#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w3y s LYS 171 N 0.00 4.46 0.00 5.55 2.20 -1.26 -4.75 119.74 125.94 1w3y s LYS 171 Ca 0.00 1.23 0.00 0.00 -0.36 0.00 0.00 55.97 56.84 1w3y s LYS 171 Cb 0.00 -3.49 0.00 0.00 -1.51 0.00 0.00 37.83 32.83 1w3y s LYS 171 CO 0.00 -0.13 0.00 -0.40 -0.36 0.00 0.00 175.35 174.46 1w3y n ASP 172 N 4.33 0.00 0.24 1.43 3.85 -1.26 -5.00 116.55 120.13 1w3y n ASP 172 Ca 0.05 -0.82 0.07 0.00 -0.71 0.00 0.00 54.79 53.38 1w3y n ASP 172 Cb 0.50 0.00 0.56 0.00 -1.35 0.00 0.00 41.12 40.84 1w3y n ASP 172 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.20 176.90 1w3y h THR 173 N 0.82 1.01 -0.24 2.12 1.35 -1.99 -1.54 112.91 114.44 1w3y h THR 173 Ca 0.00 -0.55 -0.04 0.00 -0.55 0.00 0.00 66.41 65.27 1w3y h THR 173 Cb 0.00 1.30 -0.01 0.00 -1.73 0.00 0.00 68.15 67.72 1w3y h THR 173 CO 0.00 0.15 -0.02 1.88 -0.25 0.00 0.00 175.52 177.28 1w3y h TYR 174 N 0.00 0.49 0.00 4.73 0.05 -1.95 -2.21 116.97 118.08 1w3y h TYR 174 Ca -0.00 -0.09 -0.07 0.00 0.05 0.00 0.00 58.73 58.62 1w3y h TYR 174 Cb 0.29 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.90 1w3y h TYR 174 CO 0.00 0.63 -0.33 1.79 -1.05 0.00 0.00 178.16 179.20 1w3y h THR 175 N 0.20 1.10 -0.73 -2.88 1.35 -1.75 -1.22 112.91 108.97 1w3y h THR 175 Ca 0.06 -1.19 -0.06 0.00 -0.55 0.00 0.00 66.41 64.67 1w3y h THR 175 Cb 0.46 1.67 -0.03 0.00 -1.73 0.00 0.00 68.15 68.51 1w3y h THR 175 CO 0.02 0.32 0.20 0.44 -0.25 0.00 0.00 175.52 176.26 1w3y h ASP 176 N 0.00 1.08 -0.05 5.36 3.45 -1.02 0.55 116.42 125.80 1w3y h ASP 176 Ca -0.00 -0.22 -0.15 0.00 0.43 0.00 0.00 57.03 57.08 1w3y h ASP 176 Cb 0.64 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.12 1w3y h ASP 176 CO 0.04 1.02 -0.50 0.03 -1.57 0.00 0.00 179.24 178.27 1w3y h ARG 177 N 1.10 0.61 -0.06 3.56 2.47 -0.78 -2.61 114.38 118.67 1w3y h ARG 177 Ca 0.23 -0.36 -0.09 0.00 -1.26 0.00 0.00 59.98 58.50 1w3y h ARG 177 Cb 0.34 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.68 1w3y h ARG 177 CO -0.00 0.96 -0.39 -0.07 0.56 0.00 0.00 179.97 181.04 1w3y h LEU 178 N 0.48 0.12 -0.60 3.04 3.38 -0.77 -0.66 115.31 120.30 1w3y h LEU 178 Ca 0.02 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 1w3y h LEU 178 Cb 1.03 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1w3y h LEU 178 CO 0.10 0.50 0.07 0.44 0.09 0.00 0.00 178.44 179.64 1w3y h ASP 179 N 0.10 0.97 -0.64 -0.43 3.32 -0.66 0.11 116.42 119.19 1w3y h ASP 179 Ca 0.01 -0.27 -0.08 0.00 0.02 0.00 0.00 57.03 56.71 1w3y h ASP 179 Cb 0.73 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.00 1w3y h ASP 179 CO 0.05 1.00 0.09 0.44 -1.72 0.00 0.00 179.24 179.11 1w3y h ASP 180 N 0.91 1.03 -0.63 6.45 3.32 -1.06 -1.94 116.42 124.50 1w3y h ASP 180 Ca 0.18 -0.25 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1w3y h ASP 180 Cb 0.46 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.70 1w3y h ASP 180 CO 0.02 1.03 0.28 -0.25 -1.72 0.00 0.00 179.24 178.60 1w3y h TRP 181 N 1.01 0.93 -0.42 4.55 -0.00 -0.73 -2.26 115.95 119.03 1w3y h TRP 181 Ca 0.20 -0.06 -0.03 0.00 -0.00 0.00 0.00 58.89 59.00 1w3y h TRP 181 Cb 0.45 -0.28 -0.02 0.00 -0.00 0.00 0.00 29.16 29.30 1w3y h TRP 181 CO 0.03 0.71 0.15 -0.91 -0.00 0.00 0.00 178.44 178.42 1w3y h ASN 182 N 0.87 0.55 0.86 2.65 2.35 -0.66 0.23 115.58 122.43 1w3y h ASN 182 Ca 0.21 -0.07 -0.01 0.00 -0.55 0.00 0.00 56.30 55.88 1w3y h ASN 182 Cb 0.15 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.38 1w3y h ASN 182 CO -0.02 0.52 -0.07 1.23 -1.65 0.00 0.00 177.43 177.44 1w3y h GLY 183 N 0.78 0.00 0.23 2.83 0.00 -0.79 -1.30 103.07 104.82 1w3y h GLY 183 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.19 1w3y h GLY 183 CO -0.01 0.00 -1.53 -2.22 0.00 0.00 0.00 176.54 172.78 1w3y h ILE 184 N 0.00 0.81 0.00 2.60 2.04 -0.76 -3.06 117.51 119.14 1w3y h ILE 184 Ca -0.00 -2.24 0.00 0.00 1.00 0.00 0.00 64.86 63.62 1w3y h ILE 184 Cb 0.52 2.32 0.00 0.00 -0.74 0.00 0.00 36.82 38.92 1w3y h ILE 184 CO 0.01 0.52 -0.03 0.16 0.00 0.00 0.00 178.15 178.82 1w3y h ILE 185 N -0.61 0.00 0.00 -0.67 3.07 -1.03 -3.42 117.51 114.84 1w3y h ILE 185 Ca -0.38 -0.54 0.00 0.00 1.55 0.00 0.00 64.86 65.49 1w3y h ILE 185 Cb 1.57 1.53 0.00 0.00 -0.27 0.00 0.00 36.82 39.65 1w3y h ILE 185 CO -0.10 0.00 -0.12 0.00 -1.05 0.00 0.00 178.15 176.88 1w3y n ALA 186 N -1.83 3.00 -2.01 0.16 0.00 -0.83 -4.85 120.51 114.15 1w3y n ALA 186 Ca 0.05 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.44 1w3y n ALA 186 Cb 0.44 0.08 -0.00 0.00 0.00 0.00 0.00 19.45 19.97 1w3y n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1w3y n GLY 187 N 1.82 0.21 0.41 0.00 0.00 -0.55 -2.07 105.19 105.01 1w3y n GLY 187 Ca 0.00 -0.69 0.23 0.00 0.00 0.00 0.00 46.02 45.56 1w3y n GLY 187 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1w3y h ASN 188 N 0.00 0.00 0.49 1.61 2.35 -1.86 0.17 115.58 118.34 1w3y h ASN 188 Ca -0.12 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1w3y h ASN 188 Cb 1.02 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.39 1w3y h ASN 188 CO 0.14 0.00 -0.02 0.06 -1.65 0.00 0.00 177.43 175.96 1w3y h GLN 189 N 0.00 0.00 -0.02 0.81 3.07 -1.93 -2.20 115.11 114.85 1w3y h GLN 189 Ca 0.30 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.04 1w3y h GLN 189 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.82 1w3y h GLN 189 CO -0.00 0.02 -0.33 0.66 0.09 0.00 0.00 178.83 179.27 1w3y n TYR 190 N -3.18 0.00 -1.79 0.06 4.01 0.57 -4.99 117.16 111.85 1w3y n TYR 190 Ca -0.01 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.32 1w3y n TYR 190 Cb 0.20 -0.02 -0.00 0.00 -0.31 0.00 0.00 39.34 39.20 1w3y n TYR 190 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1w3y s TYR 191 N -2.38 2.60 -0.17 -0.72 5.04 -0.83 -4.99 117.35 115.90 1w3y s TYR 191 Ca 0.22 1.10 -0.05 0.00 -2.44 0.00 0.00 57.07 55.90 1w3y s TYR 191 Cb 0.19 -4.04 0.06 0.00 0.35 0.00 0.00 41.96 38.52 1w3y s TYR 191 CO 0.51 -3.12 0.11 0.34 -1.34 0.00 0.00 175.55 172.04 1w3y s ASP 192 N -0.03 2.23 0.59 4.32 -1.08 -1.26 -5.02 116.67 116.41 1w3y s ASP 192 Ca 0.55 -0.57 0.29 0.00 -0.52 0.00 0.00 52.55 52.30 1w3y s ASP 192 Cb -0.47 -0.16 1.74 0.00 -1.46 0.00 0.00 42.92 42.56 1w3y s ASP 192 CO 0.61 -0.35 2.18 0.77 0.52 0.00 0.00 175.17 178.90 1w3y h SER 193 N 8.41 0.00 0.43 -0.34 4.64 -1.98 0.50 113.55 125.21 1w3y h SER 193 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1w3y h SER 193 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1w3y h SER 193 CO 0.29 0.00 -0.09 0.29 -0.87 0.00 0.00 176.83 176.45 1w3y n LYS 194 N -3.84 0.59 -2.98 4.77 5.02 -1.26 -4.69 118.16 115.78 1w3y n LYS 194 Ca -0.01 -0.16 -0.43 0.00 -2.02 0.00 0.00 58.31 55.70 1w3y n LYS 194 Cb 0.20 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.65 1w3y n LYS 194 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1w3y s ASN 195 N -2.51 6.39 0.17 4.39 3.84 0.17 -4.96 114.94 122.41 1w3y s ASN 195 Ca 0.28 -0.18 -0.18 0.00 0.21 0.00 0.00 52.86 52.99 1w3y s ASN 195 Cb 0.20 -2.38 0.09 0.00 -0.55 0.00 0.00 41.25 38.62 1w3y s ASN 195 CO 0.48 -0.92 1.66 -0.78 -2.79 0.00 0.00 177.10 174.75 1w3y h ASP 196 N 8.99 -0.46 -0.55 -4.21 3.58 -1.84 -0.25 116.42 121.67 1w3y h ASP 196 Ca -0.25 0.13 -0.08 0.00 0.42 0.00 0.00 57.03 57.25 1w3y h ASP 196 Cb 1.09 0.28 -0.02 0.00 1.72 0.00 0.00 39.33 42.39 1w3y h ASP 196 CO 0.96 -0.17 0.04 1.56 -2.88 0.00 0.00 179.24 178.76 1w3y h GLN 197 N -0.05 0.98 -0.38 0.28 1.08 -1.95 -2.30 115.11 112.77 1w3y h GLN 197 Ca 0.19 -0.27 -0.09 0.00 -1.45 0.00 0.00 58.65 57.03 1w3y h GLN 197 Cb 0.34 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.65 1w3y h GLN 197 CO -0.43 0.94 -0.12 0.52 -0.95 0.00 0.00 178.83 178.79 1w3y h MET 198 N 0.91 0.74 -0.22 1.46 2.86 -1.78 -2.82 114.93 116.09 1w3y h MET 198 Ca 0.18 -0.30 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1w3y h MET 198 Cb 0.47 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 1w3y h MET 198 CO 0.02 0.90 0.12 0.00 1.06 0.00 0.00 176.91 179.01 1w3y h ALA 199 N 0.82 1.79 -0.44 6.32 0.00 -0.91 -0.70 119.26 126.14 1w3y h ALA 199 Ca 0.09 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1w3y h ALA 199 Cb 0.64 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 1w3y h ALA 199 CO 0.04 0.18 0.01 -0.22 0.00 0.00 0.00 179.25 179.27 1w3y h LYS 200 N 0.30 0.76 -0.40 0.00 3.64 -1.19 -0.52 116.57 119.17 1w3y h LYS 200 Ca 0.08 -0.23 -0.13 0.00 -1.27 0.00 0.00 60.65 59.10 1w3y h LYS 200 Cb 0.02 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 1w3y h LYS 200 CO -0.01 0.82 -0.24 1.25 -2.27 0.00 0.00 179.45 179.00 1w3y h LEU 201 N 0.61 0.90 -0.67 5.20 5.85 -1.13 -2.11 115.31 123.96 1w3y h LEU 201 Ca 0.13 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.45 1w3y h LEU 201 Cb 0.47 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1w3y h LEU 201 CO 0.02 1.13 0.42 -1.13 -0.34 0.00 0.00 178.44 178.54 1w3y h ASN 202 N 0.68 0.70 -0.71 1.25 -0.00 -1.02 -1.03 115.58 115.46 1w3y h ASN 202 Ca 0.08 -0.00 -0.01 0.00 -0.00 0.00 0.00 56.30 56.37 1w3y h ASN 202 Cb 0.81 -0.15 -0.03 0.00 -0.00 0.00 0.00 38.32 38.94 1w3y h ASN 202 CO 0.07 0.49 0.40 -0.61 -0.00 0.00 0.00 177.43 177.78 1w3y h GLN 203 N 0.83 0.99 -0.33 6.67 4.15 -0.91 0.74 115.11 127.26 1w3y h GLN 203 Ca 0.27 -0.10 -0.02 0.00 0.77 0.00 0.00 58.65 59.56 1w3y h GLN 203 Cb 0.00 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.48 1w3y h GLN 203 CO -0.10 0.72 0.12 1.49 -1.93 0.00 0.00 178.83 179.13 1w3y h GLU 204 N 1.00 0.50 -0.37 1.69 4.81 -0.61 -1.77 114.58 119.84 1w3y h GLU 204 Ca 0.26 -0.10 -0.10 0.00 -0.13 0.00 0.00 59.36 59.29 1w3y h GLU 204 Cb 0.01 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.30 1w3y h GLU 204 CO -0.04 0.51 -0.17 -0.07 -0.73 0.00 0.00 179.01 178.51 1w3y h LEU 205 N 0.39 0.69 -0.47 1.64 3.38 -0.65 -1.87 115.31 118.41 1w3y h LEU 205 Ca 0.11 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.86 1w3y h LEU 205 Cb 0.21 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1w3y h LEU 205 CO -0.01 0.87 0.31 -0.33 0.09 0.00 0.00 178.44 179.37 1w3y h GLU 206 N 0.61 0.62 -0.70 1.13 4.39 -0.65 -1.28 114.58 118.71 1w3y h GLU 206 Ca 0.10 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.71 1w3y h GLU 206 Cb 0.64 -0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 29.12 1w3y h GLU 206 CO 0.05 0.41 0.24 0.78 -1.16 0.00 0.00 179.01 179.32 1w3y h GLY 207 N 0.64 1.15 1.02 -3.84 0.00 -1.07 -0.76 103.07 100.21 1w3y h GLY 207 Ca 0.17 -0.66 -0.06 0.00 0.00 0.00 0.00 47.33 46.78 1w3y h GLY 207 CO -0.04 0.62 0.13 0.50 0.00 0.00 0.00 176.54 177.75 1w3y h LYS 208 N 1.01 0.96 -0.38 4.80 1.57 -1.05 -1.02 116.57 122.45 1w3y h LYS 208 Ca 0.23 -0.24 -0.12 0.00 -1.87 0.00 0.00 60.65 58.65 1w3y h LYS 208 Cb 0.27 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1w3y h LYS 208 CO -0.01 0.89 -0.22 0.28 -0.57 0.00 0.00 179.45 179.82 1w3y h VAL 209 N 0.86 1.28 -0.73 0.50 2.07 -1.06 -1.89 116.25 117.28 1w3y h VAL 209 Ca 0.18 -1.37 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 1w3y h VAL 209 Cb 0.37 1.33 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 1w3y h VAL 209 CO 0.01 0.46 0.46 0.00 0.02 0.00 0.00 177.57 178.51 1w3y h ALA 210 N 0.80 0.93 -0.61 1.67 0.00 -0.99 -0.24 119.26 120.81 1w3y h ALA 210 Ca 0.08 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1w3y h ALA 210 Cb 0.78 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1w3y h ALA 210 CO 0.06 0.39 0.27 -0.44 0.00 0.00 0.00 179.25 179.53 1w3y h ASP 211 N 1.00 0.82 -0.59 0.00 3.32 -1.04 -1.89 116.42 118.05 1w3y h ASP 211 Ca 0.26 -0.15 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 1w3y h ASP 211 Cb -0.06 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.25 1w3y h ASP 211 CO -0.05 0.75 0.17 0.28 -1.72 0.00 0.00 179.24 178.66 1w3y h SER 212 N 0.85 0.87 0.55 6.45 0.02 -0.90 -2.72 113.55 118.67 1w3y h SER 212 Ca 0.21 -0.22 -0.07 0.00 -0.84 0.00 0.00 61.79 60.87 1w3y h SER 212 Cb 0.16 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1w3y h SER 212 CO -0.02 0.86 -0.35 -0.07 -1.14 0.00 0.00 176.83 176.12 1w3y h LEU 213 N 0.84 0.00 0.00 5.07 3.38 -0.83 -1.55 115.31 122.22 1w3y h LEU 213 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 1w3y h LEU 213 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1w3y h LEU 213 CO -0.00 0.35 -0.50 -1.54 0.09 0.00 0.00 178.44 176.84 1w3y n SER 214 N -3.80 0.49 -0.03 -0.43 3.41 -0.73 -4.15 113.62 108.38 1w3y n SER 214 Ca -0.01 -0.17 0.02 0.00 -0.26 0.00 0.00 58.87 58.45 1w3y n SER 214 Cb 0.43 0.21 -0.01 0.00 -0.26 0.00 0.00 64.21 64.57 1w3y n SER 214 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1w3y n SER 215 N -1.57 0.37 -4.74 4.04 3.41 -1.04 -5.03 113.62 109.05 1w3y n SER 215 Ca 0.05 -0.69 -0.41 0.00 -0.26 0.00 0.00 58.87 57.56 1w3y n SER 215 Cb 0.35 0.81 -0.02 0.00 -0.26 0.00 0.00 64.21 65.09 1w3y n SER 215 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 1w3y s ILE 216 N -1.12 2.55 0.02 -1.33 2.07 -0.60 -4.74 121.20 118.05 1w3y s ILE 216 Ca 0.02 0.46 -0.30 0.00 -1.41 0.00 0.00 60.65 59.41 1w3y s ILE 216 Cb 0.03 -3.29 -0.07 0.00 0.13 0.00 0.00 42.46 39.26 1w3y s ILE 216 CO 0.12 0.07 1.52 -0.44 -1.91 0.00 0.00 174.94 174.30 1w3y s SER 217 N 0.42 6.73 -0.18 4.50 0.01 0.14 -4.89 113.70 120.43 1w3y s SER 217 Ca 0.60 2.27 0.15 0.00 1.31 0.00 0.00 55.95 60.28 1w3y s SER 217 Cb -0.43 -2.56 0.44 0.00 0.21 0.00 0.00 66.02 63.68 1w3y s SER 217 CO 0.44 -0.81 1.19 -1.54 0.41 0.00 0.00 173.24 172.93 1w3y n SER 218 N 5.67 2.20 -4.88 2.44 3.41 -1.26 -4.91 113.62 116.29 1w3y n SER 218 Ca 0.15 -3.27 -0.21 0.00 -0.26 0.00 0.00 58.87 55.28 1w3y n SER 218 Cb 0.42 -0.43 0.07 0.00 -0.26 0.00 0.00 64.21 64.00 1w3y n SER 218 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w3y s GLN 219 N -2.64 2.20 0.48 4.33 -2.07 -1.26 -5.07 119.66 115.63 1w3y s GLN 219 Ca 0.39 -1.15 -0.22 0.00 -1.82 0.00 0.00 55.36 52.56 1w3y s GLN 219 Cb 0.38 -2.50 -0.07 0.00 -1.09 0.00 0.00 33.01 29.73 1w3y s GLN 219 CO -0.07 -0.97 1.12 0.00 -1.32 0.00 0.00 175.29 174.06 1w3y s ALA 220 N -2.83 2.89 -0.28 2.60 0.00 -1.26 -4.10 121.76 118.78 1w3y s ALA 220 Ca 0.61 0.83 -0.08 0.00 0.00 0.00 0.00 51.96 53.32 1w3y s ALA 220 Cb -0.07 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.71 1w3y s ALA 220 CO 0.40 -0.59 0.27 -0.40 0.00 0.00 0.00 175.76 175.44 1w3y n ASP 221 N -0.74 -2.18 -4.85 0.00 5.75 -1.26 -4.90 116.55 108.37 1w3y n ASP 221 Ca 0.09 -0.25 -0.29 0.00 -0.01 0.00 0.00 54.79 54.32 1w3y n ASP 221 Cb 0.50 -0.68 0.10 0.00 -1.03 0.00 0.00 41.12 40.01 1w3y n ASP 221 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w3y s ARG 222 N -2.21 1.74 -0.00 0.11 1.70 -1.26 -5.01 118.95 114.02 1w3y s ARG 222 Ca 0.08 0.24 0.11 0.00 -0.47 0.00 0.00 55.73 55.70 1w3y s ARG 222 Cb -0.01 -1.91 -0.13 0.00 -0.57 0.00 0.00 34.95 32.33 1w3y s ARG 222 CO 0.38 -1.78 0.47 -0.89 -1.08 0.00 0.00 175.30 172.40 1w3y n ILE 223 N -3.47 0.00 -3.53 4.99 5.41 -1.26 -5.03 119.36 116.48 1w3y n ILE 223 Ca 0.07 -0.23 -0.10 0.00 1.00 0.00 0.00 62.75 63.49 1w3y n ILE 223 Cb 0.60 0.93 -0.03 0.00 -0.71 0.00 0.00 39.64 40.43 1w3y n ILE 223 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1w3y s TYR 224 N -2.15 -0.37 -0.03 1.39 -0.85 -1.26 -5.02 117.35 109.05 1w3y s TYR 224 Ca 0.04 0.41 -0.17 0.00 -0.52 0.00 0.00 57.07 56.82 1w3y s TYR 224 Cb 0.09 0.50 -0.32 0.00 0.38 0.00 0.00 41.96 42.61 1w3y s TYR 224 CO 0.47 -0.48 0.83 -0.07 -1.52 0.00 0.00 175.55 174.78 1w3y h LEU 225 N 2.25 0.59 -7.76 -3.49 3.38 -1.91 -3.41 115.31 104.97 1w3y h LEU 225 Ca -0.21 -0.92 -0.42 0.00 0.09 0.00 0.00 57.88 56.42 1w3y h LEU 225 Cb 1.21 -0.19 -0.34 0.00 0.09 0.00 0.00 40.66 41.43 1w3y h LEU 225 CO 0.31 1.59 -0.78 0.26 0.09 0.00 0.00 178.44 179.92 1w3y s TRP 226 N -2.51 0.81 0.37 1.13 0.51 -1.26 -0.68 118.94 117.31 1w3y s TRP 226 Ca -0.14 -0.24 0.04 0.00 -2.12 0.00 0.00 56.10 53.65 1w3y s TRP 226 Cb 0.03 -0.70 0.73 0.00 -0.81 0.00 0.00 33.47 32.72 1w3y s TRP 226 CO 0.86 -0.20 2.02 1.49 -0.51 0.00 0.00 176.95 180.61 1w3y h GLU 227 N 7.15 0.68 0.00 4.98 4.22 -1.88 -1.40 114.58 128.33 1w3y h GLU 227 Ca -0.37 -0.05 -0.01 0.00 0.08 0.00 0.00 59.36 59.01 1w3y h GLU 227 Cb 1.16 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1w3y h GLU 227 CO 0.47 0.47 -0.03 -0.22 -2.18 0.00 0.00 179.01 177.52 1w3y h LYS 228 N 0.69 0.00 -1.75 1.92 3.64 -1.97 -2.83 116.57 116.27 1w3y h LYS 228 Ca 0.18 0.00 -0.49 0.00 -1.27 0.00 0.00 60.65 59.07 1w3y h LYS 228 Cb -0.04 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 31.37 1w3y h LYS 228 CO -0.04 0.03 -0.99 1.19 -2.27 0.00 0.00 179.45 177.38 1w3y n PHE 229 N -3.72 1.86 -0.03 1.91 3.72 -0.58 -4.90 117.46 115.72 1w3y n PHE 229 Ca -0.03 -3.50 -0.12 0.00 -0.05 0.00 0.00 57.45 53.75 1w3y n PHE 229 Cb 0.12 -0.37 -0.14 0.00 -0.94 0.00 0.00 39.48 38.15 1w3y n PHE 229 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1w3y n SER 230 N -0.05 1.12 -4.55 4.37 3.41 -0.91 -4.61 113.62 112.40 1w3y n SER 230 Ca 0.25 0.29 -0.41 0.00 -0.26 0.00 0.00 58.87 58.74 1w3y n SER 230 Cb 0.63 -0.15 -0.03 0.00 -0.26 0.00 0.00 64.21 64.41 1w3y n SER 230 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1w3y s ASN 231 N -6.27 6.30 0.00 4.04 2.47 -1.26 -4.83 114.94 115.39 1w3y s ASN 231 Ca -0.11 -0.87 0.01 0.00 0.42 0.00 0.00 52.86 52.31 1w3y s ASN 231 Cb 0.07 -2.56 0.04 0.00 -1.45 0.00 0.00 41.25 37.35 1w3y s ASN 231 CO 0.80 -1.70 0.72 -1.22 -3.72 0.00 0.00 177.10 171.98 1w3y n TYR 232 N 9.15 0.00 0.08 0.43 4.01 -1.26 -1.79 117.16 127.77 1w3y n TYR 232 Ca 0.15 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.88 1w3y n TYR 232 Cb 0.50 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.48 1w3y n TYR 232 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 1w3y h LYS 233 N 0.00 0.00 -5.50 -0.72 1.79 -1.90 -3.40 116.57 106.84 1w3y h LYS 233 Ca 0.00 0.00 -0.64 0.00 -2.18 0.00 0.00 60.65 57.83 1w3y h LYS 233 Cb 0.00 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 30.51 1w3y h LYS 233 CO 0.00 0.53 0.43 0.99 -1.08 0.00 0.00 179.45 180.32 1w3y s THR 234 N -2.87 4.50 0.54 -0.16 2.01 -0.74 -4.34 115.64 114.57 1w3y s THR 234 Ca 0.01 -0.11 0.32 0.00 0.31 0.00 0.00 61.69 62.21 1w3y s THR 234 Cb 0.08 -4.52 0.49 0.00 0.01 0.00 0.00 72.50 68.56 1w3y s THR 234 CO 0.79 -1.14 1.88 0.77 -0.69 0.00 0.00 174.62 176.23 1w3y h SER 235 N 9.31 0.01 -0.07 3.53 4.64 -1.78 0.01 113.55 129.19 1w3y h SER 235 Ca -0.27 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.07 1w3y h SER 235 Cb 1.08 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1w3y h SER 235 CO 1.09 0.00 0.08 0.00 -0.87 0.00 0.00 176.83 177.13 1w3y h ALA 236 N 1.54 1.64 0.00 5.18 0.00 -1.92 -1.24 119.26 124.47 1w3y h ALA 236 Ca 0.44 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.28 1w3y h ALA 236 Cb 1.74 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.52 1w3y h ALA 236 CO -0.01 -0.11 -0.28 -0.91 0.00 0.00 0.00 179.25 177.93 1w3y h ASN 237 N 0.00 0.00 0.04 0.00 -0.26 -1.26 -1.96 115.58 112.14 1w3y h ASN 237 Ca 0.03 0.00 -0.00 0.00 -0.56 0.00 0.00 56.30 55.77 1w3y h ASN 237 Cb 0.19 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 1w3y h ASN 237 CO -0.00 0.28 -0.02 -0.07 -1.06 0.00 0.00 177.43 176.57 1w3y h LEU 238 N 0.00 -0.04 -0.65 1.61 4.07 -1.38 -2.42 115.31 116.50 1w3y h LEU 238 Ca -0.00 -0.50 -0.01 0.00 0.08 0.00 0.00 57.88 57.45 1w3y h LEU 238 Cb 0.79 0.01 -0.03 0.00 1.08 0.00 0.00 40.66 42.51 1w3y h LEU 238 CO 0.04 0.49 0.37 0.74 -1.08 0.00 0.00 178.44 178.99 1w3y h THR 239 N -0.59 1.20 -0.82 0.22 2.02 -1.58 -1.70 112.91 111.65 1w3y h THR 239 Ca -0.01 -0.50 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 1w3y h THR 239 Cb 0.54 0.34 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 1w3y h THR 239 CO 0.01 0.22 0.42 0.00 0.37 0.00 0.00 175.52 176.54 1w3y h ALA 240 N 1.18 1.19 0.03 6.16 0.00 -1.41 -0.51 119.26 125.89 1w3y h ALA 240 Ca 0.23 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1w3y h ALA 240 Cb 0.03 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1w3y h ALA 240 CO -0.04 0.63 -0.01 1.15 0.00 0.00 0.00 179.25 180.98 1w3y h THR 241 N 1.16 1.19 -0.02 0.00 2.02 -1.04 -2.73 112.91 113.49 1w3y h THR 241 Ca 0.29 -0.68 -0.05 0.00 0.77 0.00 0.00 66.41 66.74 1w3y h THR 241 Cb 0.08 1.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1w3y h THR 241 CO -0.04 0.17 -0.22 1.88 0.37 0.00 0.00 175.52 177.68 1w3y h TYR 242 N -0.33 0.03 0.00 3.16 0.05 -1.17 -2.04 116.97 116.67 1w3y h TYR 242 Ca -0.00 -0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.71 1w3y h TYR 242 Cb 0.31 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.03 1w3y h TYR 242 CO 0.03 0.25 -0.32 0.00 -1.05 0.00 0.00 178.16 177.06 1w3y h ARG 243 N 0.02 0.00 -0.11 4.88 3.08 -0.96 -1.46 114.38 119.84 1w3y h ARG 243 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.94 1w3y h ARG 243 Cb 0.41 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1w3y h ARG 243 CO 0.03 0.32 -0.45 0.87 -1.07 0.00 0.00 179.97 179.67 1w3y h LYS 244 N 0.00 0.26 -0.07 0.04 1.57 -1.06 -2.15 116.57 115.16 1w3y h LYS 244 Ca -0.00 -0.13 -0.18 0.00 -1.87 0.00 0.00 60.65 58.46 1w3y h LYS 244 Cb 0.70 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 1w3y h LYS 244 CO 0.04 0.66 -0.73 -0.07 -0.57 0.00 0.00 179.45 178.78 1w3y h LEU 245 N 0.21 0.42 -0.87 2.94 3.38 -1.24 -2.76 115.31 117.40 1w3y h LEU 245 Ca 0.01 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.63 1w3y h LEU 245 Cb 0.88 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 1w3y h LEU 245 CO 0.07 1.01 0.06 -0.08 0.09 0.00 0.00 178.44 179.59 1w3y h GLU 246 N 0.24 0.90 -0.75 1.13 4.81 -1.00 -1.25 114.58 118.66 1w3y h GLU 246 Ca -0.03 -0.23 -0.03 0.00 -0.13 0.00 0.00 59.36 58.94 1w3y h GLU 246 Cb 1.30 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 1w3y h GLU 246 CO 0.12 0.86 0.34 0.93 -0.73 0.00 0.00 179.01 180.52 1w3y h GLU 247 N 0.84 1.09 -0.78 1.92 5.08 -1.28 -1.55 114.58 119.90 1w3y h GLU 247 Ca 0.17 -0.17 -0.05 0.00 -1.00 0.00 0.00 59.36 58.31 1w3y h GLU 247 Cb 0.42 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1w3y h GLU 247 CO 0.01 0.87 0.30 0.52 -1.00 0.00 0.00 179.01 179.71 1w3y h MET 248 N 1.06 1.18 -0.70 2.33 2.86 -1.15 -2.56 114.93 117.94 1w3y h MET 248 Ca 0.25 -0.22 -0.05 0.00 -2.06 0.00 0.00 59.70 57.62 1w3y h MET 248 Cb 0.15 -0.19 -0.03 0.00 0.06 0.00 0.00 31.60 31.60 1w3y h MET 248 CO -0.03 0.96 0.24 0.00 1.06 0.00 0.00 176.91 179.15 1w3y h ALA 249 N 1.17 1.10 -0.56 6.32 0.00 -0.69 -0.08 119.26 126.51 1w3y h ALA 249 Ca 0.26 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1w3y h ALA 249 Cb 0.24 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1w3y h ALA 249 CO -0.02 0.63 0.20 0.87 0.00 0.00 0.00 179.25 180.93 1w3y h LYS 250 N 1.03 0.85 0.04 0.00 1.57 -1.00 -2.93 116.57 116.13 1w3y h LYS 250 Ca 0.23 -0.17 -0.24 0.00 -1.87 0.00 0.00 60.65 58.61 1w3y h LYS 250 Cb 0.26 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1w3y h LYS 250 CO -0.01 0.75 -1.03 1.96 -0.57 0.00 0.00 179.45 180.56 1w3y h GLN 251 N 0.77 0.33 0.00 3.15 1.08 -1.20 -3.02 115.11 116.22 1w3y h GLN 251 Ca 0.18 -0.41 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 1w3y h GLN 251 Cb 0.24 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 1w3y h GLN 251 CO -0.01 1.12 0.00 -0.24 -0.95 0.00 0.00 178.83 178.75 1w3y h VAL 252 N 0.16 0.00 -0.50 -0.54 3.04 -1.00 -2.10 116.25 115.32 1w3y h VAL 252 Ca -0.09 -0.32 0.00 0.00 -1.01 0.00 0.00 66.70 65.28 1w3y h VAL 252 Cb 1.69 1.30 0.00 0.00 -2.01 0.00 0.00 31.29 32.27 1w3y h VAL 252 CO 0.17 0.00 0.00 0.35 -1.01 0.00 0.00 177.57 177.08 1w3y n THR 253 N -3.04 1.21 -3.57 3.17 -2.24 -1.11 -0.97 114.28 107.73 1w3y n THR 253 Ca -0.01 -1.10 -0.41 0.00 -2.27 0.00 0.00 64.05 60.27 1w3y n THR 253 Cb 0.22 0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 68.73 1w3y n THR 253 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1w3y s ASN 254 N -1.06 5.77 0.56 3.42 3.04 -0.79 -4.93 114.94 120.95 1w3y s ASN 254 Ca 0.36 -1.16 0.31 0.00 0.04 0.00 0.00 52.86 52.41 1w3y s ASN 254 Cb 0.21 -2.04 1.45 0.00 -1.54 0.00 0.00 41.25 39.34 1w3y s ASN 254 CO 0.22 -0.46 1.84 -0.65 -3.04 0.00 0.00 177.10 175.01 1w3y h PRO 255 N 8.47 0.00 -0.00 0.43 0.11 -1.89 -0.17 132.00 138.94 1w3y h PRO 255 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 1w3y h PRO 255 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1w3y h PRO 255 CO 0.72 0.00 -0.42 0.43 -0.21 0.00 0.00 178.00 178.52 1w3y n SER 256 N -3.95 0.53 -4.80 -2.05 7.64 -1.26 -4.88 113.62 104.84 1w3y n SER 256 Ca 0.15 -0.28 -0.34 0.00 1.01 0.00 0.00 58.87 59.41 1w3y n SER 256 Cb 0.92 0.17 -0.05 0.00 -1.01 0.00 0.00 64.21 64.23 1w3y n SER 256 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1w3y s SER 257 N -2.92 6.74 0.21 6.43 0.15 -0.08 -4.92 113.70 119.32 1w3y s SER 257 Ca 0.13 1.83 0.22 0.00 0.70 0.00 0.00 55.95 58.83 1w3y s SER 257 Cb 0.18 -2.56 0.92 0.00 -1.71 0.00 0.00 66.02 62.85 1w3y s SER 257 CO 0.66 -0.50 1.66 -2.11 1.20 0.00 0.00 173.24 174.15 1w3y n ARG 258 N -0.57 0.16 -0.31 5.44 1.85 -1.26 -2.03 116.66 119.94 1w3y n ARG 258 Ca 0.07 0.40 0.12 0.00 -1.00 0.00 0.00 57.85 57.44 1w3y n ARG 258 Cb 0.53 -1.81 0.28 0.00 -1.05 0.00 0.00 32.46 30.41 1w3y n ARG 258 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1w3y n TYR 259 N -2.11 0.81 -1.68 2.89 4.01 -1.26 -4.88 117.16 114.93 1w3y n TYR 259 Ca 0.02 -0.41 -0.49 0.00 -0.16 0.00 0.00 57.90 56.86 1w3y n TYR 259 Cb 0.21 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.19 1w3y n TYR 259 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 1w3y n TYR 260 N 1.58 2.31 -1.98 -0.72 9.36 -0.86 -1.45 117.16 125.39 1w3y n TYR 260 Ca 0.23 0.05 -0.13 0.00 3.32 0.00 0.00 57.90 61.36 1w3y n TYR 260 Cb 0.61 -2.64 -0.03 0.00 -0.63 0.00 0.00 39.34 36.65 1w3y n TYR 260 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1w3y n GLN 261 N 6.39 -1.80 -2.00 2.98 6.02 -0.15 -4.90 117.38 123.92 1w3y n GLN 261 Ca 0.23 0.69 -0.42 0.00 -0.01 0.00 0.00 57.00 57.49 1w3y n GLN 261 Cb 0.28 -5.14 -0.03 0.00 1.02 0.00 0.00 30.24 26.37 1w3y n GLN 261 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1w3y s ASP 262 N -2.06 6.66 0.34 1.08 -1.08 -0.53 -4.92 116.67 116.16 1w3y s ASP 262 Ca 0.00 2.51 0.02 0.00 -0.52 0.00 0.00 52.55 54.56 1w3y s ASP 262 Cb 0.00 -2.59 0.60 0.00 -1.46 0.00 0.00 42.92 39.47 1w3y s ASP 262 CO 0.00 -0.78 1.98 1.05 0.52 0.00 0.00 175.17 177.94 1w3y h GLU 263 N 6.99 0.82 -0.22 4.34 -0.00 -1.91 -1.04 114.58 123.56 1w3y h GLU 263 Ca -0.42 -0.07 -0.20 0.00 -0.00 0.00 0.00 59.36 58.67 1w3y h GLU 263 Cb 1.20 -0.17 0.00 0.00 -0.00 0.00 0.00 28.75 29.78 1w3y h GLU 263 CO 0.90 0.58 -0.64 1.79 -0.00 0.00 0.00 179.01 181.64 1w3y h THR 264 N 0.83 1.28 -0.44 -1.06 1.35 -1.98 -2.46 112.91 110.43 1w3y h THR 264 Ca 0.22 -1.85 -0.11 0.00 -0.55 0.00 0.00 66.41 64.12 1w3y h THR 264 Cb -0.02 1.79 -0.01 0.00 -1.73 0.00 0.00 68.15 68.18 1w3y h THR 264 CO -0.04 0.59 -0.15 0.58 -0.25 0.00 0.00 175.52 176.25 1w3y h VAL 265 N 0.58 1.27 -0.08 6.82 2.07 -1.85 0.78 116.25 125.84 1w3y h VAL 265 Ca -0.01 -1.29 0.00 0.00 0.82 0.00 0.00 66.70 66.22 1w3y h VAL 265 Cb 1.25 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1w3y h VAL 265 CO 0.13 0.44 0.05 0.58 0.02 0.00 0.00 177.57 178.80 1w3y h VAL 266 N 0.71 1.04 -0.11 2.57 2.07 -1.21 -1.66 116.25 119.66 1w3y h VAL 266 Ca 0.11 -0.10 -0.09 0.00 0.82 0.00 0.00 66.70 67.43 1w3y h VAL 266 Cb 0.71 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1w3y h VAL 266 CO 0.05 0.04 -0.34 -0.09 0.02 0.00 0.00 177.57 177.25 1w3y h ARG 267 N 0.09 0.22 -0.51 1.57 2.43 -1.37 -2.27 114.38 114.55 1w3y h ARG 267 Ca 0.03 -0.09 -0.07 0.00 -0.81 0.00 0.00 59.98 59.04 1w3y h ARG 267 Cb 0.01 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1w3y h ARG 267 CO -0.01 0.54 0.03 1.15 -1.51 0.00 0.00 179.97 180.18 1w3y h THR 268 N 0.19 1.26 -0.10 0.20 2.02 -0.52 0.24 112.91 116.20 1w3y h THR 268 Ca 0.02 -1.03 -0.02 0.00 0.77 0.00 0.00 66.41 66.15 1w3y h THR 268 Cb 0.70 0.92 -0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1w3y h THR 268 CO 0.05 0.37 -0.01 0.58 0.37 0.00 0.00 175.52 176.88 1w3y h VAL 269 N 0.75 1.27 -0.22 3.16 2.07 -1.16 0.34 116.25 122.47 1w3y h VAL 269 Ca 0.15 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1w3y h VAL 269 Cb 0.47 1.67 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1w3y h VAL 269 CO 0.02 0.25 0.15 0.03 0.02 0.00 0.00 177.57 178.04 1w3y h ARG 270 N -0.12 0.29 -0.26 1.57 3.08 -1.32 -0.90 114.38 116.73 1w3y h ARG 270 Ca 0.03 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 59.96 1w3y h ARG 270 Cb 0.40 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 1w3y h ARG 270 CO 0.01 0.20 -0.24 -0.44 -1.07 0.00 0.00 179.97 178.43 1w3y h ASP 271 N 0.30 0.49 -0.10 7.04 5.19 -0.51 -2.57 116.42 126.25 1w3y h ASP 271 Ca 0.08 -0.16 -0.16 0.00 -0.62 0.00 0.00 57.03 56.17 1w3y h ASP 271 Cb -0.03 -0.13 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 1w3y h ASP 271 CO -0.02 0.73 -0.49 0.28 -3.12 0.00 0.00 179.24 176.63 1w3y h SER 272 N 0.43 0.72 -0.66 6.45 0.02 -0.69 -0.97 113.55 118.85 1w3y h SER 272 Ca 0.06 -0.36 -0.05 0.00 -0.84 0.00 0.00 61.79 60.61 1w3y h SER 272 Cb 0.66 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.96 1w3y h SER 272 CO 0.05 1.08 0.23 0.24 -1.14 0.00 0.00 176.83 177.29 1w3y h MET 273 N 0.52 1.02 -0.35 3.45 2.86 -1.03 -1.79 114.93 119.60 1w3y h MET 273 Ca 0.03 -0.21 -0.04 0.00 -2.06 0.00 0.00 59.70 57.42 1w3y h MET 273 Cb 1.03 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.53 1w3y h MET 273 CO 0.10 0.87 0.06 1.49 1.06 0.00 0.00 176.91 180.49 1w3y h GLU 274 N 0.95 0.59 0.02 1.72 4.57 -1.28 -1.47 114.58 119.68 1w3y h GLU 274 Ca 0.22 -0.16 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 1w3y h GLU 274 Cb 0.26 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.78 1w3y h GLU 274 CO -0.01 0.66 -0.01 2.35 -1.18 0.00 0.00 179.01 180.82 1w3y h TRP 275 N 0.42 -0.02 -0.94 0.92 7.01 -1.01 -1.17 115.95 121.17 1w3y h TRP 275 Ca 0.11 -0.00 0.01 0.00 2.11 0.00 0.00 58.89 61.12 1w3y h TRP 275 Cb 0.35 0.01 -0.05 0.00 -2.10 0.00 0.00 29.16 27.37 1w3y h TRP 275 CO 0.02 0.09 0.62 0.52 -2.79 0.00 0.00 178.44 176.90 1w3y h MET 276 N -0.12 1.22 -0.69 2.65 2.86 -1.34 -0.63 114.93 118.89 1w3y h MET 276 Ca -0.00 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.55 1w3y h MET 276 Cb 0.12 -0.28 -0.03 0.00 0.06 0.00 0.00 31.60 31.47 1w3y h MET 276 CO 0.00 0.81 0.35 1.25 1.06 0.00 0.00 176.91 180.39 1w3y h HIS 277 N 1.26 0.95 0.05 -0.22 -0.00 -1.00 0.20 115.15 116.38 1w3y h HIS 277 Ca 0.35 -0.02 -0.26 0.00 -0.00 0.00 0.00 60.37 60.43 1w3y h HIS 277 Cb -0.13 -0.30 -0.02 0.00 -0.00 0.00 0.00 27.41 26.95 1w3y h HIS 277 CO -0.01 0.68 -1.30 0.87 -0.00 0.00 0.00 177.93 178.17 1w3y h LYS 278 N 0.96 0.10 -0.00 5.26 1.57 -0.58 -3.39 116.57 120.49 1w3y h LYS 278 Ca 0.24 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1w3y h LYS 278 Cb 0.06 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.43 1w3y h LYS 278 CO -0.04 0.96 -0.11 0.72 -0.57 0.00 0.00 179.45 180.41 1w3y n HIS 279 N -3.34 0.00 0.00 -1.35 8.25 -0.30 -4.95 115.22 113.53 1w3y n HIS 279 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1w3y n HIS 279 Cb 1.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 32.11 1w3y n HIS 279 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1w3y n VAL 280 N -1.06 0.00 -3.82 1.59 0.31 0.43 -5.05 118.33 110.74 1w3y n VAL 280 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.04 1w3y n VAL 280 Cb 0.04 -0.85 -0.15 0.00 -0.91 0.00 0.00 33.84 31.96 1w3y n VAL 280 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 1w3y s TYR 281 N -1.90 2.11 0.33 3.52 5.04 0.27 -4.96 117.35 121.76 1w3y s TYR 281 Ca 0.00 -1.86 -0.09 0.00 -2.44 0.00 0.00 57.07 52.68 1w3y s TYR 281 Cb 0.00 -1.83 0.01 0.00 0.35 0.00 0.00 41.96 40.50 1w3y s TYR 281 CO 0.00 -0.84 0.56 0.54 -1.34 0.00 0.00 175.55 174.47 1w3y s ASN 282 N 1.48 0.40 0.66 4.32 6.03 -1.26 -4.27 114.94 122.30 1w3y s ASN 282 Ca 0.06 -1.23 0.44 0.00 -1.03 0.00 0.00 52.86 51.10 1w3y s ASN 282 Cb -0.18 0.69 2.41 0.00 -3.03 0.00 0.00 41.25 41.14 1w3y s ASN 282 CO -0.17 -1.36 2.37 0.28 -2.03 0.00 0.00 177.10 176.19 1w3y h SER 283 N 2.12 0.00 0.69 3.54 0.02 -1.90 -1.95 113.55 116.07 1w3y h SER 283 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 1w3y h SER 283 Cb 1.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.79 1w3y h SER 283 CO 0.38 0.00 -0.25 -0.62 -1.14 0.00 0.00 176.83 175.20 1w3y n GLU 284 N -3.10 0.09 -2.36 3.45 1.02 -1.26 -4.90 120.64 113.58 1w3y n GLU 284 Ca -0.03 -0.03 -0.27 0.00 -0.02 0.00 0.00 57.16 56.81 1w3y n GLU 284 Cb 0.08 -1.50 0.04 0.00 -0.02 0.00 0.00 31.44 30.03 1w3y n GLU 284 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1w3y s LYS 285 N -2.94 2.85 0.18 3.49 -0.14 -0.73 -5.11 119.74 117.35 1w3y s LYS 285 Ca 0.14 -0.01 0.08 0.00 -1.36 0.00 0.00 55.97 54.82 1w3y s LYS 285 Cb 0.18 -2.25 -0.04 0.00 -1.68 0.00 0.00 37.83 34.04 1w3y s LYS 285 CO 0.60 -0.76 -0.16 -1.12 -0.76 0.00 0.00 175.35 173.15 1w3y s SER 286 N -4.33 2.57 0.14 2.83 0.01 -1.26 -4.96 113.70 108.69 1w3y s SER 286 Ca 0.55 -0.94 -0.31 0.00 1.31 0.00 0.00 55.95 56.55 1w3y s SER 286 Cb -0.11 -0.14 -0.10 0.00 0.21 0.00 0.00 66.02 65.88 1w3y s SER 286 CO 0.45 -0.12 1.72 -0.63 0.41 0.00 0.00 173.24 175.07 1w3y s ILE 287 N -2.56 2.56 -0.22 1.44 1.01 -1.26 -4.97 121.20 117.19 1w3y s ILE 287 Ca 0.19 0.22 -0.01 0.00 0.00 0.00 0.00 60.65 61.04 1w3y s ILE 287 Cb -0.03 -3.14 0.07 0.00 0.01 0.00 0.00 42.46 39.37 1w3y s ILE 287 CO 0.06 0.01 0.02 -0.69 0.00 0.00 0.00 174.94 174.34 1w3y s VAL 288 N 2.09 0.91 0.00 2.92 1.01 -1.26 -5.03 120.40 121.04 1w3y s VAL 288 Ca 0.76 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.84 1w3y s VAL 288 Cb -0.45 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 34.55 1w3y s VAL 288 CO 0.34 -0.24 0.00 0.61 0.00 0.00 0.00 175.10 175.80 1w3y n GLY 289 N 4.89 0.70 3.64 4.51 0.00 -1.26 -3.89 105.19 113.78 1w3y n GLY 289 Ca -0.09 -1.38 -0.40 0.00 0.00 0.00 0.00 46.02 44.16 1w3y n GLY 289 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1w3y s ASN 290 N -4.00 6.56 0.48 1.61 3.84 -1.26 -4.95 114.94 117.21 1w3y s ASN 290 Ca 0.00 0.68 0.18 0.00 0.21 0.00 0.00 52.86 53.93 1w3y s ASN 290 Cb 0.00 -2.31 1.18 0.00 -0.55 0.00 0.00 41.25 39.56 1w3y s ASN 290 CO 0.00 -0.28 2.01 4.11 -2.79 0.00 0.00 177.10 180.15 1w3y h TRP 291 N 7.72 0.23 -0.94 0.43 5.08 -1.97 -2.62 115.95 123.89 1w3y h TRP 291 Ca -0.30 0.01 0.12 0.00 1.08 0.00 0.00 58.89 59.79 1w3y h TRP 291 Cb 1.14 -0.08 -0.07 0.00 -3.00 0.00 0.00 29.16 27.15 1w3y h TRP 291 CO 0.73 0.11 0.60 2.35 -1.28 0.00 0.00 178.44 180.95 1w3y h TRP 292 N 0.22 1.01 -0.44 0.12 7.01 -1.97 -0.68 115.95 121.21 1w3y h TRP 292 Ca 0.22 0.03 -0.15 0.00 2.11 0.00 0.00 58.89 61.11 1w3y h TRP 292 Cb 0.59 -0.32 -0.01 0.00 -2.10 0.00 0.00 29.16 27.32 1w3y h TRP 292 CO -0.00 0.42 -0.30 -0.44 -2.79 0.00 0.00 178.44 175.33 1w3y h ASP 293 N 0.89 1.02 0.69 2.65 3.32 -1.80 0.90 116.42 124.09 1w3y h ASP 293 Ca 0.46 -0.42 -0.12 0.00 0.02 0.00 0.00 57.03 56.96 1w3y h ASP 293 Cb 0.51 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1w3y h ASP 293 CO -0.22 1.23 -0.57 1.88 -1.72 0.00 0.00 179.24 179.84 1w3y h TYR 294 N 0.82 0.00 0.00 4.55 -1.99 -1.39 -0.15 116.97 118.80 1w3y h TYR 294 Ca 0.09 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.82 1w3y h TYR 294 Cb 0.89 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.62 1w3y h TYR 294 CO 0.06 0.57 -1.60 0.39 -0.00 0.00 0.00 178.16 177.58 1w3y n GLU 295 N -3.72 0.42 0.09 4.88 1.02 -0.36 -4.58 120.64 118.40 1w3y n GLU 295 Ca -0.01 -0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1w3y n GLU 295 Cb 0.60 -1.31 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 1w3y n GLU 295 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1w3y n ILE 296 N -1.96 0.69 0.10 -3.67 5.41 0.16 -4.70 119.36 115.39 1w3y n ILE 296 Ca -0.02 0.23 -0.14 0.00 1.00 0.00 0.00 62.75 63.81 1w3y n ILE 296 Cb 0.34 -1.11 -0.07 0.00 -0.71 0.00 0.00 39.64 38.10 1w3y n ILE 296 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1w3y h GLY 297 N 0.00 -0.78 0.75 7.39 0.00 -1.23 -1.58 103.07 107.62 1w3y h GLY 297 Ca 0.00 0.48 -0.06 0.00 0.00 0.00 0.00 47.33 47.75 1w3y h GLY 297 CO 0.00 -0.26 -0.13 -0.84 0.00 0.00 0.00 176.54 175.31 1w3y h THR 298 N -0.61 1.34 -0.81 4.70 2.02 -1.25 -2.78 112.91 115.51 1w3y h THR 298 Ca 0.03 -1.25 0.06 0.00 0.77 0.00 0.00 66.41 66.02 1w3y h THR 298 Cb 0.65 1.83 -0.05 0.00 -1.74 0.00 0.00 68.15 68.84 1w3y h THR 298 CO -0.25 0.37 0.53 -0.65 0.37 0.00 0.00 175.52 175.88 1w3y h PRO 299 N -0.01 0.86 -0.51 6.66 0.11 -1.74 0.21 132.00 137.58 1w3y h PRO 299 Ca 0.03 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.98 1w3y h PRO 299 Cb 0.64 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 1w3y h PRO 299 CO 0.03 0.57 -0.09 0.00 -0.21 0.00 0.00 178.00 178.30 1w3y h ARG 300 N 0.88 0.92 -0.46 1.05 3.08 -1.28 0.48 114.38 119.06 1w3y h ARG 300 Ca 0.35 -0.32 -0.11 0.00 0.07 0.00 0.00 59.98 59.97 1w3y h ARG 300 Cb 0.22 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1w3y h ARG 300 CO -0.12 0.97 -0.16 0.00 -1.07 0.00 0.00 179.97 179.59 1w3y h ALA 301 N 1.06 0.64 -0.26 0.04 0.00 -1.01 -1.71 119.26 118.03 1w3y h ALA 301 Ca 0.14 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1w3y h ALA 301 Cb 0.61 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1w3y h ALA 301 CO 0.04 0.58 0.04 0.82 0.00 0.00 0.00 179.25 180.73 1w3y h ILE 302 N 0.77 1.23 -0.12 0.00 2.04 -0.83 -1.87 117.51 118.72 1w3y h ILE 302 Ca 0.11 -0.77 0.03 0.00 1.00 0.00 0.00 64.86 65.23 1w3y h ILE 302 Cb 0.72 1.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 1w3y h ILE 302 CO 0.06 0.25 -0.07 0.78 0.00 0.00 0.00 178.15 179.16 1w3y h ASN 303 N 0.23 -0.22 -0.42 1.72 2.35 -0.80 -1.65 115.58 116.79 1w3y h ASN 303 Ca 0.08 0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.81 1w3y h ASN 303 Cb 0.33 0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 1w3y h ASN 303 CO 0.01 -0.09 0.03 0.78 -1.65 0.00 0.00 177.43 176.50 1w3y h ASN 304 N -0.07 0.76 -0.20 5.81 2.35 -1.30 -0.23 115.58 122.71 1w3y h ASN 304 Ca 0.07 -0.17 -0.02 0.00 -0.55 0.00 0.00 56.30 55.63 1w3y h ASN 304 Cb 0.17 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1w3y h ASN 304 CO -0.16 0.81 0.05 0.74 -1.65 0.00 0.00 177.43 177.22 1w3y h THR 305 N 0.75 1.20 -0.33 2.81 2.02 -1.05 -1.33 112.91 116.98 1w3y h THR 305 Ca 0.15 -0.64 -0.11 0.00 0.77 0.00 0.00 66.41 66.58 1w3y h THR 305 Cb 0.41 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.06 1w3y h THR 305 CO 0.01 0.20 -0.26 -0.07 0.37 0.00 0.00 175.52 175.78 1w3y h LEU 306 N 0.14 0.66 -0.17 2.58 3.38 -1.18 -1.73 115.31 118.98 1w3y h LEU 306 Ca 0.06 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1w3y h LEU 306 Cb 0.26 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1w3y h LEU 306 CO -0.00 0.90 0.05 -1.28 0.09 0.00 0.00 178.44 178.19 1w3y h SER 307 N 0.57 0.26 -0.64 -0.43 0.87 -0.91 0.37 113.55 113.64 1w3y h SER 307 Ca 0.08 -0.22 -0.08 0.00 -1.23 0.00 0.00 61.79 60.34 1w3y h SER 307 Cb 0.74 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.60 1w3y h SER 307 CO 0.06 0.42 0.11 -0.07 -0.53 0.00 0.00 176.83 176.81 1w3y h LEU 308 N 0.09 1.03 -3.77 2.23 3.38 -1.18 -3.11 115.31 113.98 1w3y h LEU 308 Ca 0.05 -0.24 -0.41 0.00 0.09 0.00 0.00 57.88 57.37 1w3y h LEU 308 Cb 0.26 -0.27 -0.24 0.00 0.09 0.00 0.00 40.66 40.49 1w3y h LEU 308 CO 0.00 1.02 0.39 0.23 0.09 0.00 0.00 178.44 180.17 1w3y n MET 309 N -4.22 2.14 0.33 1.13 2.81 -0.66 -4.67 117.12 113.99 1w3y n MET 309 Ca 0.04 -3.11 0.22 0.00 -1.81 0.00 0.00 57.70 53.05 1w3y n MET 309 Cb 0.29 -2.06 1.16 0.00 -0.71 0.00 0.00 33.22 31.89 1w3y n MET 309 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 1w3y h LYS 310 N 1.07 0.00 -0.10 0.03 2.10 -0.85 -0.84 116.57 117.97 1w3y h LYS 310 Ca 0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.14 1w3y h LYS 310 Cb 2.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.67 1w3y h LYS 310 CO 0.88 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 178.72 1w3y n GLU 311 N -3.10 1.41 0.00 0.07 1.02 -1.26 -3.36 120.64 115.41 1w3y n GLU 311 Ca -0.03 -0.61 0.01 0.00 -0.02 0.00 0.00 57.16 56.51 1w3y n GLU 311 Cb 0.10 -1.32 -0.00 0.00 -0.02 0.00 0.00 31.44 30.19 1w3y n GLU 311 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1w3y n TYR 312 N -0.15 0.00 -4.39 -0.32 4.01 -0.33 -5.03 117.16 110.96 1w3y n TYR 312 Ca 0.14 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.60 1w3y n TYR 312 Cb 0.20 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 39.11 1w3y n TYR 312 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1w3y s PHE 313 N -0.72 2.30 0.52 -0.72 0.08 -1.20 -5.08 117.98 113.15 1w3y s PHE 313 Ca 0.01 -0.38 -0.05 0.00 0.12 0.00 0.00 56.93 56.64 1w3y s PHE 313 Cb 0.01 -1.22 -0.01 0.00 -0.57 0.00 0.00 43.02 41.23 1w3y s PHE 313 CO 0.05 0.37 0.81 -1.54 -0.10 0.00 0.00 175.22 174.81 1w3y s SER 314 N -2.18 5.94 0.44 1.36 1.04 -1.26 -4.92 113.70 114.12 1w3y s SER 314 Ca 0.15 0.74 0.14 0.00 0.48 0.00 0.00 55.95 57.47 1w3y s SER 314 Cb -0.10 -1.93 0.98 0.00 0.10 0.00 0.00 66.02 65.08 1w3y s SER 314 CO 0.07 -0.78 1.99 0.44 0.98 0.00 0.00 173.24 175.93 1w3y h ASP 315 N 0.10 0.02 -0.29 7.02 3.32 -1.97 -1.23 116.42 123.39 1w3y h ASP 315 Ca -0.46 -0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.45 1w3y h ASP 315 Cb 1.23 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 1w3y h ASP 315 CO 0.61 0.20 -0.31 -0.08 -1.72 0.00 0.00 179.24 177.93 1w3y h GLU 316 N 0.02 0.81 -0.33 3.56 4.81 -1.99 -1.46 114.58 119.99 1w3y h GLU 316 Ca 0.00 -0.38 -0.17 0.00 -0.13 0.00 0.00 59.36 58.68 1w3y h GLU 316 Cb 0.32 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1w3y h GLU 316 CO 0.02 1.01 -0.47 0.93 -0.73 0.00 0.00 179.01 179.77 1w3y h GLU 317 N 0.68 0.91 -0.71 1.92 5.08 -1.79 -1.29 114.58 119.37 1w3y h GLU 317 Ca 0.07 -0.53 -0.02 0.00 -1.00 0.00 0.00 59.36 57.89 1w3y h GLU 317 Cb 0.86 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.12 1w3y h GLU 317 CO 0.08 1.17 0.38 0.82 -1.00 0.00 0.00 179.01 180.45 1w3y h ILE 318 N 0.72 1.22 -0.45 3.13 2.04 -1.12 0.48 117.51 123.53 1w3y h ILE 318 Ca 0.04 -0.58 -0.11 0.00 1.00 0.00 0.00 64.86 65.20 1w3y h ILE 318 Cb 1.07 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1w3y h ILE 318 CO 0.11 0.25 -0.15 0.50 0.00 0.00 0.00 178.15 178.86 1w3y h LYS 319 N 0.99 0.89 -0.44 2.37 3.64 -1.19 -2.46 116.57 120.37 1w3y h LYS 319 Ca 0.25 -0.36 0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1w3y h LYS 319 Cb 0.06 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 1w3y h LYS 319 CO -0.04 1.01 0.24 -0.22 -2.27 0.00 0.00 179.45 178.17 1w3y h LYS 320 N 0.73 0.46 0.00 1.90 3.64 -0.70 -1.25 116.57 121.36 1w3y h LYS 320 Ca 0.11 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1w3y h LYS 320 Cb 0.71 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1w3y h LYS 320 CO 0.05 0.31 0.00 0.66 -2.27 0.00 0.00 179.45 178.20 1w3y n TYR 321 N -4.88 0.14 0.56 1.91 4.01 0.11 -3.17 117.16 115.85 1w3y n TYR 321 Ca 0.02 0.05 0.06 0.00 -0.16 0.00 0.00 57.90 57.87 1w3y n TYR 321 Cb 0.09 -0.57 0.02 0.00 -0.31 0.00 0.00 39.34 38.57 1w3y n TYR 321 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1w3y n THR 322 N -1.62 0.00 -0.34 -0.72 -2.24 -0.93 -4.50 114.28 103.93 1w3y n THR 322 Ca 0.06 -0.43 -0.01 0.00 -2.27 0.00 0.00 64.05 61.40 1w3y n THR 322 Cb 0.30 1.21 0.12 0.00 -2.10 0.00 0.00 70.33 69.86 1w3y n THR 322 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1w3y h ASP 323 N 1.95 0.99 -0.66 3.42 3.45 -1.19 -1.83 116.42 122.54 1w3y h ASP 323 Ca 0.00 -0.01 0.04 0.00 0.43 0.00 0.00 57.03 57.49 1w3y h ASP 323 Cb 0.49 -0.23 -0.04 0.00 -0.56 0.00 0.00 39.33 38.99 1w3y h ASP 323 CO 0.00 0.69 0.44 1.62 -1.57 0.00 0.00 179.24 180.41 1w3y h VAL 324 N 1.16 1.08 -0.83 -1.35 3.04 -1.79 -1.50 116.25 116.05 1w3y h VAL 324 Ca 0.36 -0.26 -0.03 0.00 -1.01 0.00 0.00 66.70 65.75 1w3y h VAL 324 Cb -0.02 0.24 -0.04 0.00 -2.01 0.00 0.00 31.29 29.47 1w3y h VAL 324 CO -0.11 0.14 0.39 0.40 -1.01 0.00 0.00 177.57 177.37 1w3y h ILE 325 N 0.77 1.26 0.00 3.17 2.04 -1.62 -1.85 117.51 121.28 1w3y h ILE 325 Ca 0.27 -0.74 -0.08 0.00 1.00 0.00 0.00 64.86 65.30 1w3y h ILE 325 Cb 0.11 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 1w3y h ILE 325 CO -0.08 0.32 -0.38 -0.33 0.00 0.00 0.00 178.15 177.68 1w3y h GLU 326 N 1.19 0.00 -0.16 2.37 4.39 -1.17 0.16 114.58 121.36 1w3y h GLU 326 Ca 0.28 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.90 1w3y h GLU 326 Cb 0.14 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.79 1w3y h GLU 326 CO -0.03 0.38 -0.22 -0.22 -1.16 0.00 0.00 179.01 177.75 1w3y h LYS 327 N 0.00 0.44 0.00 2.33 3.11 -0.71 -2.76 116.57 118.98 1w3y h LYS 327 Ca -0.00 -0.25 -0.19 0.00 -2.81 0.00 0.00 60.65 57.39 1w3y h LYS 327 Cb 0.81 0.02 -0.03 0.00 -1.00 0.00 0.00 32.23 32.03 1w3y h LYS 327 CO 0.05 0.84 -1.03 0.74 -2.81 0.00 0.00 179.45 177.23 1w3y h PHE 328 N 0.07 0.00 -2.07 1.91 0.04 -1.25 -3.40 116.94 112.24 1w3y h PHE 328 Ca 0.02 0.00 -0.56 0.00 2.80 0.00 0.00 57.97 60.23 1w3y h PHE 328 Cb 0.79 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.53 1w3y h PHE 328 CO 0.09 0.84 -0.94 0.28 -0.60 0.00 0.00 178.31 177.98 1w3y n VAL 329 N -3.23 0.49 0.16 -0.55 0.31 0.57 -4.50 118.33 111.57 1w3y n VAL 329 Ca -0.03 -4.53 0.05 0.00 -0.01 0.00 0.00 64.34 59.82 1w3y n VAL 329 Cb 0.90 -1.74 0.06 0.00 -0.91 0.00 0.00 33.84 32.15 1w3y n VAL 329 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1w3y h PRO 330 N 3.85 0.00 -4.85 5.55 0.13 -1.69 -3.42 132.00 131.57 1w3y h PRO 330 Ca 0.11 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.57 1w3y h PRO 330 Cb 0.80 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 31.64 1w3y h PRO 330 CO 0.60 0.34 -0.68 0.34 -0.23 0.00 0.00 178.00 178.37 1w3y s ASP 331 N -6.34 4.76 0.00 1.44 2.15 -1.26 -4.99 116.67 112.42 1w3y s ASP 331 Ca 0.04 -0.81 0.10 0.00 0.43 0.00 0.00 52.55 52.31 1w3y s ASP 331 Cb 0.07 -1.78 0.57 0.00 -0.30 0.00 0.00 42.92 41.48 1w3y s ASP 331 CO 0.73 -0.17 1.12 -0.81 -0.17 0.00 0.00 175.17 175.87 1w3y n PRO 332 N 4.77 0.25 -0.00 4.34 -0.04 -1.26 -2.46 135.00 140.59 1w3y n PRO 332 Ca -0.15 0.08 0.07 0.00 -0.04 0.00 0.00 63.50 63.46 1w3y n PRO 332 Cb 0.47 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.34 1w3y n PRO 332 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1w3y n GLU 333 N -1.12 1.92 -4.11 0.54 1.02 -1.26 -4.83 120.64 112.79 1w3y n GLU 333 Ca 0.06 -0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 57.07 1w3y n GLU 333 Cb 0.05 -1.21 -0.11 0.00 -0.02 0.00 0.00 31.44 30.16 1w3y n GLU 333 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1w3y s HIS 334 N -2.48 0.72 0.37 -0.32 3.76 -1.03 -1.12 115.29 115.20 1w3y s HIS 334 Ca 0.03 -0.78 0.08 0.00 -0.15 0.00 0.00 55.06 54.25 1w3y s HIS 334 Cb 0.11 -0.44 -0.07 0.00 1.11 0.00 0.00 32.58 33.29 1w3y s HIS 334 CO 0.59 -0.17 -0.05 -0.06 -0.85 0.00 0.00 174.74 174.21 1w3y s PHE 335 N -2.80 2.46 -1.52 1.40 0.08 -0.53 -4.68 117.98 112.39 1w3y s PHE 335 Ca 0.02 -0.57 -0.03 0.00 0.12 0.00 0.00 56.93 56.47 1w3y s PHE 335 Cb -0.00 -1.55 0.01 0.00 -0.57 0.00 0.00 43.02 40.91 1w3y s PHE 335 CO -0.04 0.52 0.33 0.54 -0.10 0.00 0.00 175.22 176.48 1w3y n ARG 336 N -0.87 -3.40 0.24 0.44 1.74 -1.26 -1.74 116.66 111.80 1w3y n ARG 336 Ca -0.05 0.84 0.08 0.00 -0.77 0.00 0.00 57.85 57.95 1w3y n ARG 336 Cb 0.65 -5.59 0.59 0.00 -1.02 0.00 0.00 32.46 27.09 1w3y n ARG 336 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 1w3y h LYS 337 N -0.74 0.00 -0.17 5.56 3.64 -1.84 -2.42 116.57 120.61 1w3y h LYS 337 Ca -0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 1w3y h LYS 337 Cb 1.34 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.16 1w3y h LYS 337 CO 0.54 0.17 0.00 0.25 -2.27 0.00 0.00 179.45 178.14 1w3y n THR 338 N -3.99 0.21 -3.25 1.00 -2.24 -1.26 -4.90 114.28 99.84 1w3y n THR 338 Ca -0.02 -0.36 -0.13 0.00 -2.27 0.00 0.00 64.05 61.27 1w3y n THR 338 Cb 0.26 0.41 0.03 0.00 -2.10 0.00 0.00 70.33 68.93 1w3y n THR 338 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1w3y n THR 339 N 0.37 0.00 -0.54 4.28 -2.24 -0.91 -4.98 114.28 110.27 1w3y n THR 339 Ca 0.16 -1.20 0.02 0.00 -2.27 0.00 0.00 64.05 60.77 1w3y n THR 339 Cb 0.35 -0.55 0.30 0.00 -2.10 0.00 0.00 70.33 68.32 1w3y n THR 339 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1w3y n ASP 340 N -2.38 4.63 -2.72 3.42 8.00 -1.26 -4.52 116.55 121.72 1w3y n ASP 340 Ca 0.06 -2.81 -0.07 0.00 0.71 0.00 0.00 54.79 52.69 1w3y n ASP 340 Cb 0.36 -0.66 0.06 0.00 -0.02 0.00 0.00 41.12 40.86 1w3y n ASP 340 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1w3y n ASN 341 N 0.34 -2.35 -4.64 -2.24 0.23 -1.26 -5.16 115.26 100.17 1w3y n ASN 341 Ca 0.25 -2.91 -0.29 0.00 -0.53 0.00 0.00 54.58 51.11 1w3y n ASN 341 Cb 1.06 1.54 0.19 0.00 -2.08 0.00 0.00 39.78 40.48 1w3y n ASN 341 CO 0.00 0.00 0.00 -2.84 -0.93 0.00 0.00 177.26 173.49 1w3y s PRO 342 N 0.47 0.21 0.03 -0.53 0.02 -1.21 -4.90 135.00 129.09 1w3y s PRO 342 Ca 0.29 0.63 -0.08 0.00 0.02 0.00 0.00 61.00 61.86 1w3y s PRO 342 Cb 0.23 -1.70 -0.00 0.00 0.02 0.00 0.00 34.50 33.05 1w3y s PRO 342 CO -0.18 -2.91 0.15 -0.59 -0.33 0.00 0.00 177.00 173.14 1w3y s PHE 343 N -2.85 0.10 -0.06 6.54 -0.12 -0.71 -4.99 117.98 115.90 1w3y s PHE 343 Ca 0.66 -0.32 -0.30 0.00 -0.05 0.00 0.00 56.93 56.91 1w3y s PHE 343 Cb -0.20 -0.07 -0.03 0.00 -0.63 0.00 0.00 43.02 42.09 1w3y s PHE 343 CO 0.59 -0.38 1.13 0.21 -0.05 0.00 0.00 175.22 176.72 1w3y s LYS 344 N -2.33 4.39 -0.00 1.99 2.20 -1.26 -1.45 119.74 123.28 1w3y s LYS 344 Ca -0.07 1.58 -0.30 0.00 -0.36 0.00 0.00 55.97 56.82 1w3y s LYS 344 Cb -0.02 -3.53 -0.04 0.00 -1.51 0.00 0.00 37.83 32.73 1w3y s LYS 344 CO -0.03 -0.37 1.07 0.00 -0.36 0.00 0.00 175.35 175.66 1w3y s ALA 345 N 1.98 3.29 0.28 3.13 0.00 -0.27 -4.92 121.76 125.24 1w3y s ALA 345 Ca 0.54 0.61 -0.05 0.00 0.00 0.00 0.00 51.96 53.06 1w3y s ALA 345 Cb -0.23 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.48 1w3y s ALA 345 CO 0.22 -0.39 0.37 -0.51 0.00 0.00 0.00 175.76 175.45 1w3y s LEU 346 N 1.28 0.89 0.00 0.00 1.43 -1.26 -4.73 118.68 116.29 1w3y s LEU 346 Ca 0.54 -1.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.33 1w3y s LEU 346 Cb -0.23 1.21 0.00 0.00 0.03 0.00 0.00 46.19 47.20 1w3y s LEU 346 CO 0.26 -1.11 0.00 0.61 0.23 0.00 0.00 176.35 176.34 1w3y n GLY 347 N -0.44 2.47 0.22 -3.19 0.00 -1.26 -1.92 105.19 101.08 1w3y n GLY 347 Ca 0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 46.02 45.80 1w3y n GLY 347 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1w3y h GLY 348 N 0.00 0.80 1.12 -0.02 0.00 -1.93 -2.14 103.07 100.90 1w3y h GLY 348 Ca 0.00 -0.20 0.01 0.00 0.00 0.00 0.00 47.33 47.15 1w3y h GLY 348 CO 0.00 0.11 0.59 3.43 0.00 0.00 0.00 176.54 180.68 1w3y h ASN 349 N 0.55 1.02 -0.23 0.19 -0.26 -1.84 -1.50 115.58 113.51 1w3y h ASN 349 Ca 0.25 -0.03 -0.05 0.00 -0.56 0.00 0.00 56.30 55.92 1w3y h ASN 349 Cb 0.17 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.16 1w3y h ASN 349 CO -0.18 0.74 -0.01 0.25 -1.06 0.00 0.00 177.43 177.17 1w3y h LEU 350 N 1.20 0.51 -0.48 1.61 5.85 -0.76 -0.11 115.31 123.13 1w3y h LEU 350 Ca 0.33 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.82 1w3y h LEU 350 Cb -0.13 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 1w3y h LEU 350 CO -0.07 0.58 -0.22 0.58 -0.34 0.00 0.00 178.44 178.97 1w3y h VAL 351 N 0.52 1.27 -0.01 1.05 2.07 -0.77 -2.47 116.25 117.91 1w3y h VAL 351 Ca 0.11 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.19 1w3y h VAL 351 Cb 0.34 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 1w3y h VAL 351 CO 0.01 0.48 -0.27 0.44 0.02 0.00 0.00 177.57 178.24 1w3y h ASP 352 N 0.85 0.01 -0.53 0.57 3.32 -0.58 0.09 116.42 120.15 1w3y h ASP 352 Ca 0.11 -0.00 0.05 0.00 0.02 0.00 0.00 57.03 57.21 1w3y h ASP 352 Cb 0.80 -0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.32 1w3y h ASP 352 CO 0.07 0.28 0.35 -0.03 -1.72 0.00 0.00 179.24 178.19 1w3y h MET 353 N 0.01 0.52 -0.16 3.56 4.05 -0.57 -0.76 114.93 121.57 1w3y h MET 353 Ca -0.00 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.33 1w3y h MET 353 Cb 0.49 -0.12 -0.00 0.00 -0.80 0.00 0.00 31.60 31.17 1w3y h MET 353 CO 0.04 0.34 -0.12 0.78 0.23 0.00 0.00 176.91 178.18 1w3y h GLY 354 N 0.53 0.39 2.00 1.39 0.00 -0.79 0.74 103.07 107.33 1w3y h GLY 354 Ca 0.22 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1w3y h GLY 354 CO -0.06 0.34 0.00 0.54 0.00 0.00 0.00 176.54 177.36 1w3y n ARG 355 N -4.58 0.11 -0.08 4.80 1.74 -0.61 -0.78 116.66 117.26 1w3y n ARG 355 Ca -0.06 0.46 -0.08 0.00 -0.77 0.00 0.00 57.85 57.40 1w3y n ARG 355 Cb 0.34 -1.77 -0.03 0.00 -1.02 0.00 0.00 32.46 29.98 1w3y n ARG 355 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1w3y n VAL 356 N -1.99 1.46 0.06 1.55 0.31 -0.39 -4.40 118.33 114.93 1w3y n VAL 356 Ca 0.01 0.15 -0.04 0.00 -0.01 0.00 0.00 64.34 64.45 1w3y n VAL 356 Cb 0.13 -2.34 -0.09 0.00 -0.91 0.00 0.00 33.84 30.63 1w3y n VAL 356 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1w3y h LYS 357 N -1.00 0.00 -0.24 5.55 1.57 -0.84 -2.37 116.57 119.24 1w3y h LYS 357 Ca -0.04 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.63 1w3y h LYS 357 Cb 0.78 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.09 1w3y h LYS 357 CO -0.02 0.72 -0.28 0.28 -0.57 0.00 0.00 179.45 179.57 1w3y h VAL 358 N 0.00 1.32 -0.26 0.50 2.07 -1.13 -0.35 116.25 118.40 1w3y h VAL 358 Ca -0.08 -1.46 -0.14 0.00 0.82 0.00 0.00 66.70 65.84 1w3y h VAL 358 Cb 1.71 1.70 -0.00 0.00 -1.52 0.00 0.00 31.29 33.17 1w3y h VAL 358 CO 0.10 0.46 -0.38 0.40 0.02 0.00 0.00 177.57 178.16 1w3y h ILE 359 N 0.33 1.30 -0.54 4.57 1.08 -1.68 -1.77 117.51 120.81 1w3y h ILE 359 Ca 0.03 -1.58 -0.02 0.00 -0.39 0.00 0.00 64.86 62.90 1w3y h ILE 359 Cb 0.85 1.69 -0.03 0.00 -3.07 0.00 0.00 36.82 36.27 1w3y h ILE 359 CO 0.07 0.50 0.23 0.00 -0.69 0.00 0.00 178.15 178.26 1w3y h ALA 360 N 0.66 1.40 -0.77 1.87 0.00 -1.46 -0.40 119.26 120.57 1w3y h ALA 360 Ca 0.03 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1w3y h ALA 360 Cb 0.97 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1w3y h ALA 360 CO 0.09 0.46 0.28 0.78 0.00 0.00 0.00 179.25 180.86 1w3y h GLY 361 N 0.88 1.25 0.97 0.00 0.00 -0.79 0.11 103.07 105.49 1w3y h GLY 361 Ca 0.19 -0.70 -0.11 0.00 0.00 0.00 0.00 47.33 46.71 1w3y h GLY 361 CO -0.02 0.66 -0.22 1.41 0.00 0.00 0.00 176.54 178.37 1w3y h LEU 362 N 1.12 0.76 -0.95 3.11 3.38 -0.59 0.16 115.31 122.31 1w3y h LEU 362 Ca 0.25 -0.43 -0.05 0.00 0.09 0.00 0.00 57.88 57.74 1w3y h LEU 362 Cb 0.25 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1w3y h LEU 362 CO -0.02 1.03 0.20 -0.07 0.09 0.00 0.00 178.44 179.67 1w3y h LEU 363 N 0.50 0.90 -1.09 1.67 3.38 -0.79 -2.52 115.31 117.35 1w3y h LEU 363 Ca 0.07 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1w3y h LEU 363 Cb 0.77 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1w3y h LEU 363 CO 0.06 0.84 0.00 0.54 0.09 0.00 0.00 178.44 179.97 1w3y n ARG 364 N -4.28 1.74 -3.87 1.13 1.74 0.35 -4.82 116.66 108.65 1w3y n ARG 364 Ca 0.05 -1.08 -0.27 0.00 -0.77 0.00 0.00 57.85 55.78 1w3y n ARG 364 Cb 0.21 -1.45 0.02 0.00 -1.02 0.00 0.00 32.46 30.21 1w3y n ARG 364 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1w3y n LYS 365 N 0.31 -4.83 -3.55 5.56 5.02 -0.08 -4.94 118.16 115.66 1w3y n LYS 365 Ca 0.18 0.56 -0.41 0.00 -2.02 0.00 0.00 58.31 56.62 1w3y n LYS 365 Cb 0.36 -5.22 -0.08 0.00 -0.02 0.00 0.00 35.03 30.07 1w3y n LYS 365 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1w3y s ASP 366 N -3.81 5.71 0.24 4.39 -1.08 0.38 -4.96 116.67 117.54 1w3y s ASP 366 Ca 0.35 -1.91 -0.07 0.00 -0.52 0.00 0.00 52.55 50.41 1w3y s ASP 366 Cb -0.18 -2.02 0.25 0.00 -1.46 0.00 0.00 42.92 39.51 1w3y s ASP 366 CO 0.84 -0.70 1.92 0.44 0.52 0.00 0.00 175.17 178.19 1w3y h ASP 367 N 8.46 1.11 -0.67 -0.34 3.32 -1.92 -2.50 116.42 123.87 1w3y h ASP 367 Ca -0.21 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 1w3y h ASP 367 Cb 1.07 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.32 1w3y h ASP 367 CO 0.87 0.80 0.20 -0.61 -1.72 0.00 0.00 179.24 178.78 1w3y h GLN 368 N 1.31 1.07 -0.52 3.56 -0.00 -1.97 -0.98 115.11 117.58 1w3y h GLN 368 Ca 0.36 -0.23 -0.10 0.00 -0.00 0.00 0.00 58.65 58.67 1w3y h GLN 368 Cb -0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 27.48 27.17 1w3y h GLN 368 CO -0.08 0.92 -0.08 1.49 0.00 0.00 0.00 178.83 181.08 1w3y h GLU 369 N 1.03 0.97 -0.06 1.69 4.81 -1.88 -1.56 114.58 119.58 1w3y h GLU 369 Ca 0.22 -0.35 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 1w3y h GLU 369 Cb 0.31 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 29.62 1w3y h GLU 369 CO -0.01 1.02 0.00 0.82 -0.73 0.00 0.00 179.01 180.12 1w3y h ILE 370 N 0.84 1.23 -0.13 2.32 2.04 -1.18 -2.10 117.51 120.52 1w3y h ILE 370 Ca 0.14 -0.71 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 1w3y h ILE 370 Cb 0.64 1.60 -0.00 0.00 -0.74 0.00 0.00 36.82 38.31 1w3y h ILE 370 CO 0.04 0.20 0.01 0.77 0.00 0.00 0.00 178.15 179.17 1w3y h SER 371 N -0.17 0.22 -0.10 1.72 4.64 -1.19 -2.23 113.55 116.44 1w3y h SER 371 Ca 0.02 -0.28 -0.05 0.00 -0.47 0.00 0.00 61.79 61.01 1w3y h SER 371 Cb 0.31 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1w3y h SER 371 CO 0.00 0.44 -0.06 0.77 -0.87 0.00 0.00 176.83 177.12 1w3y h SER 372 N -0.02 0.33 -0.13 4.97 4.64 -1.35 -1.37 113.55 120.63 1w3y h SER 372 Ca 0.04 -0.06 -0.13 0.00 -0.47 0.00 0.00 61.79 61.16 1w3y h SER 372 Cb 0.33 -0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 1w3y h SER 372 CO 0.00 0.44 -0.44 0.74 -0.87 0.00 0.00 176.83 176.70 1w3y h THR 373 N 0.34 1.36 -0.70 2.95 2.02 -1.31 -2.21 112.91 115.35 1w3y h THR 373 Ca 0.07 -1.74 -0.03 0.00 0.77 0.00 0.00 66.41 65.49 1w3y h THR 373 Cb 0.33 2.09 -0.03 0.00 -1.74 0.00 0.00 68.15 68.79 1w3y h THR 373 CO 0.01 0.52 0.33 0.40 0.37 0.00 0.00 175.52 177.16 1w3y h ILE 374 N 0.15 1.23 -0.43 3.11 2.04 -1.22 -0.27 117.51 122.11 1w3y h ILE 374 Ca -0.02 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.21 1w3y h ILE 374 Cb 1.07 0.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 1w3y h ILE 374 CO 0.09 0.27 0.26 -0.09 0.00 0.00 0.00 178.15 178.69 1w3y h ARG 375 N 1.00 0.51 -0.55 2.37 9.65 -1.17 -2.34 114.38 123.84 1w3y h ARG 375 Ca 0.24 -0.03 -0.08 0.00 -1.10 0.00 0.00 59.98 59.02 1w3y h ARG 375 Cb 0.11 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.56 1w3y h ARG 375 CO -0.03 0.34 0.05 1.03 2.80 0.00 0.00 179.97 184.16 1w3y h SER 376 N 0.53 0.91 -0.71 -3.80 0.87 -0.79 -2.99 113.55 107.57 1w3y h SER 376 Ca 0.17 -0.28 0.09 0.00 -1.23 0.00 0.00 61.79 60.54 1w3y h SER 376 Cb 0.00 -0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 61.67 1w3y h SER 376 CO -0.07 0.97 0.47 0.40 -0.53 0.00 0.00 176.83 178.06 1w3y h ILE 377 N 0.83 0.95 0.00 2.23 1.08 -0.63 -2.29 117.51 119.68 1w3y h ILE 377 Ca 0.16 -0.22 0.00 0.00 -0.39 0.00 0.00 64.86 64.42 1w3y h ILE 377 Cb 0.47 0.27 0.00 0.00 -3.07 0.00 0.00 36.82 34.48 1w3y h ILE 377 CO 0.02 0.11 0.12 -0.33 -0.69 0.00 0.00 178.15 177.38 1w3y h GLU 378 N 0.63 0.00 0.00 2.37 5.08 -1.28 -1.12 114.58 120.27 1w3y h GLU 378 Ca 0.32 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.67 1w3y h GLU 378 Cb 0.42 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.67 1w3y h GLU 378 CO -0.11 0.00 -0.07 1.96 -1.00 0.00 0.00 179.01 179.79 1w3y h GLN 379 N 0.00 0.00 0.00 2.33 4.20 -1.58 -2.59 115.11 117.47 1w3y h GLN 379 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1w3y h GLN 379 Cb 0.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.02 1w3y h GLN 379 CO 0.00 0.07 0.00 -0.24 -0.67 0.00 0.00 178.83 177.99 1w3y h VAL 380 N 0.00 0.00 -0.00 -0.54 3.04 -1.43 -2.72 116.25 114.59 1w3y h VAL 380 Ca -0.00 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.47 1w3y h VAL 380 Cb 0.22 1.12 0.00 0.00 -2.01 0.00 0.00 31.29 30.62 1w3y h VAL 380 CO 0.01 0.00 -0.14 0.49 -1.01 0.00 0.00 177.57 176.91 1w3y n PHE 381 N -2.88 0.00 -3.02 3.17 3.72 -0.97 -4.90 117.46 112.57 1w3y n PHE 381 Ca -0.01 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.00 1w3y n PHE 381 Cb 0.17 -0.20 -0.06 0.00 -0.94 0.00 0.00 39.48 38.45 1w3y n PHE 381 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1w3y s LYS 382 N -2.54 4.51 0.03 -1.08 1.02 -1.03 -5.01 119.74 115.64 1w3y s LYS 382 Ca 0.26 1.10 -0.29 0.00 0.02 0.00 0.00 55.97 57.06 1w3y s LYS 382 Cb 0.20 -3.26 -0.04 0.00 -0.52 0.00 0.00 37.83 34.20 1w3y s LYS 382 CO 0.50 0.58 0.93 -1.17 -0.92 0.00 0.00 175.35 175.26 1w3y s LEU 383 N -1.12 4.41 0.28 3.17 2.96 -1.26 -4.59 118.68 122.54 1w3y s LEU 383 Ca 0.35 1.64 0.09 0.00 -0.22 0.00 0.00 54.13 55.99 1w3y s LEU 383 Cb -0.23 -3.50 -0.04 0.00 0.50 0.00 0.00 46.19 42.93 1w3y s LEU 383 CO 0.25 -0.16 0.02 0.68 -1.32 0.00 0.00 176.35 175.83 1w3y s VAL 384 N 0.57 3.32 0.00 1.68 -7.23 -0.35 -5.02 120.40 113.37 1w3y s VAL 384 Ca 0.48 -1.88 0.00 0.00 -1.81 0.00 0.00 61.98 58.77 1w3y s VAL 384 Cb -0.21 -2.87 0.00 0.00 0.56 0.00 0.00 36.38 33.86 1w3y s VAL 384 CO 0.27 -0.33 0.74 -0.90 -0.31 0.00 0.00 175.10 174.57 1w3y n ASP 385 N -0.94 1.33 -3.52 4.85 5.75 -1.26 -4.36 116.55 118.40 1w3y n ASP 385 Ca -0.06 -1.55 -0.11 0.00 -0.01 0.00 0.00 54.79 53.06 1w3y n ASP 385 Cb 0.60 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.65 1w3y n ASP 385 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 1w3y s GLN 386 N -0.55 0.84 2.28 0.11 0.74 -1.26 -5.15 119.66 116.66 1w3y s GLN 386 Ca 0.00 -0.07 0.00 0.00 0.05 0.00 0.00 55.36 55.34 1w3y s GLN 386 Cb 0.00 0.39 0.00 0.00 1.10 0.00 0.00 33.01 34.50 1w3y s GLN 386 CO 0.00 -0.32 0.00 0.41 -0.55 0.00 0.00 175.29 174.83 1w3y n GLY 387 N 0.28 -0.90 3.79 2.59 0.00 -1.26 -4.87 105.19 104.82 1w3y n GLY 387 Ca -0.12 -1.19 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 1w3y n GLY 387 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1w3y s GLU 388 N 0.00 4.53 0.00 1.61 2.02 -1.26 -4.72 118.70 120.88 1w3y s GLU 388 Ca 0.00 1.23 0.00 0.00 0.02 0.00 0.00 54.97 56.22 1w3y s GLU 388 Cb 0.00 -2.87 0.00 0.00 0.10 0.00 0.00 34.13 31.36 1w3y s GLU 388 CO 0.00 0.33 0.00 0.41 0.02 0.00 0.00 175.26 176.02 1w3y n GLY 389 N 0.70 0.62 3.81 -1.39 0.00 0.04 -4.91 105.19 104.06 1w3y n GLY 389 Ca 0.00 -2.11 -0.38 0.00 0.00 0.00 0.00 46.02 43.53 1w3y n GLY 389 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1w3y s PHE 390 N -1.06 3.74 0.30 1.61 0.08 -1.26 -1.60 117.98 119.79 1w3y s PHE 390 Ca 0.00 1.14 0.08 0.00 0.12 0.00 0.00 56.93 58.27 1w3y s PHE 390 Cb 0.00 -2.45 -0.04 0.00 -0.57 0.00 0.00 43.02 39.97 1w3y s PHE 390 CO 0.00 0.55 0.17 0.71 -0.10 0.00 0.00 175.22 176.55 1w3y s TYR 391 N -0.85 2.89 0.60 0.36 1.51 -0.19 -1.21 117.35 120.45 1w3y s TYR 391 Ca 0.27 -0.24 0.36 0.00 -1.01 0.00 0.00 57.07 56.45 1w3y s TYR 391 Cb -0.18 -1.52 2.04 0.00 -0.11 0.00 0.00 41.96 42.19 1w3y s TYR 391 CO 0.16 0.41 2.29 -0.56 -1.11 0.00 0.00 175.55 176.74 1w3y h GLN 392 N 1.52 0.00 -0.29 -0.62 3.07 -1.89 -0.46 115.11 116.43 1w3y h GLN 392 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.28 1w3y h GLN 392 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.81 1w3y h GLN 392 CO 0.61 0.01 0.00 -0.40 0.09 0.00 0.00 178.83 179.13 1w3y n ASP 393 N -3.52 2.01 0.00 0.06 5.68 -1.26 -4.91 116.55 114.61 1w3y n ASP 393 Ca -0.03 -1.87 0.00 0.00 -0.50 0.00 0.00 54.79 52.39 1w3y n ASP 393 Cb 0.09 -0.19 0.00 0.00 -1.14 0.00 0.00 41.12 39.88 1w3y n ASP 393 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1w3y n GLY 394 N 1.16 1.30 3.74 6.12 0.00 -0.18 -4.65 105.19 112.68 1w3y n GLY 394 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1w3y n GLY 394 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1w3y s SER 395 N -1.99 4.68 -0.08 1.61 0.01 -1.26 -4.35 113.70 112.32 1w3y s SER 395 Ca 0.00 2.48 -0.01 0.00 1.31 0.00 0.00 55.95 59.73 1w3y s SER 395 Cb 0.00 -2.60 0.03 0.00 0.21 0.00 0.00 66.02 63.65 1w3y s SER 395 CO 0.00 -1.94 -0.03 -0.47 0.41 0.00 0.00 173.24 171.21 1w3y s TYR 396 N -1.61 0.94 -0.05 2.43 6.14 -1.26 -1.03 117.35 122.92 1w3y s TYR 396 Ca 0.79 -0.36 0.02 0.00 0.64 0.00 0.00 57.07 58.16 1w3y s TYR 396 Cb -0.33 -0.94 -0.03 0.00 0.42 0.00 0.00 41.96 41.08 1w3y s TYR 396 CO 0.39 -0.38 -0.09 0.42 0.64 0.00 0.00 175.55 176.53 1w3y s ILE 397 N 1.83 3.50 0.22 3.14 -1.09 -0.62 -1.32 121.20 126.86 1w3y s ILE 397 Ca 0.04 -0.59 -0.04 0.00 -2.23 0.00 0.00 60.65 57.83 1w3y s ILE 397 Cb -0.12 -2.43 -0.03 0.00 -1.58 0.00 0.00 42.46 38.30 1w3y s ILE 397 CO -0.06 0.57 0.23 -0.62 -1.23 0.00 0.00 174.94 173.83 1w3y s ASP 398 N -0.87 0.15 -1.32 3.58 -1.08 -0.66 -0.78 116.67 115.69 1w3y s ASP 398 Ca 0.13 -1.29 -0.02 0.00 -0.52 0.00 0.00 52.55 50.85 1w3y s ASP 398 Cb -0.11 0.44 -0.00 0.00 -1.46 0.00 0.00 42.92 41.79 1w3y s ASP 398 CO 0.02 -0.93 0.60 1.41 0.52 0.00 0.00 175.17 176.79 1w3y n HIS 399 N -0.31 -1.82 0.00 -5.34 8.25 -1.26 -1.53 115.22 113.21 1w3y n HIS 399 Ca 0.01 0.77 0.00 0.00 -0.26 0.00 0.00 57.72 58.24 1w3y n HIS 399 Cb 0.65 -4.06 0.00 0.00 1.12 0.00 0.00 29.99 27.70 1w3y n HIS 399 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1w3y n THR 400 N -4.29 0.00 -2.60 1.59 -1.04 -1.26 -3.96 114.28 102.71 1w3y n THR 400 Ca -0.28 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.71 1w3y n THR 400 Cb 0.67 0.00 0.07 0.00 -1.82 0.00 0.00 70.33 69.25 1w3y n THR 400 CO 0.00 0.00 0.00 -0.46 -0.64 0.00 0.00 175.07 173.97 1w3y n ASN 401 N 2.30 -0.37 -4.41 8.00 6.94 -1.21 -4.53 115.26 121.97 1w3y n ASN 401 Ca 0.00 -2.11 -0.33 0.00 -0.02 0.00 0.00 54.58 52.11 1w3y n ASN 401 Cb 0.00 0.23 -0.14 0.00 -2.36 0.00 0.00 39.78 37.52 1w3y n ASN 401 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1w3y s VAL 402 N -0.97 3.20 0.08 3.53 1.01 -0.58 -1.12 120.40 125.54 1w3y s VAL 402 Ca 0.15 -0.62 -0.31 0.00 0.00 0.00 0.00 61.98 61.20 1w3y s VAL 402 Cb 0.34 -2.34 -0.09 0.00 0.00 0.00 0.00 36.38 34.30 1w3y s VAL 402 CO -0.09 0.53 1.75 0.00 0.00 0.00 0.00 175.10 177.30 1w3y s ALA 403 N 0.13 3.70 0.00 5.51 0.00 -1.26 -1.65 121.76 128.19 1w3y s ALA 403 Ca -0.06 1.29 0.11 0.00 0.00 0.00 0.00 51.96 53.30 1w3y s ALA 403 Cb -0.15 -3.74 0.18 0.00 0.00 0.00 0.00 23.12 19.41 1w3y s ALA 403 CO 0.04 -1.22 1.00 0.66 0.00 0.00 0.00 175.76 176.25 1w3y n TYR 404 N 5.93 0.00 -0.35 0.00 4.01 -0.44 -4.41 117.16 121.91 1w3y n TYR 404 Ca 0.17 -0.30 0.08 0.00 -0.16 0.00 0.00 57.90 57.69 1w3y n TYR 404 Cb 0.40 0.06 0.25 0.00 -0.31 0.00 0.00 39.34 39.74 1w3y n TYR 404 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 1w3y h THR 405 N 6.35 0.84 0.00 -0.72 2.02 -1.63 -2.44 112.91 117.33 1w3y h THR 405 Ca -0.21 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1w3y h THR 405 Cb 1.55 -0.11 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 1w3y h THR 405 CO -0.02 0.16 0.00 0.61 0.37 0.00 0.00 175.52 176.64 1w3y n GLY 406 N -1.34 -0.96 1.91 2.16 0.00 0.46 -2.54 105.19 104.89 1w3y n GLY 406 Ca 0.19 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1w3y n GLY 406 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w3y n ALA 407 N -0.65 3.00 0.12 4.61 0.00 -1.04 -4.58 120.51 121.96 1w3y n ALA 407 Ca 0.07 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.48 1w3y n ALA 407 Cb 0.03 0.01 0.10 0.00 0.00 0.00 0.00 19.45 19.59 1w3y n ALA 407 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1w3y h TYR 408 N 0.00 0.00 -0.60 0.00 0.05 -1.71 -2.21 116.97 112.50 1w3y h TYR 408 Ca 0.00 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.69 1w3y h TYR 408 Cb 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 1w3y h TYR 408 CO 0.00 0.71 0.03 0.78 -1.05 0.00 0.00 178.16 178.63 1w3y h GLY 409 N 2.17 1.13 0.65 3.88 0.00 -1.17 -1.64 103.07 108.08 1w3y h GLY 409 Ca -0.01 -0.80 0.04 0.00 0.00 0.00 0.00 47.33 46.56 1w3y h GLY 409 CO 0.09 0.74 0.03 3.43 0.00 0.00 0.00 176.54 180.83 1w3y h ASN 410 N 0.94 -0.04 -0.68 0.19 4.21 -1.19 -1.62 115.58 117.39 1w3y h ASN 410 Ca 0.17 0.05 0.04 0.00 1.21 0.00 0.00 56.30 57.77 1w3y h ASN 410 Cb 0.52 0.08 -0.05 0.00 -1.12 0.00 0.00 38.32 37.75 1w3y h ASN 410 CO 0.02 0.01 0.42 0.58 -1.29 0.00 0.00 177.43 177.18 1w3y h VAL 411 N 0.12 1.06 0.22 2.81 2.07 -1.15 0.20 116.25 121.59 1w3y h VAL 411 Ca 0.12 -0.28 0.01 0.00 0.82 0.00 0.00 66.70 67.37 1w3y h VAL 411 Cb 0.14 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1w3y h VAL 411 CO -0.18 0.15 -0.24 0.25 0.02 0.00 0.00 177.57 177.56 1w3y h LEU 412 N 0.80 -0.66 -0.29 2.57 6.46 -0.63 0.16 115.31 123.72 1w3y h LEU 412 Ca 0.28 0.06 -0.20 0.00 -0.12 0.00 0.00 57.88 57.90 1w3y h LEU 412 Cb 0.06 0.23 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1w3y h LEU 412 CO -0.12 -0.35 -0.79 -0.29 -0.62 0.00 0.00 178.44 176.26 1w3y h ILE 413 N -0.51 1.35 0.08 4.05 2.10 -1.12 -0.89 117.51 122.58 1w3y h ILE 413 Ca 0.00 -2.15 -0.00 0.00 1.08 0.00 0.00 64.86 63.78 1w3y h ILE 413 Cb 0.48 2.14 0.00 0.00 -1.09 0.00 0.00 36.82 38.35 1w3y h ILE 413 CO -0.07 0.66 -0.04 -0.78 -1.08 0.00 0.00 178.15 176.84 1w3y h ASP 414 N 0.34 -0.10 -0.39 2.19 3.58 -0.53 -1.81 116.42 119.70 1w3y h ASP 414 Ca -0.05 -0.20 -0.15 0.00 0.42 0.00 0.00 57.03 57.05 1w3y h ASP 414 Cb 1.39 0.02 -0.01 0.00 1.72 0.00 0.00 39.33 42.46 1w3y h ASP 414 CO 0.14 0.15 -0.35 1.23 -2.88 0.00 0.00 179.24 177.53 1w3y h GLY 415 N -0.35 1.01 1.17 -0.78 0.00 -0.75 -3.07 103.07 100.30 1w3y h GLY 415 Ca -0.01 -1.01 -0.09 0.00 0.00 0.00 0.00 47.33 46.21 1w3y h GLY 415 CO 0.02 0.92 -0.01 -2.00 0.00 0.00 0.00 176.54 175.46 1w3y h LEU 416 N 0.75 0.97 -1.68 3.11 5.85 -1.18 -2.29 115.31 120.84 1w3y h LEU 416 Ca 0.07 -0.27 -0.04 0.00 0.84 0.00 0.00 57.88 58.48 1w3y h LEU 416 Cb 0.95 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.71 1w3y h LEU 416 CO 0.09 1.03 -0.19 0.77 -0.34 0.00 0.00 178.44 179.80 1w3y h SER 417 N 0.91 0.00 -0.02 1.25 4.64 -1.35 -0.65 113.55 118.33 1w3y h SER 417 Ca 0.16 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.23 1w3y h SER 417 Cb 0.54 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.65 1w3y h SER 417 CO 0.03 0.19 -0.97 1.56 -0.87 0.00 0.00 176.83 176.77 1w3y h GLN 418 N 0.00 0.69 -0.08 4.77 4.20 -1.36 -3.35 115.11 119.98 1w3y h GLN 418 Ca -0.00 -0.72 -0.21 0.00 0.06 0.00 0.00 58.65 57.78 1w3y h GLN 418 Cb 0.41 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.39 1w3y h GLN 418 CO 0.02 1.30 -0.79 -0.07 -0.67 0.00 0.00 178.83 178.62 1w3y h LEU 419 N 0.37 0.63 -0.71 1.46 3.38 -0.98 -3.38 115.31 116.07 1w3y h LEU 419 Ca -0.12 -0.43 0.16 0.00 0.09 0.00 0.00 57.88 57.58 1w3y h LEU 419 Cb 1.63 -0.19 -0.13 0.00 0.09 0.00 0.00 40.66 42.06 1w3y h LEU 419 CO 0.19 1.20 -0.03 -0.07 0.09 0.00 0.00 178.44 179.82 1w3y h LEU 420 N 0.34 -0.38 -1.73 1.67 3.38 -1.27 -0.44 115.31 116.89 1w3y h LEU 420 Ca -0.05 0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1w3y h LEU 420 Cb 1.40 0.34 -0.02 0.00 0.09 0.00 0.00 40.66 42.47 1w3y h LEU 420 CO 0.14 -0.17 0.26 -0.65 0.09 0.00 0.00 178.44 178.11 1w3y h PRO 421 N 0.09 0.34 0.02 1.13 0.11 -1.79 -0.81 132.00 131.10 1w3y h PRO 421 Ca 0.38 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 66.47 1w3y h PRO 421 Cb 0.64 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 31.68 1w3y h PRO 421 CO -0.64 0.22 -0.01 0.28 -0.21 0.00 0.00 178.00 177.64 1w3y h VAL 422 N 0.35 1.45 -0.71 3.15 2.07 -1.37 -3.32 116.25 117.87 1w3y h VAL 422 Ca 0.16 -1.78 0.09 0.00 0.82 0.00 0.00 66.70 65.99 1w3y h VAL 422 Cb 0.22 2.60 -0.07 0.00 -1.52 0.00 0.00 31.29 32.52 1w3y h VAL 422 CO -0.04 0.44 0.36 0.40 0.02 0.00 0.00 177.57 178.75 1w3y h ILE 423 N -0.84 0.87 0.00 4.57 2.04 -0.89 -1.46 117.51 121.80 1w3y h ILE 423 Ca -0.00 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 65.64 1w3y h ILE 423 Cb 0.74 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 37.01 1w3y h ILE 423 CO 0.01 0.11 0.00 0.00 0.00 0.00 0.00 178.15 178.27 1w3y n GLN 424 N -4.84 0.09 -0.03 2.37 1.13 -0.33 -1.66 117.38 114.10 1w3y n GLN 424 Ca 0.11 0.44 0.09 0.00 -1.94 0.00 0.00 57.00 55.70 1w3y n GLN 424 Cb 0.26 -1.71 0.10 0.00 0.11 0.00 0.00 30.24 28.99 1w3y n GLN 424 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1w3y n LYS 425 N -1.88 1.70 -2.34 -1.09 5.02 -0.56 -4.76 118.16 114.25 1w3y n LYS 425 Ca 0.01 -1.69 -0.26 0.00 -2.02 0.00 0.00 58.31 54.35 1w3y n LYS 425 Cb 0.12 -1.37 0.14 0.00 -0.02 0.00 0.00 35.03 33.90 1w3y n LYS 425 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1w3y s THR 426 N -1.49 2.06 -2.03 -0.18 -4.23 -0.66 -4.95 115.64 104.15 1w3y s THR 426 Ca 0.23 -0.37 0.14 0.00 -1.18 0.00 0.00 61.69 60.51 1w3y s THR 426 Cb 0.16 -2.69 0.38 0.00 1.34 0.00 0.00 72.50 71.69 1w3y s THR 426 CO 0.24 0.00 1.50 0.29 -0.54 0.00 0.00 174.62 176.11 1w3y n LYS 427 N -3.21 1.12 -2.60 3.99 5.02 -1.26 -3.70 118.16 117.53 1w3y n LYS 427 Ca 0.15 -0.19 -0.16 0.00 -2.02 0.00 0.00 58.31 56.10 1w3y n LYS 427 Cb 0.60 -1.23 0.02 0.00 -0.02 0.00 0.00 35.03 34.40 1w3y n LYS 427 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1w3y n ASN 428 N -0.53 2.76 -4.72 4.39 5.03 -1.26 -5.11 115.26 115.82 1w3y n ASN 428 Ca 0.11 -3.13 -0.36 0.00 0.87 0.00 0.00 54.58 52.07 1w3y n ASN 428 Cb 0.09 -0.50 0.09 0.00 -1.02 0.00 0.00 39.78 38.43 1w3y n ASN 428 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1w3y s PRO 429 N -3.28 2.25 -0.05 3.52 0.04 -1.24 -4.91 135.00 131.32 1w3y s PRO 429 Ca 0.36 1.95 -0.24 0.00 0.04 0.00 0.00 61.00 63.11 1w3y s PRO 429 Cb 0.43 -1.82 -0.04 0.00 0.04 0.00 0.00 34.50 33.11 1w3y s PRO 429 CO -0.06 -1.80 0.71 0.42 0.04 0.00 0.00 177.00 176.32 1w3y s ILE 430 N -1.66 5.01 -0.23 0.56 1.01 -1.26 -4.98 121.20 119.64 1w3y s ILE 430 Ca 0.79 1.48 -0.40 0.00 0.00 0.00 0.00 60.65 62.52 1w3y s ILE 430 Cb -0.34 -4.05 -0.16 0.00 0.01 0.00 0.00 42.46 37.91 1w3y s ILE 430 CO 0.43 0.27 1.66 0.47 0.00 0.00 0.00 174.94 177.77 1w3y n ASP 431 N 3.64 2.16 -3.51 3.58 8.00 -1.26 -4.77 116.55 124.39 1w3y n ASP 431 Ca -0.01 1.09 -0.37 0.00 0.71 0.00 0.00 54.79 56.20 1w3y n ASP 431 Cb 0.51 -1.13 -0.04 0.00 -0.02 0.00 0.00 41.12 40.45 1w3y n ASP 431 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1w3y n LYS 432 N 4.80 1.90 0.00 -1.24 4.81 -1.26 -2.71 118.16 124.47 1w3y n LYS 432 Ca 0.25 -1.85 0.00 0.00 -0.87 0.00 0.00 58.31 55.85 1w3y n LYS 432 Cb 0.12 -2.84 0.00 0.00 0.02 0.00 0.00 35.03 32.34 1w3y n LYS 432 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1w3y n ASP 433 N 6.30 0.00 -0.09 3.14 -0.08 -1.26 -4.78 116.55 119.78 1w3y n ASP 433 Ca 0.50 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.91 1w3y n ASP 433 Cb 0.32 0.00 0.58 0.00 2.34 0.00 0.00 41.12 44.36 1w3y n ASP 433 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1w3y n LYS 434 N -0.19 0.52 0.18 -0.67 5.02 -1.10 -3.11 118.16 118.81 1w3y n LYS 434 Ca 0.00 -0.17 0.05 0.00 -2.02 0.00 0.00 58.31 56.17 1w3y n LYS 434 Cb 0.00 -1.50 0.26 0.00 -0.02 0.00 0.00 35.03 33.77 1w3y n LYS 434 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1w3y h MET 435 N 0.42 0.00 -0.07 1.97 2.86 -1.86 -1.82 114.93 116.43 1w3y h MET 435 Ca 0.00 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.55 1w3y h MET 435 Cb 0.39 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 1w3y h MET 435 CO 0.00 0.39 -0.35 1.96 1.06 0.00 0.00 176.91 179.96 1w3y h GLN 436 N 0.00 0.13 -0.22 1.72 1.08 -1.91 -1.02 115.11 114.89 1w3y h GLN 436 Ca -0.00 -0.05 -0.15 0.00 -1.45 0.00 0.00 58.65 56.99 1w3y h GLN 436 Cb 1.03 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.44 1w3y h GLN 436 CO 0.05 0.47 -0.48 1.15 -0.95 0.00 0.00 178.83 179.07 1w3y h THR 437 N 0.12 1.31 -0.51 -0.54 2.02 -1.50 -2.18 112.91 111.63 1w3y h THR 437 Ca 0.01 -1.70 -0.13 0.00 0.77 0.00 0.00 66.41 65.37 1w3y h THR 437 Cb 0.69 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.74 1w3y h THR 437 CO 0.05 0.53 -0.18 0.24 0.37 0.00 0.00 175.52 176.54 1w3y h MET 438 N 0.47 1.01 -0.23 6.66 2.86 -0.82 -2.03 114.93 122.85 1w3y h MET 438 Ca 0.02 -0.41 -0.03 0.00 -2.06 0.00 0.00 59.70 57.22 1w3y h MET 438 Cb 1.02 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1w3y h MET 438 CO 0.09 1.09 -0.00 1.88 1.06 0.00 0.00 176.91 181.03 1w3y h TYR 439 N 0.88 0.34 -0.37 -0.22 0.05 -1.05 -1.92 116.97 114.69 1w3y h TYR 439 Ca 0.12 -0.02 -0.13 0.00 0.05 0.00 0.00 58.73 58.74 1w3y h TYR 439 Cb 0.75 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.38 1w3y h TYR 439 CO 0.05 0.36 -0.30 1.25 -1.05 0.00 0.00 178.16 178.47 1w3y h HIS 440 N 0.33 1.01 -0.24 4.88 2.76 -0.99 -2.26 115.15 120.64 1w3y h HIS 440 Ca 0.08 -0.29 0.03 0.00 -2.20 0.00 0.00 60.37 57.99 1w3y h HIS 440 Cb 0.23 -0.22 -0.03 0.00 1.55 0.00 0.00 27.41 28.94 1w3y h HIS 440 CO 0.01 1.08 0.04 -1.49 -1.30 0.00 0.00 177.93 176.27 1w3y h TRP 441 N 0.65 0.07 -0.21 5.26 6.55 -0.68 0.19 115.95 127.78 1w3y h TRP 441 Ca 0.07 0.01 0.05 0.00 0.95 0.00 0.00 58.89 59.97 1w3y h TRP 441 Cb 0.88 0.00 -0.05 0.00 -0.86 0.00 0.00 29.16 29.13 1w3y h TRP 441 CO 0.06 0.02 -0.09 0.82 -1.05 0.00 0.00 178.44 178.21 1w3y h ILE 442 N 0.14 0.71 -0.06 1.49 2.04 -1.25 0.25 117.51 120.82 1w3y h ILE 442 Ca 0.11 0.00 -0.21 0.00 1.00 0.00 0.00 64.86 65.77 1w3y h ILE 442 Cb 0.11 0.71 0.01 0.00 -0.74 0.00 0.00 36.82 36.91 1w3y h ILE 442 CO -0.15 0.00 -0.76 0.44 0.00 0.00 0.00 178.15 177.68 1w3y h ASP 443 N -0.05 0.78 0.33 1.72 3.32 -1.15 -0.17 116.42 121.20 1w3y h ASP 443 Ca 0.11 -0.69 -0.33 0.00 0.02 0.00 0.00 57.03 56.14 1w3y h ASP 443 Cb 0.22 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1w3y h ASP 443 CO -0.25 1.36 -1.71 0.50 -1.72 0.00 0.00 179.24 177.42 1w3y h LYS 444 N 0.26 0.25 0.00 3.56 1.63 -0.60 -3.40 116.57 118.27 1w3y h LYS 444 Ca -0.08 -0.42 -0.40 0.00 -0.85 0.00 0.00 60.65 58.91 1w3y h LYS 444 Cb 1.42 0.16 -0.07 0.00 -0.60 0.00 0.00 32.23 33.14 1w3y h LYS 444 CO 0.15 1.09 -2.42 0.43 -3.45 0.00 0.00 179.45 175.26 1w3y n SER 445 N -3.43 1.99 -0.09 4.20 7.64 0.80 -4.66 113.62 120.08 1w3y n SER 445 Ca -0.22 0.06 -0.17 0.00 1.01 0.00 0.00 58.87 59.55 1w3y n SER 445 Cb 1.05 -0.55 -0.10 0.00 -1.01 0.00 0.00 64.21 63.61 1w3y n SER 445 CO 0.00 0.00 0.00 -0.26 -3.01 0.00 0.00 175.04 171.77 1w3y h PHE 446 N -0.40 0.00 -0.75 1.43 0.04 -1.35 -3.40 116.94 112.51 1w3y h PHE 446 Ca -0.59 0.00 0.17 0.00 2.80 0.00 0.00 57.97 60.34 1w3y h PHE 446 Cb 1.73 0.00 -0.11 0.00 2.20 0.00 0.00 35.95 39.77 1w3y h PHE 446 CO -0.02 1.15 0.16 0.00 -0.60 0.00 0.00 178.31 179.01 1w3y h ALA 447 N -0.50 0.96 -0.03 2.45 0.00 -1.23 -1.03 119.26 119.88 1w3y h ALA 447 Ca -0.23 0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1w3y h ALA 447 Cb 1.10 0.26 -0.00 0.00 0.00 0.00 0.00 17.79 19.14 1w3y h ALA 447 CO -0.14 -0.36 0.03 -1.35 0.00 0.00 0.00 179.25 177.43 1w3y h PRO 448 N 0.24 0.00 -0.04 0.00 0.11 -1.79 -1.86 132.00 128.67 1w3y h PRO 448 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 1w3y h PRO 448 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 1w3y h PRO 448 CO -0.54 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.53 1w3y n LEU 449 N -4.22 0.81 -4.35 2.35 4.77 -0.39 -4.75 117.00 111.21 1w3y n LEU 449 Ca -0.02 -0.30 -0.37 0.00 -0.03 0.00 0.00 56.01 55.29 1w3y n LEU 449 Cb 0.12 -0.02 -0.13 0.00 -2.33 0.00 0.00 43.42 41.06 1w3y n LEU 449 CO 0.31 0.15 -0.28 -0.76 -1.33 0.00 0.00 177.39 175.48 1w3y s LEU 450 N -1.83 3.78 -0.15 2.23 1.43 -0.70 -0.88 118.68 122.56 1w3y s LEU 450 Ca 0.38 -0.67 -0.00 0.00 -1.03 0.00 0.00 54.13 52.80 1w3y s LEU 450 Cb 0.19 -1.87 0.03 0.00 0.03 0.00 0.00 46.19 44.57 1w3y s LEU 450 CO 0.31 -0.17 -0.08 -0.69 0.23 0.00 0.00 176.35 175.94 1w3y s VAL 451 N 1.50 1.22 -1.54 -1.59 1.01 -0.22 -4.78 120.40 116.00 1w3y s VAL 451 Ca 0.03 -0.56 -0.14 0.00 0.00 0.00 0.00 61.98 61.31 1w3y s VAL 451 Cb -0.17 -1.29 0.09 0.00 0.00 0.00 0.00 36.38 35.02 1w3y s VAL 451 CO 0.02 0.27 0.90 0.59 0.00 0.00 0.00 175.10 176.88 1w3y n ASN 452 N 4.86 -4.56 0.00 3.32 3.02 -1.26 -1.34 115.26 119.29 1w3y n ASN 452 Ca -0.13 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 53.66 1w3y n ASN 452 Cb 0.49 -3.66 0.00 0.00 -0.61 0.00 0.00 39.78 35.99 1w3y n ASN 452 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1w3y n GLY 453 N -1.59 0.84 3.63 7.41 0.00 -1.26 -4.28 105.19 109.94 1w3y n GLY 453 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 1w3y n GLY 453 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1w3y s GLU 454 N -0.23 3.08 -0.31 1.61 2.12 -0.45 -4.35 118.70 120.17 1w3y s GLU 454 Ca 0.00 -0.45 -0.17 0.00 0.36 0.00 0.00 54.97 54.71 1w3y s GLU 454 Cb 0.00 -2.79 -0.02 0.00 0.26 0.00 0.00 34.13 31.59 1w3y s GLU 454 CO 0.00 0.60 0.44 -1.17 -0.54 0.00 0.00 175.26 174.60 1w3y s LEU 455 N -0.62 4.23 -0.30 2.70 2.96 -0.70 -1.05 118.68 125.89 1w3y s LEU 455 Ca 0.10 0.11 -0.39 0.00 -0.22 0.00 0.00 54.13 53.73 1w3y s LEU 455 Cb -0.12 -2.50 -0.15 0.00 0.50 0.00 0.00 46.19 43.92 1w3y s LEU 455 CO 0.02 -0.34 1.86 0.23 -1.32 0.00 0.00 176.35 176.80 1w3y n MET 456 N 5.52 1.11 0.05 1.98 2.81 -0.06 -4.66 117.12 123.88 1w3y n MET 456 Ca -0.07 0.39 0.20 0.00 -1.81 0.00 0.00 57.70 56.41 1w3y n MET 456 Cb 0.50 -2.15 0.72 0.00 -0.71 0.00 0.00 33.22 31.58 1w3y n MET 456 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1w3y h ASP 457 N 8.32 0.00 0.26 7.83 3.32 -1.94 -1.71 116.42 132.50 1w3y h ASP 457 Ca -0.41 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.64 1w3y h ASP 457 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1w3y h ASP 457 CO 0.98 0.00 0.00 1.15 -1.72 0.00 0.00 179.24 179.65 1w3y n MET 458 N -4.16 0.01 -0.03 3.56 0.00 -1.26 -1.54 117.12 113.69 1w3y n MET 458 Ca 0.08 0.38 0.07 0.00 0.00 0.00 0.00 57.70 58.23 1w3y n MET 458 Cb 0.56 -1.52 0.08 0.00 0.00 0.00 0.00 33.22 32.35 1w3y n MET 458 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 1w3y n SER 459 N -1.53 2.34 -1.17 3.17 3.41 -0.64 -4.58 113.62 114.62 1w3y n SER 459 Ca 0.02 -1.66 0.12 0.00 -0.26 0.00 0.00 58.87 57.09 1w3y n SER 459 Cb 0.09 -0.04 0.23 0.00 -0.26 0.00 0.00 64.21 64.23 1w3y n SER 459 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1w3y n ARG 460 N 0.82 2.52 0.00 4.33 1.74 -0.59 -0.40 116.66 125.08 1w3y n ARG 460 Ca 0.09 -2.30 0.00 0.00 -0.77 0.00 0.00 57.85 54.88 1w3y n ARG 460 Cb 0.38 -1.52 0.00 0.00 -1.02 0.00 0.00 32.46 30.30 1w3y n ARG 460 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1w3y n GLY 461 N 1.52 2.65 0.00 -0.13 0.00 -1.26 -1.67 105.19 106.30 1w3y n GLY 461 Ca 0.20 -0.17 0.09 0.00 0.00 0.00 0.00 46.02 46.13 1w3y n GLY 461 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1w3y n ARG 462 N 14.00 0.13 0.06 1.61 1.85 -1.26 -3.25 116.66 129.80 1w3y n ARG 462 Ca 0.00 0.15 0.09 0.00 -1.00 0.00 0.00 57.85 57.09 1w3y n ARG 462 Cb 0.00 -1.50 0.38 0.00 -1.05 0.00 0.00 32.46 30.29 1w3y n ARG 462 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1w3y n SER 463 N -1.40 0.30 0.27 2.89 7.64 -0.67 -2.24 113.62 120.40 1w3y n SER 463 Ca 0.07 0.58 0.18 0.00 1.01 0.00 0.00 58.87 60.70 1w3y n SER 463 Cb 0.18 -0.64 0.80 0.00 -1.01 0.00 0.00 64.21 63.54 1w3y n SER 463 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 1w3y h ILE 464 N 0.00 0.00 -0.33 0.44 3.07 -1.71 -2.55 117.51 116.43 1w3y h ILE 464 Ca 0.00 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 66.09 1w3y h ILE 464 Cb 0.28 1.25 0.00 0.00 -0.27 0.00 0.00 36.82 38.08 1w3y h ILE 464 CO 0.00 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.56 1w3y n SER 465 N -2.94 2.04 -4.49 2.16 3.41 -0.95 -4.81 113.62 108.04 1w3y n SER 465 Ca -0.00 -2.06 -0.37 0.00 -0.26 0.00 0.00 58.87 56.18 1w3y n SER 465 Cb 0.22 -0.28 -0.12 0.00 -0.26 0.00 0.00 64.21 63.77 1w3y n SER 465 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1w3y s ARG 466 N -1.58 3.73 0.43 4.33 0.52 -0.96 -4.61 118.95 120.81 1w3y s ARG 466 Ca 0.23 -0.44 0.09 0.00 -0.52 0.00 0.00 55.73 55.09 1w3y s ARG 466 Cb 0.13 -3.37 0.95 0.00 0.52 0.00 0.00 34.95 33.18 1w3y s ARG 466 CO 0.14 -0.14 2.08 0.00 0.02 0.00 0.00 175.30 177.40 1w3y h ALA 467 N 8.11 1.77 -0.32 2.13 0.00 -1.89 -2.21 119.26 126.86 1w3y h ALA 467 Ca -0.37 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1w3y h ALA 467 Cb 1.18 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1w3y h ALA 467 CO 0.58 0.21 0.00 0.27 0.00 0.00 0.00 179.25 180.32 1w3y n ASN 468 N -4.49 1.91 -2.52 0.00 6.94 -1.26 -4.21 115.26 111.64 1w3y n ASN 468 Ca 0.02 -1.93 -0.13 0.00 -0.02 0.00 0.00 54.58 52.53 1w3y n ASN 468 Cb 0.07 -0.21 0.03 0.00 -2.36 0.00 0.00 39.78 37.31 1w3y n ASN 468 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1w3y n SER 469 N 0.52 2.97 -4.68 0.53 7.64 -0.83 -4.87 113.62 114.91 1w3y n SER 469 Ca 0.13 -2.89 -0.29 0.00 1.01 0.00 0.00 58.87 56.83 1w3y n SER 469 Cb 0.32 -0.45 0.17 0.00 -1.01 0.00 0.00 64.21 63.24 1w3y n SER 469 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1w3y s GLU 470 N -3.58 0.67 0.25 1.43 2.02 -1.25 -4.45 118.70 113.79 1w3y s GLU 470 Ca 0.37 0.70 -0.07 0.00 0.02 0.00 0.00 54.97 55.99 1w3y s GLU 470 Cb 0.38 -1.75 0.42 0.00 0.10 0.00 0.00 34.13 33.29 1w3y s GLU 470 CO -0.02 -2.61 1.41 0.41 0.02 0.00 0.00 175.26 174.46 1w3y n GLY 471 N -0.90 -1.51 0.15 -1.39 0.00 -1.26 -1.31 105.19 98.97 1w3y n GLY 471 Ca 0.06 0.96 -0.03 0.00 0.00 0.00 0.00 46.02 47.02 1w3y n GLY 471 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1w3y h HIS 472 N 0.00 0.11 -0.02 1.61 3.86 -1.88 -1.72 115.15 117.11 1w3y h HIS 472 Ca 0.44 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.59 1w3y h HIS 472 Cb 0.67 -0.02 -0.00 0.00 1.06 0.00 0.00 27.41 29.12 1w3y h HIS 472 CO -0.69 0.67 -0.04 0.28 0.86 0.00 0.00 177.93 179.02 1w3y h VAL 473 N 0.06 1.43 -0.67 2.45 2.07 -1.50 -3.15 116.25 116.94 1w3y h VAL 473 Ca -0.01 -1.33 0.04 0.00 0.82 0.00 0.00 66.70 66.23 1w3y h VAL 473 Cb 1.09 2.28 -0.04 0.00 -1.52 0.00 0.00 31.29 33.11 1w3y h VAL 473 CO 0.08 0.35 0.44 0.00 0.02 0.00 0.00 177.57 178.47 1w3y h ALA 474 N 0.46 1.67 -0.55 1.67 0.00 -1.28 -1.80 119.26 119.43 1w3y h ALA 474 Ca 0.00 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.95 1w3y h ALA 474 Cb 0.59 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 1w3y h ALA 474 CO 0.01 0.24 0.37 0.00 0.00 0.00 0.00 179.25 179.87 1w3y h ALA 475 N 1.62 1.92 0.00 0.00 0.00 -1.37 -1.80 119.26 119.62 1w3y h ALA 475 Ca 0.27 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.13 1w3y h ALA 475 Cb 0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1w3y h ALA 475 CO -0.08 -0.02 -0.17 0.28 0.00 0.00 0.00 179.25 179.26 1w3y h VAL 476 N 0.46 1.08 -0.72 0.00 2.07 -1.34 -1.06 116.25 116.75 1w3y h VAL 476 Ca 0.24 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 67.14 1w3y h VAL 476 Cb 0.36 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1w3y h VAL 476 CO -0.07 0.17 0.37 -0.33 0.02 0.00 0.00 177.57 177.74 1w3y h GLU 477 N 0.00 1.00 -0.02 1.57 5.08 -1.43 0.17 114.58 120.94 1w3y h GLU 477 Ca -0.00 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 1w3y h GLU 477 Cb 0.32 -0.20 0.01 0.00 0.50 0.00 0.00 28.75 29.38 1w3y h GLU 477 CO 0.02 0.75 -0.41 0.28 -1.00 0.00 0.00 179.01 178.65 1w3y h VAL 478 N 1.00 1.46 -0.80 3.13 2.07 -1.41 -3.00 116.25 118.71 1w3y h VAL 478 Ca 0.25 -1.93 0.00 0.00 0.82 0.00 0.00 66.70 65.84 1w3y h VAL 478 Cb 0.05 2.57 -0.04 0.00 -1.52 0.00 0.00 31.29 32.35 1w3y h VAL 478 CO -0.04 0.55 0.50 -0.07 0.02 0.00 0.00 177.57 178.53 1w3y h LEU 479 N -0.24 0.94 -1.12 2.57 3.38 -0.96 -1.10 115.31 118.77 1w3y h LEU 479 Ca -0.04 -0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1w3y h LEU 479 Cb 1.11 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.61 1w3y h LEU 479 CO 0.08 0.71 -0.43 0.08 0.09 0.00 0.00 178.44 178.97 1w3y h ARG 480 N 1.09 0.00 -0.46 1.13 0.11 -1.06 -0.79 114.38 114.40 1w3y h ARG 480 Ca 0.29 0.00 -0.12 0.00 0.10 0.00 0.00 59.98 60.25 1w3y h ARG 480 Cb -0.08 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 30.99 1w3y h ARG 480 CO -0.06 0.43 -0.18 0.78 0.10 0.00 0.00 179.97 181.04 1w3y h GLY 481 N 1.40 1.02 0.93 0.08 0.00 -1.24 -2.20 103.07 103.07 1w3y h GLY 481 Ca -0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 47.33 46.39 1w3y h GLY 481 CO 0.06 0.81 0.06 -2.22 0.00 0.00 0.00 176.54 175.25 1w3y h ILE 482 N 0.79 1.24 -0.11 2.60 2.04 -0.69 -1.88 117.51 121.50 1w3y h ILE 482 Ca 0.11 -0.86 -0.05 0.00 1.00 0.00 0.00 64.86 65.05 1w3y h ILE 482 Cb 0.75 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.86 1w3y h ILE 482 CO 0.06 0.29 -0.18 -0.74 0.00 0.00 0.00 178.15 177.59 1w3y h HIS 483 N 0.50 0.19 -0.19 1.37 2.76 -1.09 0.16 115.15 118.85 1w3y h HIS 483 Ca 0.12 -0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.11 1w3y h HIS 483 Cb 0.37 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.28 1w3y h HIS 483 CO 0.02 0.35 -0.48 0.00 -1.30 0.00 0.00 177.93 176.53 1w3y h ARG 484 N 0.17 0.67 -0.53 5.26 3.08 -1.20 -1.94 114.38 119.89 1w3y h ARG 484 Ca 0.03 -0.46 -0.06 0.00 0.07 0.00 0.00 59.98 59.57 1w3y h ARG 484 Cb 0.42 0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.51 1w3y h ARG 484 CO 0.03 1.08 0.09 0.82 -1.07 0.00 0.00 179.97 180.92 1w3y h ILE 485 N 0.36 1.23 -0.70 2.04 2.04 -0.85 -1.98 117.51 119.65 1w3y h ILE 485 Ca -0.00 -0.87 -0.05 0.00 1.00 0.00 0.00 64.86 64.93 1w3y h ILE 485 Cb 1.09 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 1w3y h ILE 485 CO 0.10 0.32 0.22 0.00 0.00 0.00 0.00 178.15 178.79 1w3y h ALA 486 N 1.32 1.07 0.00 1.87 0.00 -0.82 -2.29 119.26 120.40 1w3y h ALA 486 Ca 0.17 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1w3y h ALA 486 Cb 0.34 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1w3y h ALA 486 CO 0.00 0.63 -0.15 0.22 0.00 0.00 0.00 179.25 179.96 1w3y h ASP 487 N 1.03 0.00 -0.08 0.00 3.58 -0.61 -1.26 116.42 119.09 1w3y h ASP 487 Ca 0.23 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.68 1w3y h ASP 487 Cb 0.29 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.34 1w3y h ASP 487 CO -0.01 0.15 0.00 0.23 -2.88 0.00 0.00 179.24 176.73 1w3y n MET 488 N -3.98 1.93 -1.95 0.28 2.81 -0.91 -4.91 117.12 110.39 1w3y n MET 488 Ca -0.02 -1.36 -0.10 0.00 -1.81 0.00 0.00 57.70 54.41 1w3y n MET 488 Cb 0.24 -1.46 0.03 0.00 -0.71 0.00 0.00 33.22 31.32 1w3y n MET 488 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1w3y n SER 489 N 0.63 1.02 -3.93 7.83 7.64 -0.47 -5.09 113.62 121.25 1w3y n SER 489 Ca 0.17 -1.75 -0.09 0.00 1.01 0.00 0.00 58.87 58.22 1w3y n SER 489 Cb 0.44 -0.21 -0.09 0.00 -1.01 0.00 0.00 64.21 63.34 1w3y n SER 489 CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 1w3y s GLU 490 N -3.31 0.71 4.91 1.43 -1.05 -1.26 -4.79 118.70 115.34 1w3y s GLU 490 Ca 0.30 -0.93 0.00 0.00 -0.15 0.00 0.00 54.97 54.19 1w3y s GLU 490 Cb -0.02 0.28 0.00 0.00 -0.44 0.00 0.00 34.13 33.94 1w3y s GLU 490 CO 0.19 -0.19 0.00 0.41 0.95 0.00 0.00 175.26 176.62 1w3y n GLY 491 N 0.26 3.18 0.11 -3.83 0.00 -1.26 -3.00 105.19 100.66 1w3y n GLY 491 Ca -0.16 -0.07 -0.08 0.00 0.00 0.00 0.00 46.02 45.71 1w3y n GLY 491 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1w3y h GLU 492 N 0.00 0.08 -0.64 1.61 4.39 -1.99 -1.58 114.58 116.45 1w3y h GLU 492 Ca 0.00 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.78 1w3y h GLU 492 Cb 0.00 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.56 1w3y h GLU 492 CO 0.00 0.05 0.29 1.15 -1.16 0.00 0.00 179.01 179.35 1w3y h THR 493 N 0.08 0.84 0.01 1.13 2.02 -1.97 0.32 112.91 115.34 1w3y h THR 493 Ca 0.10 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 1w3y h THR 493 Cb 0.12 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.80 1w3y h THR 493 CO -0.16 0.09 -0.00 0.50 0.37 0.00 0.00 175.52 176.32 1w3y h LYS 494 N 0.52 -0.01 -0.87 6.66 3.64 -1.40 -1.74 116.57 123.37 1w3y h LYS 494 Ca 0.31 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.67 1w3y h LYS 494 Cb 0.33 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.12 1w3y h LYS 494 CO -0.26 0.15 0.45 0.37 -2.27 0.00 0.00 179.45 177.88 1w3y h GLN 495 N -0.17 1.23 -0.26 1.90 4.15 -0.65 -0.70 115.11 120.61 1w3y h GLN 495 Ca -0.00 -0.16 -0.15 0.00 0.77 0.00 0.00 58.65 59.11 1w3y h GLN 495 Cb 0.17 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.62 1w3y h GLN 495 CO 0.00 0.92 -0.44 0.07 -1.93 0.00 0.00 178.83 177.46 1w3y h ARG 496 N 1.23 0.65 -0.40 1.69 0.11 -0.32 -0.20 114.38 117.14 1w3y h ARG 496 Ca 0.30 -0.35 -0.12 0.00 0.10 0.00 0.00 59.98 59.91 1w3y h ARG 496 Cb 0.07 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 31.16 1w3y h ARG 496 CO -0.04 0.96 -0.24 -0.07 0.10 0.00 0.00 179.97 180.68 1w3y h LEU 497 N 0.53 0.85 -0.76 0.08 3.38 -1.07 -0.93 115.31 117.38 1w3y h LEU 497 Ca 0.04 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.65 1w3y h LEU 497 Cb 0.97 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.45 1w3y h LEU 497 CO 0.09 1.05 0.32 1.56 0.09 0.00 0.00 178.44 181.55 1w3y h GLN 498 N 0.71 1.13 -0.44 1.13 4.20 -0.87 -2.22 115.11 118.75 1w3y h GLN 498 Ca 0.09 -0.20 -0.07 0.00 0.06 0.00 0.00 58.65 58.53 1w3y h GLN 498 Cb 0.77 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.34 1w3y h GLN 498 CO 0.06 0.91 -0.03 0.77 -0.67 0.00 0.00 178.83 179.88 1w3y h SER 499 N 1.10 0.71 -0.05 1.46 0.02 -0.62 0.33 113.55 116.49 1w3y h SER 499 Ca 0.26 -0.17 -0.00 0.00 -0.84 0.00 0.00 61.79 61.03 1w3y h SER 499 Cb 0.19 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 1w3y h SER 499 CO -0.02 0.79 0.02 0.25 -1.14 0.00 0.00 176.83 176.73 1w3y h LEU 500 N 0.68 0.07 -0.60 5.07 5.85 -0.78 -1.04 115.31 124.57 1w3y h LEU 500 Ca 0.13 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 1w3y h LEU 500 Cb 0.46 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1w3y h LEU 500 CO 0.02 0.20 0.26 0.58 -0.34 0.00 0.00 178.44 179.17 1w3y h VAL 501 N -0.06 1.22 -0.17 1.05 2.07 -1.20 -2.47 116.25 116.69 1w3y h VAL 501 Ca 0.02 -0.65 -0.00 0.00 0.82 0.00 0.00 66.70 66.89 1w3y h VAL 501 Cb 0.15 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 1w3y h VAL 501 CO -0.00 0.26 0.10 0.50 0.02 0.00 0.00 177.57 178.45 1w3y h LYS 502 N 0.82 0.23 -0.32 1.57 3.64 -0.75 -1.39 116.57 120.36 1w3y h LYS 502 Ca 0.20 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.47 1w3y h LYS 502 Cb 0.16 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1w3y h LYS 502 CO -0.02 0.20 -0.20 0.00 -2.27 0.00 0.00 179.45 177.16 1w3y h THR 503 N 0.20 1.26 -0.09 1.00 1.03 -1.14 -0.95 112.91 114.22 1w3y h THR 503 Ca 0.06 -1.23 -0.02 0.00 -0.01 0.00 0.00 66.41 65.22 1w3y h THR 503 Cb 0.03 1.23 -0.00 0.00 -1.07 0.00 0.00 68.15 68.34 1w3y h THR 503 CO -0.01 0.40 -0.02 0.40 -0.01 0.00 0.00 175.52 176.28 1w3y h ILE 504 N 0.53 1.29 -0.52 0.00 2.04 -1.28 -2.21 117.51 117.36 1w3y h ILE 504 Ca 0.08 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 1w3y h ILE 504 Cb 0.64 1.72 -0.02 0.00 -0.74 0.00 0.00 36.82 38.42 1w3y h ILE 504 CO 0.05 0.26 0.30 0.58 0.00 0.00 0.00 178.15 179.33 1w3y h VAL 505 N -0.15 1.17 0.00 1.67 2.07 -1.16 -2.41 116.25 117.43 1w3y h VAL 505 Ca 0.02 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1w3y h VAL 505 Cb 0.41 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1w3y h VAL 505 CO 0.01 0.18 0.00 1.56 0.02 0.00 0.00 177.57 179.33 1w3y h GLN 506 N 0.69 0.00 0.00 1.57 4.20 -1.17 -2.24 115.11 118.16 1w3y h GLN 506 Ca 0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1w3y h GLN 506 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 1w3y h GLN 506 CO -0.03 0.00 -0.32 -1.13 -0.67 0.00 0.00 178.83 176.67 1w3y n SER 507 N -2.46 0.53 -4.43 1.46 3.41 -0.83 -4.68 113.62 106.62 1w3y n SER 507 Ca 0.02 0.22 -0.44 0.00 -0.26 0.00 0.00 58.87 58.41 1w3y n SER 507 Cb 0.27 -0.17 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 1w3y n SER 507 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1w3y s ASP 508 N -3.75 6.40 0.00 4.04 -1.08 -0.85 -4.79 116.67 116.64 1w3y s ASP 508 Ca 0.10 -1.61 0.27 0.00 -0.52 0.00 0.00 52.55 50.79 1w3y s ASP 508 Cb 0.15 -2.38 1.07 0.00 -1.46 0.00 0.00 42.92 40.30 1w3y s ASP 508 CO 0.65 -1.17 1.75 -1.54 0.52 0.00 0.00 175.17 175.37 1w3y n SER 509 N 6.76 1.40 -0.13 -0.34 3.41 -1.26 -4.27 113.62 119.18 1w3y n SER 509 Ca 0.08 -1.49 -0.25 0.00 -0.26 0.00 0.00 58.87 56.95 1w3y n SER 509 Cb 0.46 -0.02 -0.11 0.00 -0.26 0.00 0.00 64.21 64.29 1w3y n SER 509 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1w3y n TYR 510 N 0.10 0.03 -4.72 7.33 9.36 -1.26 -5.00 117.16 123.00 1w3y n TYR 510 Ca 0.19 0.01 -0.33 0.00 3.32 0.00 0.00 57.90 61.08 1w3y n TYR 510 Cb 0.33 -1.00 -0.12 0.00 -0.63 0.00 0.00 39.34 37.91 1w3y n TYR 510 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1w3y s TYR 511 N -2.51 2.85 -0.48 2.98 5.04 -1.26 -5.08 117.35 118.89 1w3y s TYR 511 Ca -0.37 -0.14 -0.24 0.00 -2.44 0.00 0.00 57.07 53.88 1w3y s TYR 511 Cb 0.12 -1.72 0.03 0.00 0.35 0.00 0.00 41.96 40.74 1w3y s TYR 511 CO 0.54 0.19 0.84 0.34 -1.34 0.00 0.00 175.55 176.12 1w3y s ASP 512 N -0.55 6.40 0.42 4.32 2.15 -1.26 -4.92 116.67 123.23 1w3y s ASP 512 Ca 0.08 -0.16 0.19 0.00 0.43 0.00 0.00 52.55 53.08 1w3y s ASP 512 Cb -0.12 -2.40 1.11 0.00 -0.30 0.00 0.00 42.92 41.21 1w3y s ASP 512 CO 0.02 -1.01 1.83 1.62 -0.17 0.00 0.00 175.17 177.46 1w3y h VAL 513 N 6.00 0.62 0.00 1.11 3.04 -1.93 -0.04 116.25 125.05 1w3y h VAL 513 Ca -0.25 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.31 1w3y h VAL 513 Cb 1.08 0.21 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 1w3y h VAL 513 CO 1.00 0.07 0.00 -0.26 -1.01 0.00 0.00 177.57 177.37 1w3y h PHE 514 N 0.38 0.00 0.00 3.17 0.04 -1.94 -1.85 116.94 116.75 1w3y h PHE 514 Ca 0.51 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.28 1w3y h PHE 514 Cb 1.31 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.46 1w3y h PHE 514 CO -0.00 0.00 0.00 0.87 -0.60 0.00 0.00 178.31 178.58 1w3y h LYS 515 N 0.00 0.00 -0.05 1.51 1.57 -1.41 -2.74 116.57 115.46 1w3y h LYS 515 Ca 0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 1w3y h LYS 515 Cb 0.08 0.00 -0.18 0.00 0.08 0.00 0.00 32.23 32.21 1w3y h LYS 515 CO 0.00 0.00 -0.74 -1.71 -0.57 0.00 0.00 179.45 176.43 1w3y n ASN 516 N -2.57 1.58 -4.17 0.86 5.15 -0.70 -4.92 115.26 110.49 1w3y n ASN 516 Ca -0.01 -3.11 -0.37 0.00 -0.60 0.00 0.00 54.58 50.49 1w3y n ASN 516 Cb 0.13 -0.43 -0.12 0.00 -0.53 0.00 0.00 39.78 38.83 1w3y n ASN 516 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1w3y s LEU 517 N -2.04 4.89 -0.20 1.20 1.43 -1.03 -4.82 118.68 118.11 1w3y s LEU 517 Ca 0.37 -1.72 0.15 0.00 -1.03 0.00 0.00 54.13 51.90 1w3y s LEU 517 Cb 0.38 -1.84 0.80 0.00 0.03 0.00 0.00 46.19 45.56 1w3y s LEU 517 CO -0.10 -0.47 1.72 0.29 0.23 0.00 0.00 176.35 178.02 1w3y n LYS 518 N 4.67 4.59 -4.00 1.70 4.76 -1.26 -4.81 118.16 123.82 1w3y n LYS 518 Ca -0.07 -3.10 -0.09 0.00 -2.87 0.00 0.00 58.31 52.19 1w3y n LYS 518 Cb 0.42 -2.17 -0.10 0.00 -1.84 0.00 0.00 35.03 31.34 1w3y n LYS 518 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1w3y s THR 519 N -2.52 0.15 0.33 -0.18 -4.23 -1.26 -4.93 115.64 102.99 1w3y s THR 519 Ca 0.54 -1.22 0.07 0.00 -1.18 0.00 0.00 61.69 59.90 1w3y s THR 519 Cb 0.39 -0.80 0.08 0.00 1.34 0.00 0.00 72.50 73.51 1w3y s THR 519 CO 0.18 -0.67 1.78 1.88 -0.54 0.00 0.00 174.62 177.25 1w3y h TYR 520 N 3.94 0.29 -0.43 3.99 0.05 -1.68 -2.35 116.97 120.78 1w3y h TYR 520 Ca -0.33 -0.06 -0.12 0.00 0.05 0.00 0.00 58.73 58.28 1w3y h TYR 520 Cb 1.18 -0.07 -0.01 0.00 1.01 0.00 0.00 36.73 38.84 1w3y h TYR 520 CO 0.59 0.53 -0.20 -0.22 -1.05 0.00 0.00 178.16 177.81 1w3y h LYS 521 N 0.23 0.86 -0.57 4.88 1.63 -1.81 -0.07 116.57 121.71 1w3y h LYS 521 Ca 0.03 -0.34 -0.08 0.00 -0.85 0.00 0.00 60.65 59.41 1w3y h LYS 521 Cb 0.64 -0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 32.21 1w3y h LYS 521 CO 0.05 0.98 0.03 -0.44 -3.45 0.00 0.00 179.45 176.61 1w3y h ASP 522 N 0.75 0.94 -0.22 4.20 3.32 -1.84 -0.12 116.42 123.45 1w3y h ASP 522 Ca 0.10 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 1w3y h ASP 522 Cb 0.74 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1w3y h ASP 522 CO 0.06 0.98 0.04 0.40 -1.72 0.00 0.00 179.24 179.00 1w3y h ILE 523 N 0.90 1.22 -0.37 0.35 2.04 -1.18 -2.29 117.51 118.18 1w3y h ILE 523 Ca 0.17 -0.71 0.03 0.00 1.00 0.00 0.00 64.86 65.35 1w3y h ILE 523 Cb 0.49 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.81 1w3y h ILE 523 CO 0.02 0.22 0.19 -1.28 0.00 0.00 0.00 178.15 177.30 1w3y h SER 524 N 0.16 0.27 -0.68 1.72 0.87 -0.73 -1.20 113.55 113.96 1w3y h SER 524 Ca 0.07 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1w3y h SER 524 Cb 0.29 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.19 1w3y h SER 524 CO 0.00 0.20 0.42 -0.07 -0.53 0.00 0.00 176.83 176.85 1w3y h LEU 525 N 0.38 0.81 -0.55 2.23 3.38 -0.97 -1.90 115.31 118.69 1w3y h LEU 525 Ca 0.16 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1w3y h LEU 525 Cb 0.06 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 1w3y h LEU 525 CO -0.11 0.62 0.04 -0.03 0.09 0.00 0.00 178.44 179.05 1w3y h MET 526 N 0.92 0.95 -0.55 1.13 4.05 -1.09 -2.36 114.93 117.98 1w3y h MET 526 Ca 0.25 -0.28 -0.05 0.00 -0.28 0.00 0.00 59.70 59.34 1w3y h MET 526 Cb -0.05 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 30.63 1w3y h MET 526 CO -0.05 0.94 0.15 1.96 0.23 0.00 0.00 176.91 180.14 1w3y h GLN 527 N 0.83 0.86 -0.62 0.39 4.20 -0.97 -1.51 115.11 118.30 1w3y h GLN 527 Ca 0.16 -0.20 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 1w3y h GLN 527 Cb 0.48 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1w3y h GLN 527 CO 0.02 0.80 0.08 0.66 -0.67 0.00 0.00 178.83 179.71 1w3y h SER 528 N 0.77 0.98 -0.27 1.46 4.64 -1.29 -1.71 113.55 118.14 1w3y h SER 528 Ca 0.17 -0.24 -0.02 0.00 -0.47 0.00 0.00 61.79 61.24 1w3y h SER 528 Cb 0.31 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1w3y h SER 528 CO -0.00 0.99 0.10 0.25 -0.87 0.00 0.00 176.83 177.30 1w3y h LEU 529 N 0.95 0.37 -0.99 5.97 6.46 -1.22 -0.75 115.31 126.10 1w3y h LEU 529 Ca 0.19 -0.18 -0.10 0.00 -0.12 0.00 0.00 57.88 57.67 1w3y h LEU 529 Cb 0.45 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.27 1w3y h LEU 529 CO 0.02 0.45 -0.31 -0.07 -0.62 0.00 0.00 178.44 177.91 1w3y h LEU 530 N 0.27 0.35 -0.04 2.25 3.38 -1.14 -3.14 115.31 117.25 1w3y h LEU 530 Ca 0.09 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1w3y h LEU 530 Cb 0.20 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1w3y h LEU 530 CO -0.01 0.65 -0.60 -1.54 0.09 0.00 0.00 178.44 177.04 1w3y n SER 531 N -4.10 0.65 -4.59 -0.43 3.41 -0.65 -4.84 113.62 103.07 1w3y n SER 531 Ca -0.01 -0.46 -0.43 0.00 -0.26 0.00 0.00 58.87 57.71 1w3y n SER 531 Cb 0.42 0.41 -0.02 0.00 -0.26 0.00 0.00 64.21 64.76 1w3y n SER 531 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1w3y s ASP 532 N -2.97 6.54 0.57 4.04 -1.08 -0.30 -4.87 116.67 118.60 1w3y s ASP 532 Ca 0.11 0.37 0.37 0.00 -0.52 0.00 0.00 52.55 52.89 1w3y s ASP 532 Cb 0.17 -2.55 1.78 0.00 -1.46 0.00 0.00 42.92 40.86 1w3y s ASP 532 CO 0.73 -1.35 2.11 0.00 0.52 0.00 0.00 175.17 177.18 1w3y h ALA 533 N 9.50 1.00 0.00 3.66 0.00 -1.88 -1.89 119.26 129.65 1w3y h ALA 533 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1w3y h ALA 533 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1w3y h ALA 533 CO 1.15 0.00 0.00 0.78 0.00 0.00 0.00 179.25 181.18 1w3y h GLY 534 N 1.12 0.00 -7.24 0.00 0.00 -1.95 -3.41 103.07 91.58 1w3y h GLY 534 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.68 1w3y h GLY 534 CO 0.00 0.00 -0.16 0.14 0.00 0.00 0.00 176.54 176.52 1w3y s VAL 535 N -3.37 5.10 0.38 4.60 1.01 -0.71 -5.05 120.40 122.36 1w3y s VAL 535 Ca 0.05 0.33 -0.26 0.00 0.00 0.00 0.00 61.98 62.09 1w3y s VAL 535 Cb 0.09 -3.86 -0.09 0.00 0.00 0.00 0.00 36.38 32.52 1w3y s VAL 535 CO 0.50 -0.09 1.20 0.00 0.00 0.00 0.00 175.10 176.71 1w3y s ALA 536 N 2.21 3.23 -0.45 5.51 0.00 -1.26 -4.95 121.76 126.05 1w3y s ALA 536 Ca 0.16 1.04 0.02 0.00 0.00 0.00 0.00 51.96 53.19 1w3y s ALA 536 Cb -0.16 -3.41 0.15 0.00 0.00 0.00 0.00 23.12 19.70 1w3y s ALA 536 CO 0.12 -0.57 0.28 0.45 0.00 0.00 0.00 175.76 176.04 1w3y s SER 537 N -0.97 3.21 -0.07 0.00 0.15 -1.26 -4.41 113.70 110.35 1w3y s SER 537 Ca 0.55 -2.77 0.03 0.00 0.70 0.00 0.00 55.95 54.46 1w3y s SER 537 Cb -0.33 -0.86 -0.02 0.00 -1.71 0.00 0.00 66.02 63.10 1w3y s SER 537 CO 0.42 -0.23 -0.14 -0.69 1.20 0.00 0.00 173.24 173.80 1w3y s VAL 538 N 0.23 3.07 0.23 4.45 1.01 -1.26 -4.94 120.40 123.18 1w3y s VAL 538 Ca 0.22 -0.71 -0.31 0.00 0.00 0.00 0.00 61.98 61.18 1w3y s VAL 538 Cb -0.16 -2.22 -0.15 0.00 0.00 0.00 0.00 36.38 33.85 1w3y s VAL 538 CO -0.06 0.58 1.20 -2.65 0.00 0.00 0.00 175.10 174.17 1w3y n PRO 539 N 2.60 1.48 -2.05 2.72 -0.02 -1.26 -4.86 135.00 133.61 1w3y n PRO 539 Ca -0.17 0.53 -0.38 0.00 -2.02 0.00 0.00 63.50 61.45 1w3y n PRO 539 Cb 0.52 -2.04 0.01 0.00 -0.02 0.00 0.00 33.50 31.98 1w3y n PRO 539 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1w3y s ARG 540 N -0.74 3.57 0.78 -0.52 0.52 -1.26 -5.02 118.95 116.29 1w3y s ARG 540 Ca 0.67 2.01 -0.10 0.00 -0.52 0.00 0.00 55.73 57.79 1w3y s ARG 540 Cb -0.75 -2.42 0.09 0.00 0.52 0.00 0.00 34.95 32.39 1w3y s ARG 540 CO 0.54 -0.77 1.13 -0.08 0.02 0.00 0.00 175.30 176.13 1w3y s THR 541 N -1.41 2.10 0.56 0.02 -1.32 -1.26 -4.69 115.64 109.65 1w3y s THR 541 Ca 0.65 -0.11 -0.19 0.00 -1.21 0.00 0.00 61.69 60.83 1w3y s THR 541 Cb -0.35 -2.99 -0.05 0.00 -1.51 0.00 0.00 72.50 67.61 1w3y s THR 541 CO 0.42 0.00 1.17 -0.44 -2.21 0.00 0.00 174.62 173.56 1w3y s SER 542 N -4.59 5.49 0.19 8.08 0.01 -1.26 -4.72 113.70 116.90 1w3y s SER 542 Ca 0.63 2.28 -0.21 0.00 1.31 0.00 0.00 55.95 59.96 1w3y s SER 542 Cb -0.10 -2.59 0.05 0.00 0.21 0.00 0.00 66.02 63.59 1w3y s SER 542 CO 0.48 -1.38 0.60 -0.72 0.41 0.00 0.00 173.24 172.63 1w3y s TYR 543 N -1.68 -0.38 -0.23 2.43 -0.85 -0.68 -4.95 117.35 111.00 1w3y s TYR 543 Ca 0.75 0.10 -0.04 0.00 -0.52 0.00 0.00 57.07 57.36 1w3y s TYR 543 Cb -0.27 0.55 0.12 0.00 0.38 0.00 0.00 41.96 42.74 1w3y s TYR 543 CO 0.30 -0.93 0.38 -1.17 -1.52 0.00 0.00 175.55 172.61 1w3y s LEU 544 N -2.81 -0.63 -0.23 -3.49 0.20 -1.20 -0.94 118.68 109.58 1w3y s LEU 544 Ca 0.04 0.39 -0.07 0.00 0.69 0.00 0.00 54.13 55.18 1w3y s LEU 544 Cb -0.02 1.15 -0.03 0.00 -0.43 0.00 0.00 46.19 46.87 1w3y s LEU 544 CO -0.07 -0.28 0.05 -0.44 -0.29 0.00 0.00 176.35 175.31 1w3y s SER 545 N 2.56 5.08 -0.73 3.68 0.01 0.90 -4.87 113.70 120.32 1w3y s SER 545 Ca 0.10 -0.19 -0.15 0.00 1.31 0.00 0.00 55.95 57.01 1w3y s SER 545 Cb -0.15 -1.90 0.17 0.00 0.21 0.00 0.00 66.02 64.36 1w3y s SER 545 CO -0.15 0.00 0.71 0.00 0.41 0.00 0.00 173.24 174.21 1w3y s ALA 546 N 1.37 3.84 -1.37 1.44 0.00 -1.26 -1.24 121.76 124.54 1w3y s ALA 546 Ca 0.05 -2.94 -0.12 0.00 0.00 0.00 0.00 51.96 48.95 1w3y s ALA 546 Cb -0.15 -3.49 0.11 0.00 0.00 0.00 0.00 23.12 19.59 1w3y s ALA 546 CO 0.03 -2.26 2.04 1.19 0.00 0.00 0.00 175.76 176.76 1w3y n PHE 547 N 4.77 3.25 0.14 0.00 3.72 -0.28 -4.77 117.46 124.30 1w3y n PHE 547 Ca 0.04 -2.88 0.05 0.00 -0.05 0.00 0.00 57.45 54.60 1w3y n PHE 547 Cb 0.45 -2.25 0.49 0.00 -0.94 0.00 0.00 39.48 37.22 1w3y n PHE 547 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1w3y h ASN 548 N 5.89 0.21 0.39 4.37 2.35 -1.89 -1.25 115.58 125.66 1w3y h ASN 548 Ca 0.48 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 56.21 1w3y h ASN 548 Cb 0.64 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.95 1w3y h ASN 548 CO 1.75 0.24 0.00 0.29 -1.65 0.00 0.00 177.43 178.05 1w3y n LYS 549 N -4.42 0.17 -0.06 0.81 4.76 -1.26 -2.44 118.16 115.72 1w3y n LYS 549 Ca -0.00 0.15 0.01 0.00 -2.87 0.00 0.00 58.31 55.59 1w3y n LYS 549 Cb 0.15 -1.50 0.01 0.00 -1.84 0.00 0.00 35.03 31.85 1w3y n LYS 549 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1w3y n MET 550 N -1.35 1.07 -3.85 1.97 0.00 -0.88 -4.95 117.12 109.14 1w3y n MET 550 Ca 0.07 -1.04 -0.28 0.00 0.00 0.00 0.00 57.70 56.45 1w3y n MET 550 Cb 0.15 -0.74 0.03 0.00 0.00 0.00 0.00 33.22 32.66 1w3y n MET 550 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1w3y n ASP 551 N -0.27 -4.07 -4.25 3.17 8.00 -0.53 -4.68 116.55 113.92 1w3y n ASP 551 Ca 0.01 -0.78 -0.17 0.00 0.71 0.00 0.00 54.79 54.57 1w3y n ASP 551 Cb 0.45 -3.98 -0.11 0.00 -0.02 0.00 0.00 41.12 37.46 1w3y n ASP 551 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 1w3y s LYS 552 N -6.46 1.05 -0.01 -1.24 -0.14 -0.93 -1.95 119.74 110.05 1w3y s LYS 552 Ca 0.51 -1.31 0.00 0.00 -1.36 0.00 0.00 55.97 53.81 1w3y s LYS 552 Cb -0.25 -0.85 0.02 0.00 -1.68 0.00 0.00 37.83 35.07 1w3y s LYS 552 CO 0.82 0.15 0.02 0.99 -0.76 0.00 0.00 175.35 176.57 1w3y s THR 553 N -2.47 -0.01 -0.10 2.17 2.01 -0.71 -1.12 115.64 115.41 1w3y s THR 553 Ca 0.12 0.13 0.03 0.00 0.31 0.00 0.00 61.69 62.28 1w3y s THR 553 Cb -0.03 -0.09 0.01 0.00 0.01 0.00 0.00 72.50 72.40 1w3y s THR 553 CO 0.03 0.07 -0.20 0.00 -0.69 0.00 0.00 174.62 173.83 1w3y s ALA 554 N 0.74 1.95 0.01 7.40 0.00 -0.37 -0.98 121.76 130.51 1w3y s ALA 554 Ca -0.06 -0.86 0.05 0.00 0.00 0.00 0.00 51.96 51.09 1w3y s ALA 554 Cb -0.09 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.20 1w3y s ALA 554 CO -0.02 0.13 -0.16 1.41 0.00 0.00 0.00 175.76 177.13 1w3y s MET 555 N 0.60 1.16 -0.07 0.00 0.00 0.37 -0.07 119.30 121.30 1w3y s MET 555 Ca -0.14 -0.68 -0.03 0.00 0.00 0.00 0.00 55.69 54.85 1w3y s MET 555 Cb -0.17 -1.17 0.04 0.00 0.00 0.00 0.00 34.83 33.54 1w3y s MET 555 CO 0.04 0.31 0.16 -0.47 0.00 0.00 0.00 175.02 175.05 1w3y s TYR 556 N -0.59 -0.18 -0.30 4.11 5.04 -0.11 -0.12 117.35 125.19 1w3y s TYR 556 Ca 0.05 0.53 -0.06 0.00 -2.44 0.00 0.00 57.07 55.15 1w3y s TYR 556 Cb -0.07 -0.09 0.02 0.00 0.35 0.00 0.00 41.96 42.17 1w3y s TYR 556 CO 0.00 -0.18 0.06 1.21 -1.34 0.00 0.00 175.55 175.30 1w3y s ASN 557 N 1.30 5.06 0.21 4.32 3.84 -0.27 -1.69 114.94 127.72 1w3y s ASN 557 Ca -0.08 -0.88 0.11 0.00 0.21 0.00 0.00 52.86 52.22 1w3y s ASN 557 Cb -0.12 -1.84 0.00 0.00 -0.55 0.00 0.00 41.25 38.75 1w3y s ASN 557 CO -0.06 -0.23 1.40 0.00 -2.79 0.00 0.00 177.10 175.42 1w3y h ALA 558 N 8.19 0.57 -0.31 1.71 0.00 -1.84 0.46 119.26 128.03 1w3y h ALA 558 Ca -0.29 -0.68 -0.06 0.00 0.00 0.00 0.00 54.91 53.88 1w3y h ALA 558 Cb 1.11 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1w3y h ALA 558 CO 0.60 0.93 -0.04 1.49 0.00 0.00 0.00 179.25 182.23 1w3y h GLU 559 N 0.00 0.58 0.00 0.00 4.81 -1.94 -3.29 114.58 114.75 1w3y h GLU 559 Ca -0.01 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 1w3y h GLU 559 Cb 1.51 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.85 1w3y h GLU 559 CO 0.10 0.75 -1.73 1.63 -0.73 0.00 0.00 179.01 179.02 1w3y n LYS 560 N -4.50 0.50 -2.18 1.92 5.02 -1.25 -5.04 118.16 112.62 1w3y n LYS 560 Ca -0.03 -0.14 -0.02 0.00 -2.02 0.00 0.00 58.31 56.10 1w3y n LYS 560 Cb 0.30 -1.52 0.01 0.00 -0.02 0.00 0.00 35.03 33.80 1w3y n LYS 560 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1w3y n GLY 561 N 1.32 0.38 3.04 0.72 0.00 0.12 -4.94 105.19 105.83 1w3y n GLY 561 Ca -0.02 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.48 1w3y n GLY 561 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1w3y s PHE 562 N -3.04 0.47 0.21 1.61 -0.12 -0.99 -4.67 117.98 111.45 1w3y s PHE 562 Ca 0.00 -0.69 0.10 0.00 -0.05 0.00 0.00 56.93 56.30 1w3y s PHE 562 Cb -0.00 -0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.03 1w3y s PHE 562 CO 0.08 -0.21 -0.15 0.20 -0.05 0.00 0.00 175.22 175.09 1w3y s GLY 563 N -1.98 1.74 -0.02 1.99 0.00 0.37 -1.11 107.32 108.32 1w3y s GLY 563 Ca -0.07 -1.62 -0.00 0.00 0.00 0.00 0.00 44.72 43.03 1w3y s GLY 563 CO -0.03 -1.66 0.03 -0.12 0.00 0.00 0.00 173.10 171.32 1w3y s PHE 564 N -1.91 0.01 -0.06 1.90 5.36 0.83 -0.52 117.98 123.59 1w3y s PHE 564 Ca 0.25 0.11 0.04 0.00 -0.96 0.00 0.00 56.93 56.37 1w3y s PHE 564 Cb -0.08 -0.15 0.00 0.00 -0.34 0.00 0.00 43.02 42.45 1w3y s PHE 564 CO 0.14 -0.07 -0.17 0.20 -1.46 0.00 0.00 175.22 173.87 1w3y s GLY 565 N 0.74 0.95 -0.23 13.12 0.00 -0.28 -0.47 107.32 121.14 1w3y s GLY 565 Ca -0.06 -0.66 -0.00 0.00 0.00 0.00 0.00 44.72 44.00 1w3y s GLY 565 CO -0.02 -0.23 -0.11 -2.27 0.00 0.00 0.00 173.10 170.47 1w3y s LEU 566 N 0.25 2.90 -0.39 0.66 2.96 -0.15 -0.25 118.68 124.66 1w3y s LEU 566 Ca -0.09 -0.88 -0.11 0.00 -0.22 0.00 0.00 54.13 52.83 1w3y s LEU 566 Cb -0.14 -1.59 0.03 0.00 0.50 0.00 0.00 46.19 45.00 1w3y s LEU 566 CO 0.04 -0.10 0.23 -0.55 -1.32 0.00 0.00 176.35 174.65 1w3y s SER 567 N 1.28 5.77 0.41 3.68 0.15 -0.11 -1.74 113.70 123.15 1w3y s SER 567 Ca 0.00 -1.05 0.02 0.00 0.70 0.00 0.00 55.95 55.62 1w3y s SER 567 Cb -0.16 -2.04 -0.01 0.00 -1.71 0.00 0.00 66.02 62.11 1w3y s SER 567 CO -0.07 -0.42 0.07 0.18 1.20 0.00 0.00 173.24 174.20 1w3y n LEU 568 N 5.01 0.00 -3.90 3.45 4.77 -0.82 -2.50 117.00 123.01 1w3y n LEU 568 Ca -0.12 -2.85 -0.08 0.00 -0.03 0.00 0.00 56.01 52.94 1w3y n LEU 568 Cb 0.46 0.62 -0.03 0.00 -2.33 0.00 0.00 43.42 42.13 1w3y n LEU 568 CO 0.37 -0.42 0.35 0.72 -1.33 0.00 0.00 177.39 177.08 1w3y s PHE 569 N -2.79 0.02 0.00 -1.77 -0.71 -1.23 -4.70 117.98 106.80 1w3y s PHE 569 Ca 0.09 -0.43 0.00 0.00 -1.04 0.00 0.00 56.93 55.55 1w3y s PHE 569 Cb 0.00 0.49 0.00 0.00 -1.21 0.00 0.00 43.02 42.30 1w3y s PHE 569 CO 0.07 -1.12 0.00 -1.13 -1.34 0.00 0.00 175.22 171.70 1w3y n SER 570 N -0.42 0.00 0.18 1.98 3.41 -1.24 -4.84 113.62 112.68 1w3y n SER 570 Ca -0.04 -0.43 0.13 0.00 -0.26 0.00 0.00 58.87 58.27 1w3y n SER 570 Cb 0.60 0.00 0.61 0.00 -0.26 0.00 0.00 64.21 65.16 1w3y n SER 570 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1w3y h SER 571 N 0.00 0.00 0.45 4.04 4.64 -1.08 -1.33 113.55 120.27 1w3y h SER 571 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1w3y h SER 571 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1w3y h SER 571 CO 0.00 0.00 -0.93 0.54 -0.87 0.00 0.00 176.83 175.57 1w3y n ARG 572 N -2.41 0.24 -4.01 4.77 1.74 -1.26 -4.74 116.66 110.98 1w3y n ARG 572 Ca 0.00 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 56.99 1w3y n ARG 572 Cb 0.16 -1.58 -0.11 0.00 -1.02 0.00 0.00 32.46 29.90 1w3y n ARG 572 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1w3y s THR 573 N -3.16 0.23 0.25 0.55 -4.23 -0.95 -4.84 115.64 103.49 1w3y s THR 573 Ca 0.05 -1.05 -0.30 0.00 -1.18 0.00 0.00 61.69 59.22 1w3y s THR 573 Cb 0.15 -0.47 -0.09 0.00 1.34 0.00 0.00 72.50 73.42 1w3y s THR 573 CO 0.79 -0.52 0.96 -0.22 -0.54 0.00 0.00 174.62 175.09 1w3y s LEU 574 N -1.64 4.62 0.01 4.79 2.96 -0.28 -3.68 118.68 125.46 1w3y s LEU 574 Ca -0.12 1.99 -0.25 0.00 -0.22 0.00 0.00 54.13 55.53 1w3y s LEU 574 Cb -0.08 -3.63 -0.19 0.00 0.50 0.00 0.00 46.19 42.79 1w3y s LEU 574 CO -0.02 0.10 1.39 -0.55 -1.32 0.00 0.00 176.35 175.95 1w3y h ASN 575 N 4.05 -0.01 -5.04 3.68 7.08 -1.50 -3.45 115.58 120.39 1w3y h ASN 575 Ca -0.45 -0.35 -0.11 0.00 -3.08 0.00 0.00 56.30 52.31 1w3y h ASN 575 Cb 1.20 0.00 -0.18 0.00 -2.08 0.00 0.00 38.32 37.26 1w3y h ASN 575 CO 0.68 0.35 -0.33 -0.72 -2.08 0.00 0.00 177.43 175.32 1w3y s TYR 576 N -4.76 -0.05 -0.24 4.14 1.13 -1.26 -4.38 117.35 111.93 1w3y s TYR 576 Ca -0.15 -0.07 -0.07 0.00 -1.41 0.00 0.00 57.07 55.37 1w3y s TYR 576 Cb 0.03 0.03 -0.03 0.00 -1.10 0.00 0.00 41.96 40.89 1w3y s TYR 576 CO 0.67 -0.43 0.05 -2.00 -2.51 0.00 0.00 175.55 171.32 1w3y s GLU 577 N -2.19 3.65 -0.29 -3.49 2.12 -1.26 -3.49 118.70 113.75 1w3y s GLU 577 Ca -0.08 -0.49 0.02 0.00 0.36 0.00 0.00 54.97 54.78 1w3y s GLU 577 Cb -0.02 -3.26 0.08 0.00 0.26 0.00 0.00 34.13 31.19 1w3y s GLU 577 CO -0.01 -0.13 0.01 -1.58 -0.54 0.00 0.00 175.26 173.00 1w3y s HIS 578 N 1.44 2.76 0.10 5.30 5.65 -1.26 -4.26 115.29 125.01 1w3y s HIS 578 Ca 0.05 -2.21 -0.13 0.00 0.25 0.00 0.00 55.06 53.02 1w3y s HIS 578 Cb -0.15 -2.09 0.02 0.00 -1.18 0.00 0.00 32.58 29.19 1w3y s HIS 578 CO 0.03 -0.86 0.32 0.00 -0.65 0.00 0.00 174.74 173.57 1w3y s MET 579 N 1.26 0.96 -1.36 2.88 0.23 -1.14 -4.83 119.30 117.30 1w3y s MET 579 Ca 0.03 -0.75 -0.04 0.00 -1.03 0.00 0.00 55.69 53.90 1w3y s MET 579 Cb -0.19 0.41 0.02 0.00 -1.53 0.00 0.00 34.83 33.55 1w3y s MET 579 CO -0.11 -0.35 0.30 0.09 -2.03 0.00 0.00 175.02 172.93 1w3y n ASN 580 N -0.05 -4.74 -1.50 -1.18 3.02 -1.26 -1.09 115.26 108.46 1w3y n ASN 580 Ca -0.16 -0.13 -0.16 0.00 -0.03 0.00 0.00 54.58 54.09 1w3y n ASN 580 Cb 0.63 -3.92 -0.05 0.00 -0.61 0.00 0.00 39.78 35.83 1w3y n ASN 580 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1w3y n LYS 581 N -3.43 -1.21 -4.62 3.52 5.02 -1.26 -4.86 118.16 111.32 1w3y n LYS 581 Ca -0.11 0.97 -0.32 0.00 -2.02 0.00 0.00 58.31 56.82 1w3y n LYS 581 Cb 0.60 -5.25 -0.12 0.00 -0.02 0.00 0.00 35.03 30.25 1w3y n LYS 581 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1w3y s GLU 582 N -3.94 2.45 -0.90 1.97 2.02 -0.25 -1.53 118.70 118.52 1w3y s GLU 582 Ca 0.00 -0.76 -0.01 0.00 0.02 0.00 0.00 54.97 54.22 1w3y s GLU 582 Cb 0.00 -2.41 -0.02 0.00 0.10 0.00 0.00 34.13 31.80 1w3y s GLU 582 CO 0.00 0.60 0.76 -1.71 0.02 0.00 0.00 175.26 174.93 1w3y n ASN 583 N 1.79 -3.10 0.28 -0.19 5.15 0.32 -2.87 115.26 116.63 1w3y n ASN 583 Ca -0.16 -0.50 0.16 0.00 -0.60 0.00 0.00 54.58 53.47 1w3y n ASN 583 Cb 0.52 -4.12 0.79 0.00 -0.53 0.00 0.00 39.78 36.44 1w3y n ASN 583 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1w3y h LYS 584 N -1.29 0.00 -0.25 1.20 1.57 -1.60 -3.24 116.57 112.96 1w3y h LYS 584 Ca -0.46 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.12 1w3y h LYS 584 Cb 1.26 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 33.38 1w3y h LYS 584 CO 0.37 0.07 -0.69 0.54 -0.57 0.00 0.00 179.45 179.18 1w3y n ARG 585 N -3.33 2.05 -0.30 3.15 1.74 -1.26 -4.53 116.66 114.18 1w3y n ARG 585 Ca -0.01 -3.45 0.04 0.00 -0.77 0.00 0.00 57.85 53.66 1w3y n ARG 585 Cb 0.25 -1.65 0.16 0.00 -1.02 0.00 0.00 32.46 30.19 1w3y n ARG 585 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1w3y n GLY 586 N -0.80 1.49 0.27 -0.13 0.00 -1.22 -4.63 105.19 100.16 1w3y n GLY 586 Ca 0.25 -0.38 0.08 0.00 0.00 0.00 0.00 46.02 45.97 1w3y n GLY 586 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1w3y n TRP 587 N 0.34 0.38 -0.72 1.61 8.01 -1.26 -1.62 117.44 124.17 1w3y n TRP 587 Ca 0.11 0.94 0.08 0.00 -1.31 0.00 0.00 57.50 57.32 1w3y n TRP 587 Cb 0.50 -1.01 0.25 0.00 -2.01 0.00 0.00 31.31 29.05 1w3y n TRP 587 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 1w3y n TYR 588 N -5.18 0.95 0.54 -5.99 4.01 -1.26 -4.67 117.16 105.56 1w3y n TYR 588 Ca 0.15 -0.73 0.06 0.00 -0.16 0.00 0.00 57.90 57.22 1w3y n TYR 588 Cb 0.48 -0.24 0.29 0.00 -0.31 0.00 0.00 39.34 39.56 1w3y n TYR 588 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1w3y n THR 589 N 0.04 0.79 -0.86 -0.72 -2.24 -0.64 -2.38 114.28 108.27 1w3y n THR 589 Ca 0.20 0.20 0.02 0.00 -2.27 0.00 0.00 64.05 62.19 1w3y n THR 589 Cb 0.79 -1.00 0.03 0.00 -2.10 0.00 0.00 70.33 68.05 1w3y n THR 589 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1w3y n SER 590 N -1.33 1.13 -1.99 3.42 7.64 -1.26 -4.51 113.62 116.73 1w3y n SER 590 Ca 0.05 -1.92 -0.15 0.00 1.01 0.00 0.00 58.87 57.86 1w3y n SER 590 Cb 0.10 -0.12 -0.04 0.00 -1.01 0.00 0.00 64.21 63.14 1w3y n SER 590 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1w3y n ASP 591 N -0.45 5.96 -0.13 6.43 9.92 -1.00 -3.53 116.55 133.75 1w3y n ASP 591 Ca 0.03 -2.83 0.00 0.00 -0.53 0.00 0.00 54.79 51.46 1w3y n ASP 591 Cb 0.48 -1.20 0.00 0.00 -0.64 0.00 0.00 41.12 39.76 1w3y n ASP 591 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1w3y n GLY 592 N 1.20 0.71 3.77 0.44 0.00 -1.04 -4.40 105.19 105.87 1w3y n GLY 592 Ca 0.31 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 45.24 1w3y n GLY 592 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1w3y s MET 593 N -3.81 4.60 0.20 1.61 0.00 -1.08 -3.98 119.30 116.85 1w3y s MET 593 Ca 0.00 1.49 0.11 0.00 0.00 0.00 0.00 55.69 57.29 1w3y s MET 593 Cb 0.00 -2.96 -0.04 0.00 0.00 0.00 0.00 34.83 31.83 1w3y s MET 593 CO 0.00 0.26 -0.22 -0.59 0.00 0.00 0.00 175.02 174.47 1w3y s PHE 594 N -1.42 2.19 0.00 4.11 -0.71 -0.64 -0.93 117.98 120.58 1w3y s PHE 594 Ca 0.48 -0.38 0.07 0.00 -1.04 0.00 0.00 56.93 56.06 1w3y s PHE 594 Cb -0.24 -1.05 -0.02 0.00 -1.21 0.00 0.00 43.02 40.50 1w3y s PHE 594 CO 0.30 0.51 -0.21 0.71 -1.34 0.00 0.00 175.22 175.19 1w3y s TYR 595 N -1.95 1.84 -0.13 3.49 1.51 0.65 -4.76 117.35 118.00 1w3y s TYR 595 Ca 0.22 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 55.94 1w3y s TYR 595 Cb -0.07 -1.16 0.01 0.00 -0.11 0.00 0.00 41.96 40.64 1w3y s TYR 595 CO 0.10 0.01 -0.17 -1.17 -1.11 0.00 0.00 175.55 173.21 1w3y s LEU 596 N -0.70 1.86 -0.37 -1.29 2.96 -1.26 -1.13 118.68 118.75 1w3y s LEU 596 Ca 0.08 -0.51 -0.08 0.00 -0.22 0.00 0.00 54.13 53.41 1w3y s LEU 596 Cb -0.08 -1.24 0.05 0.00 0.50 0.00 0.00 46.19 45.42 1w3y s LEU 596 CO 0.00 0.02 0.16 -0.31 -1.32 0.00 0.00 176.35 174.90 1w3y s TYR 597 N 1.04 3.29 0.00 5.38 2.02 0.33 -4.96 117.35 124.45 1w3y s TYR 597 Ca -0.04 -1.44 0.00 0.00 -0.37 0.00 0.00 57.07 55.22 1w3y s TYR 597 Cb -0.15 -2.51 0.00 0.00 -0.40 0.00 0.00 41.96 38.91 1w3y s TYR 597 CO -0.04 -0.76 0.00 0.27 -1.57 0.00 0.00 175.55 173.45 1w3y n ASN 598 N 4.85 0.87 0.33 2.29 0.23 -1.26 -0.48 115.26 122.09 1w3y n ASN 598 Ca -0.11 0.00 0.20 0.00 -0.53 0.00 0.00 54.58 54.14 1w3y n ASN 598 Cb 0.44 0.00 1.07 0.00 -2.08 0.00 0.00 39.78 39.21 1w3y n ASN 598 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1w3y h GLY 599 N 0.00 0.00 -7.58 4.83 0.00 -1.32 -3.32 103.07 95.67 1w3y h GLY 599 Ca 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 47.33 46.61 1w3y h GLY 599 CO 0.00 0.00 0.79 -0.35 0.00 0.00 0.00 176.54 176.98 1w3y s ASP 600 N -4.87 6.79 0.63 0.19 2.15 -1.26 -4.84 116.67 115.45 1w3y s ASP 600 Ca -0.04 -2.46 0.41 0.00 0.43 0.00 0.00 52.55 50.89 1w3y s ASP 600 Cb 0.11 -2.35 2.07 0.00 -0.30 0.00 0.00 42.92 42.45 1w3y s ASP 600 CO 0.36 -0.86 2.24 -0.07 -0.17 0.00 0.00 175.17 176.66 1w3y h LEU 601 N 9.57 0.00 -0.76 -1.34 4.07 -1.98 -2.37 115.31 122.50 1w3y h LEU 601 Ca 0.18 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.14 1w3y h LEU 601 Cb 0.99 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.73 1w3y h LEU 601 CO 1.07 0.00 -0.01 -1.54 -1.08 0.00 0.00 178.44 176.87 1w3y n SER 602 N -3.07 1.20 -0.18 -0.43 3.41 -1.26 -4.58 113.62 108.71 1w3y n SER 602 Ca -0.02 -1.36 -0.05 0.00 -0.26 0.00 0.00 58.87 57.18 1w3y n SER 602 Cb 0.15 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.11 1w3y n SER 602 CO 0.00 0.00 0.00 -0.74 -0.16 0.00 0.00 175.04 174.14 1w3y h HIS 603 N 1.86 -0.81 -0.34 7.33 6.17 -1.79 -0.19 115.15 127.39 1w3y h HIS 603 Ca 0.00 0.07 0.00 0.00 0.71 0.00 0.00 60.37 61.15 1w3y h HIS 603 Cb 0.41 0.43 0.00 0.00 2.52 0.00 0.00 27.41 30.78 1w3y h HIS 603 CO 0.00 -0.36 0.00 0.66 0.71 0.00 0.00 177.93 178.94 1w3y n TYR 604 N -5.43 0.75 -3.56 5.26 4.01 -1.26 -4.72 117.16 112.21 1w3y n TYR 604 Ca 0.04 -0.30 0.00 0.00 -0.16 0.00 0.00 57.90 57.48 1w3y n TYR 604 Cb 0.35 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 39.24 1w3y n TYR 604 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1w3y n SER 605 N 0.47 1.90 -3.90 7.72 7.64 -0.08 -4.48 113.62 122.88 1w3y n SER 605 Ca 0.13 -0.62 -0.29 0.00 1.01 0.00 0.00 58.87 59.11 1w3y n SER 605 Cb 0.50 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.72 1w3y n SER 605 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1w3y n ASP 606 N -0.68 -3.55 0.00 6.43 8.00 -1.26 -2.58 116.55 122.92 1w3y n ASP 606 Ca 0.00 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.67 1w3y n ASP 606 Cb 0.00 -3.75 0.00 0.00 -0.02 0.00 0.00 41.12 37.35 1w3y n ASP 606 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1w3y n GLY 607 N -1.66 0.49 0.19 0.44 0.00 -1.26 -4.95 105.19 98.43 1w3y n GLY 607 Ca -0.05 -0.88 -0.11 0.00 0.00 0.00 0.00 46.02 44.97 1w3y n GLY 607 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1w3y h TYR 608 N 0.00 -0.39 -0.86 1.61 3.20 -1.72 -2.90 116.97 115.91 1w3y h TYR 608 Ca 0.00 0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.92 1w3y h TYR 608 Cb 0.00 0.17 -0.05 0.00 1.54 0.00 0.00 36.73 38.39 1w3y h TYR 608 CO 0.00 -0.22 0.57 -1.49 -1.64 0.00 0.00 178.16 175.38 1w3y h TRP 609 N -0.27 1.04 -0.00 -3.82 4.06 -1.88 0.46 115.95 115.54 1w3y h TRP 609 Ca 0.04 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.02 1w3y h TRP 609 Cb 0.31 -0.35 0.00 0.00 -1.00 0.00 0.00 29.16 28.13 1w3y h TRP 609 CO -0.19 0.60 -0.20 -0.35 -3.56 0.00 0.00 178.44 174.74 1w3y n PRO 610 N -4.45 0.23 -0.00 0.49 -0.04 -1.20 -4.10 135.00 125.94 1w3y n PRO 610 Ca 0.11 -0.08 0.05 0.00 -0.04 0.00 0.00 63.50 63.54 1w3y n PRO 610 Cb 0.11 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.00 1w3y n PRO 610 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1w3y n THR 611 N -1.31 0.00 -2.02 0.52 -2.24 -0.90 -4.11 114.28 104.21 1w3y n THR 611 Ca 0.09 -0.23 -0.39 0.00 -2.27 0.00 0.00 64.05 61.25 1w3y n THR 611 Cb 0.32 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 1w3y n THR 611 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1w3y s VAL 612 N -2.61 2.57 -0.47 2.28 0.11 0.10 -4.69 120.40 117.70 1w3y s VAL 612 Ca -0.03 0.48 -0.29 0.00 -2.93 0.00 0.00 61.98 59.21 1w3y s VAL 612 Cb 0.07 -3.27 0.02 0.00 -1.53 0.00 0.00 36.38 31.67 1w3y s VAL 612 CO 0.42 0.04 1.32 0.21 -3.33 0.00 0.00 175.10 173.76 1w3y s ASN 613 N -0.88 6.39 0.46 3.54 3.84 -1.26 -4.89 114.94 122.13 1w3y s ASN 613 Ca 0.61 0.57 0.31 0.00 0.21 0.00 0.00 52.86 54.57 1w3y s ASN 613 Cb -0.37 -2.54 1.66 0.00 -0.55 0.00 0.00 41.25 39.44 1w3y s ASN 613 CO 0.46 -1.44 1.94 1.55 -2.79 0.00 0.00 177.10 176.83 1w3y h PRO 614 N 10.28 0.00 -0.00 0.43 0.13 -1.91 -1.77 132.00 139.15 1w3y h PRO 614 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1w3y h PRO 614 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1w3y h PRO 614 CO 1.12 0.00 -0.25 0.66 -0.23 0.00 0.00 178.00 179.30 1w3y n TYR 615 N -2.59 0.00 -2.73 1.56 4.01 -1.26 -4.26 117.16 111.89 1w3y n TYR 615 Ca -0.02 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.55 1w3y n TYR 615 Cb 0.06 -0.26 0.00 0.00 -0.31 0.00 0.00 39.34 38.83 1w3y n TYR 615 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1w3y n LYS 616 N -1.21 1.98 -1.96 -0.72 5.02 -0.67 -4.95 118.16 115.65 1w3y n LYS 616 Ca 0.09 -3.80 -0.41 0.00 -2.02 0.00 0.00 58.31 52.17 1w3y n LYS 616 Cb 0.32 -1.71 -0.02 0.00 -0.02 0.00 0.00 35.03 33.60 1w3y n LYS 616 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1w3y s MET 617 N -3.16 4.24 -0.05 1.97 -1.94 -1.26 -4.72 119.30 114.39 1w3y s MET 617 Ca 0.38 2.37 -0.37 0.00 -1.71 0.00 0.00 55.69 56.36 1w3y s MET 617 Cb 0.40 -3.06 -0.15 0.00 2.01 0.00 0.00 34.83 34.04 1w3y s MET 617 CO -0.06 -0.41 1.63 -0.35 -0.01 0.00 0.00 175.02 175.81 1w3y n PRO 618 N 1.57 1.58 0.00 2.03 -0.04 -1.26 -2.09 135.00 136.79 1w3y n PRO 618 Ca 0.04 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 64.08 1w3y n PRO 618 Cb 0.40 -2.30 0.00 0.00 -0.04 0.00 0.00 33.50 31.56 1w3y n PRO 618 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1w3y n GLY 619 N 3.63 2.23 3.83 0.55 0.00 0.20 -1.62 105.19 114.01 1w3y n GLY 619 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1w3y n GLY 619 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1w3y s THR 620 N -2.30 4.57 -0.25 2.61 -4.23 -0.89 -4.72 115.64 110.43 1w3y s THR 620 Ca 0.00 1.21 -0.05 0.00 -1.18 0.00 0.00 61.69 61.67 1w3y s THR 620 Cb 0.00 -3.76 -0.00 0.00 1.34 0.00 0.00 72.50 70.08 1w3y s THR 620 CO 0.00 0.03 0.02 -0.89 -0.54 0.00 0.00 174.62 173.23 1w3y s THR 621 N -1.74 3.68 0.19 3.99 2.01 -1.26 -0.92 115.64 121.59 1w3y s THR 621 Ca 0.49 -0.57 -0.09 0.00 0.31 0.00 0.00 61.69 61.82 1w3y s THR 621 Cb -0.14 -2.79 -0.01 0.00 0.01 0.00 0.00 72.50 69.57 1w3y s THR 621 CO 0.19 0.26 0.32 -1.61 -0.69 0.00 0.00 174.62 173.10 1w3y s GLU 622 N 1.49 1.28 0.53 4.92 0.41 -0.67 -4.96 118.70 121.69 1w3y s GLU 622 Ca 0.04 -1.25 0.03 0.00 -0.41 0.00 0.00 54.97 53.38 1w3y s GLU 622 Cb -0.16 0.39 0.03 0.00 -1.78 0.00 0.00 34.13 32.62 1w3y s GLU 622 CO -0.00 -0.48 0.74 0.95 -0.49 0.00 0.00 175.26 175.97 1w3y s THR 623 N -4.01 2.71 -0.36 3.63 -4.23 -1.26 -1.73 115.64 110.39 1w3y s THR 623 Ca 0.21 -0.74 0.10 0.00 -1.18 0.00 0.00 61.69 60.09 1w3y s THR 623 Cb 0.03 -2.97 0.68 0.00 1.34 0.00 0.00 72.50 71.58 1w3y s THR 623 CO 0.04 0.00 1.60 -0.90 -0.54 0.00 0.00 174.62 174.82 1w3y n ASP 624 N -2.25 4.81 -4.76 3.99 5.75 -0.46 -4.96 116.55 118.67 1w3y n ASP 624 Ca 0.08 -2.89 -0.39 0.00 -0.01 0.00 0.00 54.79 51.59 1w3y n ASP 624 Cb 0.60 -0.68 0.02 0.00 -1.03 0.00 0.00 41.12 40.02 1w3y n ASP 624 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w3y s ALA 625 N -2.55 3.03 0.46 2.12 0.00 -1.26 -4.96 121.76 118.60 1w3y s ALA 625 Ca 0.47 1.26 -0.24 0.00 0.00 0.00 0.00 51.96 53.45 1w3y s ALA 625 Cb 0.36 -3.52 -0.07 0.00 0.00 0.00 0.00 23.12 19.89 1w3y s ALA 625 CO 0.13 -1.07 1.22 -1.59 0.00 0.00 0.00 175.76 174.45 1w3y s LYS 626 N -2.62 3.73 0.10 0.00 0.00 -1.26 -5.04 119.74 114.65 1w3y s LYS 626 Ca 0.64 1.93 0.10 0.00 0.00 0.00 0.00 55.97 58.65 1w3y s LYS 626 Cb -0.38 -2.48 -0.04 0.00 0.00 0.00 0.00 37.83 34.93 1w3y s LYS 626 CO 0.47 -0.62 -0.26 1.03 0.00 0.00 0.00 175.35 175.97 1w3y s ARG 627 N -2.60 1.54 -0.03 1.78 1.81 -1.26 -5.13 118.95 115.07 1w3y s ARG 627 Ca 0.63 -1.27 -0.14 0.00 -1.72 0.00 0.00 55.73 53.23 1w3y s ARG 627 Cb -0.32 -1.94 -0.05 0.00 -0.45 0.00 0.00 34.95 32.18 1w3y s ARG 627 CO 0.40 0.47 0.39 0.00 -0.68 0.00 0.00 175.30 175.88 1w3y s ALA 628 N -0.99 3.69 0.43 2.13 0.00 -1.26 -4.98 121.76 120.78 1w3y s ALA 628 Ca 0.14 -0.26 0.23 0.00 0.00 0.00 0.00 51.96 52.07 1w3y s ALA 628 Cb -0.10 -2.38 1.29 0.00 0.00 0.00 0.00 23.12 21.94 1w3y s ALA 628 CO 0.05 0.44 2.04 -0.44 0.00 0.00 0.00 175.76 177.85 1w3y h ASP 629 N 4.98 0.00 0.66 0.00 3.32 -2.01 -2.50 116.42 120.87 1w3y h ASP 629 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1w3y h ASP 629 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1w3y h ASP 629 CO 0.63 0.15 0.00 -1.54 -1.72 0.00 0.00 179.24 176.76 1w3y n SER 630 N -3.87 0.00 -4.71 6.45 3.41 -1.26 -4.78 113.62 108.85 1w3y n SER 630 Ca -0.02 0.42 -0.31 0.00 -0.26 0.00 0.00 58.87 58.70 1w3y n SER 630 Cb 0.24 -0.47 0.14 0.00 -0.26 0.00 0.00 64.21 63.86 1w3y n SER 630 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1w3y s ASP 631 N -2.93 3.56 0.27 4.04 1.11 -0.94 -5.06 116.67 116.71 1w3y s ASP 631 Ca 0.11 2.05 0.04 0.00 0.18 0.00 0.00 52.55 54.93 1w3y s ASP 631 Cb 0.14 -2.55 -0.06 0.00 1.07 0.00 0.00 42.92 41.52 1w3y s ASP 631 CO 0.37 -2.68 0.01 0.42 1.18 0.00 0.00 175.17 174.47 1w3y s THR 632 N -2.75 1.16 1.02 -1.27 -4.23 -1.26 -4.89 115.64 103.42 1w3y s THR 632 Ca 0.65 -2.04 -0.11 0.00 -1.18 0.00 0.00 61.69 59.01 1w3y s THR 632 Cb -0.21 -2.53 0.20 0.00 1.34 0.00 0.00 72.50 71.31 1w3y s THR 632 CO 0.57 -0.19 1.10 -0.83 -0.54 0.00 0.00 174.62 174.73 1w3y s GLY 633 N -3.39 1.63 0.16 3.99 0.00 -1.23 -5.02 107.32 103.46 1w3y s GLY 633 Ca 0.32 0.31 -0.05 0.00 0.00 0.00 0.00 44.72 45.30 1w3y s GLY 633 CO 0.12 0.85 0.18 0.54 0.00 0.00 0.00 173.10 174.78 1w3y s LYS 634 N -4.57 1.08 0.31 2.90 -0.14 -1.26 -4.94 119.74 113.12 1w3y s LYS 634 Ca 0.67 -1.34 0.06 0.00 -1.36 0.00 0.00 55.97 54.01 1w3y s LYS 634 Cb -0.24 0.31 -0.02 0.00 -1.68 0.00 0.00 37.83 36.21 1w3y s LYS 634 CO 0.61 -0.36 0.41 0.14 -0.76 0.00 0.00 175.35 175.39 1w3y s VAL 635 N -4.02 4.24 0.20 3.17 -7.23 -1.26 -1.18 120.40 114.32 1w3y s VAL 635 Ca 0.23 -1.07 -0.18 0.00 -1.81 0.00 0.00 61.98 59.15 1w3y s VAL 635 Cb 0.05 -3.46 -0.08 0.00 0.56 0.00 0.00 36.38 33.45 1w3y s VAL 635 CO 0.02 -0.20 0.68 -0.22 -0.31 0.00 0.00 175.10 175.07 1w3y s LEU 636 N -4.10 4.34 0.32 1.32 2.96 -0.54 -4.91 118.68 118.07 1w3y s LEU 636 Ca 0.42 1.33 0.01 0.00 -0.22 0.00 0.00 54.13 55.67 1w3y s LEU 636 Cb -0.09 -3.52 0.54 0.00 0.50 0.00 0.00 46.19 43.63 1w3y s LEU 636 CO 0.30 0.05 1.94 -0.65 -1.32 0.00 0.00 176.35 176.66 1w3y h PRO 637 N 3.43 0.84 -6.34 0.98 0.11 -1.92 -2.87 132.00 126.23 1w3y h PRO 637 Ca -0.48 -0.09 -0.54 0.00 0.11 0.00 0.00 66.00 64.99 1w3y h PRO 637 Cb 1.19 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1w3y h PRO 637 CO 0.65 0.63 -0.21 0.45 -0.21 0.00 0.00 178.00 179.31 1w3y s SER 638 N -6.51 6.49 0.00 -2.05 0.15 -1.26 -4.77 113.70 105.76 1w3y s SER 638 Ca -0.10 0.68 0.21 0.00 0.70 0.00 0.00 55.95 57.45 1w3y s SER 638 Cb 0.17 -2.13 0.17 0.00 -1.71 0.00 0.00 66.02 62.52 1w3y s SER 638 CO 0.78 -0.07 1.17 0.00 1.20 0.00 0.00 173.24 176.32 1w3y n ALA 639 N -0.40 2.48 -2.02 5.45 0.00 -1.26 -1.64 120.51 123.11 1w3y n ALA 639 Ca -0.02 -0.67 -0.42 0.00 0.00 0.00 0.00 53.44 52.33 1w3y n ALA 639 Cb 0.53 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.26 1w3y n ALA 639 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1w3y n PHE 640 N 1.19 3.59 -3.71 0.00 7.35 -1.26 -3.61 117.46 121.00 1w3y n PHE 640 Ca 0.12 -2.93 -0.15 0.00 -0.76 0.00 0.00 57.45 53.73 1w3y n PHE 640 Cb 0.53 -2.42 -0.15 0.00 0.35 0.00 0.00 39.48 37.80 1w3y n PHE 640 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1w3y s VAL 641 N 2.62 -0.14 0.00 -2.13 1.01 -1.26 -1.94 120.40 118.55 1w3y s VAL 641 Ca 0.46 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.70 1w3y s VAL 641 Cb 0.11 -0.26 0.00 0.00 0.00 0.00 0.00 36.38 36.23 1w3y s VAL 641 CO -0.04 0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.77 1w3y n GLY 642 N 4.71 0.72 3.15 4.51 0.00 -0.86 -4.77 105.19 112.66 1w3y n GLY 642 Ca -0.17 -0.95 -0.27 0.00 0.00 0.00 0.00 46.02 44.63 1w3y n GLY 642 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1w3y s THR 643 N -2.00 1.53 -0.29 2.61 2.01 -1.26 -1.78 115.64 116.46 1w3y s THR 643 Ca 0.00 -0.77 -0.06 0.00 0.31 0.00 0.00 61.69 61.17 1w3y s THR 643 Cb 0.00 -1.31 0.01 0.00 0.01 0.00 0.00 72.50 71.20 1w3y s THR 643 CO 0.00 0.44 0.07 -0.55 -0.69 0.00 0.00 174.62 173.89 1w3y s SER 644 N 0.06 5.06 -0.19 3.53 0.15 0.62 -4.92 113.70 118.00 1w3y s SER 644 Ca -0.05 -0.67 -0.10 0.00 0.70 0.00 0.00 55.95 55.83 1w3y s SER 644 Cb -0.12 -1.87 -0.05 0.00 -1.71 0.00 0.00 66.02 62.27 1w3y s SER 644 CO 0.03 -0.17 0.14 -0.75 1.20 0.00 0.00 173.24 173.68 1w3y s LYS 645 N 1.50 4.15 -0.23 5.44 2.20 -1.26 -1.32 119.74 130.21 1w3y s LYS 645 Ca 0.03 -0.20 -0.18 0.00 -0.36 0.00 0.00 55.97 55.25 1w3y s LYS 645 Cb -0.17 -3.41 -0.16 0.00 -1.51 0.00 0.00 37.83 32.59 1w3y s LYS 645 CO 0.02 0.32 -0.03 -0.11 -0.36 0.00 0.00 175.35 175.19 1w3y n LEU 646 N 3.44 1.90 0.00 5.43 7.94 -0.51 -4.83 117.00 130.37 1w3y n LEU 646 Ca -0.16 0.39 0.00 0.00 -1.11 0.00 0.00 56.01 55.13 1w3y n LEU 646 Cb 0.52 -0.90 0.00 0.00 0.53 0.00 0.00 43.42 43.57 1w3y n LEU 646 CO 0.37 0.37 0.00 -0.90 -1.11 0.00 0.00 177.39 176.12 1w3y n ASP 647 N -4.37 0.00 0.00 1.96 5.68 -1.17 -5.01 116.55 113.65 1w3y n ASP 647 Ca -0.40 -0.25 0.07 0.00 -0.50 0.00 0.00 54.79 53.71 1w3y n ASP 647 Cb 0.75 0.00 0.35 0.00 -1.14 0.00 0.00 41.12 41.08 1w3y n ASP 647 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1w3y n ASP 648 N -0.47 0.00 0.00 -1.12 8.00 -1.26 -3.65 116.55 118.05 1w3y n ASP 648 Ca 0.00 0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.84 1w3y n ASP 648 Cb 0.00 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 40.68 1w3y n ASP 648 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1w3y n ALA 649 N -1.42 1.17 -3.33 2.24 0.00 -1.26 -3.21 120.51 114.69 1w3y n ALA 649 Ca 0.05 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.26 1w3y n ALA 649 Cb 0.16 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.44 1w3y n ALA 649 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1w3y s ASN 650 N -0.61 1.60 0.19 0.00 0.01 -1.24 -0.34 114.94 114.54 1w3y s ASN 650 Ca 0.00 -0.26 -0.22 0.00 -0.71 0.00 0.00 52.86 51.67 1w3y s ASN 650 Cb 0.00 -0.65 0.06 0.00 0.41 0.00 0.00 41.25 41.07 1w3y s ASN 650 CO 0.00 0.04 0.61 0.00 -1.51 0.00 0.00 177.10 176.25 1w3y s ALA 651 N 0.52 -1.47 -0.00 0.60 0.00 -0.62 -1.42 121.76 119.37 1w3y s ALA 651 Ca -0.11 0.27 0.03 0.00 0.00 0.00 0.00 51.96 52.15 1w3y s ALA 651 Cb -0.14 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.85 1w3y s ALA 651 CO 0.02 -0.82 -0.08 0.99 0.00 0.00 0.00 175.76 175.87 1w3y s THR 652 N -3.79 0.67 0.08 0.00 2.01 -0.44 -0.71 115.64 113.46 1w3y s THR 652 Ca 0.04 -0.40 0.01 0.00 0.31 0.00 0.00 61.69 61.65 1w3y s THR 652 Cb -0.02 -0.57 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 1w3y s THR 652 CO -0.08 0.16 -0.06 0.00 -0.69 0.00 0.00 174.62 173.95 1w3y s ALA 653 N -0.25 0.82 0.09 7.40 0.00 -0.27 -0.28 121.76 129.27 1w3y s ALA 653 Ca 0.03 -1.22 -0.11 0.00 0.00 0.00 0.00 51.96 50.65 1w3y s ALA 653 Cb -0.04 0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.26 1w3y s ALA 653 CO -0.00 -0.22 0.26 -0.08 0.00 0.00 0.00 175.76 175.71 1w3y s THR 654 N -3.29 0.11 -0.15 0.00 -1.32 -0.73 -0.90 115.64 109.36 1w3y s THR 654 Ca 0.07 -0.94 -0.04 0.00 -1.21 0.00 0.00 61.69 59.57 1w3y s THR 654 Cb 0.03 -1.21 0.07 0.00 -1.51 0.00 0.00 72.50 69.88 1w3y s THR 654 CO -0.05 -0.52 0.24 -0.32 -2.21 0.00 0.00 174.62 171.76 1w3y s MET 655 N -3.58 0.15 -1.23 7.08 0.00 0.57 -2.02 119.30 120.28 1w3y s MET 655 Ca 0.02 0.54 -0.18 0.00 0.00 0.00 0.00 55.69 56.07 1w3y s MET 655 Cb 0.03 -0.46 0.08 0.00 0.00 0.00 0.00 34.83 34.48 1w3y s MET 655 CO -0.10 -0.42 1.63 0.34 0.00 0.00 0.00 175.02 176.47 1w3y s ASP 656 N 2.38 6.80 0.20 1.11 2.15 -0.82 -2.02 116.67 126.47 1w3y s ASP 656 Ca 0.04 -2.31 -0.30 0.00 0.43 0.00 0.00 52.55 50.41 1w3y s ASP 656 Cb -0.13 -2.55 -0.08 0.00 -0.30 0.00 0.00 42.92 39.85 1w3y s ASP 656 CO -0.10 -1.18 1.00 0.12 -0.17 0.00 0.00 175.17 174.84 1w3y s PHE 657 N 4.03 3.81 -0.02 -5.34 5.36 -0.70 -4.67 117.98 120.46 1w3y s PHE 657 Ca 0.51 1.79 0.00 0.00 -0.96 0.00 0.00 56.93 58.27 1w3y s PHE 657 Cb 0.02 -3.10 0.02 0.00 -0.34 0.00 0.00 43.02 39.62 1w3y s PHE 657 CO 0.03 0.03 0.01 0.99 -1.46 0.00 0.00 175.22 174.83 1w3y s THR 658 N -0.69 0.04 0.99 0.12 2.01 -1.26 -1.80 115.64 115.05 1w3y s THR 658 Ca 0.45 0.11 -0.15 0.00 0.31 0.00 0.00 61.69 62.40 1w3y s THR 658 Cb -0.27 -0.13 0.19 0.00 0.01 0.00 0.00 72.50 72.31 1w3y s THR 658 CO 0.33 0.08 1.22 0.54 -0.69 0.00 0.00 174.62 176.10 1w3y s ASN 659 N 0.73 2.84 0.45 3.53 4.22 -0.23 -4.91 114.94 121.57 1w3y s ASN 659 Ca -0.06 0.57 0.22 0.00 -2.14 0.00 0.00 52.86 51.45 1w3y s ASN 659 Cb -0.09 -0.83 1.21 0.00 1.28 0.00 0.00 41.25 42.82 1w3y s ASN 659 CO -0.02 -2.93 1.85 4.11 -2.04 0.00 0.00 177.10 178.07 1w3y h TRP 660 N -1.77 0.39 -0.18 1.54 5.08 -1.98 -2.30 115.95 116.73 1w3y h TRP 660 Ca -0.46 0.01 -0.03 0.00 1.08 0.00 0.00 58.89 59.49 1w3y h TRP 660 Cb 1.28 -0.12 -0.02 0.00 -3.00 0.00 0.00 29.16 27.30 1w3y h TRP 660 CO -0.89 0.08 -0.04 0.27 -1.28 0.00 0.00 178.44 176.59 1w3y n ASN 661 N -4.45 3.06 -3.83 0.11 2.04 -1.26 -4.99 115.26 105.93 1w3y n ASN 661 Ca 0.20 -3.22 -0.24 0.00 -0.44 0.00 0.00 54.58 50.89 1w3y n ASN 661 Cb 0.82 -0.52 0.01 0.00 -2.53 0.00 0.00 39.78 37.55 1w3y n ASN 661 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1w3y n GLN 662 N -0.93 -4.24 -0.00 -3.83 3.00 -0.87 -4.88 117.38 105.63 1w3y n GLN 662 Ca 0.22 0.52 0.01 0.00 -0.01 0.00 0.00 57.00 57.73 1w3y n GLN 662 Cb 0.83 -4.93 -0.01 0.00 0.00 0.00 0.00 30.24 26.13 1w3y n GLN 662 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 1w3y n THR 663 N -4.36 0.00 -3.94 5.09 -2.24 -1.26 -4.96 114.28 102.61 1w3y n THR 663 Ca -0.27 -0.39 -0.12 0.00 -2.27 0.00 0.00 64.05 61.00 1w3y n THR 663 Cb 0.67 0.91 -0.13 0.00 -2.10 0.00 0.00 70.33 69.67 1w3y n THR 663 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1w3y s LEU 664 N -2.25 2.09 0.16 3.22 0.20 -1.26 -0.60 118.68 120.23 1w3y s LEU 664 Ca 0.00 -0.19 0.03 0.00 0.69 0.00 0.00 54.13 54.65 1w3y s LEU 664 Cb 0.01 -0.01 -0.05 0.00 -0.43 0.00 0.00 46.19 45.72 1w3y s LEU 664 CO 0.06 -0.10 -0.03 0.42 -0.29 0.00 0.00 176.35 176.41 1w3y s THR 665 N -0.54 0.82 -0.29 3.68 -4.23 -0.69 -1.07 115.64 113.32 1w3y s THR 665 Ca -0.05 -1.99 -0.24 0.00 -1.18 0.00 0.00 61.69 58.22 1w3y s THR 665 Cb -0.04 -2.01 0.16 0.00 1.34 0.00 0.00 72.50 71.96 1w3y s THR 665 CO -0.00 -0.59 1.25 0.00 -0.54 0.00 0.00 174.62 174.74 1w3y s ALA 666 N -3.56 -2.16 -0.59 3.99 0.00 -0.74 -2.03 121.76 116.66 1w3y s ALA 666 Ca 0.21 1.80 -0.20 0.00 0.00 0.00 0.00 51.96 53.77 1w3y s ALA 666 Cb 0.05 -1.67 0.08 0.00 0.00 0.00 0.00 23.12 21.59 1w3y s ALA 666 CO 0.02 -0.18 0.77 -1.01 0.00 0.00 0.00 175.76 175.36 1w3y s HIS 667 N 0.24 2.92 -0.19 0.00 3.76 0.11 -1.71 115.29 120.42 1w3y s HIS 667 Ca 0.04 -0.70 -0.09 0.00 -0.15 0.00 0.00 55.06 54.15 1w3y s HIS 667 Cb -0.05 -3.98 -0.05 0.00 1.11 0.00 0.00 32.58 29.62 1w3y s HIS 667 CO -0.12 -1.33 0.12 0.15 -0.85 0.00 0.00 174.74 172.71 1w3y s LYS 668 N 3.09 4.08 0.06 1.40 1.02 -0.85 -1.79 119.74 126.75 1w3y s LYS 668 Ca 0.16 -0.23 0.01 0.00 0.02 0.00 0.00 55.97 55.93 1w3y s LYS 668 Cb -0.21 -3.36 -0.03 0.00 -0.52 0.00 0.00 37.83 33.71 1w3y s LYS 668 CO 0.09 0.34 -0.06 -1.12 -0.92 0.00 0.00 175.35 173.69 1w3y s SER 669 N 0.22 0.79 -0.01 2.83 0.01 0.24 -0.32 113.70 117.46 1w3y s SER 669 Ca 0.08 -0.78 0.03 0.00 1.31 0.00 0.00 55.95 56.59 1w3y s SER 669 Cb -0.11 0.10 -0.00 0.00 0.21 0.00 0.00 66.02 66.21 1w3y s SER 669 CO -0.01 -0.38 -0.09 0.26 0.41 0.00 0.00 173.24 173.43 1w3y s TRP 670 N -2.61 0.81 -0.35 2.43 0.51 -0.08 -1.34 118.94 118.32 1w3y s TRP 670 Ca -0.00 -0.16 0.02 0.00 -2.12 0.00 0.00 56.10 53.83 1w3y s TRP 670 Cb -0.02 -0.54 0.10 0.00 -0.81 0.00 0.00 33.47 32.21 1w3y s TRP 670 CO -0.03 -0.03 0.09 -0.06 -0.51 0.00 0.00 176.95 176.41 1w3y s PHE 671 N -0.12 2.88 -0.46 -1.98 0.40 -0.05 -1.12 117.98 117.54 1w3y s PHE 671 Ca 0.02 -2.53 -0.28 0.00 -0.60 0.00 0.00 56.93 53.54 1w3y s PHE 671 Cb -0.04 -2.43 0.03 0.00 0.51 0.00 0.00 43.02 41.09 1w3y s PHE 671 CO -0.00 -0.90 1.06 -1.64 0.70 0.00 0.00 175.22 174.44 1w3y s MET 672 N 1.03 3.69 -0.59 0.44 -1.94 0.12 -0.97 119.30 121.08 1w3y s MET 672 Ca 0.11 0.48 0.06 0.00 -1.71 0.00 0.00 55.69 54.63 1w3y s MET 672 Cb -0.19 -3.90 0.31 0.00 2.01 0.00 0.00 34.83 33.06 1w3y s MET 672 CO -0.13 -1.29 0.86 1.28 -0.01 0.00 0.00 175.02 175.73 1w3y n LEU 673 N 7.54 4.03 0.00 -0.03 4.77 -0.38 -1.59 117.00 131.34 1w3y n LEU 673 Ca 0.10 -5.56 0.00 0.00 -0.03 0.00 0.00 56.01 50.52 1w3y n LEU 673 Cb 0.49 -0.53 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1w3y n LEU 673 CO 0.68 2.24 0.00 1.17 -1.33 0.00 0.00 177.39 180.16 1w3y n LYS 674 N 0.19 0.00 -0.14 3.23 4.81 0.54 -3.62 118.16 123.16 1w3y n LYS 674 Ca 0.30 0.00 0.09 0.00 -0.87 0.00 0.00 58.31 57.84 1w3y n LYS 674 Cb 0.41 0.00 0.15 0.00 0.02 0.00 0.00 35.03 35.61 1w3y n LYS 674 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1w3y n ASP 675 N 1.43 2.28 -3.55 3.14 5.75 -1.26 -4.80 116.55 119.54 1w3y n ASP 675 Ca 0.00 -3.20 -0.07 0.00 -0.01 0.00 0.00 54.79 51.52 1w3y n ASP 675 Cb 0.00 -0.44 -0.02 0.00 -1.03 0.00 0.00 41.12 39.63 1w3y n ASP 675 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1w3y s LYS 676 N -2.93 0.74 -0.06 0.11 -2.85 -1.24 -4.35 119.74 109.17 1w3y s LYS 676 Ca 0.33 -0.30 0.00 0.00 -1.00 0.00 0.00 55.97 55.00 1w3y s LYS 676 Cb 0.29 0.33 0.02 0.00 -2.06 0.00 0.00 37.83 36.41 1w3y s LYS 676 CO 0.02 -0.33 -0.04 0.42 0.10 0.00 0.00 175.35 175.52 1w3y s ILE 677 N -2.98 0.57 -0.02 3.79 1.09 -0.74 -1.25 121.20 121.66 1w3y s ILE 677 Ca 0.07 -0.10 -0.16 0.00 -1.10 0.00 0.00 60.65 59.36 1w3y s ILE 677 Cb -0.01 -0.61 -0.05 0.00 -1.06 0.00 0.00 42.46 40.72 1w3y s ILE 677 CO -0.07 0.25 0.42 0.00 -0.10 0.00 0.00 174.94 175.45 1w3y s ALA 678 N 1.19 3.65 -0.23 9.38 0.00 -0.14 -0.39 121.76 135.21 1w3y s ALA 678 Ca -0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 51.96 51.67 1w3y s ALA 678 Cb -0.14 -2.45 0.01 0.00 0.00 0.00 0.00 23.12 20.55 1w3y s ALA 678 CO -0.01 0.38 -0.08 -0.06 0.00 0.00 0.00 175.76 175.99 1w3y s PHE 679 N -0.73 2.97 -0.03 0.00 0.40 0.74 -0.87 117.98 120.46 1w3y s PHE 679 Ca 0.24 -1.34 0.06 0.00 -0.60 0.00 0.00 56.93 55.29 1w3y s PHE 679 Cb -0.16 -2.05 -0.01 0.00 0.51 0.00 0.00 43.02 41.30 1w3y s PHE 679 CO 0.13 -0.68 -0.21 -0.51 0.70 0.00 0.00 175.22 174.65 1w3y s LEU 680 N 1.38 2.01 -0.02 -0.37 1.43 -0.45 -1.60 118.68 121.07 1w3y s LEU 680 Ca 0.03 -0.40 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1w3y s LEU 680 Cb -0.15 -1.12 0.01 0.00 0.03 0.00 0.00 46.19 44.96 1w3y s LEU 680 CO -0.06 0.23 -0.03 -0.83 0.23 0.00 0.00 176.35 175.90 1w3y s GLY 681 N -0.30 0.25 0.25 -3.19 0.00 -0.20 -0.60 107.32 103.54 1w3y s GLY 681 Ca 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 44.72 44.69 1w3y s GLY 681 CO 0.01 0.17 0.25 -1.35 0.00 0.00 0.00 173.10 172.17 1w3y s SER 682 N 0.39 0.56 -1.45 1.64 1.04 -0.74 -1.38 113.70 113.77 1w3y s SER 682 Ca -0.04 -1.43 -0.09 0.00 0.48 0.00 0.00 55.95 54.87 1w3y s SER 682 Cb -0.07 0.48 0.05 0.00 0.10 0.00 0.00 66.02 66.58 1w3y s SER 682 CO -0.01 -0.98 0.74 -3.20 0.98 0.00 0.00 173.24 170.77 1w3y n ASN 683 N -0.71 -5.10 -4.65 7.02 4.05 -1.21 -0.71 115.26 113.94 1w3y n ASN 683 Ca 0.03 -0.48 -0.43 0.00 0.45 0.00 0.00 54.58 54.15 1w3y n ASN 683 Cb 0.64 -4.11 -0.02 0.00 1.23 0.00 0.00 39.78 37.52 1w3y n ASN 683 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1w3y s ILE 684 N -3.15 4.35 0.04 -1.44 1.01 -0.88 -3.98 121.20 117.15 1w3y s ILE 684 Ca 0.46 1.61 0.04 0.00 0.00 0.00 0.00 60.65 62.77 1w3y s ILE 684 Cb -0.23 -4.10 -0.02 0.00 0.01 0.00 0.00 42.46 38.12 1w3y s ILE 684 CO 0.57 -0.21 -0.13 -1.10 0.00 0.00 0.00 174.94 174.07 1w3y s GLN 685 N 3.55 0.85 -0.04 2.79 -0.21 -0.86 -0.41 119.66 125.33 1w3y s GLN 685 Ca 0.52 -0.76 -0.02 0.00 0.02 0.00 0.00 55.36 55.13 1w3y s GLN 685 Cb -0.19 -0.83 0.03 0.00 1.00 0.00 0.00 33.01 33.02 1w3y s GLN 685 CO 0.14 0.20 0.05 1.21 -2.12 0.00 0.00 175.29 174.78 1w3y s ASN 686 N -1.21 0.94 0.00 5.90 2.47 -1.26 -1.70 114.94 120.08 1w3y s ASN 686 Ca -0.00 0.07 0.16 0.00 0.42 0.00 0.00 52.86 53.51 1w3y s ASN 686 Cb -0.08 -0.13 0.32 0.00 -1.45 0.00 0.00 41.25 39.91 1w3y s ASN 686 CO 0.01 -0.23 1.23 0.35 -3.72 0.00 0.00 177.10 174.74 1w3y n THR 687 N 5.09 0.59 -2.95 -5.21 -2.24 0.23 -4.94 114.28 104.84 1w3y n THR 687 Ca -0.08 -0.80 -0.20 0.00 -2.27 0.00 0.00 64.05 60.71 1w3y n THR 687 Cb 0.50 0.84 0.07 0.00 -2.10 0.00 0.00 70.33 69.64 1w3y n THR 687 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1w3y s SER 688 N -1.14 5.02 0.00 3.42 1.04 -1.26 -5.00 113.70 115.77 1w3y s SER 688 Ca 0.28 -0.73 0.26 0.00 0.48 0.00 0.00 55.95 56.24 1w3y s SER 688 Cb 0.16 0.17 0.71 0.00 0.10 0.00 0.00 66.02 67.16 1w3y s SER 688 CO 0.22 -1.39 1.54 0.35 0.98 0.00 0.00 173.24 174.95 1w3y n THR 689 N -2.32 0.00 -2.36 2.02 -2.24 -1.26 -4.91 114.28 103.22 1w3y n THR 689 Ca 0.15 -0.23 -0.30 0.00 -2.27 0.00 0.00 64.05 61.41 1w3y n THR 689 Cb 0.61 0.65 -0.01 0.00 -2.10 0.00 0.00 70.33 69.48 1w3y n THR 689 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1w3y s ASP 690 N -2.27 6.34 0.15 3.42 1.01 -1.26 -5.06 116.67 119.01 1w3y s ASP 690 Ca 0.29 1.23 -0.22 0.00 0.71 0.00 0.00 52.55 54.56 1w3y s ASP 690 Cb 0.20 -2.38 -0.08 0.00 1.01 0.00 0.00 42.92 41.67 1w3y s ASP 690 CO 0.44 -0.66 0.70 0.42 0.21 0.00 0.00 175.17 176.28 1w3y s THR 691 N -2.82 4.52 0.06 -1.27 -4.23 -1.26 -4.84 115.64 105.79 1w3y s THR 691 Ca 0.52 1.47 0.04 0.00 -1.18 0.00 0.00 61.69 62.55 1w3y s THR 691 Cb -0.10 -4.01 -0.04 0.00 1.34 0.00 0.00 72.50 69.69 1w3y s THR 691 CO 0.44 0.48 -0.03 0.00 -0.54 0.00 0.00 174.62 174.97 1w3y s ALA 692 N -1.21 3.19 -0.01 3.99 0.00 -1.26 -1.36 121.76 125.11 1w3y s ALA 692 Ca 0.35 -1.09 -0.28 0.00 0.00 0.00 0.00 51.96 50.94 1w3y s ALA 692 Cb -0.21 -1.16 0.10 0.00 0.00 0.00 0.00 23.12 21.85 1w3y s ALA 692 CO 0.23 0.67 0.85 0.00 0.00 0.00 0.00 175.76 177.50 1w3y s ALA 693 N -1.20 -1.80 -0.13 0.00 0.00 -0.71 -1.20 121.76 116.72 1w3y s ALA 693 Ca 0.22 1.05 -0.01 0.00 0.00 0.00 0.00 51.96 53.22 1w3y s ALA 693 Cb -0.11 0.28 -0.02 0.00 0.00 0.00 0.00 23.12 23.26 1w3y s ALA 693 CO 0.14 -0.62 -0.08 0.99 0.00 0.00 0.00 175.76 176.19 1w3y s THR 694 N -2.76 3.48 -0.46 0.00 2.01 -0.24 -1.67 115.64 116.00 1w3y s THR 694 Ca 0.02 -0.51 -0.25 0.00 0.31 0.00 0.00 61.69 61.26 1w3y s THR 694 Cb -0.01 -2.49 0.03 0.00 0.01 0.00 0.00 72.50 70.04 1w3y s THR 694 CO -0.07 0.52 0.87 -0.89 -0.69 0.00 0.00 174.62 174.37 1w3y s THR 695 N 0.22 4.54 0.21 -0.82 2.01 -0.10 -1.33 115.64 120.36 1w3y s THR 695 Ca -0.05 0.63 -0.05 0.00 0.31 0.00 0.00 61.69 62.53 1w3y s THR 695 Cb -0.15 -4.39 0.03 0.00 0.01 0.00 0.00 72.50 68.00 1w3y s THR 695 CO 0.04 -0.79 1.62 0.40 -0.69 0.00 0.00 174.62 175.19 1w3y h ILE 696 N 6.04 1.27 -1.91 1.82 2.04 -0.88 0.57 117.51 126.47 1w3y h ILE 696 Ca -0.24 -1.35 0.13 0.00 1.00 0.00 0.00 64.86 64.40 1w3y h ILE 696 Cb 1.08 1.21 -0.18 0.00 -0.74 0.00 0.00 36.82 38.19 1w3y h ILE 696 CO 1.00 0.45 0.58 -0.62 0.00 0.00 0.00 178.15 179.57 1w3y s ASP 697 N -6.75 -0.31 -0.38 1.72 -1.08 -0.98 -4.22 116.67 104.67 1w3y s ASP 697 Ca -0.10 0.10 0.03 0.00 -0.52 0.00 0.00 52.55 52.07 1w3y s ASP 697 Cb 0.13 0.31 0.16 0.00 -1.46 0.00 0.00 42.92 42.05 1w3y s ASP 697 CO 0.84 -0.46 0.39 -1.58 0.52 0.00 0.00 175.17 174.88 1w3y s GLN 698 N -2.42 0.66 -0.21 4.34 0.74 -1.25 -0.78 119.66 120.74 1w3y s GLN 698 Ca 0.04 -0.88 -0.10 0.00 0.05 0.00 0.00 55.36 54.47 1w3y s GLN 698 Cb -0.01 -0.71 -0.05 0.00 1.10 0.00 0.00 33.01 33.34 1w3y s GLN 698 CO -0.05 -1.20 0.13 0.50 -0.55 0.00 0.00 175.29 174.11 1w3y s ARG 699 N 1.40 4.09 0.09 1.67 6.06 -0.38 -4.84 118.95 127.03 1w3y s ARG 699 Ca 0.17 -0.27 -0.30 0.00 -2.50 0.00 0.00 55.73 52.83 1w3y s ARG 699 Cb -0.15 -3.43 -0.06 0.00 0.06 0.00 0.00 34.95 31.38 1w3y s ARG 699 CO -0.02 0.19 1.10 0.21 -2.50 0.00 0.00 175.30 174.28 1w3y s LYS 700 N 0.67 4.53 0.36 5.12 2.20 -1.26 -0.99 119.74 130.36 1w3y s LYS 700 Ca 0.07 1.65 0.05 0.00 -0.36 0.00 0.00 55.97 57.38 1w3y s LYS 700 Cb -0.12 -3.35 -0.01 0.00 -1.51 0.00 0.00 37.83 32.84 1w3y s LYS 700 CO 0.01 -0.07 0.51 -0.51 -0.36 0.00 0.00 175.35 174.93 1w3y s LEU 701 N 0.52 3.91 -0.15 5.43 1.43 0.17 -4.95 118.68 125.05 1w3y s LEU 701 Ca 0.53 -0.06 -0.01 0.00 -1.03 0.00 0.00 54.13 53.57 1w3y s LEU 701 Cb -0.27 -2.86 -0.01 0.00 0.03 0.00 0.00 46.19 43.08 1w3y s LEU 701 CO 0.31 -0.48 -0.12 -1.61 0.23 0.00 0.00 176.35 174.68 1w3y s GLU 702 N -4.26 3.35 0.51 1.70 2.02 -1.26 -4.64 118.70 116.12 1w3y s GLU 702 Ca 0.45 -0.69 0.25 0.00 0.02 0.00 0.00 54.97 55.00 1w3y s GLU 702 Cb -0.10 -2.70 1.35 0.00 0.10 0.00 0.00 34.13 32.78 1w3y s GLU 702 CO 0.33 0.10 2.05 0.66 0.02 0.00 0.00 175.26 178.42 1w3y h SER 703 N 7.09 0.00 0.40 -0.19 4.64 -1.99 -2.68 113.55 120.82 1w3y h SER 703 Ca -0.30 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 60.78 1w3y h SER 703 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1w3y h SER 703 CO 0.57 0.14 -1.02 0.77 -0.87 0.00 0.00 176.83 176.42 1w3y h SER 704 N 0.00 0.51 -3.44 4.97 4.64 -2.06 -3.39 113.55 114.78 1w3y h SER 704 Ca -0.00 -0.44 -0.66 0.00 -0.47 0.00 0.00 61.79 60.22 1w3y h SER 704 Cb 0.33 -0.16 -0.39 0.00 -0.31 0.00 0.00 62.40 61.87 1w3y h SER 704 CO 0.02 1.26 -0.41 0.20 -0.87 0.00 0.00 176.83 177.03 1w3y s ASN 705 N -7.11 5.16 0.51 4.97 0.02 -1.01 -5.09 114.94 112.39 1w3y s ASN 705 Ca -0.05 -3.62 -0.21 0.00 -1.02 0.00 0.00 52.86 47.96 1w3y s ASN 705 Cb 0.08 -1.74 -0.07 0.00 0.02 0.00 0.00 41.25 39.54 1w3y s ASN 705 CO 0.87 -0.16 1.13 -2.16 0.02 0.00 0.00 177.10 176.80 1w3y s PRO 706 N -1.15 3.56 -0.03 -0.60 0.04 -1.25 -4.44 135.00 131.13 1w3y s PRO 706 Ca 0.24 1.63 -0.08 0.00 0.04 0.00 0.00 61.00 62.84 1w3y s PRO 706 Cb -0.10 -2.16 -0.05 0.00 0.04 0.00 0.00 34.50 32.24 1w3y s PRO 706 CO -0.12 -0.69 0.25 0.71 0.04 0.00 0.00 177.00 177.19 1w3y s TYR 707 N -1.72 3.60 -0.26 0.56 2.02 -1.26 -4.62 117.35 115.67 1w3y s TYR 707 Ca 0.69 0.61 -0.09 0.00 -0.37 0.00 0.00 57.07 57.91 1w3y s TYR 707 Cb -0.25 -2.01 -0.04 0.00 -0.40 0.00 0.00 41.96 39.27 1w3y s TYR 707 CO 0.29 0.66 0.11 0.21 -1.57 0.00 0.00 175.55 175.24 1w3y s LYS 708 N -1.46 3.77 -0.12 -0.62 2.20 -0.04 -4.89 119.74 118.57 1w3y s LYS 708 Ca 0.23 -0.42 -0.14 0.00 -0.36 0.00 0.00 55.97 55.29 1w3y s LYS 708 Cb -0.13 -3.44 -0.05 0.00 -1.51 0.00 0.00 37.83 32.70 1w3y s LYS 708 CO 0.12 -0.18 0.31 0.08 -0.36 0.00 0.00 175.35 175.33 1w3y s VAL 709 N 1.65 5.26 -0.04 4.02 1.01 -1.26 -1.05 120.40 129.98 1w3y s VAL 709 Ca 0.07 0.60 0.05 0.00 0.00 0.00 0.00 61.98 62.70 1w3y s VAL 709 Cb -0.15 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 1w3y s VAL 709 CO 0.06 0.45 -0.20 -0.31 0.00 0.00 0.00 175.10 175.11 1w3y s TYR 710 N -0.05 1.92 -0.14 5.22 1.51 -0.16 -0.19 117.35 125.46 1w3y s TYR 710 Ca 0.19 -0.50 0.01 0.00 -1.01 0.00 0.00 57.07 55.76 1w3y s TYR 710 Cb -0.14 -1.26 0.02 0.00 -0.11 0.00 0.00 41.96 40.46 1w3y s TYR 710 CO 0.06 -0.13 -0.17 0.08 -1.11 0.00 0.00 175.55 174.28 1w3y s VAL 711 N -0.18 1.75 -1.43 0.71 1.01 -0.23 -0.57 120.40 121.47 1w3y s VAL 711 Ca 0.00 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.17 1w3y s VAL 711 Cb -0.11 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.70 1w3y s VAL 711 CO 0.02 0.49 0.37 0.59 0.00 0.00 0.00 175.10 176.57 1w3y n ASN 712 N 4.41 -5.07 -1.08 3.32 3.02 -0.17 -1.41 115.26 118.28 1w3y n ASN 712 Ca -0.19 -0.18 -0.13 0.00 -0.03 0.00 0.00 54.58 54.05 1w3y n ASN 712 Cb 0.51 -4.17 -0.04 0.00 -0.61 0.00 0.00 39.78 35.47 1w3y n ASN 712 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1w3y n ASP 713 N -2.25 -4.39 -4.17 6.41 2.03 -1.26 -5.02 116.55 107.90 1w3y n ASP 713 Ca -0.12 0.23 -0.29 0.00 0.52 0.00 0.00 54.79 55.14 1w3y n ASP 713 Cb 0.61 -3.14 -0.17 0.00 -0.72 0.00 0.00 41.12 37.70 1w3y n ASP 713 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1w3y s LYS 714 N -3.44 2.50 0.28 -0.67 -0.14 -0.50 -5.05 119.74 112.72 1w3y s LYS 714 Ca 0.00 -0.74 -0.30 0.00 -1.36 0.00 0.00 55.97 53.57 1w3y s LYS 714 Cb 0.00 -1.97 -0.13 0.00 -1.68 0.00 0.00 37.83 34.05 1w3y s LYS 714 CO 0.00 0.19 1.37 -1.91 -0.76 0.00 0.00 175.35 174.24 1w3y n GLU 715 N 3.45 2.11 -4.56 1.68 2.13 -1.26 -1.06 120.64 123.12 1w3y n GLU 715 Ca -0.20 0.75 -0.25 0.00 0.66 0.00 0.00 57.16 58.12 1w3y n GLU 715 Cb 0.53 -2.38 -0.14 0.00 0.27 0.00 0.00 31.44 29.72 1w3y n GLU 715 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1w3y s ALA 716 N -0.45 1.74 -0.37 4.31 0.00 0.73 -4.84 121.76 122.87 1w3y s ALA 716 Ca 0.63 -1.08 -0.08 0.00 0.00 0.00 0.00 51.96 51.43 1w3y s ALA 716 Cb -0.61 -0.32 0.05 0.00 0.00 0.00 0.00 23.12 22.24 1w3y s ALA 716 CO 0.54 0.38 0.16 -1.12 0.00 0.00 0.00 175.76 175.72 1w3y s SER 717 N -1.31 5.46 0.32 0.00 0.01 -1.26 -4.38 113.70 112.54 1w3y s SER 717 Ca 0.07 -1.23 -0.18 0.00 1.31 0.00 0.00 55.95 55.91 1w3y s SER 717 Cb -0.09 -1.92 -0.09 0.00 0.21 0.00 0.00 66.02 64.13 1w3y s SER 717 CO 0.02 -0.39 0.80 -0.76 0.41 0.00 0.00 173.24 173.32 1w3y s LEU 718 N 1.42 4.13 0.34 2.44 1.43 -1.26 -5.08 118.68 122.10 1w3y s LEU 718 Ca 0.00 1.45 0.03 0.00 -1.03 0.00 0.00 54.13 54.59 1w3y s LEU 718 Cb -0.20 -4.05 -0.05 0.00 0.03 0.00 0.00 46.19 41.91 1w3y s LEU 718 CO 0.03 -0.17 0.09 0.42 0.23 0.00 0.00 176.35 176.95 1w3y s THR 719 N -1.88 0.84 0.41 5.49 -4.23 -1.26 -4.76 115.64 110.24 1w3y s THR 719 Ca 0.53 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 59.15 1w3y s THR 719 Cb -0.12 -2.61 0.16 0.00 1.34 0.00 0.00 72.50 71.26 1w3y s THR 719 CO 0.18 0.00 1.93 -0.33 -0.54 0.00 0.00 174.62 175.86 1w3y h GLU 720 N 2.08 0.14 -6.48 3.99 5.08 -1.89 -1.09 114.58 116.40 1w3y h GLU 720 Ca -0.38 -0.03 -0.53 0.00 -1.00 0.00 0.00 59.36 57.42 1w3y h GLU 720 Cb 1.25 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1w3y h GLU 720 CO 0.63 0.31 0.27 -1.14 -1.00 0.00 0.00 179.01 178.09 1w3y s GLN 721 N -4.65 4.63 0.22 2.33 0.74 -1.26 -4.64 119.66 117.03 1w3y s GLN 721 Ca -0.05 1.29 -0.32 0.00 0.05 0.00 0.00 55.36 56.34 1w3y s GLN 721 Cb 0.15 -3.36 -0.12 0.00 1.10 0.00 0.00 33.01 30.79 1w3y s GLN 721 CO 0.72 0.28 1.69 -2.00 -0.55 0.00 0.00 175.29 175.43 1w3y s GLU 722 N -0.18 4.13 -0.07 1.67 2.12 -1.26 -4.78 118.70 120.33 1w3y s GLU 722 Ca 0.43 2.59 0.03 0.00 0.36 0.00 0.00 54.97 58.38 1w3y s GLU 722 Cb -0.22 -3.07 -0.02 0.00 0.26 0.00 0.00 34.13 31.08 1w3y s GLU 722 CO 0.27 -0.72 -0.15 0.15 -0.54 0.00 0.00 175.26 174.27 1w3y s LYS 723 N 0.80 2.69 0.02 4.30 1.02 -0.35 -4.94 119.74 123.29 1w3y s LYS 723 Ca 0.72 -0.71 -0.14 0.00 0.02 0.00 0.00 55.97 55.86 1w3y s LYS 723 Cb -0.49 -2.41 -0.06 0.00 -0.52 0.00 0.00 37.83 34.35 1w3y s LYS 723 CO 0.36 0.52 0.41 -0.51 -0.92 0.00 0.00 175.35 175.21 1w3y s ASP 724 N -0.46 6.77 -0.46 2.83 1.01 -1.26 -0.94 116.67 124.17 1w3y s ASP 724 Ca 0.06 0.93 0.02 0.00 0.71 0.00 0.00 52.55 54.27 1w3y s ASP 724 Cb -0.12 -2.24 0.14 0.00 1.01 0.00 0.00 42.92 41.72 1w3y s ASP 724 CO 0.02 0.28 0.27 -0.31 0.21 0.00 0.00 175.17 175.64 1w3y s TYR 725 N -1.17 1.94 0.57 4.23 1.51 0.11 -4.98 117.35 119.56 1w3y s TYR 725 Ca 0.26 -2.45 -0.16 0.00 -1.01 0.00 0.00 57.07 53.72 1w3y s TYR 725 Cb -0.16 -1.78 -0.05 0.00 -0.11 0.00 0.00 41.96 39.86 1w3y s TYR 725 CO 0.15 -0.77 1.05 -1.25 -1.11 0.00 0.00 175.55 173.61 1w3y s PRO 726 N 0.19 3.46 -1.29 -1.71 0.04 -1.26 -2.46 135.00 131.96 1w3y s PRO 726 Ca 0.20 1.18 -0.03 0.00 0.04 0.00 0.00 61.00 62.40 1w3y s PRO 726 Cb -0.19 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.31 1w3y s PRO 726 CO -0.04 -0.70 0.97 0.39 0.04 0.00 0.00 177.00 177.66 1w3y n GLU 727 N -1.86 -6.42 -3.22 4.56 -0.58 -1.16 -4.94 120.64 107.02 1w3y n GLU 727 Ca 0.08 0.77 -0.39 0.00 -0.42 0.00 0.00 57.16 57.21 1w3y n GLU 727 Cb 0.53 -5.68 -0.06 0.00 -0.57 0.00 0.00 31.44 25.66 1w3y n GLU 727 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1w3y s THR 728 N -3.42 5.13 -0.14 2.62 2.01 0.37 -4.76 115.64 117.45 1w3y s THR 728 Ca 0.18 1.10 0.16 0.00 0.31 0.00 0.00 61.69 63.43 1w3y s THR 728 Cb -0.08 -3.89 -0.23 0.00 0.01 0.00 0.00 72.50 68.31 1w3y s THR 728 CO 0.76 0.27 0.13 1.67 -0.69 0.00 0.00 174.62 176.76 1w3y n GLN 729 N 3.94 1.08 -3.46 4.92 -0.06 -1.26 -0.91 117.38 121.63 1w3y n GLN 729 Ca -0.05 -0.04 -0.14 0.00 -2.00 0.00 0.00 57.00 54.77 1w3y n GLN 729 Cb 0.51 -1.44 -0.04 0.00 -4.06 0.00 0.00 30.24 25.22 1w3y n GLN 729 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 1w3y s SER 730 N -4.88 -0.60 -0.02 1.69 1.04 -1.26 -0.92 113.70 108.74 1w3y s SER 730 Ca -0.08 0.28 0.01 0.00 0.48 0.00 0.00 55.95 56.63 1w3y s SER 730 Cb 0.06 0.58 0.02 0.00 0.10 0.00 0.00 66.02 66.78 1w3y s SER 730 CO 0.71 -0.83 -0.01 -0.69 0.98 0.00 0.00 173.24 173.40 1w3y s VAL 731 N -2.75 0.24 -0.06 5.02 1.01 -0.28 -1.00 120.40 122.58 1w3y s VAL 731 Ca -0.04 0.01 0.02 0.00 0.00 0.00 0.00 61.98 61.97 1w3y s VAL 731 Cb -0.01 -0.30 0.02 0.00 0.00 0.00 0.00 36.38 36.10 1w3y s VAL 731 CO -0.04 0.14 -0.09 0.12 0.00 0.00 0.00 175.10 175.23 1w3y s PHE 732 N 0.75 1.15 -0.39 5.22 5.36 0.27 -0.31 117.98 130.04 1w3y s PHE 732 Ca -0.08 -0.41 -0.11 0.00 -0.96 0.00 0.00 56.93 55.37 1w3y s PHE 732 Cb -0.11 -0.91 0.04 0.00 -0.34 0.00 0.00 43.02 41.70 1w3y s PHE 732 CO -0.01 -0.26 0.23 -0.51 -1.46 0.00 0.00 175.22 173.21 1w3y s LEU 733 N 0.85 4.84 -0.27 6.12 1.43 0.39 -0.99 118.68 131.05 1w3y s LEU 733 Ca -0.12 -1.09 -0.10 0.00 -1.03 0.00 0.00 54.13 51.79 1w3y s LEU 733 Cb -0.15 -2.03 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 1w3y s LEU 733 CO 0.01 -0.42 0.17 -0.70 0.23 0.00 0.00 176.35 175.64 1w3y s GLU 734 N 1.54 3.92 0.39 1.70 2.12 -0.22 -2.30 118.70 125.85 1w3y s GLU 734 Ca 0.02 -0.34 0.08 0.00 0.36 0.00 0.00 54.97 55.09 1w3y s GLU 734 Cb -0.20 -3.59 -0.03 0.00 0.26 0.00 0.00 34.13 30.57 1w3y s GLU 734 CO 0.06 -0.14 0.27 0.45 -0.54 0.00 0.00 175.26 175.36 1w3y s SER 735 N 1.62 4.85 0.27 -1.70 0.15 -1.26 -0.86 113.70 116.78 1w3y s SER 735 Ca 0.07 -0.80 0.26 0.00 0.70 0.00 0.00 55.95 56.18 1w3y s SER 735 Cb -0.15 -0.64 0.85 0.00 -1.71 0.00 0.00 66.02 64.37 1w3y s SER 735 CO 0.09 -0.51 1.75 0.77 1.20 0.00 0.00 173.24 176.54 1w3y h SER 736 N 1.26 0.00 -3.61 5.45 4.64 -1.94 -3.40 113.55 115.96 1w3y h SER 736 Ca -0.43 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.21 1w3y h SER 736 Cb 1.26 0.00 -0.29 0.00 -0.31 0.00 0.00 62.40 63.06 1w3y h SER 736 CO 0.62 0.00 -0.66 -0.62 -0.87 0.00 0.00 176.83 175.30 1w3y s ASP 737 N -4.70 4.93 0.54 4.97 -1.08 -1.26 -4.98 116.67 115.09 1w3y s ASP 737 Ca 0.08 -0.87 0.24 0.00 -0.52 0.00 0.00 52.55 51.48 1w3y s ASP 737 Cb 0.10 -1.81 1.43 0.00 -1.46 0.00 0.00 42.92 41.19 1w3y s ASP 737 CO 0.54 -0.20 2.05 0.77 0.52 0.00 0.00 175.17 178.85 1w3y h SER 738 N 8.15 0.00 0.00 -0.34 4.64 -1.94 -0.43 113.55 123.63 1w3y h SER 738 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 1w3y h SER 738 Cb 1.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1w3y h SER 738 CO 0.59 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.84 1w3y n LYS 739 N -4.26 0.60 0.00 4.77 4.76 -1.26 -1.98 118.16 120.79 1w3y n LYS 739 Ca 0.05 0.00 0.01 0.00 -2.87 0.00 0.00 58.31 55.50 1w3y n LYS 739 Cb 0.43 -1.33 0.00 0.00 -1.84 0.00 0.00 35.03 32.29 1w3y n LYS 739 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1w3y n LYS 740 N -0.83 0.62 -2.24 1.97 5.02 -0.17 -0.97 118.16 121.55 1w3y n LYS 740 Ca 0.10 -0.50 -0.39 0.00 -2.02 0.00 0.00 58.31 55.50 1w3y n LYS 740 Cb 0.04 -0.95 -0.02 0.00 -0.02 0.00 0.00 35.03 34.09 1w3y n LYS 740 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1w3y s ASN 741 N -0.34 6.51 -0.05 4.39 0.01 -0.84 -4.80 114.94 119.82 1w3y s ASN 741 Ca 0.02 2.42 -0.01 0.00 -0.71 0.00 0.00 52.86 54.58 1w3y s ASN 741 Cb 0.01 -2.62 0.03 0.00 0.41 0.00 0.00 41.25 39.08 1w3y s ASN 741 CO 0.03 -0.69 0.01 -0.63 -1.51 0.00 0.00 177.10 174.31 1w3y s ILE 742 N -1.36 0.26 0.09 0.60 1.01 -0.97 -1.51 121.20 119.33 1w3y s ILE 742 Ca 0.56 0.13 0.10 0.00 0.00 0.00 0.00 60.65 61.45 1w3y s ILE 742 Cb -0.33 -0.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 1w3y s ILE 742 CO 0.41 0.21 -0.27 -0.83 0.00 0.00 0.00 174.94 174.47 1w3y s GLY 743 N 1.62 1.50 -0.11 6.18 0.00 -0.41 -0.46 107.32 115.64 1w3y s GLY 743 Ca -0.01 -1.38 0.00 0.00 0.00 0.00 0.00 44.72 43.33 1w3y s GLY 743 CO -0.03 -1.32 -0.10 -0.19 0.00 0.00 0.00 173.10 171.46 1w3y s TYR 744 N -0.95 1.61 -0.23 1.90 1.51 0.58 -0.81 117.35 120.95 1w3y s TYR 744 Ca 0.13 -0.79 -0.04 0.00 -1.01 0.00 0.00 57.07 55.36 1w3y s TYR 744 Cb -0.10 -1.27 -0.00 0.00 -0.11 0.00 0.00 41.96 40.48 1w3y s TYR 744 CO 0.04 -0.50 -0.03 0.12 -1.11 0.00 0.00 175.55 174.07 1w3y s PHE 745 N 1.48 3.00 -0.36 2.71 5.36 -0.31 -1.12 117.98 128.74 1w3y s PHE 745 Ca 0.02 -1.03 -0.19 0.00 -0.96 0.00 0.00 56.93 54.76 1w3y s PHE 745 Cb -0.13 -2.12 0.00 0.00 -0.34 0.00 0.00 43.02 40.43 1w3y s PHE 745 CO -0.07 -0.58 0.58 -0.06 -1.46 0.00 0.00 175.22 173.64 1w3y s PHE 746 N 1.46 3.16 0.31 10.12 0.40 -0.09 0.23 117.98 133.57 1w3y s PHE 746 Ca 0.05 0.24 0.08 0.00 -0.60 0.00 0.00 56.93 56.70 1w3y s PHE 746 Cb -0.15 -3.05 0.83 0.00 0.51 0.00 0.00 43.02 41.16 1w3y s PHE 746 CO -0.03 -0.60 1.74 0.74 0.70 0.00 0.00 175.22 177.78 1w3y h PHE 747 N 8.48 1.02 -3.97 0.36 0.04 -1.82 -3.38 116.94 117.67 1w3y h PHE 747 Ca -0.27 0.04 -0.55 0.00 2.80 0.00 0.00 57.97 59.99 1w3y h PHE 747 Cb 1.12 -0.30 -0.31 0.00 2.20 0.00 0.00 35.95 38.66 1w3y h PHE 747 CO 0.73 0.12 -0.83 0.15 -0.60 0.00 0.00 178.31 177.88 1w3y s LYS 748 N -5.81 1.65 0.09 1.51 3.01 -1.26 -5.05 119.74 113.88 1w3y s LYS 748 Ca -0.11 -0.59 -0.36 0.00 -1.01 0.00 0.00 55.97 53.90 1w3y s LYS 748 Cb 0.26 -1.46 -0.17 0.00 -1.01 0.00 0.00 37.83 35.44 1w3y s LYS 748 CO 0.80 0.26 1.17 1.63 0.51 0.00 0.00 175.35 179.71 1w3y n LYS 749 N 3.07 0.74 -4.32 1.68 5.02 -1.26 -4.92 118.16 118.17 1w3y n LYS 749 Ca -0.17 0.27 -0.19 0.00 -2.02 0.00 0.00 58.31 56.19 1w3y n LYS 749 Cb 0.53 -1.79 -0.10 0.00 -0.02 0.00 0.00 35.03 33.65 1w3y n LYS 749 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1w3y s SER 750 N 0.13 2.45 -0.38 4.39 0.01 -0.09 -4.77 113.70 115.43 1w3y s SER 750 Ca 0.82 -0.95 -0.16 0.00 1.31 0.00 0.00 55.95 56.98 1w3y s SER 750 Cb -1.02 -0.12 0.01 0.00 0.21 0.00 0.00 66.02 65.09 1w3y s SER 750 CO 0.52 -0.15 0.36 -0.55 0.41 0.00 0.00 173.24 173.83 1w3y s SER 751 N -3.02 6.16 0.41 2.44 0.15 -1.26 -0.48 113.70 118.09 1w3y s SER 751 Ca 0.18 -0.55 0.03 0.00 0.70 0.00 0.00 55.95 56.32 1w3y s SER 751 Cb -0.02 -2.19 -0.04 0.00 -1.71 0.00 0.00 66.02 62.06 1w3y s SER 751 CO 0.06 -0.43 0.07 0.27 1.20 0.00 0.00 173.24 174.40 1w3y s ILE 752 N 1.95 1.03 0.03 6.45 -4.36 -1.03 -4.33 121.20 120.94 1w3y s ILE 752 Ca 0.10 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.50 1w3y s ILE 752 Cb -0.17 -2.50 -0.02 0.00 1.25 0.00 0.00 42.46 41.02 1w3y s ILE 752 CO 0.12 0.00 -0.05 -0.94 0.24 0.00 0.00 174.94 174.31 1w3y s SER 753 N -3.64 0.53 0.04 4.36 1.04 -0.44 0.04 113.70 115.63 1w3y s SER 753 Ca 0.24 -0.49 -0.03 0.00 0.48 0.00 0.00 55.95 56.16 1w3y s SER 753 Cb 0.05 0.06 -0.02 0.00 0.10 0.00 0.00 66.02 66.21 1w3y s SER 753 CO 0.13 -0.23 0.02 -0.04 0.98 0.00 0.00 173.24 174.10 1w3y s MET 754 N -1.40 0.52 0.10 4.02 -1.94 -0.11 -1.61 119.30 118.88 1w3y s MET 754 Ca -0.12 -0.86 -0.22 0.00 -1.71 0.00 0.00 55.69 52.78 1w3y s MET 754 Cb -0.09 0.19 0.06 0.00 2.01 0.00 0.00 34.83 37.00 1w3y s MET 754 CO -0.00 -0.11 0.55 -1.54 -0.01 0.00 0.00 175.02 173.91 1w3y s SER 755 N -2.19 -0.49 -0.13 3.03 1.04 -0.79 -1.21 113.70 112.96 1w3y s SER 755 Ca -0.04 0.07 -0.01 0.00 0.48 0.00 0.00 55.95 56.44 1w3y s SER 755 Cb -0.01 0.54 0.04 0.00 0.10 0.00 0.00 66.02 66.70 1w3y s SER 755 CO -0.05 -0.85 -0.01 -0.75 0.98 0.00 0.00 173.24 172.56 1w3y s LYS 756 N -3.14 0.91 0.06 4.02 2.20 -0.41 -1.04 119.74 122.33 1w3y s LYS 756 Ca -0.02 -0.21 -0.10 0.00 -0.36 0.00 0.00 55.97 55.28 1w3y s LYS 756 Cb -0.00 -1.58 0.00 0.00 -1.51 0.00 0.00 37.83 34.74 1w3y s LYS 756 CO -0.07 -0.42 0.21 0.00 -0.36 0.00 0.00 175.35 174.71 1w3y s ALA 757 N 1.84 -0.36 -0.06 3.13 0.00 -0.64 -2.62 121.76 123.04 1w3y s ALA 757 Ca 0.02 -0.36 -0.29 0.00 0.00 0.00 0.00 51.96 51.34 1w3y s ALA 757 Cb -0.14 0.36 -0.02 0.00 0.00 0.00 0.00 23.12 23.32 1w3y s ALA 757 CO -0.07 -0.42 0.95 -1.17 0.00 0.00 0.00 175.76 175.05 1w3y s LEU 758 N -2.36 4.30 -0.13 0.00 2.96 -1.26 -1.15 118.68 121.05 1w3y s LEU 758 Ca -0.02 1.52 0.02 0.00 -0.22 0.00 0.00 54.13 55.44 1w3y s LEU 758 Cb 0.01 -3.49 -0.00 0.00 0.50 0.00 0.00 46.19 43.21 1w3y s LEU 758 CO -0.06 -0.32 -0.20 -1.10 -1.32 0.00 0.00 176.35 173.35 1w3y s GLN 759 N 1.45 3.14 0.15 1.98 -0.21 0.49 -4.97 119.66 121.69 1w3y s GLN 759 Ca 0.48 -0.81 0.06 0.00 0.02 0.00 0.00 55.36 55.11 1w3y s GLN 759 Cb -0.19 -2.46 -0.04 0.00 1.00 0.00 0.00 33.01 31.31 1w3y s GLN 759 CO 0.22 0.11 0.02 0.15 -2.12 0.00 0.00 175.29 173.67 1w3y s LYS 760 N 0.55 2.52 -0.06 2.91 1.02 -1.26 -1.83 119.74 123.59 1w3y s LYS 760 Ca -0.12 -1.01 -0.30 0.00 0.02 0.00 0.00 55.97 54.56 1w3y s LYS 760 Cb -0.16 -2.45 0.11 0.00 -0.52 0.00 0.00 37.83 34.81 1w3y s LYS 760 CO 0.04 0.48 1.34 0.20 -0.92 0.00 0.00 175.35 176.49 1w3y s GLY 761 N -2.84 -0.26 0.04 -3.33 0.00 0.06 -4.85 107.32 96.14 1w3y s GLY 761 Ca 0.28 0.32 0.03 0.00 0.00 0.00 0.00 44.72 45.34 1w3y s GLY 761 CO 0.19 4.42 -0.09 0.00 0.00 0.00 0.00 173.10 177.63 1w3y s ALA 762 N -2.07 0.70 0.46 3.20 0.00 -1.26 0.97 121.76 123.77 1w3y s ALA 762 Ca 0.26 -0.77 0.12 0.00 0.00 0.00 0.00 51.96 51.57 1w3y s ALA 762 Cb 0.02 -0.01 1.07 0.00 0.00 0.00 0.00 23.12 24.20 1w3y s ALA 762 CO -0.03 0.04 2.09 -1.49 0.00 0.00 0.00 175.76 176.37 1w3y h TRP 763 N 4.60 0.27 0.00 0.00 4.06 -1.75 -0.26 115.95 122.88 1w3y h TRP 763 Ca -0.36 0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.59 1w3y h TRP 763 Cb 1.20 -0.09 -0.00 0.00 -1.00 0.00 0.00 29.16 29.27 1w3y h TRP 763 CO 0.62 0.17 -0.03 -0.22 -3.56 0.00 0.00 178.44 175.41 1w3y h LYS 764 N 0.29 0.00 -0.26 0.49 3.64 -1.31 -0.99 116.57 118.44 1w3y h LYS 764 Ca 0.10 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1w3y h LYS 764 Cb 0.05 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 1w3y h LYS 764 CO -0.02 0.03 0.03 -0.44 -2.27 0.00 0.00 179.45 176.78 1w3y h ASP 765 N 0.00 0.34 -0.01 4.20 3.32 -1.32 -3.04 116.42 119.91 1w3y h ASP 765 Ca -0.00 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.01 1w3y h ASP 765 Cb 0.10 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1w3y h ASP 765 CO 0.00 0.37 -0.18 2.30 -1.72 0.00 0.00 179.24 180.02 1w3y n ILE 766 N -4.36 0.00 -3.24 0.35 -5.35 -0.61 -4.80 119.36 101.34 1w3y n ILE 766 Ca 0.01 -0.41 -0.03 0.00 -0.27 0.00 0.00 62.75 62.05 1w3y n ILE 766 Cb 0.18 1.18 -0.04 0.00 -1.74 0.00 0.00 39.64 39.22 1w3y n ILE 766 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1w3y s ASN 767 N -1.41 -0.57 0.43 7.28 3.84 -0.47 -0.53 114.94 123.51 1w3y s ASN 767 Ca 0.11 0.34 0.24 0.00 0.21 0.00 0.00 52.86 53.77 1w3y s ASN 767 Cb 0.10 1.61 1.26 0.00 -0.55 0.00 0.00 41.25 43.67 1w3y s ASN 767 CO 0.26 -0.30 1.73 -0.33 -2.79 0.00 0.00 177.10 175.67 1w3y h GLU 768 N 8.09 0.24 -0.10 0.43 4.39 -1.38 -0.58 114.58 125.68 1w3y h GLU 768 Ca -0.16 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.52 1w3y h GLU 768 Cb 1.16 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 1w3y h GLU 768 CO 0.25 0.16 0.00 0.41 -1.16 0.00 0.00 179.01 178.67 1w3y n GLY 769 N -1.52 -0.23 4.00 -3.84 0.00 -1.26 -4.91 105.19 97.42 1w3y n GLY 769 Ca 0.29 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 1w3y n GLY 769 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w3y s GLN 770 N -1.87 2.30 0.40 1.61 -1.52 -0.22 -5.06 119.66 115.29 1w3y s GLN 770 Ca 0.29 -1.13 -0.26 0.00 -1.95 0.00 0.00 55.36 52.31 1w3y s GLN 770 Cb 0.15 -2.52 -0.09 0.00 -0.22 0.00 0.00 33.01 30.33 1w3y s GLN 770 CO 0.23 -0.88 1.21 0.45 -0.25 0.00 0.00 175.29 176.05 1w3y s SER 771 N -4.55 6.48 0.00 5.90 0.15 -1.26 -4.21 113.70 116.21 1w3y s SER 771 Ca 0.60 2.44 0.16 0.00 0.70 0.00 0.00 55.95 59.85 1w3y s SER 771 Cb -0.08 -2.62 0.49 0.00 -1.71 0.00 0.00 66.02 62.10 1w3y s SER 771 CO 0.39 -0.71 1.38 -0.90 1.20 0.00 0.00 173.24 174.61 1w3y n ASP 772 N 0.14 2.05 -4.73 5.45 5.68 -1.26 -1.25 116.55 122.63 1w3y n ASP 772 Ca 0.04 -1.90 -0.42 0.00 -0.50 0.00 0.00 54.79 52.01 1w3y n ASP 772 Cb 0.45 -0.21 -0.03 0.00 -1.14 0.00 0.00 41.12 40.19 1w3y n ASP 772 CO 0.00 0.00 0.00 -0.75 -1.33 0.00 0.00 177.20 175.12 1w3y s LYS 773 N -1.57 4.25 0.28 0.11 2.36 -1.26 -4.86 119.74 119.04 1w3y s LYS 773 Ca 0.29 2.30 -0.29 0.00 -2.55 0.00 0.00 55.97 55.72 1w3y s LYS 773 Cb 0.16 -3.15 -0.10 0.00 -1.05 0.00 0.00 37.83 33.69 1w3y s LYS 773 CO 0.22 -0.50 1.34 -2.00 1.55 0.00 0.00 175.35 175.95 1w3y s GLU 774 N 0.45 4.34 0.12 4.03 2.12 -1.26 -4.39 118.70 124.11 1w3y s GLU 774 Ca 0.65 2.20 0.08 0.00 0.36 0.00 0.00 54.97 58.26 1w3y s GLU 774 Cb -0.42 -3.11 -0.04 0.00 0.26 0.00 0.00 34.13 30.82 1w3y s GLU 774 CO 0.36 -0.26 -0.20 0.08 -0.54 0.00 0.00 175.26 174.71 1w3y s VAL 775 N -0.55 1.70 -0.02 3.70 1.01 0.27 -4.97 120.40 121.54 1w3y s VAL 775 Ca 0.53 -1.63 -0.13 0.00 0.00 0.00 0.00 61.98 60.75 1w3y s VAL 775 Cb -0.40 -1.61 0.02 0.00 0.00 0.00 0.00 36.38 34.40 1w3y s VAL 775 CO 0.47 -0.14 0.28 -1.83 0.00 0.00 0.00 175.10 173.88 1w3y s GLU 776 N -2.14 0.61 0.02 2.72 -1.05 -1.26 -0.76 118.70 116.84 1w3y s GLU 776 Ca 0.08 -0.17 -0.20 0.00 -0.15 0.00 0.00 54.97 54.54 1w3y s GLU 776 Cb -0.09 0.27 0.04 0.00 -0.44 0.00 0.00 34.13 33.91 1w3y s GLU 776 CO 0.05 -0.16 0.44 -0.80 0.95 0.00 0.00 175.26 175.74 1w3y s ASN 777 N -1.19 -0.34 -0.06 0.83 0.01 -0.76 -4.99 114.94 108.45 1w3y s ASN 777 Ca -0.12 0.14 -0.15 0.00 -0.71 0.00 0.00 52.86 52.01 1w3y s ASN 777 Cb -0.05 0.43 -0.05 0.00 0.41 0.00 0.00 41.25 41.98 1w3y s ASN 777 CO 0.03 -0.62 0.40 -0.70 -1.51 0.00 0.00 177.10 174.70 1w3y s GLU 778 N -2.07 4.05 0.04 -0.60 2.56 -1.26 -0.38 118.70 121.05 1w3y s GLU 778 Ca -0.08 0.35 0.05 0.00 0.00 0.00 0.00 54.97 55.30 1w3y s GLU 778 Cb -0.02 -3.30 -0.02 0.00 2.00 0.00 0.00 34.13 32.79 1w3y s GLU 778 CO 0.01 0.50 -0.15 -0.06 -0.56 0.00 0.00 175.26 174.99 1w3y s PHE 779 N -0.43 1.31 -0.28 5.30 0.40 -0.30 -0.65 117.98 123.34 1w3y s PHE 779 Ca 0.23 -0.37 -0.06 0.00 -0.60 0.00 0.00 56.93 56.13 1w3y s PHE 779 Cb -0.16 -0.77 0.01 0.00 0.51 0.00 0.00 43.02 42.61 1w3y s PHE 779 CO 0.11 0.05 0.04 -1.17 0.70 0.00 0.00 175.22 174.95 1w3y s LEU 780 N -1.22 3.62 -0.12 -0.37 0.20 -0.16 -1.63 118.68 118.99 1w3y s LEU 780 Ca 0.02 -0.66 -0.02 0.00 0.69 0.00 0.00 54.13 54.16 1w3y s LEU 780 Cb -0.08 -1.84 -0.03 0.00 -0.43 0.00 0.00 46.19 43.81 1w3y s LEU 780 CO 0.01 -0.15 -0.04 -0.89 -0.29 0.00 0.00 176.35 175.00 1w3y s THR 781 N 1.48 3.94 -0.09 3.68 2.01 -0.20 -1.25 115.64 125.20 1w3y s THR 781 Ca 0.03 -0.36 0.02 0.00 0.31 0.00 0.00 61.69 61.69 1w3y s THR 781 Cb -0.17 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 69.67 1w3y s THR 781 CO 0.01 0.54 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.70 1w3y s ILE 782 N -0.17 1.41 0.09 1.82 1.01 0.04 -1.88 121.20 123.52 1w3y s ILE 782 Ca 0.03 -0.61 -0.04 0.00 0.00 0.00 0.00 60.65 60.03 1w3y s ILE 782 Cb -0.13 -1.28 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 1w3y s ILE 782 CO 0.02 0.42 0.08 -0.94 0.00 0.00 0.00 174.94 174.53 1w3y s SER 783 N 0.82 0.30 -0.11 3.58 1.04 -0.63 -0.16 113.70 118.54 1w3y s SER 783 Ca -0.11 -0.92 -0.01 0.00 0.48 0.00 0.00 55.95 55.39 1w3y s SER 783 Cb -0.16 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.28 1w3y s SER 783 CO 0.01 -0.69 -0.03 -1.58 0.98 0.00 0.00 173.24 171.93 1w3y s GLN 784 N -3.93 1.04 0.43 4.02 0.74 -0.44 -1.32 119.66 120.19 1w3y s GLN 784 Ca 0.11 -0.14 -0.22 0.00 0.05 0.00 0.00 55.36 55.15 1w3y s GLN 784 Cb 0.06 -1.42 -0.09 0.00 1.10 0.00 0.00 33.01 32.66 1w3y s GLN 784 CO -0.07 -0.34 1.01 0.00 -0.55 0.00 0.00 175.29 175.34 1w3y s ALA 785 N 1.83 3.02 -0.50 1.58 0.00 -1.26 -1.08 121.76 125.34 1w3y s ALA 785 Ca 0.04 0.57 0.03 0.00 0.00 0.00 0.00 51.96 52.60 1w3y s ALA 785 Cb -0.13 -3.22 0.14 0.00 0.00 0.00 0.00 23.12 19.90 1w3y s ALA 785 CO -0.07 -0.11 0.27 -1.01 0.00 0.00 0.00 175.76 174.84 1w3y s HIS 786 N -1.90 2.67 -1.33 0.00 0.09 -0.34 -4.93 115.29 109.54 1w3y s HIS 786 Ca 0.61 -2.86 0.27 0.00 -0.00 0.00 0.00 55.06 53.08 1w3y s HIS 786 Cb -0.16 -2.39 0.88 0.00 -0.00 0.00 0.00 32.58 30.91 1w3y s HIS 786 CO 0.21 -0.75 1.66 1.63 -0.00 0.00 0.00 174.74 177.49 1w3y n LYS 787 N 3.21 0.36 -4.16 1.40 5.02 -1.26 -4.33 118.16 118.40 1w3y n LYS 787 Ca 0.08 -0.16 -0.17 0.00 -2.02 0.00 0.00 58.31 56.03 1w3y n LYS 787 Cb 0.33 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.73 1w3y n LYS 787 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1w3y s GLN 788 N -2.75 0.79 0.31 1.97 -1.52 -1.26 -5.10 119.66 112.10 1w3y s GLN 788 Ca 0.19 -0.95 -0.29 0.00 -1.95 0.00 0.00 55.36 52.36 1w3y s GLN 788 Cb 0.19 -0.73 -0.10 0.00 -0.22 0.00 0.00 33.01 32.15 1w3y s GLN 788 CO 0.57 0.16 1.26 -0.80 -0.25 0.00 0.00 175.29 176.23 1w3y s ASN 789 N -1.80 6.89 0.00 5.90 0.01 -1.26 -2.56 114.94 122.11 1w3y s ASN 789 Ca -0.02 2.58 0.00 0.00 -0.71 0.00 0.00 52.86 54.71 1w3y s ASN 789 Cb -0.09 -2.64 0.00 0.00 0.41 0.00 0.00 41.25 38.93 1w3y s ASN 789 CO 0.02 -0.45 0.00 0.61 -1.51 0.00 0.00 177.10 175.77 1w3y n GLY 790 N 0.97 0.76 3.60 0.66 0.00 0.45 -5.00 105.19 106.64 1w3y n GLY 790 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 1w3y n GLY 790 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1w3y s ASP 791 N -2.36 1.89 0.27 1.61 1.01 -1.06 -4.54 116.67 113.49 1w3y s ASP 791 Ca 0.00 1.33 -0.18 0.00 0.71 0.00 0.00 52.55 54.41 1w3y s ASP 791 Cb 0.00 -2.05 0.01 0.00 1.01 0.00 0.00 42.92 41.89 1w3y s ASP 791 CO 0.00 -3.61 0.64 -0.94 0.21 0.00 0.00 175.17 171.47 1w3y s SER 792 N -3.05 -0.21 0.05 0.27 1.04 -1.26 -2.08 113.70 108.46 1w3y s SER 792 Ca 0.67 -0.70 -0.07 0.00 0.48 0.00 0.00 55.95 56.33 1w3y s SER 792 Cb -0.21 0.68 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 1w3y s SER 792 CO 0.61 -1.27 0.12 -0.72 0.98 0.00 0.00 173.24 172.96 1w3y s TYR 793 N -3.95 0.19 -0.30 5.02 -0.85 -0.48 -4.97 117.35 112.00 1w3y s TYR 793 Ca 0.14 -0.51 -0.11 0.00 -0.52 0.00 0.00 57.07 56.07 1w3y s TYR 793 Cb -0.04 -0.12 0.16 0.00 0.38 0.00 0.00 41.96 42.33 1w3y s TYR 793 CO 0.07 -0.41 0.82 0.20 -1.52 0.00 0.00 175.55 174.71 1w3y s GLY 794 N -2.30 -0.51 0.13 5.49 0.00 -1.26 -1.03 107.32 107.84 1w3y s GLY 794 Ca -0.02 2.60 -0.19 0.00 0.00 0.00 0.00 44.72 47.11 1w3y s GLY 794 CO -0.06 3.26 0.47 -2.52 0.00 0.00 0.00 173.10 174.25 1w3y s TYR 795 N 2.72 -0.32 -0.18 1.90 -0.85 -0.63 -2.86 117.35 117.13 1w3y s TYR 795 Ca -0.00 0.06 -0.03 0.00 -0.52 0.00 0.00 57.07 56.59 1w3y s TYR 795 Cb -0.10 0.36 -0.01 0.00 0.38 0.00 0.00 41.96 42.58 1w3y s TYR 795 CO -0.18 -0.74 -0.07 1.41 -1.52 0.00 0.00 175.55 174.45 1w3y s MET 796 N -3.69 3.44 -0.28 -3.49 -2.45 0.14 -0.18 119.30 112.78 1w3y s MET 796 Ca 0.02 -0.62 -0.20 0.00 -1.25 0.00 0.00 55.69 53.63 1w3y s MET 796 Cb 0.01 -2.86 -0.01 0.00 1.25 0.00 0.00 34.83 33.22 1w3y s MET 796 CO -0.12 0.03 0.64 -1.17 1.05 0.00 0.00 175.02 175.45 1w3y s LEU 797 N 0.86 4.11 -0.32 4.11 2.96 0.47 -1.16 118.68 129.71 1w3y s LEU 797 Ca -0.02 0.56 0.03 0.00 -0.22 0.00 0.00 54.13 54.47 1w3y s LEU 797 Cb -0.15 -2.84 0.09 0.00 0.50 0.00 0.00 46.19 43.79 1w3y s LEU 797 CO 0.01 -0.44 0.03 -0.63 -1.32 0.00 0.00 176.35 174.00 1w3y s ILE 798 N 2.58 1.93 0.35 6.68 1.01 0.00 -1.79 121.20 131.96 1w3y s ILE 798 Ca 0.26 -1.98 0.05 0.00 0.00 0.00 0.00 60.65 58.97 1w3y s ILE 798 Cb -0.15 -2.36 -0.01 0.00 0.01 0.00 0.00 42.46 39.94 1w3y s ILE 798 CO 0.10 -0.51 0.50 -2.16 0.00 0.00 0.00 174.94 172.88 1w3y s PRO 799 N 1.11 3.15 -1.67 2.79 0.04 -1.26 -1.29 135.00 137.87 1w3y s PRO 799 Ca 0.07 -0.86 -0.02 0.00 0.04 0.00 0.00 61.00 60.23 1w3y s PRO 799 Cb -0.19 -2.77 0.00 0.00 0.04 0.00 0.00 34.50 31.58 1w3y s PRO 799 CO -0.11 0.04 0.26 0.09 0.04 0.00 0.00 177.00 177.33 1w3y n ASN 800 N -1.71 -5.97 -4.25 6.66 4.13 -0.57 -4.99 115.26 108.57 1w3y n ASN 800 Ca -0.01 -0.14 -0.18 0.00 1.68 0.00 0.00 54.58 55.94 1w3y n ASN 800 Cb 0.58 -4.90 -0.11 0.00 -1.54 0.00 0.00 39.78 33.81 1w3y n ASN 800 CO 0.00 0.00 0.00 0.68 0.28 0.00 0.00 177.26 178.22 1w3y s VAL 801 N -3.10 1.34 0.81 2.41 -7.23 -1.25 -4.72 120.40 108.67 1w3y s VAL 801 Ca 0.13 -1.77 -0.12 0.00 -1.81 0.00 0.00 61.98 58.42 1w3y s VAL 801 Cb -0.06 -1.58 0.09 0.00 0.56 0.00 0.00 36.38 35.39 1w3y s VAL 801 CO 0.16 -0.45 1.17 1.51 -0.31 0.00 0.00 175.10 177.19 1w3y s ASP 802 N -2.55 4.42 0.17 4.85 1.47 -1.26 -4.77 116.67 119.00 1w3y s ASP 802 Ca 0.10 0.70 -0.18 0.00 1.18 0.00 0.00 52.55 54.35 1w3y s ASP 802 Cb -0.04 -1.17 0.10 0.00 -0.34 0.00 0.00 42.92 41.46 1w3y s ASP 802 CO 0.03 -1.94 1.65 -0.09 0.68 0.00 0.00 175.17 175.50 1w3y h ARG 803 N -1.06 -0.08 -0.84 2.11 2.43 -1.98 -0.34 114.38 114.63 1w3y h ARG 803 Ca -0.46 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 58.70 1w3y h ARG 803 Cb 1.32 0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 30.85 1w3y h ARG 803 CO 0.63 -0.05 0.44 0.00 -1.51 0.00 0.00 179.97 179.48 1w3y h ALA 804 N 1.24 1.19 -0.46 2.80 0.00 -1.99 -1.18 119.26 120.86 1w3y h ALA 804 Ca 0.19 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1w3y h ALA 804 Cb 0.38 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1w3y h ALA 804 CO -0.45 0.64 -0.26 1.15 0.00 0.00 0.00 179.25 180.33 1w3y h THR 805 N 1.19 1.27 -0.40 0.00 2.02 -1.81 -2.09 112.91 113.08 1w3y h THR 805 Ca 0.29 -1.43 -0.00 0.00 0.77 0.00 0.00 66.41 66.04 1w3y h THR 805 Cb 0.06 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1w3y h THR 805 CO -0.04 0.49 0.24 0.15 0.37 0.00 0.00 175.52 176.73 1w3y h PHE 806 N 0.84 0.53 -0.18 3.16 3.57 -0.72 -0.20 116.94 123.94 1w3y h PHE 806 Ca 0.10 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 1w3y h PHE 806 Cb 0.85 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 1w3y h PHE 806 CO 0.06 0.38 0.04 -0.91 -2.23 0.00 0.00 178.31 175.65 1w3y h ASN 807 N 0.53 0.23 -0.13 0.41 2.35 -1.06 -1.58 115.58 116.33 1w3y h ASN 807 Ca 0.14 -0.02 -0.17 0.00 -0.55 0.00 0.00 56.30 55.71 1w3y h ASN 807 Cb 0.00 -0.06 0.01 0.00 0.05 0.00 0.00 38.32 38.32 1w3y h ASN 807 CO -0.03 0.24 -0.57 -0.61 -1.65 0.00 0.00 177.43 174.81 1w3y h GLN 808 N 0.26 0.62 -0.80 0.81 5.75 -0.72 -3.20 115.11 117.83 1w3y h GLN 808 Ca 0.06 -0.49 -0.03 0.00 -0.15 0.00 0.00 58.65 58.05 1w3y h GLN 808 Cb 0.11 0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.72 1w3y h GLN 808 CO -0.00 1.11 0.40 0.52 -2.65 0.00 0.00 178.83 178.21 1w3y h MET 809 N 0.27 1.15 0.00 1.69 2.86 -0.40 -2.17 114.93 118.33 1w3y h MET 809 Ca -0.03 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.41 1w3y h MET 809 Cb 1.21 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.65 1w3y h MET 809 CO 0.12 0.88 -0.17 -0.84 1.06 0.00 0.00 176.91 177.96 1w3y h ILE 810 N 1.13 0.59 -0.20 -1.22 3.07 -1.38 0.37 117.51 119.87 1w3y h ILE 810 Ca 0.28 -0.79 -0.15 0.00 1.55 0.00 0.00 64.86 65.74 1w3y h ILE 810 Cb 0.10 1.52 0.00 0.00 -0.27 0.00 0.00 36.82 38.17 1w3y h ILE 810 CO -0.04 0.17 -0.47 0.11 -1.05 0.00 0.00 178.15 176.87 1w3y h LYS 811 N 0.00 0.67 -0.25 0.16 1.79 -1.40 -2.19 116.57 115.36 1w3y h LYS 811 Ca -0.00 -0.46 -0.07 0.00 -2.18 0.00 0.00 60.65 57.95 1w3y h LYS 811 Cb 0.50 0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.20 1w3y h LYS 811 CO 0.02 1.08 -0.14 0.93 -1.08 0.00 0.00 179.45 180.26 1w3y h GLU 812 N 0.37 0.41 -0.36 3.15 5.08 -0.76 -2.73 114.58 119.75 1w3y h GLU 812 Ca -0.00 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1w3y h GLU 812 Cb 1.08 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.28 1w3y h GLU 812 CO 0.10 0.55 0.00 1.28 -1.00 0.00 0.00 179.01 179.95 1w3y n LEU 813 N -4.21 2.12 -0.30 1.33 4.77 0.04 -4.54 117.00 116.21 1w3y n LEU 813 Ca 0.00 -1.03 0.13 0.00 -0.03 0.00 0.00 56.01 55.08 1w3y n LEU 813 Cb 0.32 -0.24 0.28 0.00 -2.33 0.00 0.00 43.42 41.44 1w3y n LEU 813 CO 0.40 0.51 0.90 -0.08 -1.33 0.00 0.00 177.39 177.79 1w3y h GLU 814 N 2.42 0.14 -0.33 3.23 4.81 -1.07 -1.51 114.58 122.27 1w3y h GLU 814 Ca 0.00 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.10 1w3y h GLU 814 Cb 0.55 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.82 1w3y h GLU 814 CO 0.00 0.09 -0.02 0.43 -0.73 0.00 0.00 179.01 178.78 1w3y n SER 815 N -5.30 3.04 0.24 1.04 7.64 -1.26 -4.69 113.62 114.33 1w3y n SER 815 Ca 0.21 -3.47 0.11 0.00 1.01 0.00 0.00 58.87 56.73 1w3y n SER 815 Cb 0.68 -0.60 0.58 0.00 -1.01 0.00 0.00 64.21 63.86 1w3y n SER 815 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1w3y h SER 816 N 1.27 0.00 -3.26 6.43 4.64 -1.51 -3.42 113.55 117.70 1w3y h SER 816 Ca 0.15 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.90 1w3y h SER 816 Cb 1.61 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.64 1w3y h SER 816 CO 0.34 0.19 0.97 -0.22 -0.87 0.00 0.00 176.83 177.24 1w3y s LEU 817 N -7.11 3.80 -0.10 5.97 2.96 -1.26 -0.24 118.68 122.70 1w3y s LEU 817 Ca -0.01 1.02 -0.19 0.00 -0.22 0.00 0.00 54.13 54.73 1w3y s LEU 817 Cb 0.12 -3.54 -0.28 0.00 0.50 0.00 0.00 46.19 42.99 1w3y s LEU 817 CO 0.62 -1.14 0.63 0.40 -1.32 0.00 0.00 176.35 175.54 1w3y h ILE 818 N 6.06 1.21 -1.79 6.68 1.08 -1.27 -3.48 117.51 125.99 1w3y h ILE 818 Ca -0.25 -2.41 0.07 0.00 -0.39 0.00 0.00 64.86 61.87 1w3y h ILE 818 Cb 1.09 2.86 -0.21 0.00 -3.07 0.00 0.00 36.82 37.49 1w3y h ILE 818 CO 1.05 0.67 0.49 -0.70 -0.69 0.00 0.00 178.15 178.97 1w3y s GLU 819 N -2.43 0.71 -0.47 2.37 2.56 -1.07 -4.94 118.70 115.43 1w3y s GLU 819 Ca -0.19 0.06 0.06 0.00 0.00 0.00 0.00 54.97 54.90 1w3y s GLU 819 Cb 0.03 0.33 0.22 0.00 2.00 0.00 0.00 34.13 36.72 1w3y s GLU 819 CO 0.76 -0.24 0.72 -1.71 -0.56 0.00 0.00 175.26 174.22 1w3y n ASN 820 N 0.53 -2.14 -2.31 -1.70 4.05 -1.21 -0.94 115.26 111.54 1w3y n ASN 820 Ca -0.11 -2.99 -0.07 0.00 0.45 0.00 0.00 54.58 51.86 1w3y n ASN 820 Cb 0.59 1.04 -0.02 0.00 1.23 0.00 0.00 39.78 42.62 1w3y n ASN 820 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 1w3y n ASN 821 N 2.03 1.50 0.05 1.20 0.23 -0.18 -4.86 115.26 115.23 1w3y n ASN 821 Ca 0.16 -1.57 0.06 0.00 -0.53 0.00 0.00 54.58 52.70 1w3y n ASN 821 Cb 0.58 0.21 0.28 0.00 -2.08 0.00 0.00 39.78 38.76 1w3y n ASN 821 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1w3y n GLU 822 N -0.27 0.06 0.00 -3.83 0.00 -1.26 -3.35 120.64 111.98 1w3y n GLU 822 Ca -0.03 0.45 0.00 0.00 0.00 0.00 0.00 57.16 57.58 1w3y n GLU 822 Cb 0.16 -1.65 0.00 0.00 0.00 0.00 0.00 31.44 29.96 1w3y n GLU 822 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1w3y n THR 823 N -1.76 0.00 -3.78 3.84 -2.24 -1.26 -4.83 114.28 104.25 1w3y n THR 823 Ca 0.01 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.65 1w3y n THR 823 Cb 0.09 0.33 -0.15 0.00 -2.10 0.00 0.00 70.33 68.50 1w3y n THR 823 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1w3y s LEU 824 N -2.08 1.10 -0.05 3.22 2.96 -1.21 -1.09 118.68 121.52 1w3y s LEU 824 Ca 0.00 0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.05 1w3y s LEU 824 Cb 0.00 0.12 0.02 0.00 0.50 0.00 0.00 46.19 46.83 1w3y s LEU 824 CO 0.00 -0.11 -0.03 -1.10 -1.32 0.00 0.00 176.35 173.79 1w3y s GLN 825 N 0.90 0.75 -0.14 1.98 -0.21 -0.68 -1.02 119.66 121.24 1w3y s GLN 825 Ca -0.07 -0.03 -0.20 0.00 0.02 0.00 0.00 55.36 55.08 1w3y s GLN 825 Cb -0.10 -0.88 0.05 0.00 1.00 0.00 0.00 33.01 33.08 1w3y s GLN 825 CO -0.03 -0.16 0.52 0.45 -2.12 0.00 0.00 175.29 173.94 1w3y s SER 826 N 1.28 -0.51 -0.01 5.90 0.15 -0.12 -0.50 113.70 119.89 1w3y s SER 826 Ca -0.05 0.84 0.04 0.00 0.70 0.00 0.00 55.95 57.48 1w3y s SER 826 Cb -0.14 0.86 -0.01 0.00 -1.71 0.00 0.00 66.02 65.03 1w3y s SER 826 CO -0.02 -0.30 -0.12 -0.69 1.20 0.00 0.00 173.24 173.30 1w3y s VAL 827 N -0.24 0.98 -0.09 4.45 1.01 -0.87 -0.90 120.40 124.73 1w3y s VAL 827 Ca -0.04 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.45 1w3y s VAL 827 Cb -0.03 -0.82 -0.01 0.00 0.00 0.00 0.00 36.38 35.52 1w3y s VAL 827 CO 0.03 0.28 -0.21 -0.47 0.00 0.00 0.00 175.10 174.73 1w3y s TYR 828 N -0.25 2.60 -0.55 5.22 5.04 0.66 -1.41 117.35 128.65 1w3y s TYR 828 Ca 0.04 -0.83 -0.09 0.00 -2.44 0.00 0.00 57.07 53.76 1w3y s TYR 828 Cb -0.05 -1.71 0.14 0.00 0.35 0.00 0.00 41.96 40.69 1w3y s TYR 828 CO -0.00 -0.29 0.43 0.34 -1.34 0.00 0.00 175.55 174.68 1w3y s ASP 829 N 0.16 5.78 0.34 4.32 -1.08 0.19 -4.54 116.67 121.85 1w3y s ASP 829 Ca -0.12 -2.19 0.04 0.00 -0.52 0.00 0.00 52.55 49.76 1w3y s ASP 829 Cb -0.16 -2.02 0.60 0.00 -1.46 0.00 0.00 42.92 39.89 1w3y s ASP 829 CO 0.06 -0.62 1.90 0.00 0.52 0.00 0.00 175.17 177.03 1w3y h ALA 830 N 8.11 1.40 -0.67 3.66 0.00 -1.93 0.39 119.26 130.22 1w3y h ALA 830 Ca -0.13 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1w3y h ALA 830 Cb 1.05 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.64 1w3y h ALA 830 CO 0.82 0.43 0.27 -0.22 0.00 0.00 0.00 179.25 180.55 1w3y h LYS 831 N 0.58 1.00 0.00 0.00 3.64 -1.96 -3.08 116.57 116.76 1w3y h LYS 831 Ca 0.13 -0.18 -0.26 0.00 -1.27 0.00 0.00 60.65 59.07 1w3y h LYS 831 Cb 0.24 -0.16 -0.04 0.00 -0.41 0.00 0.00 32.23 31.86 1w3y h LYS 831 CO -0.00 0.83 -1.44 1.96 -2.27 0.00 0.00 179.45 178.53 1w3y h GLN 832 N 0.94 0.01 -0.60 1.90 4.20 -1.94 -3.48 115.11 116.14 1w3y h GLN 832 Ca 0.22 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.92 1w3y h GLN 832 Cb 0.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.99 1w3y h GLN 832 CO -0.02 0.70 0.00 0.41 -0.67 0.00 0.00 178.83 179.25 1w3y n GLY 833 N 1.48 0.80 3.31 3.46 0.00 0.13 -4.79 105.19 109.58 1w3y n GLY 833 Ca -0.11 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 44.90 1w3y n GLY 833 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w3y s VAL 834 N -2.60 2.13 -0.00 1.61 1.01 -0.86 -1.02 120.40 120.67 1w3y s VAL 834 Ca 0.00 -1.07 0.08 0.00 0.00 0.00 0.00 61.98 60.98 1w3y s VAL 834 Cb 0.00 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.61 1w3y s VAL 834 CO 0.00 0.58 -0.24 0.26 0.00 0.00 0.00 175.10 175.70 1w3y s TRP 835 N -0.52 2.41 -0.11 5.22 0.51 0.84 -0.63 118.94 126.65 1w3y s TRP 835 Ca 0.07 -0.37 0.02 0.00 -2.12 0.00 0.00 56.10 53.70 1w3y s TRP 835 Cb -0.11 -1.49 -0.01 0.00 -0.81 0.00 0.00 33.47 31.05 1w3y s TRP 835 CO 0.00 0.07 -0.19 0.20 -0.51 0.00 0.00 176.95 176.52 1w3y s GLY 836 N -0.87 1.43 -0.02 0.98 0.00 -0.50 -1.02 107.32 107.32 1w3y s GLY 836 Ca 0.11 -0.94 -0.01 0.00 0.00 0.00 0.00 44.72 43.88 1w3y s GLY 836 CO 0.01 -0.32 0.05 -0.42 0.00 0.00 0.00 173.10 172.41 1w3y s ILE 837 N 0.23 -0.03 -0.12 0.90 1.01 -0.07 -2.06 121.20 121.06 1w3y s ILE 837 Ca -0.12 0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.65 1w3y s ILE 837 Cb -0.16 -0.09 0.02 0.00 0.01 0.00 0.00 42.46 42.23 1w3y s ILE 837 CO 0.06 0.04 -0.15 -0.69 0.00 0.00 0.00 174.94 174.21 1w3y s VAL 838 N 0.58 1.52 -0.14 2.92 1.01 0.34 0.10 120.40 126.73 1w3y s VAL 838 Ca -0.05 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1w3y s VAL 838 Cb -0.07 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.90 1w3y s VAL 838 CO -0.02 0.45 -0.15 -0.54 0.00 0.00 0.00 175.10 174.83 1w3y s LYS 839 N 1.19 3.25 0.00 2.72 1.02 -0.02 -1.69 119.74 126.21 1w3y s LYS 839 Ca -0.02 -0.74 0.25 0.00 0.02 0.00 0.00 55.97 55.48 1w3y s LYS 839 Cb -0.14 -2.60 0.44 0.00 -0.52 0.00 0.00 37.83 35.01 1w3y s LYS 839 CO -0.05 0.08 1.37 0.66 -0.92 0.00 0.00 175.35 176.49 1w3y n TYR 840 N 3.87 0.00 -4.15 3.18 4.02 -0.25 -0.75 117.16 123.08 1w3y n TYR 840 Ca -0.19 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.58 1w3y n TYR 840 Cb 0.52 -0.07 -0.08 0.00 -0.02 0.00 0.00 39.34 39.69 1w3y n TYR 840 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 1w3y s ASP 841 N -2.51 0.36 -0.19 7.72 1.47 -1.26 -4.91 116.67 117.35 1w3y s ASP 841 Ca 0.22 -1.34 0.04 0.00 1.18 0.00 0.00 52.55 52.65 1w3y s ASP 841 Cb 0.19 0.48 0.38 0.00 -0.34 0.00 0.00 42.92 43.63 1w3y s ASP 841 CO 0.55 -0.99 1.36 0.47 0.68 0.00 0.00 175.17 177.24 1w3y n ASP 842 N -0.57 3.43 -4.82 2.11 8.00 -1.26 -3.05 116.55 120.38 1w3y n ASP 842 Ca 0.02 -2.71 -0.30 0.00 0.71 0.00 0.00 54.79 52.50 1w3y n ASP 842 Cb 0.64 -0.65 0.06 0.00 -0.02 0.00 0.00 41.12 41.15 1w3y n ASP 842 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1w3y s SER 843 N -0.27 5.12 -0.32 -2.24 1.04 -1.26 -4.73 113.70 111.04 1w3y s SER 843 Ca 0.29 1.43 -0.26 0.00 0.48 0.00 0.00 55.95 57.89 1w3y s SER 843 Cb 0.24 -2.26 0.01 0.00 0.10 0.00 0.00 66.02 64.11 1w3y s SER 843 CO 0.07 -1.59 0.91 -0.69 0.98 0.00 0.00 173.24 172.92 1w3y s VAL 844 N -3.13 4.67 -0.26 5.02 1.01 -1.26 -4.59 120.40 121.86 1w3y s VAL 844 Ca 0.59 1.40 -0.07 0.00 0.00 0.00 0.00 61.98 63.90 1w3y s VAL 844 Cb -0.14 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 31.95 1w3y s VAL 844 CO 0.54 -0.36 0.07 -0.44 0.00 0.00 0.00 175.10 174.91 1w3y s SER 845 N 1.65 5.12 -0.17 3.32 0.01 -0.67 -4.98 113.70 117.98 1w3y s SER 845 Ca 0.38 -0.30 -0.18 0.00 1.31 0.00 0.00 55.95 57.16 1w3y s SER 845 Cb -0.13 -1.91 -0.04 0.00 0.21 0.00 0.00 66.02 64.15 1w3y s SER 845 CO 0.14 -0.07 0.49 -0.89 0.41 0.00 0.00 173.24 173.32 1w3y s THR 846 N 1.59 5.15 -0.17 1.44 2.01 -1.26 -1.25 115.64 123.15 1w3y s THR 846 Ca 0.06 0.93 -0.02 0.00 0.31 0.00 0.00 61.69 62.97 1w3y s THR 846 Cb -0.15 -3.82 -0.01 0.00 0.01 0.00 0.00 72.50 68.52 1w3y s THR 846 CO 0.03 0.25 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.49 1w3y s ILE 847 N 1.18 3.28 -0.53 1.82 -1.09 0.87 -4.68 121.20 122.05 1w3y s ILE 847 Ca 0.24 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 58.10 1w3y s ILE 847 Cb -0.15 -2.43 0.00 0.00 -1.58 0.00 0.00 42.46 38.30 1w3y s ILE 847 CO 0.10 0.49 0.00 -1.20 -1.23 0.00 0.00 174.94 173.09 1w3y n SER 848 N 3.97 -2.27 -3.13 3.58 7.64 -1.26 -0.83 113.62 121.31 1w3y n SER 848 Ca -0.18 0.32 -0.21 0.00 1.01 0.00 0.00 58.87 59.81 1w3y n SER 848 Cb 0.52 -2.06 0.00 0.00 -1.01 0.00 0.00 64.21 61.66 1w3y n SER 848 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1w3y n ASN 849 N -1.33 -4.25 0.00 6.43 5.15 -1.26 -4.79 115.26 115.20 1w3y n ASN 849 Ca -0.07 -0.26 0.00 0.00 -0.60 0.00 0.00 54.58 53.65 1w3y n ASN 849 Cb 0.50 -3.51 0.00 0.00 -0.53 0.00 0.00 39.78 36.24 1w3y n ASN 849 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1w3y n GLN 850 N -3.63 1.79 -3.91 1.20 6.02 -0.01 -4.98 117.38 113.86 1w3y n GLN 850 Ca -0.06 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.84 1w3y n GLN 850 Cb 0.57 -0.86 -0.02 0.00 1.02 0.00 0.00 30.24 30.95 1w3y n GLN 850 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 1w3y s PHE 851 N -1.72 0.15 0.01 1.08 -0.12 -1.12 -1.83 117.98 114.42 1w3y s PHE 851 Ca 0.00 -0.61 0.05 0.00 -0.05 0.00 0.00 56.93 56.31 1w3y s PHE 851 Cb 0.00 0.53 -0.01 0.00 -0.63 0.00 0.00 43.02 42.91 1w3y s PHE 851 CO 0.00 -1.25 -0.14 -0.65 -0.05 0.00 0.00 175.22 173.13 1w3y s GLN 852 N -3.48 1.07 -0.08 1.99 -0.21 0.46 -0.09 119.66 119.33 1w3y s GLN 852 Ca 0.17 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 54.97 1w3y s GLN 852 Cb -0.04 -1.06 -0.02 0.00 1.00 0.00 0.00 33.01 32.89 1w3y s GLN 852 CO 0.10 0.28 -0.13 0.14 -2.12 0.00 0.00 175.29 173.56 1w3y s VAL 853 N -0.51 3.15 -0.44 1.09 -7.23 -0.38 -1.23 120.40 114.85 1w3y s VAL 853 Ca 0.04 -0.67 0.08 0.00 -1.81 0.00 0.00 61.98 59.62 1w3y s VAL 853 Cb -0.06 -2.27 -0.08 0.00 0.56 0.00 0.00 36.38 34.53 1w3y s VAL 853 CO 0.00 0.57 0.38 0.18 -0.31 0.00 0.00 175.10 175.92 1w3y n LEU 854 N 2.69 0.48 -4.22 1.32 4.77 -0.40 -1.67 117.00 119.96 1w3y n LEU 854 Ca -0.18 -0.53 -0.21 0.00 -0.03 0.00 0.00 56.01 55.06 1w3y n LEU 854 Cb 0.52 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.49 1w3y n LEU 854 CO 0.27 0.11 -0.49 -0.54 -1.33 0.00 0.00 177.39 175.42 1w3y s LYS 855 N -1.70 0.98 0.25 3.23 1.02 -1.26 -4.41 119.74 117.85 1w3y s LYS 855 Ca 0.04 -1.03 -0.31 0.00 0.02 0.00 0.00 55.97 54.69 1w3y s LYS 855 Cb 0.06 -1.10 -0.13 0.00 -0.52 0.00 0.00 37.83 36.14 1w3y s LYS 855 CO 0.32 0.25 1.43 -2.13 -0.92 0.00 0.00 175.35 174.30 1w3y n ARG 856 N 1.26 2.15 -2.21 1.68 0.63 -1.17 -4.74 116.66 114.25 1w3y n ARG 856 Ca -0.20 0.76 0.00 0.00 -0.92 0.00 0.00 57.85 57.49 1w3y n ARG 856 Cb 0.54 -2.44 0.00 0.00 0.45 0.00 0.00 32.46 31.01 1w3y n ARG 856 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1w3y n GLY 857 N 2.08 -0.29 3.31 5.14 0.00 0.07 -4.85 105.19 110.66 1w3y n GLY 857 Ca 0.11 -1.53 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 1w3y n GLY 857 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1w3y s VAL 858 N -2.59 2.32 0.07 1.61 1.01 -0.38 -0.84 120.40 121.61 1w3y s VAL 858 Ca 0.00 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.07 1w3y s VAL 858 Cb 0.00 -1.88 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 1w3y s VAL 858 CO 0.00 0.57 -0.14 -0.31 0.00 0.00 0.00 175.10 175.22 1w3y s TYR 859 N -0.13 1.20 -0.12 5.22 1.51 0.11 -1.14 117.35 124.00 1w3y s TYR 859 Ca -0.04 -0.47 -0.04 0.00 -1.01 0.00 0.00 57.07 55.51 1w3y s TYR 859 Cb -0.14 -0.67 0.05 0.00 -0.11 0.00 0.00 41.96 41.09 1w3y s TYR 859 CO 0.04 0.05 0.11 0.99 -1.11 0.00 0.00 175.55 175.63 1w3y s THR 860 N -1.36 -0.15 -0.01 -0.71 2.01 -0.59 -0.89 115.64 113.95 1w3y s THR 860 Ca -0.02 0.09 0.06 0.00 0.31 0.00 0.00 61.69 62.14 1w3y s THR 860 Cb -0.10 -0.42 -0.02 0.00 0.01 0.00 0.00 72.50 71.98 1w3y s THR 860 CO 0.02 -0.08 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.05 1w3y s ILE 861 N 2.19 1.53 -0.05 1.82 1.01 -0.19 -1.68 121.20 125.83 1w3y s ILE 861 Ca 0.04 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 59.84 1w3y s ILE 861 Cb -0.14 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.05 1w3y s ILE 861 CO -0.07 0.39 -0.16 -0.60 0.00 0.00 0.00 174.94 174.50 1w3y s ARG 862 N -0.57 1.75 -0.23 2.79 3.52 -0.56 -0.11 118.95 125.54 1w3y s ARG 862 Ca 0.07 -0.55 -0.10 0.00 -0.13 0.00 0.00 55.73 55.03 1w3y s ARG 862 Cb -0.08 -1.49 -0.05 0.00 -1.56 0.00 0.00 34.95 31.77 1w3y s ARG 862 CO -0.00 0.18 0.14 0.21 -0.81 0.00 0.00 175.30 175.01 1w3y s LYS 863 N 0.21 4.04 -0.29 5.12 2.20 -0.19 -0.20 119.74 130.63 1w3y s LYS 863 Ca -0.07 -0.29 0.00 0.00 -0.36 0.00 0.00 55.97 55.25 1w3y s LYS 863 Cb -0.12 -3.46 0.09 0.00 -1.51 0.00 0.00 37.83 32.82 1w3y s LYS 863 CO 0.03 0.10 0.05 -1.21 -0.36 0.00 0.00 175.35 173.95 1w3y s GLU 864 N 0.93 1.08 7.78 4.03 2.02 0.84 -4.82 118.70 130.55 1w3y s GLU 864 Ca 0.07 -1.17 0.00 0.00 0.02 0.00 0.00 54.97 53.89 1w3y s GLU 864 Cb -0.13 -2.40 0.00 0.00 0.10 0.00 0.00 34.13 31.70 1w3y s GLU 864 CO 0.03 -0.86 0.00 0.41 0.02 0.00 0.00 175.26 174.87 1w3y n GLY 865 N 4.70 3.09 0.99 -1.39 0.00 -1.26 -0.66 105.19 110.66 1w3y n GLY 865 Ca -0.04 -0.19 0.09 0.00 0.00 0.00 0.00 46.02 45.89 1w3y n GLY 865 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1w3y n ASP 866 N 8.24 3.34 -4.91 1.61 8.00 -1.26 -4.96 116.55 126.60 1w3y n ASP 866 Ca 0.00 -1.95 -0.30 0.00 0.71 0.00 0.00 54.79 53.24 1w3y n ASP 866 Cb 0.00 -0.31 -0.04 0.00 -0.02 0.00 0.00 41.12 40.75 1w3y n ASP 866 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1w3y s GLU 867 N -1.10 3.56 -0.09 -1.24 0.41 0.16 -5.11 118.70 115.30 1w3y s GLU 867 Ca 0.35 -0.21 0.01 0.00 -0.41 0.00 0.00 54.97 54.71 1w3y s GLU 867 Cb 0.19 -2.87 0.02 0.00 -1.78 0.00 0.00 34.13 29.69 1w3y s GLU 867 CO 0.25 0.47 -0.10 0.71 -0.49 0.00 0.00 175.26 176.10 1w3y s TYR 868 N -1.70 1.46 -0.16 1.61 2.02 -1.26 -0.11 117.35 119.20 1w3y s TYR 868 Ca 0.39 -0.63 -0.14 0.00 -0.37 0.00 0.00 57.07 56.33 1w3y s TYR 868 Cb -0.12 -1.14 -0.05 0.00 -0.40 0.00 0.00 41.96 40.26 1w3y s TYR 868 CO 0.26 -0.39 0.28 0.15 -1.57 0.00 0.00 175.55 174.29 1w3y s LYS 869 N 1.16 4.24 -0.04 -0.62 3.01 0.72 -4.95 119.74 123.26 1w3y s LYS 869 Ca -0.05 0.08 0.06 0.00 -1.01 0.00 0.00 55.97 55.05 1w3y s LYS 869 Cb -0.14 -3.42 -0.01 0.00 -1.01 0.00 0.00 37.83 33.24 1w3y s LYS 869 CO -0.02 0.25 -0.22 0.42 0.51 0.00 0.00 175.35 176.29 1w3y s ILE 870 N 0.44 1.78 -0.24 2.17 1.01 -1.26 -1.49 121.20 123.61 1w3y s ILE 870 Ca 0.16 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.87 1w3y s ILE 870 Cb -0.13 -1.50 0.07 0.00 0.01 0.00 0.00 42.46 40.91 1w3y s ILE 870 CO 0.04 0.50 0.03 0.00 0.00 0.00 0.00 174.94 175.51 1w3y s ALA 871 N -0.24 1.43 0.01 9.38 0.00 -0.68 -5.03 121.76 126.63 1w3y s ALA 871 Ca 0.01 -1.18 0.07 0.00 0.00 0.00 0.00 51.96 50.85 1w3y s ALA 871 Cb -0.11 -1.39 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 1w3y s ALA 871 CO 0.02 -1.34 -0.20 -0.47 0.00 0.00 0.00 175.76 173.78 1w3y s TYR 872 N 1.65 2.52 -0.08 0.00 5.04 -1.26 -1.54 117.35 123.69 1w3y s TYR 872 Ca 0.01 -0.28 -0.03 0.00 -2.44 0.00 0.00 57.07 54.33 1w3y s TYR 872 Cb -0.18 -1.51 0.04 0.00 0.35 0.00 0.00 41.96 40.67 1w3y s TYR 872 CO -0.13 0.16 0.17 -0.47 -1.34 0.00 0.00 175.55 173.95 1w3y s TYR 873 N -0.80 -0.20 -0.53 4.97 5.04 -0.29 -4.41 117.35 121.13 1w3y s TYR 873 Ca 0.13 0.56 -0.14 0.00 -2.44 0.00 0.00 57.07 55.18 1w3y s TYR 873 Cb -0.10 -0.08 0.13 0.00 0.35 0.00 0.00 41.96 42.25 1w3y s TYR 873 CO 0.02 -0.20 0.47 1.21 -1.34 0.00 0.00 175.55 175.72 1w3y s ASN 874 N 1.37 6.09 0.58 4.32 3.04 0.59 -1.25 114.94 129.67 1w3y s ASN 874 Ca -0.07 -1.85 0.29 0.00 0.04 0.00 0.00 52.86 51.27 1w3y s ASN 874 Cb -0.11 -2.16 1.76 0.00 -1.54 0.00 0.00 41.25 39.19 1w3y s ASN 874 CO -0.06 -0.81 2.23 1.55 -3.04 0.00 0.00 177.10 176.96 1w3y h PRO 875 N 8.75 0.00 -0.04 0.43 0.13 -1.86 0.15 132.00 139.57 1w3y h PRO 875 Ca -0.27 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.64 1w3y h PRO 875 Cb 1.09 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.24 1w3y h PRO 875 CO 0.99 0.02 -0.84 0.93 -0.23 0.00 0.00 178.00 178.87 1w3y h GLU 876 N 0.00 0.63 -0.00 0.86 5.08 -1.87 -3.25 114.58 116.03 1w3y h GLU 876 Ca -0.00 -0.63 0.00 0.00 -1.00 0.00 0.00 59.36 57.73 1w3y h GLU 876 Cb 0.06 0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1w3y h GLU 876 CO 0.00 1.24 -0.64 0.25 -1.00 0.00 0.00 179.01 178.86 1w3y n THR 877 N -3.99 0.00 -3.53 1.13 -2.24 -1.16 -4.97 114.28 99.51 1w3y n THR 877 Ca -0.10 -0.05 -0.19 0.00 -2.27 0.00 0.00 64.05 61.44 1w3y n THR 877 Cb 0.78 0.66 0.07 0.00 -2.10 0.00 0.00 70.33 69.74 1w3y n THR 877 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1w3y n GLN 878 N -1.20 -6.05 -3.90 -0.78 6.02 0.49 -5.01 117.38 106.96 1w3y n GLN 878 Ca 0.06 0.77 -0.10 0.00 -0.01 0.00 0.00 57.00 57.72 1w3y n GLN 878 Cb 0.35 -5.62 -0.09 0.00 1.02 0.00 0.00 30.24 25.90 1w3y n GLN 878 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1w3y s GLU 879 N -5.61 0.61 0.00 -1.09 2.02 -1.02 -4.99 118.70 108.62 1w3y s GLU 879 Ca 0.02 -0.71 0.00 0.00 0.02 0.00 0.00 54.97 54.30 1w3y s GLU 879 Cb -0.01 0.24 0.00 0.00 0.10 0.00 0.00 34.13 34.46 1w3y s GLU 879 CO 0.76 -0.16 0.00 0.45 0.02 0.00 0.00 175.26 176.33 1w3y n SER 880 N 0.78 0.00 -3.55 -0.19 2.88 -1.26 -0.30 113.62 111.98 1w3y n SER 880 Ca -0.19 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.25 1w3y n SER 880 Cb 0.58 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.01 1w3y n SER 880 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1w3y s ALA 881 N -3.13 -1.89 0.40 -1.46 0.00 -1.26 -4.77 121.76 109.65 1w3y s ALA 881 Ca 0.00 1.36 -0.26 0.00 0.00 0.00 0.00 51.96 53.06 1w3y s ALA 881 Cb 0.00 -0.21 -0.10 0.00 0.00 0.00 0.00 23.12 22.80 1w3y s ALA 881 CO 0.00 -0.48 1.26 -2.30 0.00 0.00 0.00 175.76 174.25 1w3y n PRO 882 N 0.30 1.96 -0.22 0.00 -0.02 -1.26 -4.89 135.00 130.87 1w3y n PRO 882 Ca -0.09 0.69 0.03 0.00 -2.02 0.00 0.00 63.50 62.11 1w3y n PRO 882 Cb 0.59 -2.35 0.13 0.00 -0.02 0.00 0.00 33.50 31.85 1w3y n PRO 882 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1w3y h ASP 883 N 2.18 -0.07 0.35 2.55 3.32 -1.99 -1.91 116.42 120.85 1w3y h ASP 883 Ca -0.47 0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.71 1w3y h ASP 883 Cb 1.29 0.20 0.00 0.00 0.22 0.00 0.00 39.33 41.04 1w3y h ASP 883 CO 0.60 -0.04 0.00 0.06 -1.72 0.00 0.00 179.24 178.14 1w3y h GLN 884 N 0.23 0.00 0.00 3.56 -0.00 -1.90 -0.27 115.11 116.72 1w3y h GLN 884 Ca 0.35 0.00 -0.15 0.00 -0.00 0.00 0.00 58.65 58.85 1w3y h GLN 884 Cb 0.57 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.03 1w3y h GLN 884 CO -0.48 0.00 -0.74 0.93 -0.00 0.00 0.00 178.83 178.55 1w3y h GLU 885 N 0.00 0.00 0.00 0.06 5.08 -1.70 -3.38 114.58 114.64 1w3y h GLU 885 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1w3y h GLU 885 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1w3y h GLU 885 CO 0.00 0.74 -0.02 1.33 -1.00 0.00 0.00 179.01 180.06 1w3y n VAL 886 N -3.39 0.00 -4.06 3.13 0.24 -0.89 -4.57 118.33 108.79 1w3y n VAL 886 Ca 0.00 -0.47 -0.14 0.00 -2.04 0.00 0.00 64.34 61.69 1w3y n VAL 886 Cb 0.79 0.99 -0.13 0.00 -1.47 0.00 0.00 33.84 34.02 1w3y n VAL 886 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 1w3y s PHE 887 N -0.98 0.40 -0.18 6.34 5.36 -0.16 -1.28 117.98 127.48 1w3y s PHE 887 Ca 0.00 -0.20 -0.06 0.00 -0.96 0.00 0.00 56.93 55.71 1w3y s PHE 887 Cb 0.00 -0.25 0.08 0.00 -0.34 0.00 0.00 43.02 42.51 1w3y s PHE 887 CO 0.00 -0.04 0.36 0.21 -1.46 0.00 0.00 175.22 174.29 1w3y s LYS 888 N -0.55 0.26 0.44 10.12 2.36 -0.37 -4.42 119.74 127.59 1w3y s LYS 888 Ca -0.03 0.90 -0.22 0.00 -2.55 0.00 0.00 55.97 54.07 1w3y s LYS 888 Cb -0.04 0.15 -0.08 0.00 -1.05 0.00 0.00 37.83 36.81 1w3y s LYS 888 CO -0.00 -0.28 1.07 0.21 1.55 0.00 0.00 175.35 177.90 1w3y s LYS 889 N 2.54 3.94 0.00 4.03 2.20 -1.26 -0.40 119.74 130.78 1w3y s LYS 889 Ca 0.00 1.53 0.29 0.00 -0.36 0.00 0.00 55.97 57.43 1w3y s LYS 889 Cb -0.12 -2.36 1.31 0.00 -1.51 0.00 0.00 37.83 35.15 1w3y s LYS 889 CO -0.11 -0.34 1.89 1.28 -0.36 0.00 0.00 175.35 177.71