#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k3e s LEU 188 N 0.00 4.48 0.86 2.23 1.43 -1.26 -5.04 118.68 121.39 3k3e s LEU 188 Ca 0.00 2.29 -0.13 0.00 -1.03 0.00 0.00 54.13 55.26 3k3e s LEU 188 Cb 0.00 -3.62 0.12 0.00 0.03 0.00 0.00 46.19 42.73 3k3e s LEU 188 CO 0.00 -0.31 1.23 -0.94 0.23 0.00 0.00 176.35 176.55 3k3e s SER 189 N -0.26 4.00 0.37 2.29 1.04 -1.26 -4.87 113.70 115.01 3k3e s SER 189 Ca 0.50 0.59 0.19 0.00 0.48 0.00 0.00 55.95 57.70 3k3e s SER 189 Cb -0.33 -0.92 0.63 0.00 0.10 0.00 0.00 66.02 65.50 3k3e s SER 189 CO 0.40 -2.20 1.70 1.55 0.98 0.00 0.00 173.24 175.67 3k3e h PRO 190 N -1.26 0.00 -0.48 4.02 0.13 -1.99 -2.30 132.00 130.12 3k3e h PRO 190 Ca -0.45 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.60 3k3e h PRO 190 Cb 1.30 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 3k3e h PRO 190 CO 0.56 0.37 0.01 1.49 -0.23 0.00 0.00 178.00 180.20 3k3e h GLU 191 N 0.00 0.85 0.13 0.86 4.81 -2.00 -2.96 114.58 116.27 3k3e h GLU 191 Ca -0.00 -0.27 -0.01 0.00 -0.13 0.00 0.00 59.36 58.95 3k3e h GLU 191 Cb 0.95 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.25 3k3e h GLU 191 CO 0.05 0.89 -0.06 1.15 -0.73 0.00 0.00 179.01 180.30 3k3e h THR 192 N 0.71 1.02 0.00 0.32 2.02 -1.89 -2.57 112.91 112.51 3k3e h THR 192 Ca 0.14 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.61 3k3e h THR 192 Cb 0.50 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.36 3k3e h THR 192 CO 0.02 0.17 0.29 0.40 0.37 0.00 0.00 175.52 176.77 3k3e h ILE 193 N -0.52 0.00 0.03 3.11 2.04 -1.40 -0.88 117.51 119.89 3k3e h ILE 193 Ca -0.02 0.00 -0.36 0.00 1.00 0.00 0.00 64.86 65.48 3k3e h ILE 193 Cb 0.41 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 36.92 3k3e h ILE 193 CO 0.03 0.00 -2.22 1.21 0.00 0.00 0.00 178.15 177.17 3k3e n GLU 194 N -2.47 0.68 0.12 2.37 2.13 -1.09 -4.21 120.64 118.18 3k3e n GLU 194 Ca -0.01 0.16 0.13 0.00 0.66 0.00 0.00 57.16 58.09 3k3e n GLU 194 Cb 0.33 -1.61 0.38 0.00 0.27 0.00 0.00 31.44 30.81 3k3e n GLU 194 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3k3e h ALA 195 N 0.43 1.00 0.00 4.31 0.00 -0.86 -3.17 119.26 120.96 3k3e h ALA 195 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3k3e h ALA 195 Cb 2.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.83 3k3e h ALA 195 CO 0.01 0.00 0.00 -0.11 0.00 0.00 0.00 179.25 179.15 3k3e n LEU 196 N -2.39 0.46 -0.96 0.00 7.94 -0.44 -2.30 117.00 119.30 3k3e n LEU 196 Ca 0.05 0.60 0.11 0.00 -1.11 0.00 0.00 56.01 55.65 3k3e n LEU 196 Cb 0.43 -0.52 0.27 0.00 0.53 0.00 0.00 43.42 44.14 3k3e n LEU 196 CO 0.30 -0.39 0.72 0.54 -1.11 0.00 0.00 177.39 177.46 3k3e n ARG 197 N -1.99 2.24 -4.57 1.96 1.74 -1.20 -4.58 116.66 110.26 3k3e n ARG 197 Ca 0.03 -1.88 -0.28 0.00 -0.77 0.00 0.00 57.85 54.95 3k3e n ARG 197 Cb 0.25 -1.46 -0.14 0.00 -1.02 0.00 0.00 32.46 30.09 3k3e n ARG 197 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3k3e s LYS 198 N -1.50 1.46 0.00 5.56 1.02 -0.97 -4.45 119.74 120.86 3k3e s LYS 198 Ca 0.37 -1.17 0.12 0.00 0.02 0.00 0.00 55.97 55.30 3k3e s LYS 198 Cb 0.20 -1.75 0.59 0.00 -0.52 0.00 0.00 37.83 36.35 3k3e s LYS 198 CO 0.28 0.43 1.27 -0.35 -0.92 0.00 0.00 175.35 176.07 3k3e n PRO 199 N 1.37 0.17 0.00 -1.68 -0.04 -1.26 -2.21 135.00 131.35 3k3e n PRO 199 Ca -0.18 0.17 0.14 0.00 -0.04 0.00 0.00 63.50 63.59 3k3e n PRO 199 Cb 0.53 -1.50 0.60 0.00 -0.04 0.00 0.00 33.50 33.09 3k3e n PRO 199 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3k3e n THR 200 N -1.27 0.00 -1.65 0.52 -2.24 -1.26 -4.53 114.28 103.84 3k3e n THR 200 Ca 0.06 -0.08 -0.47 0.00 -2.27 0.00 0.00 64.05 61.29 3k3e n THR 200 Cb 0.09 -0.02 -0.04 0.00 -2.10 0.00 0.00 70.33 68.26 3k3e n THR 200 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3k3e n PHE 201 N -0.82 2.01 -2.88 4.78 7.35 -0.94 -4.86 117.46 122.10 3k3e n PHE 201 Ca 0.15 0.43 -0.43 0.00 -0.76 0.00 0.00 57.45 56.84 3k3e n PHE 201 Cb 0.28 -2.45 -0.04 0.00 0.35 0.00 0.00 39.48 37.62 3k3e n PHE 201 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3k3e s ASP 202 N 0.53 6.21 0.43 -2.13 3.68 -1.26 -4.87 116.67 119.25 3k3e s ASP 202 Ca 0.75 -1.09 0.22 0.00 2.13 0.00 0.00 52.55 54.56 3k3e s ASP 202 Cb -0.73 -2.41 0.90 0.00 -1.45 0.00 0.00 42.92 39.23 3k3e s ASP 202 CO 0.45 -1.40 1.83 -0.37 0.13 0.00 0.00 175.17 175.81 3k3e h VAL 203 N 5.97 0.68 0.00 1.11 -1.51 -1.95 -3.13 116.25 117.41 3k3e h VAL 203 Ca -0.25 -1.18 0.00 0.00 -1.23 0.00 0.00 66.70 64.04 3k3e h VAL 203 Cb 1.07 1.76 0.00 0.00 -2.13 0.00 0.00 31.29 31.99 3k3e h VAL 203 CO 1.17 0.26 0.00 0.79 -1.23 0.00 0.00 177.57 178.56 3k3e n TRP 204 N -3.49 0.00 0.00 5.19 7.02 -1.26 -3.92 117.44 120.99 3k3e n TRP 204 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 3k3e n TRP 204 Cb 0.43 -0.45 0.00 0.00 -2.42 0.00 0.00 31.31 28.87 3k3e n TRP 204 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3k3e n LEU 205 N -1.45 0.44 -4.31 -0.99 4.77 -1.18 -4.97 117.00 109.31 3k3e n LEU 205 Ca 0.05 0.44 -0.36 0.00 -0.03 0.00 0.00 56.01 56.11 3k3e n LEU 205 Cb 0.18 -0.42 0.06 0.00 -2.33 0.00 0.00 43.42 40.90 3k3e n LEU 205 CO 0.15 -0.42 -0.41 0.79 -1.33 0.00 0.00 177.39 176.17 3k3e n TRP 206 N -1.77 -2.28 -4.12 -1.77 7.02 -1.25 -5.04 117.44 108.23 3k3e n TRP 206 Ca 0.00 0.27 -0.22 0.00 -1.02 0.00 0.00 57.50 56.53 3k3e n TRP 206 Cb 0.00 -1.75 -0.05 0.00 -2.42 0.00 0.00 31.31 27.09 3k3e n TRP 206 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 3k3e s GLU 207 N -2.34 2.59 0.34 -0.99 2.02 -1.26 -4.88 118.70 114.18 3k3e s GLU 207 Ca 0.57 -1.30 0.14 0.00 0.02 0.00 0.00 54.97 54.40 3k3e s GLU 207 Cb -0.33 -2.35 1.12 0.00 0.10 0.00 0.00 34.13 32.67 3k3e s GLU 207 CO 0.66 0.28 1.55 -0.35 0.02 0.00 0.00 175.26 177.42 3k3e n PRO 208 N -1.12 -0.07 0.12 0.39 -0.04 -1.26 0.05 135.00 133.07 3k3e n PRO 208 Ca -0.05 1.40 -0.14 0.00 -0.04 0.00 0.00 63.50 64.67 3k3e n PRO 208 Cb 0.59 -2.40 -0.08 0.00 -0.04 0.00 0.00 33.50 31.57 3k3e n PRO 208 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 3k3e h ASN 209 N 0.00 -0.22 -0.49 3.54 -0.73 -2.00 -2.00 115.58 113.69 3k3e h ASN 209 Ca 0.75 -0.10 -0.04 0.00 1.87 0.00 0.00 56.30 58.78 3k3e h ASN 209 Cb 1.85 0.06 -0.02 0.00 0.27 0.00 0.00 38.32 40.48 3k3e h ASN 209 CO -0.82 -0.03 0.16 -0.33 -0.37 0.00 0.00 177.43 176.05 3k3e h GLU 210 N -0.39 0.75 -0.77 6.67 5.08 -0.76 -2.91 114.58 122.25 3k3e h GLU 210 Ca -0.03 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.15 3k3e h GLU 210 Cb 0.30 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.41 3k3e h GLU 210 CO 0.04 0.70 0.36 0.52 -1.00 0.00 0.00 179.01 179.63 3k3e h MET 211 N 0.65 1.11 -0.65 2.33 2.86 -1.02 -0.61 114.93 119.61 3k3e h MET 211 Ca 0.16 -0.17 0.13 0.00 -2.06 0.00 0.00 59.70 57.76 3k3e h MET 211 Cb 0.25 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.67 3k3e h MET 211 CO -0.01 0.87 0.44 -0.07 1.06 0.00 0.00 176.91 179.20 3k3e h LEU 212 N 1.08 0.29 -0.03 1.22 3.38 -1.17 0.80 115.31 120.89 3k3e h LEU 212 Ca 0.26 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 3k3e h LEU 212 Cb 0.13 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3k3e h LEU 212 CO -0.03 0.16 -0.02 0.28 0.09 0.00 0.00 178.44 178.92 3k3e h SER 213 N 0.31 0.07 -0.69 -0.43 0.02 -0.99 -1.84 113.55 110.01 3k3e h SER 213 Ca 0.31 -0.45 0.08 0.00 -0.84 0.00 0.00 61.79 60.90 3k3e h SER 213 Cb 0.79 -0.02 -0.06 0.00 0.14 0.00 0.00 62.40 63.25 3k3e h SER 213 CO -0.08 0.50 0.35 0.00 -1.14 0.00 0.00 176.83 176.47 3k3e h LEU 215 N 0.62 -0.10 -0.58 0.00 3.38 -0.86 -0.39 115.31 117.38 3k3e h LEU 215 Ca 0.33 0.01 0.09 0.00 0.09 0.00 0.00 57.88 58.39 3k3e h LEU 215 Cb 0.30 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.01 3k3e h LEU 215 CO -0.24 -0.06 0.21 -0.08 0.09 0.00 0.00 178.44 178.36 3k3e h GLU 216 N -0.09 0.38 -0.02 1.13 4.81 -0.44 -1.93 114.58 118.41 3k3e h GLU 216 Ca 0.00 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 3k3e h GLU 216 Cb 0.09 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 3k3e h GLU 216 CO -0.01 0.25 -0.20 1.25 -0.73 0.00 0.00 179.01 179.57 3k3e h HIS 217 N 0.39 -0.52 -0.98 0.92 2.76 -0.10 -2.16 115.15 115.46 3k3e h HIS 217 Ca 0.29 0.02 0.21 0.00 -2.20 0.00 0.00 60.37 58.68 3k3e h HIS 217 Cb 0.34 0.24 -0.11 0.00 1.55 0.00 0.00 27.41 29.43 3k3e h HIS 217 CO -0.17 -0.28 0.57 0.52 -1.30 0.00 0.00 177.93 177.27 3k3e h MET 218 N -0.31 0.64 -0.21 5.26 2.86 -0.32 0.33 114.93 123.18 3k3e h MET 218 Ca 0.07 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.58 3k3e h MET 218 Cb 0.40 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 3k3e h MET 218 CO -0.20 0.43 -0.26 1.88 1.06 0.00 0.00 176.91 179.81 3k3e h TYR 219 N 0.66 0.44 0.01 -0.22 -1.99 -0.90 -1.41 116.97 113.56 3k3e h TYR 219 Ca 0.59 -0.09 -0.02 0.00 2.00 0.00 0.00 58.73 61.20 3k3e h TYR 219 Cb 0.99 -0.11 0.00 0.00 2.00 0.00 0.00 36.73 39.62 3k3e h TYR 219 CO -0.03 0.63 -0.10 0.45 -0.00 0.00 0.00 178.16 179.11 3k3e h HIS 220 N 0.35 0.08 -0.89 4.88 3.86 -0.69 -1.93 115.15 120.80 3k3e h HIS 220 Ca 0.05 -0.05 0.18 0.00 -1.16 0.00 0.00 60.37 59.39 3k3e h HIS 220 Cb 0.65 -0.01 -0.07 0.00 1.06 0.00 0.00 27.41 29.04 3k3e h HIS 220 CO 0.02 0.97 0.58 0.22 0.86 0.00 0.00 177.93 180.58 3k3e h ASP 221 N -0.83 0.48 0.38 2.45 -0.00 -0.42 0.45 116.42 118.92 3k3e h ASP 221 Ca -0.02 0.04 0.00 0.00 -0.00 0.00 0.00 57.03 57.06 3k3e h ASP 221 Cb 1.00 -0.05 0.00 0.00 -0.00 0.00 0.00 39.33 40.29 3k3e h ASP 221 CO 0.02 0.21 -0.09 0.18 -0.00 0.00 0.00 179.24 179.56 3k3e n LEU 222 N -4.53 0.38 -1.55 2.28 4.77 -0.54 -4.92 117.00 112.89 3k3e n LEU 222 Ca 0.19 0.05 -0.14 0.00 -0.03 0.00 0.00 56.01 56.08 3k3e n LEU 222 Cb 0.62 -0.19 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 3k3e n LEU 222 CO 0.30 0.07 -0.18 0.61 -1.33 0.00 0.00 177.39 176.87 3k3e n GLY 223 N 1.27 -0.13 0.19 -0.72 0.00 0.16 -4.90 105.19 101.06 3k3e n GLY 223 Ca 0.15 -0.31 -0.17 0.00 0.00 0.00 0.00 46.02 45.69 3k3e n GLY 223 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3k3e h LEU 224 N 0.00 0.76 0.54 0.99 3.38 -1.55 -1.45 115.31 117.99 3k3e h LEU 224 Ca -0.33 -0.59 -0.02 0.00 0.09 0.00 0.00 57.88 57.04 3k3e h LEU 224 Cb 1.23 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.74 3k3e h LEU 224 CO 0.39 1.39 -0.38 0.58 0.09 0.00 0.00 178.44 180.50 3k3e h VAL 225 N 0.35 0.23 0.00 1.22 2.07 -1.85 -1.15 116.25 117.12 3k3e h VAL 225 Ca -0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.42 3k3e h VAL 225 Cb 1.60 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 3k3e h VAL 225 CO 0.18 0.00 0.00 0.54 0.02 0.00 0.00 177.57 178.31 3k3e n ARG 226 N -5.51 0.00 0.08 1.57 1.74 -1.20 0.55 116.66 113.89 3k3e n ARG 226 Ca -0.12 0.56 0.04 0.00 -0.77 0.00 0.00 57.85 57.57 3k3e n ARG 226 Cb 0.40 -1.33 0.23 0.00 -1.02 0.00 0.00 32.46 30.74 3k3e n ARG 226 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3k3e n ASP 227 N -1.88 0.22 -0.00 0.55 8.00 -0.55 -2.57 116.55 120.32 3k3e n ASP 227 Ca 0.00 0.54 0.01 0.00 0.71 0.00 0.00 54.79 56.05 3k3e n ASP 227 Cb 0.00 -0.54 -0.01 0.00 -0.02 0.00 0.00 41.12 40.54 3k3e n ASP 227 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3k3e n PHE 228 N -1.77 0.00 -2.34 1.24 3.72 -0.43 -5.03 117.46 112.85 3k3e n PHE 228 Ca -0.01 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.38 3k3e n PHE 228 Cb 0.12 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 3k3e n PHE 228 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 3k3e n SER 229 N -1.43 -1.80 -4.72 4.37 7.64 0.19 -4.63 113.62 113.24 3k3e n SER 229 Ca -0.00 -0.01 -0.42 0.00 1.01 0.00 0.00 58.87 59.45 3k3e n SER 229 Cb 0.05 -0.70 -0.03 0.00 -1.01 0.00 0.00 64.21 62.52 3k3e n SER 229 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3k3e s ILE 230 N -2.63 3.41 -0.46 0.44 1.01 -0.88 -4.65 121.20 117.45 3k3e s ILE 230 Ca 0.02 1.05 -0.29 0.00 0.00 0.00 0.00 60.65 61.42 3k3e s ILE 230 Cb -0.01 -3.67 0.02 0.00 0.01 0.00 0.00 42.46 38.81 3k3e s ILE 230 CO 0.02 0.10 1.30 0.21 0.00 0.00 0.00 174.94 176.57 3k3e s ASN 231 N 0.91 6.43 0.56 3.58 3.84 -1.26 -4.86 114.94 124.13 3k3e s ASN 231 Ca 0.62 0.62 0.13 0.00 0.21 0.00 0.00 52.86 54.44 3k3e s ASN 231 Cb -0.35 -2.54 0.69 0.00 -0.55 0.00 0.00 41.25 38.49 3k3e s ASN 231 CO 0.32 -1.39 1.34 1.55 -2.79 0.00 0.00 177.10 176.12 3k3e h PRO 232 N 10.16 0.00 0.10 0.43 0.13 -1.98 0.83 132.00 141.68 3k3e h PRO 232 Ca -0.26 0.00 -0.33 0.00 -0.87 0.00 0.00 66.00 64.54 3k3e h PRO 232 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 3k3e h PRO 232 CO 1.11 0.00 -1.80 0.28 -0.23 0.00 0.00 178.00 177.36 3k3e h VAL 233 N 0.00 0.72 0.15 1.56 2.07 -1.99 -3.20 116.25 115.56 3k3e h VAL 233 Ca 0.00 -2.32 -0.01 0.00 0.82 0.00 0.00 66.70 65.20 3k3e h VAL 233 Cb 1.22 2.47 -0.00 0.00 -1.52 0.00 0.00 31.29 33.46 3k3e h VAL 233 CO 0.00 0.77 -0.08 0.74 0.02 0.00 0.00 177.57 179.01 3k3e h THR 234 N -0.17 0.82 -0.85 2.57 2.02 -1.22 -1.33 112.91 114.75 3k3e h THR 234 Ca -0.40 0.00 0.22 0.00 0.77 0.00 0.00 66.41 67.00 3k3e h THR 234 Cb 1.87 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 69.06 3k3e h THR 234 CO 0.03 0.00 0.59 0.25 0.37 0.00 0.00 175.52 176.76 3k3e h LEU 235 N -0.22 0.17 0.03 2.58 5.85 -1.28 0.20 115.31 122.63 3k3e h LEU 235 Ca -0.02 0.02 -0.23 0.00 0.84 0.00 0.00 57.88 58.49 3k3e h LEU 235 Cb 0.18 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 3k3e h LEU 235 CO 0.02 0.07 -1.06 -0.09 -0.34 0.00 0.00 178.44 177.04 3k3e h ARG 236 N 0.17 0.08 -0.06 1.25 2.43 -1.34 -2.99 114.38 113.92 3k3e h ARG 236 Ca 0.42 -0.14 -0.04 0.00 -0.81 0.00 0.00 59.98 59.41 3k3e h ARG 236 Cb 1.39 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.99 3k3e h ARG 236 CO -0.08 1.06 -0.12 0.00 -1.51 0.00 0.00 179.97 179.32 3k3e h ARG 237 N 0.02 0.19 -0.54 0.20 3.08 0.31 -3.16 114.38 114.48 3k3e h ARG 237 Ca -0.05 -0.12 0.11 0.00 0.07 0.00 0.00 59.98 59.99 3k3e h ARG 237 Cb 1.82 0.01 -0.10 0.00 0.08 0.00 0.00 29.97 31.79 3k3e h ARG 237 CO 0.15 0.70 -0.06 2.35 -1.07 0.00 0.00 179.97 182.04 3k3e h TRP 238 N -0.30 -0.16 0.00 3.04 7.01 -0.84 0.71 115.95 125.42 3k3e h TRP 238 Ca 0.00 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.05 3k3e h TRP 238 Cb 0.69 0.15 0.00 0.00 -2.10 0.00 0.00 29.16 27.91 3k3e h TRP 238 CO 0.11 -0.18 0.00 -0.07 -2.79 0.00 0.00 178.44 175.51 3k3e h LEU 239 N 0.06 0.00 0.10 0.65 3.38 -1.58 0.16 115.31 118.08 3k3e h LEU 239 Ca 0.27 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.89 3k3e h LEU 239 Cb 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 3k3e h LEU 239 CO -0.51 0.00 -1.99 0.33 0.09 0.00 0.00 178.44 176.36 3k3e n PHE 240 N -2.39 1.14 0.03 1.13 7.35 0.20 -2.56 117.46 122.36 3k3e n PHE 240 Ca -0.00 0.26 -0.10 0.00 -0.76 0.00 0.00 57.45 56.85 3k3e n PHE 240 Cb 0.12 -1.16 -0.04 0.00 0.35 0.00 0.00 39.48 38.76 3k3e n PHE 240 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3k3e h VAL 242 N -0.23 0.27 -0.91 0.00 2.07 -0.87 -2.29 116.25 114.28 3k3e h VAL 242 Ca 0.07 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.77 3k3e h VAL 242 Cb 0.33 0.27 -0.07 0.00 -1.52 0.00 0.00 31.29 30.30 3k3e h VAL 242 CO -0.19 0.00 0.59 -0.74 0.02 0.00 0.00 177.57 177.25 3k3e h HIS 243 N -0.57 0.70 -0.24 1.57 6.17 -1.24 -1.36 115.15 120.18 3k3e h HIS 243 Ca 0.03 0.02 -0.03 0.00 0.71 0.00 0.00 60.37 61.10 3k3e h HIS 243 Cb 0.60 -0.22 -0.01 0.00 2.52 0.00 0.00 27.41 30.31 3k3e h HIS 243 CO -0.31 0.20 0.02 0.22 0.71 0.00 0.00 177.93 178.77 3k3e h ASP 244 N 0.54 0.39 0.04 3.26 3.58 -0.80 -3.02 116.42 120.41 3k3e h ASP 244 Ca 0.48 -0.28 0.00 0.00 0.42 0.00 0.00 57.03 57.65 3k3e h ASP 244 Cb 1.00 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 41.94 3k3e h ASP 244 CO -0.22 0.57 0.00 0.59 -2.88 0.00 0.00 179.24 177.30 3k3e n ASN 245 N -4.68 0.00 -4.88 2.28 3.02 -0.53 -4.68 115.26 105.79 3k3e n ASN 245 Ca -0.04 -0.20 -0.31 0.00 -0.03 0.00 0.00 54.58 54.00 3k3e n ASN 245 Cb 0.21 -0.06 -0.05 0.00 -0.61 0.00 0.00 39.78 39.27 3k3e n ASN 245 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3k3e s TYR 246 N -2.12 3.44 0.34 3.10 1.51 -1.14 -1.35 117.35 121.13 3k3e s TYR 246 Ca 0.13 0.79 0.07 0.00 -1.01 0.00 0.00 57.07 57.05 3k3e s TYR 246 Cb 0.06 -2.20 -0.01 0.00 -0.11 0.00 0.00 41.96 39.70 3k3e s TYR 246 CO 0.12 0.26 0.45 1.03 -1.11 0.00 0.00 175.55 176.29 3k3e s ARG 247 N -2.98 3.02 -1.44 -0.62 0.52 -1.26 -4.89 118.95 111.29 3k3e s ARG 247 Ca 0.46 -1.09 -0.11 0.00 -0.52 0.00 0.00 55.73 54.47 3k3e s ARG 247 Cb -0.11 -2.75 0.05 0.00 0.52 0.00 0.00 34.95 32.66 3k3e s ARG 247 CO 0.24 0.03 2.36 -1.71 0.02 0.00 0.00 175.30 176.24 3k3e n ASN 248 N -1.61 5.95 -4.92 0.23 2.85 -1.26 -4.37 115.26 112.13 3k3e n ASN 248 Ca 0.00 -2.88 -0.31 0.00 -0.11 0.00 0.00 54.58 51.28 3k3e n ASN 248 Cb 0.58 -1.55 -0.04 0.00 1.24 0.00 0.00 39.78 40.01 3k3e n ASN 248 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 3k3e s ASN 249 N 2.02 6.37 0.27 1.20 0.01 -1.26 -5.00 114.94 118.55 3k3e s ASN 249 Ca 0.52 0.31 -0.00 0.00 -0.71 0.00 0.00 52.86 52.98 3k3e s ASN 249 Cb 0.15 -1.98 0.49 0.00 0.41 0.00 0.00 41.25 40.32 3k3e s ASN 249 CO -0.06 0.18 1.85 1.55 -1.51 0.00 0.00 177.10 179.10 3k3e h PRO 250 N 3.18 1.02 0.00 -0.60 0.13 -1.93 -3.38 132.00 130.42 3k3e h PRO 250 Ca -0.46 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 3k3e h PRO 250 Cb 1.16 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.06 3k3e h PRO 250 CO 0.75 0.67 -0.42 0.34 -0.23 0.00 0.00 178.00 179.11 3k3e n PHE 251 N -4.58 0.00 -1.92 1.56 7.35 -1.23 -4.76 117.46 113.87 3k3e n PHE 251 Ca 0.17 0.00 -0.39 0.00 -0.76 0.00 0.00 57.45 56.47 3k3e n PHE 251 Cb 0.29 -0.21 -0.03 0.00 0.35 0.00 0.00 39.48 39.88 3k3e n PHE 251 CO 0.00 0.00 0.00 0.72 -0.76 0.00 0.00 176.76 176.72 3k3e n HIS 252 N -3.70 3.29 -4.32 -5.13 8.25 -1.26 -4.40 115.22 107.95 3k3e n HIS 252 Ca -0.06 -2.32 -0.16 0.00 -0.26 0.00 0.00 57.72 54.92 3k3e n HIS 252 Cb 0.22 -2.40 -0.04 0.00 1.12 0.00 0.00 29.99 28.89 3k3e n HIS 252 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 3k3e n ASN 253 N 8.98 1.42 0.28 0.41 0.23 -1.26 -4.31 115.26 121.01 3k3e n ASN 253 Ca 0.49 -2.29 0.11 0.00 -0.53 0.00 0.00 54.58 52.36 3k3e n ASN 253 Cb 0.43 0.54 0.78 0.00 -2.08 0.00 0.00 39.78 39.45 3k3e n ASN 253 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 3k3e h PHE 254 N 1.36 0.00 -0.22 -2.53 3.57 -1.89 -2.25 116.94 114.98 3k3e h PHE 254 Ca -0.20 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.21 3k3e h PHE 254 Cb 0.73 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.46 3k3e h PHE 254 CO 0.00 0.00 -0.22 -0.09 -2.23 0.00 0.00 178.31 175.77 3k3e h ARG 255 N 0.00 0.53 -0.61 1.11 2.43 -1.96 -0.91 114.38 114.97 3k3e h ARG 255 Ca -0.00 -0.28 0.10 0.00 -0.81 0.00 0.00 59.98 58.99 3k3e h ARG 255 Cb 0.01 0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.49 3k3e h ARG 255 CO 0.00 0.87 0.19 1.25 -1.51 0.00 0.00 179.97 180.77 3k3e h HIS 256 N 0.22 0.33 -0.47 2.20 2.76 -1.62 0.25 115.15 118.81 3k3e h HIS 256 Ca 0.03 0.03 0.09 0.00 -2.20 0.00 0.00 60.37 58.33 3k3e h HIS 256 Cb 0.77 -0.05 -0.08 0.00 1.55 0.00 0.00 27.41 29.60 3k3e h HIS 256 CO 0.08 0.05 -0.01 0.00 -1.30 0.00 0.00 177.93 176.74 3k3e h PHE 258 N 0.10 -0.57 -0.40 0.00 -0.00 0.82 -1.59 116.94 115.30 3k3e h PHE 258 Ca 0.23 0.01 0.07 0.00 -0.00 0.00 0.00 57.97 58.28 3k3e h PHE 258 Cb 0.35 0.23 -0.06 0.00 -0.00 0.00 0.00 35.95 36.46 3k3e h PHE 258 CO -0.31 -0.31 0.00 0.00 -0.00 0.00 0.00 178.31 177.69 3k3e h VAL 260 N 0.11 1.03 -0.09 0.00 2.07 -0.86 0.24 116.25 118.75 3k3e h VAL 260 Ca 0.20 -0.21 -0.17 0.00 0.82 0.00 0.00 66.70 67.34 3k3e h VAL 260 Cb 0.28 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3k3e h VAL 260 CO -0.33 0.11 -0.67 0.00 0.02 0.00 0.00 177.57 176.70 3k3e h ALA 261 N 1.25 0.67 -0.44 1.67 0.00 -0.66 -1.80 119.26 119.95 3k3e h ALA 261 Ca 0.22 -0.58 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 3k3e h ALA 261 Cb 0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3k3e h ALA 261 CO -0.11 0.75 -0.02 0.37 0.00 0.00 0.00 179.25 180.23 3k3e h GLN 262 N 0.27 0.79 -0.58 0.00 -0.00 0.18 -0.08 115.11 115.69 3k3e h GLN 262 Ca -0.02 -0.26 -0.06 0.00 -0.00 0.00 0.00 58.65 58.31 3k3e h GLN 262 Cb 1.23 -0.07 -0.02 0.00 0.00 0.00 0.00 27.48 28.62 3k3e h GLN 262 CO 0.11 0.87 0.13 1.98 0.00 0.00 0.00 178.83 181.93 3k3e h MET 263 N 0.63 0.93 -0.67 1.69 4.05 -0.48 0.58 114.93 121.67 3k3e h MET 263 Ca 0.12 -0.23 0.02 0.00 -0.28 0.00 0.00 59.70 59.34 3k3e h MET 263 Cb 0.52 -0.12 -0.04 0.00 -0.80 0.00 0.00 31.60 31.16 3k3e h MET 263 CO 0.03 0.87 0.42 1.98 0.23 0.00 0.00 176.91 180.44 3k3e h MET 264 N 0.84 0.81 -0.58 0.39 1.85 -1.12 -1.08 114.93 116.05 3k3e h MET 264 Ca 0.18 -0.05 -0.01 0.00 -0.61 0.00 0.00 59.70 59.21 3k3e h MET 264 Cb 0.36 -0.18 -0.03 0.00 0.43 0.00 0.00 31.60 32.18 3k3e h MET 264 CO 0.00 0.54 0.30 -0.92 -0.40 0.00 0.00 176.91 176.43 3k3e h TYR 265 N 0.84 0.80 -1.00 1.39 3.20 -0.50 -1.80 116.97 119.90 3k3e h TYR 265 Ca 0.26 -0.03 0.04 0.00 3.14 0.00 0.00 58.73 62.15 3k3e h TYR 265 Cb -0.01 -0.25 -0.06 0.00 1.54 0.00 0.00 36.73 37.94 3k3e h TYR 265 CO -0.04 0.59 0.65 0.77 -1.64 0.00 0.00 178.16 178.50 3k3e h SER 266 N 0.78 1.09 0.66 -2.11 0.02 -0.08 -2.32 113.55 111.59 3k3e h SER 266 Ca 0.20 -0.01 -0.10 0.00 -0.84 0.00 0.00 61.79 61.04 3k3e h SER 266 Cb 0.07 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 3k3e h SER 266 CO -0.03 0.74 -0.49 0.24 -1.14 0.00 0.00 176.83 176.14 3k3e h MET 267 N 1.26 0.00 -0.60 3.45 2.86 -0.72 0.11 114.93 121.28 3k3e h MET 267 Ca 0.40 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.98 3k3e h MET 267 Cb 0.02 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 3k3e h MET 267 CO -0.13 0.49 0.13 0.28 1.06 0.00 0.00 176.91 178.75 3k3e h VAL 268 N 0.00 1.24 0.03 -2.22 2.07 -0.77 -1.86 116.25 114.74 3k3e h VAL 268 Ca -0.00 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.61 3k3e h VAL 268 Cb 0.96 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 3k3e h VAL 268 CO 0.06 0.34 -0.01 -0.50 0.02 0.00 0.00 177.57 177.48 3k3e h TRP 269 N 0.91 -0.04 -0.17 1.57 -0.00 -1.33 -1.41 115.95 115.48 3k3e h TRP 269 Ca 0.19 -0.00 0.05 0.00 -0.00 0.00 0.00 58.89 59.13 3k3e h TRP 269 Cb 0.34 0.01 -0.07 0.00 -0.00 0.00 0.00 29.16 29.45 3k3e h TRP 269 CO 0.02 0.46 -0.30 1.25 -0.00 0.00 0.00 178.44 179.88 3k3e h LEU 270 N -0.98 -0.94 -0.81 -4.49 5.85 -0.82 -2.19 115.31 110.93 3k3e h LEU 270 Ca -0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.86 3k3e h LEU 270 Cb 0.52 0.41 0.00 0.00 0.37 0.00 0.00 40.66 41.96 3k3e h LEU 270 CO 0.01 -0.34 0.00 0.00 -0.34 0.00 0.00 178.44 177.77 3k3e n SER 272 N 0.01 -3.12 0.10 0.00 7.64 -0.83 -4.85 113.62 112.57 3k3e n SER 272 Ca 0.17 -0.98 0.10 0.00 1.01 0.00 0.00 58.87 59.18 3k3e n SER 272 Cb 0.28 -3.43 0.44 0.00 -1.01 0.00 0.00 64.21 60.50 3k3e n SER 272 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3k3e n LEU 273 N -4.25 0.49 0.00 -3.43 4.77 -0.58 -2.19 117.00 111.81 3k3e n LEU 273 Ca -0.19 0.63 0.13 0.00 -0.03 0.00 0.00 56.01 56.55 3k3e n LEU 273 Cb 0.64 -0.58 0.66 0.00 -2.33 0.00 0.00 43.42 41.81 3k3e n LEU 273 CO 0.70 -0.53 0.93 0.00 -1.33 0.00 0.00 177.39 177.15 3k3e n GLN 274 N -2.06 0.44 0.02 3.23 6.02 -1.26 0.02 117.38 123.79 3k3e n GLN 274 Ca 0.02 0.04 0.11 0.00 -0.01 0.00 0.00 57.00 57.16 3k3e n GLN 274 Cb 0.19 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.92 3k3e n GLN 274 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3k3e n GLU 275 N -1.24 0.28 -0.05 -1.09 1.02 -0.93 -4.48 120.64 114.15 3k3e n GLU 275 Ca 0.13 -0.03 -0.08 0.00 -0.02 0.00 0.00 57.16 57.17 3k3e n GLU 275 Cb 0.18 -1.56 -0.04 0.00 -0.02 0.00 0.00 31.44 30.00 3k3e n GLU 275 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3k3e n LYS 276 N -1.91 0.24 -3.94 3.49 4.76 -0.81 -5.05 118.16 114.94 3k3e n LYS 276 Ca 0.02 0.07 -0.28 0.00 -2.87 0.00 0.00 58.31 55.24 3k3e n LYS 276 Cb 0.43 -1.13 -0.03 0.00 -1.84 0.00 0.00 35.03 32.46 3k3e n LYS 276 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3k3e s PHE 277 N -2.20 3.49 0.72 2.13 0.08 0.10 -5.08 117.98 117.22 3k3e s PHE 277 Ca -0.14 0.16 -0.11 0.00 0.12 0.00 0.00 56.93 56.97 3k3e s PHE 277 Cb 0.04 -1.70 0.03 0.00 -0.57 0.00 0.00 43.02 40.82 3k3e s PHE 277 CO 0.22 0.54 1.10 -1.54 -0.10 0.00 0.00 175.22 175.44 3k3e s SER 278 N -2.95 5.24 0.53 1.36 1.04 -1.26 -4.58 113.70 113.08 3k3e s SER 278 Ca 0.35 1.01 0.28 0.00 0.48 0.00 0.00 55.95 58.07 3k3e s SER 278 Cb -0.12 -1.75 1.50 0.00 0.10 0.00 0.00 66.02 65.75 3k3e s SER 278 CO 0.28 -1.45 2.10 1.56 0.98 0.00 0.00 173.24 176.71 3k3e h GLN 279 N -0.71 0.00 0.82 4.02 1.08 -1.97 -1.82 115.11 116.53 3k3e h GLN 279 Ca -0.45 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 56.71 3k3e h GLN 279 Cb 1.27 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.71 3k3e h GLN 279 CO 0.64 0.10 -0.39 1.15 -0.95 0.00 0.00 178.83 179.38 3k3e h THR 280 N 0.00 0.00 -0.88 -0.54 2.02 -1.98 -0.29 112.91 111.23 3k3e h THR 280 Ca -0.00 -0.06 0.16 0.00 0.77 0.00 0.00 66.41 67.28 3k3e h THR 280 Cb 0.29 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.63 3k3e h THR 280 CO 0.01 0.00 0.57 0.44 0.37 0.00 0.00 175.52 176.92 3k3e h ASP 281 N -1.16 0.57 0.21 4.18 3.32 -1.81 0.96 116.42 122.69 3k3e h ASP 281 Ca -0.11 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 56.85 3k3e h ASP 281 Cb 0.84 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.31 3k3e h ASP 281 CO 0.18 0.27 -0.47 0.40 -1.72 0.00 0.00 179.24 177.90 3k3e h ILE 282 N 0.59 1.33 -0.33 0.35 1.08 -1.16 -0.15 117.51 119.22 3k3e h ILE 282 Ca 0.45 -1.68 -0.16 0.00 -0.39 0.00 0.00 64.86 63.09 3k3e h ILE 282 Cb 0.86 1.76 -0.01 0.00 -3.07 0.00 0.00 36.82 36.36 3k3e h ILE 282 CO -0.20 0.50 -0.42 0.25 -0.69 0.00 0.00 178.15 177.59 3k3e h LEU 283 N 0.25 0.91 0.37 1.44 5.85 0.96 -2.29 115.31 122.80 3k3e h LEU 283 Ca 0.01 -0.43 -0.02 0.00 0.84 0.00 0.00 57.88 58.29 3k3e h LEU 283 Cb 0.93 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3k3e h LEU 283 CO 0.08 1.21 -0.18 0.40 -0.34 0.00 0.00 178.44 179.61 3k3e h ILE 284 N 0.68 0.64 -0.79 4.05 2.04 -0.89 -0.61 117.51 122.63 3k3e h ILE 284 Ca 0.05 -0.28 0.12 0.00 1.00 0.00 0.00 64.86 65.74 3k3e h ILE 284 Cb 1.00 0.79 -0.08 0.00 -0.74 0.00 0.00 36.82 37.79 3k3e h ILE 284 CO 0.10 0.06 0.41 -0.07 0.00 0.00 0.00 178.15 178.64 3k3e h LEU 285 N -0.66 0.52 -0.05 1.44 3.38 -1.03 0.43 115.31 119.34 3k3e h LEU 285 Ca -0.05 0.07 -0.26 0.00 0.09 0.00 0.00 57.88 57.74 3k3e h LEU 285 Cb 0.47 -0.01 0.02 0.00 0.09 0.00 0.00 40.66 41.23 3k3e h LEU 285 CO 0.08 0.26 -0.99 0.24 0.09 0.00 0.00 178.44 178.12 3k3e h MET 286 N 0.64 0.68 -0.19 1.13 2.86 -1.36 -2.16 114.93 116.52 3k3e h MET 286 Ca 0.41 -0.70 -0.11 0.00 -2.06 0.00 0.00 59.70 57.24 3k3e h MET 286 Cb 0.49 0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.34 3k3e h MET 286 CO -0.31 1.29 -0.31 1.15 1.06 0.00 0.00 176.91 179.79 3k3e h THR 287 N 0.40 1.34 -0.29 2.22 2.02 -0.80 -2.52 112.91 115.27 3k3e h THR 287 Ca -0.11 -1.53 0.04 0.00 0.77 0.00 0.00 66.41 65.58 3k3e h THR 287 Cb 1.64 1.86 -0.04 0.00 -1.74 0.00 0.00 68.15 69.87 3k3e h THR 287 CO 0.19 0.47 0.07 0.00 0.37 0.00 0.00 175.52 176.62 3k3e h ALA 288 N 0.61 0.31 -0.82 6.16 0.00 -0.22 -1.49 119.26 123.80 3k3e h ALA 288 Ca 0.02 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.03 3k3e h ALA 288 Cb 0.89 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 3k3e h ALA 288 CO 0.07 -0.34 0.51 0.00 0.00 0.00 0.00 179.25 179.49 3k3e h ALA 289 N 1.21 1.11 -0.37 0.00 0.00 -1.33 0.10 119.26 119.98 3k3e h ALA 289 Ca 0.13 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3k3e h ALA 289 Cb 0.13 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3k3e h ALA 289 CO -0.17 0.27 -0.28 0.82 0.00 0.00 0.00 179.25 179.89 3k3e h ILE 290 N 0.95 1.28 0.00 0.00 2.04 -1.01 -3.28 117.51 117.47 3k3e h ILE 290 Ca 0.35 -1.42 -0.04 0.00 1.00 0.00 0.00 64.86 64.76 3k3e h ILE 290 Cb 0.13 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 3k3e h ILE 290 CO -0.16 0.47 -0.96 0.00 0.00 0.00 0.00 178.15 177.51 3k3e n HIS 292 N -2.79 0.00 -1.34 0.00 1.44 0.32 -1.28 115.22 111.57 3k3e n HIS 292 Ca -0.01 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.78 3k3e n HIS 292 Cb 0.61 -0.48 0.17 0.00 0.12 0.00 0.00 29.99 30.42 3k3e n HIS 292 CO 0.00 0.00 0.00 -0.25 -2.81 0.00 0.00 176.34 173.28 3k3e n ASP 293 N -3.87 2.02 -4.67 4.39 8.00 -1.26 -4.80 116.55 116.37 3k3e n ASP 293 Ca 0.43 -3.47 -0.52 0.00 0.71 0.00 0.00 54.79 51.94 3k3e n ASP 293 Cb 1.99 -0.48 -0.06 0.00 -0.02 0.00 0.00 41.12 42.56 3k3e n ASP 293 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3k3e n LEU 294 N -1.27 2.57 -2.61 0.64 4.77 -0.40 -2.05 117.00 118.65 3k3e n LEU 294 Ca 0.17 1.06 -0.21 0.00 -0.03 0.00 0.00 56.01 57.01 3k3e n LEU 294 Cb 0.67 -1.25 0.02 0.00 -2.33 0.00 0.00 43.42 40.52 3k3e n LEU 294 CO -0.01 -0.47 -0.10 -0.67 -1.33 0.00 0.00 177.39 174.80 3k3e n ASP 295 N 4.71 -5.81 -4.75 -1.43 2.03 -0.46 -4.33 116.55 106.51 3k3e n ASP 295 Ca 0.22 -0.17 -0.41 0.00 0.52 0.00 0.00 54.79 54.95 3k3e n ASP 295 Cb 0.21 -4.72 -0.02 0.00 -0.72 0.00 0.00 41.12 35.87 3k3e n ASP 295 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 3k3e s HIS 296 N -3.08 2.89 -0.88 -0.67 5.65 -0.87 -4.91 115.29 113.42 3k3e s HIS 296 Ca 0.17 1.01 0.26 0.00 0.25 0.00 0.00 55.06 56.75 3k3e s HIS 296 Cb -0.07 -3.90 0.65 0.00 -1.18 0.00 0.00 32.58 28.07 3k3e s HIS 296 CO 0.21 -2.89 1.53 -0.35 -0.65 0.00 0.00 174.74 172.59 3k3e n PRO 297 N 1.90 0.10 -0.22 2.88 -0.04 -1.26 -4.53 135.00 133.84 3k3e n PRO 297 Ca 0.06 0.04 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 3k3e n PRO 297 Cb 0.39 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 3k3e n PRO 297 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3k3e n GLY 298 N 1.44 0.82 2.86 0.55 0.00 -1.26 -5.05 105.19 104.56 3k3e n GLY 298 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 3k3e n GLY 298 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k3e s TYR 299 N -2.11 0.75 1.09 1.61 1.51 -1.26 -4.73 117.35 114.21 3k3e s TYR 299 Ca 0.00 -0.21 -0.17 0.00 -1.01 0.00 0.00 57.07 55.68 3k3e s TYR 299 Cb 0.00 -0.71 0.24 0.00 -0.11 0.00 0.00 41.96 41.38 3k3e s TYR 299 CO 0.00 -0.23 1.16 0.54 -1.11 0.00 0.00 175.55 175.90 3k3e s ASN 300 N 1.18 1.90 0.33 2.29 2.20 -1.26 -4.75 114.94 116.83 3k3e s ASN 300 Ca -0.07 0.66 0.07 0.00 -0.94 0.00 0.00 52.86 52.57 3k3e s ASN 300 Cb -0.14 -0.95 0.74 0.00 -2.00 0.00 0.00 41.25 38.90 3k3e s ASN 300 CO -0.01 -3.52 1.86 0.78 -2.94 0.00 0.00 177.10 173.26 3k3e h ASN 301 N -2.17 0.74 -0.76 3.54 2.35 -2.00 -0.79 115.58 116.49 3k3e h ASN 301 Ca -0.47 0.04 0.02 0.00 -0.55 0.00 0.00 56.30 55.35 3k3e h ASN 301 Cb 1.29 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 39.52 3k3e h ASN 301 CO 0.41 0.38 0.49 0.74 -1.65 0.00 0.00 177.43 177.80 3k3e h THR 302 N 0.78 1.15 -0.20 2.81 2.02 -1.99 0.27 112.91 117.75 3k3e h THR 302 Ca 0.47 -0.34 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 3k3e h THR 302 Cb 0.66 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.14 3k3e h THR 302 CO -0.23 0.18 0.08 0.22 0.37 0.00 0.00 175.52 176.14 3k3e h TYR 303 N 0.98 0.31 -0.11 3.16 3.20 -1.51 0.52 116.97 123.52 3k3e h TYR 303 Ca 0.29 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.18 3k3e h TYR 303 Cb -0.05 -0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.08 3k3e h TYR 303 CO -0.03 0.36 -0.20 1.96 -1.64 0.00 0.00 178.16 178.61 3k3e h GLN 304 N 0.17 -0.26 0.54 1.82 1.08 -0.61 0.16 115.11 118.01 3k3e h GLN 304 Ca 0.07 0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.26 3k3e h GLN 304 Cb 0.18 0.06 0.01 0.00 -0.05 0.00 0.00 27.48 27.67 3k3e h GLN 304 CO -0.01 -0.17 -0.26 0.82 -0.95 0.00 0.00 178.83 178.26 3k3e h ILE 305 N -0.27 0.46 -0.71 2.54 2.04 -0.37 0.71 117.51 121.92 3k3e h ILE 305 Ca 0.09 -0.09 0.03 0.00 1.00 0.00 0.00 64.86 65.89 3k3e h ILE 305 Cb 0.40 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 3k3e h ILE 305 CO -0.26 0.01 0.47 0.78 0.00 0.00 0.00 178.15 179.15 3k3e h ASN 306 N -0.78 0.75 0.27 1.72 2.35 -0.76 -1.54 115.58 117.58 3k3e h ASN 306 Ca -0.07 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.66 3k3e h ASN 306 Cb 0.58 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 38.78 3k3e h ASN 306 CO 0.12 0.52 -0.14 0.00 -1.65 0.00 0.00 177.43 176.28 3k3e n ALA 307 N -2.44 2.84 -3.72 -0.83 0.00 0.54 -4.95 120.51 111.96 3k3e n ALA 307 Ca 0.09 -0.33 -0.22 0.00 0.00 0.00 0.00 53.44 52.98 3k3e n ALA 307 Cb 0.11 -1.26 0.03 0.00 0.00 0.00 0.00 19.45 18.33 3k3e n ALA 307 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3k3e n ARG 308 N -0.74 -4.81 -1.18 0.00 1.74 0.18 -4.97 116.66 106.88 3k3e n ARG 308 Ca 0.14 0.60 -0.29 0.00 -0.77 0.00 0.00 57.85 57.54 3k3e n ARG 308 Cb 0.30 -5.14 0.20 0.00 -1.02 0.00 0.00 32.46 26.80 3k3e n ARG 308 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3k3e s THR 309 N -3.68 1.87 0.24 0.55 -4.23 -0.82 -4.70 115.64 104.86 3k3e s THR 309 Ca 0.02 0.00 -0.07 0.00 -1.18 0.00 0.00 61.69 60.46 3k3e s THR 309 Cb -0.01 -2.52 0.23 0.00 1.34 0.00 0.00 72.50 71.54 3k3e s THR 309 CO 0.82 0.00 1.91 -0.33 -0.54 0.00 0.00 174.62 176.48 3k3e h GLU 310 N -2.12 1.23 -0.21 3.99 5.08 -1.93 0.20 114.58 120.82 3k3e h GLU 310 Ca -0.51 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 57.77 3k3e h GLU 310 Cb 1.32 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 3k3e h GLU 310 CO 0.50 0.81 0.12 -0.07 -1.00 0.00 0.00 179.01 179.37 3k3e h LEU 311 N 1.26 0.27 -0.16 1.33 3.38 -1.94 0.57 115.31 120.02 3k3e h LEU 311 Ca 0.35 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.23 3k3e h LEU 311 Cb -0.12 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3k3e h LEU 311 CO -0.08 0.28 0.09 0.00 0.09 0.00 0.00 178.44 178.83 3k3e h ALA 312 N 1.00 0.21 -0.45 1.53 0.00 -1.68 0.70 119.26 120.58 3k3e h ALA 312 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3k3e h ALA 312 Cb 0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3k3e h ALA 312 CO -0.01 -0.27 0.29 0.28 0.00 0.00 0.00 179.25 179.54 3k3e h VAL 313 N 0.18 1.12 -0.78 0.00 2.07 -0.37 0.08 116.25 118.55 3k3e h VAL 313 Ca 0.06 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.34 3k3e h VAL 313 Cb 0.05 0.46 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 3k3e h VAL 313 CO -0.01 0.11 0.38 -0.09 0.02 0.00 0.00 177.57 177.98 3k3e h ARG 314 N 0.60 1.13 -0.54 1.57 2.43 0.47 -3.07 114.38 116.97 3k3e h ARG 314 Ca 0.16 -0.16 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3k3e h ARG 314 Cb -0.07 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.28 3k3e h ARG 314 CO -0.04 0.87 0.00 0.66 -1.51 0.00 0.00 179.97 179.96 3k3e n TYR 315 N -4.37 0.72 -3.74 2.20 4.01 0.21 -4.97 117.16 111.22 3k3e n TYR 315 Ca 0.07 -0.36 -0.24 0.00 -0.16 0.00 0.00 57.90 57.21 3k3e n TYR 315 Cb 0.13 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.20 3k3e n TYR 315 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3k3e n ASN 316 N 1.49 -3.01 0.00 7.72 3.02 -0.06 -1.75 115.26 122.68 3k3e n ASN 316 Ca 0.21 -0.76 0.00 0.00 -0.03 0.00 0.00 54.58 54.01 3k3e n ASN 316 Cb 0.59 -4.20 0.00 0.00 -0.61 0.00 0.00 39.78 35.56 3k3e n ASN 316 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3k3e n ASP 317 N -2.99 -1.84 -4.53 6.41 8.00 -0.76 -4.93 116.55 115.91 3k3e n ASP 317 Ca -0.15 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 54.92 3k3e n ASP 317 Cb 0.61 -2.76 -0.06 0.00 -0.02 0.00 0.00 41.12 38.90 3k3e n ASP 317 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k3e s ILE 318 N -1.05 4.76 -0.79 0.53 1.01 -0.72 -4.50 121.20 120.44 3k3e s ILE 318 Ca 0.00 0.29 -0.08 0.00 0.00 0.00 0.00 60.65 60.86 3k3e s ILE 318 Cb 0.00 -4.24 0.01 0.00 0.01 0.00 0.00 42.46 38.24 3k3e s ILE 318 CO 0.00 -0.62 0.16 -1.20 0.00 0.00 0.00 174.94 173.28 3k3e n SER 319 N 6.43 -0.64 -0.23 3.58 7.64 -1.26 -4.80 113.62 124.35 3k3e n SER 319 Ca 0.00 -0.73 0.03 0.00 1.01 0.00 0.00 58.87 59.18 3k3e n SER 319 Cb 0.48 -0.89 0.15 0.00 -1.01 0.00 0.00 64.21 62.94 3k3e n SER 319 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3k3e h PRO 320 N -0.39 0.33 0.46 1.43 0.13 -1.87 -0.80 132.00 131.29 3k3e h PRO 320 Ca -0.38 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.70 3k3e h PRO 320 Cb 0.79 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 31.85 3k3e h PRO 320 CO 0.35 0.22 -0.22 -0.07 -0.23 0.00 0.00 178.00 178.05 3k3e h LEU 321 N 0.34 -0.52 -0.73 1.56 3.38 -1.92 -2.20 115.31 115.22 3k3e h LEU 321 Ca 0.36 -0.09 0.10 0.00 0.09 0.00 0.00 57.88 58.34 3k3e h LEU 321 Cb 0.55 0.14 -0.07 0.00 0.09 0.00 0.00 40.66 41.36 3k3e h LEU 321 CO -0.41 -0.17 0.36 -0.33 0.09 0.00 0.00 178.44 177.99 3k3e h GLU 322 N -0.92 0.59 -0.81 1.13 3.07 -1.89 0.11 114.58 115.86 3k3e h GLU 322 Ca -0.06 -0.04 0.04 0.00 -0.50 0.00 0.00 59.36 58.80 3k3e h GLU 322 Cb 0.58 -0.13 -0.05 0.00 -0.84 0.00 0.00 28.75 28.31 3k3e h GLU 322 CO 0.10 0.39 0.52 -0.91 -1.40 0.00 0.00 179.01 177.71 3k3e h ASN 323 N 0.61 0.85 -0.52 1.42 2.35 -1.16 -1.54 115.58 117.59 3k3e h ASN 323 Ca 0.36 -0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.99 3k3e h ASN 323 Cb 0.39 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 3k3e h ASN 323 CO -0.28 0.58 -0.14 -0.74 -1.65 0.00 0.00 177.43 175.21 3k3e h HIS 324 N 1.00 1.14 0.61 1.19 2.76 -0.54 -2.18 115.15 119.12 3k3e h HIS 324 Ca 0.33 -0.25 -0.03 0.00 -2.20 0.00 0.00 60.37 58.22 3k3e h HIS 324 Cb 0.03 -0.28 0.00 0.00 1.55 0.00 0.00 27.41 28.72 3k3e h HIS 324 CO -0.03 1.07 -0.31 0.45 -1.30 0.00 0.00 177.93 177.82 3k3e h HIS 325 N 0.88 -0.80 -0.15 5.26 3.86 -0.27 0.52 115.15 124.46 3k3e h HIS 325 Ca 0.13 -0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.37 3k3e h HIS 325 Cb 0.71 0.27 -0.01 0.00 1.06 0.00 0.00 27.41 29.44 3k3e h HIS 325 CO 0.05 -0.49 0.18 0.00 0.86 0.00 0.00 177.93 178.53 3k3e h ALA 327 N 1.78 -0.10 0.00 0.00 0.00 -0.70 -2.91 119.26 117.33 3k3e h ALA 327 Ca 0.07 -0.72 -0.04 0.00 0.00 0.00 0.00 54.91 54.22 3k3e h ALA 327 Cb 0.43 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3k3e h ALA 327 CO -0.00 0.43 -0.20 0.28 0.00 0.00 0.00 179.25 179.76 3k3e h VAL 328 N -0.27 0.64 0.02 0.00 2.07 0.08 -1.25 116.25 117.54 3k3e h VAL 328 Ca -0.16 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.48 3k3e h VAL 328 Cb 1.72 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 3k3e h VAL 328 CO 0.17 0.19 -0.01 0.00 0.02 0.00 0.00 177.57 177.94 3k3e h ALA 329 N 1.80 -0.03 0.00 1.67 0.00 -0.86 -2.73 119.26 119.11 3k3e h ALA 329 Ca -0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3k3e h ALA 329 Cb 0.55 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3k3e h ALA 329 CO 0.03 -0.36 0.00 1.19 0.00 0.00 0.00 179.25 180.10 3k3e n PHE 330 N -4.96 0.28 -0.03 0.00 3.72 -1.08 -2.38 117.46 113.02 3k3e n PHE 330 Ca -0.08 0.09 -0.16 0.00 -0.05 0.00 0.00 57.45 57.25 3k3e n PHE 330 Cb 0.18 -0.65 -0.06 0.00 -0.94 0.00 0.00 39.48 38.01 3k3e n PHE 330 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 3k3e h GLN 331 N 0.00 0.79 -0.30 -1.08 4.20 -1.03 -2.29 115.11 115.41 3k3e h GLN 331 Ca 0.00 -0.62 -0.15 0.00 0.06 0.00 0.00 58.65 57.94 3k3e h GLN 331 Cb 0.47 0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 3k3e h GLN 331 CO 0.00 1.23 -0.40 0.82 -0.67 0.00 0.00 178.83 179.81 3k3e h ILE 332 N 0.55 1.29 0.00 2.54 2.04 -1.19 -2.40 117.51 120.34 3k3e h ILE 332 Ca -0.04 -1.59 0.00 0.00 1.00 0.00 0.00 64.86 64.23 3k3e h ILE 332 Cb 1.36 1.60 0.00 0.00 -0.74 0.00 0.00 36.82 39.04 3k3e h ILE 332 CO 0.15 0.51 0.00 0.18 0.00 0.00 0.00 178.15 179.00 3k3e n LEU 333 N -4.14 0.00 0.11 1.44 4.77 -1.00 -2.41 117.00 115.77 3k3e n LEU 333 Ca -0.04 0.21 -0.23 0.00 -0.03 0.00 0.00 56.01 55.92 3k3e n LEU 333 Cb 0.54 -0.21 -0.15 0.00 -2.33 0.00 0.00 43.42 41.27 3k3e n LEU 333 CO 0.47 -0.08 -0.20 0.00 -1.33 0.00 0.00 177.39 176.25 3k3e h ALA 334 N 2.96 -0.11 -2.81 -1.18 0.00 -0.88 -3.39 119.26 113.86 3k3e h ALA 334 Ca 0.00 -0.85 -0.56 0.00 0.00 0.00 0.00 54.91 53.49 3k3e h ALA 334 Cb 0.13 0.20 0.14 0.00 0.00 0.00 0.00 17.79 18.26 3k3e h ALA 334 CO 0.00 0.64 0.36 0.39 0.00 0.00 0.00 179.25 180.65 3k3e n GLU 335 N -3.82 1.44 0.22 0.00 -0.58 -1.01 -4.87 120.64 112.02 3k3e n GLU 335 Ca -0.17 0.53 0.11 0.00 -0.42 0.00 0.00 57.16 57.21 3k3e n GLU 335 Cb 1.02 -2.33 0.38 0.00 -0.57 0.00 0.00 31.44 29.94 3k3e n GLU 335 CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 3k3e h PRO 336 N 1.28 0.00 0.00 3.49 0.13 -1.88 -2.89 132.00 132.14 3k3e h PRO 336 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 3k3e h PRO 336 Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 3k3e h PRO 336 CO 0.56 0.16 -0.40 -0.85 -0.23 0.00 0.00 178.00 177.24 3k3e n GLU 337 N -3.23 0.15 0.00 0.86 0.28 -1.26 -3.88 120.64 113.56 3k3e n GLU 337 Ca 0.01 0.06 0.03 0.00 -0.16 0.00 0.00 57.16 57.10 3k3e n GLU 337 Cb 0.47 -1.61 -0.03 0.00 1.43 0.00 0.00 31.44 31.70 3k3e n GLU 337 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3k3e n ASN 339 N -1.09 1.37 0.00 0.00 5.15 -1.09 -4.55 115.26 115.05 3k3e n ASN 339 Ca 0.01 -2.52 0.00 0.00 -0.60 0.00 0.00 54.58 51.47 3k3e n ASN 339 Cb 0.10 -1.10 0.02 0.00 -0.53 0.00 0.00 39.78 38.27 3k3e n ASN 339 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 3k3e n ILE 340 N 7.79 0.00 0.24 -1.44 -5.35 -1.26 -0.77 119.36 118.57 3k3e n ILE 340 Ca 0.45 0.00 0.03 0.00 -0.27 0.00 0.00 62.75 62.96 3k3e n ILE 340 Cb 0.44 -0.56 0.03 0.00 -1.74 0.00 0.00 39.64 37.81 3k3e n ILE 340 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 3k3e n PHE 341 N -0.60 0.01 -0.38 4.28 3.72 -1.26 -4.73 117.46 118.48 3k3e n PHE 341 Ca 0.00 -0.01 0.33 0.00 -0.05 0.00 0.00 57.45 57.73 3k3e n PHE 341 Cb 0.00 -0.00 0.60 0.00 -0.94 0.00 0.00 39.48 39.14 3k3e n PHE 341 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3k3e h SER 342 N 1.16 0.32 -0.57 4.37 4.64 -1.34 -0.41 113.55 121.72 3k3e h SER 342 Ca 0.00 0.19 -0.35 0.00 -0.47 0.00 0.00 61.79 61.16 3k3e h SER 342 Cb 0.26 0.18 -0.17 0.00 -0.31 0.00 0.00 62.40 62.36 3k3e h SER 342 CO 0.00 -0.27 0.45 0.59 -0.87 0.00 0.00 176.83 176.73 3k3e n ASN 343 N -4.96 5.24 -4.23 4.97 3.02 -1.26 -4.88 115.26 113.16 3k3e n ASN 343 Ca 0.37 -3.08 -0.31 0.00 -0.03 0.00 0.00 54.58 51.54 3k3e n ASN 343 Cb 1.31 -0.89 -0.17 0.00 -0.61 0.00 0.00 39.78 39.43 3k3e n ASN 343 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3k3e s ILE 344 N -2.38 1.93 0.86 2.41 1.01 -0.17 -4.80 121.20 120.07 3k3e s ILE 344 Ca 0.35 -0.98 -0.14 0.00 0.00 0.00 0.00 60.65 59.88 3k3e s ILE 344 Cb 0.28 -1.65 0.02 0.00 0.01 0.00 0.00 42.46 41.12 3k3e s ILE 344 CO 0.02 0.54 0.55 -0.81 0.00 0.00 0.00 174.94 175.25 3k3e n PRO 345 N 3.17 -0.04 -0.00 2.79 -0.04 -1.26 -4.62 135.00 134.99 3k3e n PRO 345 Ca -0.18 0.04 -0.10 0.00 -0.04 0.00 0.00 63.50 63.21 3k3e n PRO 345 Cb 0.52 -1.93 -0.04 0.00 -0.04 0.00 0.00 33.50 32.02 3k3e n PRO 345 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 3k3e h PRO 346 N -1.10 -0.37 -0.87 0.54 0.13 -1.99 -0.35 132.00 128.00 3k3e h PRO 346 Ca -0.44 0.03 0.23 0.00 -0.87 0.00 0.00 66.00 64.94 3k3e h PRO 346 Cb 1.31 0.08 -0.05 0.00 0.13 0.00 0.00 31.00 32.47 3k3e h PRO 346 CO 0.38 -0.25 0.60 -0.44 -0.23 0.00 0.00 178.00 178.07 3k3e h ASP 347 N -0.38 0.16 0.12 1.44 3.45 -2.01 -1.99 116.42 117.21 3k3e h ASP 347 Ca 0.10 0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.57 3k3e h ASP 347 Cb 0.54 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 39.30 3k3e h ASP 347 CO -0.36 0.06 -0.06 1.23 -1.57 0.00 0.00 179.24 178.54 3k3e h GLY 348 N 0.16 -0.17 1.02 2.75 0.00 -1.40 -3.07 103.07 102.35 3k3e h GLY 348 Ca 0.43 0.06 0.10 0.00 0.00 0.00 0.00 47.33 47.92 3k3e h GLY 348 CO -0.07 -0.06 0.41 -2.75 0.00 0.00 0.00 176.54 174.06 3k3e h PHE 349 N -0.74 0.43 0.73 5.60 3.57 -0.70 -1.81 116.94 124.01 3k3e h PHE 349 Ca -0.02 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.46 3k3e h PHE 349 Cb 0.54 -0.14 0.01 0.00 2.79 0.00 0.00 35.95 39.15 3k3e h PHE 349 CO 0.09 0.20 -0.35 0.87 -2.23 0.00 0.00 178.31 176.89 3k3e h LYS 350 N 0.40 -0.94 -0.56 1.11 1.57 -1.41 -1.66 116.57 115.08 3k3e h LYS 350 Ca 0.28 0.06 0.10 0.00 -1.87 0.00 0.00 60.65 59.23 3k3e h LYS 350 Cb 0.57 0.21 -0.03 0.00 0.08 0.00 0.00 32.23 33.06 3k3e h LYS 350 CO -0.08 -0.60 0.38 0.37 -0.57 0.00 0.00 179.45 178.95 3k3e h GLN 351 N -1.10 0.32 0.35 3.15 4.15 -1.34 -1.84 115.11 118.80 3k3e h GLN 351 Ca -0.10 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.28 3k3e h GLN 351 Cb 0.77 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.39 3k3e h GLN 351 CO 0.16 0.21 -0.17 0.82 -1.93 0.00 0.00 178.83 177.92 3k3e h ILE 352 N 0.33 0.51 -0.45 2.39 2.04 -1.21 -2.69 117.51 118.44 3k3e h ILE 352 Ca 0.26 -0.67 0.09 0.00 1.00 0.00 0.00 64.86 65.54 3k3e h ILE 352 Cb 0.59 0.78 -0.09 0.00 -0.74 0.00 0.00 36.82 37.37 3k3e h ILE 352 CO -0.06 0.10 -0.14 -0.09 0.00 0.00 0.00 178.15 177.96 3k3e h ARG 353 N -0.92 -0.03 -0.67 2.37 2.43 -0.98 0.11 114.38 116.68 3k3e h ARG 353 Ca -0.05 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.17 3k3e h ARG 353 Cb 0.53 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.04 3k3e h ARG 353 CO 0.08 -0.02 0.39 0.37 -1.51 0.00 0.00 179.97 179.28 3k3e h GLN 354 N -0.03 0.72 0.12 0.20 4.15 -1.43 -0.03 115.11 118.81 3k3e h GLN 354 Ca 0.22 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.59 3k3e h GLN 354 Cb 0.36 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.89 3k3e h GLN 354 CO -0.48 0.47 -0.06 0.78 -1.93 0.00 0.00 178.83 177.62 3k3e h GLY 355 N 0.74 -0.17 0.98 2.39 0.00 -0.82 -1.17 103.07 105.02 3k3e h GLY 355 Ca 0.29 0.06 0.04 0.00 0.00 0.00 0.00 47.33 47.72 3k3e h GLY 355 CO -0.16 -0.06 0.60 -0.33 0.00 0.00 0.00 176.54 176.59 3k3e h MET 356 N -0.17 1.11 -0.15 4.80 2.86 -0.37 -0.40 114.93 122.60 3k3e h MET 356 Ca -0.02 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 3k3e h MET 356 Cb 0.13 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 3k3e h MET 356 CO 0.03 0.73 0.04 0.82 1.06 0.00 0.00 176.91 179.59 3k3e h ILE 357 N 1.14 1.19 -0.13 -1.22 2.04 -0.78 -0.80 117.51 118.95 3k3e h ILE 357 Ca 0.36 -0.58 0.04 0.00 1.00 0.00 0.00 64.86 65.68 3k3e h ILE 357 Cb 0.02 1.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 3k3e h ILE 357 CO -0.11 0.17 -0.10 0.74 0.00 0.00 0.00 178.15 178.85 3k3e h THR 358 N 0.05 0.70 0.30 -0.27 2.02 -0.63 -0.48 112.91 114.61 3k3e h THR 358 Ca 0.05 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 3k3e h THR 358 Cb 0.23 0.70 0.00 0.00 -1.74 0.00 0.00 68.15 67.34 3k3e h THR 358 CO -0.00 0.00 -0.14 -0.07 0.37 0.00 0.00 175.52 175.68 3k3e h LEU 359 N -0.11 -0.34 -0.82 2.58 3.38 -0.95 -1.93 115.31 117.12 3k3e h LEU 359 Ca 0.09 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.02 3k3e h LEU 359 Cb 0.24 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 3k3e h LEU 359 CO -0.20 -0.14 0.52 0.40 0.09 0.00 0.00 178.44 179.11 3k3e h ILE 360 N -0.52 1.11 0.00 1.22 2.04 -1.09 -0.47 117.51 119.79 3k3e h ILE 360 Ca -0.04 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.48 3k3e h ILE 360 Cb 0.39 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 3k3e h ILE 360 CO 0.07 0.18 0.00 -0.07 0.00 0.00 0.00 178.15 178.33 3k3e h LEU 361 N 1.00 0.00 -0.31 1.44 3.38 -1.00 -2.56 115.31 117.26 3k3e h LEU 361 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 3k3e h LEU 361 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3k3e h LEU 361 CO -0.13 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.38 3k3e n ALA 362 N -2.01 2.67 1.17 1.53 0.00 -0.19 -3.38 120.51 120.29 3k3e n ALA 362 Ca 0.00 -0.28 0.13 0.00 0.00 0.00 0.00 53.44 53.30 3k3e n ALA 362 Cb 0.25 -1.38 0.45 0.00 0.00 0.00 0.00 19.45 18.77 3k3e n ALA 362 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3k3e n THR 363 N -0.70 0.00 -2.21 0.00 -2.24 -0.96 -4.76 114.28 103.41 3k3e n THR 363 Ca 0.20 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.52 3k3e n THR 363 Cb 0.22 0.04 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 3k3e n THR 363 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3k3e s ASP 364 N -2.74 5.98 0.64 3.42 -1.08 -1.22 -4.85 116.67 116.82 3k3e s ASP 364 Ca 0.20 0.75 0.26 0.00 -0.52 0.00 0.00 52.55 53.23 3k3e s ASP 364 Cb 0.19 -2.54 1.33 0.00 -1.46 0.00 0.00 42.92 40.45 3k3e s ASP 364 CO 0.57 -1.74 1.76 0.24 0.52 0.00 0.00 175.17 176.51 3k3e h MET 365 N 12.12 0.00 -0.02 4.34 2.86 -1.93 0.16 114.93 132.46 3k3e h MET 365 Ca -0.29 0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.36 3k3e h MET 365 Cb 1.13 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.79 3k3e h MET 365 CO 1.11 0.00 0.04 0.00 1.06 0.00 0.00 176.91 179.12 3k3e h ALA 366 N 1.15 1.34 -0.30 6.32 0.00 -1.97 -1.13 119.26 124.68 3k3e h ALA 366 Ca 0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3k3e h ALA 366 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.93 3k3e h ALA 366 CO -0.00 -0.05 0.00 0.54 0.00 0.00 0.00 179.25 179.74 3k3e n ARG 367 N -3.49 2.34 -0.06 0.00 1.74 0.54 -4.69 116.66 113.03 3k3e n ARG 367 Ca -0.02 -2.13 -0.12 0.00 -0.77 0.00 0.00 57.85 54.81 3k3e n ARG 367 Cb 0.12 -1.47 -0.06 0.00 -1.02 0.00 0.00 32.46 30.03 3k3e n ARG 367 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3k3e h HIS 368 N 4.17 -1.30 -0.63 -1.55 2.76 -1.31 -0.77 115.15 116.52 3k3e h HIS 368 Ca 0.00 0.06 0.04 0.00 -2.20 0.00 0.00 60.37 58.27 3k3e h HIS 368 Cb 0.93 0.61 -0.05 0.00 1.55 0.00 0.00 27.41 30.45 3k3e h HIS 368 CO 0.19 -0.47 0.36 0.00 -1.30 0.00 0.00 177.93 176.71 3k3e h ALA 369 N 0.18 0.83 0.19 5.26 0.00 -1.84 0.12 119.26 124.01 3k3e h ALA 369 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3k3e h ALA 369 Cb 0.61 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3k3e h ALA 369 CO -0.49 0.07 -0.17 1.49 0.00 0.00 0.00 179.25 180.15 3k3e h GLU 370 N 0.70 -0.37 -0.56 0.00 4.81 -1.81 -0.76 114.58 116.58 3k3e h GLU 370 Ca 0.27 0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.48 3k3e h GLU 370 Cb 0.10 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3k3e h GLU 370 CO -0.14 -0.25 0.18 0.82 -0.73 0.00 0.00 179.01 178.90 3k3e h ILE 371 N -0.38 1.24 -0.14 2.32 2.04 -0.86 -1.99 117.51 119.74 3k3e h ILE 371 Ca -0.00 -0.79 -0.02 0.00 1.00 0.00 0.00 64.86 65.05 3k3e h ILE 371 Cb 0.35 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 3k3e h ILE 371 CO -0.03 0.30 -0.01 0.24 0.00 0.00 0.00 178.15 178.65 3k3e h MET 372 N 0.79 0.20 0.08 2.37 2.86 -0.59 -1.79 114.93 118.85 3k3e h MET 372 Ca 0.18 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.79 3k3e h MET 372 Cb 0.27 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 31.89 3k3e h MET 372 CO -0.01 0.23 -0.04 -0.44 1.06 0.00 0.00 176.91 177.71 3k3e h ASP 373 N 0.20 -0.09 -0.91 1.22 3.32 -0.65 -0.79 116.42 118.72 3k3e h ASP 373 Ca 0.05 -0.45 0.14 0.00 0.02 0.00 0.00 57.03 56.79 3k3e h ASP 373 Cb 0.15 0.02 -0.07 0.00 0.22 0.00 0.00 39.33 39.65 3k3e h ASP 373 CO 0.00 0.44 0.58 0.28 -1.72 0.00 0.00 179.24 178.82 3k3e h SER 374 N -0.66 0.69 0.15 6.45 0.02 -1.20 -1.34 113.55 117.66 3k3e h SER 374 Ca -0.01 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 3k3e h SER 374 Cb 0.54 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.99 3k3e h SER 374 CO 0.02 0.35 -0.07 0.15 -1.14 0.00 0.00 176.83 176.14 3k3e h PHE 375 N 0.74 -0.19 -0.06 3.45 3.57 -1.29 -2.31 116.94 120.84 3k3e h PHE 375 Ca 0.46 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.97 3k3e h PHE 375 Cb 0.69 0.06 -0.00 0.00 2.79 0.00 0.00 35.95 39.49 3k3e h PHE 375 CO -0.00 0.24 0.21 0.87 -2.23 0.00 0.00 178.31 177.40 3k3e h LYS 376 N -0.74 0.00 0.06 1.11 1.57 -0.63 0.18 116.57 118.11 3k3e h LYS 376 Ca -0.02 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3k3e h LYS 376 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3k3e h LYS 376 CO 0.03 0.00 -0.03 1.49 -0.57 0.00 0.00 179.45 180.38 3k3e h GLU 377 N 0.00 -0.08 -0.74 3.15 4.81 -1.17 -3.16 114.58 117.39 3k3e h GLU 377 Ca 0.03 0.01 0.22 0.00 -0.13 0.00 0.00 59.36 59.48 3k3e h GLU 377 Cb 0.45 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 3k3e h GLU 377 CO -0.00 -0.05 0.66 0.87 -0.73 0.00 0.00 179.01 179.76 3k3e h LYS 378 N -0.48 0.00 0.00 1.92 1.79 -0.94 0.50 116.57 119.36 3k3e h LYS 378 Ca -0.01 0.00 -0.04 0.00 -2.18 0.00 0.00 60.65 58.43 3k3e h LYS 378 Cb 0.06 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 3k3e h LYS 378 CO 0.01 0.00 -0.17 1.98 -1.08 0.00 0.00 179.45 180.19 3k3e h MET 379 N 0.00 0.00 0.00 3.15 4.05 -0.70 -1.22 114.93 120.21 3k3e h MET 379 Ca 0.35 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.77 3k3e h MET 379 Cb 1.66 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.46 3k3e h MET 379 CO -0.00 0.17 0.00 0.93 0.23 0.00 0.00 176.91 178.24 3k3e h GLU 380 N 0.00 0.00 0.00 0.39 5.08 0.05 -3.22 114.58 116.88 3k3e h GLU 380 Ca -0.00 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.16 3k3e h GLU 380 Cb 0.51 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.62 3k3e h GLU 380 CO 0.02 0.00 -0.31 -1.71 -1.00 0.00 0.00 179.01 176.02 3k3e n ASN 381 N -2.34 -2.08 -4.26 1.42 2.85 -0.96 -5.15 115.26 104.73 3k3e n ASN 381 Ca -0.01 -3.16 -0.34 0.00 -0.11 0.00 0.00 54.58 50.96 3k3e n ASN 381 Cb 0.09 1.70 0.12 0.00 1.24 0.00 0.00 39.78 42.92 3k3e n ASN 381 CO 0.00 0.00 0.00 0.33 -2.11 0.00 0.00 177.26 175.48 3k3e n PHE 382 N 0.52 -2.00 -3.12 1.20 7.35 -0.50 -4.99 117.46 115.92 3k3e n PHE 382 Ca 0.03 0.21 0.01 0.00 -0.76 0.00 0.00 57.45 56.94 3k3e n PHE 382 Cb 0.71 -1.61 -0.01 0.00 0.35 0.00 0.00 39.48 38.92 3k3e n PHE 382 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 3k3e s ASP 383 N -1.69 -1.32 0.00 -2.13 3.68 -1.26 -5.00 116.67 108.95 3k3e s ASP 383 Ca 0.52 -0.69 0.00 0.00 2.13 0.00 0.00 52.55 54.51 3k3e s ASP 383 Cb -0.14 1.69 0.00 0.00 -1.45 0.00 0.00 42.92 43.02 3k3e s ASP 383 CO 0.69 -0.14 0.26 -1.22 0.13 0.00 0.00 175.17 174.89 3k3e n TYR 384 N 4.26 0.00 -0.11 -5.34 4.02 -1.26 -0.64 117.16 118.08 3k3e n TYR 384 Ca 0.10 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.76 3k3e n TYR 384 Cb 0.58 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.79 3k3e n TYR 384 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 3k3e n SER 385 N -0.73 1.98 -4.58 7.72 7.64 -1.26 -4.90 113.62 119.49 3k3e n SER 385 Ca 0.00 0.12 -0.45 0.00 1.01 0.00 0.00 58.87 59.55 3k3e n SER 385 Cb 0.00 -0.66 -0.04 0.00 -1.01 0.00 0.00 64.21 62.50 3k3e n SER 385 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3k3e n ASN 386 N -3.73 3.11 0.11 6.43 2.85 0.18 -4.86 115.26 119.35 3k3e n ASN 386 Ca -0.46 0.32 0.16 0.00 -0.11 0.00 0.00 54.58 54.50 3k3e n ASN 386 Cb 0.94 -1.49 0.70 0.00 1.24 0.00 0.00 39.78 41.16 3k3e n ASN 386 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 3k3e h GLU 387 N 14.01 0.00 0.02 1.20 4.81 -1.90 -0.91 114.58 131.80 3k3e h GLU 387 Ca -0.39 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.63 3k3e h GLU 387 Cb 1.26 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.63 3k3e h GLU 387 CO 0.97 0.00 -0.94 0.93 -0.73 0.00 0.00 179.01 179.24 3k3e h GLU 388 N 0.00 0.20 -0.76 1.92 5.08 -1.94 -2.28 114.58 116.81 3k3e h GLU 388 Ca 0.15 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.21 3k3e h GLU 388 Cb 0.63 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 3k3e h GLU 388 CO -0.00 1.01 0.25 0.45 -1.00 0.00 0.00 179.01 179.71 3k3e h HIS 389 N 0.10 1.21 -0.08 4.33 3.86 -1.48 -2.58 115.15 120.51 3k3e h HIS 389 Ca -0.06 -0.12 -0.16 0.00 -1.16 0.00 0.00 60.37 58.88 3k3e h HIS 389 Cb 1.60 -0.35 -0.01 0.00 1.06 0.00 0.00 27.41 29.71 3k3e h HIS 389 CO 0.03 0.95 -0.64 0.52 0.86 0.00 0.00 177.93 179.65 3k3e h MET 390 N 1.12 0.31 -0.33 2.45 2.86 -1.36 -2.51 114.93 117.47 3k3e h MET 390 Ca 0.25 -0.22 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 3k3e h MET 390 Cb 0.30 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.98 3k3e h MET 390 CO -0.01 0.85 0.08 1.15 1.06 0.00 0.00 176.91 180.03 3k3e h THR 391 N 0.22 1.22 -0.36 2.22 2.02 -1.26 -0.68 112.91 116.30 3k3e h THR 391 Ca -0.01 -0.76 -0.06 0.00 0.77 0.00 0.00 66.41 66.35 3k3e h THR 391 Cb 1.17 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 68.65 3k3e h THR 391 CO 0.10 0.25 -0.04 -0.07 0.37 0.00 0.00 175.52 176.14 3k3e h LEU 392 N 0.38 0.56 -0.62 2.58 3.38 -1.45 -0.41 115.31 119.73 3k3e h LEU 392 Ca 0.10 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 3k3e h LEU 392 Cb 0.31 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3k3e h LEU 392 CO 0.00 0.66 -0.16 0.25 0.09 0.00 0.00 178.44 179.29 3k3e h LEU 393 N 0.56 0.93 -0.85 1.67 5.85 -1.08 -0.08 115.31 122.31 3k3e h LEU 393 Ca 0.11 -0.32 -0.12 0.00 0.84 0.00 0.00 57.88 58.40 3k3e h LEU 393 Cb 0.42 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.18 3k3e h LEU 393 CO 0.02 1.07 -0.40 0.11 -0.34 0.00 0.00 178.44 178.90 3k3e h LYS 394 N 0.81 0.36 -0.50 1.25 1.57 -0.63 0.60 116.57 120.02 3k3e h LYS 394 Ca 0.12 -0.17 -0.11 0.00 -1.87 0.00 0.00 60.65 58.62 3k3e h LYS 394 Cb 0.70 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 3k3e h LYS 394 CO 0.05 0.71 -0.12 0.52 -0.57 0.00 0.00 179.45 180.04 3k3e h MET 395 N 0.30 0.97 -0.10 3.15 2.86 -0.78 -2.35 114.93 118.99 3k3e h MET 395 Ca 0.03 -0.37 -0.15 0.00 -2.06 0.00 0.00 59.70 57.15 3k3e h MET 395 Cb 0.84 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.43 3k3e h MET 395 CO 0.07 1.04 -0.58 0.82 1.06 0.00 0.00 176.91 179.31 3k3e h ILE 396 N 0.83 1.37 -0.35 -1.22 1.08 -0.78 -2.31 117.51 116.13 3k3e h ILE 396 Ca 0.13 -1.91 -0.08 0.00 -0.39 0.00 0.00 64.86 62.61 3k3e h ILE 396 Cb 0.68 1.93 -0.01 0.00 -3.07 0.00 0.00 36.82 36.35 3k3e h ILE 396 CO 0.05 0.57 -0.09 -0.07 -0.69 0.00 0.00 178.15 177.92 3k3e h LEU 397 N 0.23 0.68 -0.65 1.44 3.38 -0.73 -0.26 115.31 119.41 3k3e h LEU 397 Ca -0.00 -0.37 -0.13 0.00 0.09 0.00 0.00 57.88 57.47 3k3e h LEU 397 Cb 1.09 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 3k3e h LEU 397 CO 0.09 0.89 -0.60 -0.29 0.09 0.00 0.00 178.44 178.62 3k3e h ILE 398 N 0.46 1.30 -0.39 1.22 2.10 -1.44 -1.87 117.51 118.88 3k3e h ILE 398 Ca 0.09 -2.17 -0.07 0.00 1.08 0.00 0.00 64.86 63.79 3k3e h ILE 398 Cb 0.59 2.21 -0.01 0.00 -1.09 0.00 0.00 36.82 38.52 3k3e h ILE 398 CO 0.04 0.59 -0.03 0.11 -1.08 0.00 0.00 178.15 177.78 3k3e h LYS 399 N 0.00 0.72 -0.10 2.19 1.57 -1.24 0.10 116.57 119.81 3k3e h LYS 399 Ca -0.01 -0.24 0.03 0.00 -1.87 0.00 0.00 60.65 58.56 3k3e h LYS 399 Cb 1.16 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.39 3k3e h LYS 399 CO 0.08 0.82 -0.07 0.00 -0.57 0.00 0.00 179.45 179.72 3k3e h ASP 402 N 0.22 0.00 0.00 0.00 3.58 -0.31 -3.25 116.42 116.66 3k3e h ASP 402 Ca 0.04 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.49 3k3e h ASP 402 Cb 0.42 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.47 3k3e h ASP 402 CO 0.03 0.50 -0.29 2.30 -2.88 0.00 0.00 179.24 178.90 3k3e n ILE 403 N -3.94 2.07 0.56 2.25 -5.35 -1.01 -4.80 119.36 109.14 3k3e n ILE 403 Ca -0.01 -2.82 0.02 0.00 -0.27 0.00 0.00 62.75 59.66 3k3e n ILE 403 Cb 0.52 -0.24 0.10 0.00 -1.74 0.00 0.00 39.64 38.27 3k3e n ILE 403 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3k3e n SER 404 N -1.25 2.11 -0.19 7.28 3.41 -0.57 -4.53 113.62 119.88 3k3e n SER 404 Ca 0.18 -2.22 -0.01 0.00 -0.26 0.00 0.00 58.87 56.56 3k3e n SER 404 Cb 0.67 -0.54 0.09 0.00 -0.26 0.00 0.00 64.21 64.17 3k3e n SER 404 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3k3e h ASN 405 N 0.95 0.25 0.12 4.04 2.35 -1.87 -1.06 115.58 120.37 3k3e h ASN 405 Ca 0.00 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 3k3e h ASN 405 Cb 0.85 0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.26 3k3e h ASN 405 CO 0.12 0.16 0.00 -0.62 -1.65 0.00 0.00 177.43 175.43 3k3e n GLU 406 N -4.98 0.18 0.13 0.81 -0.58 -1.26 -1.48 120.64 113.46 3k3e n GLU 406 Ca 0.08 0.14 0.04 0.00 -0.42 0.00 0.00 57.16 57.00 3k3e n GLU 406 Cb 0.24 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.64 3k3e n GLU 406 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3k3e h VAL 407 N 0.00 0.60 -4.54 2.62 2.07 -1.51 -3.37 116.25 112.11 3k3e h VAL 407 Ca 0.00 -1.89 -0.47 0.00 0.82 0.00 0.00 66.70 65.17 3k3e h VAL 407 Cb 0.06 2.22 0.11 0.00 -1.52 0.00 0.00 31.29 32.16 3k3e h VAL 407 CO 0.00 0.34 0.41 -0.13 0.02 0.00 0.00 177.57 178.21 3k3e s ARG 408 N -3.03 1.81 0.55 1.57 0.52 -0.55 -4.79 118.95 115.04 3k3e s ARG 408 Ca 0.03 0.04 -0.21 0.00 -0.52 0.00 0.00 55.73 55.08 3k3e s ARG 408 Cb 0.07 -1.94 -0.06 0.00 0.52 0.00 0.00 34.95 33.55 3k3e s ARG 408 CO 0.75 -1.69 1.11 -2.30 0.02 0.00 0.00 175.30 173.19 3k3e n PRO 409 N -3.37 1.25 -0.30 3.54 -0.02 -1.26 -4.60 135.00 130.24 3k3e n PRO 409 Ca 0.09 0.47 0.05 0.00 -2.02 0.00 0.00 63.50 62.09 3k3e n PRO 409 Cb 0.61 -2.29 0.14 0.00 -0.02 0.00 0.00 33.50 31.94 3k3e n PRO 409 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3k3e h MET 410 N 0.99 0.02 -0.12 -0.52 2.86 -1.95 0.22 114.93 116.43 3k3e h MET 410 Ca -0.49 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.15 3k3e h MET 410 Cb 1.34 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.99 3k3e h MET 410 CO 0.54 0.01 0.00 -1.91 1.06 0.00 0.00 176.91 176.61 3k3e n GLU 411 N -5.51 1.69 0.04 1.72 2.13 -1.26 -0.98 120.64 118.47 3k3e n GLU 411 Ca 0.14 -1.02 -0.18 0.00 0.66 0.00 0.00 57.16 56.76 3k3e n GLU 411 Cb 0.48 -1.42 -0.14 0.00 0.27 0.00 0.00 31.44 30.63 3k3e n GLU 411 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3k3e h VAL 412 N 2.17 0.98 0.13 6.31 2.07 -1.01 -3.41 116.25 123.49 3k3e h VAL 412 Ca 0.00 -2.65 -0.01 0.00 0.82 0.00 0.00 66.70 64.86 3k3e h VAL 412 Cb 0.47 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.91 3k3e h VAL 412 CO 0.00 0.80 -0.06 0.00 0.02 0.00 0.00 177.57 178.33 3k3e h ALA 413 N 0.42 -0.17 -0.85 1.67 0.00 -0.89 -3.39 119.26 116.04 3k3e h ALA 413 Ca -0.30 -0.23 0.15 0.00 0.00 0.00 0.00 54.91 54.53 3k3e h ALA 413 Cb 2.03 0.07 -0.15 0.00 0.00 0.00 0.00 17.79 19.74 3k3e h ALA 413 CO 0.14 -0.24 -0.30 0.93 0.00 0.00 0.00 179.25 179.78 3k3e h GLU 414 N -0.90 -0.04 -1.00 0.00 5.08 -1.28 0.05 114.58 116.50 3k3e h GLU 414 Ca -0.02 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.52 3k3e h GLU 414 Cb 0.52 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 29.68 3k3e h GLU 414 CO 0.03 -0.02 0.62 -1.00 -1.00 0.00 0.00 179.01 177.63 3k3e h PRO 415 N -0.04 0.78 -0.81 2.33 0.13 -1.78 -1.49 132.00 131.12 3k3e h PRO 415 Ca 0.36 -0.05 0.08 0.00 -0.87 0.00 0.00 66.00 65.52 3k3e h PRO 415 Cb 0.61 -0.18 -0.07 0.00 0.13 0.00 0.00 31.00 31.50 3k3e h PRO 415 CO -0.88 0.51 0.48 -1.49 -0.23 0.00 0.00 178.00 176.39 3k3e h TRP 416 N 0.80 0.87 -0.36 1.56 4.06 -1.17 -0.02 115.95 121.70 3k3e h TRP 416 Ca 0.56 0.03 0.00 0.00 2.06 0.00 0.00 58.89 61.54 3k3e h TRP 416 Cb 0.83 -0.27 -0.02 0.00 -1.00 0.00 0.00 29.16 28.70 3k3e h TRP 416 CO -0.00 0.39 0.23 0.28 -3.56 0.00 0.00 178.44 175.78 3k3e h VAL 417 N 0.83 1.10 -0.17 1.49 2.07 -1.25 -1.04 116.25 119.28 3k3e h VAL 417 Ca 0.38 -0.19 -0.14 0.00 0.82 0.00 0.00 66.70 67.57 3k3e h VAL 417 Cb 0.28 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 3k3e h VAL 417 CO -0.21 0.09 -0.43 -0.78 0.02 0.00 0.00 177.57 176.26 3k3e h ASP 418 N 0.49 0.67 -0.14 0.57 1.82 -0.93 -2.64 116.42 116.25 3k3e h ASP 418 Ca 0.13 -0.58 -0.03 0.00 -0.39 0.00 0.00 57.03 56.16 3k3e h ASP 418 Cb -0.04 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 39.76 3k3e h ASP 418 CO -0.03 1.13 0.01 0.00 -1.61 0.00 0.00 179.24 178.74 3k3e h LEU 420 N 0.34 0.93 -0.74 0.00 5.85 -1.17 -2.75 115.31 117.77 3k3e h LEU 420 Ca 0.08 -0.54 -0.13 0.00 0.84 0.00 0.00 57.88 58.13 3k3e h LEU 420 Cb 0.21 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 3k3e h LEU 420 CO 0.00 1.30 -0.46 -0.07 -0.34 0.00 0.00 178.44 178.88 3k3e h LEU 421 N 0.60 0.43 -1.11 2.25 3.38 -1.10 0.31 115.31 120.06 3k3e h LEU 421 Ca 0.01 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.78 3k3e h LEU 421 Cb 1.15 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.74 3k3e h LEU 421 CO 0.12 0.83 0.57 -0.08 0.09 0.00 0.00 178.44 179.97 3k3e h GLU 422 N 0.32 1.17 -0.16 1.13 4.81 -1.11 0.31 114.58 121.05 3k3e h GLU 422 Ca 0.02 -0.08 -0.21 0.00 -0.13 0.00 0.00 59.36 58.97 3k3e h GLU 422 Cb 0.93 -0.26 0.01 0.00 0.63 0.00 0.00 28.75 30.06 3k3e h GLU 422 CO 0.08 0.78 -0.71 1.49 -0.73 0.00 0.00 179.01 179.92 3k3e h GLU 423 N 1.20 0.77 0.10 1.92 4.81 -1.18 -2.59 114.58 119.61 3k3e h GLU 423 Ca 0.32 -0.61 -0.01 0.00 -0.13 0.00 0.00 59.36 58.94 3k3e h GLU 423 Cb -0.12 0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3k3e h GLU 423 CO -0.07 1.22 -0.05 1.88 -0.73 0.00 0.00 179.01 181.26 3k3e h TYR 424 N 0.50 -0.13 -0.23 0.92 -1.99 -0.10 -1.95 116.97 113.99 3k3e h TYR 424 Ca -0.04 -0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.71 3k3e h TYR 424 Cb 1.34 0.04 -0.01 0.00 2.00 0.00 0.00 36.73 40.10 3k3e h TYR 424 CO 0.09 0.07 0.16 0.74 -0.00 0.00 0.00 178.16 179.22 3k3e h PHE 425 N -0.31 0.18 0.00 4.88 0.04 -0.49 0.38 116.94 121.62 3k3e h PHE 425 Ca -0.01 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.71 3k3e h PHE 425 Cb 0.26 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.34 3k3e h PHE 425 CO -0.02 0.10 -0.25 1.98 -0.60 0.00 0.00 178.31 179.53 3k3e h MET 426 N 0.18 0.00 0.22 1.51 4.05 -1.03 -0.17 114.93 119.70 3k3e h MET 426 Ca 0.10 0.00 -0.35 0.00 -0.28 0.00 0.00 59.70 59.17 3k3e h MET 426 Cb 0.16 0.00 0.02 0.00 -0.80 0.00 0.00 31.60 30.99 3k3e h MET 426 CO -0.02 0.25 -1.64 0.37 0.23 0.00 0.00 176.91 176.11 3k3e h GLN 427 N 0.00 0.47 -0.28 0.39 4.15 0.43 -3.21 115.11 117.06 3k3e h GLN 427 Ca -0.00 -0.80 -0.16 0.00 0.77 0.00 0.00 58.65 58.46 3k3e h GLN 427 Cb 0.45 0.30 -0.01 0.00 0.21 0.00 0.00 27.48 28.43 3k3e h GLN 427 CO 0.03 1.38 -0.47 0.66 -1.93 0.00 0.00 178.83 178.50 3k3e h SER 428 N 0.13 0.81 -0.39 -0.69 4.64 -0.85 -0.61 113.55 116.58 3k3e h SER 428 Ca -0.31 -0.40 0.03 0.00 -0.47 0.00 0.00 61.79 60.64 3k3e h SER 428 Cb 2.14 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 63.96 3k3e h SER 428 CO 0.22 1.15 0.19 0.44 -0.87 0.00 0.00 176.83 177.96 3k3e h ASP 429 N 0.59 0.27 0.25 4.97 3.32 -1.17 0.41 116.42 125.05 3k3e h ASP 429 Ca 0.03 0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 3k3e h ASP 429 Cb 1.04 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 3k3e h ASP 429 CO 0.10 0.20 -0.27 -0.09 -1.72 0.00 0.00 179.24 177.46 3k3e h ARG 430 N 0.38 0.04 -0.01 3.56 2.43 -1.52 -1.14 114.38 118.14 3k3e h ARG 430 Ca 0.17 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.30 3k3e h ARG 430 Cb 0.08 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 3k3e h ARG 430 CO -0.12 0.31 -0.10 0.93 -1.51 0.00 0.00 179.97 179.48 3k3e h GLU 431 N 0.04 0.08 -0.40 0.20 5.08 0.12 -1.38 114.58 118.32 3k3e h GLU 431 Ca 0.00 -0.08 0.07 0.00 -1.00 0.00 0.00 59.36 58.36 3k3e h GLU 431 Cb 0.50 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.70 3k3e h GLU 431 CO 0.04 0.79 0.02 0.87 -1.00 0.00 0.00 179.01 179.73 3k3e h LYS 432 N -0.61 0.13 -0.26 2.33 1.57 -0.11 0.62 116.57 120.24 3k3e h LYS 432 Ca -0.01 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.80 3k3e h LYS 432 Cb 0.82 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.06 3k3e h LYS 432 CO 0.02 0.09 0.02 1.03 -0.57 0.00 0.00 179.45 180.03 3k3e h SER 433 N 0.13 -0.07 0.27 0.86 0.87 -1.23 -1.41 113.55 112.97 3k3e h SER 433 Ca 0.20 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 3k3e h SER 433 Cb 0.27 0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 3k3e h SER 433 CO -0.31 -0.00 0.00 -0.62 -0.53 0.00 0.00 176.83 175.37 3k3e n GLU 434 N -5.13 0.71 -1.66 2.24 1.02 -0.52 -4.91 120.64 112.39 3k3e n GLU 434 Ca -0.01 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.10 3k3e n GLU 434 Cb 0.13 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.04 3k3e n GLU 434 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k3e n GLY 435 N 1.07 0.40 3.93 0.62 0.00 0.19 -5.05 105.19 106.36 3k3e n GLY 435 Ca 0.19 -0.82 -0.27 0.00 0.00 0.00 0.00 46.02 45.12 3k3e n GLY 435 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k3e s LEU 436 N -0.88 4.22 0.70 0.99 1.43 0.13 -4.99 118.68 120.28 3k3e s LEU 436 Ca 0.00 0.39 -0.17 0.00 -1.03 0.00 0.00 54.13 53.32 3k3e s LEU 436 Cb 0.00 -3.16 0.02 0.00 0.03 0.00 0.00 46.19 43.08 3k3e s LEU 436 CO 0.00 -0.05 1.27 -0.81 0.23 0.00 0.00 176.35 176.98 3k3e n PRO 437 N -0.73 0.83 -5.17 1.29 -0.04 -1.26 -4.22 135.00 125.70 3k3e n PRO 437 Ca -0.05 0.35 -0.32 0.00 -0.04 0.00 0.00 63.50 63.44 3k3e n PRO 437 Cb 0.54 -2.50 -0.16 0.00 -0.04 0.00 0.00 33.50 31.33 3k3e n PRO 437 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3k3e s VAL 438 N -1.61 2.23 0.35 0.52 1.01 -1.26 -4.90 120.40 116.74 3k3e s VAL 438 Ca 0.80 -0.98 -0.27 0.00 0.00 0.00 0.00 61.98 61.52 3k3e s VAL 438 Cb -0.35 -1.84 -0.09 0.00 0.00 0.00 0.00 36.38 34.09 3k3e s VAL 438 CO 0.43 0.56 1.18 0.00 0.00 0.00 0.00 175.10 177.27 3k3e s ALA 439 N 0.04 3.31 0.21 5.51 0.00 -1.26 -4.94 121.76 124.63 3k3e s ALA 439 Ca -0.09 1.00 -0.10 0.00 0.00 0.00 0.00 51.96 52.77 3k3e s ALA 439 Cb -0.15 -3.38 0.18 0.00 0.00 0.00 0.00 23.12 19.77 3k3e s ALA 439 CO 0.06 -0.43 1.86 -1.35 0.00 0.00 0.00 175.76 175.89 3k3e h PRO 440 N 3.15 0.87 0.00 0.00 0.11 -1.99 -1.75 132.00 132.40 3k3e h PRO 440 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3k3e h PRO 440 Cb 1.22 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3k3e h PRO 440 CO 0.64 0.58 0.00 1.97 -0.21 0.00 0.00 178.00 180.98 3k3e n PHE 441 N -4.64 0.00 0.01 0.65 1.16 -1.26 -0.78 117.46 112.61 3k3e n PHE 441 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.66 3k3e n PHE 441 Cb 0.07 0.00 0.01 0.00 -1.61 0.00 0.00 39.48 37.95 3k3e n PHE 441 CO 0.00 0.00 0.00 -1.33 -1.87 0.00 0.00 176.76 173.56 3k3e n MET 442 N -0.85 0.74 -3.30 3.97 2.81 -0.67 -4.81 117.12 115.00 3k3e n MET 442 Ca 0.07 -0.96 -0.40 0.00 -1.81 0.00 0.00 57.70 54.59 3k3e n MET 442 Cb 0.03 -1.02 -0.08 0.00 -0.71 0.00 0.00 33.22 31.44 3k3e n MET 442 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3k3e s ASP 443 N -0.46 6.32 0.41 7.83 -1.08 0.04 -4.39 116.67 125.35 3k3e s ASP 443 Ca 0.01 0.22 0.16 0.00 -0.52 0.00 0.00 52.55 52.42 3k3e s ASP 443 Cb 0.01 -2.25 1.05 0.00 -1.46 0.00 0.00 42.92 40.27 3k3e s ASP 443 CO 0.01 -0.32 1.87 0.03 0.52 0.00 0.00 175.17 177.28 3k3e h ARG 444 N 8.24 0.43 -0.27 4.34 3.08 -1.90 0.15 114.38 128.45 3k3e h ARG 444 Ca -0.29 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.73 3k3e h ARG 444 Cb 1.14 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.10 3k3e h ARG 444 CO 0.71 0.28 0.00 -0.25 -1.07 0.00 0.00 179.97 179.64 3k3e n ASP 445 N -4.51 1.20 0.00 7.04 8.00 -1.26 -4.29 116.55 122.73 3k3e n ASP 445 Ca 0.18 -2.02 0.00 0.00 0.71 0.00 0.00 54.79 53.66 3k3e n ASP 445 Cb 0.64 -0.17 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 3k3e n ASP 445 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3k3e n LYS 446 N 0.10 0.00 -2.74 -1.24 5.02 0.32 -5.09 118.16 114.54 3k3e n LYS 446 Ca 0.07 0.00 -0.40 0.00 -2.02 0.00 0.00 58.31 55.96 3k3e n LYS 446 Cb 0.20 -0.51 -0.06 0.00 -0.02 0.00 0.00 35.03 34.65 3k3e n LYS 446 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3k3e s VAL 447 N -1.42 4.14 -0.03 -0.18 0.11 -0.09 -5.01 120.40 117.92 3k3e s VAL 447 Ca 0.00 2.07 0.01 0.00 -2.93 0.00 0.00 61.98 61.13 3k3e s VAL 447 Cb 0.00 -4.32 0.02 0.00 -1.53 0.00 0.00 36.38 30.55 3k3e s VAL 447 CO 0.00 0.46 -0.05 0.42 -3.33 0.00 0.00 175.10 172.60 3k3e s THR 448 N -0.92 0.51 0.28 5.04 -4.23 -1.26 -4.88 115.64 110.17 3k3e s THR 448 Ca 0.42 -0.14 0.01 0.00 -1.18 0.00 0.00 61.69 60.80 3k3e s THR 448 Cb -0.26 -0.52 0.29 0.00 1.34 0.00 0.00 72.50 73.36 3k3e s THR 448 CO 0.32 0.20 1.66 0.11 -0.54 0.00 0.00 174.62 176.37 3k3e h LYS 449 N 6.92 0.25 0.00 3.99 1.57 -1.99 -1.85 116.57 125.46 3k3e h LYS 449 Ca -0.37 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 3k3e h LYS 449 Cb 1.16 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.41 3k3e h LYS 449 CO 0.48 0.16 0.00 0.00 -0.57 0.00 0.00 179.45 179.53 3k3e n ALA 450 N -2.67 -0.28 -0.23 3.86 0.00 -1.26 -1.43 120.51 118.51 3k3e n ALA 450 Ca 0.20 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.66 3k3e n ALA 450 Cb 0.62 0.20 0.14 0.00 0.00 0.00 0.00 19.45 20.41 3k3e n ALA 450 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3k3e h THR 451 N 0.00 0.66 0.20 0.00 1.35 -1.82 -2.20 112.91 111.11 3k3e h THR 451 Ca 0.00 -0.12 -0.00 0.00 -0.55 0.00 0.00 66.41 65.73 3k3e h THR 451 Cb 0.00 0.27 -0.02 0.00 -1.73 0.00 0.00 68.15 66.67 3k3e h THR 451 CO 0.00 0.07 -0.32 0.00 -0.25 0.00 0.00 175.52 175.01 3k3e h ALA 452 N 1.50 -0.92 0.00 6.62 0.00 -1.20 -2.46 119.26 122.79 3k3e h ALA 452 Ca 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3k3e h ALA 452 Cb 0.53 0.63 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3k3e h ALA 452 CO -0.39 -0.97 0.00 1.96 0.00 0.00 0.00 179.25 179.85 3k3e h GLN 453 N -0.56 0.00 0.21 0.00 1.08 -1.07 -1.88 115.11 112.89 3k3e h GLN 453 Ca -0.02 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.17 3k3e h GLN 453 Cb 0.51 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.94 3k3e h GLN 453 CO -0.10 0.00 -0.10 0.82 -0.95 0.00 0.00 178.83 178.49 3k3e h ILE 454 N 0.00 0.79 -0.29 2.54 2.04 -0.93 -1.16 117.51 120.50 3k3e h ILE 454 Ca 0.00 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 3k3e h ILE 454 Cb 0.09 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 3k3e h ILE 454 CO 0.00 0.18 0.15 1.23 0.00 0.00 0.00 178.15 179.71 3k3e h GLY 455 N -0.81 0.43 1.19 5.37 0.00 -1.27 -0.06 103.07 107.92 3k3e h GLY 455 Ca -0.03 -0.21 0.03 0.00 0.00 0.00 0.00 47.33 47.13 3k3e h GLY 455 CO 0.05 0.20 0.48 -2.75 0.00 0.00 0.00 176.54 174.51 3k3e h PHE 456 N 0.34 0.85 0.07 5.60 3.57 -1.41 0.11 116.94 126.07 3k3e h PHE 456 Ca 0.10 0.02 -0.21 0.00 3.53 0.00 0.00 57.97 61.41 3k3e h PHE 456 Cb 0.09 -0.28 0.02 0.00 2.79 0.00 0.00 35.95 38.57 3k3e h PHE 456 CO -0.03 0.50 -0.85 0.82 -2.23 0.00 0.00 178.31 176.53 3k3e h ILE 457 N 0.88 1.41 -0.14 1.41 2.04 -0.94 -0.88 117.51 121.28 3k3e h ILE 457 Ca 0.28 -2.31 -0.13 0.00 1.00 0.00 0.00 64.86 63.70 3k3e h ILE 457 Cb 0.04 2.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 3k3e h ILE 457 CO -0.08 0.68 -0.43 0.11 0.00 0.00 0.00 178.15 178.43 3k3e h LYS 458 N -0.06 0.54 0.00 2.37 1.57 -0.78 -1.31 116.57 118.90 3k3e h LYS 458 Ca -0.13 -0.39 0.00 0.00 -1.87 0.00 0.00 60.65 58.26 3k3e h LYS 458 Cb 1.58 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.96 3k3e h LYS 458 CO 0.16 1.01 -1.17 1.19 -0.57 0.00 0.00 179.45 180.08 3k3e n PHE 459 N -4.26 0.02 0.03 -1.35 0.99 0.37 -4.30 117.46 108.95 3k3e n PHE 459 Ca -0.07 0.01 -0.01 0.00 -0.00 0.00 0.00 57.45 57.37 3k3e n PHE 459 Cb 0.56 -0.13 -0.00 0.00 -1.00 0.00 0.00 39.48 38.90 3k3e n PHE 459 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 3k3e n VAL 460 N -1.67 1.13 0.17 -4.37 0.31 -0.81 -4.79 118.33 108.30 3k3e n VAL 460 Ca 0.02 0.33 -0.07 0.00 -0.01 0.00 0.00 64.34 64.61 3k3e n VAL 460 Cb 0.38 -1.65 -0.03 0.00 -0.91 0.00 0.00 33.84 31.63 3k3e n VAL 460 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3k3e h LEU 461 N -0.10 -0.38 -0.58 7.52 3.38 -1.22 -3.15 115.31 120.77 3k3e h LEU 461 Ca -0.01 0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.08 3k3e h LEU 461 Cb 0.22 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.99 3k3e h LEU 461 CO -0.01 -0.23 0.12 0.40 0.09 0.00 0.00 178.44 178.82 3k3e h ILE 462 N -0.54 0.66 -0.88 1.22 2.04 -1.49 -1.79 117.51 116.73 3k3e h ILE 462 Ca -0.05 -0.09 0.04 0.00 1.00 0.00 0.00 64.86 65.77 3k3e h ILE 462 Cb 0.35 0.38 -0.05 0.00 -0.74 0.00 0.00 36.82 36.75 3k3e h ILE 462 CO 0.08 0.05 0.56 -0.65 0.00 0.00 0.00 178.15 178.18 3k3e h PRO 463 N 0.25 1.04 -0.46 2.37 0.11 -1.75 0.63 132.00 134.20 3k3e h PRO 463 Ca 0.30 -0.06 -0.13 0.00 0.11 0.00 0.00 66.00 66.22 3k3e h PRO 463 Cb 0.44 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.30 3k3e h PRO 463 CO -0.39 0.69 -0.21 1.98 -0.21 0.00 0.00 178.00 179.86 3k3e h MET 464 N 1.07 0.95 -0.02 1.05 1.85 -1.36 -2.86 114.93 115.61 3k3e h MET 464 Ca 0.36 -0.41 -0.18 0.00 -0.61 0.00 0.00 59.70 58.86 3k3e h MET 464 Cb 0.04 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.03 3k3e h MET 464 CO -0.13 1.08 -0.77 0.74 -0.40 0.00 0.00 176.91 177.43 3k3e h PHE 465 N 0.79 0.28 -0.94 1.39 -1.00 -1.06 -2.57 116.94 113.83 3k3e h PHE 465 Ca 0.10 -0.14 0.03 0.00 2.81 0.00 0.00 57.97 60.77 3k3e h PHE 465 Cb 0.79 -0.04 -0.05 0.00 3.61 0.00 0.00 35.95 40.26 3k3e h PHE 465 CO 0.05 0.89 0.62 0.93 -1.61 0.00 0.00 178.31 179.19 3k3e h GLU 466 N 0.13 1.18 -0.40 1.51 5.08 -0.81 0.15 114.58 121.42 3k3e h GLU 466 Ca -0.03 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.18 3k3e h GLU 466 Cb 1.34 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 3k3e h GLU 466 CO 0.12 0.78 -0.06 1.15 -1.00 0.00 0.00 179.01 180.00 3k3e h THR 467 N 1.21 1.27 -0.06 1.13 2.02 -1.43 -2.61 112.91 114.44 3k3e h THR 467 Ca 0.37 -1.12 -0.06 0.00 0.77 0.00 0.00 66.41 66.37 3k3e h THR 467 Cb -0.04 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 3k3e h THR 467 CO -0.11 0.38 -0.22 0.58 0.37 0.00 0.00 175.52 176.52 3k3e h VAL 468 N 0.56 1.19 0.00 3.16 2.07 -0.99 -2.11 116.25 120.13 3k3e h VAL 468 Ca 0.11 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.73 3k3e h VAL 468 Cb 0.57 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 3k3e h VAL 468 CO 0.03 0.27 -0.01 0.74 0.02 0.00 0.00 177.57 178.62 3k3e h THR 469 N 0.10 0.03 -0.49 2.57 2.02 -0.34 -1.53 112.91 115.26 3k3e h THR 469 Ca 0.02 -0.40 -0.11 0.00 0.77 0.00 0.00 66.41 66.69 3k3e h THR 469 Cb 0.45 1.38 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 3k3e h THR 469 CO 0.03 0.01 -0.14 0.11 0.37 0.00 0.00 175.52 175.90 3k3e h LYS 470 N 0.00 0.94 0.18 6.66 1.57 -1.21 -2.45 116.57 122.25 3k3e h LYS 470 Ca -0.00 -0.35 -0.26 0.00 -1.87 0.00 0.00 60.65 58.17 3k3e h LYS 470 Cb 0.38 -0.06 0.03 0.00 0.08 0.00 0.00 32.23 32.66 3k3e h LYS 470 CO 0.00 1.01 -1.13 -0.07 -0.57 0.00 0.00 179.45 178.69 3k3e h LEU 471 N 0.83 0.69 -7.27 2.94 3.38 -1.56 -3.40 115.31 110.92 3k3e h LEU 471 Ca 0.13 -0.91 -0.64 0.00 0.09 0.00 0.00 57.88 56.54 3k3e h LEU 471 Cb 0.68 -0.22 -0.40 0.00 0.09 0.00 0.00 40.66 40.80 3k3e h LEU 471 CO 0.05 1.54 -0.53 -0.36 0.09 0.00 0.00 178.44 179.24 3k3e s PHE 472 N -2.62 3.44 0.50 1.13 0.40 -0.62 -4.97 117.98 115.24 3k3e s PHE 472 Ca -0.11 -3.19 0.29 0.00 -0.60 0.00 0.00 56.93 53.32 3k3e s PHE 472 Cb 0.03 -2.85 1.39 0.00 0.51 0.00 0.00 43.02 42.10 3k3e s PHE 472 CO 0.89 -0.67 1.85 -1.00 0.70 0.00 0.00 175.22 176.99 3k3e h PRO 473 N 6.03 0.11 0.00 0.24 0.13 -1.67 -0.89 132.00 135.96 3k3e h PRO 473 Ca 0.04 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 3k3e h PRO 473 Cb 0.83 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3k3e h PRO 473 CO 0.72 0.07 0.00 0.00 -0.23 0.00 0.00 178.00 178.56 3k3e n MET 474 N -4.33 0.13 0.08 0.86 0.00 -1.26 -2.29 117.12 110.30 3k3e n MET 474 Ca 0.21 0.50 -0.04 0.00 0.00 0.00 0.00 57.70 58.38 3k3e n MET 474 Cb 0.98 -1.82 0.18 0.00 0.00 0.00 0.00 33.22 32.56 3k3e n MET 474 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 3k3e h VAL 475 N 0.00 1.33 -0.68 3.17 2.07 -1.49 -3.24 116.25 117.41 3k3e h VAL 475 Ca 0.00 -1.66 0.11 0.00 0.82 0.00 0.00 66.70 65.97 3k3e h VAL 475 Cb 0.16 1.76 -0.08 0.00 -1.52 0.00 0.00 31.29 31.60 3k3e h VAL 475 CO 0.00 0.50 0.29 -0.08 0.02 0.00 0.00 177.57 178.30 3k3e h GLU 476 N 0.23 0.47 -0.04 1.57 4.81 -1.65 0.19 114.58 120.16 3k3e h GLU 476 Ca 0.01 -0.03 -0.24 0.00 -0.13 0.00 0.00 59.36 58.98 3k3e h GLU 476 Cb 0.91 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 30.20 3k3e h GLU 476 CO 0.07 0.31 -0.93 1.49 -0.73 0.00 0.00 179.01 179.23 3k3e h GLU 477 N 0.48 0.59 0.00 1.92 4.81 -1.76 -1.50 114.58 119.13 3k3e h GLU 477 Ca 0.35 -0.59 -0.17 0.00 -0.13 0.00 0.00 59.36 58.82 3k3e h GLU 477 Cb 0.44 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.95 3k3e h GLU 477 CO -0.32 1.20 -1.27 0.82 -0.73 0.00 0.00 179.01 178.71 3k3e h ILE 478 N 0.36 0.67 0.00 2.32 1.08 -1.54 -3.38 117.51 117.01 3k3e h ILE 478 Ca -0.09 -2.19 0.00 0.00 -0.39 0.00 0.00 64.86 62.19 3k3e h ILE 478 Cb 1.56 2.19 0.00 0.00 -3.07 0.00 0.00 36.82 37.50 3k3e h ILE 478 CO 0.17 0.38 -0.83 0.23 -0.69 0.00 0.00 178.15 177.42 3k3e n MET 479 N -2.99 0.88 -0.13 2.37 2.81 0.64 -4.62 117.12 116.09 3k3e n MET 479 Ca -0.08 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.68 3k3e n MET 479 Cb 0.85 -0.91 -0.02 0.00 -0.71 0.00 0.00 33.22 32.43 3k3e n MET 479 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 3k3e h LEU 480 N 0.00 1.00 0.00 4.03 3.38 -1.31 -2.82 115.31 119.58 3k3e h LEU 480 Ca 0.00 -0.45 0.01 0.00 0.09 0.00 0.00 57.88 57.53 3k3e h LEU 480 Cb 0.83 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.28 3k3e h LEU 480 CO 0.00 1.24 -0.21 -0.61 0.09 0.00 0.00 178.44 178.95 3k3e h GLN 481 N 0.77 -0.26 -0.32 1.13 5.75 -1.46 0.22 115.11 120.94 3k3e h GLN 481 Ca 0.07 0.02 0.09 0.00 -0.15 0.00 0.00 58.65 58.68 3k3e h GLN 481 Cb 0.93 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.52 3k3e h GLN 481 CO 0.09 -0.17 0.25 -1.00 -2.65 0.00 0.00 178.83 175.34 3k3e h PRO 482 N -0.27 0.00 -0.29 -2.39 0.13 -1.81 -1.30 132.00 126.07 3k3e h PRO 482 Ca 0.00 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.95 3k3e h PRO 482 Cb 0.28 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.42 3k3e h PRO 482 CO -0.14 0.00 -0.55 -0.07 -0.23 0.00 0.00 178.00 177.01 3k3e h LEU 483 N 0.00 0.98 -0.79 1.56 3.38 -1.03 0.79 115.31 120.20 3k3e h LEU 483 Ca 0.15 -0.53 -0.07 0.00 0.09 0.00 0.00 57.88 57.52 3k3e h LEU 483 Cb 0.65 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 3k3e h LEU 483 CO -0.00 1.33 0.11 -0.50 0.09 0.00 0.00 178.44 179.47 3k3e h TRP 484 N 0.68 1.09 -0.42 1.13 6.55 0.51 -0.25 115.95 125.23 3k3e h TRP 484 Ca 0.01 -0.14 -0.11 0.00 0.95 0.00 0.00 58.89 59.61 3k3e h TRP 484 Cb 1.16 -0.30 -0.02 0.00 -0.86 0.00 0.00 29.16 29.14 3k3e h TRP 484 CO 0.07 0.91 -0.17 0.93 -1.05 0.00 0.00 178.44 179.14 3k3e h GLU 485 N 0.97 0.81 -0.22 0.49 5.08 -1.26 -1.21 114.58 119.24 3k3e h GLU 485 Ca 0.20 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 3k3e h GLU 485 Cb 0.40 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3k3e h GLU 485 CO 0.01 0.92 0.09 1.03 -1.00 0.00 0.00 179.01 180.06 3k3e h SER 486 N 0.72 0.31 0.51 1.42 0.87 -0.34 0.56 113.55 117.59 3k3e h SER 486 Ca 0.11 -0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.50 3k3e h SER 486 Cb 0.68 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.54 3k3e h SER 486 CO 0.05 0.38 -0.42 -0.09 -0.53 0.00 0.00 176.83 176.22 3k3e h ARG 487 N 0.22 -0.88 -0.55 2.24 2.43 -0.80 -1.10 114.38 115.93 3k3e h ARG 487 Ca 0.08 0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.39 3k3e h ARG 487 Cb 0.16 0.20 -0.06 0.00 -0.42 0.00 0.00 29.97 29.85 3k3e h ARG 487 CO -0.01 -0.59 0.20 -0.44 -1.51 0.00 0.00 179.97 177.63 3k3e h ASP 488 N -0.91 0.20 -0.40 -3.80 3.32 -1.16 0.08 116.42 113.75 3k3e h ASP 488 Ca -0.05 0.07 0.05 0.00 0.02 0.00 0.00 57.03 57.12 3k3e h ASP 488 Cb 0.78 0.05 -0.05 0.00 0.22 0.00 0.00 39.33 40.34 3k3e h ASP 488 CO -0.01 0.14 0.12 -0.09 -1.72 0.00 0.00 179.24 177.68 3k3e h ARG 489 N 0.38 0.27 0.00 3.56 2.43 -0.63 0.11 114.38 120.50 3k3e h ARG 489 Ca 0.27 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.37 3k3e h ARG 489 Cb 0.31 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 3k3e h ARG 489 CO -0.27 0.18 -0.27 1.88 -1.51 0.00 0.00 179.97 179.98 3k3e h TYR 490 N 0.27 0.00 -0.24 2.20 0.05 -0.26 0.11 116.97 119.10 3k3e h TYR 490 Ca 0.19 0.00 -0.15 0.00 0.05 0.00 0.00 58.73 58.81 3k3e h TYR 490 Cb 0.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.93 3k3e h TYR 490 CO -0.16 0.27 -0.45 0.93 -1.05 0.00 0.00 178.16 177.70 3k3e h GLU 491 N 0.00 0.73 -0.29 4.88 5.08 0.17 -1.32 114.58 123.83 3k3e h GLU 491 Ca -0.00 -0.46 -0.06 0.00 -1.00 0.00 0.00 59.36 57.83 3k3e h GLU 491 Cb 0.53 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.82 3k3e h GLU 491 CO 0.03 1.08 -0.09 1.49 -1.00 0.00 0.00 179.01 180.53 3k3e h GLU 492 N 0.46 0.47 0.00 2.33 4.57 -0.49 -1.96 114.58 119.96 3k3e h GLU 492 Ca 0.01 -0.12 -0.08 0.00 -1.18 0.00 0.00 59.36 57.99 3k3e h GLU 492 Cb 1.05 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.57 3k3e h GLU 492 CO 0.10 0.57 -0.39 1.25 -1.18 0.00 0.00 179.01 179.36 3k3e h LEU 493 N 0.44 0.00 -0.15 1.64 5.85 -0.51 -2.93 115.31 119.65 3k3e h LEU 493 Ca 0.09 0.00 -0.23 0.00 0.84 0.00 0.00 57.88 58.58 3k3e h LEU 493 Cb 0.43 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3k3e h LEU 493 CO 0.02 0.39 -0.96 0.50 -0.34 0.00 0.00 178.44 178.05 3k3e h LYS 494 N 0.00 0.38 0.08 1.25 3.64 -0.48 -2.57 116.57 118.88 3k3e h LYS 494 Ca -0.00 -0.43 0.01 0.00 -1.27 0.00 0.00 60.65 58.95 3k3e h LYS 494 Cb 0.84 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.77 3k3e h LYS 494 CO 0.05 1.11 -0.10 0.00 -2.27 0.00 0.00 179.45 178.23 3k3e h ARG 495 N 0.21 -0.21 -0.47 1.90 3.08 -1.35 0.13 114.38 117.67 3k3e h ARG 495 Ca -0.08 0.01 0.09 0.00 0.07 0.00 0.00 59.98 60.08 3k3e h ARG 495 Cb 1.61 0.05 -0.09 0.00 0.08 0.00 0.00 29.97 31.62 3k3e h ARG 495 CO 0.16 -0.14 -0.08 0.82 -1.07 0.00 0.00 179.97 179.67 3k3e h ILE 496 N -0.22 0.56 -0.34 2.04 2.04 -1.53 -0.07 117.51 119.99 3k3e h ILE 496 Ca 0.01 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 3k3e h ILE 496 Cb 0.23 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3k3e h ILE 496 CO -0.05 0.01 0.10 0.44 0.00 0.00 0.00 178.15 178.65 3k3e h ASP 497 N 0.04 0.44 0.12 1.72 5.19 -0.94 0.15 116.42 123.14 3k3e h ASP 497 Ca 0.23 -0.05 -0.01 0.00 -0.62 0.00 0.00 57.03 56.59 3k3e h ASP 497 Cb 0.35 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 39.75 3k3e h ASP 497 CO -0.46 0.43 -0.06 0.44 -3.12 0.00 0.00 179.24 176.48 3k3e h ASP 498 N 0.48 -0.13 0.03 6.45 3.32 0.62 -2.32 116.42 124.87 3k3e h ASP 498 Ca 0.12 -0.37 0.03 0.00 0.02 0.00 0.00 57.03 56.82 3k3e h ASP 498 Cb 0.15 0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.70 3k3e h ASP 498 CO -0.01 0.34 -0.24 0.00 -1.72 0.00 0.00 179.24 177.61 3k3e h ALA 499 N 0.14 -0.34 -0.85 3.45 0.00 -0.86 0.33 119.26 121.13 3k3e h ALA 499 Ca -0.02 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.03 3k3e h ALA 499 Cb 0.50 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 3k3e h ALA 499 CO 0.03 -0.75 0.44 1.98 0.00 0.00 0.00 179.25 180.95 3k3e h MET 500 N -0.39 0.62 -0.11 0.00 1.85 -0.76 -1.06 114.93 115.07 3k3e h MET 500 Ca 0.05 -0.04 -0.20 0.00 -0.61 0.00 0.00 59.70 58.90 3k3e h MET 500 Cb 0.46 -0.14 0.00 0.00 0.43 0.00 0.00 31.60 32.35 3k3e h MET 500 CO -0.20 0.41 -0.76 0.87 -0.40 0.00 0.00 176.91 176.84 3k3e h LYS 501 N 0.64 0.59 -0.95 0.39 1.57 -0.86 -3.06 116.57 114.88 3k3e h LYS 501 Ca 0.46 -0.48 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 3k3e h LYS 501 Cb 0.63 0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.99 3k3e h LYS 501 CO -0.35 1.11 0.63 1.49 -0.57 0.00 0.00 179.45 181.75 3k3e h GLU 502 N 0.40 1.21 0.00 3.15 4.57 -0.10 0.66 114.58 124.48 3k3e h GLU 502 Ca -0.04 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.07 3k3e h GLU 502 Cb 1.36 -0.27 0.00 0.00 -0.16 0.00 0.00 28.75 29.67 3k3e h GLU 502 CO 0.14 0.80 0.00 1.28 -1.18 0.00 0.00 179.01 180.05 3k3e n LEU 503 N -4.41 0.00 -0.07 1.64 4.77 -0.48 -2.17 117.00 116.27 3k3e n LEU 503 Ca 0.12 0.27 0.01 0.00 -0.03 0.00 0.00 56.01 56.37 3k3e n LEU 503 Cb 0.05 -0.27 0.01 0.00 -2.33 0.00 0.00 43.42 40.89 3k3e n LEU 503 CO 0.36 -0.23 0.42 0.00 -1.33 0.00 0.00 177.39 176.61 3k3e n GLN 504 N -1.27 1.44 0.04 3.23 6.02 0.22 -4.86 117.38 122.20 3k3e n GLN 504 Ca 0.02 -1.16 0.00 0.00 -0.01 0.00 0.00 57.00 55.85 3k3e n GLN 504 Cb 0.03 -1.03 0.00 0.00 1.02 0.00 0.00 30.24 30.27 3k3e n GLN 504 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 3k3e n LYS 505 N -0.20 0.00 0.00 -1.09 4.81 -0.92 -5.10 118.16 115.66 3k3e n LYS 505 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 3k3e n LYS 505 Cb 0.17 -0.34 0.00 0.00 0.02 0.00 0.00 35.03 34.88 3k3e n LYS 505 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20