#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ojo s LYS 171 N 0.00 3.64 0.00 5.55 2.20 -1.26 -4.75 119.74 125.13 1ojo s LYS 171 Ca 0.00 1.79 0.00 0.00 -0.36 0.00 0.00 55.97 57.40 1ojo s LYS 171 Cb 0.00 -4.14 0.00 0.00 -1.51 0.00 0.00 37.83 32.18 1ojo s LYS 171 CO 0.00 -1.49 0.00 -0.40 -0.36 0.00 0.00 175.35 173.10 1ojo n ASP 172 N 9.21 0.00 0.22 1.43 3.85 -1.26 -5.00 116.55 125.00 1ojo n ASP 172 Ca 0.21 -0.39 0.05 0.00 -0.71 0.00 0.00 54.79 53.96 1ojo n ASP 172 Cb 0.45 0.00 0.49 0.00 -1.35 0.00 0.00 41.12 40.71 1ojo n ASP 172 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 1ojo h THR 173 N 0.39 1.12 -0.12 2.12 1.35 -1.99 -1.22 112.91 114.56 1ojo h THR 173 Ca 0.00 -0.72 -0.02 0.00 -0.55 0.00 0.00 66.41 65.12 1ojo h THR 173 Cb 0.00 1.39 -0.00 0.00 -1.73 0.00 0.00 68.15 67.81 1ojo h THR 173 CO 0.00 0.20 -0.00 1.88 -0.25 0.00 0.00 175.52 177.35 1ojo h TYR 174 N 0.00 0.23 -0.11 4.73 0.05 -1.93 -1.81 116.97 118.14 1ojo h TYR 174 Ca -0.00 -0.04 -0.05 0.00 0.05 0.00 0.00 58.73 58.69 1ojo h TYR 174 Cb 0.37 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 38.05 1ojo h TYR 174 CO 0.00 0.46 -0.16 1.79 -1.05 0.00 0.00 178.16 179.20 1ojo h THR 175 N -0.07 1.18 -0.48 -2.88 1.35 -1.76 -1.16 112.91 109.09 1ojo h THR 175 Ca 0.03 -0.79 -0.02 0.00 -0.55 0.00 0.00 66.41 65.08 1ojo h THR 175 Cb 0.37 1.27 -0.02 0.00 -1.73 0.00 0.00 68.15 68.05 1ojo h THR 175 CO 0.01 0.24 0.20 0.44 -0.25 0.00 0.00 175.52 176.16 1ojo h ASP 176 N 0.16 0.65 -0.34 5.36 3.45 -0.95 0.96 116.42 125.71 1ojo h ASP 176 Ca 0.03 -0.16 -0.10 0.00 0.43 0.00 0.00 57.03 57.24 1ojo h ASP 176 Cb 0.39 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 38.97 1ojo h ASP 176 CO 0.02 0.63 -0.14 0.03 -1.57 0.00 0.00 179.24 178.22 1ojo h ARG 177 N 0.63 0.79 -0.06 3.56 2.47 -0.75 -2.22 114.38 118.80 1ojo h ARG 177 Ca 0.16 -0.28 -0.09 0.00 -1.26 0.00 0.00 59.98 58.51 1ojo h ARG 177 Cb 0.17 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 1ojo h ARG 177 CO -0.02 0.89 -0.38 -0.07 0.56 0.00 0.00 179.97 180.96 1ojo h LEU 178 N 0.71 0.12 -0.39 3.04 3.38 -0.78 -0.10 115.31 121.28 1ojo h LEU 178 Ca 0.11 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1ojo h LEU 178 Cb 0.63 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 1ojo h LEU 178 CO 0.04 0.49 -0.02 0.44 0.09 0.00 0.00 178.44 179.48 1ojo h ASP 179 N 0.10 0.70 -0.85 -0.43 3.32 -0.41 0.89 116.42 119.75 1ojo h ASP 179 Ca 0.01 -0.32 -0.03 0.00 0.02 0.00 0.00 57.03 56.71 1ojo h ASP 179 Cb 0.71 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 40.04 1ojo h ASP 179 CO 0.05 0.85 0.40 0.44 -1.72 0.00 0.00 179.24 179.27 1ojo h ASP 180 N 0.53 1.12 -0.58 6.45 3.32 -0.92 -1.31 116.42 125.02 1ojo h ASP 180 Ca 0.11 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 56.99 1ojo h ASP 180 Cb 0.51 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.74 1ojo h ASP 180 CO 0.02 0.94 0.26 -0.25 -1.72 0.00 0.00 179.24 178.50 1ojo h TRP 181 N 1.22 0.86 -0.70 4.55 -0.00 -0.67 -2.18 115.95 119.02 1ojo h TRP 181 Ca 0.29 -0.05 -0.01 0.00 -0.00 0.00 0.00 58.89 59.12 1ojo h TRP 181 Cb 0.13 -0.26 -0.03 0.00 -0.00 0.00 0.00 29.16 28.99 1ojo h TRP 181 CO 0.02 0.68 0.39 -0.91 -0.00 0.00 0.00 178.44 178.61 1ojo h ASN 182 N 0.80 0.86 0.66 2.65 2.35 -0.27 0.58 115.58 123.21 1ojo h ASN 182 Ca 0.20 -0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 55.85 1ojo h ASN 182 Cb 0.16 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 1ojo h ASN 182 CO -0.02 0.69 -0.14 1.23 -1.65 0.00 0.00 177.43 177.54 1ojo h GLY 183 N 1.02 0.00 0.48 2.83 0.00 -0.72 -1.36 103.07 105.31 1ojo h GLY 183 Ca 0.25 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 47.29 1ojo h GLY 183 CO -0.04 0.00 -1.53 -2.22 0.00 0.00 0.00 176.54 172.75 1ojo h ILE 184 N 0.00 0.91 0.00 2.60 2.04 -0.57 -2.99 117.51 119.50 1ojo h ILE 184 Ca -0.00 -2.35 0.00 0.00 1.00 0.00 0.00 64.86 63.51 1ojo h ILE 184 Cb 0.51 2.58 0.00 0.00 -0.74 0.00 0.00 36.82 39.17 1ojo h ILE 184 CO 0.02 0.69 -0.22 2.30 0.00 0.00 0.00 178.15 180.93 1ojo n ILE 185 N -3.90 0.39 0.06 -0.67 -5.35 0.05 -4.62 119.36 105.32 1ojo n ILE 185 Ca -0.28 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 1ojo n ILE 185 Cb 0.90 -0.37 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 1ojo n ILE 185 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ojo n ALA 186 N -1.74 3.00 -2.15 -1.28 0.00 -0.70 -4.84 120.51 112.80 1ojo n ALA 186 Ca 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.45 1ojo n ALA 186 Cb 0.41 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.92 1ojo n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ojo n GLY 187 N 1.75 0.26 0.34 0.00 0.00 -0.60 -1.90 105.19 105.04 1ojo n GLY 187 Ca 0.00 -0.70 0.16 0.00 0.00 0.00 0.00 46.02 45.48 1ojo n GLY 187 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ojo h ASN 188 N -0.06 0.00 0.45 1.61 2.35 -1.86 0.19 115.58 118.26 1ojo h ASN 188 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 1ojo h ASN 188 Cb 1.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.44 1ojo h ASN 188 CO 0.11 0.00 0.00 0.06 -1.65 0.00 0.00 177.43 175.95 1ojo h GLN 189 N 0.00 0.00 -0.01 0.81 3.07 -1.92 -2.11 115.11 114.95 1ojo h GLN 189 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.90 1ojo h GLN 189 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.22 1ojo h GLN 189 CO -0.00 0.00 -0.58 0.66 0.09 0.00 0.00 178.83 179.00 1ojo n TYR 190 N -3.02 0.00 -1.73 0.06 4.01 0.05 -4.99 117.16 111.53 1ojo n TYR 190 Ca -0.01 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.33 1ojo n TYR 190 Cb 0.17 -0.01 0.02 0.00 -0.31 0.00 0.00 39.34 39.21 1ojo n TYR 190 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 1ojo n TYR 191 N -0.39 2.31 -3.48 -0.72 9.36 -0.80 -4.99 117.16 118.47 1ojo n TYR 191 Ca 0.08 0.46 -0.16 0.00 3.32 0.00 0.00 57.90 61.60 1ojo n TYR 191 Cb 0.43 -2.39 -0.12 0.00 -0.63 0.00 0.00 39.34 36.63 1ojo n TYR 191 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 1ojo s ASP 192 N -0.62 1.08 0.58 2.98 2.15 -1.26 -5.03 116.67 116.55 1ojo s ASP 192 Ca 0.64 -0.08 0.27 0.00 0.43 0.00 0.00 52.55 53.81 1ojo s ASP 192 Cb -0.46 0.54 1.64 0.00 -0.30 0.00 0.00 42.92 44.34 1ojo s ASP 192 CO 0.55 -0.32 2.16 0.77 -0.17 0.00 0.00 175.17 178.17 1ojo h SER 193 N 8.29 0.00 0.57 -0.34 4.64 -1.97 0.86 113.55 125.58 1ojo h SER 193 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1ojo h SER 193 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1ojo h SER 193 CO 0.27 0.00 -0.03 0.29 -0.87 0.00 0.00 176.83 176.49 1ojo n LYS 194 N -3.97 0.43 -3.03 4.77 5.02 -1.26 -4.62 118.16 115.50 1ojo n LYS 194 Ca -0.00 -0.04 -0.43 0.00 -2.02 0.00 0.00 58.31 55.81 1ojo n LYS 194 Cb 0.22 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.67 1ojo n LYS 194 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1ojo s ASN 195 N -2.60 6.31 0.20 4.39 3.84 0.29 -4.96 114.94 122.42 1ojo s ASN 195 Ca 0.27 -0.48 -0.12 0.00 0.21 0.00 0.00 52.86 52.74 1ojo s ASN 195 Cb 0.20 -2.35 0.23 0.00 -0.55 0.00 0.00 41.25 38.77 1ojo s ASN 195 CO 0.47 -0.96 1.69 -0.78 -2.79 0.00 0.00 177.10 174.74 1ojo h ASP 196 N 9.05 -0.13 -0.58 -4.21 3.58 -1.84 0.30 116.42 122.59 1ojo h ASP 196 Ca -0.26 0.12 -0.07 0.00 0.42 0.00 0.00 57.03 57.23 1ojo h ASP 196 Cb 1.09 0.19 -0.02 0.00 1.72 0.00 0.00 39.33 42.30 1ojo h ASP 196 CO 0.98 -0.04 0.08 1.56 -2.88 0.00 0.00 179.24 178.94 1ojo h GLN 197 N 0.17 0.97 -0.45 0.28 1.08 -1.94 -2.19 115.11 113.01 1ojo h GLN 197 Ca 0.27 -0.27 -0.09 0.00 -1.45 0.00 0.00 58.65 57.12 1ojo h GLN 197 Cb 0.41 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.71 1ojo h GLN 197 CO -0.41 0.92 -0.06 0.52 -0.95 0.00 0.00 178.83 178.86 1ojo h MET 198 N 0.86 0.84 -0.46 1.46 2.86 -1.76 -2.77 114.93 115.96 1ojo h MET 198 Ca 0.17 -0.30 0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1ojo h MET 198 Cb 0.43 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 1ojo h MET 198 CO 0.01 0.92 0.31 0.00 1.06 0.00 0.00 176.91 179.21 1ojo h ALA 199 N 0.89 1.83 -0.46 6.32 0.00 -0.78 -0.57 119.26 126.50 1ojo h ALA 199 Ca 0.12 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1ojo h ALA 199 Cb 0.58 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1ojo h ALA 199 CO 0.03 0.11 0.04 -0.22 0.00 0.00 0.00 179.25 179.22 1ojo h LYS 200 N 0.48 0.77 -0.42 0.00 3.64 -1.13 -0.75 116.57 119.17 1ojo h LYS 200 Ca 0.19 -0.22 -0.13 0.00 -1.27 0.00 0.00 60.65 59.21 1ojo h LYS 200 Cb 0.16 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 1ojo h LYS 200 CO -0.05 0.81 -0.26 1.25 -2.27 0.00 0.00 179.45 178.93 1ojo h LEU 201 N 0.63 0.96 -0.39 5.20 5.85 -1.12 -2.37 115.31 124.07 1ojo h LEU 201 Ca 0.13 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.46 1ojo h LEU 201 Cb 0.43 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 1ojo h LEU 201 CO 0.01 1.17 0.20 -1.13 -0.34 0.00 0.00 178.44 178.36 1ojo h ASN 202 N 0.75 0.30 -0.36 1.25 -0.00 -0.96 -1.20 115.58 115.36 1ojo h ASN 202 Ca 0.09 0.02 -0.01 0.00 -0.00 0.00 0.00 56.30 56.39 1ojo h ASN 202 Cb 0.84 -0.04 -0.02 0.00 -0.00 0.00 0.00 38.32 39.10 1ojo h ASN 202 CO 0.07 0.22 0.20 1.56 -0.00 0.00 0.00 177.43 179.49 1ojo h GLN 203 N 0.41 0.53 -0.28 6.67 1.08 -1.02 0.13 115.11 122.63 1ojo h GLN 203 Ca 0.16 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1ojo h GLN 203 Cb 0.06 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.37 1ojo h GLN 203 CO -0.11 0.40 0.01 1.49 -0.95 0.00 0.00 178.83 179.68 1ojo h GLU 204 N 0.54 0.49 -0.29 1.46 4.81 -0.80 -1.31 114.58 119.48 1ojo h GLU 204 Ca 0.14 -0.15 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 1ojo h GLU 204 Cb 0.03 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 1ojo h GLU 204 CO -0.02 0.63 -0.20 -0.07 -0.73 0.00 0.00 179.01 178.62 1ojo h LEU 205 N 0.29 0.53 -0.18 1.64 3.38 -0.55 -1.36 115.31 119.06 1ojo h LEU 205 Ca 0.08 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1ojo h LEU 205 Cb 0.40 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1ojo h LEU 205 CO 0.01 0.74 0.11 -0.33 0.09 0.00 0.00 178.44 179.06 1ojo h GLU 206 N 0.48 0.24 -0.65 1.13 4.39 -0.54 -1.47 114.58 118.17 1ojo h GLU 206 Ca 0.08 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.73 1ojo h GLU 206 Cb 0.62 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.19 1ojo h GLU 206 CO 0.04 0.21 0.33 0.78 -1.16 0.00 0.00 179.01 179.21 1ojo h GLY 207 N 0.21 0.98 0.97 -3.84 0.00 -0.97 -0.09 103.07 100.34 1ojo h GLY 207 Ca 0.06 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.91 1ojo h GLY 207 CO -0.01 0.45 0.24 0.50 0.00 0.00 0.00 176.54 177.72 1ojo h LYS 208 N 0.89 0.66 -0.43 4.80 1.57 -1.06 -0.17 116.57 122.82 1ojo h LYS 208 Ca 0.22 -0.09 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1ojo h LYS 208 Cb 0.09 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.26 1ojo h LYS 208 CO -0.03 0.55 -0.00 0.28 -0.57 0.00 0.00 179.45 179.67 1ojo h VAL 209 N 0.61 1.26 -0.56 0.50 2.07 -1.08 -0.82 116.25 118.24 1ojo h VAL 209 Ca 0.16 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.67 1ojo h VAL 209 Cb 0.09 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1ojo h VAL 209 CO -0.02 0.36 0.34 0.00 0.02 0.00 0.00 177.57 178.26 1ojo h ALA 210 N 0.90 0.72 -0.61 1.67 0.00 -0.78 0.14 119.26 121.31 1ojo h ALA 210 Ca 0.12 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 1ojo h ALA 210 Cb 0.49 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1ojo h ALA 210 CO 0.02 0.06 0.20 -0.44 0.00 0.00 0.00 179.25 179.09 1ojo h ASP 211 N 0.67 0.88 -0.52 0.00 3.32 -0.82 -2.08 116.42 117.87 1ojo h ASP 211 Ca 0.22 -0.20 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 1ojo h ASP 211 Cb 0.02 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1ojo h ASP 211 CO -0.10 0.85 0.02 0.28 -1.72 0.00 0.00 179.24 178.57 1ojo h SER 212 N 0.87 0.89 0.02 6.45 0.02 -0.59 -2.69 113.55 118.52 1ojo h SER 212 Ca 0.20 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 60.77 1ojo h SER 212 Cb 0.28 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1ojo h SER 212 CO -0.01 0.97 -0.24 -0.07 -1.14 0.00 0.00 176.83 176.34 1ojo h LEU 213 N 0.78 0.37 0.00 5.07 3.38 -0.58 -1.52 115.31 122.81 1ojo h LEU 213 Ca 0.15 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1ojo h LEU 213 Cb 0.50 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.15 1ojo h LEU 213 CO 0.02 0.61 -0.33 -1.54 0.09 0.00 0.00 178.44 177.30 1ojo n SER 214 N -4.15 0.36 -0.00 -0.43 3.41 -0.80 -3.89 113.62 108.12 1ojo n SER 214 Ca -0.01 0.07 0.04 0.00 -0.26 0.00 0.00 58.87 58.71 1ojo n SER 214 Cb 0.37 -0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 64.23 1ojo n SER 214 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1ojo n SER 215 N -1.58 0.50 -4.76 4.04 3.41 -1.02 -5.02 113.62 109.19 1ojo n SER 215 Ca 0.06 -0.66 -0.36 0.00 -0.26 0.00 0.00 58.87 57.65 1ojo n SER 215 Cb 0.35 1.02 0.03 0.00 -0.26 0.00 0.00 64.21 65.34 1ojo n SER 215 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1ojo s ILE 216 N -1.79 2.69 -0.06 -1.33 2.07 -0.58 -4.70 121.20 117.50 1ojo s ILE 216 Ca 0.03 0.45 -0.30 0.00 -1.41 0.00 0.00 60.65 59.42 1ojo s ILE 216 Cb 0.06 -3.19 -0.02 0.00 0.13 0.00 0.00 42.46 39.43 1ojo s ILE 216 CO 0.33 -0.07 1.07 -0.44 -1.91 0.00 0.00 174.94 173.92 1ojo s SER 217 N -1.52 7.20 -0.11 4.50 0.01 0.17 -4.90 113.70 119.05 1ojo s SER 217 Ca 0.75 1.68 0.15 0.00 1.31 0.00 0.00 55.95 59.83 1ojo s SER 217 Cb -0.30 -2.56 0.31 0.00 0.21 0.00 0.00 66.02 63.67 1ojo s SER 217 CO 0.34 -0.45 1.21 -1.20 0.41 0.00 0.00 173.24 173.55 1ojo n SER 218 N 4.75 2.75 -4.84 2.44 7.64 -1.26 -4.95 113.62 120.14 1ojo n SER 218 Ca 0.09 -2.80 -0.37 0.00 1.01 0.00 0.00 58.87 56.79 1ojo n SER 218 Cb 0.48 -0.37 -0.06 0.00 -1.01 0.00 0.00 64.21 63.25 1ojo n SER 218 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ojo s GLN 219 N -2.41 3.90 0.54 1.43 -2.07 -1.26 -5.07 119.66 114.73 1ojo s GLN 219 Ca 0.29 0.38 -0.20 0.00 -1.82 0.00 0.00 55.36 54.01 1ojo s GLN 219 Cb 0.24 -3.15 -0.05 0.00 -1.09 0.00 0.00 33.01 28.96 1ojo s GLN 219 CO 0.05 0.64 1.17 0.00 -1.32 0.00 0.00 175.29 175.84 1ojo s ALA 220 N -1.19 2.70 -1.58 2.60 0.00 -1.26 -3.09 121.76 119.95 1ojo s ALA 220 Ca 0.27 0.93 -0.04 0.00 0.00 0.00 0.00 51.96 53.12 1ojo s ALA 220 Cb -0.16 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.56 1ojo s ALA 220 CO 0.15 -0.91 0.58 -0.25 0.00 0.00 0.00 175.76 175.34 1ojo n ASP 221 N -1.23 -6.17 -4.76 0.00 9.92 -1.26 -4.95 116.55 108.09 1ojo n ASP 221 Ca 0.11 -0.28 -0.38 0.00 -0.53 0.00 0.00 54.79 53.72 1ojo n ASP 221 Cb 0.50 -4.99 0.00 0.00 -0.64 0.00 0.00 41.12 35.99 1ojo n ASP 221 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1ojo s ARG 222 N -5.68 3.72 0.00 -1.24 1.70 -1.18 -4.92 118.95 111.36 1ojo s ARG 222 Ca 0.29 2.03 0.22 0.00 -0.47 0.00 0.00 55.73 57.80 1ojo s ARG 222 Cb -0.13 -2.53 0.56 0.00 -0.57 0.00 0.00 34.95 32.29 1ojo s ARG 222 CO 0.36 -0.66 1.46 0.44 -1.08 0.00 0.00 175.30 175.82 1ojo n ILE 223 N -0.34 0.33 -3.61 4.99 -5.35 -1.26 -4.95 119.36 109.17 1ojo n ILE 223 Ca 0.06 -0.54 -0.00 0.00 -0.27 0.00 0.00 62.75 62.00 1ojo n ILE 223 Cb 0.45 0.73 -0.01 0.00 -1.74 0.00 0.00 39.64 39.08 1ojo n ILE 223 CO 0.00 0.00 0.00 -0.72 -1.76 0.00 0.00 176.55 174.07 1ojo s TYR 224 N -1.67 -0.06 -0.19 4.28 -0.85 -1.26 -4.97 117.35 112.63 1ojo s TYR 224 Ca 0.35 -0.01 -0.12 0.00 -0.52 0.00 0.00 57.07 56.77 1ojo s TYR 224 Cb 0.20 0.53 -0.21 0.00 0.38 0.00 0.00 41.96 42.86 1ojo s TYR 224 CO 0.29 -0.21 0.16 1.28 -1.52 0.00 0.00 175.55 175.55 1ojo n LEU 225 N -0.34 2.31 -3.90 -3.49 4.77 -1.26 -4.58 117.00 110.51 1ojo n LEU 225 Ca -0.05 0.27 -0.27 0.00 -0.03 0.00 0.00 56.01 55.92 1ojo n LEU 225 Cb 0.61 -1.01 -0.17 0.00 -2.33 0.00 0.00 43.42 40.53 1ojo n LEU 225 CO 0.11 0.62 -0.43 0.26 -1.33 0.00 0.00 177.39 176.61 1ojo s TRP 226 N -2.48 1.55 0.52 -1.77 0.51 -1.26 -0.66 118.94 115.35 1ojo s TRP 226 Ca -0.28 -0.87 0.30 0.00 -2.12 0.00 0.00 56.10 53.13 1ojo s TRP 226 Cb 0.08 -1.26 1.42 0.00 -0.81 0.00 0.00 33.47 32.90 1ojo s TRP 226 CO 0.65 -0.55 1.88 1.49 -0.51 0.00 0.00 176.95 179.91 1ojo h GLU 227 N 8.16 0.06 0.00 4.98 4.22 -1.89 0.27 114.58 130.38 1ojo h GLU 227 Ca -0.27 -0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.16 1ojo h GLU 227 Cb 1.12 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.36 1ojo h GLU 227 CO 0.40 0.04 0.00 1.17 -2.18 0.00 0.00 179.01 178.44 1ojo n LYS 228 N -4.31 0.12 -2.70 1.92 4.81 -1.26 -3.19 118.16 113.55 1ojo n LYS 228 Ca 0.19 0.03 -0.07 0.00 -0.87 0.00 0.00 58.31 57.59 1ojo n LYS 228 Cb 0.93 -1.50 0.04 0.00 0.02 0.00 0.00 35.03 34.52 1ojo n LYS 228 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1ojo n PHE 229 N -1.44 1.34 0.01 5.64 3.72 0.88 -4.91 117.46 122.71 1ojo n PHE 229 Ca 0.09 -2.53 -0.18 0.00 -0.05 0.00 0.00 57.45 54.78 1ojo n PHE 229 Cb 0.29 -0.31 -0.14 0.00 -0.94 0.00 0.00 39.48 38.38 1ojo n PHE 229 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1ojo h SER 230 N 2.80 0.32 -1.70 4.37 4.64 -1.34 -3.43 113.55 119.22 1ojo h SER 230 Ca -0.08 -0.67 -0.49 0.00 -0.47 0.00 0.00 61.79 60.07 1ojo h SER 230 Cb 1.22 -0.11 -0.06 0.00 -0.31 0.00 0.00 62.40 63.14 1ojo h SER 230 CO 0.40 1.59 1.17 0.21 -0.87 0.00 0.00 176.83 179.34 1ojo s ASN 231 N -6.81 5.76 0.00 4.97 2.47 -1.26 -4.81 114.94 115.25 1ojo s ASN 231 Ca -0.16 -0.44 0.14 0.00 0.42 0.00 0.00 52.86 52.83 1ojo s ASN 231 Cb 0.07 -2.55 0.85 0.00 -1.45 0.00 0.00 41.25 38.17 1ojo s ASN 231 CO 0.80 -2.11 1.38 -1.22 -3.72 0.00 0.00 177.10 172.23 1ojo n TYR 232 N 11.18 0.00 0.56 0.43 4.01 -1.26 -1.95 117.16 130.13 1ojo n TYR 232 Ca 0.21 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.07 1ojo n TYR 232 Cb 0.50 0.00 0.28 0.00 -0.31 0.00 0.00 39.34 39.81 1ojo n TYR 232 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1ojo h LYS 233 N 0.00 0.00 -4.40 -0.72 1.57 -1.90 -3.39 116.57 107.73 1ojo h LYS 233 Ca 0.00 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 58.05 1ojo h LYS 233 Cb 0.00 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 32.09 1ojo h LYS 233 CO 0.00 0.00 -0.05 0.99 -0.57 0.00 0.00 179.45 179.82 1ojo s THR 234 N -3.14 5.01 0.47 -0.16 2.01 -0.82 -4.28 115.64 114.72 1ojo s THR 234 Ca 0.08 -1.23 0.29 0.00 0.31 0.00 0.00 61.69 61.14 1ojo s THR 234 Cb 0.12 -4.41 0.49 0.00 0.01 0.00 0.00 72.50 68.71 1ojo s THR 234 CO 0.66 -0.99 1.74 0.77 -0.69 0.00 0.00 174.62 176.10 1ojo h SER 235 N 9.04 0.22 -0.25 3.53 4.64 -1.77 0.62 113.55 129.58 1ojo h SER 235 Ca -0.30 0.06 0.07 0.00 -0.47 0.00 0.00 61.79 61.16 1ojo h SER 235 Cb 1.09 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 63.21 1ojo h SER 235 CO 1.07 -0.01 0.21 0.00 -0.87 0.00 0.00 176.83 177.23 1ojo h ALA 236 N 1.50 2.06 0.00 5.18 0.00 -1.92 -0.99 119.26 125.09 1ojo h ALA 236 Ca 0.66 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.50 1ojo h ALA 236 Cb 2.16 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.96 1ojo h ALA 236 CO -0.21 -0.34 -0.28 -0.91 0.00 0.00 0.00 179.25 177.51 1ojo h ASN 237 N 0.00 0.00 0.03 0.00 -0.26 -1.15 -2.29 115.58 111.91 1ojo h ASN 237 Ca 0.12 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.86 1ojo h ASN 237 Cb 0.54 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.80 1ojo h ASN 237 CO -0.00 0.28 -0.01 -0.07 -1.06 0.00 0.00 177.43 176.57 1ojo h LEU 238 N 0.00 -0.03 -0.67 1.61 4.07 -1.32 -2.32 115.31 116.64 1ojo h LEU 238 Ca -0.00 -0.52 -0.01 0.00 0.08 0.00 0.00 57.88 57.43 1ojo h LEU 238 Cb 0.72 0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.44 1ojo h LEU 238 CO 0.04 0.51 0.38 0.74 -1.08 0.00 0.00 178.44 179.03 1ojo h THR 239 N -0.58 1.21 -0.62 0.22 2.02 -1.56 -1.27 112.91 112.32 1ojo h THR 239 Ca -0.00 -0.50 -0.06 0.00 0.77 0.00 0.00 66.41 66.62 1ojo h THR 239 Cb 0.55 0.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1ojo h THR 239 CO 0.01 0.22 0.15 0.00 0.37 0.00 0.00 175.52 176.27 1ojo h ALA 240 N 1.19 1.11 0.13 6.16 0.00 -1.48 -0.88 119.26 125.49 1ojo h ALA 240 Ca 0.24 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ojo h ALA 240 Cb 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ojo h ALA 240 CO -0.04 0.60 -0.06 1.15 0.00 0.00 0.00 179.25 180.90 1ojo h THR 241 N 0.92 0.99 -0.01 0.00 2.02 -0.94 -2.71 112.91 113.18 1ojo h THR 241 Ca 0.20 -0.52 -0.04 0.00 0.77 0.00 0.00 66.41 66.82 1ojo h THR 241 Cb 0.33 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1ojo h THR 241 CO -0.00 0.12 -0.20 1.88 0.37 0.00 0.00 175.52 177.69 1ojo h TYR 242 N -0.42 0.02 0.00 3.16 0.05 -1.15 -2.02 116.97 116.61 1ojo h TYR 242 Ca -0.02 -0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.68 1ojo h TYR 242 Cb 0.34 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 1ojo h TYR 242 CO 0.01 0.22 -0.37 0.00 -1.05 0.00 0.00 178.16 176.97 1ojo h ARG 243 N 0.02 0.00 -0.16 4.88 3.08 -1.03 -1.72 114.38 119.45 1ojo h ARG 243 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.96 1ojo h ARG 243 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 1ojo h ARG 243 CO 0.03 0.37 -0.33 0.87 -1.07 0.00 0.00 179.97 179.84 1ojo h LYS 244 N 0.00 0.32 -0.12 0.04 1.57 -1.04 -2.02 116.57 115.31 1ojo h LYS 244 Ca -0.00 -0.13 -0.17 0.00 -1.87 0.00 0.00 60.65 58.48 1ojo h LYS 244 Cb 0.72 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 1ojo h LYS 244 CO 0.05 0.62 -0.63 -0.07 -0.57 0.00 0.00 179.45 178.85 1ojo h LEU 245 N 0.28 0.51 -0.82 2.94 3.38 -1.28 -2.62 115.31 117.69 1ojo h LEU 245 Ca 0.04 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.64 1ojo h LEU 245 Cb 0.72 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.29 1ojo h LEU 245 CO 0.05 1.01 0.13 -0.08 0.09 0.00 0.00 178.44 179.65 1ojo h GLU 246 N 0.33 1.02 -0.82 1.13 4.81 -0.92 -0.59 114.58 119.54 1ojo h GLU 246 Ca -0.01 -0.24 -0.03 0.00 -0.13 0.00 0.00 59.36 58.94 1ojo h GLU 246 Cb 1.18 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 1ojo h GLU 246 CO 0.11 0.92 0.38 0.93 -0.73 0.00 0.00 179.01 180.62 1ojo h GLU 247 N 0.97 1.19 -0.56 1.92 5.08 -1.24 -1.30 114.58 120.63 1ojo h GLU 247 Ca 0.20 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.34 1ojo h GLU 247 Cb 0.37 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1ojo h GLU 247 CO 0.00 0.92 0.20 0.52 -1.00 0.00 0.00 179.01 179.66 1ojo h MET 248 N 1.17 0.86 -0.42 2.33 2.86 -1.03 -2.61 114.93 118.08 1ojo h MET 248 Ca 0.28 -0.17 -0.03 0.00 -2.06 0.00 0.00 59.70 57.72 1ojo h MET 248 Cb 0.14 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.64 1ojo h MET 248 CO -0.03 0.76 0.13 0.00 1.06 0.00 0.00 176.91 178.82 1ojo h ALA 249 N 1.06 1.43 -0.53 6.32 0.00 -0.60 -0.53 119.26 126.41 1ojo h ALA 249 Ca 0.18 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1ojo h ALA 249 Cb 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1ojo h ALA 249 CO -0.01 0.42 0.08 0.87 0.00 0.00 0.00 179.25 180.61 1ojo h LYS 250 N 0.61 0.87 0.08 0.00 1.57 -0.92 -3.06 116.57 115.72 1ojo h LYS 250 Ca 0.14 -0.24 -0.27 0.00 -1.87 0.00 0.00 60.65 58.41 1ojo h LYS 250 Cb 0.19 -0.10 0.02 0.00 0.08 0.00 0.00 32.23 32.42 1ojo h LYS 250 CO -0.01 0.86 -1.14 1.96 -0.57 0.00 0.00 179.45 180.55 1ojo h GLN 251 N 0.76 0.54 0.00 3.15 1.08 -1.10 -3.02 115.11 116.51 1ojo h GLN 251 Ca 0.16 -0.68 -0.00 0.00 -1.45 0.00 0.00 58.65 56.67 1ojo h GLN 251 Cb 0.41 0.22 -0.00 0.00 -0.05 0.00 0.00 27.48 28.06 1ojo h GLN 251 CO 0.01 1.29 -0.02 -0.39 -0.95 0.00 0.00 178.83 178.77 1ojo h VAL 252 N 0.26 0.33 -0.53 -0.54 -1.51 -1.15 -0.94 116.25 112.17 1ojo h VAL 252 Ca -0.15 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.23 1ojo h VAL 252 Cb 1.81 1.07 0.00 0.00 -2.13 0.00 0.00 31.29 32.04 1ojo h VAL 252 CO 0.21 0.02 0.00 0.35 -1.23 0.00 0.00 177.57 176.92 1ojo n THR 253 N -3.52 1.33 -3.63 7.19 -2.24 -1.16 -0.96 114.28 111.29 1ojo n THR 253 Ca -0.03 -1.13 -0.40 0.00 -2.27 0.00 0.00 64.05 60.22 1ojo n THR 253 Cb 0.11 0.34 -0.11 0.00 -2.10 0.00 0.00 70.33 68.57 1ojo n THR 253 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ojo s ASN 254 N -1.07 5.59 0.58 3.42 3.04 -0.36 -4.91 114.94 121.23 1ojo s ASN 254 Ca 0.40 -1.38 0.31 0.00 0.04 0.00 0.00 52.86 52.23 1ojo s ASN 254 Cb 0.23 -1.97 1.38 0.00 -1.54 0.00 0.00 41.25 39.36 1ojo s ASN 254 CO 0.23 -0.48 1.74 -0.65 -3.04 0.00 0.00 177.10 174.90 1ojo h PRO 255 N 8.37 0.00 -0.01 0.43 0.11 -1.89 0.85 132.00 139.86 1ojo h PRO 255 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1ojo h PRO 255 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ojo h PRO 255 CO 0.72 0.00 -0.34 0.43 -0.21 0.00 0.00 178.00 178.60 1ojo n SER 256 N -3.73 1.06 -4.81 -2.05 7.64 -1.26 -4.88 113.62 105.58 1ojo n SER 256 Ca 0.17 -0.87 -0.34 0.00 1.01 0.00 0.00 58.87 58.84 1ojo n SER 256 Cb 1.03 0.21 -0.07 0.00 -1.01 0.00 0.00 64.21 64.37 1ojo n SER 256 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1ojo s SER 257 N -2.58 7.01 0.09 6.43 0.15 0.29 -4.92 113.70 120.16 1ojo s SER 257 Ca 0.21 1.70 0.19 0.00 0.70 0.00 0.00 55.95 58.75 1ojo s SER 257 Cb 0.19 -2.54 0.77 0.00 -1.71 0.00 0.00 66.02 62.73 1ojo s SER 257 CO 0.56 -0.30 1.58 -2.11 1.20 0.00 0.00 173.24 174.17 1ojo n ARG 258 N -0.41 0.07 -0.25 5.44 1.85 -1.26 -1.94 116.66 120.17 1ojo n ARG 258 Ca 0.06 0.29 0.11 0.00 -1.00 0.00 0.00 57.85 57.31 1ojo n ARG 258 Cb 0.53 -1.63 0.24 0.00 -1.05 0.00 0.00 32.46 30.56 1ojo n ARG 258 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1ojo n TYR 259 N -1.76 0.66 -1.68 2.89 4.01 -1.26 -4.88 117.16 115.14 1ojo n TYR 259 Ca 0.03 -0.36 -0.48 0.00 -0.16 0.00 0.00 57.90 56.94 1ojo n TYR 259 Cb 0.21 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.19 1ojo n TYR 259 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 1ojo n TYR 260 N 1.45 2.32 -2.39 -0.72 9.36 -0.82 -1.23 117.16 125.13 1ojo n TYR 260 Ca 0.20 0.04 -0.12 0.00 3.32 0.00 0.00 57.90 61.35 1ojo n TYR 260 Cb 0.59 -2.64 -0.01 0.00 -0.63 0.00 0.00 39.34 36.65 1ojo n TYR 260 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1ojo n GLN 261 N 6.13 -2.21 -2.17 2.98 6.02 -0.14 -4.89 117.38 123.11 1ojo n GLN 261 Ca 0.22 0.58 -0.42 0.00 -0.01 0.00 0.00 57.00 57.36 1ojo n GLN 261 Cb 0.29 -5.15 -0.03 0.00 1.02 0.00 0.00 30.24 26.37 1ojo n GLN 261 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1ojo s ASP 262 N -2.03 6.81 0.30 1.08 -1.08 -0.37 -4.91 116.67 116.47 1ojo s ASP 262 Ca 0.00 2.22 -0.01 0.00 -0.52 0.00 0.00 52.55 54.24 1ojo s ASP 262 Cb 0.00 -2.57 0.48 0.00 -1.46 0.00 0.00 42.92 39.37 1ojo s ASP 262 CO 0.00 -0.73 1.95 -0.08 0.52 0.00 0.00 175.17 176.83 1ojo h GLU 263 N 7.67 1.05 -0.19 4.34 4.81 -1.90 -0.82 114.58 129.54 1ojo h GLU 263 Ca -0.40 -0.06 -0.19 0.00 -0.13 0.00 0.00 59.36 58.58 1ojo h GLU 263 Cb 1.19 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.33 1ojo h GLU 263 CO 0.90 0.70 -0.64 1.79 -0.73 0.00 0.00 179.01 181.02 1ojo h THR 264 N 1.08 1.31 -0.25 0.32 1.35 -1.98 -2.44 112.91 112.31 1ojo h THR 264 Ca 0.34 -1.88 -0.20 0.00 -0.55 0.00 0.00 66.41 64.11 1ojo h THR 264 Cb -0.00 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 1ojo h THR 264 CO -0.10 0.59 -0.62 0.58 -0.25 0.00 0.00 175.52 175.72 1ojo h VAL 265 N 0.50 1.27 -0.62 6.82 2.07 -1.83 0.03 116.25 124.48 1ojo h VAL 265 Ca -0.01 -1.81 -0.00 0.00 0.82 0.00 0.00 66.70 65.70 1ojo h VAL 265 Cb 1.23 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 32.70 1ojo h VAL 265 CO 0.13 0.59 0.39 0.58 0.02 0.00 0.00 177.57 179.27 1ojo h VAL 266 N 0.64 1.18 -0.10 2.57 2.07 -1.16 -0.98 116.25 120.46 1ojo h VAL 266 Ca -0.01 -0.37 -0.17 0.00 0.82 0.00 0.00 66.70 66.98 1ojo h VAL 266 Cb 1.24 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 1ojo h VAL 266 CO 0.14 0.18 -0.67 -0.09 0.02 0.00 0.00 177.57 177.15 1ojo h ARG 267 N 0.85 0.39 -0.63 1.57 2.43 -1.40 -2.44 114.38 115.15 1ojo h ARG 267 Ca 0.23 -0.29 -0.03 0.00 -0.81 0.00 0.00 59.98 59.08 1ojo h ARG 267 Cb -0.05 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.53 1ojo h ARG 267 CO -0.04 0.92 0.29 1.15 -1.51 0.00 0.00 179.97 180.78 1ojo h THR 268 N 0.28 1.22 -0.15 0.20 2.02 -0.52 0.29 112.91 116.25 1ojo h THR 268 Ca -0.02 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.50 1ojo h THR 268 Cb 1.22 0.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.10 1ojo h THR 268 CO 0.11 0.26 -0.01 0.58 0.37 0.00 0.00 175.52 176.83 1ojo h VAL 269 N 0.86 1.27 -0.05 3.16 2.07 -1.16 0.02 116.25 122.42 1ojo h VAL 269 Ca 0.21 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.83 1ojo h VAL 269 Cb 0.13 1.57 -0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1ojo h VAL 269 CO -0.03 0.27 0.03 0.03 0.02 0.00 0.00 177.57 177.89 1ojo h ARG 270 N -0.00 0.07 -0.76 1.57 3.08 -1.25 -1.34 114.38 115.74 1ojo h ARG 270 Ca 0.04 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 1ojo h ARG 270 Cb 0.41 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1ojo h ARG 270 CO 0.01 0.10 0.32 -0.44 -1.07 0.00 0.00 179.97 178.89 1ojo h ASP 271 N 0.02 1.04 -0.65 7.04 3.32 -0.43 -2.28 116.42 124.48 1ojo h ASP 271 Ca 0.02 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.86 1ojo h ASP 271 Cb 0.04 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.30 1ojo h ASP 271 CO -0.00 0.91 0.21 0.28 -1.72 0.00 0.00 179.24 178.92 1ojo h SER 272 N 1.09 0.94 -0.40 6.45 0.02 -0.82 0.52 113.55 121.35 1ojo h SER 272 Ca 0.26 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1ojo h SER 272 Cb 0.19 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 1ojo h SER 272 CO -0.02 0.89 0.23 0.24 -1.14 0.00 0.00 176.83 177.03 1ojo h MET 273 N 0.93 0.55 -0.40 3.45 2.86 -1.05 -1.30 114.93 119.97 1ojo h MET 273 Ca 0.21 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.78 1ojo h MET 273 Cb 0.28 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.81 1ojo h MET 273 CO -0.01 0.42 0.19 1.49 1.06 0.00 0.00 176.91 180.06 1ojo h GLU 274 N 0.52 0.58 -0.07 1.72 4.57 -1.10 -0.32 114.58 120.48 1ojo h GLU 274 Ca 0.14 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1ojo h GLU 274 Cb 0.02 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.50 1ojo h GLU 274 CO -0.03 0.52 0.05 2.35 -1.18 0.00 0.00 179.01 180.72 1ojo h TRP 275 N 0.51 0.09 -0.82 0.92 7.01 -0.66 -0.33 115.95 122.68 1ojo h TRP 275 Ca 0.14 0.00 -0.04 0.00 2.11 0.00 0.00 58.89 61.10 1ojo h TRP 275 Cb 0.13 -0.03 -0.04 0.00 -2.10 0.00 0.00 29.16 27.12 1ojo h TRP 275 CO -0.01 0.08 0.37 0.52 -2.79 0.00 0.00 178.44 176.61 1ojo h MET 276 N 0.08 1.20 -0.80 2.65 2.86 -1.17 -0.92 114.93 118.83 1ojo h MET 276 Ca 0.03 -0.19 -0.02 0.00 -2.06 0.00 0.00 59.70 57.45 1ojo h MET 276 Cb 0.01 -0.21 -0.04 0.00 0.06 0.00 0.00 31.60 31.43 1ojo h MET 276 CO -0.01 0.94 0.41 1.25 1.06 0.00 0.00 176.91 180.57 1ojo h HIS 277 N 1.18 1.12 0.12 -0.22 -0.00 -0.71 0.29 115.15 116.94 1ojo h HIS 277 Ca 0.28 -0.04 -0.29 0.00 -0.00 0.00 0.00 60.37 60.32 1ojo h HIS 277 Cb 0.16 -0.35 0.02 0.00 -0.00 0.00 0.00 27.41 27.24 1ojo h HIS 277 CO 0.02 0.80 -1.23 0.87 -0.00 0.00 0.00 177.93 178.38 1ojo h LYS 278 N 1.13 0.51 -0.01 5.26 1.57 -0.69 -3.39 116.57 120.95 1ojo h LYS 278 Ca 0.28 -0.71 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1ojo h LYS 278 Cb 0.08 0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.63 1ojo h LYS 278 CO -0.04 1.31 0.00 0.72 -0.57 0.00 0.00 179.45 180.87 1ojo n HIS 279 N -3.72 0.00 0.00 -1.35 8.25 -0.38 -4.93 115.22 113.09 1ojo n HIS 279 Ca -0.12 -0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 1ojo n HIS 279 Cb 0.99 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.09 1ojo n HIS 279 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1ojo n VAL 280 N 0.08 0.00 -3.75 1.59 0.31 0.70 -5.03 118.33 112.23 1ojo n VAL 280 Ca 0.01 0.00 -0.29 0.00 -0.01 0.00 0.00 64.34 64.05 1ojo n VAL 280 Cb 0.06 -0.28 -0.15 0.00 -0.91 0.00 0.00 33.84 32.56 1ojo n VAL 280 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1ojo s TYR 281 N -1.49 1.59 0.25 3.52 5.04 0.60 -4.99 117.35 121.86 1ojo s TYR 281 Ca 0.00 -1.52 -0.16 0.00 -2.44 0.00 0.00 57.07 52.96 1ojo s TYR 281 Cb 0.00 -1.53 0.01 0.00 0.35 0.00 0.00 41.96 40.79 1ojo s TYR 281 CO 0.00 -0.80 0.55 0.54 -1.34 0.00 0.00 175.55 174.50 1ojo s ASN 282 N 1.66 -0.17 0.63 4.32 6.03 -1.26 -4.22 114.94 121.94 1ojo s ASN 282 Ca 0.06 -0.75 0.31 0.00 -1.03 0.00 0.00 52.86 51.44 1ojo s ASN 282 Cb -0.17 0.62 1.66 0.00 -3.03 0.00 0.00 41.25 40.33 1ojo s ASN 282 CO -0.20 -1.18 1.98 0.28 -2.03 0.00 0.00 177.10 175.96 1ojo h SER 283 N 2.18 0.00 0.40 3.54 0.02 -1.88 -0.03 113.55 117.77 1ojo h SER 283 Ca -0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.70 1ojo h SER 283 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1ojo h SER 283 CO 0.32 0.00 -0.11 -0.62 -1.14 0.00 0.00 176.83 175.28 1ojo n GLU 284 N -3.27 0.63 -2.66 3.45 1.02 -1.26 -4.89 120.64 113.66 1ojo n GLU 284 Ca 0.01 -0.20 -0.24 0.00 -0.02 0.00 0.00 57.16 56.71 1ojo n GLU 284 Cb 0.41 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.37 1ojo n GLU 284 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1ojo s LYS 285 N -2.51 2.81 0.12 3.49 -0.14 -0.03 -5.11 119.74 118.37 1ojo s LYS 285 Ca 0.28 -0.41 0.07 0.00 -1.36 0.00 0.00 55.97 54.55 1ojo s LYS 285 Cb 0.20 -2.42 -0.04 0.00 -1.68 0.00 0.00 37.83 33.89 1ojo s LYS 285 CO 0.48 -0.60 -0.17 -1.12 -0.76 0.00 0.00 175.35 173.18 1ojo s SER 286 N -4.32 2.30 -0.07 2.83 0.01 -1.26 -4.96 113.70 108.22 1ojo s SER 286 Ca 0.53 -0.77 -0.32 0.00 1.31 0.00 0.00 55.95 56.70 1ojo s SER 286 Cb -0.10 -0.11 -0.10 0.00 0.21 0.00 0.00 66.02 65.92 1ojo s SER 286 CO 0.41 -0.05 1.97 -0.38 0.41 0.00 0.00 173.24 175.60 1ojo n ILE 287 N 0.71 0.61 -4.03 1.44 5.41 -1.26 -4.95 119.36 117.30 1ojo n ILE 287 Ca -0.17 -0.16 -0.31 0.00 1.00 0.00 0.00 62.75 63.11 1ojo n ILE 287 Cb 0.56 -2.10 -0.15 0.00 -0.71 0.00 0.00 39.64 37.24 1ojo n ILE 287 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1ojo s VAL 288 N 4.83 2.03 0.00 1.39 1.01 -1.26 -4.99 120.40 123.41 1ojo s VAL 288 Ca 0.93 -1.67 0.00 0.00 0.00 0.00 0.00 61.98 61.24 1ojo s VAL 288 Cb -0.57 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 33.57 1ojo s VAL 288 CO 0.47 -0.16 0.00 0.61 0.00 0.00 0.00 175.10 176.02 1ojo n GLY 289 N 4.46 0.64 3.71 4.51 0.00 -1.26 -3.77 105.19 113.48 1ojo n GLY 289 Ca -0.10 -1.38 -0.37 0.00 0.00 0.00 0.00 46.02 44.17 1ojo n GLY 289 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ojo s ASN 290 N -4.00 6.43 0.47 1.61 3.84 -1.26 -4.97 114.94 117.06 1ojo s ASN 290 Ca 0.00 0.51 0.14 0.00 0.21 0.00 0.00 52.86 53.71 1ojo s ASN 290 Cb 0.00 -2.20 1.10 0.00 -0.55 0.00 0.00 41.25 39.60 1ojo s ASN 290 CO 0.00 0.04 2.07 4.11 -2.79 0.00 0.00 177.10 180.53 1ojo h TRP 291 N 6.95 0.25 -0.92 0.43 5.08 -1.96 -2.83 115.95 122.96 1ojo h TRP 291 Ca -0.39 0.01 0.10 0.00 1.08 0.00 0.00 58.89 59.68 1ojo h TRP 291 Cb 1.16 -0.08 -0.08 0.00 -3.00 0.00 0.00 29.16 27.16 1ojo h TRP 291 CO 0.63 0.15 0.56 2.35 -1.28 0.00 0.00 178.44 180.84 1ojo h TRP 292 N 0.26 1.01 -0.44 0.12 7.01 -1.97 0.03 115.95 121.98 1ojo h TRP 292 Ca 0.13 0.03 -0.13 0.00 2.11 0.00 0.00 58.89 61.03 1ojo h TRP 292 Cb 0.18 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 1ojo h TRP 292 CO -0.00 0.42 -0.23 -0.44 -2.79 0.00 0.00 178.44 175.41 1ojo h ASP 293 N 0.92 0.92 0.63 2.65 3.32 -1.83 0.29 116.42 123.32 1ojo h ASP 293 Ca 0.44 -0.35 -0.15 0.00 0.02 0.00 0.00 57.03 57.00 1ojo h ASP 293 Cb 0.40 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.67 1ojo h ASP 293 CO -0.25 1.11 -0.69 1.88 -1.72 0.00 0.00 179.24 179.57 1ojo h TYR 294 N 0.78 0.06 0.00 4.55 -1.99 -1.41 -0.44 116.97 118.52 1ojo h TYR 294 Ca 0.10 -0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.80 1ojo h TYR 294 Cb 0.78 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.50 1ojo h TYR 294 CO 0.05 0.72 -1.46 0.39 -0.00 0.00 0.00 178.16 177.85 1ojo n GLU 295 N -3.74 0.67 0.05 4.88 1.02 -0.08 -4.54 120.64 118.89 1ojo n GLU 295 Ca -0.01 -0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 1ojo n GLU 295 Cb 0.67 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.82 1ojo n GLU 295 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1ojo n ILE 296 N -1.86 0.57 0.13 -3.67 5.41 0.85 -4.70 119.36 116.09 1ojo n ILE 296 Ca -0.02 0.19 -0.17 0.00 1.00 0.00 0.00 62.75 63.76 1ojo n ILE 296 Cb 0.31 -1.07 -0.10 0.00 -0.71 0.00 0.00 39.64 38.08 1ojo n ILE 296 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1ojo h GLY 297 N 0.00 -1.15 0.75 7.39 0.00 -1.16 -1.83 103.07 107.06 1ojo h GLY 297 Ca 0.00 0.64 -0.02 0.00 0.00 0.00 0.00 47.33 47.95 1ojo h GLY 297 CO 0.00 -0.28 -0.00 -0.84 0.00 0.00 0.00 176.54 175.42 1ojo h THR 298 N -0.77 1.26 -0.79 4.70 2.02 -1.30 -2.70 112.91 115.33 1ojo h THR 298 Ca -0.01 -0.83 0.12 0.00 0.77 0.00 0.00 66.41 66.46 1ojo h THR 298 Cb 0.77 1.61 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 1ojo h THR 298 CO -0.27 0.24 0.52 -0.65 0.37 0.00 0.00 175.52 175.73 1ojo h PRO 299 N -0.10 0.59 -0.36 6.66 0.11 -1.73 0.42 132.00 137.58 1ojo h PRO 299 Ca 0.03 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.95 1ojo h PRO 299 Cb 0.37 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 31.34 1ojo h PRO 299 CO 0.01 0.39 -0.37 0.00 -0.21 0.00 0.00 178.00 177.82 1ojo h ARG 300 N 0.60 0.89 -0.45 1.05 3.08 -1.28 -0.76 114.38 117.51 1ojo h ARG 300 Ca 0.38 -0.47 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 1ojo h ARG 300 Cb 0.64 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 1ojo h ARG 300 CO -0.15 1.12 -0.13 0.00 -1.07 0.00 0.00 179.97 179.74 1ojo h ALA 301 N 0.75 0.93 -0.22 0.04 0.00 -0.90 -1.65 119.26 118.22 1ojo h ALA 301 Ca 0.06 -0.33 -0.07 0.00 0.00 0.00 0.00 54.91 54.56 1ojo h ALA 301 Cb 0.96 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1ojo h ALA 301 CO 0.09 0.62 -0.14 0.82 0.00 0.00 0.00 179.25 180.64 1ojo h ILE 302 N 0.74 1.31 -0.29 0.00 2.04 -0.91 -1.93 117.51 118.47 1ojo h ILE 302 Ca 0.12 -1.24 0.03 0.00 1.00 0.00 0.00 64.86 64.76 1ojo h ILE 302 Cb 0.63 1.64 -0.03 0.00 -0.74 0.00 0.00 36.82 38.32 1ojo h ILE 302 CO 0.04 0.38 0.12 0.78 0.00 0.00 0.00 178.15 179.48 1ojo h ASN 303 N 0.19 0.16 -0.62 1.72 2.35 -0.98 -1.46 115.58 116.93 1ojo h ASN 303 Ca 0.05 0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.73 1ojo h ASN 303 Cb 0.66 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 1ojo h ASN 303 CO 0.04 0.13 0.02 0.78 -1.65 0.00 0.00 177.43 176.75 1ojo h ASN 304 N 0.26 1.06 0.12 5.81 4.21 -1.32 0.43 115.58 126.16 1ojo h ASN 304 Ca 0.13 -0.29 -0.01 0.00 1.21 0.00 0.00 56.30 57.34 1ojo h ASN 304 Cb 0.08 -0.28 0.00 0.00 -1.12 0.00 0.00 38.32 36.99 1ojo h ASN 304 CO -0.11 1.10 -0.06 0.74 -1.29 0.00 0.00 177.43 177.81 1ojo h THR 305 N 1.00 0.91 -0.51 2.81 2.02 -1.10 -0.18 112.91 117.87 1ojo h THR 305 Ca 0.18 -0.11 -0.07 0.00 0.77 0.00 0.00 66.41 67.19 1ojo h THR 305 Cb 0.54 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.91 1ojo h THR 305 CO 0.03 0.03 0.05 -0.07 0.37 0.00 0.00 175.52 175.92 1ojo h LEU 306 N -0.21 0.78 -0.28 2.58 3.38 -1.20 -1.35 115.31 119.02 1ojo h LEU 306 Ca -0.02 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.75 1ojo h LEU 306 Cb 0.16 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1ojo h LEU 306 CO 0.03 0.82 0.05 -1.28 0.09 0.00 0.00 178.44 178.14 1ojo h SER 307 N 0.77 0.45 -0.53 -0.43 0.87 -0.68 -0.48 113.55 113.52 1ojo h SER 307 Ca 0.16 -0.26 -0.06 0.00 -1.23 0.00 0.00 61.79 60.40 1ojo h SER 307 Cb 0.40 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 1ojo h SER 307 CO 0.01 0.59 0.11 -0.07 -0.53 0.00 0.00 176.83 176.95 1ojo h LEU 308 N 0.29 0.82 -3.90 2.23 3.38 -0.88 -3.17 115.31 114.08 1ojo h LEU 308 Ca 0.09 -0.24 -0.56 0.00 0.09 0.00 0.00 57.88 57.25 1ojo h LEU 308 Cb 0.34 -0.22 -0.29 0.00 0.09 0.00 0.00 40.66 40.58 1ojo h LEU 308 CO 0.01 0.85 0.52 0.23 0.09 0.00 0.00 178.44 180.14 1ojo n MET 309 N -4.41 2.55 0.24 1.13 2.81 -0.52 -4.66 117.12 114.25 1ojo n MET 309 Ca 0.02 -3.29 0.16 0.00 -1.81 0.00 0.00 57.70 52.78 1ojo n MET 309 Cb 0.24 -2.20 0.76 0.00 -0.71 0.00 0.00 33.22 31.31 1ojo n MET 309 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1ojo h LYS 310 N 1.60 0.00 -0.14 0.03 2.10 -1.05 -1.63 116.57 117.48 1ojo h LYS 310 Ca 0.55 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.20 1ojo h LYS 310 Cb 1.62 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.95 1ojo h LYS 310 CO 1.22 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 179.06 1ojo n GLU 311 N -2.72 1.55 0.00 0.07 1.02 -1.26 -3.50 120.64 115.80 1ojo n GLU 311 Ca -0.00 -0.82 0.00 0.00 -0.02 0.00 0.00 57.16 56.31 1ojo n GLU 311 Cb 0.17 -1.35 -0.00 0.00 -0.02 0.00 0.00 31.44 30.24 1ojo n GLU 311 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1ojo n TYR 312 N 0.06 0.00 -4.43 -0.32 4.01 -0.62 -5.03 117.16 110.83 1ojo n TYR 312 Ca 0.15 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.60 1ojo n TYR 312 Cb 0.26 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.16 1ojo n TYR 312 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1ojo s PHE 313 N -0.73 2.39 0.46 -0.72 0.08 -1.18 -5.09 117.98 113.18 1ojo s PHE 313 Ca 0.00 -0.34 -0.07 0.00 0.12 0.00 0.00 56.93 56.64 1ojo s PHE 313 Cb 0.00 -1.30 -0.05 0.00 -0.57 0.00 0.00 43.02 41.11 1ojo s PHE 313 CO 0.01 0.33 0.78 -1.54 -0.10 0.00 0.00 175.22 174.70 1ojo s SER 314 N -1.98 6.35 0.54 1.36 1.04 -1.26 -4.90 113.70 114.85 1ojo s SER 314 Ca 0.15 1.00 0.20 0.00 0.48 0.00 0.00 55.95 57.78 1ojo s SER 314 Cb -0.10 -2.28 1.39 0.00 0.10 0.00 0.00 66.02 65.13 1ojo s SER 314 CO 0.07 -0.52 2.14 0.44 0.98 0.00 0.00 173.24 176.35 1ojo h ASP 315 N 0.58 0.00 -0.35 7.02 3.32 -1.97 -0.98 116.42 124.05 1ojo h ASP 315 Ca -0.47 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.49 1ojo h ASP 315 Cb 1.20 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.74 1ojo h ASP 315 CO 0.62 0.00 -0.15 -0.08 -1.72 0.00 0.00 179.24 177.92 1ojo h GLU 316 N 0.00 0.72 -0.34 3.56 4.81 -1.98 -2.26 114.58 119.08 1ojo h GLU 316 Ca 0.04 -0.30 -0.13 0.00 -0.13 0.00 0.00 59.36 58.83 1ojo h GLU 316 Cb 0.17 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1ojo h GLU 316 CO -0.00 0.91 -0.33 0.93 -0.73 0.00 0.00 179.01 179.79 1ojo h GLU 317 N 0.50 0.75 -0.23 1.92 5.08 -1.64 -0.89 114.58 120.08 1ojo h GLU 317 Ca 0.08 -0.35 -0.01 0.00 -1.00 0.00 0.00 59.36 58.08 1ojo h GLU 317 Cb 0.68 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1ojo h GLU 317 CO 0.05 0.97 0.11 0.82 -1.00 0.00 0.00 179.01 179.96 1ojo h ILE 318 N 0.63 1.13 -0.42 3.13 2.04 -1.18 0.03 117.51 122.88 1ojo h ILE 318 Ca 0.07 -0.38 -0.08 0.00 1.00 0.00 0.00 64.86 65.47 1ojo h ILE 318 Cb 0.86 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.89 1ojo h ILE 318 CO 0.08 0.13 -0.06 0.11 0.00 0.00 0.00 178.15 178.40 1ojo h LYS 319 N 0.24 0.72 -0.25 2.37 1.57 -1.31 -1.98 116.57 117.92 1ojo h LYS 319 Ca 0.08 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 1ojo h LYS 319 Cb 0.11 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1ojo h LYS 319 CO -0.01 0.77 0.14 -0.22 -0.57 0.00 0.00 179.45 179.56 1ojo h LYS 320 N 0.66 0.36 0.00 3.15 3.64 -0.70 -1.51 116.57 122.17 1ojo h LYS 320 Ca 0.12 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1ojo h LYS 320 Cb 0.50 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1ojo h LYS 320 CO 0.03 0.32 0.00 0.66 -2.27 0.00 0.00 179.45 178.19 1ojo n TYR 321 N -4.85 0.00 0.55 1.91 4.01 -0.04 -3.12 117.16 115.62 1ojo n TYR 321 Ca -0.03 0.00 0.06 0.00 -0.16 0.00 0.00 57.90 57.78 1ojo n TYR 321 Cb 0.08 -0.40 0.03 0.00 -0.31 0.00 0.00 39.34 38.74 1ojo n TYR 321 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1ojo n THR 322 N -1.40 0.00 -0.32 -0.72 -2.24 -0.76 -4.50 114.28 104.34 1ojo n THR 322 Ca 0.09 -0.43 -0.04 0.00 -2.27 0.00 0.00 64.05 61.40 1ojo n THR 322 Cb 0.26 1.21 0.08 0.00 -2.10 0.00 0.00 70.33 69.78 1ojo n THR 322 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1ojo h ASP 323 N 1.94 1.04 -0.51 3.42 3.45 -1.22 -1.84 116.42 122.70 1ojo h ASP 323 Ca 0.00 -0.06 0.06 0.00 0.43 0.00 0.00 57.03 57.46 1ojo h ASP 323 Cb 0.48 -0.26 -0.03 0.00 -0.56 0.00 0.00 39.33 38.96 1ojo h ASP 323 CO 0.00 0.79 0.34 1.62 -1.57 0.00 0.00 179.24 180.42 1ojo h VAL 324 N 1.19 0.97 -0.53 -1.35 3.04 -1.79 -0.91 116.25 116.87 1ojo h VAL 324 Ca 0.31 -0.15 -0.10 0.00 -1.01 0.00 0.00 66.70 65.76 1ojo h VAL 324 Cb -0.06 0.49 -0.02 0.00 -2.01 0.00 0.00 31.29 29.69 1ojo h VAL 324 CO -0.06 0.08 -0.05 0.40 -1.01 0.00 0.00 177.57 176.93 1ojo h ILE 325 N 0.44 1.26 0.00 3.17 2.04 -1.62 -1.97 117.51 120.84 1ojo h ILE 325 Ca 0.22 -1.16 -0.09 0.00 1.00 0.00 0.00 64.86 64.84 1ojo h ILE 325 Cb 0.31 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1ojo h ILE 325 CO -0.06 0.41 -0.43 -0.33 0.00 0.00 0.00 178.15 177.74 1ojo h GLU 326 N 0.85 0.00 -0.18 2.37 4.39 -1.05 0.27 114.58 121.24 1ojo h GLU 326 Ca 0.15 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.70 1ojo h GLU 326 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1ojo h GLU 326 CO 0.03 0.43 -0.49 -0.22 -1.16 0.00 0.00 179.01 177.60 1ojo h LYS 327 N 0.00 0.65 0.00 2.33 3.11 -0.90 -2.76 116.57 119.00 1ojo h LYS 327 Ca -0.00 -0.46 -0.18 0.00 -2.81 0.00 0.00 60.65 57.20 1ojo h LYS 327 Cb 0.89 0.07 -0.03 0.00 -1.00 0.00 0.00 32.23 32.17 1ojo h LYS 327 CO 0.06 1.08 -1.13 0.74 -2.81 0.00 0.00 179.45 177.38 1ojo h PHE 328 N 0.33 0.00 -2.05 1.91 0.04 -1.27 -3.41 116.94 112.49 1ojo h PHE 328 Ca -0.01 0.00 -0.56 0.00 2.80 0.00 0.00 57.97 60.20 1ojo h PHE 328 Cb 1.10 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.86 1ojo h PHE 328 CO 0.09 0.71 -1.00 0.28 -0.60 0.00 0.00 178.31 177.79 1ojo n VAL 329 N -3.10 0.06 0.14 -0.55 0.31 0.94 -4.47 118.33 111.65 1ojo n VAL 329 Ca -0.06 -4.34 0.06 0.00 -0.01 0.00 0.00 64.34 59.99 1ojo n VAL 329 Cb 0.87 -1.86 0.04 0.00 -0.91 0.00 0.00 33.84 31.98 1ojo n VAL 329 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1ojo h PRO 330 N 3.95 0.00 -4.73 5.55 0.13 -1.68 -3.42 132.00 131.79 1ojo h PRO 330 Ca 0.10 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.54 1ojo h PRO 330 Cb 0.83 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 31.70 1ojo h PRO 330 CO 0.55 0.25 -0.60 0.34 -0.23 0.00 0.00 178.00 178.31 1ojo s ASP 331 N -6.11 5.28 0.00 1.44 2.15 -1.26 -4.98 116.67 113.20 1ojo s ASP 331 Ca 0.03 -0.88 0.09 0.00 0.43 0.00 0.00 52.55 52.22 1ojo s ASP 331 Cb 0.07 -1.90 0.40 0.00 -0.30 0.00 0.00 42.92 41.20 1ojo s ASP 331 CO 0.74 -0.26 1.20 -0.81 -0.17 0.00 0.00 175.17 175.87 1ojo n PRO 332 N 4.87 0.07 -0.00 4.34 -0.04 -1.26 -2.45 135.00 140.53 1ojo n PRO 332 Ca -0.13 0.27 0.09 0.00 -0.04 0.00 0.00 63.50 63.68 1ojo n PRO 332 Cb 0.47 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.32 1ojo n PRO 332 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ojo n GLU 333 N -1.37 0.95 -4.08 0.54 1.02 -1.26 -4.85 120.64 111.59 1ojo n GLU 333 Ca 0.03 -0.03 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 1ojo n GLU 333 Cb 0.08 -1.37 -0.11 0.00 -0.02 0.00 0.00 31.44 30.03 1ojo n GLU 333 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1ojo s HIS 334 N -2.81 0.60 0.30 -0.32 3.76 -1.02 -0.97 115.29 114.83 1ojo s HIS 334 Ca 0.04 -0.76 0.11 0.00 -0.15 0.00 0.00 55.06 54.29 1ojo s HIS 334 Cb 0.13 -0.38 -0.05 0.00 1.11 0.00 0.00 32.58 33.39 1ojo s HIS 334 CO 0.75 -0.20 -0.11 -0.06 -0.85 0.00 0.00 174.74 174.27 1ojo s PHE 335 N -2.65 2.42 -1.46 1.40 0.08 -0.54 -4.66 117.98 112.57 1ojo s PHE 335 Ca -0.01 -0.37 -0.03 0.00 0.12 0.00 0.00 56.93 56.64 1ojo s PHE 335 Cb -0.01 -1.20 0.00 0.00 -0.57 0.00 0.00 43.02 41.24 1ojo s PHE 335 CO -0.04 0.63 0.40 0.54 -0.10 0.00 0.00 175.22 176.65 1ojo n ARG 336 N -0.76 -3.64 -0.03 0.44 1.74 -1.26 -1.42 116.66 111.72 1ojo n ARG 336 Ca -0.05 0.85 0.02 0.00 -0.77 0.00 0.00 57.85 57.90 1ojo n ARG 336 Cb 0.61 -5.48 0.36 0.00 -1.02 0.00 0.00 32.46 26.93 1ojo n ARG 336 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1ojo h LYS 337 N -0.92 0.61 -0.01 5.56 1.63 -1.83 -2.24 116.57 119.36 1ojo h LYS 337 Ca -0.47 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 1ojo h LYS 337 Cb 1.33 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.84 1ojo h LYS 337 CO 0.52 0.46 -0.02 0.25 -3.45 0.00 0.00 179.45 177.21 1ojo n THR 338 N -4.42 0.00 -2.76 1.00 -2.24 -1.26 -4.88 114.28 99.72 1ojo n THR 338 Ca 0.03 -0.16 -0.16 0.00 -2.27 0.00 0.00 64.05 61.50 1ojo n THR 338 Cb 0.10 0.17 0.07 0.00 -2.10 0.00 0.00 70.33 68.57 1ojo n THR 338 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ojo n THR 339 N -0.27 0.00 -0.80 4.28 -2.24 -0.85 -5.00 114.28 109.41 1ojo n THR 339 Ca 0.20 -1.28 -0.03 0.00 -2.27 0.00 0.00 64.05 60.66 1ojo n THR 339 Cb 0.28 -0.84 0.29 0.00 -2.10 0.00 0.00 70.33 67.96 1ojo n THR 339 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1ojo n ASP 340 N -2.73 4.69 -2.72 3.42 9.92 -1.26 -4.50 116.55 123.37 1ojo n ASP 340 Ca 0.12 -3.04 -0.07 0.00 -0.53 0.00 0.00 54.79 51.26 1ojo n ASP 340 Cb 0.44 -0.72 0.07 0.00 -0.64 0.00 0.00 41.12 40.27 1ojo n ASP 340 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1ojo n ASN 341 N 0.02 -2.37 -4.62 -2.24 0.23 -1.26 -5.16 115.26 99.86 1ojo n ASN 341 Ca 0.35 -3.05 -0.29 0.00 -0.53 0.00 0.00 54.58 51.06 1ojo n ASN 341 Cb 1.26 1.63 0.20 0.00 -2.08 0.00 0.00 39.78 40.79 1ojo n ASN 341 CO 0.00 0.00 0.00 -2.84 -0.93 0.00 0.00 177.26 173.49 1ojo s PRO 342 N 0.44 0.02 0.00 -0.53 0.02 -1.22 -4.89 135.00 128.85 1ojo s PRO 342 Ca 0.27 0.61 -0.13 0.00 0.02 0.00 0.00 61.00 61.78 1ojo s PRO 342 Cb 0.25 -1.68 0.02 0.00 0.02 0.00 0.00 34.50 33.10 1ojo s PRO 342 CO -0.17 -3.03 0.27 -0.59 -0.33 0.00 0.00 177.00 173.15 1ojo s PHE 343 N -2.82 -0.11 0.00 6.54 -0.12 -0.51 -4.98 117.98 115.98 1ojo s PHE 343 Ca 0.66 0.10 -0.30 0.00 -0.05 0.00 0.00 56.93 57.34 1ojo s PHE 343 Cb -0.20 0.06 -0.06 0.00 -0.63 0.00 0.00 43.02 42.19 1ojo s PHE 343 CO 0.60 -0.39 1.47 0.21 -0.05 0.00 0.00 175.22 177.05 1ojo s LYS 344 N -1.64 4.26 -0.09 1.99 2.47 -1.26 -1.47 119.74 124.00 1ojo s LYS 344 Ca -0.12 2.04 -0.30 0.00 -1.56 0.00 0.00 55.97 56.04 1ojo s LYS 344 Cb -0.05 -3.62 -0.02 0.00 -1.46 0.00 0.00 37.83 32.69 1ojo s LYS 344 CO 0.02 -0.63 1.04 0.00 0.16 0.00 0.00 175.35 175.94 1ojo s ALA 345 N 2.61 3.40 0.24 3.13 0.00 -0.14 -4.90 121.76 126.10 1ojo s ALA 345 Ca 0.66 0.44 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 1ojo s ALA 345 Cb -0.33 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.32 1ojo s ALA 345 CO 0.27 -0.60 0.28 -0.51 0.00 0.00 0.00 175.76 175.20 1ojo s LEU 346 N 1.96 0.96 0.00 0.00 1.43 -1.26 -4.67 118.68 117.09 1ojo s LEU 346 Ca 0.50 -1.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.29 1ojo s LEU 346 Cb -0.20 0.90 0.00 0.00 0.03 0.00 0.00 46.19 46.92 1ojo s LEU 346 CO 0.20 -0.99 0.00 0.61 0.23 0.00 0.00 176.35 176.39 1ojo n GLY 347 N -0.36 2.30 0.23 -3.19 0.00 -1.26 -1.70 105.19 101.21 1ojo n GLY 347 Ca 0.01 -0.22 0.01 0.00 0.00 0.00 0.00 46.02 45.82 1ojo n GLY 347 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ojo h GLY 348 N 0.00 0.81 0.76 -0.02 0.00 -1.92 -1.00 103.07 101.69 1ojo h GLY 348 Ca 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 47.33 47.34 1ojo h GLY 348 CO 0.00 -0.10 0.56 3.43 0.00 0.00 0.00 176.54 180.43 1ojo h ASN 349 N 0.29 0.89 -0.24 0.19 -0.26 -1.82 -0.30 115.58 114.33 1ojo h ASN 349 Ca 0.32 0.01 -0.05 0.00 -0.56 0.00 0.00 56.30 56.02 1ojo h ASN 349 Cb 0.47 -0.18 -0.02 0.00 -1.06 0.00 0.00 38.32 37.53 1ojo h ASN 349 CO -0.39 0.58 -0.00 0.25 -1.06 0.00 0.00 177.43 176.81 1ojo h LEU 350 N 1.03 0.51 -0.36 1.61 5.85 -0.31 0.07 115.31 123.70 1ojo h LEU 350 Ca 0.38 -0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.88 1ojo h LEU 350 Cb 0.14 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1ojo h LEU 350 CO -0.16 0.58 -0.24 0.58 -0.34 0.00 0.00 178.44 178.86 1ojo h VAL 351 N 0.52 1.29 0.00 1.05 2.07 -0.34 -2.54 116.25 118.30 1ojo h VAL 351 Ca 0.11 -1.38 -0.04 0.00 0.82 0.00 0.00 66.70 66.21 1ojo h VAL 351 Cb 0.34 1.39 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1ojo h VAL 351 CO 0.01 0.46 -0.20 0.44 0.02 0.00 0.00 177.57 178.30 1ojo h ASP 352 N 0.58 0.00 -0.15 0.57 3.32 -0.47 -0.04 116.42 120.23 1ojo h ASP 352 Ca 0.07 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 1ojo h ASP 352 Cb 0.80 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 1ojo h ASP 352 CO 0.06 0.20 0.08 -0.03 -1.72 0.00 0.00 179.24 177.84 1ojo h MET 353 N 0.00 0.24 -0.15 3.56 4.05 -0.58 -1.20 114.93 120.86 1ojo h MET 353 Ca -0.00 -0.02 -0.15 0.00 -0.28 0.00 0.00 59.70 59.25 1ojo h MET 353 Cb 0.35 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 31.11 1ojo h MET 353 CO 0.03 0.20 -0.49 0.78 0.23 0.00 0.00 176.91 177.65 1ojo h GLY 354 N 0.34 0.66 1.88 1.39 0.00 -0.84 -0.15 103.07 106.34 1ojo h GLY 354 Ca 0.07 -0.86 0.00 0.00 0.00 0.00 0.00 47.33 46.53 1ojo h GLY 354 CO -0.01 0.77 0.00 0.54 0.00 0.00 0.00 176.54 177.84 1ojo n ARG 355 N -4.20 0.06 -0.08 4.80 1.74 -0.71 -0.78 116.66 117.49 1ojo n ARG 355 Ca -0.07 0.22 -0.08 0.00 -0.77 0.00 0.00 57.85 57.15 1ojo n ARG 355 Cb 0.59 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.50 1ojo n ARG 355 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1ojo n VAL 356 N -1.44 1.36 0.10 1.55 0.31 -0.53 -4.45 118.33 115.23 1ojo n VAL 356 Ca 0.04 0.17 -0.02 0.00 -0.01 0.00 0.00 64.34 64.53 1ojo n VAL 356 Cb 0.15 -2.27 -0.04 0.00 -0.91 0.00 0.00 33.84 30.77 1ojo n VAL 356 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1ojo h LYS 357 N -0.91 0.00 -0.13 5.55 1.57 -1.06 -1.85 116.57 119.74 1ojo h LYS 357 Ca 0.00 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.65 1ojo h LYS 357 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1ojo h LYS 357 CO 0.00 0.69 -0.43 0.28 -0.57 0.00 0.00 179.45 179.42 1ojo h VAL 358 N 0.00 1.36 -0.27 0.50 2.07 -1.12 0.14 116.25 118.94 1ojo h VAL 358 Ca -0.02 -1.72 -0.10 0.00 0.82 0.00 0.00 66.70 65.68 1ojo h VAL 358 Cb 1.56 2.09 -0.00 0.00 -1.52 0.00 0.00 31.29 33.41 1ojo h VAL 358 CO 0.09 0.52 -0.23 0.40 0.02 0.00 0.00 177.57 178.37 1ojo h ILE 359 N 0.14 1.31 -0.75 4.57 1.08 -1.66 -1.00 117.51 121.20 1ojo h ILE 359 Ca -0.02 -1.39 -0.02 0.00 -0.39 0.00 0.00 64.86 63.04 1ojo h ILE 359 Cb 1.05 1.60 -0.04 0.00 -3.07 0.00 0.00 36.82 36.37 1ojo h ILE 359 CO 0.09 0.44 0.37 0.00 -0.69 0.00 0.00 178.15 178.36 1ojo h ALA 360 N 0.70 1.24 -0.80 1.87 0.00 -1.37 0.69 119.26 121.59 1ojo h ALA 360 Ca 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1ojo h ALA 360 Cb 0.79 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.24 1ojo h ALA 360 CO 0.06 0.59 0.43 0.78 0.00 0.00 0.00 179.25 181.11 1ojo h GLY 361 N 1.11 1.21 1.00 0.00 0.00 -0.44 0.16 103.07 106.10 1ojo h GLY 361 Ca 0.26 -0.56 -0.10 0.00 0.00 0.00 0.00 47.33 46.94 1ojo h GLY 361 CO -0.04 0.53 -0.13 1.41 0.00 0.00 0.00 176.54 178.32 1ojo h LEU 362 N 1.12 0.82 -1.10 3.11 3.38 -0.37 0.15 115.31 122.41 1ojo h LEU 362 Ca 0.28 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 1ojo h LEU 362 Cb 0.04 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1ojo h LEU 362 CO -0.04 1.01 -0.15 -0.07 0.09 0.00 0.00 178.44 179.28 1ojo h LEU 363 N 0.62 0.45 -1.62 1.67 3.38 -0.49 -2.55 115.31 116.77 1ojo h LEU 363 Ca 0.10 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ojo h LEU 363 Cb 0.67 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1ojo h LEU 363 CO 0.05 0.62 0.00 0.54 0.09 0.00 0.00 178.44 179.74 1ojo n ARG 364 N -4.20 2.07 -4.03 1.13 1.74 0.53 -4.75 116.66 109.15 1ojo n ARG 364 Ca 0.00 -1.60 -0.30 0.00 -0.77 0.00 0.00 57.85 55.18 1ojo n ARG 364 Cb 0.33 -1.45 -0.01 0.00 -1.02 0.00 0.00 32.46 30.31 1ojo n ARG 364 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1ojo n LYS 365 N 0.84 -3.69 -3.56 5.56 5.02 0.24 -4.93 118.16 117.65 1ojo n LYS 365 Ca 0.17 0.43 -0.41 0.00 -2.02 0.00 0.00 58.31 56.49 1ojo n LYS 365 Cb 0.46 -4.92 -0.09 0.00 -0.02 0.00 0.00 35.03 30.46 1ojo n LYS 365 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ojo s ASP 366 N -3.82 5.69 0.28 4.39 -1.08 0.26 -4.97 116.67 117.44 1ojo s ASP 366 Ca 0.37 -1.83 -0.02 0.00 -0.52 0.00 0.00 52.55 50.55 1ojo s ASP 366 Cb -0.20 -2.01 0.40 0.00 -1.46 0.00 0.00 42.92 39.65 1ojo s ASP 366 CO 0.89 -0.66 1.90 0.44 0.52 0.00 0.00 175.17 178.26 1ojo h ASP 367 N 8.44 0.91 -0.46 -0.34 3.32 -1.91 -2.27 116.42 124.11 1ojo h ASP 367 Ca -0.22 -0.08 -0.09 0.00 0.02 0.00 0.00 57.03 56.67 1ojo h ASP 367 Cb 1.08 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.37 1ojo h ASP 367 CO 0.84 0.74 -0.03 -0.61 -1.72 0.00 0.00 179.24 178.46 1ojo h GLN 368 N 1.02 0.89 -0.49 3.56 -0.00 -1.97 0.07 115.11 118.19 1ojo h GLN 368 Ca 0.26 -0.27 -0.13 0.00 -0.00 0.00 0.00 58.65 58.51 1ojo h GLN 368 Cb 0.04 -0.09 -0.01 0.00 0.00 0.00 0.00 27.48 27.42 1ojo h GLN 368 CO -0.04 0.91 -0.20 1.49 0.00 0.00 0.00 178.83 180.98 1ojo h GLU 369 N 0.82 0.99 0.22 1.69 4.81 -1.88 -1.30 114.58 119.93 1ojo h GLU 369 Ca 0.15 -0.41 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 1ojo h GLU 369 Cb 0.53 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1ojo h GLU 369 CO 0.03 1.09 -0.11 0.82 -0.73 0.00 0.00 179.01 180.11 1ojo h ILE 370 N 0.86 0.84 0.20 2.32 2.04 -1.10 -1.91 117.51 120.76 1ojo h ILE 370 Ca 0.11 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 1ojo h ILE 370 Cb 0.78 1.10 0.00 0.00 -0.74 0.00 0.00 36.82 37.96 1ojo h ILE 370 CO 0.06 0.10 -0.09 0.77 0.00 0.00 0.00 178.15 178.99 1ojo h SER 371 N -0.52 -0.22 -0.92 1.72 4.64 -0.99 -1.58 113.55 115.66 1ojo h SER 371 Ca -0.03 -0.06 0.03 0.00 -0.47 0.00 0.00 61.79 61.26 1ojo h SER 371 Cb 0.39 0.06 -0.05 0.00 -0.31 0.00 0.00 62.40 62.49 1ojo h SER 371 CO 0.05 -0.09 0.61 0.77 -0.87 0.00 0.00 176.83 177.30 1ojo h SER 372 N -0.35 1.03 -0.28 4.97 4.64 -1.31 -0.32 113.55 121.93 1ojo h SER 372 Ca -0.03 -0.02 -0.05 0.00 -0.47 0.00 0.00 61.79 61.22 1ojo h SER 372 Cb 0.27 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1ojo h SER 372 CO 0.04 0.72 -0.03 0.74 -0.87 0.00 0.00 176.83 177.43 1ojo h THR 373 N 1.20 1.27 -0.76 2.95 2.02 -1.23 -1.18 112.91 117.19 1ojo h THR 373 Ca 0.36 -1.01 -0.01 0.00 0.77 0.00 0.00 66.41 66.51 1ojo h THR 373 Cb -0.05 1.37 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 1ojo h THR 373 CO -0.10 0.32 0.42 0.40 0.37 0.00 0.00 175.52 176.93 1ojo h ILE 374 N 0.28 1.23 -0.72 3.11 2.04 -0.93 0.13 117.51 122.65 1ojo h ILE 374 Ca 0.07 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.39 1ojo h ILE 374 Cb 0.48 0.22 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 1ojo h ILE 374 CO 0.02 0.25 0.48 -0.09 0.00 0.00 0.00 178.15 178.81 1ojo h ARG 375 N 1.04 0.94 -0.54 2.37 2.43 -0.90 -1.75 114.38 117.97 1ojo h ARG 375 Ca 0.27 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.32 1ojo h ARG 375 Cb 0.03 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1ojo h ARG 375 CO -0.04 0.62 0.10 1.03 -1.51 0.00 0.00 179.97 180.17 1ojo h SER 376 N 0.97 0.85 -0.52 -3.80 0.87 -0.47 -2.83 113.55 108.62 1ojo h SER 376 Ca 0.27 -0.25 0.05 0.00 -1.23 0.00 0.00 61.79 60.63 1ojo h SER 376 Cb -0.10 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.61 1ojo h SER 376 CO -0.06 0.89 0.35 0.40 -0.53 0.00 0.00 176.83 177.87 1ojo h ILE 377 N 0.78 0.99 -0.02 2.23 1.08 -0.08 -2.46 117.51 120.04 1ojo h ILE 377 Ca 0.17 -0.17 0.01 0.00 -0.39 0.00 0.00 64.86 64.47 1ojo h ILE 377 Cb 0.39 0.46 -0.00 0.00 -3.07 0.00 0.00 36.82 34.60 1ojo h ILE 377 CO 0.01 0.09 0.16 -0.33 -0.69 0.00 0.00 178.15 177.39 1ojo h GLU 378 N 0.49 0.00 0.00 2.37 5.08 -1.08 -1.16 114.58 120.29 1ojo h GLU 378 Ca 0.22 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 1ojo h GLU 378 Cb 0.26 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.51 1ojo h GLU 378 CO -0.06 0.00 -0.06 1.96 -1.00 0.00 0.00 179.01 179.85 1ojo h GLN 379 N 0.00 0.00 0.00 2.33 4.20 -1.59 -2.61 115.11 117.43 1ojo h GLN 379 Ca 0.01 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.72 1ojo h GLN 379 Cb 0.33 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.11 1ojo h GLN 379 CO -0.00 0.06 -0.01 -0.24 -0.67 0.00 0.00 178.83 177.98 1ojo h VAL 380 N 0.00 0.26 -0.00 -0.54 3.04 -1.43 -2.32 116.25 115.27 1ojo h VAL 380 Ca -0.00 -0.04 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1ojo h VAL 380 Cb 0.12 1.03 0.00 0.00 -2.01 0.00 0.00 31.29 30.43 1ojo h VAL 380 CO 0.01 0.01 -0.06 0.49 -1.01 0.00 0.00 177.57 177.00 1ojo n PHE 381 N -3.45 0.00 -3.21 3.17 3.72 -0.98 -4.81 117.46 111.89 1ojo n PHE 381 Ca -0.03 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.98 1ojo n PHE 381 Cb 0.09 -0.17 -0.06 0.00 -0.94 0.00 0.00 39.48 38.41 1ojo n PHE 381 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1ojo s LYS 382 N -2.39 4.29 0.46 -1.08 1.02 -0.87 -4.72 119.74 116.45 1ojo s LYS 382 Ca 0.32 0.55 -0.21 0.00 0.02 0.00 0.00 55.97 56.66 1ojo s LYS 382 Cb 0.20 -3.50 -0.09 0.00 -0.52 0.00 0.00 37.83 33.92 1ojo s LYS 382 CO 0.45 -0.02 1.01 -0.51 -0.92 0.00 0.00 175.35 175.36 1ojo s LEU 383 N 1.17 3.91 0.30 3.17 1.43 -1.26 -4.68 118.68 122.72 1ojo s LEU 383 Ca 0.28 1.85 0.10 0.00 -1.03 0.00 0.00 54.13 55.34 1ojo s LEU 383 Cb -0.16 -4.52 -0.05 0.00 0.03 0.00 0.00 46.19 41.49 1ojo s LEU 383 CO 0.11 -0.60 -0.09 0.68 0.23 0.00 0.00 176.35 176.68 1ojo s VAL 384 N -2.02 2.67 -0.17 -1.59 -7.23 0.19 -5.01 120.40 107.24 1ojo s VAL 384 Ca 0.65 -2.17 0.02 0.00 -1.81 0.00 0.00 61.98 58.67 1ojo s VAL 384 Cb -0.14 -2.59 0.04 0.00 0.56 0.00 0.00 36.38 34.25 1ojo s VAL 384 CO 0.18 -0.31 0.89 -0.90 -0.31 0.00 0.00 175.10 174.65 1ojo n ASP 385 N -0.79 1.84 -3.55 4.85 3.85 -1.26 -4.28 116.55 117.20 1ojo n ASP 385 Ca -0.05 -1.71 -0.11 0.00 -0.71 0.00 0.00 54.79 52.21 1ojo n ASP 385 Cb 0.61 -0.03 -0.04 0.00 -1.35 0.00 0.00 41.12 40.31 1ojo n ASP 385 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.20 174.61 1ojo s GLN 386 N -0.74 0.71 1.84 0.11 0.74 -1.26 -5.15 119.66 115.92 1ojo s GLN 386 Ca 0.03 0.03 0.00 0.00 0.05 0.00 0.00 55.36 55.47 1ojo s GLN 386 Cb 0.02 0.33 0.00 0.00 1.10 0.00 0.00 33.01 34.46 1ojo s GLN 386 CO 0.02 -0.25 0.00 0.41 -0.55 0.00 0.00 175.29 174.92 1ojo n GLY 387 N 0.46 -1.49 3.79 2.59 0.00 -1.26 -4.88 105.19 104.40 1ojo n GLY 387 Ca -0.11 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.25 1ojo n GLY 387 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ojo s GLU 388 N 0.00 4.42 0.00 1.61 2.02 -1.26 -4.68 118.70 120.81 1ojo s GLU 388 Ca 0.00 1.35 0.00 0.00 0.02 0.00 0.00 54.97 56.34 1ojo s GLU 388 Cb 0.00 -2.64 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1ojo s GLU 388 CO 0.00 0.12 0.00 0.41 0.02 0.00 0.00 175.26 175.81 1ojo n GLY 389 N 0.33 0.73 3.81 -1.39 0.00 0.49 -4.90 105.19 104.27 1ojo n GLY 389 Ca 0.03 -2.09 -0.38 0.00 0.00 0.00 0.00 46.02 43.58 1ojo n GLY 389 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ojo s PHE 390 N -1.09 3.79 0.29 1.61 0.08 -1.26 -1.42 117.98 119.98 1ojo s PHE 390 Ca 0.00 1.24 0.08 0.00 0.12 0.00 0.00 56.93 58.37 1ojo s PHE 390 Cb 0.00 -2.48 -0.04 0.00 -0.57 0.00 0.00 43.02 39.94 1ojo s PHE 390 CO 0.00 0.58 0.15 0.71 -0.10 0.00 0.00 175.22 176.56 1ojo s TYR 391 N -1.14 2.86 0.37 0.36 1.51 0.13 -0.63 117.35 120.81 1ojo s TYR 391 Ca 0.29 -0.24 0.06 0.00 -1.01 0.00 0.00 57.07 56.17 1ojo s TYR 391 Cb -0.19 -1.48 0.75 0.00 -0.11 0.00 0.00 41.96 40.93 1ojo s TYR 391 CO 0.19 0.44 1.97 0.37 -1.11 0.00 0.00 175.55 177.40 1ojo h GLN 392 N 1.56 0.71 -0.02 -0.62 5.75 -1.88 -1.11 115.11 119.51 1ojo h GLN 392 Ca -0.45 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.00 1ojo h GLN 392 Cb 1.25 -0.16 0.00 0.00 1.07 0.00 0.00 27.48 29.64 1ojo h GLN 392 CO 0.61 0.47 0.00 -0.40 -2.65 0.00 0.00 178.83 176.86 1ojo n ASP 393 N -4.48 0.14 0.00 -0.69 5.75 -1.26 -4.87 116.55 111.14 1ojo n ASP 393 Ca 0.10 -1.60 0.00 0.00 -0.01 0.00 0.00 54.79 53.28 1ojo n ASP 393 Cb 0.22 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 40.30 1ojo n ASP 393 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ojo n GLY 394 N 0.74 1.26 3.73 6.12 0.00 -0.42 -4.66 105.19 111.97 1ojo n GLY 394 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1ojo n GLY 394 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ojo s SER 395 N -1.95 4.34 -0.05 1.61 0.01 -1.26 -4.18 113.70 112.21 1ojo s SER 395 Ca 0.00 2.26 -0.01 0.00 1.31 0.00 0.00 55.95 59.51 1ojo s SER 395 Cb 0.00 -2.58 0.03 0.00 0.21 0.00 0.00 66.02 63.68 1ojo s SER 395 CO 0.00 -2.16 0.03 -0.47 0.41 0.00 0.00 173.24 171.05 1ojo s TYR 396 N -2.11 0.37 -0.05 2.43 6.14 -1.26 -0.69 117.35 122.18 1ojo s TYR 396 Ca 0.72 0.03 0.03 0.00 0.64 0.00 0.00 57.07 58.49 1ojo s TYR 396 Cb -0.27 -0.62 -0.03 0.00 0.42 0.00 0.00 41.96 41.47 1ojo s TYR 396 CO 0.45 -0.25 -0.11 0.42 0.64 0.00 0.00 175.55 176.71 1ojo s ILE 397 N 1.94 3.34 0.19 3.14 -1.09 -0.51 -1.15 121.20 127.07 1ojo s ILE 397 Ca 0.03 -0.67 -0.05 0.00 -2.23 0.00 0.00 60.65 57.74 1ojo s ILE 397 Cb -0.12 -2.35 -0.03 0.00 -1.58 0.00 0.00 42.46 38.38 1ojo s ILE 397 CO -0.04 0.56 0.22 -0.62 -1.23 0.00 0.00 174.94 173.83 1ojo s ASP 398 N -0.87 0.11 -1.32 3.58 -1.08 -0.57 -0.38 116.67 116.14 1ojo s ASP 398 Ca 0.13 -1.19 -0.01 0.00 -0.52 0.00 0.00 52.55 50.96 1ojo s ASP 398 Cb -0.11 0.42 -0.00 0.00 -1.46 0.00 0.00 42.92 41.77 1ojo s ASP 398 CO 0.02 -0.90 0.63 1.41 0.52 0.00 0.00 175.17 176.85 1ojo n HIS 399 N -0.26 -1.84 0.00 -5.34 8.25 -1.26 -1.27 115.22 113.49 1ojo n HIS 399 Ca -0.01 0.80 0.00 0.00 -0.26 0.00 0.00 57.72 58.24 1ojo n HIS 399 Cb 0.64 -4.17 0.00 0.00 1.12 0.00 0.00 29.99 27.58 1ojo n HIS 399 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1ojo n THR 400 N -4.29 0.00 -2.44 1.59 -1.04 -1.26 -3.92 114.28 102.92 1ojo n THR 400 Ca -0.29 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.69 1ojo n THR 400 Cb 0.68 0.00 0.03 0.00 -1.82 0.00 0.00 70.33 69.22 1ojo n THR 400 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1ojo n ASN 401 N 2.60 -0.52 -4.51 8.00 6.94 -1.21 -4.52 115.26 122.04 1ojo n ASN 401 Ca 0.00 -2.08 -0.34 0.00 -0.02 0.00 0.00 54.58 52.14 1ojo n ASN 401 Cb 0.00 0.25 -0.12 0.00 -2.36 0.00 0.00 39.78 37.55 1ojo n ASN 401 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1ojo s VAL 402 N -0.50 3.83 0.02 3.53 1.01 -0.40 -1.31 120.40 126.57 1ojo s VAL 402 Ca 0.12 -0.39 -0.30 0.00 0.00 0.00 0.00 61.98 61.41 1ojo s VAL 402 Cb 0.27 -2.66 -0.08 0.00 0.00 0.00 0.00 36.38 33.91 1ojo s VAL 402 CO -0.08 0.51 1.75 0.00 0.00 0.00 0.00 175.10 177.29 1ojo s ALA 403 N 0.15 3.64 0.00 5.51 0.00 -1.26 -1.51 121.76 128.29 1ojo s ALA 403 Ca -0.02 1.16 0.04 0.00 0.00 0.00 0.00 51.96 53.14 1ojo s ALA 403 Cb -0.14 -3.76 0.07 0.00 0.00 0.00 0.00 23.12 19.29 1ojo s ALA 403 CO 0.03 -1.35 0.95 0.66 0.00 0.00 0.00 175.76 176.05 1ojo n TYR 404 N 6.71 0.00 -0.30 0.00 4.01 -0.30 -4.36 117.16 122.91 1ojo n TYR 404 Ca 0.18 -0.10 0.11 0.00 -0.16 0.00 0.00 57.90 57.92 1ojo n TYR 404 Cb 0.41 0.01 0.28 0.00 -0.31 0.00 0.00 39.34 39.73 1ojo n TYR 404 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1ojo h THR 405 N 6.59 0.57 -0.00 -0.72 2.02 -1.61 -2.39 112.91 117.36 1ojo h THR 405 Ca -0.06 -0.17 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1ojo h THR 405 Cb 1.42 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1ojo h THR 405 CO 0.00 0.09 0.00 0.61 0.37 0.00 0.00 175.52 176.59 1ojo n GLY 406 N -1.33 -0.98 1.99 2.16 0.00 0.11 -2.45 105.19 104.68 1ojo n GLY 406 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1ojo n GLY 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ojo n ALA 407 N -0.52 3.00 0.14 4.61 0.00 -0.97 -4.52 120.51 122.24 1ojo n ALA 407 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1ojo n ALA 407 Cb 0.01 0.00 0.16 0.00 0.00 0.00 0.00 19.45 19.62 1ojo n ALA 407 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1ojo h PHE 408 N 0.00 0.00 -0.47 0.00 -1.00 -1.70 -2.19 116.94 111.58 1ojo h PHE 408 Ca 0.00 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.66 1ojo h PHE 408 Cb 0.00 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 1ojo h PHE 408 CO 0.00 0.60 -0.17 0.78 -1.61 0.00 0.00 178.31 177.92 1ojo h GLY 409 N 2.24 0.98 0.76 -1.45 0.00 -1.11 -1.82 103.07 102.66 1ojo h GLY 409 Ca -0.01 -0.81 0.02 0.00 0.00 0.00 0.00 47.33 46.53 1ojo h GLY 409 CO 0.08 0.74 -0.09 3.43 0.00 0.00 0.00 176.54 180.70 1ojo h ASN 410 N 0.80 -0.26 -0.94 0.19 4.21 -1.13 -1.70 115.58 116.76 1ojo h ASN 410 Ca 0.12 0.04 0.08 0.00 1.21 0.00 0.00 56.30 57.74 1ojo h ASN 410 Cb 0.71 0.11 -0.07 0.00 -1.12 0.00 0.00 38.32 37.95 1ojo h ASN 410 CO 0.05 -0.13 0.59 0.58 -1.29 0.00 0.00 177.43 177.24 1ojo h VAL 411 N -0.15 1.03 0.75 2.81 2.07 -1.25 0.12 116.25 121.63 1ojo h VAL 411 Ca 0.04 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1ojo h VAL 411 Cb 0.20 -0.10 0.01 0.00 -1.52 0.00 0.00 31.29 29.87 1ojo h VAL 411 CO -0.10 0.19 -0.36 0.25 0.02 0.00 0.00 177.57 177.57 1ojo h LEU 412 N 1.04 -0.85 -0.60 2.57 6.46 -0.68 0.28 115.31 123.53 1ojo h LEU 412 Ca 0.42 0.03 -0.15 0.00 -0.12 0.00 0.00 57.88 58.06 1ojo h LEU 412 Cb 0.24 0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 1ojo h LEU 412 CO -0.20 -0.60 -0.52 -0.29 -0.62 0.00 0.00 178.44 176.21 1ojo h ILE 413 N -1.01 1.33 0.01 4.05 2.10 -1.14 -0.71 117.51 122.13 1ojo h ILE 413 Ca -0.10 -1.76 -0.00 0.00 1.08 0.00 0.00 64.86 64.08 1ojo h ILE 413 Cb 0.77 1.76 0.00 0.00 -1.09 0.00 0.00 36.82 38.26 1ojo h ILE 413 CO 0.17 0.54 -0.01 -0.78 -1.08 0.00 0.00 178.15 177.00 1ojo h ASP 414 N 0.38 -0.01 -0.06 2.19 3.58 -0.76 -1.89 116.42 119.85 1ojo h ASP 414 Ca 0.01 -0.27 -0.17 0.00 0.42 0.00 0.00 57.03 57.02 1ojo h ASP 414 Cb 1.04 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.09 1ojo h ASP 414 CO 0.09 0.27 -0.55 1.23 -2.88 0.00 0.00 179.24 177.40 1ojo h GLY 415 N -0.29 0.71 1.31 -0.78 0.00 -0.96 -3.09 103.07 99.97 1ojo h GLY 415 Ca -0.00 -0.82 -0.14 0.00 0.00 0.00 0.00 47.33 46.37 1ojo h GLY 415 CO 0.00 0.74 -0.34 -2.00 0.00 0.00 0.00 176.54 174.94 1ojo h LEU 416 N 0.50 0.80 -1.77 3.11 5.85 -1.15 -2.17 115.31 120.48 1ojo h LEU 416 Ca 0.01 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.36 1ojo h LEU 416 Cb 1.11 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.91 1ojo h LEU 416 CO 0.11 1.07 -0.15 0.77 -0.34 0.00 0.00 178.44 179.90 1ojo h SER 417 N 0.64 0.00 -0.01 1.25 4.64 -1.36 -0.56 113.55 118.15 1ojo h SER 417 Ca 0.07 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.27 1ojo h SER 417 Cb 0.88 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.98 1ojo h SER 417 CO 0.08 0.15 -0.46 1.56 -0.87 0.00 0.00 176.83 177.29 1ojo h GLN 418 N 0.00 0.32 -0.38 4.77 4.20 -1.39 -3.37 115.11 119.26 1ojo h GLN 418 Ca -0.00 -0.34 -0.12 0.00 0.06 0.00 0.00 58.65 58.25 1ojo h GLN 418 Cb 0.40 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 1ojo h GLN 418 CO 0.02 1.03 -0.23 -0.07 -0.67 0.00 0.00 178.83 178.91 1ojo h LEU 419 N -0.25 0.85 -0.76 1.46 3.38 -0.96 -3.36 115.31 115.67 1ojo h LEU 419 Ca -0.06 -0.42 0.18 0.00 0.09 0.00 0.00 57.88 57.67 1ojo h LEU 419 Cb 1.18 -0.24 -0.13 0.00 0.09 0.00 0.00 40.66 41.57 1ojo h LEU 419 CO 0.09 1.09 0.05 -0.07 0.09 0.00 0.00 178.44 179.69 1ojo h LEU 420 N 0.62 -0.27 -1.52 1.67 3.38 -1.28 -0.28 115.31 117.63 1ojo h LEU 420 Ca 0.08 0.19 0.06 0.00 0.09 0.00 0.00 57.88 58.30 1ojo h LEU 420 Cb 0.79 0.32 -0.04 0.00 0.09 0.00 0.00 40.66 41.82 1ojo h LEU 420 CO 0.06 -0.16 0.40 -0.65 0.09 0.00 0.00 178.44 178.18 1ojo h PRO 421 N 0.13 0.57 0.01 1.13 0.11 -1.78 0.59 132.00 132.76 1ojo h PRO 421 Ca 0.43 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.50 1ojo h PRO 421 Cb 0.76 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.74 1ojo h PRO 421 CO -0.65 0.38 -0.01 0.28 -0.21 0.00 0.00 178.00 177.80 1ojo h VAL 422 N 0.59 1.54 -0.73 3.15 2.07 -1.40 -3.30 116.25 118.17 1ojo h VAL 422 Ca 0.26 -1.94 0.11 0.00 0.82 0.00 0.00 66.70 65.95 1ojo h VAL 422 Cb 0.27 2.80 -0.08 0.00 -1.52 0.00 0.00 31.29 32.77 1ojo h VAL 422 CO -0.08 0.48 0.34 0.40 0.02 0.00 0.00 177.57 178.74 1ojo h ILE 423 N -0.89 0.80 0.00 4.57 2.04 -0.84 -0.95 117.51 122.24 1ojo h ILE 423 Ca -0.00 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1ojo h ILE 423 Cb 0.80 0.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1ojo h ILE 423 CO 0.00 0.10 0.00 0.00 0.00 0.00 0.00 178.15 178.26 1ojo n GLN 424 N -4.90 0.05 -0.06 2.37 1.13 0.18 -1.76 117.38 114.39 1ojo n GLN 424 Ca 0.12 0.29 0.08 0.00 -1.94 0.00 0.00 57.00 55.54 1ojo n GLN 424 Cb 0.31 -1.50 0.10 0.00 0.11 0.00 0.00 30.24 29.26 1ojo n GLN 424 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1ojo n LYS 425 N -1.43 1.53 -1.64 -1.09 5.02 -0.37 -4.73 118.16 115.44 1ojo n LYS 425 Ca 0.03 -1.61 -0.17 0.00 -2.02 0.00 0.00 58.31 54.54 1ojo n LYS 425 Cb 0.10 -1.31 0.10 0.00 -0.02 0.00 0.00 35.03 33.90 1ojo n LYS 425 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1ojo n THR 426 N 0.88 0.00 1.74 -0.18 -2.24 -0.72 -4.95 114.28 108.80 1ojo n THR 426 Ca 0.11 -0.88 0.10 0.00 -2.27 0.00 0.00 64.05 61.11 1ojo n THR 426 Cb 0.41 -1.32 0.51 0.00 -2.10 0.00 0.00 70.33 67.83 1ojo n THR 426 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1ojo n LYS 427 N -2.51 1.25 -2.74 -0.78 5.02 -1.26 -3.92 118.16 113.21 1ojo n LYS 427 Ca 0.11 -0.37 -0.20 0.00 -2.02 0.00 0.00 58.31 55.82 1ojo n LYS 427 Cb 0.39 -1.34 -0.00 0.00 -0.02 0.00 0.00 35.03 34.06 1ojo n LYS 427 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1ojo n ASN 428 N -0.42 3.04 -4.70 4.39 5.03 -1.26 -5.10 115.26 116.23 1ojo n ASN 428 Ca 0.15 -3.29 -0.33 0.00 0.87 0.00 0.00 54.58 51.98 1ojo n ASN 428 Cb 0.16 -0.53 0.12 0.00 -1.02 0.00 0.00 39.78 38.51 1ojo n ASN 428 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1ojo s PRO 429 N -3.21 1.70 -0.05 3.52 0.04 -1.25 -4.88 135.00 130.86 1ojo s PRO 429 Ca 0.41 1.67 -0.18 0.00 0.04 0.00 0.00 61.00 62.94 1ojo s PRO 429 Cb 0.39 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 33.08 1ojo s PRO 429 CO -0.09 -2.15 0.48 0.42 0.04 0.00 0.00 177.00 175.70 1ojo s ILE 430 N -2.26 5.05 0.34 0.56 1.01 -1.26 -5.03 121.20 119.61 1ojo s ILE 430 Ca 0.71 0.99 -0.27 0.00 0.00 0.00 0.00 60.65 62.08 1ojo s ILE 430 Cb -0.27 -3.81 -0.13 0.00 0.01 0.00 0.00 42.46 38.27 1ojo s ILE 430 CO 0.51 0.44 1.12 0.47 0.00 0.00 0.00 174.94 177.48 1ojo n ASP 431 N 2.76 1.87 -0.22 3.58 8.00 -1.26 -4.90 116.55 126.39 1ojo n ASP 431 Ca -0.10 1.16 -0.07 0.00 0.71 0.00 0.00 54.79 56.49 1ojo n ASP 431 Cb 0.52 -1.38 0.03 0.00 -0.02 0.00 0.00 41.12 40.27 1ojo n ASP 431 CO 0.00 0.00 0.00 0.50 -0.39 0.00 0.00 177.20 177.31 1ojo h LYS 432 N 2.11 0.89 0.00 -1.24 3.64 -1.99 -2.49 116.57 117.49 1ojo h LYS 432 Ca -0.43 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 58.80 1ojo h LYS 432 Cb 1.32 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1ojo h LYS 432 CO 0.60 0.74 0.00 -0.44 -2.27 0.00 0.00 179.45 178.08 1ojo h ASP 433 N 0.83 0.00 0.28 4.20 3.32 -2.01 -2.39 116.42 120.65 1ojo h ASP 433 Ca 0.20 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.92 1ojo h ASP 433 Cb 0.16 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.75 1ojo h ASP 433 CO -0.02 0.00 -1.51 0.11 -1.72 0.00 0.00 179.24 176.10 1ojo h LYS 434 N 0.00 0.51 0.00 3.56 1.57 -1.81 -3.27 116.57 117.13 1ojo h LYS 434 Ca 0.00 -0.87 0.00 0.00 -1.87 0.00 0.00 60.65 57.91 1ojo h LYS 434 Cb 0.26 0.33 0.00 0.00 0.08 0.00 0.00 32.23 32.89 1ojo h LYS 434 CO 0.00 1.42 0.00 -1.33 -0.57 0.00 0.00 179.45 178.97 1ojo n MET 435 N -3.69 0.02 -0.02 3.15 2.81 -0.93 -3.64 117.12 114.82 1ojo n MET 435 Ca -0.17 0.16 0.18 0.00 -1.81 0.00 0.00 57.70 56.06 1ojo n MET 435 Cb 1.10 -1.54 0.65 0.00 -0.71 0.00 0.00 33.22 32.72 1ojo n MET 435 CO 0.00 0.00 0.00 0.37 1.51 0.00 0.00 175.97 177.85 1ojo h GLN 436 N 0.00 0.09 0.00 0.03 5.75 -1.52 -1.68 115.11 117.77 1ojo h GLN 436 Ca 0.00 -0.01 -0.01 0.00 -0.15 0.00 0.00 58.65 58.49 1ojo h GLN 436 Cb 0.38 -0.02 -0.00 0.00 1.07 0.00 0.00 27.48 28.91 1ojo h GLN 436 CO 0.00 0.06 -0.03 1.79 -2.65 0.00 0.00 178.83 178.00 1ojo h THR 437 N 0.09 0.26 -0.85 2.39 1.35 -1.81 -2.65 112.91 111.68 1ojo h THR 437 Ca 0.26 -0.18 0.09 0.00 -0.55 0.00 0.00 66.41 66.02 1ojo h THR 437 Cb 0.91 1.14 -0.06 0.00 -1.73 0.00 0.00 68.15 68.41 1ojo h THR 437 CO -0.02 0.03 0.55 0.24 -0.25 0.00 0.00 175.52 176.07 1ojo h MET 438 N 0.00 0.82 0.00 4.72 2.86 -1.60 0.16 114.93 121.89 1ojo h MET 438 Ca -0.00 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.53 1ojo h MET 438 Cb 0.14 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 1ojo h MET 438 CO 0.00 0.54 -0.29 1.88 1.06 0.00 0.00 176.91 180.11 1ojo h TYR 439 N 0.85 0.00 -0.35 -0.22 0.05 -1.68 -1.48 116.97 114.14 1ojo h TYR 439 Ca 0.39 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 59.03 1ojo h TYR 439 Cb 0.38 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 1ojo h TYR 439 CO -0.00 0.29 -0.33 1.25 -1.05 0.00 0.00 178.16 178.32 1ojo h HIS 440 N 0.00 1.00 -0.04 4.88 2.76 -0.85 -2.04 115.15 120.86 1ojo h HIS 440 Ca -0.00 -0.30 -0.00 0.00 -2.20 0.00 0.00 60.37 57.87 1ojo h HIS 440 Cb 0.55 -0.21 -0.00 0.00 1.55 0.00 0.00 27.41 29.30 1ojo h HIS 440 CO 0.00 1.09 0.02 -1.49 -1.30 0.00 0.00 177.93 176.25 1ojo h TRP 441 N 0.62 0.06 0.02 5.26 6.55 -0.64 0.55 115.95 128.37 1ojo h TRP 441 Ca 0.06 -0.00 0.02 0.00 0.95 0.00 0.00 58.89 59.92 1ojo h TRP 441 Cb 0.91 -0.02 -0.03 0.00 -0.86 0.00 0.00 29.16 29.16 1ojo h TRP 441 CO 0.07 0.10 -0.19 0.82 -1.05 0.00 0.00 178.44 178.19 1ojo h ILE 442 N -0.00 0.55 -0.06 1.49 2.04 -1.23 0.29 117.51 120.58 1ojo h ILE 442 Ca 0.02 0.00 -0.24 0.00 1.00 0.00 0.00 64.86 65.63 1ojo h ILE 442 Cb 0.06 0.55 0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1ojo h ILE 442 CO -0.00 0.00 -0.92 0.44 0.00 0.00 0.00 178.15 177.67 1ojo h ASP 443 N -0.32 0.86 0.20 1.72 3.32 -1.32 -0.37 116.42 120.51 1ojo h ASP 443 Ca 0.05 -0.63 -0.34 0.00 0.02 0.00 0.00 57.03 56.12 1ojo h ASP 443 Cb 0.38 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.62 1ojo h ASP 443 CO -0.16 1.43 -2.08 0.29 -1.72 0.00 0.00 179.24 176.99 1ojo n LYS 444 N -3.87 0.68 -0.11 3.56 5.02 0.18 -4.48 118.16 119.14 1ojo n LYS 444 Ca -0.09 0.18 -0.25 0.00 -2.02 0.00 0.00 58.31 56.13 1ojo n LYS 444 Cb 0.82 -1.66 -0.11 0.00 -0.02 0.00 0.00 35.03 34.06 1ojo n LYS 444 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1ojo n SER 445 N -3.09 1.92 -0.09 4.39 7.64 0.86 -4.57 113.62 120.68 1ojo n SER 445 Ca -0.29 0.36 -0.19 0.00 1.01 0.00 0.00 58.87 59.76 1ojo n SER 445 Cb 1.07 -0.88 -0.12 0.00 -1.01 0.00 0.00 64.21 63.27 1ojo n SER 445 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1ojo h PHE 446 N -0.90 0.00 -0.72 1.43 0.04 -1.12 -3.40 116.94 112.26 1ojo h PHE 446 Ca -0.51 0.00 0.16 0.00 2.80 0.00 0.00 57.97 60.42 1ojo h PHE 446 Cb 1.49 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.53 1ojo h PHE 446 CO 0.02 1.28 0.15 0.00 -0.60 0.00 0.00 178.31 179.15 1ojo h ALA 447 N -0.36 0.90 0.00 2.45 0.00 -1.28 -1.28 119.26 119.69 1ojo h ALA 447 Ca -0.23 0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1ojo h ALA 447 Cb 1.17 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.21 1ojo h ALA 447 CO -0.14 -0.35 -0.08 -1.35 0.00 0.00 0.00 179.25 177.33 1ojo h PRO 448 N 0.24 0.00 -0.03 0.00 0.11 -1.79 -2.30 132.00 128.23 1ojo h PRO 448 Ca 0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.52 1ojo h PRO 448 Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 1ojo h PRO 448 CO -0.52 0.08 0.00 1.28 -0.21 0.00 0.00 178.00 178.62 1ojo n LEU 449 N -4.12 0.64 -4.36 2.35 4.77 -0.49 -4.74 117.00 111.05 1ojo n LEU 449 Ca -0.03 -0.24 -0.38 0.00 -0.03 0.00 0.00 56.01 55.34 1ojo n LEU 449 Cb 0.16 -0.02 -0.12 0.00 -2.33 0.00 0.00 43.42 41.11 1ojo n LEU 449 CO 0.32 0.12 -0.25 -0.76 -1.33 0.00 0.00 177.39 175.49 1ojo s LEU 450 N -1.82 3.98 -0.15 2.23 1.43 -0.87 -0.68 118.68 122.80 1ojo s LEU 450 Ca 0.38 -0.70 -0.00 0.00 -1.03 0.00 0.00 54.13 52.78 1ojo s LEU 450 Cb 0.19 -1.92 0.03 0.00 0.03 0.00 0.00 46.19 44.52 1ojo s LEU 450 CO 0.31 -0.21 -0.08 -0.69 0.23 0.00 0.00 176.35 175.90 1ojo s VAL 451 N 1.52 1.23 -1.57 -1.59 1.01 -0.14 -4.78 120.40 116.08 1ojo s VAL 451 Ca 0.03 -0.55 -0.15 0.00 0.00 0.00 0.00 61.98 61.31 1ojo s VAL 451 Cb -0.17 -1.28 0.10 0.00 0.00 0.00 0.00 36.38 35.03 1ojo s VAL 451 CO 0.04 0.28 0.94 0.59 0.00 0.00 0.00 175.10 176.94 1ojo n ASN 452 N 4.86 -4.42 0.00 3.32 3.02 -1.26 -1.22 115.26 119.55 1ojo n ASN 452 Ca -0.13 -0.84 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1ojo n ASN 452 Cb 0.49 -3.62 0.00 0.00 -0.61 0.00 0.00 39.78 36.04 1ojo n ASN 452 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ojo n GLY 453 N -1.63 0.82 3.56 7.41 0.00 -1.26 -4.26 105.19 109.84 1ojo n GLY 453 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1ojo n GLY 453 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ojo s GLU 454 N -0.16 3.44 -0.30 1.61 2.12 -0.36 -4.33 118.70 120.71 1ojo s GLU 454 Ca 0.00 -0.48 -0.20 0.00 0.36 0.00 0.00 54.97 54.65 1ojo s GLU 454 Cb 0.00 -2.88 -0.01 0.00 0.26 0.00 0.00 34.13 31.50 1ojo s GLU 454 CO 0.00 0.40 0.59 -1.17 -0.54 0.00 0.00 175.26 174.54 1ojo s LEU 455 N -0.06 4.14 -0.23 2.70 2.96 -0.73 -0.96 118.68 126.50 1ojo s LEU 455 Ca 0.02 0.41 -0.38 0.00 -0.22 0.00 0.00 54.13 53.96 1ojo s LEU 455 Cb -0.13 -2.76 -0.14 0.00 0.50 0.00 0.00 46.19 43.66 1ojo s LEU 455 CO 0.02 -0.43 1.80 0.23 -1.32 0.00 0.00 176.35 176.65 1ojo n MET 456 N 5.79 1.43 0.06 1.98 2.81 0.14 -4.66 117.12 124.67 1ojo n MET 456 Ca -0.02 0.52 0.19 0.00 -1.81 0.00 0.00 57.70 56.58 1ojo n MET 456 Cb 0.49 -2.26 0.72 0.00 -0.71 0.00 0.00 33.22 31.46 1ojo n MET 456 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1ojo h ASP 457 N 7.91 0.00 0.24 7.83 3.32 -1.94 -1.63 116.42 132.15 1ojo h ASP 457 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1ojo h ASP 457 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1ojo h ASP 457 CO 0.96 0.00 0.00 1.15 -1.72 0.00 0.00 179.24 179.63 1ojo n MET 458 N -4.17 0.01 -0.01 3.56 0.00 -1.26 -1.38 117.12 113.87 1ojo n MET 458 Ca 0.07 0.39 0.08 0.00 0.00 0.00 0.00 57.70 58.24 1ojo n MET 458 Cb 0.54 -1.51 0.07 0.00 0.00 0.00 0.00 33.22 32.32 1ojo n MET 458 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1ojo n SER 459 N -1.52 2.27 -1.11 3.17 3.41 -0.61 -4.61 113.62 114.62 1ojo n SER 459 Ca 0.02 -1.63 0.12 0.00 -0.26 0.00 0.00 58.87 57.11 1ojo n SER 459 Cb 0.08 -0.01 0.24 0.00 -0.26 0.00 0.00 64.21 64.26 1ojo n SER 459 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ojo n ARG 460 N 0.85 2.44 0.00 4.33 1.74 -0.48 0.04 116.66 125.58 1ojo n ARG 460 Ca 0.09 -2.19 0.00 0.00 -0.77 0.00 0.00 57.85 54.98 1ojo n ARG 460 Cb 0.38 -1.51 0.00 0.00 -1.02 0.00 0.00 32.46 30.31 1ojo n ARG 460 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ojo n GLY 461 N 1.48 2.55 0.00 -0.13 0.00 -1.26 -1.81 105.19 106.03 1ojo n GLY 461 Ca 0.19 -0.25 0.09 0.00 0.00 0.00 0.00 46.02 46.05 1ojo n GLY 461 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1ojo n ARG 462 N 14.00 0.11 0.15 1.61 1.85 -1.26 -3.31 116.66 129.81 1ojo n ARG 462 Ca 0.00 0.15 0.12 0.00 -1.00 0.00 0.00 57.85 57.12 1ojo n ARG 462 Cb 0.00 -1.50 0.55 0.00 -1.05 0.00 0.00 32.46 30.46 1ojo n ARG 462 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1ojo n SER 463 N -1.41 0.66 0.27 2.89 7.64 -0.75 -2.10 113.62 120.81 1ojo n SER 463 Ca 0.06 0.71 0.18 0.00 1.01 0.00 0.00 58.87 60.84 1ojo n SER 463 Cb 0.19 -0.84 0.84 0.00 -1.01 0.00 0.00 64.21 63.39 1ojo n SER 463 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1ojo h ILE 464 N 0.00 0.00 -0.31 0.44 3.07 -1.71 -2.32 117.51 116.68 1ojo h ILE 464 Ca 0.00 -0.24 0.00 0.00 1.55 0.00 0.00 64.86 66.17 1ojo h ILE 464 Cb 0.23 1.15 0.00 0.00 -0.27 0.00 0.00 36.82 37.93 1ojo h ILE 464 CO 0.00 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.56 1ojo n SER 465 N -2.88 1.95 -4.47 2.16 3.41 -0.89 -4.81 113.62 108.09 1ojo n SER 465 Ca -0.01 -2.07 -0.37 0.00 -0.26 0.00 0.00 58.87 56.17 1ojo n SER 465 Cb 0.18 -0.28 -0.12 0.00 -0.26 0.00 0.00 64.21 63.74 1ojo n SER 465 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1ojo s ARG 466 N -1.60 3.70 0.43 4.33 0.52 -0.87 -4.61 118.95 120.84 1ojo s ARG 466 Ca 0.22 -0.46 0.09 0.00 -0.52 0.00 0.00 55.73 55.06 1ojo s ARG 466 Cb 0.12 -3.35 0.93 0.00 0.52 0.00 0.00 34.95 33.17 1ojo s ARG 466 CO 0.13 -0.17 2.06 0.00 0.02 0.00 0.00 175.30 177.35 1ojo h ALA 467 N 8.19 1.74 -0.17 2.13 0.00 -1.88 -2.11 119.26 127.16 1ojo h ALA 467 Ca -0.38 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1ojo h ALA 467 Cb 1.18 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1ojo h ALA 467 CO 0.58 0.23 0.00 0.27 0.00 0.00 0.00 179.25 180.33 1ojo n ASN 468 N -4.47 1.30 -2.50 0.00 6.94 -1.26 -4.16 115.26 111.11 1ojo n ASN 468 Ca 0.02 -1.74 -0.13 0.00 -0.02 0.00 0.00 54.58 52.70 1ojo n ASN 468 Cb 0.08 -0.11 0.03 0.00 -2.36 0.00 0.00 39.78 37.42 1ojo n ASN 468 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1ojo n SER 469 N 0.11 3.07 -4.67 0.53 7.64 -0.79 -4.88 113.62 114.63 1ojo n SER 469 Ca 0.14 -2.93 -0.29 0.00 1.01 0.00 0.00 58.87 56.79 1ojo n SER 469 Cb 0.25 -0.44 0.17 0.00 -1.01 0.00 0.00 64.21 63.18 1ojo n SER 469 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1ojo s GLU 470 N -3.59 0.59 0.24 1.43 2.02 -1.25 -4.44 118.70 113.70 1ojo s GLU 470 Ca 0.38 0.70 -0.08 0.00 0.02 0.00 0.00 54.97 55.99 1ojo s GLU 470 Cb 0.38 -1.74 0.38 0.00 0.10 0.00 0.00 34.13 33.26 1ojo s GLU 470 CO -0.02 -2.67 1.35 0.41 0.02 0.00 0.00 175.26 174.35 1ojo n GLY 471 N -0.83 -1.48 0.16 -1.39 0.00 -1.26 -1.13 105.19 99.25 1ojo n GLY 471 Ca 0.06 0.93 -0.03 0.00 0.00 0.00 0.00 46.02 46.98 1ojo n GLY 471 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1ojo h HIS 472 N 0.00 0.14 -0.01 1.61 3.86 -1.88 -1.78 115.15 117.09 1ojo h HIS 472 Ca 0.41 -0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.56 1ojo h HIS 472 Cb 0.62 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 29.07 1ojo h HIS 472 CO -0.67 0.67 -0.01 0.28 0.86 0.00 0.00 177.93 179.05 1ojo h VAL 473 N 0.09 1.40 -0.82 2.45 2.07 -1.43 -3.15 116.25 116.85 1ojo h VAL 473 Ca -0.00 -1.20 0.06 0.00 0.82 0.00 0.00 66.70 66.37 1ojo h VAL 473 Cb 1.05 2.19 -0.05 0.00 -1.52 0.00 0.00 31.29 32.96 1ojo h VAL 473 CO 0.08 0.32 0.54 0.00 0.02 0.00 0.00 177.57 178.53 1ojo h ALA 474 N 0.50 1.58 -0.66 1.67 0.00 -1.30 -1.58 119.26 119.48 1ojo h ALA 474 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 54.97 1ojo h ALA 474 Cb 0.52 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1ojo h ALA 474 CO 0.00 0.30 0.44 0.00 0.00 0.00 0.00 179.25 179.99 1ojo h ALA 475 N 1.55 1.84 -0.16 0.00 0.00 -1.37 -1.33 119.26 119.79 1ojo h ALA 475 Ca 0.35 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.21 1ojo h ALA 475 Cb 0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1ojo h ALA 475 CO -0.12 0.03 -0.08 0.28 0.00 0.00 0.00 179.25 179.36 1ojo h VAL 476 N 0.59 1.15 -0.96 0.00 2.07 -1.27 0.36 116.25 118.20 1ojo h VAL 476 Ca 0.29 -0.65 0.04 0.00 0.82 0.00 0.00 66.70 67.20 1ojo h VAL 476 Cb 0.39 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1ojo h VAL 476 CO -0.09 0.21 0.63 -0.33 0.02 0.00 0.00 177.57 178.00 1ojo h GLU 477 N 0.24 1.18 -0.01 1.57 5.08 -1.31 0.11 114.58 121.43 1ojo h GLU 477 Ca 0.05 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1ojo h GLU 477 Cb 0.30 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1ojo h GLU 477 CO 0.01 0.78 -0.07 0.28 -1.00 0.00 0.00 179.01 179.02 1ojo h VAL 478 N 1.21 1.51 -0.67 3.13 2.07 -1.32 -2.99 116.25 119.20 1ojo h VAL 478 Ca 0.38 -1.61 0.05 0.00 0.82 0.00 0.00 66.70 66.34 1ojo h VAL 478 Cb -0.00 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 1ojo h VAL 478 CO -0.12 0.43 0.38 -0.07 0.02 0.00 0.00 177.57 178.21 1ojo h LEU 479 N -0.57 0.57 -1.27 2.57 3.38 -0.66 -0.03 115.31 119.31 1ojo h LEU 479 Ca -0.00 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 1ojo h LEU 479 Cb 0.73 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1ojo h LEU 479 CO 0.01 0.38 -0.32 0.08 0.09 0.00 0.00 178.44 178.68 1ojo h ARG 480 N 0.71 0.07 -0.24 1.13 0.11 -0.88 0.17 114.38 115.45 1ojo h ARG 480 Ca 0.29 -0.02 -0.08 0.00 0.10 0.00 0.00 59.98 60.27 1ojo h ARG 480 Cb 0.16 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.23 1ojo h ARG 480 CO -0.17 0.39 -0.15 0.78 0.10 0.00 0.00 179.97 180.92 1ojo h GLY 481 N 1.01 0.58 1.00 0.08 0.00 -1.13 -2.08 103.07 102.54 1ojo h GLY 481 Ca 0.01 -0.54 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 1ojo h GLY 481 CO 0.04 0.49 0.34 -2.22 0.00 0.00 0.00 176.54 175.19 1ojo h ILE 482 N 0.25 1.21 -0.60 2.60 2.04 -0.60 -1.98 117.51 120.43 1ojo h ILE 482 Ca 0.05 -0.57 -0.04 0.00 1.00 0.00 0.00 64.86 65.31 1ojo h ILE 482 Cb 0.67 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 1ojo h ILE 482 CO 0.04 0.24 0.23 -0.74 0.00 0.00 0.00 178.15 177.92 1ojo h HIS 483 N 0.89 0.89 -0.56 1.37 2.76 -0.87 0.19 115.15 119.82 1ojo h HIS 483 Ca 0.23 -0.05 -0.10 0.00 -2.20 0.00 0.00 60.37 58.24 1ojo h HIS 483 Cb 0.08 -0.27 -0.02 0.00 1.55 0.00 0.00 27.41 28.75 1ojo h HIS 483 CO -0.00 0.69 -0.06 0.00 -1.30 0.00 0.00 177.93 177.26 1ojo h ARG 484 N 0.86 1.02 -0.70 5.26 3.08 -1.07 -1.07 114.38 121.77 1ojo h ARG 484 Ca 0.20 -0.36 -0.06 0.00 0.07 0.00 0.00 59.98 59.84 1ojo h ARG 484 Cb 0.18 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 1ojo h ARG 484 CO -0.02 1.04 0.19 0.82 -1.07 0.00 0.00 179.97 180.94 1ojo h ILE 485 N 0.91 1.26 -0.78 2.04 2.04 -0.72 -1.92 117.51 120.34 1ojo h ILE 485 Ca 0.15 -0.92 -0.02 0.00 1.00 0.00 0.00 64.86 65.07 1ojo h ILE 485 Cb 0.62 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 1ojo h ILE 485 CO 0.04 0.36 0.41 0.00 0.00 0.00 0.00 178.15 178.96 1ojo h ALA 486 N 1.16 1.00 0.00 1.87 0.00 -0.67 -1.71 119.26 120.91 1ojo h ALA 486 Ca 0.22 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1ojo h ALA 486 Cb 0.33 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1ojo h ALA 486 CO -0.00 0.52 -0.16 0.22 0.00 0.00 0.00 179.25 179.83 1ojo h ASP 487 N 1.08 0.00 -0.13 0.00 3.58 -0.50 -1.75 116.42 118.70 1ojo h ASP 487 Ca 0.27 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.72 1ojo h ASP 487 Cb 0.06 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.11 1ojo h ASP 487 CO -0.04 0.16 0.00 1.15 -2.88 0.00 0.00 179.24 177.63 1ojo n MET 488 N -4.25 2.08 -2.18 0.28 0.00 -0.79 -4.92 117.12 107.35 1ojo n MET 488 Ca -0.02 -1.60 -0.16 0.00 0.00 0.00 0.00 57.70 55.92 1ojo n MET 488 Cb 0.23 -1.46 0.07 0.00 0.00 0.00 0.00 33.22 32.06 1ojo n MET 488 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1ojo n SER 489 N 0.88 1.19 -3.99 3.17 7.64 -0.66 -5.08 113.62 116.77 1ojo n SER 489 Ca 0.17 -1.94 -0.08 0.00 1.01 0.00 0.00 58.87 58.04 1ojo n SER 489 Cb 0.49 -0.41 -0.09 0.00 -1.01 0.00 0.00 64.21 63.19 1ojo n SER 489 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1ojo s GLU 490 N -4.18 0.72 3.59 1.43 -1.05 -1.26 -4.75 118.70 113.20 1ojo s GLU 490 Ca 0.46 -1.11 0.00 0.00 -0.15 0.00 0.00 54.97 54.17 1ojo s GLU 490 Cb -0.03 0.27 0.00 0.00 -0.44 0.00 0.00 34.13 33.93 1ojo s GLU 490 CO 0.30 -0.18 0.00 0.41 0.95 0.00 0.00 175.26 176.74 1ojo n GLY 491 N 0.03 2.41 0.33 -3.83 0.00 -1.26 -2.56 105.19 100.32 1ojo n GLY 491 Ca -0.14 -0.27 0.07 0.00 0.00 0.00 0.00 46.02 45.67 1ojo n GLY 491 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ojo h GLU 492 N 0.00 0.80 -0.18 1.61 4.22 -1.99 0.31 114.58 119.35 1ojo h GLU 492 Ca 0.00 -0.05 0.03 0.00 0.08 0.00 0.00 59.36 59.42 1ojo h GLU 492 Cb 0.00 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.04 1ojo h GLU 492 CO 0.00 0.53 0.01 1.15 -2.18 0.00 0.00 179.01 178.52 1ojo h THR 493 N 0.83 0.89 -0.22 0.32 2.02 -1.93 0.94 112.91 115.75 1ojo h THR 493 Ca 0.47 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.62 1ojo h THR 493 Cb 0.54 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.75 1ojo h THR 493 CO -0.30 0.01 0.10 0.50 0.37 0.00 0.00 175.52 176.21 1ojo h LYS 494 N 0.07 0.33 -0.16 6.66 3.64 -1.05 -2.32 116.57 123.74 1ojo h LYS 494 Ca 0.08 -0.05 0.04 0.00 -1.27 0.00 0.00 60.65 59.45 1ojo h LYS 494 Cb 0.10 -0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.82 1ojo h LYS 494 CO -0.13 0.35 -0.09 1.96 -2.27 0.00 0.00 179.45 179.27 1ojo h GLN 495 N 0.22 -0.08 -0.54 1.90 4.20 -0.56 -1.07 115.11 119.18 1ojo h GLN 495 Ca 0.08 0.01 -0.08 0.00 0.06 0.00 0.00 58.65 58.71 1ojo h GLN 495 Cb 0.14 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 1ojo h GLN 495 CO -0.01 -0.06 0.01 0.07 -0.67 0.00 0.00 178.83 178.18 1ojo h ARG 496 N -0.09 0.92 -0.33 1.46 0.11 -0.79 -1.44 114.38 114.22 1ojo h ARG 496 Ca 0.09 -0.26 -0.11 0.00 0.10 0.00 0.00 59.98 59.80 1ojo h ARG 496 Cb 0.22 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.19 1ojo h ARG 496 CO -0.21 0.91 -0.24 -0.07 0.10 0.00 0.00 179.97 180.45 1ojo h LEU 497 N 0.85 0.67 -0.54 0.08 3.38 -1.20 -0.47 115.31 118.08 1ojo h LEU 497 Ca 0.16 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.86 1ojo h LEU 497 Cb 0.49 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1ojo h LEU 497 CO 0.02 0.89 0.23 1.56 0.09 0.00 0.00 178.44 181.24 1ojo h GLN 498 N 0.58 0.80 -0.60 1.13 4.20 -0.88 -1.92 115.11 118.42 1ojo h GLN 498 Ca 0.08 -0.14 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 1ojo h GLN 498 Cb 0.72 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 1ojo h GLN 498 CO 0.06 0.69 0.17 0.77 -0.67 0.00 0.00 178.83 179.84 1ojo h SER 499 N 0.73 0.85 -0.09 1.46 0.02 -0.86 0.23 113.55 115.90 1ojo h SER 499 Ca 0.18 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1ojo h SER 499 Cb 0.17 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.49 1ojo h SER 499 CO -0.02 0.81 0.04 0.25 -1.14 0.00 0.00 176.83 176.77 1ojo h LEU 500 N 0.88 0.12 -0.47 5.07 5.85 -0.78 -0.67 115.31 125.30 1ojo h LEU 500 Ca 0.20 -0.14 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 1ojo h LEU 500 Cb 0.28 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1ojo h LEU 500 CO -0.01 0.23 0.17 0.58 -0.34 0.00 0.00 178.44 179.07 1ojo h VAL 501 N 0.00 1.21 -0.02 1.05 2.07 -1.14 -2.47 116.25 116.96 1ojo h VAL 501 Ca 0.03 -0.68 0.00 0.00 0.82 0.00 0.00 66.70 66.88 1ojo h VAL 501 Cb 0.14 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1ojo h VAL 501 CO -0.00 0.25 -0.00 0.50 0.02 0.00 0.00 177.57 178.34 1ojo h LYS 502 N 0.62 0.01 -0.43 1.57 3.64 -0.78 -1.39 116.57 119.81 1ojo h LYS 502 Ca 0.15 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.45 1ojo h LYS 502 Cb 0.22 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1ojo h LYS 502 CO -0.01 0.00 -0.06 0.00 -2.27 0.00 0.00 179.45 177.11 1ojo h THR 503 N 0.01 1.25 -0.03 1.00 1.03 -1.11 -0.92 112.91 114.12 1ojo h THR 503 Ca 0.01 -1.06 -0.00 0.00 -0.01 0.00 0.00 66.41 65.34 1ojo h THR 503 Cb 0.01 0.98 -0.00 0.00 -1.07 0.00 0.00 68.15 68.08 1ojo h THR 503 CO -0.02 0.37 0.01 0.40 -0.01 0.00 0.00 175.52 176.26 1ojo h ILE 504 N 0.68 1.21 -0.59 0.00 2.04 -1.24 -1.72 117.51 117.88 1ojo h ILE 504 Ca 0.12 -0.62 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 1ojo h ILE 504 Cb 0.51 1.56 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 1ojo h ILE 504 CO 0.03 0.17 0.36 0.58 0.00 0.00 0.00 178.15 179.28 1ojo h VAL 505 N -0.19 1.18 0.00 1.67 2.07 -1.15 -2.35 116.25 117.48 1ojo h VAL 505 Ca 0.01 -0.40 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1ojo h VAL 505 Cb 0.26 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1ojo h VAL 505 CO 0.00 0.18 0.00 1.56 0.02 0.00 0.00 177.57 179.33 1ojo h GLN 506 N 0.80 0.00 0.00 1.57 4.20 -1.11 -2.20 115.11 118.37 1ojo h GLN 506 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 1ojo h GLN 506 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1ojo h GLN 506 CO -0.04 0.00 -0.29 -1.13 -0.67 0.00 0.00 178.83 176.70 1ojo n SER 507 N -2.67 0.60 -4.44 1.46 3.41 -0.65 -4.68 113.62 106.65 1ojo n SER 507 Ca 0.02 0.30 -0.43 0.00 -0.26 0.00 0.00 58.87 58.49 1ojo n SER 507 Cb 0.28 -0.27 -0.04 0.00 -0.26 0.00 0.00 64.21 63.93 1ojo n SER 507 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ojo s ASP 508 N -3.98 6.25 0.00 4.04 -1.08 -0.83 -4.77 116.67 116.30 1ojo s ASP 508 Ca 0.10 -1.25 0.27 0.00 -0.52 0.00 0.00 52.55 51.14 1ojo s ASP 508 Cb 0.14 -2.39 0.89 0.00 -1.46 0.00 0.00 42.92 40.10 1ojo s ASP 508 CO 0.64 -1.32 1.65 -1.54 0.52 0.00 0.00 175.17 175.13 1ojo n SER 509 N 7.24 1.77 -0.13 -0.34 3.41 -1.26 -4.32 113.62 119.99 1ojo n SER 509 Ca -0.00 -1.60 -0.21 0.00 -0.26 0.00 0.00 58.87 56.79 1ojo n SER 509 Cb 0.45 -0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 64.29 1ojo n SER 509 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ojo n TYR 510 N 0.39 0.00 -4.70 7.33 9.36 -1.26 -4.99 117.16 123.28 1ojo n TYR 510 Ca 0.18 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 61.07 1ojo n TYR 510 Cb 0.40 -0.96 -0.13 0.00 -0.63 0.00 0.00 39.34 38.02 1ojo n TYR 510 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1ojo s TYR 511 N -2.50 2.85 -0.53 2.98 5.04 -1.26 -5.08 117.35 118.86 1ojo s TYR 511 Ca -0.35 -0.33 -0.27 0.00 -2.44 0.00 0.00 57.07 53.69 1ojo s TYR 511 Cb 0.11 -1.79 0.03 0.00 0.35 0.00 0.00 41.96 40.66 1ojo s TYR 511 CO 0.54 0.03 1.05 0.34 -1.34 0.00 0.00 175.55 176.16 1ojo s ASP 512 N -0.14 6.46 0.40 4.32 2.15 -1.26 -4.92 116.67 123.69 1ojo s ASP 512 Ca 0.00 0.04 0.19 0.00 0.43 0.00 0.00 52.55 53.21 1ojo s ASP 512 Cb -0.13 -2.49 1.13 0.00 -0.30 0.00 0.00 42.92 41.12 1ojo s ASP 512 CO 0.03 -1.27 1.77 1.62 -0.17 0.00 0.00 175.17 177.15 1ojo h VAL 513 N 6.11 0.50 0.00 1.11 3.04 -1.93 -0.20 116.25 124.89 1ojo h VAL 513 Ca -0.25 -0.13 -0.00 0.00 -1.01 0.00 0.00 66.70 65.31 1ojo h VAL 513 Cb 1.07 0.10 -0.00 0.00 -2.01 0.00 0.00 31.29 30.45 1ojo h VAL 513 CO 1.11 0.07 -0.02 -0.26 -1.01 0.00 0.00 177.57 177.46 1ojo h PHE 514 N 0.37 0.00 0.00 3.17 0.04 -1.93 -1.76 116.94 116.83 1ojo h PHE 514 Ca 0.60 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.37 1ojo h PHE 514 Cb 1.57 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.72 1ojo h PHE 514 CO -0.00 0.02 0.00 0.87 -0.60 0.00 0.00 178.31 178.59 1ojo h LYS 515 N 0.00 0.00 0.00 1.51 1.57 -1.44 -2.42 116.57 115.79 1ojo h LYS 515 Ca -0.00 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 1ojo h LYS 515 Cb 0.07 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.26 1ojo h LYS 515 CO 0.00 0.00 -0.63 -1.71 -0.57 0.00 0.00 179.45 176.54 1ojo n ASN 516 N -2.67 1.47 -4.16 0.86 5.15 -0.66 -4.90 115.26 110.36 1ojo n ASN 516 Ca -0.02 -3.19 -0.38 0.00 -0.60 0.00 0.00 54.58 50.40 1ojo n ASN 516 Cb 0.09 -0.44 -0.11 0.00 -0.53 0.00 0.00 39.78 38.80 1ojo n ASN 516 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1ojo s LEU 517 N -2.09 5.31 -0.22 1.20 1.43 -0.91 -4.79 118.68 118.60 1ojo s LEU 517 Ca 0.35 -1.93 0.12 0.00 -1.03 0.00 0.00 54.13 51.64 1ojo s LEU 517 Cb 0.36 -1.88 0.74 0.00 0.03 0.00 0.00 46.19 45.44 1ojo s LEU 517 CO -0.09 -0.57 1.64 0.29 0.23 0.00 0.00 176.35 177.85 1ojo n LYS 518 N 4.70 4.49 -3.91 1.70 4.76 -1.26 -4.77 118.16 123.87 1ojo n LYS 518 Ca -0.05 -2.86 -0.10 0.00 -2.87 0.00 0.00 58.31 52.43 1ojo n LYS 518 Cb 0.41 -2.20 -0.09 0.00 -1.84 0.00 0.00 35.03 31.31 1ojo n LYS 518 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1ojo s THR 519 N -2.62 0.13 0.32 -0.18 -4.23 -1.26 -4.91 115.64 102.89 1ojo s THR 519 Ca 0.50 -1.04 0.05 0.00 -1.18 0.00 0.00 61.69 60.02 1ojo s THR 519 Cb 0.38 -0.85 0.11 0.00 1.34 0.00 0.00 72.50 73.48 1ojo s THR 519 CO 0.14 -0.57 1.81 1.88 -0.54 0.00 0.00 174.62 177.34 1ojo h TYR 520 N 3.70 0.43 -0.48 3.99 0.05 -1.63 -2.26 116.97 120.77 1ojo h TYR 520 Ca -0.32 -0.07 -0.11 0.00 0.05 0.00 0.00 58.73 58.28 1ojo h TYR 520 Cb 1.19 -0.11 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 1ojo h TYR 520 CO 0.54 0.56 -0.13 -0.22 -1.05 0.00 0.00 178.16 177.87 1ojo h LYS 521 N 0.37 0.90 -0.59 4.88 1.63 -1.80 0.48 116.57 122.43 1ojo h LYS 521 Ca 0.06 -0.32 -0.08 0.00 -0.85 0.00 0.00 60.65 59.46 1ojo h LYS 521 Cb 0.53 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.08 1ojo h LYS 521 CO 0.03 0.97 0.05 -0.44 -3.45 0.00 0.00 179.45 176.62 1ojo h ASP 522 N 0.80 0.97 -0.22 4.20 3.32 -1.84 0.31 116.42 123.96 1ojo h ASP 522 Ca 0.13 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 1ojo h ASP 522 Cb 0.65 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1ojo h ASP 522 CO 0.05 1.01 0.08 0.40 -1.72 0.00 0.00 179.24 179.06 1ojo h ILE 523 N 0.89 1.17 -0.29 0.35 2.04 -1.19 -2.21 117.51 118.27 1ojo h ILE 523 Ca 0.17 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.53 1ojo h ILE 523 Cb 0.48 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 1ojo h ILE 523 CO 0.02 0.17 0.17 -1.28 0.00 0.00 0.00 178.15 177.23 1ojo h SER 524 N 0.19 0.28 -0.51 1.72 0.87 -0.66 -1.48 113.55 113.96 1ojo h SER 524 Ca 0.07 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.67 1ojo h SER 524 Cb 0.18 -0.06 -0.04 0.00 -0.44 0.00 0.00 62.40 62.04 1ojo h SER 524 CO -0.01 0.21 0.27 -0.07 -0.53 0.00 0.00 176.83 176.70 1ojo h LEU 525 N 0.35 0.40 -0.72 2.23 3.38 -0.86 -1.70 115.31 118.39 1ojo h LEU 525 Ca 0.11 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 1ojo h LEU 525 Cb -0.01 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 1ojo h LEU 525 CO -0.05 0.28 0.16 -0.03 0.09 0.00 0.00 178.44 178.89 1ojo h MET 526 N 0.53 1.14 -0.48 1.13 4.05 -1.14 -1.70 114.93 118.47 1ojo h MET 526 Ca 0.22 -0.28 -0.06 0.00 -0.28 0.00 0.00 59.70 59.30 1ojo h MET 526 Cb 0.10 -0.15 -0.02 0.00 -0.80 0.00 0.00 31.60 30.74 1ojo h MET 526 CO -0.14 1.01 0.07 1.96 0.23 0.00 0.00 176.91 180.04 1ojo h GLN 527 N 1.08 0.79 -0.54 0.39 4.20 -0.94 -1.14 115.11 118.96 1ojo h GLN 527 Ca 0.22 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.66 1ojo h GLN 527 Cb 0.38 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.05 1ojo h GLN 527 CO 0.00 0.80 0.12 0.66 -0.67 0.00 0.00 178.83 179.75 1ojo h SER 528 N 0.66 0.82 0.01 1.46 4.64 -1.18 -2.01 113.55 117.96 1ojo h SER 528 Ca 0.14 -0.24 0.01 0.00 -0.47 0.00 0.00 61.79 61.23 1ojo h SER 528 Cb 0.40 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1ojo h SER 528 CO 0.01 0.85 -0.05 0.25 -0.87 0.00 0.00 176.83 177.02 1ojo h LEU 529 N 0.76 -0.14 -1.52 5.97 6.46 -1.16 -0.70 115.31 124.98 1ojo h LEU 529 Ca 0.17 0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.91 1ojo h LEU 529 Cb 0.35 0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.34 1ojo h LEU 529 CO 0.00 -0.08 -0.14 -0.07 -0.62 0.00 0.00 178.44 177.53 1ojo h LEU 530 N -0.10 0.12 -0.42 2.25 3.38 -1.09 -2.97 115.31 116.49 1ojo h LEU 530 Ca 0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ojo h LEU 530 Cb 0.12 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1ojo h LEU 530 CO -0.04 0.28 -0.54 -1.54 0.09 0.00 0.00 178.44 176.69 1ojo n SER 531 N -4.31 1.18 -4.57 -0.43 3.41 -0.77 -4.85 113.62 103.29 1ojo n SER 531 Ca -0.01 -0.95 -0.42 0.00 -0.26 0.00 0.00 58.87 57.22 1ojo n SER 531 Cb 0.25 0.45 -0.03 0.00 -0.26 0.00 0.00 64.21 64.62 1ojo n SER 531 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ojo s ASP 532 N -2.71 6.44 0.57 4.04 -1.08 -0.29 -4.87 116.67 118.77 1ojo s ASP 532 Ca 0.16 0.04 0.38 0.00 -0.52 0.00 0.00 52.55 52.61 1ojo s ASP 532 Cb 0.18 -2.53 1.90 0.00 -1.46 0.00 0.00 42.92 41.00 1ojo s ASP 532 CO 0.65 -1.43 2.14 0.00 0.52 0.00 0.00 175.17 177.06 1ojo h ALA 533 N 9.49 1.00 0.00 3.66 0.00 -1.88 -1.68 119.26 129.85 1ojo h ALA 533 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ojo h ALA 533 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1ojo h ALA 533 CO 1.17 0.00 0.00 0.78 0.00 0.00 0.00 179.25 181.20 1ojo h GLY 534 N 0.77 0.00 -7.47 0.00 0.00 -1.95 -3.41 103.07 91.01 1ojo h GLY 534 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1ojo h GLY 534 CO 0.00 0.00 -0.30 0.14 0.00 0.00 0.00 176.54 176.38 1ojo s VAL 535 N -3.34 5.18 0.35 4.60 1.01 -0.63 -5.05 120.40 122.51 1ojo s VAL 535 Ca 0.05 -0.02 -0.28 0.00 0.00 0.00 0.00 61.98 61.73 1ojo s VAL 535 Cb 0.10 -3.83 -0.10 0.00 0.00 0.00 0.00 36.38 32.55 1ojo s VAL 535 CO 0.47 -0.11 1.32 0.00 0.00 0.00 0.00 175.10 176.78 1ojo s ALA 536 N 1.99 3.45 -0.40 5.51 0.00 -1.26 -4.95 121.76 126.09 1ojo s ALA 536 Ca 0.11 1.27 0.01 0.00 0.00 0.00 0.00 51.96 53.36 1ojo s ALA 536 Cb -0.17 -3.49 0.13 0.00 0.00 0.00 0.00 23.12 19.60 1ojo s ALA 536 CO 0.12 -0.71 0.22 0.45 0.00 0.00 0.00 175.76 175.84 1ojo s SER 537 N -0.53 3.46 -0.07 0.00 0.15 -1.26 -4.38 113.70 111.07 1ojo s SER 537 Ca 0.51 -2.42 0.04 0.00 0.70 0.00 0.00 55.95 54.77 1ojo s SER 537 Cb -0.40 -0.82 -0.02 0.00 -1.71 0.00 0.00 66.02 63.07 1ojo s SER 537 CO 0.53 -0.29 -0.18 -0.69 1.20 0.00 0.00 173.24 173.80 1ojo s VAL 538 N 0.66 2.65 0.18 4.45 1.01 -1.26 -4.94 120.40 123.15 1ojo s VAL 538 Ca 0.17 -0.85 -0.33 0.00 0.00 0.00 0.00 61.98 60.98 1ojo s VAL 538 Cb -0.24 -2.03 -0.15 0.00 0.00 0.00 0.00 36.38 33.96 1ojo s VAL 538 CO -0.01 0.57 1.18 -2.65 0.00 0.00 0.00 175.10 174.19 1ojo n PRO 539 N 2.89 1.25 -1.99 2.72 -0.02 -1.26 -4.86 135.00 133.73 1ojo n PRO 539 Ca -0.18 0.45 -0.38 0.00 -2.02 0.00 0.00 63.50 61.37 1ojo n PRO 539 Cb 0.52 -1.96 0.02 0.00 -0.02 0.00 0.00 33.50 32.06 1ojo n PRO 539 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1ojo s ARG 540 N -0.41 3.51 0.84 -0.52 0.52 -1.26 -5.01 118.95 116.61 1ojo s ARG 540 Ca 0.72 2.07 -0.12 0.00 -0.52 0.00 0.00 55.73 57.88 1ojo s ARG 540 Cb -0.83 -2.41 0.10 0.00 0.52 0.00 0.00 34.95 32.33 1ojo s ARG 540 CO 0.52 -0.84 1.19 -0.08 0.02 0.00 0.00 175.30 176.11 1ojo s THR 541 N -1.38 2.00 0.54 0.02 -1.32 -1.26 -4.68 115.64 109.56 1ojo s THR 541 Ca 0.66 0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.94 1ojo s THR 541 Cb -0.36 -2.97 -0.05 0.00 -1.51 0.00 0.00 72.50 67.61 1ojo s THR 541 CO 0.44 0.00 1.18 -0.44 -2.21 0.00 0.00 174.62 173.59 1ojo s SER 542 N -4.55 5.58 0.20 8.08 0.01 -1.26 -4.71 113.70 117.05 1ojo s SER 542 Ca 0.63 2.33 -0.20 0.00 1.31 0.00 0.00 55.95 60.02 1ojo s SER 542 Cb -0.11 -2.60 0.04 0.00 0.21 0.00 0.00 66.02 63.57 1ojo s SER 542 CO 0.50 -1.32 0.58 -0.72 0.41 0.00 0.00 173.24 172.69 1ojo s TYR 543 N -1.62 -0.28 -0.22 2.43 -0.85 -0.67 -4.94 117.35 111.19 1ojo s TYR 543 Ca 0.73 -0.03 -0.05 0.00 -0.52 0.00 0.00 57.07 57.19 1ojo s TYR 543 Cb -0.28 0.51 0.11 0.00 0.38 0.00 0.00 41.96 42.67 1ojo s TYR 543 CO 0.32 -0.95 0.40 -1.17 -1.52 0.00 0.00 175.55 172.64 1ojo s LEU 544 N -2.84 -0.65 -0.22 -3.49 0.20 -1.19 -0.85 118.68 109.64 1ojo s LEU 544 Ca 0.06 0.64 -0.05 0.00 0.69 0.00 0.00 54.13 55.47 1ojo s LEU 544 Cb -0.02 1.24 -0.02 0.00 -0.43 0.00 0.00 46.19 46.96 1ojo s LEU 544 CO -0.05 -0.26 0.00 -0.44 -0.29 0.00 0.00 176.35 175.31 1ojo s SER 545 N 2.58 4.74 -0.71 3.68 0.01 0.95 -4.86 113.70 120.10 1ojo s SER 545 Ca 0.05 -0.26 -0.15 0.00 1.31 0.00 0.00 55.95 56.90 1ojo s SER 545 Cb -0.14 -1.82 0.17 0.00 0.21 0.00 0.00 66.02 64.44 1ojo s SER 545 CO -0.14 0.01 0.70 0.00 0.41 0.00 0.00 173.24 174.22 1ojo s ALA 546 N 1.30 3.83 -1.38 1.44 0.00 -1.26 -1.25 121.76 124.44 1ojo s ALA 546 Ca 0.04 -2.92 -0.11 0.00 0.00 0.00 0.00 51.96 48.97 1ojo s ALA 546 Cb -0.15 -3.47 0.10 0.00 0.00 0.00 0.00 23.12 19.60 1ojo s ALA 546 CO 0.01 -2.24 2.10 1.19 0.00 0.00 0.00 175.76 176.81 1ojo n PHE 547 N 4.80 3.19 0.20 0.00 3.72 -0.20 -4.76 117.46 124.40 1ojo n PHE 547 Ca 0.03 -2.89 0.06 0.00 -0.05 0.00 0.00 57.45 54.60 1ojo n PHE 547 Cb 0.44 -2.26 0.55 0.00 -0.94 0.00 0.00 39.48 37.27 1ojo n PHE 547 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1ojo h ASN 548 N 5.80 0.10 0.36 4.37 2.35 -1.89 -0.91 115.58 125.77 1ojo h ASN 548 Ca 0.50 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.25 1ojo h ASN 548 Cb 0.61 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.96 1ojo h ASN 548 CO 1.76 0.14 0.00 0.29 -1.65 0.00 0.00 177.43 177.97 1ojo n LYS 549 N -4.45 0.17 -0.05 0.81 4.76 -1.26 -2.58 118.16 115.55 1ojo n LYS 549 Ca -0.02 0.16 0.00 0.00 -2.87 0.00 0.00 58.31 55.59 1ojo n LYS 549 Cb 0.14 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.84 1ojo n LYS 549 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ojo n MET 550 N -1.34 0.63 -3.89 1.97 0.00 -0.80 -4.94 117.12 108.76 1ojo n MET 550 Ca 0.07 -0.81 -0.29 0.00 0.00 0.00 0.00 57.70 56.66 1ojo n MET 550 Cb 0.14 -0.63 0.03 0.00 0.00 0.00 0.00 33.22 32.76 1ojo n MET 550 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1ojo n ASP 551 N -0.14 -4.31 -4.26 3.17 8.00 -0.41 -4.72 116.55 113.87 1ojo n ASP 551 Ca 0.00 -0.78 -0.18 0.00 0.71 0.00 0.00 54.79 54.54 1ojo n ASP 551 Cb 0.48 -3.91 -0.11 0.00 -0.02 0.00 0.00 41.12 37.56 1ojo n ASP 551 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1ojo s LYS 552 N -6.54 1.08 -0.02 -1.24 -0.14 -0.93 -1.98 119.74 109.98 1ojo s LYS 552 Ca 0.57 -1.30 0.00 0.00 -1.36 0.00 0.00 55.97 53.88 1ojo s LYS 552 Cb -0.29 -0.96 0.02 0.00 -1.68 0.00 0.00 37.83 34.93 1ojo s LYS 552 CO 0.83 0.18 0.02 0.99 -0.76 0.00 0.00 175.35 176.61 1ojo s THR 553 N -2.26 -0.01 -0.10 2.17 2.01 -0.75 -1.03 115.64 115.66 1ojo s THR 553 Ca 0.11 0.14 0.03 0.00 0.31 0.00 0.00 61.69 62.29 1ojo s THR 553 Cb -0.04 -0.08 0.00 0.00 0.01 0.00 0.00 72.50 72.39 1ojo s THR 553 CO 0.04 0.07 -0.22 0.00 -0.69 0.00 0.00 174.62 173.82 1ojo s ALA 554 N 0.77 2.05 0.01 7.40 0.00 -0.38 -0.63 121.76 130.98 1ojo s ALA 554 Ca -0.07 -0.91 0.05 0.00 0.00 0.00 0.00 51.96 51.03 1ojo s ALA 554 Cb -0.09 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 1ojo s ALA 554 CO -0.02 0.21 -0.14 1.41 0.00 0.00 0.00 175.76 177.21 1ojo s MET 555 N 0.48 1.09 -0.07 0.00 0.00 0.69 -0.03 119.30 121.45 1ojo s MET 555 Ca -0.16 -0.62 -0.03 0.00 0.00 0.00 0.00 55.69 54.88 1ojo s MET 555 Cb -0.17 -1.07 0.04 0.00 0.00 0.00 0.00 34.83 33.62 1ojo s MET 555 CO 0.06 0.28 0.15 -0.47 0.00 0.00 0.00 175.02 175.05 1ojo s TYR 556 N -0.53 -0.17 -0.31 4.11 5.04 -0.03 -0.05 117.35 125.40 1ojo s TYR 556 Ca 0.04 0.50 -0.06 0.00 -2.44 0.00 0.00 57.07 55.11 1ojo s TYR 556 Cb -0.06 -0.10 0.03 0.00 0.35 0.00 0.00 41.96 42.18 1ojo s TYR 556 CO 0.00 -0.18 0.07 1.21 -1.34 0.00 0.00 175.55 175.32 1ojo s ASN 557 N 1.28 5.14 0.19 4.32 3.84 -0.27 -1.67 114.94 127.77 1ojo s ASN 557 Ca -0.08 -1.00 0.09 0.00 0.21 0.00 0.00 52.86 52.08 1ojo s ASN 557 Cb -0.12 -1.84 0.04 0.00 -0.55 0.00 0.00 41.25 38.78 1ojo s ASN 557 CO -0.06 -0.26 1.42 0.00 -2.79 0.00 0.00 177.10 175.41 1ojo h ALA 558 N 8.19 0.61 -0.32 1.71 0.00 -1.84 0.15 119.26 127.76 1ojo h ALA 558 Ca -0.26 -0.74 -0.06 0.00 0.00 0.00 0.00 54.91 53.85 1ojo h ALA 558 Cb 1.09 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 1ojo h ALA 558 CO 0.59 1.02 -0.02 1.49 0.00 0.00 0.00 179.25 182.33 1ojo h GLU 559 N 0.00 0.58 0.00 0.00 4.81 -1.93 -3.29 114.58 114.75 1ojo h GLU 559 Ca -0.01 -0.20 -0.10 0.00 -0.13 0.00 0.00 59.36 58.93 1ojo h GLU 559 Cb 1.48 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.80 1ojo h GLU 559 CO 0.11 0.73 -1.65 1.63 -0.73 0.00 0.00 179.01 179.10 1ojo n LYS 560 N -4.52 0.64 -2.06 1.92 4.76 -1.24 -5.04 118.16 112.62 1ojo n LYS 560 Ca -0.02 0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1ojo n LYS 560 Cb 0.28 -1.67 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 1ojo n LYS 560 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ojo n GLY 561 N 1.35 0.78 3.04 0.72 0.00 0.49 -4.93 105.19 106.64 1ojo n GLY 561 Ca -0.09 -0.54 -0.10 0.00 0.00 0.00 0.00 46.02 45.30 1ojo n GLY 561 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ojo s PHE 562 N -2.85 0.48 0.25 1.61 -0.12 -1.01 -4.64 117.98 111.70 1ojo s PHE 562 Ca 0.00 -0.69 0.10 0.00 -0.05 0.00 0.00 56.93 56.30 1ojo s PHE 562 Cb 0.00 -0.32 -0.05 0.00 -0.63 0.00 0.00 43.02 42.02 1ojo s PHE 562 CO 0.00 -0.20 -0.11 0.20 -0.05 0.00 0.00 175.22 175.06 1ojo s GLY 563 N -1.99 1.75 -0.07 1.99 0.00 0.47 -1.11 107.32 108.35 1ojo s GLY 563 Ca -0.06 -1.69 -0.03 0.00 0.00 0.00 0.00 44.72 42.94 1ojo s GLY 563 CO -0.03 -1.75 0.15 -0.12 0.00 0.00 0.00 173.10 171.34 1ojo s PHE 564 N -2.21 -0.16 -0.08 1.90 5.36 0.92 -0.71 117.98 123.00 1ojo s PHE 564 Ca 0.29 0.50 0.04 0.00 -0.96 0.00 0.00 56.93 56.80 1ojo s PHE 564 Cb -0.07 -0.11 -0.00 0.00 -0.34 0.00 0.00 43.02 42.51 1ojo s PHE 564 CO 0.17 -0.18 -0.22 0.20 -1.46 0.00 0.00 175.22 173.73 1ojo s GLY 565 N 1.30 1.21 -0.26 13.12 0.00 -0.38 -0.22 107.32 122.09 1ojo s GLY 565 Ca -0.08 -0.88 -0.02 0.00 0.00 0.00 0.00 44.72 43.74 1ojo s GLY 565 CO -0.06 -0.34 -0.04 -2.27 0.00 0.00 0.00 173.10 170.39 1ojo s LEU 566 N 0.24 3.30 -0.38 0.66 2.96 0.20 -0.36 118.68 125.30 1ojo s LEU 566 Ca -0.13 -0.85 -0.12 0.00 -0.22 0.00 0.00 54.13 52.81 1ojo s LEU 566 Cb -0.16 -1.70 0.02 0.00 0.50 0.00 0.00 46.19 44.85 1ojo s LEU 566 CO 0.06 -0.14 0.23 -0.55 -1.32 0.00 0.00 176.35 174.63 1ojo s SER 567 N 1.35 5.82 0.29 3.68 0.15 0.16 -1.81 113.70 123.35 1ojo s SER 567 Ca 0.01 -0.95 0.02 0.00 0.70 0.00 0.00 55.95 55.72 1ojo s SER 567 Cb -0.17 -2.05 -0.01 0.00 -1.71 0.00 0.00 66.02 62.08 1ojo s SER 567 CO -0.03 -0.39 0.06 0.18 1.20 0.00 0.00 173.24 174.25 1ojo n LEU 568 N 5.03 0.00 -3.80 3.45 4.77 -0.84 -2.48 117.00 123.14 1ojo n LEU 568 Ca -0.12 -2.06 -0.08 0.00 -0.03 0.00 0.00 56.01 53.72 1ojo n LEU 568 Cb 0.46 0.50 -0.02 0.00 -2.33 0.00 0.00 43.42 42.03 1ojo n LEU 568 CO 0.37 -0.31 0.42 0.72 -1.33 0.00 0.00 177.39 177.27 1ojo s PHE 569 N -2.41 -0.19 0.00 -1.77 -0.71 -1.23 -4.71 117.98 106.96 1ojo s PHE 569 Ca 0.08 -0.21 0.00 0.00 -1.04 0.00 0.00 56.93 55.76 1ojo s PHE 569 Cb 0.00 0.62 0.00 0.00 -1.21 0.00 0.00 43.02 42.44 1ojo s PHE 569 CO 0.06 -1.14 0.00 -1.13 -1.34 0.00 0.00 175.22 171.67 1ojo n SER 570 N -0.43 0.00 0.18 1.98 3.41 -1.24 -4.84 113.62 112.68 1ojo n SER 570 Ca -0.06 -0.38 0.13 0.00 -0.26 0.00 0.00 58.87 58.30 1ojo n SER 570 Cb 0.60 0.00 0.63 0.00 -0.26 0.00 0.00 64.21 65.18 1ojo n SER 570 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ojo h SER 571 N 0.00 0.00 0.53 4.04 4.64 -0.95 -1.40 113.55 120.41 1ojo h SER 571 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ojo h SER 571 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1ojo h SER 571 CO 0.00 0.00 -0.92 0.54 -0.87 0.00 0.00 176.83 175.58 1ojo n ARG 572 N -2.44 0.27 -4.04 4.77 1.74 -1.26 -4.75 116.66 110.96 1ojo n ARG 572 Ca 0.00 0.02 -0.10 0.00 -0.77 0.00 0.00 57.85 56.99 1ojo n ARG 572 Cb 0.15 -1.61 -0.11 0.00 -1.02 0.00 0.00 32.46 29.87 1ojo n ARG 572 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1ojo s THR 573 N -3.18 0.33 0.28 0.55 -4.23 -0.88 -4.82 115.64 103.68 1ojo s THR 573 Ca 0.05 -1.17 -0.27 0.00 -1.18 0.00 0.00 61.69 59.12 1ojo s THR 573 Cb 0.14 -0.66 -0.09 0.00 1.34 0.00 0.00 72.50 73.23 1ojo s THR 573 CO 0.78 -0.55 0.92 -0.22 -0.54 0.00 0.00 174.62 175.01 1ojo s LEU 574 N -1.82 4.47 -0.00 4.79 2.96 -0.43 -3.72 118.68 124.93 1ojo s LEU 574 Ca -0.09 1.85 -0.25 0.00 -0.22 0.00 0.00 54.13 55.42 1ojo s LEU 574 Cb -0.07 -3.81 -0.17 0.00 0.50 0.00 0.00 46.19 42.65 1ojo s LEU 574 CO -0.02 0.04 1.24 -0.55 -1.32 0.00 0.00 176.35 175.74 1ojo h ASN 575 N 3.61 -0.21 -5.09 3.68 7.08 -1.53 -3.44 115.58 119.67 1ojo h ASN 575 Ca -0.46 -0.26 -0.11 0.00 -3.08 0.00 0.00 56.30 52.38 1ojo h ASN 575 Cb 1.20 0.06 -0.17 0.00 -2.08 0.00 0.00 38.32 37.32 1ojo h ASN 575 CO 0.66 0.18 -0.44 -0.72 -2.08 0.00 0.00 177.43 175.03 1ojo s TYR 576 N -4.52 0.13 -0.23 4.14 1.13 -1.26 -4.42 117.35 112.31 1ojo s TYR 576 Ca -0.14 -0.41 -0.05 0.00 -1.41 0.00 0.00 57.07 55.05 1ojo s TYR 576 Cb 0.02 -0.08 -0.02 0.00 -1.10 0.00 0.00 41.96 40.79 1ojo s TYR 576 CO 0.58 -0.43 0.01 -2.00 -2.51 0.00 0.00 175.55 171.20 1ojo s GLU 577 N -2.81 3.51 -0.26 -3.49 2.12 -1.26 -3.50 118.70 113.01 1ojo s GLU 577 Ca -0.03 -0.55 0.02 0.00 0.36 0.00 0.00 54.97 54.77 1ojo s GLU 577 Cb 0.00 -3.16 0.06 0.00 0.26 0.00 0.00 34.13 31.30 1ojo s GLU 577 CO -0.05 -0.19 -0.07 -1.58 -0.54 0.00 0.00 175.26 172.83 1ojo s HIS 578 N 1.53 2.91 0.00 5.30 5.65 -1.26 -4.21 115.29 125.21 1ojo s HIS 578 Ca 0.06 -2.14 -0.25 0.00 0.25 0.00 0.00 55.06 52.98 1ojo s HIS 578 Cb -0.15 -1.87 0.06 0.00 -1.18 0.00 0.00 32.58 29.44 1ojo s HIS 578 CO 0.00 -0.84 0.56 1.41 -0.65 0.00 0.00 174.74 175.22 1ojo s MET 579 N 1.22 1.00 -1.74 2.88 0.00 -1.12 -4.82 119.30 116.72 1ojo s MET 579 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 55.69 55.61 1ojo s MET 579 Cb -0.19 0.46 0.00 0.00 0.00 0.00 0.00 34.83 35.10 1ojo s MET 579 CO -0.06 -0.33 0.00 0.09 0.00 0.00 0.00 175.02 174.71 1ojo n ASN 580 N 0.72 -5.65 -1.16 1.11 3.02 -1.26 -1.66 115.26 110.38 1ojo n ASN 580 Ca -0.19 0.03 -0.14 0.00 -0.03 0.00 0.00 54.58 54.25 1ojo n ASN 580 Cb 0.58 -4.70 -0.05 0.00 -0.61 0.00 0.00 39.78 35.01 1ojo n ASN 580 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1ojo n LYS 581 N -2.86 -0.99 -4.42 3.52 5.02 -1.26 -4.86 118.16 112.31 1ojo n LYS 581 Ca -0.23 0.93 -0.32 0.00 -2.02 0.00 0.00 58.31 56.67 1ojo n LYS 581 Cb 0.68 -5.05 -0.10 0.00 -0.02 0.00 0.00 35.03 30.53 1ojo n LYS 581 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ojo s GLU 582 N -3.47 2.47 -1.08 1.97 2.02 -0.66 -1.35 118.70 118.59 1ojo s GLU 582 Ca 0.00 -0.79 -0.01 0.00 0.02 0.00 0.00 54.97 54.20 1ojo s GLU 582 Cb 0.00 -2.46 -0.01 0.00 0.10 0.00 0.00 34.13 31.77 1ojo s GLU 582 CO 0.00 0.58 0.90 -1.71 0.02 0.00 0.00 175.26 175.06 1ojo n ASN 583 N 1.39 -2.46 0.29 -0.19 5.15 0.66 -2.79 115.26 117.31 1ojo n ASN 583 Ca -0.15 -0.57 0.19 0.00 -0.60 0.00 0.00 54.58 53.45 1ojo n ASN 583 Cb 0.52 -4.73 0.91 0.00 -0.53 0.00 0.00 39.78 35.96 1ojo n ASN 583 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1ojo h LYS 584 N -1.66 0.00 -0.18 1.20 1.57 -1.50 -3.22 116.57 112.78 1ojo h LYS 584 Ca -0.54 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.08 1ojo h LYS 584 Cb 1.31 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.42 1ojo h LYS 584 CO 0.45 0.00 -0.73 0.54 -0.57 0.00 0.00 179.45 179.14 1ojo n ARG 585 N -3.01 1.66 -0.43 3.15 1.74 -1.26 -4.50 116.66 114.00 1ojo n ARG 585 Ca -0.01 -3.21 0.04 0.00 -0.77 0.00 0.00 57.85 53.89 1ojo n ARG 585 Cb 0.19 -1.40 0.20 0.00 -1.02 0.00 0.00 32.46 30.43 1ojo n ARG 585 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ojo n GLY 586 N -0.65 2.09 0.30 -0.13 0.00 -1.22 -4.62 105.19 100.96 1ojo n GLY 586 Ca 0.20 -0.46 0.12 0.00 0.00 0.00 0.00 46.02 45.88 1ojo n GLY 586 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1ojo n TRP 587 N 0.35 0.53 -0.57 1.61 8.01 -1.26 -1.69 117.44 124.41 1ojo n TRP 587 Ca 0.14 1.03 0.07 0.00 -1.31 0.00 0.00 57.50 57.44 1ojo n TRP 587 Cb 0.69 -1.13 0.22 0.00 -2.01 0.00 0.00 31.31 29.08 1ojo n TRP 587 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1ojo n TYR 588 N -5.25 0.78 0.56 -5.99 4.01 -1.26 -4.67 117.16 105.34 1ojo n TYR 588 Ca 0.20 -0.67 0.05 0.00 -0.16 0.00 0.00 57.90 57.32 1ojo n TYR 588 Cb 0.64 -0.17 0.29 0.00 -0.31 0.00 0.00 39.34 39.78 1ojo n TYR 588 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1ojo n THR 589 N 0.13 0.55 -1.06 -0.72 -2.24 -0.68 -2.21 114.28 108.05 1ojo n THR 589 Ca 0.17 0.14 0.02 0.00 -2.27 0.00 0.00 64.05 62.11 1ojo n THR 589 Cb 0.68 -0.96 0.03 0.00 -2.10 0.00 0.00 70.33 67.97 1ojo n THR 589 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1ojo n SER 590 N -1.21 0.87 -2.10 3.42 7.64 -1.26 -4.52 113.62 116.46 1ojo n SER 590 Ca 0.06 -1.87 -0.18 0.00 1.01 0.00 0.00 58.87 57.90 1ojo n SER 590 Cb 0.07 -0.13 -0.04 0.00 -1.01 0.00 0.00 64.21 63.10 1ojo n SER 590 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ojo n ASP 591 N -0.37 6.11 -0.09 6.43 9.92 -0.94 -3.50 116.55 134.11 1ojo n ASP 591 Ca 0.03 -2.94 0.00 0.00 -0.53 0.00 0.00 54.79 51.35 1ojo n ASP 591 Cb 0.52 -1.20 0.00 0.00 -0.64 0.00 0.00 41.12 39.80 1ojo n ASP 591 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1ojo n GLY 592 N 1.08 0.61 3.77 0.44 0.00 -1.04 -4.36 105.19 105.69 1ojo n GLY 592 Ca 0.36 -0.77 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 1ojo n GLY 592 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ojo s MET 593 N -3.88 4.55 0.19 1.61 0.00 -1.04 -3.92 119.30 116.82 1ojo s MET 593 Ca 0.00 1.50 0.10 0.00 0.00 0.00 0.00 55.69 57.29 1ojo s MET 593 Cb 0.00 -2.90 -0.04 0.00 0.00 0.00 0.00 34.83 31.88 1ojo s MET 593 CO 0.00 0.21 -0.21 -0.59 0.00 0.00 0.00 175.02 174.44 1ojo s PHE 594 N -1.46 2.07 0.00 4.11 -0.71 -0.71 -0.66 117.98 120.63 1ojo s PHE 594 Ca 0.49 -0.41 0.07 0.00 -1.04 0.00 0.00 56.93 56.04 1ojo s PHE 594 Cb -0.23 -1.00 -0.02 0.00 -1.21 0.00 0.00 43.02 40.55 1ojo s PHE 594 CO 0.30 0.45 -0.20 0.71 -1.34 0.00 0.00 175.22 175.14 1ojo s TYR 595 N -2.01 1.82 -0.13 3.49 1.51 0.51 -4.76 117.35 117.77 1ojo s TYR 595 Ca 0.20 -0.35 0.02 0.00 -1.01 0.00 0.00 57.07 55.92 1ojo s TYR 595 Cb -0.06 -1.14 0.01 0.00 -0.11 0.00 0.00 41.96 40.66 1ojo s TYR 595 CO 0.09 0.01 -0.18 -1.17 -1.11 0.00 0.00 175.55 173.19 1ojo s LEU 596 N -0.72 1.88 -0.37 -1.29 2.96 -1.26 -1.25 118.68 118.63 1ojo s LEU 596 Ca 0.08 -0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 53.40 1ojo s LEU 596 Cb -0.08 -1.25 0.06 0.00 0.50 0.00 0.00 46.19 45.41 1ojo s LEU 596 CO 0.00 0.03 0.17 -0.31 -1.32 0.00 0.00 176.35 174.92 1ojo s TYR 597 N 1.01 3.31 0.00 5.38 2.02 0.11 -4.96 117.35 124.23 1ojo s TYR 597 Ca -0.04 -1.52 0.00 0.00 -0.37 0.00 0.00 57.07 55.14 1ojo s TYR 597 Cb -0.15 -2.58 0.00 0.00 -0.40 0.00 0.00 41.96 38.83 1ojo s TYR 597 CO -0.04 -0.78 0.00 0.27 -1.57 0.00 0.00 175.55 173.43 1ojo n ASN 598 N 4.84 0.90 0.31 2.29 0.23 -1.26 -0.40 115.26 122.16 1ojo n ASN 598 Ca -0.11 0.00 0.18 0.00 -0.53 0.00 0.00 54.58 54.13 1ojo n ASN 598 Cb 0.44 0.00 0.96 0.00 -2.08 0.00 0.00 39.78 39.10 1ojo n ASN 598 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1ojo h GLY 599 N 0.00 0.00 -7.61 4.83 0.00 -1.11 -3.32 103.07 95.86 1ojo h GLY 599 Ca 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.60 1ojo h GLY 599 CO 0.00 0.00 0.91 -0.35 0.00 0.00 0.00 176.54 177.10 1ojo s ASP 600 N -4.93 6.89 0.65 0.19 2.15 -1.26 -4.84 116.67 115.52 1ojo s ASP 600 Ca -0.04 -2.65 0.43 0.00 0.43 0.00 0.00 52.55 50.72 1ojo s ASP 600 Cb 0.11 -2.36 2.33 0.00 -0.30 0.00 0.00 42.92 42.71 1ojo s ASP 600 CO 0.37 -0.80 2.32 -0.07 -0.17 0.00 0.00 175.17 176.83 1ojo h LEU 601 N 9.43 0.00 -1.04 -1.34 4.07 -1.97 -2.01 115.31 122.46 1ojo h LEU 601 Ca 0.22 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.18 1ojo h LEU 601 Cb 0.95 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.69 1ojo h LEU 601 CO 1.11 0.00 -0.01 -1.54 -1.08 0.00 0.00 178.44 176.92 1ojo n SER 602 N -3.04 1.62 -0.23 -0.43 3.41 -1.26 -4.59 113.62 109.10 1ojo n SER 602 Ca -0.03 -1.52 -0.00 0.00 -0.26 0.00 0.00 58.87 57.06 1ojo n SER 602 Cb 0.08 0.01 0.07 0.00 -0.26 0.00 0.00 64.21 64.10 1ojo n SER 602 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1ojo h HIS 603 N 2.53 -0.42 -0.40 7.33 6.17 -1.72 0.83 115.15 129.47 1ojo h HIS 603 Ca 0.00 0.06 0.00 0.00 0.71 0.00 0.00 60.37 61.14 1ojo h HIS 603 Cb 0.55 0.29 0.00 0.00 2.52 0.00 0.00 27.41 30.76 1ojo h HIS 603 CO 0.00 -0.30 0.00 0.66 0.71 0.00 0.00 177.93 179.00 1ojo n TYR 604 N -5.46 0.68 -3.44 5.26 4.01 -1.26 -4.71 117.16 112.24 1ojo n TYR 604 Ca 0.08 -0.30 0.00 0.00 -0.16 0.00 0.00 57.90 57.52 1ojo n TYR 604 Cb 0.35 -0.06 0.00 0.00 -0.31 0.00 0.00 39.34 39.32 1ojo n TYR 604 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1ojo n SER 605 N 0.65 1.71 -3.92 7.72 7.64 0.28 -4.40 113.62 123.30 1ojo n SER 605 Ca 0.14 -0.59 -0.29 0.00 1.01 0.00 0.00 58.87 59.14 1ojo n SER 605 Cb 0.44 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.65 1ojo n SER 605 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1ojo n ASP 606 N -0.76 -3.57 0.00 6.43 8.00 -1.26 -2.43 116.55 122.95 1ojo n ASP 606 Ca 0.00 -0.84 0.00 0.00 0.71 0.00 0.00 54.79 54.66 1ojo n ASP 606 Cb 0.00 -3.69 0.00 0.00 -0.02 0.00 0.00 41.12 37.41 1ojo n ASP 606 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ojo n GLY 607 N -1.66 0.51 0.15 0.44 0.00 -1.26 -4.97 105.19 98.40 1ojo n GLY 607 Ca -0.04 -0.88 -0.12 0.00 0.00 0.00 0.00 46.02 44.98 1ojo n GLY 607 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1ojo h TYR 608 N 0.00 -0.26 -0.67 1.61 3.20 -1.68 -2.98 116.97 116.19 1ojo h TYR 608 Ca 0.00 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.90 1ojo h TYR 608 Cb 0.05 0.11 -0.04 0.00 1.54 0.00 0.00 36.73 38.40 1ojo h TYR 608 CO 0.00 -0.16 0.44 -1.49 -1.64 0.00 0.00 178.16 175.31 1ojo h TRP 609 N -0.19 0.81 -0.00 -3.82 4.06 -1.88 0.51 115.95 115.43 1ojo h TRP 609 Ca 0.03 0.02 0.00 0.00 2.06 0.00 0.00 58.89 61.00 1ojo h TRP 609 Cb 0.22 -0.27 0.00 0.00 -1.00 0.00 0.00 29.16 28.11 1ojo h TRP 609 CO -0.15 0.49 -0.27 -0.35 -3.56 0.00 0.00 178.44 174.60 1ojo n PRO 610 N -4.45 0.39 -0.00 0.49 -0.04 -1.21 -4.10 135.00 126.08 1ojo n PRO 610 Ca 0.08 -0.18 0.05 0.00 -0.04 0.00 0.00 63.50 63.40 1ojo n PRO 610 Cb 0.08 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.96 1ojo n PRO 610 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1ojo n THR 611 N -1.15 0.00 -2.06 0.52 -2.24 -0.92 -4.12 114.28 104.31 1ojo n THR 611 Ca 0.10 -0.25 -0.40 0.00 -2.27 0.00 0.00 64.05 61.23 1ojo n THR 611 Cb 0.32 0.32 -0.01 0.00 -2.10 0.00 0.00 70.33 68.87 1ojo n THR 611 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ojo s VAL 612 N -2.68 2.62 -0.43 2.28 0.11 0.12 -4.66 120.40 117.77 1ojo s VAL 612 Ca -0.03 0.58 -0.29 0.00 -2.93 0.00 0.00 61.98 59.31 1ojo s VAL 612 Cb 0.07 -3.35 0.01 0.00 -1.53 0.00 0.00 36.38 31.58 1ojo s VAL 612 CO 0.44 0.11 1.39 0.21 -3.33 0.00 0.00 175.10 173.92 1ojo s ASN 613 N -0.63 6.34 0.35 3.54 3.84 -1.26 -4.88 114.94 122.24 1ojo s ASN 613 Ca 0.54 0.77 0.25 0.00 0.21 0.00 0.00 52.86 54.62 1ojo s ASN 613 Cb -0.39 -2.54 1.26 0.00 -0.55 0.00 0.00 41.25 39.03 1ojo s ASN 613 CO 0.51 -1.44 1.75 1.55 -2.79 0.00 0.00 177.10 176.68 1ojo h PRO 614 N 10.63 0.00 -0.00 0.43 0.13 -1.91 -2.01 132.00 139.27 1ojo h PRO 614 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1ojo h PRO 614 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1ojo h PRO 614 CO 1.09 0.00 -0.29 0.66 -0.23 0.00 0.00 178.00 179.23 1ojo n TYR 615 N -2.36 0.00 -2.61 1.56 4.01 -1.26 -4.23 117.16 112.28 1ojo n TYR 615 Ca -0.01 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.55 1ojo n TYR 615 Cb 0.09 -0.32 0.01 0.00 -0.31 0.00 0.00 39.34 38.80 1ojo n TYR 615 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1ojo n LYS 616 N -1.43 2.25 -1.88 -0.72 5.02 -0.75 -4.94 118.16 115.70 1ojo n LYS 616 Ca 0.07 -3.89 -0.41 0.00 -2.02 0.00 0.00 58.31 52.06 1ojo n LYS 616 Cb 0.33 -1.75 -0.02 0.00 -0.02 0.00 0.00 35.03 33.57 1ojo n LYS 616 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1ojo s MET 617 N -3.30 4.19 -0.01 1.97 -1.94 -1.25 -4.71 119.30 114.25 1ojo s MET 617 Ca 0.38 2.46 -0.37 0.00 -1.71 0.00 0.00 55.69 56.45 1ojo s MET 617 Cb 0.42 -3.06 -0.15 0.00 2.01 0.00 0.00 34.83 34.05 1ojo s MET 617 CO -0.08 -0.53 1.56 -2.30 -0.01 0.00 0.00 175.02 173.67 1ojo n PRO 618 N 2.11 1.50 0.00 2.03 -0.02 -1.26 -2.10 135.00 137.27 1ojo n PRO 618 Ca 0.07 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1ojo n PRO 618 Cb 0.39 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.61 1ojo n PRO 618 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ojo n GLY 619 N 3.38 2.72 3.82 -1.23 0.00 0.24 -1.74 105.19 112.38 1ojo n GLY 619 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.88 1ojo n GLY 619 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ojo s THR 620 N -2.27 4.46 -0.24 2.61 -4.23 -0.89 -4.72 115.64 110.36 1ojo s THR 620 Ca 0.00 1.39 -0.04 0.00 -1.18 0.00 0.00 61.69 61.86 1ojo s THR 620 Cb 0.00 -3.75 0.00 0.00 1.34 0.00 0.00 72.50 70.09 1ojo s THR 620 CO 0.00 -0.07 -0.01 -0.89 -0.54 0.00 0.00 174.62 173.11 1ojo s THR 621 N -1.86 3.45 0.16 3.99 2.01 -1.26 -0.77 115.64 121.35 1ojo s THR 621 Ca 0.53 -0.63 -0.08 0.00 0.31 0.00 0.00 61.69 61.83 1ojo s THR 621 Cb -0.13 -2.65 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 1ojo s THR 621 CO 0.18 0.30 0.25 -1.61 -0.69 0.00 0.00 174.62 173.05 1ojo s GLU 622 N 1.46 1.12 0.48 4.92 0.41 -0.58 -4.96 118.70 121.55 1ojo s GLU 622 Ca 0.04 -1.21 0.01 0.00 -0.41 0.00 0.00 54.97 53.41 1ojo s GLU 622 Cb -0.15 0.36 0.01 0.00 -1.78 0.00 0.00 34.13 32.57 1ojo s GLU 622 CO -0.02 -0.40 0.69 0.95 -0.49 0.00 0.00 175.26 175.99 1ojo s THR 623 N -3.98 3.46 -0.37 3.63 -4.23 -1.26 -1.69 115.64 111.21 1ojo s THR 623 Ca 0.18 -0.62 0.05 0.00 -1.18 0.00 0.00 61.69 60.12 1ojo s THR 623 Cb 0.04 -3.27 0.48 0.00 1.34 0.00 0.00 72.50 71.09 1ojo s THR 623 CO 0.00 -0.18 1.52 -0.90 -0.54 0.00 0.00 174.62 174.52 1ojo n ASP 624 N -2.14 3.74 -4.77 3.99 5.75 0.09 -4.96 116.55 118.26 1ojo n ASP 624 Ca 0.04 -2.92 -0.38 0.00 -0.01 0.00 0.00 54.79 51.52 1ojo n ASP 624 Cb 0.58 -0.69 0.00 0.00 -1.03 0.00 0.00 41.12 39.98 1ojo n ASP 624 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ojo s ALA 625 N -2.20 2.99 0.45 2.12 0.00 -1.26 -4.94 121.76 118.92 1ojo s ALA 625 Ca 0.38 1.07 -0.23 0.00 0.00 0.00 0.00 51.96 53.17 1ojo s ALA 625 Cb 0.31 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.91 1ojo s ALA 625 CO 0.08 -0.84 1.17 -1.59 0.00 0.00 0.00 175.76 174.59 1ojo s LYS 626 N -2.66 3.79 0.10 0.00 0.00 -1.26 -5.04 119.74 114.68 1ojo s LYS 626 Ca 0.64 1.80 0.10 0.00 0.00 0.00 0.00 55.97 58.51 1ojo s LYS 626 Cb -0.33 -2.45 -0.04 0.00 0.00 0.00 0.00 37.83 35.02 1ojo s LYS 626 CO 0.40 -0.53 -0.24 1.03 0.00 0.00 0.00 175.35 176.00 1ojo s ARG 627 N -2.64 1.61 -0.03 1.78 1.81 -1.26 -5.13 118.95 115.10 1ojo s ARG 627 Ca 0.63 -1.24 -0.16 0.00 -1.72 0.00 0.00 55.73 53.24 1ojo s ARG 627 Cb -0.29 -1.98 -0.05 0.00 -0.45 0.00 0.00 34.95 32.17 1ojo s ARG 627 CO 0.36 0.48 0.44 0.00 -0.68 0.00 0.00 175.30 175.89 1ojo s ALA 628 N -1.02 3.62 0.47 2.13 0.00 -1.26 -4.96 121.76 120.75 1ojo s ALA 628 Ca 0.14 -0.19 0.22 0.00 0.00 0.00 0.00 51.96 52.13 1ojo s ALA 628 Cb -0.10 -2.49 1.34 0.00 0.00 0.00 0.00 23.12 21.87 1ojo s ALA 628 CO 0.06 0.33 2.09 -0.44 0.00 0.00 0.00 175.76 177.79 1ojo h ASP 629 N 5.30 0.00 0.63 0.00 3.32 -2.00 -2.21 116.42 121.46 1ojo h ASP 629 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1ojo h ASP 629 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1ojo h ASP 629 CO 0.66 0.11 0.00 -1.54 -1.72 0.00 0.00 179.24 176.75 1ojo n SER 630 N -4.02 0.00 -4.73 6.45 3.41 -1.26 -4.78 113.62 108.70 1ojo n SER 630 Ca -0.02 0.40 -0.31 0.00 -0.26 0.00 0.00 58.87 58.67 1ojo n SER 630 Cb 0.20 -0.46 0.12 0.00 -0.26 0.00 0.00 64.21 63.81 1ojo n SER 630 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1ojo s ASP 631 N -2.92 3.84 0.29 4.04 1.11 -0.83 -5.06 116.67 117.14 1ojo s ASP 631 Ca 0.12 2.01 0.04 0.00 0.18 0.00 0.00 52.55 54.89 1ojo s ASP 631 Cb 0.13 -2.54 -0.06 0.00 1.07 0.00 0.00 42.92 41.52 1ojo s ASP 631 CO 0.35 -2.48 0.02 0.42 1.18 0.00 0.00 175.17 174.66 1ojo s THR 632 N -2.74 1.21 1.02 -1.27 -4.23 -1.26 -4.86 115.64 103.51 1ojo s THR 632 Ca 0.64 -2.03 -0.11 0.00 -1.18 0.00 0.00 61.69 59.01 1ojo s THR 632 Cb -0.20 -2.60 0.20 0.00 1.34 0.00 0.00 72.50 71.24 1ojo s THR 632 CO 0.56 -0.15 1.10 -0.83 -0.54 0.00 0.00 174.62 174.76 1ojo s GLY 633 N -3.42 1.63 0.07 3.99 0.00 -1.23 -5.03 107.32 103.33 1ojo s GLY 633 Ca 0.33 0.33 -0.05 0.00 0.00 0.00 0.00 44.72 45.34 1ojo s GLY 633 CO 0.13 0.87 0.07 0.54 0.00 0.00 0.00 173.10 174.71 1ojo s LYS 634 N -4.56 0.72 0.44 2.90 -0.14 -1.26 -4.93 119.74 112.90 1ojo s LYS 634 Ca 0.68 -1.10 0.02 0.00 -1.36 0.00 0.00 55.97 54.21 1ojo s LYS 634 Cb -0.24 0.27 -0.00 0.00 -1.68 0.00 0.00 37.83 36.18 1ojo s LYS 634 CO 0.61 -0.18 0.64 0.14 -0.76 0.00 0.00 175.35 175.80 1ojo s VAL 635 N -3.89 3.88 0.20 3.17 -7.23 -1.26 -1.24 120.40 114.03 1ojo s VAL 635 Ca 0.06 -0.61 -0.17 0.00 -1.81 0.00 0.00 61.98 59.45 1ojo s VAL 635 Cb 0.06 -3.42 -0.08 0.00 0.56 0.00 0.00 36.38 33.51 1ojo s VAL 635 CO -0.10 -0.27 0.65 -0.22 -0.31 0.00 0.00 175.10 174.85 1ojo s LEU 636 N -4.50 4.32 0.36 1.32 2.96 -0.58 -4.91 118.68 117.64 1ojo s LEU 636 Ca 0.49 1.26 0.05 0.00 -0.22 0.00 0.00 54.13 55.71 1ojo s LEU 636 Cb -0.10 -3.48 0.68 0.00 0.50 0.00 0.00 46.19 43.79 1ojo s LEU 636 CO 0.37 0.05 1.92 -0.65 -1.32 0.00 0.00 176.35 176.71 1ojo h PRO 637 N 3.39 0.51 -6.26 0.98 0.11 -1.92 -2.86 132.00 125.95 1ojo h PRO 637 Ca -0.48 -0.09 -0.56 0.00 0.11 0.00 0.00 66.00 64.99 1ojo h PRO 637 Cb 1.19 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.19 1ojo h PRO 637 CO 0.65 0.49 -0.27 0.45 -0.21 0.00 0.00 178.00 179.12 1ojo s SER 638 N -6.73 6.47 0.00 -2.05 0.15 -1.26 -4.76 113.70 105.51 1ojo s SER 638 Ca -0.08 0.60 0.21 0.00 0.70 0.00 0.00 55.95 57.38 1ojo s SER 638 Cb 0.16 -2.09 0.09 0.00 -1.71 0.00 0.00 66.02 62.46 1ojo s SER 638 CO 0.75 -0.02 1.10 0.00 1.20 0.00 0.00 173.24 176.27 1ojo n ALA 639 N -0.28 2.90 -1.93 5.45 0.00 -1.26 -1.29 120.51 124.10 1ojo n ALA 639 Ca -0.02 -0.64 -0.42 0.00 0.00 0.00 0.00 53.44 52.35 1ojo n ALA 639 Cb 0.53 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.26 1ojo n ALA 639 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ojo n PHE 640 N 0.64 3.53 -3.71 0.00 7.35 -1.26 -3.53 117.46 120.49 1ojo n PHE 640 Ca 0.11 -2.94 -0.16 0.00 -0.76 0.00 0.00 57.45 53.70 1ojo n PHE 640 Cb 0.49 -2.44 -0.15 0.00 0.35 0.00 0.00 39.48 37.72 1ojo n PHE 640 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1ojo s VAL 641 N 2.71 -0.15 0.00 -2.13 1.01 -1.26 -1.70 120.40 118.89 1ojo s VAL 641 Ca 0.46 0.28 0.00 0.00 0.00 0.00 0.00 61.98 62.72 1ojo s VAL 641 Cb 0.12 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.26 1ojo s VAL 641 CO -0.06 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1ojo n GLY 642 N 4.77 1.01 3.19 4.51 0.00 -0.77 -4.78 105.19 113.13 1ojo n GLY 642 Ca -0.15 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.66 1ojo n GLY 642 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ojo s THR 643 N -2.00 1.73 -0.29 2.61 2.01 -1.26 -1.86 115.64 116.58 1ojo s THR 643 Ca 0.00 -0.87 -0.07 0.00 0.31 0.00 0.00 61.69 61.06 1ojo s THR 643 Cb 0.00 -1.48 0.00 0.00 0.01 0.00 0.00 72.50 71.04 1ojo s THR 643 CO 0.00 0.49 0.08 -0.55 -0.69 0.00 0.00 174.62 173.95 1ojo s SER 644 N 0.04 5.12 -0.20 3.53 0.15 0.84 -4.94 113.70 118.24 1ojo s SER 644 Ca -0.06 -0.65 -0.10 0.00 0.70 0.00 0.00 55.95 55.84 1ojo s SER 644 Cb -0.13 -1.88 -0.05 0.00 -1.71 0.00 0.00 66.02 62.24 1ojo s SER 644 CO 0.04 -0.17 0.12 -0.75 1.20 0.00 0.00 173.24 173.68 1ojo s LYS 645 N 1.51 4.17 -0.20 5.44 2.20 -1.26 -1.07 119.74 130.53 1ojo s LYS 645 Ca 0.03 -0.23 -0.18 0.00 -0.36 0.00 0.00 55.97 55.23 1ojo s LYS 645 Cb -0.17 -3.40 -0.14 0.00 -1.51 0.00 0.00 37.83 32.61 1ojo s LYS 645 CO 0.02 0.30 0.06 -0.11 -0.36 0.00 0.00 175.35 175.26 1ojo n LEU 646 N 3.51 1.86 0.00 5.43 7.94 -0.24 -4.84 117.00 130.66 1ojo n LEU 646 Ca -0.16 0.46 0.00 0.00 -1.11 0.00 0.00 56.01 55.20 1ojo n LEU 646 Cb 0.52 -0.93 0.00 0.00 0.53 0.00 0.00 43.42 43.54 1ojo n LEU 646 CO 0.37 0.12 0.00 -0.90 -1.11 0.00 0.00 177.39 175.87 1ojo n ASP 647 N -4.46 0.00 0.00 1.96 5.68 -1.12 -5.00 116.55 113.61 1ojo n ASP 647 Ca -0.28 -0.50 0.06 0.00 -0.50 0.00 0.00 54.79 53.57 1ojo n ASP 647 Cb 0.60 0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.89 1ojo n ASP 647 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1ojo n ASP 648 N -1.04 0.00 0.00 -1.12 8.00 -1.26 -3.48 116.55 117.65 1ojo n ASP 648 Ca 0.00 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.75 1ojo n ASP 648 Cb 0.00 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 1ojo n ASP 648 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ojo n ALA 649 N -1.37 1.35 -3.40 2.24 0.00 -1.26 -3.18 120.51 114.89 1ojo n ALA 649 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.26 1ojo n ALA 649 Cb 0.12 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.41 1ojo n ALA 649 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1ojo s ASN 650 N -0.79 1.54 0.18 0.00 0.01 -1.23 -0.20 114.94 114.45 1ojo s ASN 650 Ca 0.00 -0.25 -0.21 0.00 -0.71 0.00 0.00 52.86 51.69 1ojo s ASN 650 Cb 0.00 -0.66 0.05 0.00 0.41 0.00 0.00 41.25 41.05 1ojo s ASN 650 CO 0.00 0.03 0.59 0.00 -1.51 0.00 0.00 177.10 176.20 1ojo s ALA 651 N 0.60 -1.38 0.01 0.60 0.00 -0.69 -1.08 121.76 119.82 1ojo s ALA 651 Ca -0.12 0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.08 1ojo s ALA 651 Cb -0.14 0.86 -0.01 0.00 0.00 0.00 0.00 23.12 23.82 1ojo s ALA 651 CO 0.02 -0.80 -0.08 0.99 0.00 0.00 0.00 175.76 175.89 1ojo s THR 652 N -3.80 0.66 0.07 0.00 2.01 -0.23 -0.77 115.64 113.58 1ojo s THR 652 Ca 0.04 -0.52 0.00 0.00 0.31 0.00 0.00 61.69 61.52 1ojo s THR 652 Cb -0.01 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.87 1ojo s THR 652 CO -0.09 0.07 -0.05 0.00 -0.69 0.00 0.00 174.62 173.87 1ojo s ALA 653 N -0.44 0.69 0.08 7.40 0.00 -0.29 -0.11 121.76 129.09 1ojo s ALA 653 Ca 0.01 -1.22 -0.12 0.00 0.00 0.00 0.00 51.96 50.63 1ojo s ALA 653 Cb -0.05 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.30 1ojo s ALA 653 CO 0.00 -0.29 0.28 -0.08 0.00 0.00 0.00 175.76 175.67 1ojo s THR 654 N -3.56 0.10 -0.12 0.00 -1.32 -0.77 -0.68 115.64 109.29 1ojo s THR 654 Ca 0.07 -0.86 -0.04 0.00 -1.21 0.00 0.00 61.69 59.65 1ojo s THR 654 Cb 0.05 -1.14 0.06 0.00 -1.51 0.00 0.00 72.50 69.96 1ojo s THR 654 CO -0.07 -0.47 0.18 -0.32 -2.21 0.00 0.00 174.62 171.73 1ojo s MET 655 N -3.35 0.09 -1.30 7.08 0.00 0.65 -1.84 119.30 120.62 1ojo s MET 655 Ca 0.01 0.46 -0.17 0.00 0.00 0.00 0.00 55.69 55.98 1ojo s MET 655 Cb 0.02 -0.57 0.08 0.00 0.00 0.00 0.00 34.83 34.36 1ojo s MET 655 CO -0.08 -0.41 1.74 -3.47 0.00 0.00 0.00 175.02 172.79 1ojo n ASP 656 N 5.32 4.91 -4.74 1.11 2.03 -0.69 -2.11 116.55 122.39 1ojo n ASP 656 Ca -0.05 -2.92 -0.41 0.00 0.52 0.00 0.00 54.79 51.93 1ojo n ASP 656 Cb 0.50 -1.72 -0.04 0.00 -0.72 0.00 0.00 41.12 39.14 1ojo n ASP 656 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1ojo s PHE 657 N 3.83 3.60 -0.02 -0.67 5.36 -0.84 -4.64 117.98 124.60 1ojo s PHE 657 Ca 0.52 1.60 0.01 0.00 -0.96 0.00 0.00 56.93 58.10 1ojo s PHE 657 Cb 0.04 -3.27 0.02 0.00 -0.34 0.00 0.00 43.02 39.47 1ojo s PHE 657 CO 0.06 -0.59 -0.02 0.99 -1.46 0.00 0.00 175.22 174.20 1ojo s THR 658 N -0.20 0.24 1.00 0.12 2.01 -1.26 -1.76 115.64 115.79 1ojo s THR 658 Ca 0.49 -0.01 -0.15 0.00 0.31 0.00 0.00 61.69 62.33 1ojo s THR 658 Cb -0.29 -0.28 0.20 0.00 0.01 0.00 0.00 72.50 72.13 1ojo s THR 658 CO 0.35 0.13 1.19 0.54 -0.69 0.00 0.00 174.62 176.13 1ojo s ASN 659 N 0.63 2.70 0.48 3.53 4.22 -0.13 -4.91 114.94 121.47 1ojo s ASN 659 Ca -0.07 0.66 0.26 0.00 -2.14 0.00 0.00 52.86 51.57 1ojo s ASN 659 Cb -0.10 -0.98 1.32 0.00 1.28 0.00 0.00 41.25 42.78 1ojo s ASN 659 CO -0.01 -3.02 1.86 4.11 -2.04 0.00 0.00 177.10 177.99 1ojo h TRP 660 N -1.83 0.25 -0.14 1.54 5.08 -1.98 -2.23 115.95 116.64 1ojo h TRP 660 Ca -0.47 0.01 -0.02 0.00 1.08 0.00 0.00 58.89 59.49 1ojo h TRP 660 Cb 1.29 -0.07 -0.01 0.00 -3.00 0.00 0.00 29.16 27.37 1ojo h TRP 660 CO -0.81 0.05 -0.04 0.27 -1.28 0.00 0.00 178.44 176.63 1ojo n ASN 661 N -4.38 2.95 -3.76 0.11 2.04 -1.26 -5.00 115.26 105.96 1ojo n ASN 661 Ca 0.20 -3.17 -0.24 0.00 -0.44 0.00 0.00 54.58 50.93 1ojo n ASN 661 Cb 0.90 -0.50 0.02 0.00 -2.53 0.00 0.00 39.78 37.67 1ojo n ASN 661 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ojo n GLN 662 N -1.02 -3.63 0.00 -3.83 3.00 -0.84 -4.89 117.38 106.18 1ojo n GLN 662 Ca 0.20 0.53 0.00 0.00 -0.01 0.00 0.00 57.00 57.72 1ojo n GLN 662 Cb 0.78 -4.81 0.00 0.00 0.00 0.00 0.00 30.24 26.21 1ojo n GLN 662 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1ojo n THR 663 N -4.25 0.00 -3.85 5.09 -2.24 -1.26 -4.95 114.28 102.82 1ojo n THR 663 Ca -0.26 -0.44 -0.12 0.00 -2.27 0.00 0.00 64.05 60.96 1ojo n THR 663 Cb 0.66 1.01 -0.12 0.00 -2.10 0.00 0.00 70.33 69.78 1ojo n THR 663 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1ojo s LEU 664 N -1.65 1.63 0.22 3.22 0.20 -1.26 -0.42 118.68 120.62 1ojo s LEU 664 Ca 0.00 0.11 0.04 0.00 0.69 0.00 0.00 54.13 54.97 1ojo s LEU 664 Cb 0.00 0.39 -0.05 0.00 -0.43 0.00 0.00 46.19 46.10 1ojo s LEU 664 CO 0.00 -0.10 -0.03 0.42 -0.29 0.00 0.00 176.35 176.36 1ojo s THR 665 N -0.23 1.11 -0.30 3.68 -4.23 -0.79 -0.95 115.64 113.92 1ojo s THR 665 Ca -0.03 -2.05 -0.20 0.00 -1.18 0.00 0.00 61.69 58.23 1ojo s THR 665 Cb -0.02 -2.27 0.18 0.00 1.34 0.00 0.00 72.50 71.74 1ojo s THR 665 CO 0.00 -0.39 1.27 0.00 -0.54 0.00 0.00 174.62 174.96 1ojo s ALA 666 N -3.37 -2.37 -0.64 3.99 0.00 -0.72 -2.37 121.76 116.28 1ojo s ALA 666 Ca 0.26 1.88 -0.21 0.00 0.00 0.00 0.00 51.96 53.89 1ojo s ALA 666 Cb 0.05 -1.81 0.08 0.00 0.00 0.00 0.00 23.12 21.44 1ojo s ALA 666 CO 0.08 -0.23 0.88 -1.01 0.00 0.00 0.00 175.76 175.48 1ojo s HIS 667 N 0.60 2.78 -0.20 0.00 3.76 0.64 -1.99 115.29 120.88 1ojo s HIS 667 Ca -0.01 -0.69 -0.12 0.00 -0.15 0.00 0.00 55.06 54.09 1ojo s HIS 667 Cb -0.04 -4.20 -0.05 0.00 1.11 0.00 0.00 32.58 29.40 1ojo s HIS 667 CO -0.12 -1.54 0.20 0.15 -0.85 0.00 0.00 174.74 172.58 1ojo s LYS 668 N 3.61 4.19 0.08 1.40 1.02 -0.90 -1.59 119.74 127.55 1ojo s LYS 668 Ca 0.19 -0.11 0.03 0.00 0.02 0.00 0.00 55.97 56.09 1ojo s LYS 668 Cb -0.19 -3.45 -0.03 0.00 -0.52 0.00 0.00 37.83 33.64 1ojo s LYS 668 CO 0.09 0.22 -0.08 -1.12 -0.92 0.00 0.00 175.35 173.54 1ojo s SER 669 N 0.55 1.16 -0.00 2.83 0.01 0.58 -0.26 113.70 118.57 1ojo s SER 669 Ca 0.11 -0.81 0.03 0.00 1.31 0.00 0.00 55.95 56.59 1ojo s SER 669 Cb -0.12 0.05 -0.01 0.00 0.21 0.00 0.00 66.02 66.15 1ojo s SER 669 CO 0.01 -0.32 -0.09 0.26 0.41 0.00 0.00 173.24 173.51 1ojo s TRP 670 N -2.56 0.84 -0.35 2.43 0.51 0.14 -1.44 118.94 118.51 1ojo s TRP 670 Ca 0.03 -0.18 0.02 0.00 -2.12 0.00 0.00 56.10 53.85 1ojo s TRP 670 Cb -0.02 -0.53 0.11 0.00 -0.81 0.00 0.00 33.47 32.21 1ojo s TRP 670 CO -0.02 -0.01 0.10 -0.06 -0.51 0.00 0.00 176.95 176.45 1ojo s PHE 671 N -0.29 2.76 -0.44 -1.98 0.40 0.09 -1.14 117.98 117.37 1ojo s PHE 671 Ca 0.03 -2.48 -0.28 0.00 -0.60 0.00 0.00 56.93 53.60 1ojo s PHE 671 Cb -0.04 -2.35 0.03 0.00 0.51 0.00 0.00 43.02 41.16 1ojo s PHE 671 CO -0.00 -0.89 1.05 -1.64 0.70 0.00 0.00 175.22 174.44 1ojo s MET 672 N 1.02 3.73 -0.57 0.44 -1.94 0.05 -0.87 119.30 121.16 1ojo s MET 672 Ca 0.12 0.52 0.06 0.00 -1.71 0.00 0.00 55.69 54.68 1ojo s MET 672 Cb -0.19 -3.88 0.30 0.00 2.01 0.00 0.00 34.83 33.06 1ojo s MET 672 CO -0.13 -1.24 0.82 1.28 -0.01 0.00 0.00 175.02 175.74 1ojo n LEU 673 N 7.44 3.59 0.00 -0.03 4.77 -0.32 -1.71 117.00 130.74 1ojo n LEU 673 Ca 0.10 -5.46 0.00 0.00 -0.03 0.00 0.00 56.01 50.62 1ojo n LEU 673 Cb 0.49 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 1ojo n LEU 673 CO 0.67 2.21 0.00 1.17 -1.33 0.00 0.00 177.39 180.11 1ojo n LYS 674 N 0.37 0.00 -0.25 3.23 4.81 0.72 -3.61 118.16 123.43 1ojo n LYS 674 Ca 0.29 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.82 1ojo n LYS 674 Cb 0.43 0.00 0.16 0.00 0.02 0.00 0.00 35.03 35.64 1ojo n LYS 674 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1ojo n ASP 675 N 0.99 2.18 -3.58 3.14 5.75 -1.26 -4.79 116.55 118.99 1ojo n ASP 675 Ca 0.00 -3.35 -0.05 0.00 -0.01 0.00 0.00 54.79 51.37 1ojo n ASP 675 Cb 0.00 -0.47 -0.02 0.00 -1.03 0.00 0.00 41.12 39.61 1ojo n ASP 675 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1ojo s LYS 676 N -3.00 0.64 -0.05 0.11 -2.85 -1.24 -4.37 119.74 108.98 1ojo s LYS 676 Ca 0.34 -0.27 0.00 0.00 -1.00 0.00 0.00 55.97 55.05 1ojo s LYS 676 Cb 0.31 0.27 0.02 0.00 -2.06 0.00 0.00 37.83 36.38 1ojo s LYS 676 CO -0.00 -0.28 -0.03 0.42 0.10 0.00 0.00 175.35 175.56 1ojo s ILE 677 N -2.82 0.47 -0.06 3.79 1.09 -0.70 -1.18 121.20 121.79 1ojo s ILE 677 Ca 0.08 -0.05 -0.15 0.00 -1.10 0.00 0.00 60.65 59.44 1ojo s ILE 677 Cb -0.00 -0.53 -0.05 0.00 -1.06 0.00 0.00 42.46 40.81 1ojo s ILE 677 CO -0.06 0.23 0.38 0.00 -0.10 0.00 0.00 174.94 175.39 1ojo s ALA 678 N 1.17 3.65 -0.25 9.38 0.00 -0.05 -0.12 121.76 135.55 1ojo s ALA 678 Ca -0.07 -0.28 -0.04 0.00 0.00 0.00 0.00 51.96 51.57 1ojo s ALA 678 Cb -0.14 -2.40 0.01 0.00 0.00 0.00 0.00 23.12 20.59 1ojo s ALA 678 CO -0.01 0.34 -0.02 -0.06 0.00 0.00 0.00 175.76 176.00 1ojo s PHE 679 N -0.50 3.05 -0.04 0.00 0.40 0.10 -0.73 117.98 120.25 1ojo s PHE 679 Ca 0.22 -1.19 0.06 0.00 -0.60 0.00 0.00 56.93 55.42 1ojo s PHE 679 Cb -0.15 -2.12 -0.01 0.00 0.51 0.00 0.00 43.02 41.24 1ojo s PHE 679 CO 0.10 -0.63 -0.21 -0.51 0.70 0.00 0.00 175.22 174.67 1ojo s LEU 680 N 1.42 2.01 -0.02 -0.37 1.43 -0.52 -1.57 118.68 121.06 1ojo s LEU 680 Ca 0.03 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.71 1ojo s LEU 680 Cb -0.16 -1.17 0.01 0.00 0.03 0.00 0.00 46.19 44.90 1ojo s LEU 680 CO -0.02 0.22 -0.05 -0.83 0.23 0.00 0.00 176.35 175.90 1ojo s GLY 681 N -0.16 0.35 0.23 -3.19 0.00 -0.13 -0.30 107.32 104.11 1ojo s GLY 681 Ca -0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 44.72 44.57 1ojo s GLY 681 CO 0.02 0.14 0.23 -1.35 0.00 0.00 0.00 173.10 172.14 1ojo s SER 682 N 0.41 0.36 -1.46 1.64 1.04 -0.62 -1.12 113.70 113.95 1ojo s SER 682 Ca -0.05 -1.36 -0.09 0.00 0.48 0.00 0.00 55.95 54.93 1ojo s SER 682 Cb -0.09 0.46 0.04 0.00 0.10 0.00 0.00 66.02 66.53 1ojo s SER 682 CO -0.00 -0.95 0.84 -3.20 0.98 0.00 0.00 173.24 170.91 1ojo n ASN 683 N -0.53 -5.58 -4.66 7.02 4.05 -1.20 -0.26 115.26 114.10 1ojo n ASN 683 Ca 0.02 -0.48 -0.43 0.00 0.45 0.00 0.00 54.58 54.14 1ojo n ASN 683 Cb 0.65 -4.47 -0.02 0.00 1.23 0.00 0.00 39.78 37.17 1ojo n ASN 683 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1ojo s ILE 684 N -3.21 4.41 0.06 -1.44 1.01 -0.80 -3.96 121.20 117.27 1ojo s ILE 684 Ca 0.48 1.68 0.05 0.00 0.00 0.00 0.00 60.65 62.86 1ojo s ILE 684 Cb -0.23 -4.14 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 1ojo s ILE 684 CO 0.60 -0.21 -0.13 -1.10 0.00 0.00 0.00 174.94 174.09 1ojo s GLN 685 N 3.49 0.81 -0.06 2.79 -0.21 -1.00 -0.20 119.66 125.30 1ojo s GLN 685 Ca 0.51 -0.85 -0.02 0.00 0.02 0.00 0.00 55.36 55.01 1ojo s GLN 685 Cb -0.18 -0.80 0.03 0.00 1.00 0.00 0.00 33.01 33.07 1ojo s GLN 685 CO 0.13 0.18 0.08 1.21 -2.12 0.00 0.00 175.29 174.77 1ojo s ASN 686 N -1.49 1.17 0.00 5.90 2.47 -1.26 -1.89 114.94 119.84 1ojo s ASN 686 Ca -0.02 0.06 0.21 0.00 0.42 0.00 0.00 52.86 53.54 1ojo s ASN 686 Cb -0.09 -0.09 0.43 0.00 -1.45 0.00 0.00 41.25 40.05 1ojo s ASN 686 CO 0.02 -0.26 1.38 0.35 -3.72 0.00 0.00 177.10 174.87 1ojo n THR 687 N 5.30 0.61 -3.22 -5.21 -2.24 0.44 -4.96 114.28 105.00 1ojo n THR 687 Ca -0.03 -0.81 -0.21 0.00 -2.27 0.00 0.00 64.05 60.73 1ojo n THR 687 Cb 0.50 0.87 0.05 0.00 -2.10 0.00 0.00 70.33 69.65 1ojo n THR 687 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ojo s SER 688 N -1.31 4.97 0.00 3.42 1.04 -1.26 -5.02 113.70 115.54 1ojo s SER 688 Ca 0.37 -0.96 0.23 0.00 0.48 0.00 0.00 55.95 56.07 1ojo s SER 688 Cb 0.21 0.40 0.56 0.00 0.10 0.00 0.00 66.02 67.29 1ojo s SER 688 CO 0.29 -1.34 1.49 0.35 0.98 0.00 0.00 173.24 175.01 1ojo n THR 689 N -2.17 0.79 -3.23 2.02 -2.24 -1.26 -4.93 114.28 103.26 1ojo n THR 689 Ca 0.12 -0.89 -0.30 0.00 -2.27 0.00 0.00 64.05 60.72 1ojo n THR 689 Cb 0.62 0.70 -0.04 0.00 -2.10 0.00 0.00 70.33 69.52 1ojo n THR 689 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ojo s ASP 690 N -1.21 6.51 0.28 3.42 1.01 -1.26 -5.06 116.67 120.36 1ojo s ASP 690 Ca 0.45 0.88 -0.27 0.00 0.71 0.00 0.00 52.55 54.32 1ojo s ASP 690 Cb 0.25 -2.21 -0.09 0.00 1.01 0.00 0.00 42.92 41.87 1ojo s ASP 690 CO 0.33 -0.22 0.92 0.42 0.21 0.00 0.00 175.17 176.83 1ojo s THR 691 N -2.09 4.20 0.00 -1.27 -4.23 -1.26 -4.78 115.64 106.20 1ojo s THR 691 Ca 0.47 1.87 0.04 0.00 -1.18 0.00 0.00 61.69 62.89 1ojo s THR 691 Cb -0.11 -4.12 -0.03 0.00 1.34 0.00 0.00 72.50 69.58 1ojo s THR 691 CO 0.28 0.30 -0.08 0.00 -0.54 0.00 0.00 174.62 174.58 1ojo s ALA 692 N -1.42 2.95 0.15 3.99 0.00 -1.26 -0.73 121.76 125.43 1ojo s ALA 692 Ca 0.45 -1.03 -0.23 0.00 0.00 0.00 0.00 51.96 51.15 1ojo s ALA 692 Cb -0.21 -1.08 0.07 0.00 0.00 0.00 0.00 23.12 21.89 1ojo s ALA 692 CO 0.27 0.60 0.63 0.00 0.00 0.00 0.00 175.76 177.26 1ojo s ALA 693 N -0.97 -1.61 -0.12 0.00 0.00 -0.68 -0.99 121.76 117.39 1ojo s ALA 693 Ca 0.16 0.51 -0.00 0.00 0.00 0.00 0.00 51.96 52.63 1ojo s ALA 693 Cb -0.11 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.84 1ojo s ALA 693 CO 0.07 -0.77 -0.12 0.99 0.00 0.00 0.00 175.76 175.92 1ojo s THR 694 N -3.70 3.12 -0.42 0.00 2.01 -0.31 -1.53 115.64 114.82 1ojo s THR 694 Ca 0.02 -0.64 -0.24 0.00 0.31 0.00 0.00 61.69 61.14 1ojo s THR 694 Cb -0.01 -2.31 0.02 0.00 0.01 0.00 0.00 72.50 70.21 1ojo s THR 694 CO -0.12 0.53 0.84 -0.89 -0.69 0.00 0.00 174.62 174.28 1ojo s THR 695 N 0.25 4.62 0.18 -0.82 2.01 0.05 -1.11 115.64 120.82 1ojo s THR 695 Ca -0.08 0.74 -0.05 0.00 0.31 0.00 0.00 61.69 62.60 1ojo s THR 695 Cb -0.15 -4.32 -0.04 0.00 0.01 0.00 0.00 72.50 68.00 1ojo s THR 695 CO 0.05 -0.64 1.51 0.40 -0.69 0.00 0.00 174.62 175.25 1ojo h ILE 696 N 5.92 1.30 -1.87 1.82 2.04 -0.71 0.68 117.51 126.68 1ojo h ILE 696 Ca -0.24 -1.67 0.15 0.00 1.00 0.00 0.00 64.86 64.10 1ojo h ILE 696 Cb 1.08 1.60 -0.18 0.00 -0.74 0.00 0.00 36.82 38.58 1ojo h ILE 696 CO 0.96 0.53 0.61 -0.62 0.00 0.00 0.00 178.15 179.64 1ojo s ASP 697 N -6.89 -0.29 -0.38 1.72 -1.08 -1.02 -4.20 116.67 104.55 1ojo s ASP 697 Ca -0.09 0.07 0.04 0.00 -0.52 0.00 0.00 52.55 52.05 1ojo s ASP 697 Cb 0.11 0.29 0.16 0.00 -1.46 0.00 0.00 42.92 42.02 1ojo s ASP 697 CO 0.85 -0.44 0.40 -1.58 0.52 0.00 0.00 175.17 174.93 1ojo s GLN 698 N -2.49 0.68 -0.21 4.34 0.74 -1.25 -0.90 119.66 120.57 1ojo s GLN 698 Ca 0.05 -0.86 -0.10 0.00 0.05 0.00 0.00 55.36 54.50 1ojo s GLN 698 Cb -0.01 -0.66 -0.05 0.00 1.10 0.00 0.00 33.01 33.39 1ojo s GLN 698 CO -0.06 -1.20 0.14 0.50 -0.55 0.00 0.00 175.29 174.12 1ojo s ARG 699 N 1.41 4.17 -0.02 1.67 6.06 -0.47 -4.83 118.95 126.93 1ojo s ARG 699 Ca 0.17 -0.22 -0.30 0.00 -2.50 0.00 0.00 55.73 52.88 1ojo s ARG 699 Cb -0.14 -3.44 -0.03 0.00 0.06 0.00 0.00 34.95 31.40 1ojo s ARG 699 CO -0.03 0.25 1.05 0.21 -2.50 0.00 0.00 175.30 174.28 1ojo s LYS 700 N 0.51 4.48 0.41 5.12 2.20 -1.26 -1.01 119.74 130.18 1ojo s LYS 700 Ca 0.08 1.50 0.01 0.00 -0.36 0.00 0.00 55.97 57.20 1ojo s LYS 700 Cb -0.12 -3.47 -0.01 0.00 -1.51 0.00 0.00 37.83 32.72 1ojo s LYS 700 CO -0.01 -0.20 0.61 -0.51 -0.36 0.00 0.00 175.35 174.89 1ojo s LEU 701 N 1.41 3.78 -0.17 5.43 1.43 0.37 -4.92 118.68 126.00 1ojo s LEU 701 Ca 0.53 0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 53.86 1ojo s LEU 701 Cb -0.22 -3.14 -0.01 0.00 0.03 0.00 0.00 46.19 42.85 1ojo s LEU 701 CO 0.25 -0.57 -0.09 -1.61 0.23 0.00 0.00 176.35 174.56 1ojo s GLU 702 N -4.44 3.39 0.47 1.70 2.02 -1.26 -4.64 118.70 115.93 1ojo s GLU 702 Ca 0.46 -0.65 0.15 0.00 0.02 0.00 0.00 54.97 54.94 1ojo s GLU 702 Cb -0.10 -2.80 1.09 0.00 0.10 0.00 0.00 34.13 32.42 1ojo s GLU 702 CO 0.36 0.04 2.04 0.66 0.02 0.00 0.00 175.26 178.39 1ojo h SER 703 N 7.29 0.00 0.36 -0.19 4.64 -1.99 -2.44 113.55 121.24 1ojo h SER 703 Ca -0.33 -0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.80 1ojo h SER 703 Cb 1.19 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1ojo h SER 703 CO 0.59 0.12 -0.76 0.77 -0.87 0.00 0.00 176.83 176.69 1ojo h SER 704 N 0.01 0.39 -3.05 4.97 4.64 -2.06 -3.38 113.55 115.07 1ojo h SER 704 Ca 0.00 -0.27 -0.63 0.00 -0.47 0.00 0.00 61.79 60.42 1ojo h SER 704 Cb 0.21 -0.12 -0.41 0.00 -0.31 0.00 0.00 62.40 61.78 1ojo h SER 704 CO 0.02 1.01 -0.49 0.59 -0.87 0.00 0.00 176.83 177.09 1ojo n ASN 705 N -3.80 3.31 -4.77 4.97 5.03 -0.92 -5.09 115.26 114.00 1ojo n ASN 705 Ca -0.04 -3.23 -0.37 0.00 0.87 0.00 0.00 54.58 51.82 1ojo n ASN 705 Cb 0.72 -0.80 0.00 0.00 -1.02 0.00 0.00 39.78 38.68 1ojo n ASN 705 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1ojo s PRO 706 N -1.56 3.51 0.02 3.52 0.04 -1.24 -4.45 135.00 134.84 1ojo s PRO 706 Ca 0.27 1.80 -0.09 0.00 0.04 0.00 0.00 61.00 63.02 1ojo s PRO 706 Cb -0.03 -2.25 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 1ojo s PRO 706 CO -0.15 -0.77 0.32 0.71 0.04 0.00 0.00 177.00 177.16 1ojo s TYR 707 N -1.57 3.61 -0.25 0.56 2.02 -1.26 -4.62 117.35 115.84 1ojo s TYR 707 Ca 0.68 0.71 -0.08 0.00 -0.37 0.00 0.00 57.07 58.01 1ojo s TYR 707 Cb -0.29 -2.09 -0.03 0.00 -0.40 0.00 0.00 41.96 39.14 1ojo s TYR 707 CO 0.34 0.60 0.08 0.21 -1.57 0.00 0.00 175.55 175.21 1ojo s LYS 708 N -1.64 3.71 -0.12 -0.62 2.20 0.02 -4.89 119.74 118.41 1ojo s LYS 708 Ca 0.28 -0.45 -0.12 0.00 -0.36 0.00 0.00 55.97 55.31 1ojo s LYS 708 Cb -0.14 -3.35 -0.05 0.00 -1.51 0.00 0.00 37.83 32.78 1ojo s LYS 708 CO 0.15 -0.15 0.28 0.08 -0.36 0.00 0.00 175.35 175.35 1ojo s VAL 709 N 1.54 5.29 -0.04 4.02 1.01 -1.26 -0.97 120.40 129.99 1ojo s VAL 709 Ca 0.06 0.53 0.05 0.00 0.00 0.00 0.00 61.98 62.63 1ojo s VAL 709 Cb -0.15 -3.60 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 1ojo s VAL 709 CO 0.04 0.48 -0.21 -0.31 0.00 0.00 0.00 175.10 175.11 1ojo s TYR 710 N -0.22 2.01 -0.15 5.22 1.51 -0.11 0.24 117.35 125.84 1ojo s TYR 710 Ca 0.18 -0.55 0.01 0.00 -1.01 0.00 0.00 57.07 55.70 1ojo s TYR 710 Cb -0.14 -1.33 0.02 0.00 -0.11 0.00 0.00 41.96 40.41 1ojo s TYR 710 CO 0.06 -0.16 -0.19 0.08 -1.11 0.00 0.00 175.55 174.24 1ojo s VAL 711 N -0.14 1.88 -1.45 0.71 1.01 -0.20 -0.44 120.40 121.77 1ojo s VAL 711 Ca -0.01 -0.84 -0.09 0.00 0.00 0.00 0.00 61.98 61.03 1ojo s VAL 711 Cb -0.12 -1.70 0.05 0.00 0.00 0.00 0.00 36.38 34.61 1ojo s VAL 711 CO 0.02 0.51 0.74 0.59 0.00 0.00 0.00 175.10 176.96 1ojo n ASN 712 N 4.44 -5.14 -1.31 3.32 3.02 -0.07 -1.17 115.26 118.35 1ojo n ASN 712 Ca -0.20 -0.47 -0.16 0.00 -0.03 0.00 0.00 54.58 53.73 1ojo n ASN 712 Cb 0.51 -4.15 -0.06 0.00 -0.61 0.00 0.00 39.78 35.47 1ojo n ASN 712 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1ojo n ASP 713 N -2.59 -4.87 -4.17 6.41 2.03 -1.26 -5.00 116.55 107.10 1ojo n ASP 713 Ca -0.03 0.32 -0.31 0.00 0.52 0.00 0.00 54.79 55.29 1ojo n ASP 713 Cb 0.57 -3.80 -0.17 0.00 -0.72 0.00 0.00 41.12 37.00 1ojo n ASP 713 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1ojo s LYS 714 N -3.57 2.87 0.23 -0.67 -0.14 -0.31 -5.04 119.74 113.10 1ojo s LYS 714 Ca 0.00 -0.81 -0.31 0.00 -1.36 0.00 0.00 55.97 53.49 1ojo s LYS 714 Cb 0.00 -2.26 -0.14 0.00 -1.68 0.00 0.00 37.83 33.74 1ojo s LYS 714 CO 0.00 0.06 1.27 -1.91 -0.76 0.00 0.00 175.35 174.01 1ojo n GLU 715 N 3.86 1.67 -4.39 1.68 2.13 -1.26 -1.03 120.64 123.29 1ojo n GLU 715 Ca -0.20 0.59 -0.24 0.00 0.66 0.00 0.00 57.16 57.97 1ojo n GLU 715 Cb 0.52 -2.15 -0.13 0.00 0.27 0.00 0.00 31.44 29.95 1ojo n GLU 715 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ojo s ALA 716 N -0.30 1.75 -0.35 4.31 0.00 0.14 -4.83 121.76 122.48 1ojo s ALA 716 Ca 0.68 -1.17 -0.06 0.00 0.00 0.00 0.00 51.96 51.41 1ojo s ALA 716 Cb -0.72 -0.27 0.05 0.00 0.00 0.00 0.00 23.12 22.19 1ojo s ALA 716 CO 0.53 0.36 0.12 -1.12 0.00 0.00 0.00 175.76 175.65 1ojo s SER 717 N -1.66 5.31 0.35 0.00 0.01 -1.26 -4.34 113.70 112.12 1ojo s SER 717 Ca 0.06 -1.27 -0.17 0.00 1.31 0.00 0.00 55.95 55.88 1ojo s SER 717 Cb -0.10 -1.87 -0.10 0.00 0.21 0.00 0.00 66.02 64.17 1ojo s SER 717 CO 0.03 -0.36 0.81 -0.76 0.41 0.00 0.00 173.24 173.37 1ojo s LEU 718 N 1.37 4.04 0.33 2.44 1.43 -1.26 -5.08 118.68 121.95 1ojo s LEU 718 Ca -0.01 1.43 0.03 0.00 -1.03 0.00 0.00 54.13 54.56 1ojo s LEU 718 Cb -0.20 -4.21 -0.05 0.00 0.03 0.00 0.00 46.19 41.76 1ojo s LEU 718 CO 0.02 -0.24 0.09 0.42 0.23 0.00 0.00 176.35 176.86 1ojo s THR 719 N -2.02 0.85 0.36 5.49 -4.23 -1.26 -4.75 115.64 110.08 1ojo s THR 719 Ca 0.56 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.11 1ojo s THR 719 Cb -0.10 -2.63 0.23 0.00 1.34 0.00 0.00 72.50 71.34 1ojo s THR 719 CO 0.16 0.00 1.98 -0.08 -0.54 0.00 0.00 174.62 176.15 1ojo h GLU 720 N 2.10 0.68 -6.50 3.99 4.81 -1.88 -1.12 114.58 116.66 1ojo h GLU 720 Ca -0.38 -0.07 -0.53 0.00 -0.13 0.00 0.00 59.36 58.25 1ojo h GLU 720 Cb 1.25 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.47 1ojo h GLU 720 CO 0.63 0.51 0.37 -1.14 -0.73 0.00 0.00 179.01 178.65 1ojo s GLN 721 N -5.46 4.63 0.19 1.92 0.74 -1.26 -4.62 119.66 115.79 1ojo s GLN 721 Ca -0.09 1.45 -0.32 0.00 0.05 0.00 0.00 55.36 56.45 1ojo s GLN 721 Cb 0.17 -3.41 -0.12 0.00 1.10 0.00 0.00 33.01 30.75 1ojo s GLN 721 CO 0.76 0.08 1.75 -2.00 -0.55 0.00 0.00 175.29 175.34 1ojo s GLU 722 N 0.46 4.13 -0.07 1.67 2.12 -1.26 -4.78 118.70 120.97 1ojo s GLU 722 Ca 0.49 2.61 0.03 0.00 0.36 0.00 0.00 54.97 58.46 1ojo s GLU 722 Cb -0.23 -3.21 -0.02 0.00 0.26 0.00 0.00 34.13 30.93 1ojo s GLU 722 CO 0.29 -0.78 -0.14 0.15 -0.54 0.00 0.00 175.26 174.24 1ojo s LYS 723 N 1.60 2.68 0.05 4.30 1.02 -0.28 -4.93 119.74 124.17 1ojo s LYS 723 Ca 0.77 -0.70 -0.14 0.00 0.02 0.00 0.00 55.97 55.92 1ojo s LYS 723 Cb -0.49 -2.42 -0.06 0.00 -0.52 0.00 0.00 37.83 34.34 1ojo s LYS 723 CO 0.33 0.54 0.44 -0.51 -0.92 0.00 0.00 175.35 175.23 1ojo s ASP 724 N -0.51 6.79 -0.43 2.83 1.01 -1.26 -0.80 116.67 124.30 1ojo s ASP 724 Ca 0.07 0.96 0.02 0.00 0.71 0.00 0.00 52.55 54.30 1ojo s ASP 724 Cb -0.12 -2.24 0.13 0.00 1.01 0.00 0.00 42.92 41.70 1ojo s ASP 724 CO 0.02 0.24 0.23 -0.31 0.21 0.00 0.00 175.17 175.56 1ojo s TYR 725 N -1.23 1.96 0.59 4.23 1.51 0.22 -4.97 117.35 119.66 1ojo s TYR 725 Ca 0.29 -2.38 -0.14 0.00 -1.01 0.00 0.00 57.07 53.83 1ojo s TYR 725 Cb -0.16 -1.87 -0.04 0.00 -0.11 0.00 0.00 41.96 39.78 1ojo s TYR 725 CO 0.16 -0.79 1.03 -1.25 -1.11 0.00 0.00 175.55 173.59 1ojo s PRO 726 N 0.44 3.48 -1.40 -1.71 0.04 -1.26 -2.27 135.00 132.32 1ojo s PRO 726 Ca 0.17 1.01 -0.10 0.00 0.04 0.00 0.00 61.00 62.12 1ojo s PRO 726 Cb -0.24 -2.06 0.03 0.00 0.04 0.00 0.00 34.50 32.27 1ojo s PRO 726 CO -0.01 -0.67 1.11 0.39 0.04 0.00 0.00 177.00 177.87 1ojo n GLU 727 N -2.22 -7.18 -2.90 4.56 -0.58 -1.17 -4.93 120.64 106.21 1ojo n GLU 727 Ca 0.07 0.76 -0.41 0.00 -0.42 0.00 0.00 57.16 57.17 1ojo n GLU 727 Cb 0.53 -5.76 -0.04 0.00 -0.57 0.00 0.00 31.44 25.60 1ojo n GLU 727 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1ojo s THR 728 N -3.32 4.94 -0.17 2.62 2.01 0.42 -4.73 115.64 117.41 1ojo s THR 728 Ca 0.57 1.66 0.18 0.00 0.31 0.00 0.00 61.69 64.41 1ojo s THR 728 Cb -0.26 -4.14 -0.25 0.00 0.01 0.00 0.00 72.50 67.85 1ojo s THR 728 CO 0.76 0.14 0.12 1.67 -0.69 0.00 0.00 174.62 176.62 1ojo n GLN 729 N 4.40 0.81 -3.45 4.92 -0.06 -1.26 -0.94 117.38 121.81 1ojo n GLN 729 Ca 0.03 -0.03 -0.13 0.00 -2.00 0.00 0.00 57.00 54.87 1ojo n GLN 729 Cb 0.50 -1.50 -0.03 0.00 -4.06 0.00 0.00 30.24 25.16 1ojo n GLN 729 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 1ojo s SER 730 N -5.24 -0.56 -0.02 1.69 1.04 -1.26 -0.84 113.70 108.51 1ojo s SER 730 Ca -0.09 0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.46 1ojo s SER 730 Cb 0.07 0.57 0.01 0.00 0.10 0.00 0.00 66.02 66.77 1ojo s SER 730 CO 0.80 -0.87 -0.02 -0.69 0.98 0.00 0.00 173.24 173.44 1ojo s VAL 731 N -3.26 0.26 -0.06 5.02 1.01 -0.28 -0.90 120.40 122.19 1ojo s VAL 731 Ca -0.01 -0.03 0.01 0.00 0.00 0.00 0.00 61.98 61.95 1ojo s VAL 731 Cb -0.01 -0.30 0.02 0.00 0.00 0.00 0.00 36.38 36.10 1ojo s VAL 731 CO -0.09 0.13 -0.07 0.12 0.00 0.00 0.00 175.10 175.19 1ojo s PHE 732 N 0.57 1.04 -0.39 5.22 5.36 0.42 -0.36 117.98 129.85 1ojo s PHE 732 Ca -0.06 -0.36 -0.12 0.00 -0.96 0.00 0.00 56.93 55.42 1ojo s PHE 732 Cb -0.09 -0.86 0.02 0.00 -0.34 0.00 0.00 43.02 41.75 1ojo s PHE 732 CO -0.01 -0.26 0.24 -0.51 -1.46 0.00 0.00 175.22 173.22 1ojo s LEU 733 N 1.02 4.85 -0.25 6.12 1.43 0.54 -0.94 118.68 131.44 1ojo s LEU 733 Ca -0.09 -0.93 -0.09 0.00 -1.03 0.00 0.00 54.13 51.99 1ojo s LEU 733 Cb -0.14 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 43.96 1ojo s LEU 733 CO -0.00 -0.40 0.13 -0.70 0.23 0.00 0.00 176.35 175.60 1ojo s GLU 734 N 1.61 3.85 0.40 1.70 2.12 -0.14 -2.27 118.70 125.97 1ojo s GLU 734 Ca 0.03 -0.38 0.08 0.00 0.36 0.00 0.00 54.97 55.06 1ojo s GLU 734 Cb -0.19 -3.47 -0.04 0.00 0.26 0.00 0.00 34.13 30.69 1ojo s GLU 734 CO 0.08 -0.11 0.27 0.45 -0.54 0.00 0.00 175.26 175.40 1ojo s SER 735 N 1.49 4.80 0.36 -1.70 0.15 -1.26 -0.80 113.70 116.74 1ojo s SER 735 Ca 0.06 -0.84 0.26 0.00 0.70 0.00 0.00 55.95 56.14 1ojo s SER 735 Cb -0.15 -0.60 0.82 0.00 -1.71 0.00 0.00 66.02 64.38 1ojo s SER 735 CO 0.06 -0.53 1.76 0.77 1.20 0.00 0.00 173.24 176.50 1ojo h SER 736 N 1.27 0.00 -3.61 5.45 4.64 -1.93 -3.40 113.55 115.97 1ojo h SER 736 Ca -0.43 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.21 1ojo h SER 736 Cb 1.26 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 63.07 1ojo h SER 736 CO 0.63 0.00 -0.64 -0.62 -0.87 0.00 0.00 176.83 175.32 1ojo s ASP 737 N -5.24 5.01 0.59 4.97 -1.08 -1.26 -4.98 116.67 114.69 1ojo s ASP 737 Ca 0.06 -0.85 0.30 0.00 -0.52 0.00 0.00 52.55 51.54 1ojo s ASP 737 Cb 0.09 -1.83 1.73 0.00 -1.46 0.00 0.00 42.92 41.44 1ojo s ASP 737 CO 0.57 -0.21 2.15 0.77 0.52 0.00 0.00 175.17 178.96 1ojo h SER 738 N 8.18 0.00 0.00 -0.34 4.64 -1.94 -0.48 113.55 123.61 1ojo h SER 738 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1ojo h SER 738 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1ojo h SER 738 CO 0.59 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.84 1ojo n LYS 739 N -3.76 0.69 0.00 4.77 4.76 -1.26 -1.99 118.16 121.37 1ojo n LYS 739 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 1ojo n LYS 739 Cb 0.25 -1.30 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 1ojo n LYS 739 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1ojo n LYS 740 N -0.80 1.68 -2.17 1.97 5.02 -0.19 -0.59 118.16 123.08 1ojo n LYS 740 Ca 0.10 -0.37 -0.39 0.00 -2.02 0.00 0.00 58.31 55.63 1ojo n LYS 740 Cb 0.05 -0.85 -0.01 0.00 -0.02 0.00 0.00 35.03 34.19 1ojo n LYS 740 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1ojo s ASN 741 N -0.41 6.51 -0.06 4.39 0.01 -0.84 -4.80 114.94 119.75 1ojo s ASN 741 Ca 0.01 2.53 -0.01 0.00 -0.71 0.00 0.00 52.86 54.68 1ojo s ASN 741 Cb 0.01 -2.63 0.03 0.00 0.41 0.00 0.00 41.25 39.06 1ojo s ASN 741 CO 0.02 -0.70 0.00 -0.63 -1.51 0.00 0.00 177.10 174.28 1ojo s ILE 742 N -1.28 0.30 0.09 0.60 1.01 -0.96 -1.40 121.20 119.55 1ojo s ILE 742 Ca 0.55 0.12 0.10 0.00 0.00 0.00 0.00 60.65 61.42 1ojo s ILE 742 Cb -0.36 -0.44 -0.03 0.00 0.01 0.00 0.00 42.46 41.64 1ojo s ILE 742 CO 0.46 0.22 -0.27 -0.83 0.00 0.00 0.00 174.94 174.52 1ojo s GLY 743 N 1.67 1.49 -0.12 6.18 0.00 -0.46 -0.34 107.32 115.75 1ojo s GLY 743 Ca 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 44.72 43.35 1ojo s GLY 743 CO -0.04 -1.31 -0.11 -0.19 0.00 0.00 0.00 173.10 171.46 1ojo s TYR 744 N -0.94 1.77 -0.24 1.90 1.51 0.52 -0.60 117.35 121.26 1ojo s TYR 744 Ca 0.13 -0.91 -0.04 0.00 -1.01 0.00 0.00 57.07 55.24 1ojo s TYR 744 Cb -0.10 -1.37 0.00 0.00 -0.11 0.00 0.00 41.96 40.39 1ojo s TYR 744 CO 0.04 -0.55 -0.03 0.12 -1.11 0.00 0.00 175.55 174.02 1ojo s PHE 745 N 1.48 3.01 -0.32 2.71 5.36 -0.36 -1.13 117.98 128.74 1ojo s PHE 745 Ca 0.02 -1.13 -0.20 0.00 -0.96 0.00 0.00 56.93 54.67 1ojo s PHE 745 Cb -0.13 -2.11 -0.01 0.00 -0.34 0.00 0.00 43.02 40.43 1ojo s PHE 745 CO -0.08 -0.61 0.62 -0.06 -1.46 0.00 0.00 175.22 173.63 1ojo s PHE 746 N 1.44 3.19 0.32 10.12 0.40 -0.02 0.27 117.98 133.70 1ojo s PHE 746 Ca 0.04 0.48 0.09 0.00 -0.60 0.00 0.00 56.93 56.94 1ojo s PHE 746 Cb -0.15 -3.02 0.83 0.00 0.51 0.00 0.00 43.02 41.19 1ojo s PHE 746 CO -0.03 -0.52 1.77 0.74 0.70 0.00 0.00 175.22 177.88 1ojo h PHE 747 N 8.28 0.99 -3.91 0.36 0.04 -1.81 -3.38 116.94 117.51 1ojo h PHE 747 Ca -0.27 0.03 -0.53 0.00 2.80 0.00 0.00 57.97 60.00 1ojo h PHE 747 Cb 1.12 -0.29 -0.31 0.00 2.20 0.00 0.00 35.95 38.66 1ojo h PHE 747 CO 0.75 0.18 -0.83 0.15 -0.60 0.00 0.00 178.31 177.96 1ojo s LYS 748 N -5.78 1.58 -0.01 1.51 1.02 -1.26 -5.05 119.74 111.76 1ojo s LYS 748 Ca -0.11 -0.54 -0.38 0.00 0.02 0.00 0.00 55.97 54.96 1ojo s LYS 748 Cb 0.25 -1.40 -0.17 0.00 -0.52 0.00 0.00 37.83 35.99 1ojo s LYS 748 CO 0.80 0.22 1.34 1.63 -0.92 0.00 0.00 175.35 178.42 1ojo n LYS 749 N 3.14 0.83 -4.37 1.68 5.02 -1.26 -4.92 118.16 118.29 1ojo n LYS 749 Ca -0.18 0.30 -0.21 0.00 -2.02 0.00 0.00 58.31 56.20 1ojo n LYS 749 Cb 0.53 -1.91 -0.10 0.00 -0.02 0.00 0.00 35.03 33.53 1ojo n LYS 749 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1ojo s SER 750 N 0.87 2.85 -0.39 4.39 0.01 -0.12 -4.76 113.70 116.55 1ojo s SER 750 Ca 0.89 -0.96 -0.16 0.00 1.31 0.00 0.00 55.95 57.02 1ojo s SER 750 Cb -1.07 -0.18 0.01 0.00 0.21 0.00 0.00 66.02 64.99 1ojo s SER 750 CO 0.53 -0.07 0.40 -0.55 0.41 0.00 0.00 173.24 173.96 1ojo s SER 751 N -3.11 6.18 0.36 2.44 0.15 -1.26 -0.43 113.70 118.02 1ojo s SER 751 Ca 0.22 -0.55 0.04 0.00 0.70 0.00 0.00 55.95 56.35 1ojo s SER 751 Cb -0.04 -2.21 -0.06 0.00 -1.71 0.00 0.00 66.02 62.01 1ojo s SER 751 CO 0.08 -0.49 0.05 0.27 1.20 0.00 0.00 173.24 174.36 1ojo s ILE 752 N 2.05 1.27 0.03 6.45 -4.36 -0.96 -4.30 121.20 121.38 1ojo s ILE 752 Ca 0.11 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.52 1ojo s ILE 752 Cb -0.17 -2.76 -0.02 0.00 1.25 0.00 0.00 42.46 40.76 1ojo s ILE 752 CO 0.13 0.00 -0.08 -0.94 0.24 0.00 0.00 174.94 174.29 1ojo s SER 753 N -3.56 0.87 0.04 4.36 1.04 -0.31 0.70 113.70 116.84 1ojo s SER 753 Ca 0.34 -0.46 -0.01 0.00 0.48 0.00 0.00 55.95 56.30 1ojo s SER 753 Cb 0.08 0.01 -0.03 0.00 0.10 0.00 0.00 66.02 66.18 1ojo s SER 753 CO 0.15 -0.14 -0.02 -0.04 0.98 0.00 0.00 173.24 174.18 1ojo s MET 754 N -1.28 0.49 0.07 4.02 -1.94 0.02 -1.24 119.30 119.44 1ojo s MET 754 Ca -0.07 -0.93 -0.23 0.00 -1.71 0.00 0.00 55.69 52.76 1ojo s MET 754 Cb -0.08 0.17 0.06 0.00 2.01 0.00 0.00 34.83 36.98 1ojo s MET 754 CO 0.00 -0.09 0.54 -1.54 -0.01 0.00 0.00 175.02 173.92 1ojo s SER 755 N -2.25 -0.46 -0.13 3.03 1.04 -0.69 -1.13 113.70 113.10 1ojo s SER 755 Ca -0.04 0.14 -0.00 0.00 0.48 0.00 0.00 55.95 56.53 1ojo s SER 755 Cb -0.00 0.52 0.03 0.00 0.10 0.00 0.00 66.02 66.66 1ojo s SER 755 CO -0.06 -0.77 -0.07 -0.75 0.98 0.00 0.00 173.24 172.57 1ojo s LYS 756 N -2.73 1.49 0.01 4.02 2.20 -0.43 -0.81 119.74 123.49 1ojo s LYS 756 Ca -0.04 -0.35 -0.15 0.00 -0.36 0.00 0.00 55.97 55.07 1ojo s LYS 756 Cb -0.00 -1.74 0.03 0.00 -1.51 0.00 0.00 37.83 34.60 1ojo s LYS 756 CO -0.04 -0.33 0.33 0.00 -0.36 0.00 0.00 175.35 174.96 1ojo s ALA 757 N 1.68 -0.81 -0.02 3.13 0.00 -0.62 -2.46 121.76 122.66 1ojo s ALA 757 Ca 0.03 0.26 -0.30 0.00 0.00 0.00 0.00 51.96 51.96 1ojo s ALA 757 Cb -0.13 0.18 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 1ojo s ALA 757 CO -0.08 -0.33 1.04 -0.51 0.00 0.00 0.00 175.76 175.88 1ojo s LEU 758 N -1.63 4.33 -0.12 0.00 1.43 -1.26 -1.42 118.68 120.01 1ojo s LEU 758 Ca -0.10 1.69 0.02 0.00 -1.03 0.00 0.00 54.13 54.72 1ojo s LEU 758 Cb -0.03 -3.57 -0.00 0.00 0.03 0.00 0.00 46.19 42.62 1ojo s LEU 758 CO 0.01 -0.37 -0.20 -1.10 0.23 0.00 0.00 176.35 174.92 1ojo s GLN 759 N 1.40 3.14 0.18 1.70 -0.21 0.97 -4.96 119.66 121.88 1ojo s GLN 759 Ca 0.52 -0.82 0.08 0.00 0.02 0.00 0.00 55.36 55.16 1ojo s GLN 759 Cb -0.22 -2.43 -0.04 0.00 1.00 0.00 0.00 33.01 31.32 1ojo s GLN 759 CO 0.25 0.15 -0.02 0.15 -2.12 0.00 0.00 175.29 173.70 1ojo s LYS 760 N 0.44 2.35 0.00 2.91 1.02 -1.26 -1.53 119.74 123.67 1ojo s LYS 760 Ca -0.14 -1.14 0.00 0.00 0.02 0.00 0.00 55.97 54.71 1ojo s LYS 760 Cb -0.17 -2.32 0.00 0.00 -0.52 0.00 0.00 37.83 34.82 1ojo s LYS 760 CO 0.06 0.45 0.00 0.41 -0.92 0.00 0.00 175.35 175.35 1ojo n GLY 761 N -0.11 0.19 3.25 -3.33 0.00 0.19 -4.84 105.19 100.52 1ojo n GLY 761 Ca -0.10 -0.89 -0.22 0.00 0.00 0.00 0.00 46.02 44.82 1ojo n GLY 761 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ojo s ALA 762 N -2.00 1.59 0.52 4.61 0.00 -1.26 0.71 121.76 125.93 1ojo s ALA 762 Ca 0.00 -1.17 0.18 0.00 0.00 0.00 0.00 51.96 50.97 1ojo s ALA 762 Cb 0.00 -0.19 1.29 0.00 0.00 0.00 0.00 23.12 24.23 1ojo s ALA 762 CO 0.00 0.28 2.11 -1.49 0.00 0.00 0.00 175.76 176.66 1ojo h TRP 763 N 4.10 0.01 0.00 0.00 4.06 -1.74 -0.25 115.95 122.12 1ojo h TRP 763 Ca -0.44 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.49 1ojo h TRP 763 Cb 1.19 -0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.34 1ojo h TRP 763 CO 0.62 0.01 -0.12 -0.22 -3.56 0.00 0.00 178.44 175.17 1ojo h LYS 764 N 0.01 0.00 -0.47 0.49 3.64 -1.38 -0.63 116.57 118.22 1ojo h LYS 764 Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1ojo h LYS 764 Cb 0.23 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1ojo h LYS 764 CO -0.00 0.12 0.30 -0.44 -2.27 0.00 0.00 179.45 177.16 1ojo h ASP 765 N 0.00 0.55 -0.01 4.20 3.32 -1.33 -2.96 116.42 120.19 1ojo h ASP 765 Ca -0.00 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.03 1ojo h ASP 765 Cb 0.25 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.67 1ojo h ASP 765 CO 0.02 0.41 -0.35 2.30 -1.72 0.00 0.00 179.24 179.89 1ojo n ILE 766 N -4.46 0.00 -3.29 0.35 -5.35 -0.83 -4.79 119.36 101.00 1ojo n ILE 766 Ca 0.04 -0.32 -0.06 0.00 -0.27 0.00 0.00 62.75 62.14 1ojo n ILE 766 Cb 0.06 1.15 -0.05 0.00 -1.74 0.00 0.00 39.64 39.05 1ojo n ILE 766 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1ojo s ASN 767 N -1.83 -0.13 0.38 7.28 3.84 -0.30 -0.25 114.94 123.92 1ojo s ASN 767 Ca 0.11 0.13 0.19 0.00 0.21 0.00 0.00 52.86 53.50 1ojo s ASN 767 Cb 0.12 1.36 1.13 0.00 -0.55 0.00 0.00 41.25 43.31 1ojo s ASN 767 CO 0.39 -0.31 1.71 -0.33 -2.79 0.00 0.00 177.10 175.77 1ojo h GLU 768 N 8.13 0.33 -0.02 0.43 4.39 -1.29 -0.41 114.58 126.14 1ojo h GLU 768 Ca -0.15 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.53 1ojo h GLU 768 Cb 1.15 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1ojo h GLU 768 CO 0.26 0.22 0.00 0.41 -1.16 0.00 0.00 179.01 178.74 1ojo n GLY 769 N -1.42 -0.76 4.00 -3.84 0.00 -1.26 -4.89 105.19 97.01 1ojo n GLY 769 Ca 0.29 -0.19 -0.20 0.00 0.00 0.00 0.00 46.02 45.92 1ojo n GLY 769 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ojo s GLN 770 N -1.97 2.49 0.34 1.61 -1.52 -0.16 -5.05 119.66 115.40 1ojo s GLN 770 Ca 0.33 -1.10 -0.28 0.00 -1.95 0.00 0.00 55.36 52.36 1ojo s GLN 770 Cb 0.16 -2.58 -0.10 0.00 -0.22 0.00 0.00 33.01 30.26 1ojo s GLN 770 CO 0.26 -0.68 1.30 0.45 -0.25 0.00 0.00 175.29 176.37 1ojo s SER 771 N -4.47 6.72 0.00 5.90 0.15 -1.26 -4.16 113.70 116.58 1ojo s SER 771 Ca 0.58 2.67 0.19 0.00 0.70 0.00 0.00 55.95 60.09 1ojo s SER 771 Cb -0.09 -2.65 0.75 0.00 -1.71 0.00 0.00 66.02 62.33 1ojo s SER 771 CO 0.37 -0.57 1.53 -0.90 1.20 0.00 0.00 173.24 174.88 1ojo n ASP 772 N 0.70 1.36 -4.70 5.45 5.68 -1.26 -1.50 116.55 122.28 1ojo n ASP 772 Ca 0.01 -1.69 -0.43 0.00 -0.50 0.00 0.00 54.79 52.17 1ojo n ASP 772 Cb 0.42 -0.10 -0.03 0.00 -1.14 0.00 0.00 41.12 40.27 1ojo n ASP 772 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1ojo n LYS 773 N 0.13 2.62 -2.18 0.11 0.00 -1.26 -4.81 118.16 112.77 1ojo n LYS 773 Ca 0.15 0.94 -0.41 0.00 0.00 0.00 0.00 58.31 58.99 1ojo n LYS 773 Cb 0.27 -2.78 -0.03 0.00 0.00 0.00 0.00 35.03 32.50 1ojo n LYS 773 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1ojo s GLU 774 N 1.29 4.36 0.16 1.64 2.12 -1.26 -4.40 118.70 122.61 1ojo s GLU 774 Ca 0.77 2.10 0.11 0.00 0.36 0.00 0.00 54.97 58.30 1ojo s GLU 774 Cb -0.55 -3.19 -0.04 0.00 0.26 0.00 0.00 34.13 30.61 1ojo s GLU 774 CO 0.34 -0.30 -0.24 0.08 -0.54 0.00 0.00 175.26 174.60 1ojo s VAL 775 N 0.22 2.21 -0.07 3.70 1.01 0.22 -4.96 120.40 122.73 1ojo s VAL 775 Ca 0.58 -1.88 -0.09 0.00 0.00 0.00 0.00 61.98 60.60 1ojo s VAL 775 Cb -0.37 -2.00 0.02 0.00 0.00 0.00 0.00 36.38 34.03 1ojo s VAL 775 CO 0.38 -0.05 0.24 -0.70 0.00 0.00 0.00 175.10 174.97 1ojo s GLU 776 N -2.38 0.35 0.02 2.72 2.12 -1.26 -0.64 118.70 119.62 1ojo s GLU 776 Ca 0.16 0.20 -0.15 0.00 0.36 0.00 0.00 54.97 55.54 1ojo s GLU 776 Cb -0.09 0.16 0.02 0.00 0.26 0.00 0.00 34.13 34.49 1ojo s GLU 776 CO 0.08 -0.06 0.32 -0.80 -0.54 0.00 0.00 175.26 174.26 1ojo s ASN 777 N -0.20 -0.18 -0.13 -1.70 0.01 -0.58 -4.98 114.94 107.18 1ojo s ASN 777 Ca -0.03 -0.04 -0.10 0.00 -0.71 0.00 0.00 52.86 51.98 1ojo s ASN 777 Cb -0.03 0.35 -0.05 0.00 0.41 0.00 0.00 41.25 41.93 1ojo s ASN 777 CO 0.01 -0.55 0.20 -0.70 -1.51 0.00 0.00 177.10 174.55 1ojo s GLU 778 N -1.99 3.85 0.06 -0.60 2.12 -1.26 -0.02 118.70 120.86 1ojo s GLU 778 Ca -0.09 -0.04 0.07 0.00 0.36 0.00 0.00 54.97 55.27 1ojo s GLU 778 Cb -0.03 -3.30 -0.03 0.00 0.26 0.00 0.00 34.13 31.04 1ojo s GLU 778 CO 0.00 0.54 -0.19 -0.06 -0.54 0.00 0.00 175.26 175.02 1ojo s PHE 779 N -0.39 1.61 -0.27 5.30 0.40 -0.50 -0.48 117.98 123.65 1ojo s PHE 779 Ca 0.15 -0.39 -0.06 0.00 -0.60 0.00 0.00 56.93 56.03 1ojo s PHE 779 Cb -0.13 -0.94 -0.00 0.00 0.51 0.00 0.00 43.02 42.47 1ojo s PHE 779 CO 0.04 0.10 0.06 -1.17 0.70 0.00 0.00 175.22 174.95 1ojo s LEU 780 N -1.40 3.59 -0.12 -0.37 0.20 -0.18 -1.58 118.68 118.82 1ojo s LEU 780 Ca 0.05 -0.55 -0.02 0.00 0.69 0.00 0.00 54.13 54.30 1ojo s LEU 780 Cb -0.09 -1.86 -0.03 0.00 -0.43 0.00 0.00 46.19 43.78 1ojo s LEU 780 CO 0.02 -0.13 -0.05 -0.89 -0.29 0.00 0.00 176.35 175.01 1ojo s THR 781 N 1.52 3.77 -0.11 3.68 2.01 0.01 -1.36 115.64 125.16 1ojo s THR 781 Ca 0.04 -0.42 0.01 0.00 0.31 0.00 0.00 61.69 61.63 1ojo s THR 781 Cb -0.16 -2.60 0.02 0.00 0.01 0.00 0.00 72.50 69.76 1ojo s THR 781 CO 0.02 0.54 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.71 1ojo s ILE 782 N -0.14 1.47 0.08 1.82 1.01 -0.08 -1.71 121.20 123.65 1ojo s ILE 782 Ca 0.02 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 60.07 1ojo s ILE 782 Cb -0.13 -1.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 1ojo s ILE 782 CO 0.03 0.44 -0.06 -0.44 0.00 0.00 0.00 174.94 174.90 1ojo s SER 783 N 1.06 0.99 -0.16 3.58 0.01 -0.37 0.05 113.70 118.86 1ojo s SER 783 Ca -0.05 -0.95 -0.01 0.00 1.31 0.00 0.00 55.95 56.24 1ojo s SER 783 Cb -0.15 0.11 0.05 0.00 0.21 0.00 0.00 66.02 66.24 1ojo s SER 783 CO -0.03 -0.46 -0.01 -1.58 0.41 0.00 0.00 173.24 171.58 1ojo s GLN 784 N -3.59 0.98 0.44 12.44 0.74 -0.27 -1.16 119.66 129.24 1ojo s GLN 784 Ca 0.08 -0.37 -0.22 0.00 0.05 0.00 0.00 55.36 54.90 1ojo s GLN 784 Cb 0.04 -1.85 -0.09 0.00 1.10 0.00 0.00 33.01 32.21 1ojo s GLN 784 CO -0.05 -0.49 1.05 0.00 -0.55 0.00 0.00 175.29 175.25 1ojo s ALA 785 N 1.78 2.99 -0.47 1.58 0.00 -1.26 -1.16 121.76 125.22 1ojo s ALA 785 Ca 0.01 0.67 0.03 0.00 0.00 0.00 0.00 51.96 52.67 1ojo s ALA 785 Cb -0.15 -3.27 0.13 0.00 0.00 0.00 0.00 23.12 19.83 1ojo s ALA 785 CO -0.07 -0.27 0.22 -1.01 0.00 0.00 0.00 175.76 174.63 1ojo s HIS 786 N -1.79 2.77 -1.90 0.00 0.09 -0.16 -4.93 115.29 109.37 1ojo s HIS 786 Ca 0.62 -2.84 0.27 0.00 -0.00 0.00 0.00 55.06 53.11 1ojo s HIS 786 Cb -0.20 -2.47 0.96 0.00 -0.00 0.00 0.00 32.58 30.87 1ojo s HIS 786 CO 0.25 -0.78 1.69 1.63 -0.00 0.00 0.00 174.74 177.52 1ojo n LYS 787 N 3.44 0.98 -4.10 1.40 5.02 -1.26 -4.31 118.16 119.33 1ojo n LYS 787 Ca 0.06 -0.52 -0.13 0.00 -2.02 0.00 0.00 58.31 55.70 1ojo n LYS 787 Cb 0.34 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.75 1ojo n LYS 787 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1ojo s GLN 788 N -2.37 0.65 0.32 1.97 -1.52 -1.26 -5.10 119.66 112.34 1ojo s GLN 788 Ca 0.29 -0.95 -0.28 0.00 -1.95 0.00 0.00 55.36 52.46 1ojo s GLN 788 Cb 0.20 -0.31 -0.10 0.00 -0.22 0.00 0.00 33.01 32.58 1ojo s GLN 788 CO 0.47 0.04 1.20 -0.80 -0.25 0.00 0.00 175.29 175.94 1ojo s ASN 789 N -2.04 6.95 0.00 5.90 0.01 -1.26 -2.64 114.94 121.85 1ojo s ASN 789 Ca -0.03 2.46 0.00 0.00 -0.71 0.00 0.00 52.86 54.58 1ojo s ASN 789 Cb -0.05 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.97 1ojo s ASN 789 CO -0.01 -0.39 0.00 0.54 -1.51 0.00 0.00 177.10 175.73 1ojo n ARG 790 N 0.86 0.00 -1.16 -0.60 3.00 0.73 -4.99 116.66 114.49 1ojo n ARG 790 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.85 57.56 1ojo n ARG 790 Cb 0.44 -1.60 0.18 0.00 0.00 0.00 0.00 32.46 31.48 1ojo n ARG 790 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1ojo s ASP 791 N -2.02 2.53 0.27 0.55 1.01 -1.08 -4.57 116.67 113.36 1ojo s ASP 791 Ca 0.00 1.16 -0.19 0.00 0.71 0.00 0.00 52.55 54.23 1ojo s ASP 791 Cb 0.00 -1.83 0.01 0.00 1.01 0.00 0.00 42.92 42.12 1ojo s ASP 791 CO 0.00 -3.19 0.66 -0.94 0.21 0.00 0.00 175.17 171.91 1ojo s SER 792 N -3.46 -0.21 0.04 0.27 1.04 -1.26 -1.90 113.70 108.22 1ojo s SER 792 Ca 0.65 -0.70 -0.04 0.00 0.48 0.00 0.00 55.95 56.35 1ojo s SER 792 Cb -0.19 0.70 -0.02 0.00 0.10 0.00 0.00 66.02 66.61 1ojo s SER 792 CO 0.58 -1.31 0.06 -0.72 0.98 0.00 0.00 173.24 172.83 1ojo s TYR 793 N -3.92 0.26 -0.30 5.02 -0.85 -0.28 -4.97 117.35 112.31 1ojo s TYR 793 Ca 0.14 -0.60 -0.09 0.00 -0.52 0.00 0.00 57.07 56.00 1ojo s TYR 793 Cb -0.05 -0.19 0.15 0.00 0.38 0.00 0.00 41.96 42.26 1ojo s TYR 793 CO 0.08 -0.35 0.74 0.20 -1.52 0.00 0.00 175.55 174.70 1ojo s GLY 794 N -2.17 -0.64 0.12 5.49 0.00 -1.26 -0.96 107.32 107.90 1ojo s GLY 794 Ca -0.04 2.43 -0.21 0.00 0.00 0.00 0.00 44.72 46.89 1ojo s GLY 794 CO -0.05 3.22 0.53 -2.52 0.00 0.00 0.00 173.10 174.29 1ojo s TYR 795 N 2.79 -0.43 -0.18 1.90 -0.85 -0.61 -2.79 117.35 117.18 1ojo s TYR 795 Ca 0.01 0.28 -0.03 0.00 -0.52 0.00 0.00 57.07 56.81 1ojo s TYR 795 Cb -0.11 0.43 -0.02 0.00 0.38 0.00 0.00 41.96 42.64 1ojo s TYR 795 CO -0.19 -0.75 -0.05 1.41 -1.52 0.00 0.00 175.55 174.45 1ojo s MET 796 N -3.35 3.50 -0.28 -3.49 -2.45 0.14 0.01 119.30 113.38 1ojo s MET 796 Ca -0.00 -0.59 -0.20 0.00 -1.25 0.00 0.00 55.69 53.65 1ojo s MET 796 Cb -0.00 -2.91 -0.01 0.00 1.25 0.00 0.00 34.83 33.15 1ojo s MET 796 CO -0.09 0.05 0.61 -1.17 1.05 0.00 0.00 175.02 175.47 1ojo s LEU 797 N 0.84 4.11 -0.31 4.11 2.96 0.83 -1.23 118.68 129.99 1ojo s LEU 797 Ca -0.01 0.52 0.03 0.00 -0.22 0.00 0.00 54.13 54.44 1ojo s LEU 797 Cb -0.15 -2.80 0.09 0.00 0.50 0.00 0.00 46.19 43.84 1ojo s LEU 797 CO 0.01 -0.42 0.03 -0.63 -1.32 0.00 0.00 176.35 174.03 1ojo s ILE 798 N 2.53 1.91 0.40 6.68 1.01 0.23 -1.72 121.20 132.23 1ojo s ILE 798 Ca 0.25 -1.95 0.06 0.00 0.00 0.00 0.00 60.65 59.01 1ojo s ILE 798 Cb -0.15 -2.34 0.00 0.00 0.01 0.00 0.00 42.46 39.98 1ojo s ILE 798 CO 0.10 -0.49 0.56 -2.16 0.00 0.00 0.00 174.94 172.96 1ojo s PRO 799 N 1.12 2.94 -1.69 2.79 0.04 -1.26 -1.35 135.00 137.59 1ojo s PRO 799 Ca 0.06 -1.02 -0.02 0.00 0.04 0.00 0.00 61.00 60.07 1ojo s PRO 799 Cb -0.19 -2.73 0.00 0.00 0.04 0.00 0.00 34.50 31.62 1ojo s PRO 799 CO -0.11 -0.18 0.21 0.09 0.04 0.00 0.00 177.00 177.05 1ojo n ASN 800 N -1.84 -5.93 -4.22 6.66 4.13 -0.49 -4.98 115.26 108.58 1ojo n ASN 800 Ca 0.04 -0.10 -0.19 0.00 1.68 0.00 0.00 54.58 56.01 1ojo n ASN 800 Cb 0.59 -4.89 -0.12 0.00 -1.54 0.00 0.00 39.78 33.82 1ojo n ASN 800 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1ojo s VAL 801 N -3.08 1.29 0.89 2.41 -7.23 -1.25 -4.72 120.40 108.72 1ojo s VAL 801 Ca 0.10 -1.54 -0.13 0.00 -1.81 0.00 0.00 61.98 58.60 1ojo s VAL 801 Cb -0.05 -1.36 0.13 0.00 0.56 0.00 0.00 36.38 35.66 1ojo s VAL 801 CO 0.13 -0.30 1.20 1.51 -0.31 0.00 0.00 175.10 177.32 1ojo s ASP 802 N -2.12 3.79 0.16 4.85 1.47 -1.26 -4.76 116.67 118.81 1ojo s ASP 802 Ca 0.04 0.72 -0.17 0.00 1.18 0.00 0.00 52.55 54.32 1ojo s ASP 802 Cb -0.07 -1.13 0.09 0.00 -0.34 0.00 0.00 42.92 41.47 1ojo s ASP 802 CO 0.03 -2.35 1.68 -0.09 0.68 0.00 0.00 175.17 175.13 1ojo h ARG 803 N -1.36 0.04 -0.80 2.11 2.43 -1.98 0.58 114.38 115.40 1ojo h ARG 803 Ca -0.47 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.67 1ojo h ARG 803 Cb 1.31 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.81 1ojo h ARG 803 CO 0.58 0.03 0.39 0.00 -1.51 0.00 0.00 179.97 179.46 1ojo h ALA 804 N 1.36 1.04 -0.44 2.80 0.00 -1.99 -0.80 119.26 121.22 1ojo h ALA 804 Ca 0.18 -0.16 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 1ojo h ALA 804 Cb 0.27 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ojo h ALA 804 CO -0.35 0.60 -0.18 1.15 0.00 0.00 0.00 179.25 180.46 1ojo h THR 805 N 1.14 1.27 -0.37 0.00 2.02 -1.80 -1.78 112.91 113.38 1ojo h THR 805 Ca 0.28 -1.31 -0.03 0.00 0.77 0.00 0.00 66.41 66.12 1ojo h THR 805 Cb 0.12 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1ojo h THR 805 CO -0.04 0.45 0.13 0.15 0.37 0.00 0.00 175.52 176.58 1ojo h PHE 806 N 0.76 0.59 -0.53 3.16 3.57 -0.51 -0.63 116.94 123.34 1ojo h PHE 806 Ca 0.11 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1ojo h PHE 806 Cb 0.72 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.26 1ojo h PHE 806 CO 0.04 0.55 0.30 -0.91 -2.23 0.00 0.00 178.31 176.06 1ojo h ASN 807 N 0.45 0.65 -0.23 0.41 2.35 -0.95 -1.73 115.58 116.53 1ojo h ASN 807 Ca 0.12 -0.04 -0.14 0.00 -0.55 0.00 0.00 56.30 55.69 1ojo h ASN 807 Cb 0.23 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1ojo h ASN 807 CO -0.01 0.52 -0.39 1.56 -1.65 0.00 0.00 177.43 177.46 1ojo h GLN 808 N 0.74 0.67 -0.77 0.81 1.08 -1.01 -3.19 115.11 113.44 1ojo h GLN 808 Ca 0.19 -0.41 -0.03 0.00 -1.45 0.00 0.00 58.65 56.95 1ojo h GLN 808 Cb 0.01 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.45 1ojo h GLN 808 CO -0.03 1.03 0.35 0.52 -0.95 0.00 0.00 178.83 179.75 1ojo h MET 809 N 0.38 1.11 0.00 1.46 2.86 -0.61 -2.18 114.93 117.95 1ojo h MET 809 Ca 0.02 -0.17 -0.05 0.00 -2.06 0.00 0.00 59.70 57.44 1ojo h MET 809 Cb 0.99 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 1ojo h MET 809 CO 0.09 0.86 -0.23 -0.84 1.06 0.00 0.00 176.91 177.85 1ojo h ILE 810 N 1.10 0.79 -0.04 -1.22 3.07 -1.37 -1.01 117.51 118.83 1ojo h ILE 810 Ca 0.26 -0.94 -0.18 0.00 1.55 0.00 0.00 64.86 65.55 1ojo h ILE 810 Cb 0.13 1.57 -0.01 0.00 -0.27 0.00 0.00 36.82 38.25 1ojo h ILE 810 CO -0.03 0.23 -0.77 0.11 -1.05 0.00 0.00 178.15 176.64 1ojo h LYS 811 N 0.00 0.29 -0.04 0.16 1.57 -1.39 -2.15 116.57 115.02 1ojo h LYS 811 Ca -0.00 -0.26 -0.09 0.00 -1.87 0.00 0.00 60.65 58.42 1ojo h LYS 811 Cb 0.55 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 1ojo h LYS 811 CO 0.03 0.93 -0.40 0.93 -0.57 0.00 0.00 179.45 180.37 1ojo h GLU 812 N 0.19 0.09 -0.40 3.15 5.08 -0.88 -2.82 114.58 118.98 1ojo h GLU 812 Ca -0.03 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1ojo h GLU 812 Cb 1.35 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1ojo h GLU 812 CO 0.12 0.48 0.00 1.28 -1.00 0.00 0.00 179.01 179.89 1ojo n LEU 813 N -4.05 2.51 -0.33 1.33 4.77 -0.47 -4.54 117.00 116.23 1ojo n LEU 813 Ca -0.02 -1.19 0.23 0.00 -0.03 0.00 0.00 56.01 55.01 1ojo n LEU 813 Cb 0.45 -0.27 0.46 0.00 -2.33 0.00 0.00 43.42 41.73 1ojo n LEU 813 CO 0.40 0.59 1.07 -0.08 -1.33 0.00 0.00 177.39 178.05 1ojo h GLU 814 N 2.92 0.24 -0.17 3.23 4.57 -1.12 -0.74 114.58 123.51 1ojo h GLU 814 Ca 0.00 -0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.06 1ojo h GLU 814 Cb 0.66 -0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 29.12 1ojo h GLU 814 CO 0.00 0.16 -0.39 0.43 -1.18 0.00 0.00 179.01 178.03 1ojo n SER 815 N -5.12 2.24 0.19 1.04 7.64 -1.26 -4.73 113.62 113.62 1ojo n SER 815 Ca 0.31 -3.86 0.05 0.00 1.01 0.00 0.00 58.87 56.38 1ojo n SER 815 Cb 0.98 -0.55 0.35 0.00 -1.01 0.00 0.00 64.21 63.97 1ojo n SER 815 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1ojo h SER 816 N 1.10 0.00 -3.22 6.43 4.64 -1.36 -3.42 113.55 117.73 1ojo h SER 816 Ca 0.10 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.85 1ojo h SER 816 Cb 1.24 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.28 1ojo h SER 816 CO 0.19 0.38 0.98 -0.22 -0.87 0.00 0.00 176.83 177.29 1ojo s LEU 817 N -7.20 3.81 -0.10 5.97 2.96 -1.26 -0.05 118.68 122.81 1ojo s LEU 817 Ca -0.00 1.08 -0.17 0.00 -0.22 0.00 0.00 54.13 54.81 1ojo s LEU 817 Cb 0.11 -3.54 -0.28 0.00 0.50 0.00 0.00 46.19 42.99 1ojo s LEU 817 CO 0.69 -1.15 0.61 0.40 -1.32 0.00 0.00 176.35 175.58 1ojo h ILE 818 N 6.06 1.12 -1.86 6.68 1.08 -1.23 -3.48 117.51 125.88 1ojo h ILE 818 Ca -0.26 -2.41 0.05 0.00 -0.39 0.00 0.00 64.86 61.85 1ojo h ILE 818 Cb 1.09 2.79 -0.20 0.00 -3.07 0.00 0.00 36.82 37.44 1ojo h ILE 818 CO 1.05 0.69 0.45 -0.70 -0.69 0.00 0.00 178.15 178.95 1ojo s GLU 819 N -2.46 0.77 -0.47 2.37 2.56 -1.03 -4.93 118.70 115.50 1ojo s GLU 819 Ca -0.19 0.05 0.06 0.00 0.00 0.00 0.00 54.97 54.89 1ojo s GLU 819 Cb 0.04 0.36 0.23 0.00 2.00 0.00 0.00 34.13 36.75 1ojo s GLU 819 CO 0.77 -0.27 0.76 -1.71 -0.56 0.00 0.00 175.26 174.25 1ojo n ASN 820 N 0.51 -2.35 -1.57 -1.70 4.05 -1.20 -0.92 115.26 112.08 1ojo n ASN 820 Ca -0.12 -3.06 0.00 0.00 0.45 0.00 0.00 54.58 51.85 1ojo n ASN 820 Cb 0.59 1.24 0.00 0.00 1.23 0.00 0.00 39.78 42.84 1ojo n ASN 820 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 1ojo n ASN 821 N 1.97 1.26 0.00 1.20 0.23 -0.19 -4.87 115.26 114.86 1ojo n ASN 821 Ca 0.14 -0.96 0.05 0.00 -0.53 0.00 0.00 54.58 53.28 1ojo n ASN 821 Cb 0.59 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 38.52 1ojo n ASN 821 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1ojo n GLU 822 N 0.00 0.04 0.00 -3.83 0.00 -1.26 -3.49 120.64 112.10 1ojo n GLU 822 Ca 0.00 0.29 0.00 0.00 0.00 0.00 0.00 57.16 57.45 1ojo n GLU 822 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 31.44 29.94 1ojo n GLU 822 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1ojo n THR 823 N -1.44 0.00 -3.79 3.84 -2.24 -1.26 -4.83 114.28 104.55 1ojo n THR 823 Ca 0.03 -0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.67 1ojo n THR 823 Cb 0.11 0.29 -0.15 0.00 -2.10 0.00 0.00 70.33 68.48 1ojo n THR 823 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1ojo s LEU 824 N -1.67 1.20 -0.04 3.22 2.96 -1.23 -0.92 118.68 122.21 1ojo s LEU 824 Ca 0.00 0.12 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 1ojo s LEU 824 Cb 0.00 0.11 0.03 0.00 0.50 0.00 0.00 46.19 46.83 1ojo s LEU 824 CO 0.00 -0.10 -0.01 -1.10 -1.32 0.00 0.00 176.35 173.82 1ojo s GLN 825 N 0.79 0.42 -0.17 1.98 -0.21 -0.74 -1.03 119.66 120.70 1ojo s GLN 825 Ca -0.06 0.06 -0.23 0.00 0.02 0.00 0.00 55.36 55.15 1ojo s GLN 825 Cb -0.09 -0.60 0.06 0.00 1.00 0.00 0.00 33.01 33.38 1ojo s GLN 825 CO -0.03 -0.15 0.60 0.45 -2.12 0.00 0.00 175.29 174.04 1ojo s SER 826 N 1.15 -0.60 0.00 5.90 0.15 -0.10 -0.36 113.70 119.85 1ojo s SER 826 Ca -0.08 1.02 0.05 0.00 0.70 0.00 0.00 55.95 57.63 1ojo s SER 826 Cb -0.13 1.01 -0.01 0.00 -1.71 0.00 0.00 66.02 65.17 1ojo s SER 826 CO -0.02 -0.32 -0.14 -0.69 1.20 0.00 0.00 173.24 173.27 1ojo s VAL 827 N -0.15 1.13 -0.10 4.45 1.01 -0.77 -0.81 120.40 125.15 1ojo s VAL 827 Ca -0.04 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1ojo s VAL 827 Cb -0.03 -0.96 -0.00 0.00 0.00 0.00 0.00 36.38 35.38 1ojo s VAL 827 CO 0.03 0.23 -0.23 -0.47 0.00 0.00 0.00 175.10 174.66 1ojo s TYR 828 N -0.48 2.59 -0.63 5.22 5.04 0.93 -1.29 117.35 128.73 1ojo s TYR 828 Ca 0.04 -1.01 -0.11 0.00 -2.44 0.00 0.00 57.07 53.55 1ojo s TYR 828 Cb -0.06 -1.73 0.16 0.00 0.35 0.00 0.00 41.96 40.68 1ojo s TYR 828 CO 0.00 -0.40 0.53 0.34 -1.34 0.00 0.00 175.55 174.68 1ojo s ASP 829 N 0.35 6.07 0.36 4.32 -1.08 0.46 -4.51 116.67 122.64 1ojo s ASP 829 Ca -0.18 -2.29 0.03 0.00 -0.52 0.00 0.00 52.55 49.59 1ojo s ASP 829 Cb -0.18 -2.09 0.66 0.00 -1.46 0.00 0.00 42.92 39.85 1ojo s ASP 829 CO 0.08 -0.64 1.98 0.00 0.52 0.00 0.00 175.17 177.12 1ojo h ALA 830 N 8.10 1.53 -0.68 3.66 0.00 -1.92 0.37 119.26 130.32 1ojo h ALA 830 Ca -0.10 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.67 1ojo h ALA 830 Cb 1.05 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1ojo h ALA 830 CO 0.84 0.40 0.16 -0.22 0.00 0.00 0.00 179.25 180.43 1ojo h LYS 831 N 0.73 1.08 0.00 0.00 3.64 -1.95 -3.08 116.57 116.99 1ojo h LYS 831 Ca 0.19 -0.25 -0.19 0.00 -1.27 0.00 0.00 60.65 59.13 1ojo h LYS 831 Cb 0.01 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1ojo h LYS 831 CO -0.03 0.95 -1.37 1.96 -2.27 0.00 0.00 179.45 178.69 1ojo h GLN 832 N 1.02 0.00 -1.54 1.90 4.20 -1.91 -3.48 115.11 115.30 1ojo h GLN 832 Ca 0.21 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.88 1ojo h GLN 832 Cb 0.36 0.00 0.02 0.00 0.30 0.00 0.00 27.48 28.16 1ojo h GLN 832 CO 0.00 0.37 -0.08 0.41 -0.67 0.00 0.00 178.83 178.86 1ojo n GLY 833 N 1.41 0.78 3.19 3.46 0.00 0.12 -4.78 105.19 109.37 1ojo n GLY 833 Ca -0.10 -0.57 -0.28 0.00 0.00 0.00 0.00 46.02 45.07 1ojo n GLY 833 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ojo s VAL 834 N -3.02 1.64 -0.04 1.61 1.01 -0.88 -1.02 120.40 119.70 1ojo s VAL 834 Ca 0.07 -0.85 0.05 0.00 0.00 0.00 0.00 61.98 61.25 1ojo s VAL 834 Cb -0.03 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1ojo s VAL 834 CO 0.08 0.46 -0.20 0.26 0.00 0.00 0.00 175.10 175.71 1ojo s TRP 835 N -0.18 2.54 -0.12 5.22 0.51 0.11 -0.41 118.94 126.62 1ojo s TRP 835 Ca 0.00 -0.33 0.00 0.00 -2.12 0.00 0.00 56.10 53.65 1ojo s TRP 835 Cb -0.11 -1.59 -0.02 0.00 -0.81 0.00 0.00 33.47 30.95 1ojo s TRP 835 CO 0.02 0.05 -0.13 0.20 -0.51 0.00 0.00 176.95 176.57 1ojo s GLY 836 N -0.59 1.54 -0.04 0.98 0.00 -0.41 -0.55 107.32 108.25 1ojo s GLY 836 Ca 0.09 -0.90 -0.02 0.00 0.00 0.00 0.00 44.72 43.89 1ojo s GLY 836 CO 0.00 -0.25 0.09 -0.42 0.00 0.00 0.00 173.10 172.52 1ojo s ILE 837 N 0.24 -0.03 -0.13 0.90 1.01 0.04 -1.85 121.20 121.38 1ojo s ILE 837 Ca -0.09 0.10 0.01 0.00 0.00 0.00 0.00 60.65 60.67 1ojo s ILE 837 Cb -0.15 -0.14 0.02 0.00 0.01 0.00 0.00 42.46 42.19 1ojo s ILE 837 CO 0.05 0.04 -0.16 -0.69 0.00 0.00 0.00 174.94 174.19 1ojo s VAL 838 N 0.60 1.60 -0.15 2.92 1.01 0.51 0.31 120.40 127.20 1ojo s VAL 838 Ca -0.05 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.25 1ojo s VAL 838 Cb -0.06 -1.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 1ojo s VAL 838 CO -0.02 0.46 -0.13 -0.54 0.00 0.00 0.00 175.10 174.86 1ojo s LYS 839 N 1.17 3.31 0.00 2.72 1.02 -0.04 -1.79 119.74 126.13 1ojo s LYS 839 Ca -0.02 -0.71 0.25 0.00 0.02 0.00 0.00 55.97 55.51 1ojo s LYS 839 Cb -0.14 -2.66 0.46 0.00 -0.52 0.00 0.00 37.83 34.97 1ojo s LYS 839 CO -0.05 0.10 1.38 0.66 -0.92 0.00 0.00 175.35 176.51 1ojo n TYR 840 N 3.85 0.00 -4.17 3.18 4.02 -0.09 -0.46 117.16 123.48 1ojo n TYR 840 Ca -0.19 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.56 1ojo n TYR 840 Cb 0.52 -0.11 -0.07 0.00 -0.02 0.00 0.00 39.34 39.66 1ojo n TYR 840 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 1ojo s ASP 841 N -2.63 0.79 -0.24 7.72 1.47 -1.26 -4.89 116.67 117.62 1ojo s ASP 841 Ca 0.19 -1.47 0.05 0.00 1.18 0.00 0.00 52.55 52.50 1ojo s ASP 841 Cb 0.18 0.53 0.48 0.00 -0.34 0.00 0.00 42.92 43.78 1ojo s ASP 841 CO 0.60 -1.06 1.50 0.47 0.68 0.00 0.00 175.17 177.35 1ojo n ASP 842 N -0.97 3.75 -4.79 2.11 8.00 -1.26 -2.82 116.55 120.58 1ojo n ASP 842 Ca 0.03 -2.89 -0.30 0.00 0.71 0.00 0.00 54.79 52.34 1ojo n ASP 842 Cb 0.63 -0.69 0.09 0.00 -0.02 0.00 0.00 41.12 41.14 1ojo n ASP 842 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1ojo s SER 843 N -0.51 4.51 -0.29 -2.24 1.04 -1.26 -4.72 113.70 110.22 1ojo s SER 843 Ca 0.37 1.50 -0.26 0.00 0.48 0.00 0.00 55.95 58.04 1ojo s SER 843 Cb 0.30 -2.25 0.01 0.00 0.10 0.00 0.00 66.02 64.17 1ojo s SER 843 CO 0.09 -1.98 0.91 -0.69 0.98 0.00 0.00 173.24 172.54 1ojo s VAL 844 N -3.04 4.70 -0.24 5.02 1.01 -1.26 -4.57 120.40 122.01 1ojo s VAL 844 Ca 0.61 1.51 -0.06 0.00 0.00 0.00 0.00 61.98 64.03 1ojo s VAL 844 Cb -0.15 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.97 1ojo s VAL 844 CO 0.55 -0.29 0.03 -0.44 0.00 0.00 0.00 175.10 174.96 1ojo s SER 845 N 1.54 4.83 -0.22 3.32 0.01 -0.60 -4.98 113.70 117.60 1ojo s SER 845 Ca 0.38 -0.34 -0.17 0.00 1.31 0.00 0.00 55.95 57.13 1ojo s SER 845 Cb -0.14 -1.85 -0.04 0.00 0.21 0.00 0.00 66.02 64.21 1ojo s SER 845 CO 0.12 -0.05 0.44 -0.89 0.41 0.00 0.00 173.24 173.27 1ojo s THR 846 N 1.55 5.16 -0.19 1.44 2.01 -1.26 -0.96 115.64 123.39 1ojo s THR 846 Ca 0.06 0.77 -0.04 0.00 0.31 0.00 0.00 61.69 62.79 1ojo s THR 846 Cb -0.15 -3.76 -0.02 0.00 0.01 0.00 0.00 72.50 68.57 1ojo s THR 846 CO 0.01 0.20 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.48 1ojo s ILE 847 N 1.61 3.74 -0.81 1.82 -1.09 0.10 -4.64 121.20 121.93 1ojo s ILE 847 Ca 0.20 -0.39 -0.01 0.00 -2.23 0.00 0.00 60.65 58.22 1ojo s ILE 847 Cb -0.15 -2.67 0.01 0.00 -1.58 0.00 0.00 42.46 38.07 1ojo s ILE 847 CO 0.09 0.45 0.07 -1.20 -1.23 0.00 0.00 174.94 173.11 1ojo n SER 848 N 4.17 -3.08 -3.13 3.58 7.64 -1.26 -1.01 113.62 120.53 1ojo n SER 848 Ca -0.17 0.19 -0.20 0.00 1.01 0.00 0.00 58.87 59.69 1ojo n SER 848 Cb 0.52 -2.65 -0.00 0.00 -1.01 0.00 0.00 64.21 61.06 1ojo n SER 848 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1ojo n ASN 849 N -1.79 -3.76 0.00 6.43 5.15 -1.26 -4.77 115.26 115.26 1ojo n ASN 849 Ca -0.09 -0.23 0.00 0.00 -0.60 0.00 0.00 54.58 53.66 1ojo n ASN 849 Cb 0.57 -3.13 0.00 0.00 -0.53 0.00 0.00 39.78 36.69 1ojo n ASN 849 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ojo n GLN 850 N -3.51 1.14 -3.94 1.20 6.02 -0.18 -4.98 117.38 113.13 1ojo n GLN 850 Ca -0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.85 1ojo n GLN 850 Cb 0.56 -0.87 -0.03 0.00 1.02 0.00 0.00 30.24 30.92 1ojo n GLN 850 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 1ojo s PHE 851 N -1.75 0.31 0.00 1.08 -0.12 -1.11 -2.22 117.98 114.17 1ojo s PHE 851 Ca 0.00 -0.74 0.05 0.00 -0.05 0.00 0.00 56.93 56.19 1ojo s PHE 851 Cb 0.00 0.39 -0.01 0.00 -0.63 0.00 0.00 43.02 42.77 1ojo s PHE 851 CO 0.00 -1.20 -0.15 -0.65 -0.05 0.00 0.00 175.22 173.18 1ojo s GLN 852 N -3.47 1.15 -0.10 1.99 -0.21 0.14 0.02 119.66 119.18 1ojo s GLN 852 Ca 0.20 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 54.99 1ojo s GLN 852 Cb -0.03 -1.13 -0.02 0.00 1.00 0.00 0.00 33.01 32.84 1ojo s GLN 852 CO 0.11 0.30 -0.15 0.14 -2.12 0.00 0.00 175.29 173.57 1ojo s VAL 853 N -0.48 2.93 -0.92 1.09 -7.23 -0.13 -0.94 120.40 114.72 1ojo s VAL 853 Ca 0.05 -0.73 0.10 0.00 -1.81 0.00 0.00 61.98 59.58 1ojo s VAL 853 Cb -0.06 -2.19 0.01 0.00 0.56 0.00 0.00 36.38 34.70 1ojo s VAL 853 CO -0.00 0.55 0.64 0.18 -0.31 0.00 0.00 175.10 176.16 1ojo n LEU 854 N 3.09 1.27 -4.09 1.32 4.77 -0.47 -1.56 117.00 121.33 1ojo n LEU 854 Ca -0.18 -0.80 -0.15 0.00 -0.03 0.00 0.00 56.01 54.85 1ojo n LEU 854 Cb 0.52 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.50 1ojo n LEU 854 CO 0.28 0.25 -0.42 -0.54 -1.33 0.00 0.00 177.39 175.64 1ojo s LYS 855 N -1.23 0.63 0.24 3.23 1.02 -1.26 -4.44 119.74 117.92 1ojo s LYS 855 Ca 0.08 -0.79 -0.31 0.00 0.02 0.00 0.00 55.97 54.97 1ojo s LYS 855 Cb 0.08 -0.49 -0.14 0.00 -0.52 0.00 0.00 37.83 36.76 1ojo s LYS 855 CO 0.22 0.10 1.35 -2.13 -0.92 0.00 0.00 175.35 173.97 1ojo n ARG 856 N 1.50 1.91 -1.82 1.68 0.63 -1.13 -4.71 116.66 114.72 1ojo n ARG 856 Ca -0.22 0.68 0.00 0.00 -0.92 0.00 0.00 57.85 57.39 1ojo n ARG 856 Cb 0.55 -2.30 0.00 0.00 0.45 0.00 0.00 32.46 31.16 1ojo n ARG 856 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1ojo n GLY 857 N 1.99 -0.04 3.31 5.14 0.00 0.39 -4.84 105.19 111.15 1ojo n GLY 857 Ca 0.11 -1.59 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 1ojo n GLY 857 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ojo s VAL 858 N -2.53 2.39 0.08 1.61 1.01 -0.08 -0.86 120.40 122.01 1ojo s VAL 858 Ca 0.00 -0.93 0.06 0.00 0.00 0.00 0.00 61.98 61.11 1ojo s VAL 858 Cb 0.00 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 1ojo s VAL 858 CO 0.00 0.56 -0.16 -0.31 0.00 0.00 0.00 175.10 175.20 1ojo s TYR 859 N -0.05 1.35 -0.09 5.22 1.51 0.15 -0.98 117.35 124.45 1ojo s TYR 859 Ca -0.06 -0.44 -0.03 0.00 -1.01 0.00 0.00 57.07 55.53 1ojo s TYR 859 Cb -0.15 -0.76 0.04 0.00 -0.11 0.00 0.00 41.96 40.99 1ojo s TYR 859 CO 0.05 0.09 0.07 0.99 -1.11 0.00 0.00 175.55 175.64 1ojo s THR 860 N -1.21 -0.11 -0.01 -0.71 2.01 -0.56 -0.78 115.64 114.28 1ojo s THR 860 Ca 0.00 0.19 0.06 0.00 0.31 0.00 0.00 61.69 62.25 1ojo s THR 860 Cb -0.10 -0.33 -0.02 0.00 0.01 0.00 0.00 72.50 72.07 1ojo s THR 860 CO 0.03 -0.01 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.13 1ojo s ILE 861 N 2.16 1.46 -0.04 1.82 1.01 0.29 -1.64 121.20 126.26 1ojo s ILE 861 Ca 0.04 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.89 1ojo s ILE 861 Cb -0.14 -1.22 -0.00 0.00 0.01 0.00 0.00 42.46 41.11 1ojo s ILE 861 CO -0.06 0.38 -0.16 -0.60 0.00 0.00 0.00 174.94 174.50 1ojo s ARG 862 N -0.53 1.74 -0.21 2.79 3.52 -0.48 0.07 118.95 125.85 1ojo s ARG 862 Ca 0.07 -0.58 -0.08 0.00 -0.13 0.00 0.00 55.73 55.01 1ojo s ARG 862 Cb -0.07 -1.51 -0.04 0.00 -1.56 0.00 0.00 34.95 31.77 1ojo s ARG 862 CO -0.00 0.22 0.10 0.21 -0.81 0.00 0.00 175.30 175.02 1ojo s LYS 863 N 0.09 3.96 -0.22 5.12 2.20 -0.19 -0.10 119.74 130.60 1ojo s LYS 863 Ca -0.05 -0.34 -0.01 0.00 -0.36 0.00 0.00 55.97 55.22 1ojo s LYS 863 Cb -0.12 -3.35 0.06 0.00 -1.51 0.00 0.00 37.83 32.92 1ojo s LYS 863 CO 0.02 0.13 0.00 -1.21 -0.36 0.00 0.00 175.35 173.93 1ojo s GLU 864 N 0.80 1.09 0.00 4.03 2.02 0.18 -4.81 118.70 122.01 1ojo s GLU 864 Ca 0.05 -0.73 0.00 0.00 0.02 0.00 0.00 54.97 54.31 1ojo s GLU 864 Cb -0.13 -2.33 0.00 0.00 0.10 0.00 0.00 34.13 31.77 1ojo s GLU 864 CO 0.02 -0.65 0.00 0.41 0.02 0.00 0.00 175.26 175.06 1ojo n GLY 865 N 4.86 0.00 3.56 -1.39 0.00 -1.26 -0.71 105.19 110.25 1ojo n GLY 865 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1ojo n GLY 865 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ojo n ASP 866 N 1.53 0.00 -4.92 1.61 8.00 -1.26 -4.87 116.55 116.64 1ojo n ASP 866 Ca 0.00 0.00 -0.28 0.00 0.71 0.00 0.00 54.79 55.22 1ojo n ASP 866 Cb 0.05 -0.78 -0.03 0.00 -0.02 0.00 0.00 41.12 40.34 1ojo n ASP 866 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1ojo s GLU 867 N -0.13 3.53 -0.10 -1.24 0.41 0.11 -5.11 118.70 116.17 1ojo s GLU 867 Ca 0.00 -0.31 -0.01 0.00 -0.41 0.00 0.00 54.97 54.24 1ojo s GLU 867 Cb 0.00 -2.84 0.03 0.00 -1.78 0.00 0.00 34.13 29.54 1ojo s GLU 867 CO 0.00 0.40 -0.03 0.71 -0.49 0.00 0.00 175.26 175.86 1ojo s TYR 868 N -1.85 1.05 -0.20 1.61 2.02 -1.26 -0.65 117.35 118.07 1ojo s TYR 868 Ca 0.39 -0.47 -0.15 0.00 -0.37 0.00 0.00 57.07 56.47 1ojo s TYR 868 Cb -0.11 -1.00 -0.04 0.00 -0.40 0.00 0.00 41.96 40.40 1ojo s TYR 868 CO 0.29 -0.43 0.34 0.21 -1.57 0.00 0.00 175.55 174.39 1ojo s LYS 869 N 1.85 4.17 -0.07 -0.62 2.20 0.86 -4.95 119.74 123.18 1ojo s LYS 869 Ca 0.04 0.11 0.04 0.00 -0.36 0.00 0.00 55.97 55.80 1ojo s LYS 869 Cb -0.13 -3.52 -0.02 0.00 -1.51 0.00 0.00 37.83 32.65 1ojo s LYS 869 CO -0.07 0.02 -0.18 0.42 -0.36 0.00 0.00 175.35 175.18 1ojo s ILE 870 N 1.15 2.65 -0.29 5.43 1.01 -1.26 -1.38 121.20 128.51 1ojo s ILE 870 Ca 0.17 -0.85 0.00 0.00 0.00 0.00 0.00 60.65 59.97 1ojo s ILE 870 Cb -0.14 -2.02 0.09 0.00 0.01 0.00 0.00 42.46 40.39 1ojo s ILE 870 CO 0.07 0.57 0.04 0.00 0.00 0.00 0.00 174.94 175.62 1ojo s ALA 871 N -0.31 1.89 -0.02 9.38 0.00 -0.65 -5.03 121.76 127.03 1ojo s ALA 871 Ca 0.02 -1.68 0.05 0.00 0.00 0.00 0.00 51.96 50.34 1ojo s ALA 871 Cb -0.13 -1.61 -0.03 0.00 0.00 0.00 0.00 23.12 21.36 1ojo s ALA 871 CO 0.02 -1.50 -0.15 -0.47 0.00 0.00 0.00 175.76 173.66 1ojo s TYR 872 N 1.43 2.65 -0.06 0.00 5.04 -1.26 -1.49 117.35 123.66 1ojo s TYR 872 Ca 0.05 -0.19 -0.02 0.00 -2.44 0.00 0.00 57.07 54.46 1ojo s TYR 872 Cb -0.18 -1.57 0.04 0.00 0.35 0.00 0.00 41.96 40.60 1ojo s TYR 872 CO -0.15 0.21 0.12 -0.47 -1.34 0.00 0.00 175.55 173.92 1ojo s TYR 873 N -0.81 -0.12 -0.50 4.97 5.04 -0.15 -4.43 117.35 121.35 1ojo s TYR 873 Ca 0.13 0.42 -0.15 0.00 -2.44 0.00 0.00 57.07 55.03 1ojo s TYR 873 Cb -0.11 -0.15 0.10 0.00 0.35 0.00 0.00 41.96 42.15 1ojo s TYR 873 CO 0.03 -0.17 0.44 1.21 -1.34 0.00 0.00 175.55 175.71 1ojo s ASN 874 N 1.34 6.12 0.51 4.32 3.04 0.63 -0.90 114.94 130.00 1ojo s ASN 874 Ca -0.07 -1.59 0.19 0.00 0.04 0.00 0.00 52.86 51.43 1ojo s ASN 874 Cb -0.12 -2.18 1.30 0.00 -1.54 0.00 0.00 41.25 38.72 1ojo s ASN 874 CO -0.05 -0.75 2.12 1.55 -3.04 0.00 0.00 177.10 176.93 1ojo h PRO 875 N 8.78 0.00 -0.12 0.43 0.13 -1.86 0.13 132.00 139.50 1ojo h PRO 875 Ca -0.28 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.62 1ojo h PRO 875 Cb 1.10 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.24 1ojo h PRO 875 CO 0.95 0.06 -0.83 0.93 -0.23 0.00 0.00 178.00 178.88 1ojo h GLU 876 N 0.00 0.74 0.00 0.86 5.08 -1.87 -3.23 114.58 116.16 1ojo h GLU 876 Ca -0.00 -0.64 0.00 0.00 -1.00 0.00 0.00 59.36 57.72 1ojo h GLU 876 Cb 0.11 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1ojo h GLU 876 CO 0.01 1.25 -0.80 0.25 -1.00 0.00 0.00 179.01 178.71 1ojo n THR 877 N -3.91 0.02 -3.55 1.13 -2.24 -1.18 -4.97 114.28 99.58 1ojo n THR 877 Ca -0.08 -0.03 -0.20 0.00 -2.27 0.00 0.00 64.05 61.47 1ojo n THR 877 Cb 0.77 0.60 0.07 0.00 -2.10 0.00 0.00 70.33 69.68 1ojo n THR 877 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ojo n GLN 878 N -1.55 -6.57 -4.01 -0.78 6.02 0.44 -5.01 117.38 105.92 1ojo n GLN 878 Ca 0.04 0.79 -0.08 0.00 -0.01 0.00 0.00 57.00 57.74 1ojo n GLN 878 Cb 0.34 -5.73 -0.10 0.00 1.02 0.00 0.00 30.24 25.78 1ojo n GLN 878 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1ojo s GLU 879 N -5.78 0.50 0.00 -1.09 2.02 -1.01 -4.98 118.70 108.36 1ojo s GLU 879 Ca 0.18 -0.89 0.00 0.00 0.02 0.00 0.00 54.97 54.28 1ojo s GLU 879 Cb -0.08 0.18 0.00 0.00 0.10 0.00 0.00 34.13 34.33 1ojo s GLU 879 CO 0.75 -0.10 0.00 0.45 0.02 0.00 0.00 175.26 176.38 1ojo n SER 880 N 0.79 0.00 -3.53 -0.19 2.88 -1.26 -0.27 113.62 112.04 1ojo n SER 880 Ca -0.19 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.26 1ojo n SER 880 Cb 0.58 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 64.01 1ojo n SER 880 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ojo s ALA 881 N -2.98 -1.88 0.38 -1.46 0.00 -1.26 -4.78 121.76 109.78 1ojo s ALA 881 Ca 0.00 1.25 -0.27 0.00 0.00 0.00 0.00 51.96 52.94 1ojo s ALA 881 Cb 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 23.12 23.02 1ojo s ALA 881 CO 0.00 -0.55 1.32 -2.30 0.00 0.00 0.00 175.76 174.23 1ojo n PRO 882 N 0.10 2.16 -0.25 0.00 -0.02 -1.26 -4.89 135.00 130.85 1ojo n PRO 882 Ca -0.09 0.76 0.05 0.00 -2.02 0.00 0.00 63.50 62.21 1ojo n PRO 882 Cb 0.60 -2.42 0.18 0.00 -0.02 0.00 0.00 33.50 31.84 1ojo n PRO 882 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1ojo h ASP 883 N 2.46 0.01 0.42 2.55 3.32 -1.99 -1.58 116.42 121.61 1ojo h ASP 883 Ca -0.48 0.15 0.00 0.00 0.02 0.00 0.00 57.03 56.72 1ojo h ASP 883 Cb 1.28 0.20 0.00 0.00 0.22 0.00 0.00 39.33 41.02 1ojo h ASP 883 CO 0.62 -0.04 0.00 0.06 -1.72 0.00 0.00 179.24 178.16 1ojo h GLN 884 N 0.27 0.00 0.00 3.56 -0.00 -1.90 0.11 115.11 117.14 1ojo h GLN 884 Ca 0.41 0.00 -0.14 0.00 -0.00 0.00 0.00 58.65 58.92 1ojo h GLN 884 Cb 0.70 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.16 1ojo h GLN 884 CO -0.51 0.00 -0.76 0.93 -0.00 0.00 0.00 178.83 178.50 1ojo h GLU 885 N 0.00 0.00 0.00 0.06 5.08 -1.64 -3.39 114.58 114.69 1ojo h GLU 885 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ojo h GLU 885 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1ojo h GLU 885 CO 0.00 0.58 0.00 1.33 -1.00 0.00 0.00 179.01 179.92 1ojo n VAL 886 N -3.20 0.00 -4.06 3.13 0.24 -0.87 -4.61 118.33 108.97 1ojo n VAL 886 Ca -0.00 -0.41 -0.13 0.00 -2.04 0.00 0.00 64.34 61.75 1ojo n VAL 886 Cb 0.80 1.04 -0.13 0.00 -1.47 0.00 0.00 33.84 34.08 1ojo n VAL 886 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1ojo s PHE 887 N -0.66 0.41 -0.18 6.34 5.36 0.31 -1.37 117.98 128.20 1ojo s PHE 887 Ca 0.00 -0.24 -0.07 0.00 -0.96 0.00 0.00 56.93 55.66 1ojo s PHE 887 Cb 0.00 -0.26 0.08 0.00 -0.34 0.00 0.00 43.02 42.50 1ojo s PHE 887 CO 0.00 -0.05 0.39 0.21 -1.46 0.00 0.00 175.22 174.31 1ojo s LYS 888 N -0.68 0.29 0.29 10.12 2.20 -0.11 -4.40 119.74 127.45 1ojo s LYS 888 Ca -0.04 0.96 -0.28 0.00 -0.36 0.00 0.00 55.97 56.25 1ojo s LYS 888 Cb -0.05 0.24 -0.09 0.00 -1.51 0.00 0.00 37.83 36.41 1ojo s LYS 888 CO -0.00 -0.25 0.98 0.21 -0.36 0.00 0.00 175.35 175.93 1ojo s LYS 889 N 2.48 4.67 0.32 4.03 2.20 -1.26 0.25 119.74 132.43 1ojo s LYS 889 Ca -0.02 1.49 -0.27 0.00 -0.36 0.00 0.00 55.97 56.81 1ojo s LYS 889 Cb -0.12 -3.04 -0.09 0.00 -1.51 0.00 0.00 37.83 33.07 1ojo s LYS 889 CO -0.12 0.33 1.01 -0.51 -0.36 0.00 0.00 175.35 175.70 1ojo s LEU 890 N -1.64 4.39 0.00 5.43 1.43 -0.94 -4.90 118.68 122.45 1ojo s LEU 890 Ca 0.46 2.01 0.00 0.00 -1.03 0.00 0.00 54.13 55.58 1ojo s LEU 890 Cb -0.24 -3.90 0.00 0.00 0.03 0.00 0.00 46.19 42.08 1ojo s LEU 890 CO 0.30 -0.16 0.00 -0.62 0.23 0.00 0.00 176.35 176.10