb 1.42 -0.27 0.00 0.00 0.30 0.00 0.00 27.48 28.93 1m1e h GLN 611 CO 0.15 0.80 -0.01 -0.09 -0.67 0.00 0.00 178.83 179.01 1m1e h ARG 612 N 1.24 -0.01 0.00 1.46 2.43 -1.20 -1.32 114.38 116.97 1m1e h ARG 612 Ca 0.41 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.47 1m1e h ARG 612 Cb 0.04 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1m1e h ARG 612 CO -0.14 0.14 -0.52 -0.39 -1.51 0.00 0.00 179.97 177.55 1m1e h VAL 613 N -0.16 1.15 -0.09 0.20 -1.51 -1.32 0.48 116.25 115.00 1m1e h VAL 613 Ca -0.00 -1.94 -0.04 0.00 -1.23 0.00 0.00 66.70 63.48 1m1e h VAL 613 Cb 0.16 2.12 -0.00 0.00 -2.13 0.00 0.00 31.29 31.43 1m1e h VAL 613 CO 0.00 0.51 -0.11 0.00 -1.23 0.00 0.00 177.57 176.74 1m1e h ALA 614 N 1.48 0.14 -0.58 5.19 0.00 -1.21 0.09 119.26 124.37 1m1e h ALA 614 Ca -0.01 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 1m1e h ALA 614 Cb 1.08 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1m1e h ALA 614 CO 0.07 -0.00 0.15 0.00 0.00 0.00 0.00 179.25 179.46 1m1e h ALA 615 N 0.56 1.16 0.10 0.00 0.00 -1.21 -2.17 119.26 117.70 1m1e h ALA 615 Ca 0.01 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1m1e h ALA 615 Cb 0.65 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1m1e h ALA 615 CO 0.03 0.57 -0.05 0.78 0.00 0.00 0.00 179.25 180.58 1m1e h GLY 616 N 1.00 -0.14 1.48 0.00 0.00 -0.70 -0.22 103.07 104.49 1m1e h GLY 616 Ca 0.19 0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.49 1m1e h GLY 616 CO -0.00 -0.05 -0.08 -0.24 0.00 0.00 0.00 176.54 176.17 1m1e h VAL 617 N -0.18 1.24 -0.58 4.60 3.04 -0.88 -1.71 116.25 121.77 1m1e h VAL 617 Ca -0.01 -1.03 -0.06 0.00 -1.01 0.00 0.00 66.70 64.59 1m1e h VAL 617 Cb 0.14 1.05 -0.03 0.00 -2.01 0.00 0.00 31.29 30.44 1m1e h VAL 617 CO 0.02 0.35 0.13 -0.07 -1.01 0.00 0.00 177.57 176.99 1m1e h LEU 618 N 0.58 0.85 -0.18 3.16 3.38 -1.23 -1.03 115.31 120.84 1m1e h LEU 618 Ca 0.11 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1m1e h LEU 618 Cb 0.49 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1m1e h LEU 618 CO 0.03 0.84 0.09 0.00 0.09 0.00 0.00 178.44 179.48 1m1e h GLU 620 N 0.16 0.77 -0.29 0.00 4.39 -1.09 -2.54 114.58 115.98 1m1e h GLU 620 Ca 0.06 -0.12 -0.05 0.00 0.34 0.00 0.00 59.36 59.59 1m1e h GLU 620 Cb 0.12 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 1m1e h GLU 620 CO -0.01 0.64 -0.05 -0.07 -1.16 0.00 0.00 179.01 178.36 1m1e h LEU 621 N 0.72 0.43 0.00 1.33 3.38 -1.01 -2.51 115.31 117.66 1m1e h LEU 621 Ca 0.18 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1m1e h LEU 621 Cb 0.12 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.76 1m1e h LEU 621 CO -0.02 0.54 0.00 0.00 0.09 0.00 0.00 178.44 179.05 1m1e n ALA 622 N -2.48 1.67 0.48 1.53 0.00 0.29 -2.57 120.51 119.42 1m1e n ALA 622 Ca 0.01 -0.05 0.10 0.00 0.00 0.00 0.00 53.44 53.49 1m1e n ALA 622 Cb 0.27 -1.23 0.40 0.00 0.00 0.00 0.00 19.45 18.88 1m1e n ALA 622 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1m1e n GLN 623 N -1.50 0.09 -3.83 0.00 10.64 -0.94 -4.41 117.38 117.43 1m1e n GLN 623 Ca 0.04 0.31 -0.36 0.00 -1.83 0.00 0.00 57.00 55.16 1m1e n GLN 623 Cb 0.17 -1.67 -0.11 0.00 -0.86 0.00 0.00 30.24 27.77 1m1e n GLN 623 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1m1e s ASP 624 N -3.59 5.60 0.22 2.61 1.01 -1.06 -5.02 116.67 116.44 1m1e s ASP 624 Ca 0.06 -0.01 -0.17 0.00 0.71 0.00 0.00 52.55 53.14 1m1e s ASP 624 Cb 0.10 -1.99 0.22 0.00 1.01 0.00 0.00 42.92 42.26 1m1e s ASP 624 CO 0.34 0.07 1.58 0.11 0.21 0.00 0.00 175.17 177.48 1m1e h LYS 625 N 7.50 -0.07 -0.53 8.23 1.79 -1.88 -1.09 116.57 130.52 1m1e h LYS 625 Ca -0.37 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.09 1m1e h LYS 625 Cb 1.17 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 31.81 1m1e h LYS 625 CO 0.64 -0.04 0.27 0.93 -1.08 0.00 0.00 179.45 180.16 1m1e h GLU 626 N -0.07 0.75 -0.62 3.15 5.08 -1.94 -2.46 114.58 118.49 1m1e h GLU 626 Ca 0.31 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 58.52 1m1e h GLU 626 Cb 0.58 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.66 1m1e h GLU 626 CO -0.82 0.61 0.18 0.00 -1.00 0.00 0.00 179.01 177.98 1m1e h ALA 627 N 1.11 1.16 -0.91 3.43 0.00 -1.61 -1.49 119.26 120.94 1m1e h ALA 627 Ca 0.18 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1m1e h ALA 627 Cb 0.09 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1m1e h ALA 627 CO -0.03 0.58 0.52 0.00 0.00 0.00 0.00 179.25 180.33 1m1e h ALA 628 N 1.29 1.22 -0.39 0.00 0.00 -0.93 -0.40 119.26 120.05 1m1e h ALA 628 Ca 0.20 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1m1e h ALA 628 Cb 0.28 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1m1e h ALA 628 CO -0.01 0.65 -0.00 0.93 0.00 0.00 0.00 179.25 180.82 1m1e h GLU 629 N 1.26 0.68 -0.42 0.00 5.08 -0.95 -2.42 114.58 117.81 1m1e h GLU 629 Ca 0.32 -0.22 -0.04 0.00 -1.00 0.00 0.00 59.36 58.43 1m1e h GLU 629 Cb -0.02 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1m1e h GLU 629 CO -0.06 0.78 0.11 0.00 -1.00 0.00 0.00 179.01 178.85 1m1e h ALA 630 N 0.88 1.41 -0.51 3.43 0.00 -0.83 -0.72 119.26 122.92 1m1e h ALA 630 Ca 0.11 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 1m1e h ALA 630 Cb 0.48 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1m1e h ALA 630 CO 0.02 0.43 -0.09 0.82 0.00 0.00 0.00 179.25 180.43 1m1e h ILE 631 N 0.61 1.27 -0.51 0.00 2.04 -0.90 -2.66 117.51 117.35 1m1e h ILE 631 Ca 0.14 -1.22 -0.09 0.00 1.00 0.00 0.00 64.86 64.69 1m1e h ILE 631 Cb 0.21 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 1m1e h ILE 631 CO -0.01 0.43 -0.05 -0.08 0.00 0.00 0.00 178.15 178.44 1m1e h GLU 632 N 0.82 0.90 0.00 2.37 4.81 -0.95 -2.09 114.58 120.44 1m1e h GLU 632 Ca 0.13 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1m1e h GLU 632 Cb 0.64 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1m1e h GLU 632 CO 0.04 0.93 0.00 0.00 -0.73 0.00 0.00 179.01 179.25 1m1e h ALA 633 N 1.11 1.00 -0.44 2.92 0.00 -0.86 -0.96 119.26 122.03 1m1e h ALA 633 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1m1e h ALA 633 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.35 1m1e h ALA 633 CO 0.03 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.67 1m1e n GLU 634 N -2.84 2.16 -3.00 0.00 -0.58 -0.79 -4.93 120.64 110.66 1m1e n GLU 634 Ca -0.02 -1.63 -0.17 0.00 -0.42 0.00 0.00 57.16 54.92 1m1e n GLU 634 Cb 0.10 -1.41 0.04 0.00 -0.57 0.00 0.00 31.44 29.60 1m1e n GLU 634 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1m1e n GLY 635 N 1.13 -0.20 0.17 0.62 0.00 -0.37 -4.92 105.19 101.62 1m1e n GLY 635 Ca 0.15 -0.05 0.05 0.00 0.00 0.00 0.00 46.02 46.16 1m1e n GLY 635 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m1e h ALA 636 N 0.76 0.87 -0.55 4.61 0.00 -1.70 -3.35 119.26 119.89 1m1e h ALA 636 Ca -0.41 -0.38 0.11 0.00 0.00 0.00 0.00 54.91 54.23 1m1e h ALA 636 Cb 1.28 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.89 1m1e h ALA 636 CO 0.43 0.53 -0.19 1.15 0.00 0.00 0.00 179.25 181.16 1m1e h THR 637 N 0.00 0.36 0.80 0.00 2.02 -1.85 -0.70 112.91 113.54 1m1e h THR 637 Ca -0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1m1e h THR 637 Cb 1.07 0.36 0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1m1e h THR 637 CO 0.05 0.00 -0.38 0.00 0.37 0.00 0.00 175.52 175.56 1m1e h ALA 638 N 1.39 -1.07 -0.41 6.16 0.00 -2.00 0.70 119.26 124.03 1m1e h ALA 638 Ca 0.26 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1m1e h ALA 638 Cb 0.46 0.42 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 1m1e h ALA 638 CO -0.60 -1.10 0.27 -1.00 0.00 0.00 0.00 179.25 176.82 1m1e h PRO 639 N -1.08 0.52 -0.53 0.00 0.13 -1.73 -1.87 132.00 127.43 1m1e h PRO 639 Ca -0.11 -0.03 -0.11 0.00 -0.87 0.00 0.00 66.00 64.88 1m1e h PRO 639 Cb 0.82 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.82 1m1e h PRO 639 CO 0.18 0.34 -0.11 -0.07 -0.23 0.00 0.00 178.00 178.11 1m1e h LEU 640 N 0.53 1.01 -0.94 1.56 3.38 -0.92 -2.75 115.31 117.18 1m1e h LEU 640 Ca 0.15 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 1m1e h LEU 640 Cb -0.03 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.40 1m1e h LEU 640 CO -0.03 1.12 0.58 0.74 0.09 0.00 0.00 178.44 180.94 1m1e h THR 641 N 0.90 1.25 -0.28 0.22 2.02 -0.08 -1.93 112.91 115.01 1m1e h THR 641 Ca 0.14 -0.53 -0.04 0.00 0.77 0.00 0.00 66.41 66.75 1m1e h THR 641 Cb 0.67 -0.09 -0.02 0.00 -1.74 0.00 0.00 68.15 66.98 1m1e h THR 641 CO 0.05 0.26 0.01 -0.33 0.37 0.00 0.00 175.52 175.88 1m1e h GLU 642 N 1.29 0.42 0.00 6.66 4.39 -1.15 -2.14 114.58 124.05 1m1e h GLU 642 Ca 0.34 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.96 1m1e h GLU 642 Cb -0.08 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 28.50 1m1e h GLU 642 CO -0.07 0.44 0.00 1.28 -1.16 0.00 0.00 179.01 179.51 1m1e n LEU 643 N -4.33 0.59 0.25 1.33 4.77 -0.74 -3.45 117.00 115.42 1m1e n LEU 643 Ca 0.01 0.61 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 1m1e n LEU 643 Cb 0.21 -0.49 0.80 0.00 -2.33 0.00 0.00 43.42 41.61 1m1e n LEU 643 CO 0.38 -0.38 1.11 -0.07 -1.33 0.00 0.00 177.39 177.10 1m1e h LEU 644 N 0.00 0.00 -3.41 2.23 3.38 -1.20 -1.70 115.31 114.62 1m1e h LEU 644 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1m1e h LEU 644 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1m1e h LEU 644 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 1m1e n HIS 645 N -4.10 1.78 -1.93 1.13 1.44 -1.22 -4.84 115.22 107.47 1m1e n HIS 645 Ca -0.01 -0.71 -0.37 0.00 -2.01 0.00 0.00 57.72 54.62 1m1e n HIS 645 Cb 0.16 -0.41 0.04 0.00 0.12 0.00 0.00 29.99 29.89 1m1e n HIS 645 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 1m1e s SER 646 N -0.95 5.23 0.47 4.39 0.15 -0.64 -4.91 113.70 117.45 1m1e s SER 646 Ca 0.52 2.52 0.27 0.00 0.70 0.00 0.00 55.95 59.96 1m1e s SER 646 Cb 0.38 -2.61 0.84 0.00 -1.71 0.00 0.00 66.02 62.91 1m1e s SER 646 CO 0.18 -1.58 1.79 0.03 1.20 0.00 0.00 173.24 174.86 1m1e h ARG 647 N 1.13 0.00 -6.41 5.44 2.47 -1.94 -3.42 114.38 111.64 1m1e h ARG 647 Ca -0.51 0.00 -0.58 0.00 -1.26 0.00 0.00 59.98 57.64 1m1e h ARG 647 Cb 1.30 0.00 -0.09 0.00 -1.65 0.00 0.00 29.97 29.53 1m1e h ARG 647 CO 0.56 0.08 0.77 1.21 0.56 0.00 0.00 179.97 183.15 1m1e s ASN 648 N -6.02 6.53 0.27 7.04 3.84 -1.26 -4.92 114.94 120.42 1m1e s ASN 648 Ca 0.03 0.22 -0.00 0.00 0.21 0.00 0.00 52.86 53.32 1m1e s ASN 648 Cb 0.08 -2.50 0.55 0.00 -0.55 0.00 0.00 41.25 38.83 1m1e s ASN 648 CO 0.62 -1.20 1.78 -0.33 -2.79 0.00 0.00 177.10 175.18 1m1e h GLU 649 N 9.22 0.68 0.08 0.43 5.08 -1.99 -0.88 114.58 127.20 1m1e h GLU 649 Ca -0.24 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.09 1m1e h GLU 649 Cb 1.07 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.14 1m1e h GLU 649 CO 1.09 0.45 -0.14 0.78 -1.00 0.00 0.00 179.01 180.20 1m1e h GLY 650 N 0.70 -0.24 0.58 -3.84 0.00 -1.96 0.33 103.07 98.65 1m1e h GLY 650 Ca 0.48 0.16 0.03 0.00 0.00 0.00 0.00 47.33 48.00 1m1e h GLY 650 CO -0.34 -0.14 -0.15 -2.08 0.00 0.00 0.00 176.54 173.83 1m1e h VAL 651 N -0.27 0.63 -0.98 4.60 2.07 -1.65 0.01 116.25 120.65 1m1e h VAL 651 Ca 0.02 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.55 1m1e h VAL 651 Cb 0.29 0.63 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 1m1e h VAL 651 CO -0.08 0.00 0.65 0.00 0.02 0.00 0.00 177.57 178.16 1m1e h ALA 652 N 0.76 1.29 -0.05 1.67 0.00 -0.93 -1.37 119.26 120.63 1m1e h ALA 652 Ca 0.06 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1m1e h ALA 652 Cb 0.31 -0.40 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 1m1e h ALA 652 CO -0.18 0.65 -0.06 1.15 0.00 0.00 0.00 179.25 180.82 1m1e h THR 653 N 1.33 1.38 -0.63 0.00 2.02 0.04 -2.10 112.91 114.96 1m1e h THR 653 Ca 0.36 -1.25 -0.01 0.00 0.77 0.00 0.00 66.41 66.29 1m1e h THR 653 Cb -0.15 2.10 -0.03 0.00 -1.74 0.00 0.00 68.15 68.33 1m1e h THR 653 CO -0.08 0.34 0.37 1.88 0.37 0.00 0.00 175.52 178.40 1m1e h TYR 654 N -0.32 0.84 -0.04 3.16 0.05 -0.89 -0.57 116.97 119.20 1m1e h TYR 654 Ca 0.01 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1m1e h TYR 654 Cb 0.58 -0.27 -0.00 0.00 1.01 0.00 0.00 36.73 38.04 1m1e h TYR 654 CO 0.10 0.59 0.02 0.00 -1.05 0.00 0.00 178.16 177.82 1m1e h ALA 655 N 1.18 0.05 -0.91 3.88 0.00 -1.29 -1.26 119.26 120.92 1m1e h ALA 655 Ca 0.22 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1m1e h ALA 655 Cb 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1m1e h ALA 655 CO -0.04 -0.45 0.60 0.00 0.00 0.00 0.00 179.25 179.36 1m1e h ALA 656 N 1.00 1.38 -0.66 0.00 0.00 -1.18 -2.05 119.26 117.76 1m1e h ALA 656 Ca 0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1m1e h ALA 656 Cb 0.01 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 1m1e h ALA 656 CO -0.00 0.56 0.29 0.00 0.00 0.00 0.00 179.25 180.10 1m1e h ALA 657 N 1.45 0.85 -0.71 0.00 0.00 -0.62 -0.46 119.26 119.77 1m1e h ALA 657 Ca 0.34 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1m1e h ALA 657 Cb -0.09 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 1m1e h ALA 657 CO -0.08 0.44 0.20 0.28 0.00 0.00 0.00 179.25 180.09 1m1e h VAL 658 N 0.92 1.26 -0.47 0.00 2.07 -0.76 -0.85 116.25 118.42 1m1e h VAL 658 Ca 0.22 -0.93 -0.02 0.00 0.82 0.00 0.00 66.70 66.79 1m1e h VAL 658 Cb 0.17 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1m1e h VAL 658 CO -0.02 0.36 0.20 -0.07 0.02 0.00 0.00 177.57 178.06 1m1e h LEU 659 N 1.05 0.63 -0.36 2.57 3.38 -0.98 -0.39 115.31 121.21 1m1e h LEU 659 Ca 0.23 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1m1e h LEU 659 Cb 0.33 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 1m1e h LEU 659 CO -0.00 0.62 0.13 -0.26 0.09 0.00 0.00 178.44 179.01 1m1e h PHE 660 N 0.61 0.56 -0.09 1.13 0.05 -0.89 -1.96 116.94 116.35 1m1e h PHE 660 Ca 0.16 -0.05 -0.06 0.00 3.82 0.00 0.00 57.97 61.84 1m1e h PHE 660 Cb 0.17 -0.16 -0.01 0.00 2.00 0.00 0.00 35.95 37.94 1m1e h PHE 660 CO -0.00 0.52 -0.20 0.00 -0.18 0.00 0.00 178.31 178.45 1m1e h ARG 661 N 0.43 0.15 -0.07 1.51 3.08 -0.96 -2.12 114.38 116.39 1m1e h ARG 661 Ca 0.12 -0.04 -0.13 0.00 0.07 0.00 0.00 59.98 60.00 1m1e h ARG 661 Cb 0.21 -0.02 0.01 0.00 0.08 0.00 0.00 29.97 30.25 1m1e h ARG 661 CO -0.01 0.35 -0.45 0.52 -1.07 0.00 0.00 179.97 179.31 1m1e h MET 662 N 0.14 0.43 -0.13 0.04 2.86 -0.84 -3.22 114.93 114.20 1m1e h MET 662 Ca 0.03 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 1m1e h MET 662 Cb 0.44 0.08 0.00 0.00 0.06 0.00 0.00 31.60 32.18 1m1e h MET 662 CO 0.03 1.01 0.00 -1.13 1.06 0.00 0.00 176.91 177.88 1m1e n SER 663 N -4.30 0.75 -0.09 1.22 3.41 -0.76 -3.96 113.62 109.89 1m1e n SER 663 Ca -0.09 -1.91 -0.12 0.00 -0.26 0.00 0.00 58.87 56.49 1m1e n SER 663 Cb 0.57 -0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.39 1m1e n SER 663 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1m1e n GLU 664 N -0.13 0.51 0.00 4.33 2.13 -0.81 -4.44 120.64 122.24 1m1e n GLU 664 Ca 0.07 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.31 1m1e n GLU 664 Cb 0.13 -1.61 0.00 0.00 0.27 0.00 0.00 31.44 30.23 1m1e n GLU 664 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1m1e n ASP 665 N -4.49 0.00 -0.08 4.31 8.00 -1.24 -4.01 116.55 119.04 1m1e n ASP 665 Ca -0.20 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.17 1m1e n ASP 665 Cb 0.49 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.52 1m1e n ASP 665 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1m1e n LYS 666 N 0.00 0.41 -0.60 -1.24 4.76 -1.26 -4.97 118.16 115.25 1m1e n LYS 666 Ca 0.00 0.11 -0.11 0.00 -2.87 0.00 0.00 58.31 55.44 1m1e n LYS 666 Cb 0.00 -1.30 -0.08 0.00 -1.84 0.00 0.00 35.03 31.80 1m1e n LYS 666 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1m1e n PRO 667 N -3.11 0.00 0.00 1.97 -0.02 -1.26 -4.76 135.00 127.83 1m1e n PRO 667 Ca -0.30 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.18 1m1e n PRO 667 Cb 0.80 -0.46 0.00 0.00 -0.02 0.00 0.00 33.50 33.82 1m1e n PRO 667 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1m1e n GLN 668 N 2.57 0.00 -0.17 -0.52 10.64 -1.26 -4.83 117.38 123.81 1m1e n GLN 668 Ca 0.27 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.44 1m1e n GLN 668 Cb 0.04 -0.03 0.00 0.00 -0.86 0.00 0.00 30.24 29.40 1m1e n GLN 668 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1m1e n ASP 669 N -1.55 0.00 -4.23 2.61 8.00 -1.26 -5.12 116.55 115.00 1m1e n ASP 669 Ca 0.00 -0.80 -0.16 0.00 0.71 0.00 0.00 54.79 54.54 1m1e n ASP 669 Cb 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.14 1m1e n ASP 669 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1m1e n TYR 670 N -1.43 -2.21 0.00 1.24 4.02 -1.26 -5.25 117.16 112.26 1m1e n TYR 670 Ca 0.00 -1.64 0.00 0.00 -0.01 0.00 0.00 57.90 56.25 1m1e n TYR 670 Cb 0.00 -0.41 0.00 0.00 -0.02 0.00 0.00 39.34 38.91 1m1e n TYR 670 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02