#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n9n s LYS 193 N 0.00 0.49 0.35 -0.52 2.20 -1.26 -5.06 119.74 115.94 3n9n s LYS 193 Ca 0.00 0.82 0.10 0.00 -0.36 0.00 0.00 55.97 56.53 3n9n s LYS 193 Cb 0.00 0.45 0.85 0.00 -1.51 0.00 0.00 37.83 37.62 3n9n s LYS 193 CO 0.00 -0.57 1.82 0.93 -0.36 0.00 0.00 175.35 177.17 3n9n h GLU 194 N 7.98 0.64 0.00 4.03 4.39 -2.04 0.14 114.58 129.72 3n9n h GLU 194 Ca -0.19 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.47 3n9n h GLU 194 Cb 1.17 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 3n9n h GLU 194 CO 0.17 0.42 0.00 0.66 -1.16 0.00 0.00 179.01 179.11 3n9n h SER 195 N 0.66 0.00 -0.65 1.42 4.64 -2.01 -1.12 113.55 116.48 3n9n h SER 195 Ca 0.52 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 3n9n h SER 195 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 3n9n h SER 195 CO -0.28 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.15 3n9n n ASP 196 N -2.58 3.65 -4.74 4.97 8.00 0.04 -4.47 116.55 121.43 3n9n n ASP 196 Ca -0.01 -1.99 -0.39 0.00 0.71 0.00 0.00 54.79 53.11 3n9n n ASP 196 Cb 0.13 -0.43 -0.05 0.00 -0.02 0.00 0.00 41.12 40.75 3n9n n ASP 196 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3n9n s ARG 197 N -1.14 4.35 0.58 -1.24 3.52 -0.43 -4.77 118.95 119.82 3n9n s ARG 197 Ca 0.45 0.66 -0.17 0.00 -0.13 0.00 0.00 55.73 56.54 3n9n s ARG 197 Cb 0.24 -3.40 -0.04 0.00 -1.56 0.00 0.00 34.95 30.18 3n9n s ARG 197 CO 0.32 0.21 1.09 0.00 -0.81 0.00 0.00 175.30 176.11 3n9n n GLY 199 N -0.37 -1.10 0.00 0.00 0.00 -1.26 -0.22 105.19 102.23 3n9n n GLY 199 Ca 0.10 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.57 3n9n n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n9n n GLY 200 N 0.00 -1.33 4.76 -0.02 0.00 -1.26 -4.82 105.19 102.51 3n9n n GLY 200 Ca 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.80 3n9n n GLY 200 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n9n n GLY 202 N 0.00 -0.33 3.10 0.00 0.00 -0.75 -4.89 105.19 102.33 3n9n n GLY 202 Ca 0.00 0.09 -0.08 0.00 0.00 0.00 0.00 46.02 46.02 3n9n n GLY 202 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n9n s LYS 203 N -6.98 0.65 -0.07 1.61 2.20 0.70 -4.83 119.74 113.01 3n9n s LYS 203 Ca 0.64 -1.20 -0.13 0.00 -0.36 0.00 0.00 55.97 54.92 3n9n s LYS 203 Cb -0.37 0.08 -0.29 0.00 -1.51 0.00 0.00 37.83 35.73 3n9n s LYS 203 CO 0.97 -0.08 0.61 0.74 -0.36 0.00 0.00 175.35 177.24 3n9n h PHE 204 N 3.22 0.61 -3.11 4.03 0.04 -1.86 -0.95 116.94 118.92 3n9n h PHE 204 Ca -0.34 -0.44 -0.65 0.00 2.80 0.00 0.00 57.97 59.33 3n9n h PHE 204 Cb 1.15 -0.02 -0.35 0.00 2.20 0.00 0.00 35.95 38.93 3n9n h PHE 204 CO 0.56 1.64 -0.86 0.99 -0.60 0.00 0.00 178.31 180.04 3n9n s THR 205 N -2.54 1.93 0.56 -1.55 2.01 -1.26 -4.82 115.64 109.97 3n9n s THR 205 Ca -0.18 -0.87 -0.21 0.00 0.31 0.00 0.00 61.69 60.74 3n9n s THR 205 Cb 0.05 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.77 3n9n s THR 205 CO 0.82 0.52 1.29 -2.28 -0.69 0.00 0.00 174.62 174.28 3n9n s HIS 206 N 1.21 2.35 0.19 4.92 2.46 -1.26 -4.91 115.29 120.25 3n9n s HIS 206 Ca 0.02 1.44 -0.17 0.00 0.47 0.00 0.00 55.06 56.82 3n9n s HIS 206 Cb -0.14 -3.66 0.16 0.00 -0.13 0.00 0.00 32.58 28.81 3n9n s HIS 206 CO -0.09 -2.57 1.62 1.05 -2.47 0.00 0.00 174.74 172.28 3n9n h GLU 207 N 1.27 -0.08 0.00 2.88 4.11 -1.99 -3.52 114.58 117.24 3n9n h GLU 207 Ca -0.51 0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.93 3n9n h GLU 207 Cb 1.30 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.57 3n9n h GLU 207 CO 0.56 -0.06 0.00 -0.25 0.07 0.00 0.00 179.01 179.34 3n9n n ASP 208 N -5.41 0.00 0.00 3.06 8.00 -1.26 -5.17 116.55 115.77 3n9n n ASP 208 Ca 0.05 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.55 3n9n n ASP 208 Cb 0.32 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.42 3n9n n ASP 208 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 3n9n n LYS 235 N 0.00 0.00 -3.76 -1.24 4.81 -1.26 -4.86 118.16 111.85 3n9n n LYS 235 Ca 0.00 0.00 -0.38 0.00 -0.87 0.00 0.00 58.31 57.06 3n9n n LYS 235 Cb 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 34.93 3n9n n LYS 235 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 3n9n s LYS 236 N -1.08 2.62 0.60 1.64 -2.85 -1.26 -4.96 119.74 114.45 3n9n s LYS 236 Ca 0.00 -1.18 0.40 0.00 -1.00 0.00 0.00 55.97 54.19 3n9n s LYS 236 Cb 0.00 -3.44 2.18 0.00 -2.06 0.00 0.00 37.83 34.51 3n9n s LYS 236 CO 0.00 -0.66 2.23 -0.97 0.10 0.00 0.00 175.35 176.05 3n9n h ASN 237 N 8.21 0.00 0.00 0.03 -0.73 -1.98 -3.47 115.58 117.64 3n9n h ASN 237 Ca -0.23 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.94 3n9n h ASN 237 Cb 1.08 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.67 3n9n h ASN 237 CO 0.60 0.00 0.00 -0.67 -0.37 0.00 0.00 177.43 176.99 3n9n n ASP 238 N -2.92 0.00 -3.55 1.15 2.03 -1.26 -2.89 116.55 109.12 3n9n n ASP 238 Ca -0.03 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.01 3n9n n ASP 238 Cb 0.07 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.38 3n9n n ASP 238 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3n9n n PHE 239 N 7.68 3.56 -4.52 -0.67 3.72 -1.26 -4.91 117.46 121.06 3n9n n PHE 239 Ca 0.00 -4.18 -0.21 0.00 -0.05 0.00 0.00 57.45 53.02 3n9n n PHE 239 Cb 0.00 -0.59 -0.15 0.00 -0.94 0.00 0.00 39.48 37.80 3n9n n PHE 239 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 3n9n s GLN 240 N -2.24 0.97 0.12 -1.08 -0.21 -1.14 -5.10 119.66 110.98 3n9n s GLN 240 Ca 0.36 -0.42 0.06 0.00 0.02 0.00 0.00 55.36 55.38 3n9n s GLN 240 Cb 0.10 -0.93 -0.04 0.00 1.00 0.00 0.00 33.01 33.14 3n9n s GLN 240 CO -0.05 0.25 -0.15 -1.58 -2.12 0.00 0.00 175.29 171.64 3n9n s TRP 241 N -0.26 1.47 0.01 0.91 0.52 -1.26 -1.12 118.94 119.21 3n9n s TRP 241 Ca 0.04 -0.52 0.03 0.00 0.02 0.00 0.00 56.10 55.67 3n9n s TRP 241 Cb -0.05 -0.77 -0.01 0.00 -1.15 0.00 0.00 33.47 31.49 3n9n s TRP 241 CO -0.00 0.16 -0.11 -1.50 0.02 0.00 0.00 176.95 175.52 3n9n s ILE 242 N -1.97 0.84 -0.08 2.03 2.07 0.12 -4.81 121.20 119.40 3n9n s ILE 242 Ca 0.09 -0.67 -0.01 0.00 -1.41 0.00 0.00 60.65 58.64 3n9n s ILE 242 Cb -0.06 -0.75 -0.03 0.00 0.13 0.00 0.00 42.46 41.75 3n9n s ILE 242 CO 0.03 0.08 -0.02 -0.83 -1.91 0.00 0.00 174.94 172.30 3n9n s GLY 243 N -0.67 1.81 -0.19 1.50 0.00 -1.26 -0.72 107.32 107.79 3n9n s GLY 243 Ca 0.01 -0.83 -0.29 0.00 0.00 0.00 0.00 44.72 43.62 3n9n s GLY 243 CO 0.00 -0.58 1.10 0.00 0.00 0.00 0.00 173.10 173.63 3n9n n ASP 245 N 6.21 0.00 -0.06 0.00 10.43 0.63 -0.09 116.55 133.67 3n9n n ASP 245 Ca 0.12 0.07 -0.06 0.00 2.57 0.00 0.00 54.79 57.49 3n9n n ASP 245 Cb 0.46 -0.32 -0.02 0.00 1.84 0.00 0.00 41.12 43.08 3n9n n ASP 245 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 3n9n n SER 246 N -1.32 1.40 -0.19 -2.24 2.88 -1.26 -4.75 113.62 108.15 3n9n n SER 246 Ca 0.09 0.24 0.12 0.00 -1.33 0.00 0.00 58.87 57.98 3n9n n SER 246 Cb 0.17 -0.66 0.18 0.00 -0.75 0.00 0.00 64.21 63.15 3n9n n SER 246 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3n9n n GLN 248 N -0.89 -0.30 -3.07 0.00 1.13 0.87 -4.98 117.38 110.14 3n9n n GLN 248 Ca 0.08 0.08 -0.36 0.00 -1.94 0.00 0.00 57.00 54.86 3n9n n GLN 248 Cb 0.37 -3.65 -0.06 0.00 0.11 0.00 0.00 30.24 27.00 3n9n n GLN 248 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 3n9n s THR 249 N -2.19 4.53 0.24 5.09 -4.23 -1.26 -4.64 115.64 113.18 3n9n s THR 249 Ca 0.00 1.36 -0.17 0.00 -1.18 0.00 0.00 61.69 61.70 3n9n s THR 249 Cb 0.00 -3.89 -0.08 0.00 1.34 0.00 0.00 72.50 69.87 3n9n s THR 249 CO 0.00 0.23 0.69 0.26 -0.54 0.00 0.00 174.62 175.26 3n9n s TRP 250 N -1.49 3.54 -0.03 3.99 0.52 -1.26 -2.23 118.94 121.97 3n9n s TRP 250 Ca 0.43 1.25 0.03 0.00 0.02 0.00 0.00 56.10 57.82 3n9n s TRP 250 Cb -0.17 -2.53 0.00 0.00 -1.15 0.00 0.00 33.47 29.62 3n9n s TRP 250 CO 0.22 0.27 -0.10 0.71 0.02 0.00 0.00 176.95 178.06 3n9n s TYR 251 N -1.68 1.06 0.36 -1.98 2.02 0.11 -4.16 117.35 113.08 3n9n s TYR 251 Ca 0.46 -0.28 -0.28 0.00 -0.37 0.00 0.00 57.07 56.60 3n9n s TYR 251 Cb -0.14 -0.76 -0.11 0.00 -0.40 0.00 0.00 41.96 40.55 3n9n s TYR 251 CO 0.20 -0.12 1.51 0.72 -1.57 0.00 0.00 175.55 176.28 3n9n n HIS 252 N 3.34 2.99 -0.29 2.71 8.25 -1.26 0.16 115.22 131.11 3n9n n HIS 252 Ca -0.19 0.41 0.10 0.00 -0.26 0.00 0.00 57.72 57.78 3n9n n HIS 252 Cb 0.54 -2.55 0.26 0.00 1.12 0.00 0.00 29.99 29.36 3n9n n HIS 252 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 3n9n h PHE 253 N 3.27 0.61 0.00 4.41 -1.00 -1.43 0.79 116.94 123.59 3n9n h PHE 253 Ca -0.50 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.32 3n9n h PHE 253 Cb 1.24 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 40.66 3n9n h PHE 253 CO 0.54 0.01 0.00 1.28 -1.61 0.00 0.00 178.31 178.53 3n9n n LEU 254 N -5.01 0.00 -0.13 1.54 4.77 -1.26 -2.43 117.00 114.48 3n9n n LEU 254 Ca 0.19 0.06 0.02 0.00 -0.03 0.00 0.00 56.01 56.25 3n9n n LEU 254 Cb 0.55 -0.06 0.01 0.00 -2.33 0.00 0.00 43.42 41.59 3n9n n LEU 254 CO 0.15 -0.02 0.27 0.00 -1.33 0.00 0.00 177.39 176.46 3n9n n SER 256 N 0.05 0.37 0.00 0.00 3.41 -0.58 -4.65 113.62 112.22 3n9n n SER 256 Ca 0.02 0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.97 3n9n n SER 256 Cb 0.08 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.67 3n9n n SER 256 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3n9n n GLY 257 N 1.43 2.65 3.83 5.00 0.00 -1.26 -4.69 105.19 112.15 3n9n n GLY 257 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 3n9n n GLY 257 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n9n s LEU 258 N 0.00 3.10 0.25 0.99 1.43 -1.26 -5.08 118.68 118.11 3n9n s LEU 258 Ca 0.00 1.56 0.06 0.00 -1.03 0.00 0.00 54.13 54.72 3n9n s LEU 258 Cb 0.00 -4.44 -0.03 0.00 0.03 0.00 0.00 46.19 41.75 3n9n s LEU 258 CO 0.00 -1.40 0.30 -1.61 0.23 0.00 0.00 176.35 173.87 3n9n s GLU 259 N -5.08 3.25 0.38 1.70 2.02 -1.26 -4.91 118.70 114.81 3n9n s GLU 259 Ca 0.58 -0.87 0.14 0.00 0.02 0.00 0.00 54.97 54.84 3n9n s GLU 259 Cb -0.14 -2.77 0.96 0.00 0.10 0.00 0.00 34.13 32.29 3n9n s GLU 259 CO 0.55 0.42 1.83 0.37 0.02 0.00 0.00 175.26 178.45 3n9n h GLN 260 N 1.28 0.52 0.00 1.61 4.15 -1.97 0.40 115.11 121.11 3n9n h GLN 260 Ca -0.51 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.88 3n9n h GLN 260 Cb 1.23 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.81 3n9n h GLN 260 CO 0.61 0.34 0.00 1.97 -1.93 0.00 0.00 178.83 179.82 3n9n n PHE 261 N -4.58 0.81 0.33 3.99 1.16 -1.15 -2.19 117.46 115.83 3n9n n PHE 261 Ca 0.20 0.35 0.11 0.00 -1.87 0.00 0.00 57.45 56.25 3n9n n PHE 261 Cb 0.65 -1.07 -0.06 0.00 -1.61 0.00 0.00 39.48 37.38 3n9n n PHE 261 CO 0.00 0.00 0.00 0.39 -1.87 0.00 0.00 176.76 175.28 3n9n n GLU 262 N -2.27 0.45 -0.36 3.97 1.02 0.13 -4.54 120.64 119.03 3n9n n GLU 262 Ca 0.01 -0.05 0.28 0.00 -0.02 0.00 0.00 57.16 57.38 3n9n n GLU 262 Cb 0.16 -1.60 0.56 0.00 -0.02 0.00 0.00 31.44 30.54 3n9n n GLU 262 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 3n9n h TYR 263 N 0.00 0.59 -0.01 -0.32 0.05 -1.45 0.52 116.97 116.35 3n9n h TYR 263 Ca 0.00 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.80 3n9n h TYR 263 Cb 0.85 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.43 3n9n h TYR 263 CO 0.00 -0.03 -0.73 2.48 -1.05 0.00 0.00 178.16 178.83 3n9n n TYR 264 N -4.63 0.00 0.09 4.88 0.18 -1.26 -4.59 117.16 111.83 3n9n n TYR 264 Ca 0.29 0.00 -0.06 0.00 1.88 0.00 0.00 57.90 60.01 3n9n n TYR 264 Cb 1.07 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 40.05 3n9n n TYR 264 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 3n9n h LEU 265 N 1.19 0.15 -9.07 -3.48 3.38 -1.14 -3.46 115.31 102.88 3n9n h LEU 265 Ca 0.00 -0.12 -0.62 0.00 0.09 0.00 0.00 57.88 57.23 3n9n h LEU 265 Cb 0.62 -0.05 -0.16 0.00 0.09 0.00 0.00 40.66 41.16 3n9n h LEU 265 CO 0.00 0.91 -0.54 -0.31 0.09 0.00 0.00 178.44 178.58 3n9n s TYR 266 N -3.24 3.27 0.12 1.13 2.02 -1.25 -1.56 117.35 117.84 3n9n s TYR 266 Ca -0.02 0.10 0.04 0.00 -0.37 0.00 0.00 57.07 56.82 3n9n s TYR 266 Cb 0.11 -2.15 -0.20 0.00 -0.40 0.00 0.00 41.96 39.32 3n9n s TYR 266 CO 0.81 0.10 1.26 1.49 -1.57 0.00 0.00 175.55 177.64 3n9n h GLU 267 N 7.06 0.07 -5.26 -0.62 4.81 -0.18 -3.45 114.58 117.02 3n9n h GLU 267 Ca -0.38 -0.12 -0.53 0.00 -0.13 0.00 0.00 59.36 58.20 3n9n h GLU 267 Cb 1.17 0.04 -0.31 0.00 0.63 0.00 0.00 28.75 30.28 3n9n h GLU 267 CO 0.69 1.04 -0.83 0.15 -0.73 0.00 0.00 179.01 179.33 3n9n s LYS 268 N -2.75 1.51 -0.29 1.92 1.02 -0.13 -4.98 119.74 116.04 3n9n s LYS 268 Ca -0.00 -0.55 -0.09 0.00 0.02 0.00 0.00 55.97 55.34 3n9n s LYS 268 Cb 0.09 -1.37 0.13 0.00 -0.52 0.00 0.00 37.83 36.17 3n9n s LYS 268 CO 0.83 0.25 0.63 0.12 -0.92 0.00 0.00 175.35 176.26 3n9n s PHE 269 N -0.06 -1.33 0.00 3.18 2.19 -1.26 -1.58 117.98 119.12 3n9n s PHE 269 Ca -0.01 2.21 0.00 0.00 0.33 0.00 0.00 56.93 59.46 3n9n s PHE 269 Cb -0.09 0.74 0.00 0.00 -1.31 0.00 0.00 43.02 42.36 3n9n s PHE 269 CO 0.01 -0.67 0.00 1.19 1.83 0.00 0.00 175.22 177.58 3n9n n PHE 270 N 5.44 0.00 -1.85 10.12 0.99 -1.26 0.23 117.46 131.13 3n9n n PHE 270 Ca -0.11 0.00 -0.30 0.00 -0.00 0.00 0.00 57.45 57.05 3n9n n PHE 270 Cb 0.49 -0.60 0.17 0.00 -1.00 0.00 0.00 39.48 38.55 3n9n n PHE 270 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3n9n h PRO 272 N -1.60 0.26 0.00 0.00 0.11 -1.98 -1.89 132.00 126.90 3n9n h PRO 272 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3n9n h PRO 272 Cb 1.26 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3n9n h PRO 272 CO 0.44 0.17 0.00 1.63 -0.21 0.00 0.00 178.00 180.03 3n9n n LYS 273 N -4.49 0.59 0.00 1.05 4.01 -1.26 -3.68 118.16 114.38 3n9n n LYS 273 Ca 0.02 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.82 3n9n n LYS 273 Cb 0.17 -1.06 0.00 0.00 -0.51 0.00 0.00 35.03 33.63 3n9n n LYS 273 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3n9n h VAL 275 N 0.00 0.90 0.00 0.00 2.07 -1.50 0.83 116.25 118.55 3n9n h VAL 275 Ca 0.00 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.23 3n9n h VAL 275 Cb 0.02 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 3n9n h VAL 275 CO 0.00 0.15 0.00 -2.65 0.02 0.00 0.00 177.57 175.09 3n9n n PRO 276 N -4.72 0.16 -1.14 1.57 -0.02 -1.26 -1.13 135.00 128.47 3n9n n PRO 276 Ca 0.15 0.54 0.03 0.00 -2.02 0.00 0.00 63.50 62.21 3n9n n PRO 276 Cb 0.31 -1.92 0.03 0.00 -0.02 0.00 0.00 33.50 31.91 3n9n n PRO 276 CO 0.00 0.00 0.00 -2.39 1.98 0.00 0.00 175.50 175.09 3n9n n HIS 277 N -2.24 0.00 -0.09 6.00 1.44 0.53 -4.79 115.22 116.07 3n9n n HIS 277 Ca 0.00 -0.44 0.00 0.00 -2.01 0.00 0.00 57.72 55.27 3n9n n HIS 277 Cb 0.12 -0.13 0.00 0.00 0.12 0.00 0.00 29.99 30.10 3n9n n HIS 277 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 3n9n n THR 278 N 0.22 0.00 0.00 0.61 5.66 0.26 -5.03 114.28 115.99 3n9n n THR 278 Ca 0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 3n9n n THR 278 Cb 0.99 0.13 0.00 0.00 -1.55 0.00 0.00 70.33 69.90 3n9n n THR 278 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3n9n n GLY 279 N 0.00 -0.34 3.82 1.09 0.00 -0.28 -4.96 105.19 104.52 3n9n n GLY 279 Ca 0.00 -1.81 -0.32 0.00 0.00 0.00 0.00 46.02 43.89 3n9n n GLY 279 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3n9n s HIS 280 N -1.33 3.20 0.39 1.61 3.76 -1.26 -4.34 115.29 117.32 3n9n s HIS 280 Ca 0.00 1.46 -0.25 0.00 -0.15 0.00 0.00 55.06 56.12 3n9n s HIS 280 Cb 0.00 -2.90 -0.11 0.00 1.11 0.00 0.00 32.58 30.68 3n9n s HIS 280 CO 0.00 -0.91 1.00 0.43 -0.85 0.00 0.00 174.74 174.41 3n9n n SER 281 N -2.23 1.22 -4.54 1.40 7.64 -1.26 -4.95 113.62 110.90 3n9n n SER 281 Ca 0.08 1.06 -0.40 0.00 1.01 0.00 0.00 58.87 60.62 3n9n n SER 281 Cb 0.53 -1.33 -0.10 0.00 -1.01 0.00 0.00 64.21 62.30 3n9n n SER 281 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3n9n s ILE 282 N -1.24 5.27 0.43 0.44 1.09 -0.61 -4.95 121.20 121.62 3n9n s ILE 282 Ca 0.62 -0.11 -0.21 0.00 -1.10 0.00 0.00 60.65 59.84 3n9n s ILE 282 Cb -0.59 -3.71 -0.10 0.00 -1.06 0.00 0.00 42.46 37.00 3n9n s ILE 282 CO 0.58 0.01 0.97 0.00 -0.10 0.00 0.00 174.94 176.40 3n9n s ARG 283 N 1.78 4.17 0.52 2.79 1.70 -1.26 0.52 118.95 129.16 3n9n s ARG 283 Ca 0.07 1.20 -0.20 0.00 -0.47 0.00 0.00 55.73 56.33 3n9n s ARG 283 Cb -0.17 -2.22 -0.09 0.00 -0.57 0.00 0.00 34.95 31.89 3n9n s ARG 283 CO 0.11 -0.09 0.71 0.66 -1.08 0.00 0.00 175.30 175.61 3n9n n TYR 284 N -0.59 -0.00 -2.86 5.89 4.01 -0.60 -4.57 117.16 118.43 3n9n n TYR 284 Ca 0.07 0.49 -0.36 0.00 -0.16 0.00 0.00 57.90 57.95 3n9n n TYR 284 Cb 0.53 -2.05 -0.06 0.00 -0.31 0.00 0.00 39.34 37.45 3n9n n TYR 284 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 3n9n s LYS 285 N -2.09 4.42 -0.44 -0.72 3.01 -1.26 -4.97 119.74 117.69 3n9n s LYS 285 Ca 0.68 1.17 -0.28 0.00 -1.01 0.00 0.00 55.97 56.53 3n9n s LYS 285 Cb -0.49 -2.65 -0.01 0.00 -1.01 0.00 0.00 37.83 33.67 3n9n s LYS 285 CO 0.54 0.22 1.70 0.08 0.51 0.00 0.00 175.35 178.40 3n9n s VAL 286 N -1.75 3.56 -0.16 3.17 1.01 -1.26 -4.56 120.40 120.42 3n9n s VAL 286 Ca 0.52 0.52 0.08 0.00 0.00 0.00 0.00 61.98 63.09 3n9n s VAL 286 Cb -0.16 -3.90 -0.15 0.00 0.00 0.00 0.00 36.38 32.17 3n9n s VAL 286 CO 0.20 -0.68 -0.04 0.52 0.00 0.00 0.00 175.10 175.11 3n9n n VAL 287 N 7.25 1.00 -3.47 2.92 0.31 0.29 -4.82 118.33 121.81 3n9n n VAL 287 Ca 0.20 -0.51 -0.27 0.00 -0.01 0.00 0.00 64.34 63.75 3n9n n VAL 287 Cb 0.49 -0.85 -0.10 0.00 -0.91 0.00 0.00 33.84 32.47 3n9n n VAL 287 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3n9n n ALA 288 N -2.74 2.98 0.16 3.52 0.00 0.80 -4.86 120.51 120.38 3n9n n ALA 288 Ca -0.27 -3.53 0.10 0.00 0.00 0.00 0.00 53.44 49.73 3n9n n ALA 288 Cb 0.91 -0.83 0.50 0.00 0.00 0.00 0.00 19.45 20.04 3n9n n ALA 288 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3n9n n PRO 289 N 2.33 0.12 -0.33 0.00 -0.04 -1.26 -0.98 135.00 134.84 3n9n n PRO 289 Ca 0.27 0.60 0.09 0.00 -0.04 0.00 0.00 63.50 64.42 3n9n n PRO 289 Cb 0.46 -1.89 0.26 0.00 -0.04 0.00 0.00 33.50 32.29 3n9n n PRO 289 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 3n9n n HIS 290 N -2.15 0.85 -4.29 0.54 1.44 -1.26 -1.69 115.22 108.66 3n9n n HIS 290 Ca -0.01 -0.40 -0.20 0.00 -2.01 0.00 0.00 57.72 55.10 3n9n n HIS 290 Cb 0.05 -0.04 -0.13 0.00 0.12 0.00 0.00 29.99 29.99 3n9n n HIS 290 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 3n9n s ARG 291 N -1.34 0.96 0.20 -1.40 1.81 -0.15 -0.86 118.95 118.17 3n9n s ARG 291 Ca 0.39 -0.93 -0.11 0.00 -1.72 0.00 0.00 55.73 53.36 3n9n s ARG 291 Cb 0.21 -1.02 0.16 0.00 -0.45 0.00 0.00 34.95 33.85 3n9n s ARG 291 CO 0.25 0.24 1.84 1.88 -0.68 0.00 0.00 175.30 178.83 3n9n h TYR 292 N 4.50 0.77 -0.47 -0.53 0.99 -1.84 -2.62 116.97 117.77 3n9n h TYR 292 Ca -0.41 0.02 -0.71 0.00 2.00 0.00 0.00 58.73 59.63 3n9n h TYR 292 Cb 1.18 -0.25 -0.07 0.00 1.00 0.00 0.00 36.73 38.59 3n9n h TYR 292 CO 0.59 0.45 2.69 0.54 -0.00 0.00 0.00 178.16 182.43 3n9n n ARG 293 N -4.69 3.05 0.00 4.88 1.74 -1.26 -4.38 116.66 116.00 3n9n n ARG 293 Ca 0.06 -2.93 0.05 0.00 -0.77 0.00 0.00 57.85 54.26 3n9n n ARG 293 Cb 0.07 -3.30 0.24 0.00 -1.02 0.00 0.00 32.46 28.45 3n9n n ARG 293 CO 0.00 0.00 0.00 -2.67 -1.52 0.00 0.00 177.63 173.44 3n9n n TRP 294 N 6.50 0.00 0.65 -1.55 4.27 -0.99 -2.51 117.44 123.82 3n9n n TRP 294 Ca 0.49 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 54.20 3n9n n TRP 294 Cb 0.41 -0.42 0.11 0.00 -1.36 0.00 0.00 31.31 30.05 3n9n n TRP 294 CO 0.00 0.00 0.00 2.48 -2.29 0.00 0.00 177.69 177.88 3n9n n TYR 295 N -1.42 0.11 -3.66 -2.67 0.18 -1.26 -0.14 117.16 108.31 3n9n n TYR 295 Ca 0.03 -0.07 -0.39 0.00 1.88 0.00 0.00 57.90 59.35 3n9n n TYR 295 Cb 0.11 -0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 38.95 3n9n n TYR 295 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 3n9n s SER 296 N -1.52 5.57 0.61 9.48 0.15 -1.04 -4.78 113.70 122.17 3n9n s SER 296 Ca 0.25 -1.03 0.36 0.00 0.70 0.00 0.00 55.95 56.23 3n9n s SER 296 Cb 0.17 -1.97 1.96 0.00 -1.71 0.00 0.00 66.02 64.48 3n9n s SER 296 CO 0.25 -0.36 2.24 -0.65 1.20 0.00 0.00 173.24 175.92 3n9n h PRO 297 N 8.35 0.00 0.00 5.44 0.11 -1.91 -1.58 132.00 142.42 3n9n h PRO 297 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 3n9n h PRO 297 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3n9n h PRO 297 CO 0.64 0.03 0.00 0.09 -0.21 0.00 0.00 178.00 178.55 3n9n n ASN 298 N -3.38 0.00 -0.34 -2.05 3.02 -1.26 -2.70 115.26 108.54 3n9n n ASN 298 Ca -0.02 0.18 0.05 0.00 -0.03 0.00 0.00 54.58 54.76 3n9n n ASN 298 Cb 0.14 -0.36 0.02 0.00 -0.61 0.00 0.00 39.78 38.96 3n9n n ASN 298 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3n9n n GLU 299 N -1.36 1.30 -0.35 3.52 1.02 -0.59 -4.63 120.64 119.55 3n9n n GLU 299 Ca 0.08 -0.88 0.25 0.00 -0.02 0.00 0.00 57.16 56.59 3n9n n GLU 299 Cb 0.19 -1.15 0.50 0.00 -0.02 0.00 0.00 31.44 30.95 3n9n n GLU 299 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3n9n h LYS 300 N 1.66 0.30 -0.00 3.49 1.57 -1.59 -0.83 116.57 121.15 3n9n h LYS 300 Ca 0.00 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3n9n h LYS 300 Cb 0.41 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.65 3n9n h LYS 300 CO 0.00 0.20 -0.38 -2.39 -0.57 0.00 0.00 179.45 176.30 3n9n n HIS 301 N -4.97 0.00 -1.87 -1.35 1.44 -1.26 -4.92 115.22 102.28 3n9n n HIS 301 Ca 0.32 0.00 -0.30 0.00 -2.01 0.00 0.00 57.72 55.73 3n9n n HIS 301 Cb 1.03 -0.21 0.19 0.00 0.12 0.00 0.00 29.99 31.11 3n9n n HIS 301 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 3n9n s LEU 302 N -2.81 2.57 0.67 2.39 1.43 -0.32 -5.04 118.68 117.57 3n9n s LEU 302 Ca 0.16 0.29 -0.11 0.00 -1.03 0.00 0.00 54.13 53.45 3n9n s LEU 302 Cb 0.18 -2.31 -0.01 0.00 0.03 0.00 0.00 46.19 44.08 3n9n s LEU 302 CO 0.62 -2.83 1.05 -0.83 0.23 0.00 0.00 176.35 174.59 3n9n s GLY 303 N -4.82 1.67 -0.06 -3.19 0.00 -1.26 -4.99 107.32 94.68 3n9n s GLY 303 Ca 0.74 0.03 -0.30 0.00 0.00 0.00 0.00 44.72 45.19 3n9n s GLY 303 CO 0.53 0.33 1.59 -0.42 0.00 0.00 0.00 173.10 175.14 3n9n s ILE 304 N -3.08 3.64 -0.02 0.90 1.01 -1.26 -4.76 121.20 117.63 3n9n s ILE 304 Ca 0.57 0.81 -0.18 0.00 0.00 0.00 0.00 60.65 61.85 3n9n s ILE 304 Cb -0.13 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.76 3n9n s ILE 304 CO 0.54 -0.06 0.50 -1.61 0.00 0.00 0.00 174.94 174.31 3n9n s GLU 305 N 3.79 4.19 -0.00 2.79 2.02 -0.04 -4.29 118.70 127.16 3n9n s GLU 305 Ca 0.71 0.55 -0.30 0.00 0.02 0.00 0.00 54.97 55.94 3n9n s GLU 305 Cb -0.32 -3.32 -0.05 0.00 0.10 0.00 0.00 34.13 30.54 3n9n s GLU 305 CO 0.28 0.45 1.34 0.08 0.02 0.00 0.00 175.26 177.42 3n9n s VAL 306 N -0.36 3.84 -0.53 2.63 1.01 -0.27 0.44 120.40 127.16 3n9n s VAL 306 Ca 0.27 1.22 0.03 0.00 0.00 0.00 0.00 61.98 63.50 3n9n s VAL 306 Cb -0.17 -3.79 0.13 0.00 0.00 0.00 0.00 36.38 32.56 3n9n s VAL 306 CO 0.14 0.01 0.28 -0.83 0.00 0.00 0.00 175.10 174.70 3n9n s GLY 307 N 1.69 2.42 1.16 4.51 0.00 -1.26 -4.95 107.32 110.88 3n9n s GLY 307 Ca 0.62 -3.21 -0.16 0.00 0.00 0.00 0.00 44.72 41.97 3n9n s GLY 307 CO 0.26 1.02 1.06 -1.35 0.00 0.00 0.00 173.10 174.09 3n9n s SER 308 N 0.01 1.18 0.23 1.64 1.04 0.17 -4.60 113.70 113.37 3n9n s SER 308 Ca 0.16 1.03 -0.07 0.00 0.48 0.00 0.00 55.95 57.55 3n9n s SER 308 Cb -0.24 -1.56 0.37 0.00 0.10 0.00 0.00 66.02 64.68 3n9n s SER 308 CO -0.01 -4.01 1.73 0.50 0.98 0.00 0.00 173.24 172.43 3n9n h LYS 309 N -2.49 0.40 -0.43 4.02 3.64 -1.73 0.32 116.57 120.30 3n9n h LYS 309 Ca -0.52 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 58.79 3n9n h LYS 309 Cb 1.32 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 33.04 3n9n h LYS 309 CO 0.45 0.26 0.11 1.15 -2.27 0.00 0.00 179.45 179.15 3n9n h THR 310 N 0.41 1.23 -0.28 1.00 2.02 -1.68 -2.08 112.91 113.53 3n9n h THR 310 Ca 0.36 -0.80 -0.01 0.00 0.77 0.00 0.00 66.41 66.73 3n9n h THR 310 Cb 0.51 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 3n9n h THR 310 CO -0.37 0.28 0.15 -0.25 0.37 0.00 0.00 175.52 175.70 3n9n h TRP 311 N 0.56 0.39 -0.26 3.16 7.01 -1.59 -2.44 115.95 122.78 3n9n h TRP 311 Ca 0.14 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.08 3n9n h TRP 311 Cb 0.31 -0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.24 3n9n h TRP 311 CO 0.02 0.34 -0.01 0.82 -2.79 0.00 0.00 178.44 176.82 3n9n h ILE 312 N 0.34 1.26 -0.62 2.65 2.04 -0.94 0.36 117.51 122.59 3n9n h ILE 312 Ca 0.10 -0.93 0.13 0.00 1.00 0.00 0.00 64.86 65.16 3n9n h ILE 312 Cb 0.08 1.35 -0.10 0.00 -0.74 0.00 0.00 36.82 37.41 3n9n h ILE 312 CO -0.01 0.29 0.01 -0.08 0.00 0.00 0.00 178.15 178.36 3n9n h GLU 313 N 0.25 0.12 -0.01 2.37 4.57 -1.31 0.81 114.58 121.37 3n9n h GLU 313 Ca 0.07 -0.01 -0.20 0.00 -1.18 0.00 0.00 59.36 58.04 3n9n h GLU 313 Cb 0.43 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.99 3n9n h GLU 313 CO 0.01 0.08 -0.86 0.22 -1.18 0.00 0.00 179.01 177.29 3n9n h ASP 314 N 0.13 0.39 -0.37 1.04 -0.00 -1.24 -3.17 116.42 113.18 3n9n h ASP 314 Ca 0.32 -0.30 -0.05 0.00 -0.00 0.00 0.00 57.03 57.00 3n9n h ASP 314 Cb 0.52 -0.12 -0.02 0.00 -0.00 0.00 0.00 39.33 39.72 3n9n h ASP 314 CO -0.52 1.08 0.06 0.15 -0.00 0.00 0.00 179.24 180.01 3n9n h PHE 315 N 0.18 0.73 -0.02 0.28 3.04 0.35 -2.09 116.94 119.42 3n9n h PHE 315 Ca -0.05 -0.07 0.00 0.00 3.98 0.00 0.00 57.97 61.83 3n9n h PHE 315 Cb 1.48 -0.21 -0.00 0.00 2.56 0.00 0.00 35.95 39.77 3n9n h PHE 315 CO 0.04 0.65 0.09 0.82 -2.02 0.00 0.00 178.31 177.90 3n9n h ILE 316 N 0.68 0.08 0.00 1.41 2.04 -0.87 1.00 117.51 121.85 3n9n h ILE 316 Ca 0.15 0.00 -0.15 0.00 1.00 0.00 0.00 64.86 65.86 3n9n h ILE 316 Cb 0.33 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 3n9n h ILE 316 CO 0.01 0.00 -1.66 0.35 0.00 0.00 0.00 178.15 176.85 3n9n n THR 317 N -3.15 0.92 0.43 -0.27 -2.24 -0.79 -4.19 114.28 104.99 3n9n n THR 317 Ca -0.02 -0.67 0.04 0.00 -2.27 0.00 0.00 64.05 61.13 3n9n n THR 317 Cb 0.16 -0.50 -0.03 0.00 -2.10 0.00 0.00 70.33 67.86 3n9n n THR 317 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3n9n n ARG 318 N -2.71 3.29 -0.34 -0.78 1.85 -1.09 -4.74 116.66 112.14 3n9n n ARG 318 Ca -0.12 -0.22 0.03 0.00 -1.00 0.00 0.00 57.85 56.54 3n9n n ARG 318 Cb 0.81 -0.98 0.10 0.00 -1.05 0.00 0.00 32.46 31.33 3n9n n ARG 318 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 3n9n h GLU 319 N 0.40 -0.01 0.00 2.89 4.22 -0.97 -0.98 114.58 120.13 3n9n h GLU 319 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 3n9n h GLU 319 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 3n9n h GLU 319 CO 0.00 -0.01 0.00 0.27 -2.18 0.00 0.00 179.01 177.09 3n9n n ASN 320 N -5.55 0.00 0.06 1.04 2.04 -1.26 -2.48 115.26 109.11 3n9n n ASN 320 Ca 0.13 -1.14 0.13 0.00 -0.44 0.00 0.00 54.58 53.25 3n9n n ASN 320 Cb 0.45 0.00 0.33 0.00 -2.53 0.00 0.00 39.78 38.02 3n9n n ASN 320 CO 0.00 0.00 0.00 0.35 -0.44 0.00 0.00 177.26 177.17 3n9n n THR 321 N -0.68 0.34 -2.14 5.53 -2.24 -0.37 -4.85 114.28 109.87 3n9n n THR 321 Ca 0.06 -0.20 -0.42 0.00 -2.27 0.00 0.00 64.05 61.22 3n9n n THR 321 Cb 0.03 -0.29 -0.03 0.00 -2.10 0.00 0.00 70.33 67.94 3n9n n THR 321 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3n9n s VAL 322 N -3.10 3.17 0.58 2.28 0.11 -1.03 -4.95 120.40 117.45 3n9n s VAL 322 Ca 0.09 0.87 -0.20 0.00 -2.93 0.00 0.00 61.98 59.81 3n9n s VAL 322 Cb 0.14 -3.56 -0.04 0.00 -1.53 0.00 0.00 36.38 31.40 3n9n s VAL 322 CO 0.65 0.08 1.27 -2.16 -3.33 0.00 0.00 175.10 171.61 3n9n s PRO 323 N 0.76 3.01 0.68 1.54 0.04 -1.26 -4.41 135.00 135.35 3n9n s PRO 323 Ca 0.63 2.00 -0.13 0.00 0.04 0.00 0.00 61.00 63.54 3n9n s PRO 323 Cb -0.38 -2.06 0.01 0.00 0.04 0.00 0.00 34.50 32.11 3n9n s PRO 323 CO 0.33 -1.22 1.08 -1.12 0.04 0.00 0.00 177.00 176.11 3n9n s SER 324 N -1.33 5.17 0.80 6.66 0.01 -1.26 -0.54 113.70 123.22 3n9n s SER 324 Ca 0.75 1.84 -0.11 0.00 1.31 0.00 0.00 55.95 59.75 3n9n s SER 324 Cb -0.35 -2.53 0.07 0.00 0.21 0.00 0.00 66.02 63.42 3n9n s SER 324 CO 0.39 -1.58 1.09 -2.84 0.41 0.00 0.00 173.24 170.71 3n9n s PRO 325 N -4.46 2.07 0.93 12.44 0.02 -1.26 -4.75 135.00 139.99 3n9n s PRO 325 Ca 0.63 0.83 -0.13 0.00 0.02 0.00 0.00 61.00 62.35 3n9n s PRO 325 Cb -0.17 -1.90 0.20 0.00 0.02 0.00 0.00 34.50 32.65 3n9n s PRO 325 CO 0.46 -1.68 1.27 0.95 -0.33 0.00 0.00 177.00 177.68 3n9n s THR 326 N -3.04 2.01 -0.06 0.99 -4.23 -1.26 -4.89 115.64 105.16 3n9n s THR 326 Ca 0.61 -0.13 0.20 0.00 -1.18 0.00 0.00 61.69 61.19 3n9n s THR 326 Cb -0.16 -2.88 0.18 0.00 1.34 0.00 0.00 72.50 70.99 3n9n s THR 326 CO 0.55 0.00 1.65 0.44 -0.54 0.00 0.00 174.62 176.72 3n9n h ASP 327 N -1.48 0.00 1.05 3.99 3.32 -1.98 -2.52 116.42 118.80 3n9n h ASP 327 Ca -0.42 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.63 3n9n h ASP 327 Cb 1.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3n9n h ASP 327 CO 0.35 0.30 -0.47 0.44 -1.72 0.00 0.00 179.24 178.14 3n9n h ASP 328 N 0.00 0.00 0.00 6.45 3.32 -2.00 -3.37 116.42 120.82 3n9n h ASP 328 Ca -0.00 -0.15 -0.11 0.00 0.02 0.00 0.00 57.03 56.79 3n9n h ASP 328 Cb 1.03 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.57 3n9n h ASP 328 CO 0.04 0.07 -0.87 -0.62 -1.72 0.00 0.00 179.24 176.14 3n9n n GLU 329 N -2.20 0.50 -4.78 3.56 1.02 -1.15 -4.70 120.64 112.90 3n9n n GLU 329 Ca 0.04 0.55 -0.25 0.00 -0.02 0.00 0.00 57.16 57.48 3n9n n GLU 329 Cb 0.44 -1.72 -0.15 0.00 -0.02 0.00 0.00 31.44 29.99 3n9n n GLU 329 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3n9n s VAL 330 N -2.30 1.40 -0.18 2.62 -7.23 -0.96 -1.46 120.40 112.29 3n9n s VAL 330 Ca -0.21 -0.82 -0.00 0.00 -1.81 0.00 0.00 61.98 59.13 3n9n s VAL 330 Cb 0.04 -1.18 0.01 0.00 0.56 0.00 0.00 36.38 35.81 3n9n s VAL 330 CO 0.39 0.34 -0.15 0.00 -0.31 0.00 0.00 175.10 175.37 3n9n s ILE 332 N 1.25 5.36 0.17 0.00 1.01 -1.26 -1.92 121.20 125.80 3n9n s ILE 332 Ca 0.03 0.38 0.07 0.00 0.00 0.00 0.00 60.65 61.13 3n9n s ILE 332 Cb -0.14 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 3n9n s ILE 332 CO -0.08 0.43 -0.14 0.68 0.00 0.00 0.00 174.94 175.83 3n9n s VAL 333 N 0.31 1.55 0.05 2.92 -7.23 0.24 -4.96 120.40 113.28 3n9n s VAL 333 Ca 0.13 -2.06 -0.09 0.00 -1.81 0.00 0.00 61.98 58.15 3n9n s VAL 333 Cb -0.12 -1.89 -0.31 0.00 0.56 0.00 0.00 36.38 34.61 3n9n s VAL 333 CO 0.02 -0.57 1.05 -0.33 -0.31 0.00 0.00 175.10 174.95 3n9n h GLU 334 N 2.84 0.38 -3.46 4.82 4.39 -1.93 -1.43 114.58 120.20 3n9n h GLU 334 Ca -0.38 -0.65 -0.10 0.00 0.34 0.00 0.00 59.36 58.56 3n9n h GLU 334 Cb 1.21 0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 30.06 3n9n h GLU 334 CO 0.59 1.31 0.07 0.16 -1.16 0.00 0.00 179.01 179.98 3n9n s ASP 335 N -7.32 0.29 0.51 1.42 3.84 -1.26 -0.39 116.67 113.77 3n9n s ASP 335 Ca -0.07 -1.19 0.22 0.00 -0.00 0.00 0.00 52.55 51.51 3n9n s ASP 335 Cb 0.06 0.75 1.36 0.00 -1.38 0.00 0.00 42.92 43.71 3n9n s ASP 335 CO 0.91 -1.47 2.10 1.23 -0.00 0.00 0.00 175.17 177.94 3n9n h GLY 336 N 2.06 0.00 1.03 2.12 0.00 -0.66 -1.82 103.07 105.81 3n9n h GLY 336 Ca -0.29 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 46.88 3n9n h GLY 336 CO 0.38 0.00 -0.45 -0.97 0.00 0.00 0.00 176.54 175.50 3n9n h TYR 337 N 0.00 0.93 -0.33 5.60 0.05 -1.77 -1.43 116.97 120.03 3n9n h TYR 337 Ca -0.00 -0.33 -0.10 0.00 0.05 0.00 0.00 58.73 58.35 3n9n h TYR 337 Cb 0.20 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 3n9n h TYR 337 CO 0.00 1.12 -0.17 1.49 -1.05 0.00 0.00 178.16 179.55 3n9n h GLU 338 N 0.48 0.70 -0.31 4.88 4.81 -1.85 -2.24 114.58 121.04 3n9n h GLU 338 Ca 0.01 -0.31 0.07 0.00 -0.13 0.00 0.00 59.36 59.00 3n9n h GLU 338 Cb 1.05 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 30.34 3n9n h GLU 338 CO 0.10 0.91 -0.32 0.35 -0.73 0.00 0.00 179.01 179.33 3n9n h PHE 339 N 0.47 -0.88 -0.45 0.92 3.57 -1.28 0.30 116.94 119.59 3n9n h PHE 339 Ca 0.07 0.05 0.09 0.00 3.53 0.00 0.00 57.97 61.72 3n9n h PHE 339 Cb 0.71 0.43 -0.09 0.00 2.79 0.00 0.00 35.95 39.79 3n9n h PHE 339 CO 0.06 -0.38 -0.19 -0.09 -2.23 0.00 0.00 178.31 175.48 3n9n h ARG 340 N -0.29 -0.09 0.05 1.11 2.43 -1.09 0.66 114.38 117.15 3n9n h ARG 340 Ca 0.15 0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.34 3n9n h ARG 340 Cb 0.53 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 3n9n h ARG 340 CO -0.47 -0.06 -0.14 0.00 -1.51 0.00 0.00 179.97 177.79 3n9n h ARG 341 N -0.10 -0.25 -0.08 0.20 3.08 -0.72 -1.31 114.38 115.21 3n9n h ARG 341 Ca 0.22 0.02 -0.11 0.00 0.07 0.00 0.00 59.98 60.18 3n9n h ARG 341 Cb 0.43 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.53 3n9n h ARG 341 CO -0.52 -0.17 -0.45 0.93 -1.07 0.00 0.00 179.97 178.70 3n9n h GLU 342 N -0.26 0.18 -0.34 0.04 4.39 -0.36 -1.66 114.58 116.58 3n9n h GLU 342 Ca 0.03 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 3n9n h GLU 342 Cb 0.29 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.93 3n9n h GLU 342 CO -0.10 0.60 0.17 0.35 -1.16 0.00 0.00 179.01 178.86 3n9n h PHE 343 N 0.15 0.48 -0.16 4.33 -0.00 0.54 -2.80 116.94 119.48 3n9n h PHE 343 Ca 0.01 -0.02 -0.11 0.00 -0.00 0.00 0.00 57.97 57.85 3n9n h PHE 343 Cb 0.85 -0.15 -0.01 0.00 -0.00 0.00 0.00 35.95 36.64 3n9n h PHE 343 CO 0.01 0.41 -0.39 0.93 -0.00 0.00 0.00 178.31 179.27 3n9n h GLU 344 N 0.42 0.35 -0.71 1.11 3.07 -0.95 0.08 114.58 117.94 3n9n h GLU 344 Ca 0.12 -0.16 0.02 0.00 -0.50 0.00 0.00 59.36 58.83 3n9n h GLU 344 Cb 0.10 -0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 27.97 3n9n h GLU 344 CO -0.02 0.68 0.47 0.87 -1.40 0.00 0.00 179.01 179.62 3n9n h LYS 345 N 0.29 0.89 -0.01 2.33 1.57 -1.14 -2.56 116.57 117.94 3n9n h LYS 345 Ca 0.03 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3n9n h LYS 345 Cb 0.82 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.92 3n9n h LYS 345 CO 0.07 0.59 -0.05 1.28 -0.57 0.00 0.00 179.45 180.77 3n9n n LEU 346 N -4.44 0.82 0.00 2.94 4.77 -1.04 -4.88 117.00 115.17 3n9n n LEU 346 Ca 0.08 -0.23 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 3n9n n LEU 346 Cb 0.07 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 3n9n n LEU 346 CO 0.36 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3n9n n GLY 347 N 1.17 1.02 7.00 -0.72 0.00 -0.96 -4.72 105.19 107.97 3n9n n GLY 347 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 3n9n n GLY 347 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n9n n GLY 348 N -1.60 0.08 0.27 -0.02 0.00 -0.01 -3.39 105.19 100.52 3n9n n GLY 348 Ca 0.00 -0.96 0.02 0.00 0.00 0.00 0.00 46.02 45.08 3n9n n GLY 348 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n9n h ALA 349 N -0.58 1.54 -0.12 4.61 0.00 -1.96 -2.63 119.26 120.13 3n9n h ALA 349 Ca 0.00 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3n9n h ALA 349 Cb 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3n9n h ALA 349 CO 0.00 0.34 -0.15 -0.44 0.00 0.00 0.00 179.25 179.00 3n9n h ASP 350 N 0.40 0.19 -1.58 0.00 3.32 -1.85 -2.88 116.42 114.02 3n9n h ASP 350 Ca 0.09 -0.04 -0.59 0.00 0.02 0.00 0.00 57.03 56.52 3n9n h ASP 350 Cb 0.21 -0.05 -0.42 0.00 0.22 0.00 0.00 39.33 39.29 3n9n h ASP 350 CO 0.00 0.36 -0.73 -3.20 -1.72 0.00 0.00 179.24 173.95 3n9n n ASN 351 N -4.27 4.64 -4.52 6.45 2.85 -1.01 -4.69 115.26 114.72 3n9n n ASN 351 Ca -0.01 -3.70 -0.42 0.00 -0.11 0.00 0.00 54.58 50.34 3n9n n ASN 351 Cb 0.27 -0.47 -0.09 0.00 1.24 0.00 0.00 39.78 40.73 3n9n n ASN 351 CO 0.00 0.00 0.00 0.86 -2.11 0.00 0.00 177.26 176.01 3n9n s TRP 352 N -3.53 3.19 0.00 1.20 -0.00 -1.09 -4.65 118.94 114.06 3n9n s TRP 352 Ca 0.48 -0.18 0.00 0.00 -0.00 0.00 0.00 56.10 56.40 3n9n s TRP 352 Cb 0.39 -2.78 0.00 0.00 -0.00 0.00 0.00 33.47 31.08 3n9n s TRP 352 CO -0.18 -0.56 0.00 0.41 -0.00 0.00 0.00 176.95 176.61 3n9n n GLY 353 N 5.02 0.00 3.84 5.86 0.00 -1.26 -4.74 105.19 113.91 3n9n n GLY 353 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.69 3n9n n GLY 353 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n9n s LYS 354 N -1.28 3.02 0.24 1.61 -2.85 -1.26 -4.86 119.74 114.35 3n9n s LYS 354 Ca 0.00 -0.87 -0.18 0.00 -1.00 0.00 0.00 55.97 53.92 3n9n s LYS 354 Cb 0.00 -2.69 -0.08 0.00 -2.06 0.00 0.00 37.83 33.00 3n9n s LYS 354 CO 0.00 0.46 0.71 0.54 0.10 0.00 0.00 175.35 177.17 3n9n s VAL 355 N -1.86 4.61 -0.04 1.79 0.11 -0.53 -4.53 120.40 119.95 3n9n s VAL 355 Ca 0.32 1.18 0.06 0.00 -2.93 0.00 0.00 61.98 60.61 3n9n s VAL 355 Cb -0.10 -3.80 -0.02 0.00 -1.53 0.00 0.00 36.38 30.94 3n9n s VAL 355 CO 0.25 0.13 -0.21 -0.36 -3.33 0.00 0.00 175.10 171.58 3n9n s PHE 356 N -1.61 2.51 -0.16 1.54 0.08 -0.49 -0.83 117.98 119.01 3n9n s PHE 356 Ca 0.45 -0.36 -0.01 0.00 0.12 0.00 0.00 56.93 57.13 3n9n s PHE 356 Cb -0.15 -1.57 -0.01 0.00 -0.57 0.00 0.00 43.02 40.72 3n9n s PHE 356 CO 0.20 0.03 -0.13 1.41 -0.10 0.00 0.00 175.22 176.63 3n9n s MET 357 N -0.59 3.28 -0.27 0.44 -2.45 -0.81 -0.61 119.30 118.30 3n9n s MET 357 Ca 0.09 -0.71 -0.02 0.00 -1.25 0.00 0.00 55.69 53.79 3n9n s MET 357 Cb -0.11 -2.70 0.03 0.00 1.25 0.00 0.00 34.83 33.30 3n9n s MET 357 CO 0.00 0.01 -0.03 0.08 1.05 0.00 0.00 175.02 176.13 3n9n s VAL 358 N 0.86 3.03 0.11 10.11 1.01 0.50 -0.59 120.40 135.43 3n9n s VAL 358 Ca -0.04 -1.07 -0.14 0.00 0.00 0.00 0.00 61.98 60.73 3n9n s VAL 358 Cb -0.15 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.58 3n9n s VAL 358 CO -0.00 0.11 1.46 0.11 0.00 0.00 0.00 175.10 176.77 3n9n h LYS 359 N 8.03 0.78 -5.27 2.72 1.57 -1.31 -0.20 116.57 122.89 3n9n h LYS 359 Ca -0.30 -0.39 -0.66 0.00 -1.87 0.00 0.00 60.65 57.43 3n9n h LYS 359 Cb 1.10 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 33.08 3n9n h LYS 359 CO 0.57 1.01 -0.87 0.34 -0.57 0.00 0.00 179.45 179.92 3n9n s ASP 360 N -6.58 2.96 0.00 0.86 2.15 0.48 -3.80 116.67 112.73 3n9n s ASP 360 Ca -0.12 -0.53 0.26 0.00 0.43 0.00 0.00 52.55 52.58 3n9n s ASP 360 Cb 0.10 -1.35 1.19 0.00 -0.30 0.00 0.00 42.92 42.56 3n9n s ASP 360 CO 0.84 0.15 1.85 1.15 -0.17 0.00 0.00 175.17 178.99 3n9n n MET 361 N 3.54 0.16 -1.69 4.34 0.00 -1.26 -2.93 117.12 119.28 3n9n n MET 361 Ca -0.19 0.05 -0.43 0.00 0.00 0.00 0.00 57.70 57.12 3n9n n MET 361 Cb 0.53 -1.50 -0.03 0.00 0.00 0.00 0.00 33.22 32.21 3n9n n MET 361 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 3n9n n ASP 362 N -1.41 3.86 0.00 3.17 2.03 -1.26 -1.15 116.55 121.79 3n9n n ASP 362 Ca 0.09 1.00 0.00 0.00 0.52 0.00 0.00 54.79 56.40 3n9n n ASP 362 Cb 0.26 -1.52 0.00 0.00 -0.72 0.00 0.00 41.12 39.14 3n9n n ASP 362 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3n9n n GLY 363 N 4.12 0.54 0.13 0.27 0.00 -1.26 -0.48 105.19 108.52 3n9n n GLY 363 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 3n9n n GLY 363 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3n9n h LEU 364 N 0.00 0.00 -0.56 0.99 3.38 -1.38 -3.40 115.31 114.34 3n9n h LEU 364 Ca 0.00 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.55 3n9n h LEU 364 Cb 0.00 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.82 3n9n h LEU 364 CO 0.00 0.00 -0.69 0.59 0.09 0.00 0.00 178.44 178.43 3n9n n ASN 365 N -2.46 -5.86 -4.28 -0.43 3.02 -1.26 -3.28 115.26 100.70 3n9n n ASN 365 Ca 0.05 -0.56 -0.39 0.00 -0.03 0.00 0.00 54.58 53.65 3n9n n ASN 365 Cb 0.44 -4.65 -0.12 0.00 -0.61 0.00 0.00 39.78 34.85 3n9n n ASN 365 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 3n9n s MET 366 N -6.30 2.61 -0.05 3.52 1.75 -1.26 -2.60 119.30 116.96 3n9n s MET 366 Ca 0.56 -1.26 -0.30 0.00 -1.25 0.00 0.00 55.69 53.44 3n9n s MET 366 Cb -0.26 -3.57 -0.05 0.00 2.84 0.00 0.00 34.83 33.78 3n9n s MET 366 CO 0.70 -0.76 1.58 0.99 -0.65 0.00 0.00 175.02 176.88 3n9n s THR 367 N 1.41 3.64 0.07 10.11 2.01 -1.25 -4.92 115.64 126.71 3n9n s THR 367 Ca 0.00 0.84 0.01 0.00 0.31 0.00 0.00 61.69 62.85 3n9n s THR 367 Cb -0.20 -3.54 -0.04 0.00 0.01 0.00 0.00 72.50 68.73 3n9n s THR 367 CO 0.03 -0.06 -0.05 -0.04 -0.69 0.00 0.00 174.62 173.80 3n9n s MET 368 N 3.68 0.69 0.66 4.92 -1.94 -1.24 -0.37 119.30 125.69 3n9n s MET 368 Ca 0.70 -1.18 -0.18 0.00 -1.71 0.00 0.00 55.69 53.32 3n9n s MET 368 Cb -0.32 -0.06 -0.01 0.00 2.01 0.00 0.00 34.83 36.45 3n9n s MET 368 CO 0.27 -0.04 1.29 -2.14 -0.01 0.00 0.00 175.02 174.39 3n9n s PRO 369 N -3.43 2.50 -0.01 2.03 0.02 -1.15 -4.92 135.00 130.05 3n9n s PRO 369 Ca 0.06 2.04 -0.30 0.00 0.02 0.00 0.00 61.00 62.82 3n9n s PRO 369 Cb 0.03 -1.84 -0.03 0.00 0.02 0.00 0.00 34.50 32.68 3n9n s PRO 369 CO -0.06 -1.63 1.04 0.21 -0.33 0.00 0.00 177.00 176.23 3n9n s LYS 370 N -3.43 4.50 0.58 5.54 2.47 -1.26 -4.96 119.74 123.17 3n9n s LYS 370 Ca 0.82 1.50 -0.18 0.00 -1.56 0.00 0.00 55.97 56.55 3n9n s LYS 370 Cb -0.37 -3.46 -0.12 0.00 -1.46 0.00 0.00 37.83 32.42 3n9n s LYS 370 CO 0.40 -0.17 0.11 -2.30 0.16 0.00 0.00 175.35 173.55 3n9n n PRO 371 N 4.21 0.19 0.00 4.03 -0.02 -1.26 -1.75 135.00 140.40 3n9n n PRO 371 Ca 0.07 0.08 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3n9n n PRO 371 Cb 0.49 -1.31 0.00 0.00 -0.02 0.00 0.00 33.50 32.67 3n9n n PRO 371 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3n9n n GLY 372 N 2.25 2.71 3.73 -1.23 0.00 -1.26 -5.05 105.19 106.34 3n9n n GLY 372 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3n9n n GLY 372 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3n9n s PHE 373 N -2.65 3.38 0.00 1.61 5.36 -0.72 -4.98 117.98 119.98 3n9n s PHE 373 Ca 0.00 1.28 0.00 0.00 -0.96 0.00 0.00 56.93 57.25 3n9n s PHE 373 Cb 0.00 -3.49 0.00 0.00 -0.34 0.00 0.00 43.02 39.19 3n9n s PHE 373 CO 0.00 -1.51 0.00 -0.40 -1.46 0.00 0.00 175.22 171.85 3n9n n ASP 374 N 3.19 0.00 -0.35 6.13 5.75 -1.26 -4.96 116.55 125.05 3n9n n ASP 374 Ca 0.07 -0.33 0.03 0.00 -0.01 0.00 0.00 54.79 54.54 3n9n n ASP 374 Cb 0.45 0.00 0.17 0.00 -1.03 0.00 0.00 41.12 40.71 3n9n n ASP 374 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3n9n h LEU 375 N 0.00 0.97 -0.62 -2.12 5.85 -1.98 -2.56 115.31 114.85 3n9n h LEU 375 Ca 0.00 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.82 3n9n h LEU 375 Cb 0.00 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.78 3n9n h LEU 375 CO 0.00 0.60 0.28 -0.33 -0.34 0.00 0.00 178.44 178.65 3n9n h GLU 376 N 1.10 0.49 -0.79 1.25 4.39 -1.97 0.05 114.58 119.10 3n9n h GLU 376 Ca 0.43 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 60.06 3n9n h GLU 376 Cb 0.21 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 3n9n h GLU 376 CO -0.19 0.32 0.35 -0.44 -1.16 0.00 0.00 179.01 177.90 3n9n h ASP 377 N 0.50 1.05 0.19 1.42 5.19 -1.84 -2.11 116.42 120.82 3n9n h ASP 377 Ca 0.30 -0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.56 3n9n h ASP 377 Cb 0.30 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 39.54 3n9n h ASP 377 CO -0.25 0.91 -0.11 0.58 -3.12 0.00 0.00 179.24 177.24 3n9n h VAL 378 N 1.14 0.76 -0.19 -1.35 2.07 -0.86 -0.62 116.25 117.20 3n9n h VAL 378 Ca 0.27 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.72 3n9n h VAL 378 Cb 0.15 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3n9n h VAL 378 CO -0.03 0.00 -0.17 1.62 0.02 0.00 0.00 177.57 179.01 3n9n h VAL 379 N -0.29 1.22 -0.56 2.57 3.04 -1.17 0.37 116.25 121.43 3n9n h VAL 379 Ca -0.02 -0.98 -0.05 0.00 -1.01 0.00 0.00 66.70 64.64 3n9n h VAL 379 Cb 0.24 1.27 -0.02 0.00 -2.01 0.00 0.00 31.29 30.77 3n9n h VAL 379 CO 0.02 0.31 0.15 0.11 -1.01 0.00 0.00 177.57 177.15 3n9n h LYS 380 N 0.29 0.88 -0.00 4.17 1.57 -1.13 0.22 116.57 122.57 3n9n h LYS 380 Ca 0.05 -0.20 -0.13 0.00 -1.87 0.00 0.00 60.65 58.50 3n9n h LYS 380 Cb 0.48 -0.12 0.01 0.00 0.08 0.00 0.00 32.23 32.68 3n9n h LYS 380 CO 0.03 0.82 -0.49 0.82 -0.57 0.00 0.00 179.45 180.06 3n9n h ILE 381 N 0.79 1.46 0.19 1.86 2.04 -0.53 -3.36 117.51 119.95 3n9n h ILE 381 Ca 0.18 -2.03 -0.31 0.00 1.00 0.00 0.00 64.86 63.69 3n9n h ILE 381 Cb 0.32 2.64 0.03 0.00 -0.74 0.00 0.00 36.82 39.06 3n9n h ILE 381 CO -0.00 0.58 -1.36 0.24 0.00 0.00 0.00 178.15 177.60 3n9n h MET 382 N -0.22 0.52 0.00 2.37 2.86 -0.32 -3.48 114.93 116.66 3n9n h MET 382 Ca -0.06 -0.81 0.00 0.00 -2.06 0.00 0.00 59.70 56.77 3n9n h MET 382 Cb 1.21 0.29 0.00 0.00 0.06 0.00 0.00 31.60 33.16 3n9n h MET 382 CO 0.10 1.38 0.00 0.41 1.06 0.00 0.00 176.91 179.86 3n9n n GLY 383 N 1.57 3.57 0.30 8.32 0.00 0.78 -4.66 105.19 115.07 3n9n n GLY 383 Ca -0.14 -1.36 0.15 0.00 0.00 0.00 0.00 46.02 44.67 3n9n n GLY 383 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3n9n h SER 384 N 0.00 0.00 -0.23 1.61 0.02 -1.91 -0.19 113.55 112.86 3n9n h SER 384 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3n9n h SER 384 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3n9n h SER 384 CO 0.00 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.16 3n9n n ASP 385 N -3.86 3.05 -4.68 3.07 8.00 -1.26 -1.84 116.55 119.04 3n9n n ASP 385 Ca -0.02 -1.95 -0.42 0.00 0.71 0.00 0.00 54.79 53.11 3n9n n ASP 385 Cb 0.13 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 3n9n n ASP 385 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3n9n s TYR 386 N -1.72 1.76 -0.10 1.24 5.04 -0.08 -4.74 117.35 118.75 3n9n s TYR 386 Ca 0.34 -0.20 -0.18 0.00 -2.44 0.00 0.00 57.07 54.60 3n9n s TYR 386 Cb 0.21 -4.19 -0.04 0.00 0.35 0.00 0.00 41.96 38.29 3n9n s TYR 386 CO 0.31 -5.09 0.48 -1.21 -1.34 0.00 0.00 175.55 168.70 3n9n s GLU 387 N 3.58 4.30 -0.04 4.97 2.02 -1.26 -0.37 118.70 131.89 3n9n s GLU 387 Ca 0.84 0.47 0.04 0.00 0.02 0.00 0.00 54.97 56.33 3n9n s GLU 387 Cb -0.44 -3.41 0.00 0.00 0.10 0.00 0.00 34.13 30.39 3n9n s GLU 387 CO 0.38 0.23 -0.15 0.54 0.02 0.00 0.00 175.26 176.28 3n9n s VAL 388 N 0.37 1.27 0.01 2.63 0.11 -0.87 -4.91 120.40 119.02 3n9n s VAL 388 Ca 0.26 -0.62 -0.30 0.00 -2.93 0.00 0.00 61.98 58.39 3n9n s VAL 388 Cb -0.16 -1.11 -0.07 0.00 -1.53 0.00 0.00 36.38 33.51 3n9n s VAL 388 CO 0.11 0.37 1.77 -1.81 -3.33 0.00 0.00 175.10 172.22 3n9n s ASP 389 N 0.16 6.57 -0.02 3.54 -0.00 -1.26 -2.46 116.67 123.20 3n9n s ASP 389 Ca -0.05 2.46 0.05 0.00 -0.00 0.00 0.00 52.55 55.01 3n9n s ASP 389 Cb -0.12 -2.54 -0.01 0.00 -0.00 0.00 0.00 42.92 40.25 3n9n s ASP 389 CO 0.02 -0.97 -0.18 -0.89 -0.00 0.00 0.00 175.17 173.15 3n9n s THR 390 N 3.87 1.47 -0.23 -1.27 2.01 0.80 -4.31 115.64 117.99 3n9n s THR 390 Ca 0.79 -0.78 -0.26 0.00 0.31 0.00 0.00 61.69 61.75 3n9n s THR 390 Cb -0.38 -1.24 0.00 0.00 0.01 0.00 0.00 72.50 70.89 3n9n s THR 390 CO 0.35 0.42 0.91 -0.63 -0.69 0.00 0.00 174.62 174.97 3n9n s ILE 391 N -0.29 4.78 -0.71 1.82 1.01 0.38 -0.62 121.20 127.58 3n9n s ILE 391 Ca 0.04 1.75 -0.27 0.00 0.00 0.00 0.00 60.65 62.17 3n9n s ILE 391 Cb -0.09 -4.19 0.02 0.00 0.01 0.00 0.00 42.46 38.21 3n9n s ILE 391 CO 0.00 -0.11 1.45 -0.62 0.00 0.00 0.00 174.94 175.66 3n9n s ASP 392 N 1.28 5.91 0.13 3.58 -1.08 0.18 -2.15 116.67 124.53 3n9n s ASP 392 Ca 0.39 -0.25 -0.19 0.00 -0.52 0.00 0.00 52.55 51.98 3n9n s ASP 392 Cb -0.15 -2.55 -0.01 0.00 -1.46 0.00 0.00 42.92 38.74 3n9n s ASP 392 CO 0.07 -1.99 1.75 0.58 0.52 0.00 0.00 175.17 176.10 3n9n h VAL 393 N 6.28 0.92 0.00 1.11 2.07 -1.55 0.14 116.25 125.22 3n9n h VAL 393 Ca -0.27 -0.06 -0.09 0.00 0.82 0.00 0.00 66.70 67.10 3n9n h VAL 393 Cb 1.08 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 3n9n h VAL 393 CO 1.27 0.03 -0.43 1.88 0.02 0.00 0.00 177.57 180.34 3n9n h TYR 394 N 0.18 0.00 -0.01 1.57 0.05 -1.81 -1.98 116.97 114.97 3n9n h TYR 394 Ca 0.11 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.89 3n9n h TYR 394 Cb 0.09 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.83 3n9n h TYR 394 CO -0.13 0.43 -0.26 -1.71 -1.05 0.00 0.00 178.16 175.44 3n9n n ASN 395 N -3.66 0.98 -4.17 3.88 5.15 -0.94 -4.18 115.26 112.31 3n9n n ASN 395 Ca -0.01 -0.85 -0.39 0.00 -0.60 0.00 0.00 54.58 52.73 3n9n n ASN 395 Cb 0.52 0.13 -0.03 0.00 -0.53 0.00 0.00 39.78 39.86 3n9n n ASN 395 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3n9n n GLN 396 N -0.69 -0.66 -4.11 1.20 1.13 0.45 -4.83 117.38 109.87 3n9n n GLN 396 Ca 0.12 0.10 -0.10 0.00 -1.94 0.00 0.00 57.00 55.17 3n9n n GLN 396 Cb 0.34 -3.06 -0.09 0.00 0.11 0.00 0.00 30.24 27.55 3n9n n GLN 396 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 3n9n s SER 397 N -3.92 0.15 -0.10 1.08 0.01 -1.01 -4.99 113.70 104.91 3n9n s SER 397 Ca 0.27 -1.16 0.02 0.00 1.31 0.00 0.00 55.95 56.39 3n9n s SER 397 Cb -0.15 0.39 -0.02 0.00 0.21 0.00 0.00 66.02 66.46 3n9n s SER 397 CO 0.98 -0.85 -0.15 -0.89 0.41 0.00 0.00 173.24 172.74 3n9n s THR 398 N -4.06 2.94 0.04 1.44 2.01 -1.26 0.50 115.64 117.24 3n9n s THR 398 Ca 0.27 -0.72 -0.02 0.00 0.31 0.00 0.00 61.69 61.53 3n9n s THR 398 Cb 0.05 -2.20 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 3n9n s THR 398 CO 0.06 0.55 -0.00 -0.31 -0.69 0.00 0.00 174.62 174.22 3n9n s TYR 399 N 0.01 0.36 0.59 4.92 2.02 0.21 -4.90 117.35 120.56 3n9n s TYR 399 Ca -0.05 -0.76 -0.18 0.00 -0.37 0.00 0.00 57.07 55.72 3n9n s TYR 399 Cb -0.14 -0.27 -0.03 0.00 -0.40 0.00 0.00 41.96 41.12 3n9n s TYR 399 CO 0.04 -0.31 1.14 -1.12 -1.57 0.00 0.00 175.55 173.73 3n9n s SER 400 N -2.24 5.38 -0.27 2.29 0.01 -1.26 -0.14 113.70 117.47 3n9n s SER 400 Ca -0.04 2.17 -0.16 0.00 1.31 0.00 0.00 55.95 59.24 3n9n s SER 400 Cb -0.00 -2.58 0.08 0.00 0.21 0.00 0.00 66.02 63.73 3n9n s SER 400 CO -0.06 -1.45 0.67 -0.32 0.41 0.00 0.00 173.24 172.49 3n9n s MET 401 N -3.55 0.69 0.45 12.44 1.75 -1.03 -2.93 119.30 127.12 3n9n s MET 401 Ca 0.72 1.19 -0.24 0.00 -1.25 0.00 0.00 55.69 56.12 3n9n s MET 401 Cb -0.24 0.13 -0.09 0.00 2.84 0.00 0.00 34.83 37.47 3n9n s MET 401 CO 0.33 -0.15 1.08 1.63 -0.65 0.00 0.00 175.02 177.26 3n9n n LYS 402 N 4.29 1.44 -0.09 4.11 4.01 -1.26 -2.05 118.16 128.62 3n9n n LYS 402 Ca -0.20 0.52 0.00 0.00 -0.51 0.00 0.00 58.31 58.12 3n9n n LYS 402 Cb 0.59 -2.16 0.29 0.00 -0.51 0.00 0.00 35.03 33.24 3n9n n LYS 402 CO 0.00 0.00 0.00 1.25 -1.11 0.00 0.00 177.40 177.54 3n9n h LEU 403 N 1.53 0.65 -0.84 -0.35 5.85 -0.73 -2.00 115.31 119.42 3n9n h LEU 403 Ca -0.46 -0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.07 3n9n h LEU 403 Cb 1.33 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 3n9n h LEU 403 CO 0.57 0.58 -0.52 -0.78 -0.34 0.00 0.00 178.44 177.94 3n9n h ASP 404 N 0.72 0.17 -0.27 1.25 3.58 -1.64 -1.76 116.42 118.48 3n9n h ASP 404 Ca 0.18 -0.08 -0.06 0.00 0.42 0.00 0.00 57.03 57.49 3n9n h ASP 404 Cb 0.11 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.11 3n9n h ASP 404 CO -0.02 0.66 -0.06 0.74 -2.88 0.00 0.00 179.24 177.68 3n9n h THR 405 N 0.12 1.28 -0.82 2.25 2.02 -1.65 -1.95 112.91 114.17 3n9n h THR 405 Ca 0.00 -1.06 0.02 0.00 0.77 0.00 0.00 66.41 66.14 3n9n h THR 405 Cb 0.96 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 68.75 3n9n h THR 405 CO 0.08 0.33 0.54 0.15 0.37 0.00 0.00 175.52 176.99 3n9n h PHE 406 N 0.27 1.00 -0.38 3.16 3.57 -1.21 -1.90 116.94 121.45 3n9n h PHE 406 Ca 0.07 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.50 3n9n h PHE 406 Cb 0.52 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 3n9n h PHE 406 CO 0.05 0.61 -0.11 -0.09 -2.23 0.00 0.00 178.31 176.54 3n9n h ARG 407 N 1.06 0.75 -0.01 1.11 2.43 -1.14 0.50 114.38 119.08 3n9n h ARG 407 Ca 0.31 -0.29 0.03 0.00 -0.81 0.00 0.00 59.98 59.22 3n9n h ARG 407 Cb -0.04 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.43 3n9n h ARG 407 CO -0.08 0.90 -0.18 0.87 -1.51 0.00 0.00 179.97 179.96 3n9n h LYS 408 N 0.55 -0.28 -0.79 0.20 1.57 -1.03 0.21 116.57 117.00 3n9n h LYS 408 Ca 0.10 0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 3n9n h LYS 408 Cb 0.63 0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.97 3n9n h LYS 408 CO 0.04 -0.19 0.34 -0.07 -0.57 0.00 0.00 179.45 179.01 3n9n h LEU 409 N -0.29 1.06 -0.74 2.94 3.38 -1.10 -2.21 115.31 118.35 3n9n h LEU 409 Ca 0.06 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 3n9n h LEU 409 Cb 0.37 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 3n9n h LEU 409 CO -0.18 0.93 0.17 0.15 0.09 0.00 0.00 178.44 179.59 3n9n h PHE 410 N 1.13 1.18 -0.47 1.13 3.57 0.25 -3.00 116.94 120.73 3n9n h PHE 410 Ca 0.27 -0.14 -0.04 0.00 3.53 0.00 0.00 57.97 61.59 3n9n h PHE 410 Cb 0.17 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 3n9n h PHE 410 CO 0.02 0.96 0.14 0.00 -2.23 0.00 0.00 178.31 177.20 3n9n h ARG 411 N 1.07 0.70 -6.15 1.11 3.08 -0.06 -3.36 114.38 110.78 3n9n h ARG 411 Ca 0.22 -0.12 -0.58 0.00 0.07 0.00 0.00 59.98 59.57 3n9n h ARG 411 Cb 0.38 -0.12 -0.10 0.00 0.08 0.00 0.00 29.97 30.21 3n9n h ARG 411 CO 0.00 0.62 1.22 0.34 -1.07 0.00 0.00 179.97 181.09 3n9n s ASP 412 N -6.63 6.33 0.17 7.04 -1.08 -0.88 -4.81 116.67 116.81 3n9n s ASP 412 Ca -0.09 -0.99 0.25 0.00 -0.52 0.00 0.00 52.55 51.20 3n9n s ASP 412 Cb 0.16 -2.55 0.58 0.00 -1.46 0.00 0.00 42.92 39.65 3n9n s ASP 412 CO 0.78 -1.64 1.55 0.35 0.52 0.00 0.00 175.17 176.73 3n9n n THR 413 N 6.55 0.49 -0.06 1.71 -2.24 -1.26 -4.00 114.28 115.47 3n9n n THR 413 Ca 0.17 -0.28 -0.18 0.00 -2.27 0.00 0.00 64.05 61.48 3n9n n THR 413 Cb 0.50 -0.36 -0.13 0.00 -2.10 0.00 0.00 70.33 68.23 3n9n n THR 413 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3n9n n LYS 414 N -2.20 0.70 -3.54 -0.78 4.01 -1.26 -4.75 118.16 110.34 3n9n n LYS 414 Ca 0.04 0.20 -0.41 0.00 -0.51 0.00 0.00 58.31 57.63 3n9n n LYS 414 Cb 0.44 -1.63 -0.07 0.00 -0.51 0.00 0.00 35.03 33.26 3n9n n LYS 414 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 3n9n s ASN 415 N -6.65 5.89 -0.57 4.39 3.04 -1.26 -4.97 114.94 114.81 3n9n s ASN 415 Ca -0.25 -2.52 0.05 0.00 0.04 0.00 0.00 52.86 50.18 3n9n s ASN 415 Cb 0.08 -2.02 0.18 0.00 -1.54 0.00 0.00 41.25 37.94 3n9n s ASN 415 CO 0.71 -0.54 0.45 0.54 -3.04 0.00 0.00 177.10 175.22 3n9n n ARG 416 N 4.08 1.17 -0.25 0.43 1.74 -1.26 -4.91 116.66 117.66 3n9n n ARG 416 Ca 0.05 -3.92 0.05 0.00 -0.77 0.00 0.00 57.85 53.25 3n9n n ARG 416 Cb 0.42 -2.00 0.28 0.00 -1.02 0.00 0.00 32.46 30.15 3n9n n ARG 416 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3n9n h PRO 417 N 5.36 0.89 -5.80 5.56 0.11 -1.98 -3.42 132.00 132.73 3n9n h PRO 417 Ca 0.20 -0.05 -0.52 0.00 0.11 0.00 0.00 66.00 65.74 3n9n h PRO 417 Cb 0.82 -0.20 -0.24 0.00 0.11 0.00 0.00 31.00 31.48 3n9n h PRO 417 CO 0.57 0.59 -0.82 -0.51 -0.21 0.00 0.00 178.00 177.63 3n9n s LEU 418 N -9.87 2.21 -0.02 2.35 1.02 -1.26 -5.09 118.68 108.01 3n9n s LEU 418 Ca -0.11 -0.55 -0.05 0.00 0.02 0.00 0.00 54.13 53.44 3n9n s LEU 418 Cb 0.19 -0.79 -0.04 0.00 0.02 0.00 0.00 46.19 45.57 3n9n s LEU 418 CO 0.79 0.07 0.22 -0.76 0.02 0.00 0.00 176.35 176.69 3n9n s LEU 419 N -1.39 4.38 0.10 1.79 1.43 -1.26 -5.04 118.68 118.67 3n9n s LEU 419 Ca 0.04 0.48 0.07 0.00 -1.03 0.00 0.00 54.13 53.69 3n9n s LEU 419 Cb -0.09 -2.53 -0.03 0.00 0.03 0.00 0.00 46.19 43.57 3n9n s LEU 419 CO 0.02 0.29 -0.18 -0.31 0.23 0.00 0.00 176.35 176.40 3n9n s TYR 420 N -1.25 1.56 -0.27 0.29 2.02 -1.26 -1.56 117.35 116.89 3n9n s TYR 420 Ca 0.25 -0.45 -0.04 0.00 -0.37 0.00 0.00 57.07 56.47 3n9n s TYR 420 Cb -0.13 -0.86 0.15 0.00 -0.40 0.00 0.00 41.96 40.73 3n9n s TYR 420 CO 0.14 0.16 0.52 1.21 -1.57 0.00 0.00 175.55 176.01 3n9n s ASN 421 N -1.93 -0.73 -0.03 2.29 2.47 -0.91 -1.94 114.94 114.15 3n9n s ASN 421 Ca 0.04 0.82 -0.03 0.00 0.42 0.00 0.00 52.86 54.11 3n9n s ASN 421 Cb -0.09 1.78 -0.04 0.00 -1.45 0.00 0.00 41.25 41.44 3n9n s ASN 421 CO 0.04 -0.26 0.13 0.72 -3.72 0.00 0.00 177.10 174.00 3n9n s PHE 422 N 2.74 3.44 0.00 0.43 -0.12 -0.80 -0.47 117.98 123.20 3n9n s PHE 422 Ca 0.11 0.33 0.00 0.00 -0.05 0.00 0.00 56.93 57.32 3n9n s PHE 422 Cb -0.14 -1.82 0.00 0.00 -0.63 0.00 0.00 43.02 40.43 3n9n s PHE 422 CO -0.18 0.62 0.27 1.28 -0.05 0.00 0.00 175.22 177.16 3n9n n LEU 423 N 1.31 0.54 -0.32 -1.99 4.77 -1.26 -2.20 117.00 117.85 3n9n n LEU 423 Ca -0.14 -0.75 0.07 0.00 -0.03 0.00 0.00 56.01 55.16 3n9n n LEU 423 Cb 0.53 0.00 0.12 0.00 -2.33 0.00 0.00 43.42 41.74 3n9n n LEU 423 CO 0.38 0.14 0.45 -1.20 -1.33 0.00 0.00 177.39 175.83 3n9n n SER 424 N -0.42 1.74 -4.54 -1.43 7.64 -1.26 -4.72 113.62 110.64 3n9n n SER 424 Ca 0.00 -2.98 -0.42 0.00 1.01 0.00 0.00 58.87 56.48 3n9n n SER 424 Cb 0.01 -0.40 -0.03 0.00 -1.01 0.00 0.00 64.21 62.78 3n9n n SER 424 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3n9n s LEU 425 N -2.27 3.42 -0.23 -3.43 2.96 -1.19 -4.72 118.68 113.22 3n9n s LEU 425 Ca 0.27 -0.44 -0.09 0.00 -0.22 0.00 0.00 54.13 53.66 3n9n s LEU 425 Cb 0.25 -2.64 -0.04 0.00 0.50 0.00 0.00 46.19 44.26 3n9n s LEU 425 CO -0.00 -1.70 0.11 -0.70 -1.32 0.00 0.00 176.35 172.73 3n9n s GLU 426 N 5.31 3.93 -0.10 1.98 -6.30 -1.26 0.65 118.70 122.91 3n9n s GLU 426 Ca 0.34 -0.35 0.14 0.00 -2.50 0.00 0.00 54.97 52.60 3n9n s GLU 426 Cb -0.09 -3.40 0.23 0.00 0.00 0.00 0.00 34.13 30.86 3n9n s GLU 426 CO 0.16 0.04 1.13 1.97 0.02 0.00 0.00 175.26 178.58 3n9n n PHE 427 N 4.29 0.05 0.30 5.30 1.16 -0.75 -4.69 117.46 123.13 3n9n n PHE 427 Ca -0.16 -0.86 0.15 0.00 -1.87 0.00 0.00 57.45 54.71 3n9n n PHE 427 Cb 0.52 -0.13 0.67 0.00 -1.61 0.00 0.00 39.48 38.93 3n9n n PHE 427 CO 0.00 0.00 0.00 0.66 -1.87 0.00 0.00 176.76 175.55 3n9n h SER 428 N 0.12 0.00 -0.50 5.98 4.64 -1.94 -1.47 113.55 120.38 3n9n h SER 428 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3n9n h SER 428 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 3n9n h SER 428 CO 0.01 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.07 3n9n n ASP 429 N -2.55 3.54 -4.56 4.97 5.75 -1.26 -4.85 116.55 117.59 3n9n n ASP 429 Ca 0.00 -1.97 -0.40 0.00 -0.01 0.00 0.00 54.79 52.41 3n9n n ASP 429 Cb 0.17 -0.33 -0.10 0.00 -1.03 0.00 0.00 41.12 39.83 3n9n n ASP 429 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 3n9n s ASN 430 N -1.22 6.12 0.54 -1.12 2.47 -0.55 -4.98 114.94 116.19 3n9n s ASN 430 Ca 0.40 -0.16 0.24 0.00 0.42 0.00 0.00 52.86 53.76 3n9n s ASN 430 Cb 0.22 -2.16 1.50 0.00 -1.45 0.00 0.00 41.25 39.36 3n9n s ASN 430 CO 0.30 -0.22 2.14 0.78 -3.72 0.00 0.00 177.10 176.39 3n9n h ASN 431 N 8.41 0.00 0.00 -4.21 2.35 -1.89 -0.73 115.58 119.51 3n9n h ASN 431 Ca -0.32 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.39 3n9n h ASN 431 Cb 1.16 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.52 3n9n h ASN 431 CO 0.63 0.07 -0.32 -0.08 -1.65 0.00 0.00 177.43 176.08 3n9n h GLU 432 N 0.00 0.00 -0.83 0.81 4.81 -1.93 -3.40 114.58 114.04 3n9n h GLU 432 Ca -0.00 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3n9n h GLU 432 Cb 0.15 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 3n9n h GLU 432 CO 0.01 0.54 0.42 0.52 -0.73 0.00 0.00 179.01 179.77 3n9n h MET 433 N -1.00 1.19 0.00 1.92 2.86 -1.83 -2.89 114.93 115.18 3n9n h MET 433 Ca -0.07 -0.16 0.00 0.00 -2.06 0.00 0.00 59.70 57.41 3n9n h MET 433 Cb 0.68 -0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.12 3n9n h MET 433 CO -0.04 0.90 0.00 0.36 1.06 0.00 0.00 176.91 179.19 3n9n n LYS 434 N -4.35 0.03 -0.00 1.72 2.85 -0.29 -0.59 118.16 117.52 3n9n n LYS 434 Ca 0.08 0.34 0.08 0.00 -1.05 0.00 0.00 58.31 57.76 3n9n n LYS 434 Cb 0.12 -1.50 -0.12 0.00 -0.65 0.00 0.00 35.03 32.89 3n9n n LYS 434 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3n9n n GLU 435 N -1.38 0.96 0.00 -1.58 -0.58 -1.09 -4.60 120.64 112.37 3n9n n GLU 435 Ca 0.01 -0.09 -0.13 0.00 -0.42 0.00 0.00 57.16 56.54 3n9n n GLU 435 Cb 0.03 -1.35 -0.14 0.00 -0.57 0.00 0.00 31.44 29.41 3n9n n GLU 435 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 3n9n h ILE 436 N 0.00 0.88 -3.23 -3.67 2.04 -0.91 -3.45 117.51 109.18 3n9n h ILE 436 Ca 0.00 -2.67 -0.50 0.00 1.00 0.00 0.00 64.86 62.70 3n9n h ILE 436 Cb 0.61 2.51 -0.38 0.00 -0.74 0.00 0.00 36.82 38.83 3n9n h ILE 436 CO 0.00 0.66 -0.79 0.00 0.00 0.00 0.00 178.15 178.02 3n9n s ALA 437 N -2.60 1.10 0.18 1.87 0.00 -1.15 -2.91 121.76 118.25 3n9n s ALA 437 Ca -0.09 -0.43 0.06 0.00 0.00 0.00 0.00 51.96 51.49 3n9n s ALA 437 Cb 0.08 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 3n9n s ALA 437 CO 0.82 -0.51 -0.12 0.15 0.00 0.00 0.00 175.76 176.10 3n9n s LYS 438 N 1.80 1.19 0.73 0.00 1.02 0.50 -4.81 119.74 120.18 3n9n s LYS 438 Ca 0.04 -1.52 -0.12 0.00 0.02 0.00 0.00 55.97 54.39 3n9n s LYS 438 Cb -0.13 -0.85 0.04 0.00 -0.52 0.00 0.00 37.83 36.37 3n9n s LYS 438 CO -0.07 0.12 1.10 -2.14 -0.92 0.00 0.00 175.35 173.44 3n9n s PRO 439 N -3.70 2.42 0.68 -1.68 0.02 -1.26 -3.91 135.00 127.57 3n9n s PRO 439 Ca 0.20 1.27 -0.17 0.00 0.02 0.00 0.00 61.00 62.32 3n9n s PRO 439 Cb 0.01 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.58 3n9n s PRO 439 CO 0.04 -1.53 0.69 -2.30 -0.33 0.00 0.00 177.00 173.57 3n9n n PRO 440 N -3.11 0.45 -0.25 5.54 -0.02 -1.26 -4.50 135.00 131.85 3n9n n PRO 440 Ca 0.10 0.20 0.01 0.00 -2.02 0.00 0.00 63.50 61.79 3n9n n PRO 440 Cb 0.53 -1.95 0.14 0.00 -0.02 0.00 0.00 33.50 32.20 3n9n n PRO 440 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3n9n h ARG 441 N -0.15 0.64 -0.07 -0.52 2.43 -1.48 -1.28 114.38 113.93 3n9n h ARG 441 Ca -0.46 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 58.65 3n9n h ARG 441 Cb 1.36 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.76 3n9n h ARG 441 CO 0.45 0.42 -0.06 0.27 -1.51 0.00 0.00 179.97 179.54 3n9n h PHE 442 N 0.66 0.10 -0.38 2.20 -5.15 -1.90 -0.80 116.94 111.68 3n9n h PHE 442 Ca 0.35 -0.00 -0.12 0.00 -0.20 0.00 0.00 57.97 58.00 3n9n h PHE 442 Cb 0.35 -0.03 -0.01 0.00 0.22 0.00 0.00 35.95 36.47 3n9n h PHE 442 CO -0.09 0.17 -0.23 0.28 -2.00 0.00 0.00 178.31 176.44 3n9n h VAL 443 N 0.10 1.28 -0.31 0.88 2.07 -1.59 -3.06 116.25 115.63 3n9n h VAL 443 Ca 0.02 -1.38 -0.05 0.00 0.82 0.00 0.00 66.70 66.12 3n9n h VAL 443 Cb 0.19 1.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 3n9n h VAL 443 CO 0.01 0.46 -0.02 1.56 0.02 0.00 0.00 177.57 179.60 3n9n h GLN 444 N 0.62 0.48 0.00 1.57 4.20 -0.61 -0.67 115.11 120.70 3n9n h GLN 444 Ca 0.08 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 3n9n h GLN 444 Cb 0.79 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.50 3n9n h GLN 444 CO 0.06 0.53 -0.02 0.93 -0.67 0.00 0.00 178.83 179.66 3n9n h GLU 445 N 0.46 0.00 0.00 1.46 5.08 -1.17 -3.27 114.58 117.15 3n9n h GLU 445 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3n9n h GLU 445 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 3n9n h GLU 445 CO 0.01 0.02 -0.40 0.44 -1.00 0.00 0.00 179.01 178.08 3n9n n ILE 446 N -3.11 0.00 -1.67 3.13 -5.35 -1.00 -5.00 119.36 106.35 3n9n n ILE 446 Ca 0.02 -0.31 -0.45 0.00 -0.27 0.00 0.00 62.75 61.74 3n9n n ILE 446 Cb 0.41 0.98 -0.04 0.00 -1.74 0.00 0.00 39.64 39.25 3n9n n ILE 446 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 3n9n n SER 447 N -1.20 3.77 -0.20 7.28 2.88 -0.29 -4.43 113.62 121.43 3n9n n SER 447 Ca 0.01 0.95 -0.10 0.00 -1.33 0.00 0.00 58.87 58.41 3n9n n SER 447 Cb 0.12 -1.45 0.02 0.00 -0.75 0.00 0.00 64.21 62.15 3n9n n SER 447 CO 0.00 0.00 0.00 0.24 -1.23 0.00 0.00 175.04 174.05 3n9n h MET 448 N 9.48 1.05 -0.62 -1.46 2.86 -1.38 -1.18 114.93 123.68 3n9n h MET 448 Ca -0.49 -0.37 -0.02 0.00 -2.06 0.00 0.00 59.70 56.77 3n9n h MET 448 Cb 1.25 -0.08 -0.03 0.00 0.06 0.00 0.00 31.60 32.81 3n9n h MET 448 CO 0.94 1.07 0.32 0.28 1.06 0.00 0.00 176.91 180.58 3n9n h VAL 449 N 0.94 1.20 -0.20 -2.22 2.07 -1.90 -1.98 116.25 114.17 3n9n h VAL 449 Ca 0.15 -0.54 -0.08 0.00 0.82 0.00 0.00 66.70 67.06 3n9n h VAL 449 Cb 0.64 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 3n9n h VAL 449 CO 0.04 0.23 -0.22 -1.13 0.02 0.00 0.00 177.57 176.51 3n9n h ASN 450 N 0.84 0.35 -0.13 0.57 -1.24 -1.81 0.28 115.58 114.43 3n9n h ASN 450 Ca 0.22 -0.10 -0.09 0.00 0.71 0.00 0.00 56.30 57.04 3n9n h ASN 450 Cb 0.07 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 3n9n h ASN 450 CO -0.03 0.58 -0.19 -0.09 -1.29 0.00 0.00 177.43 176.41 3n9n h ARG 451 N 0.32 0.54 0.01 6.67 9.65 -0.86 -3.04 114.38 127.67 3n9n h ARG 451 Ca 0.05 -0.18 -0.29 0.00 -1.10 0.00 0.00 59.98 58.46 3n9n h ARG 451 Cb 0.57 -0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 29.06 3n9n h ARG 451 CO 0.04 0.70 -1.66 -0.07 2.80 0.00 0.00 179.97 181.78 3n9n h LEU 452 N 0.48 0.03 -5.99 3.80 3.38 -0.95 -3.38 115.31 112.68 3n9n h LEU 452 Ca 0.08 -0.06 -0.62 0.00 0.09 0.00 0.00 57.88 57.36 3n9n h LEU 452 Cb 0.60 -0.01 -0.40 0.00 0.09 0.00 0.00 40.66 40.94 3n9n h LEU 452 CO 0.04 1.05 -0.41 0.79 0.09 0.00 0.00 178.44 180.00 3n9n n TRP 453 N -3.10 3.62 -1.99 1.13 8.01 0.05 -4.71 117.44 120.45 3n9n n TRP 453 Ca -0.16 -3.90 -0.42 0.00 -1.31 0.00 0.00 57.50 51.71 3n9n n TRP 453 Cb 1.04 -0.63 -0.03 0.00 -2.01 0.00 0.00 31.31 29.68 3n9n n TRP 453 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.69 174.54 3n9n s PRO 454 N -2.89 4.24 -1.48 -0.99 0.02 -1.15 -4.75 135.00 128.00 3n9n s PRO 454 Ca 0.42 2.29 -0.12 0.00 0.02 0.00 0.00 61.00 63.61 3n9n s PRO 454 Cb 0.18 -3.19 -0.04 0.00 0.02 0.00 0.00 34.50 31.46 3n9n s PRO 454 CO -0.04 -0.57 2.59 -3.47 -0.33 0.00 0.00 177.00 175.18 3n9n n ASP 455 N 4.03 6.44 -5.01 2.53 4.64 -1.26 -4.90 116.55 123.03 3n9n n ASP 455 Ca 0.13 -2.65 -0.17 0.00 -1.38 0.00 0.00 54.79 50.72 3n9n n ASP 455 Cb 0.39 -1.54 0.01 0.00 -1.04 0.00 0.00 41.12 38.95 3n9n n ASP 455 CO 0.00 0.00 0.00 0.68 -0.82 0.00 0.00 177.20 177.06 3n9n s VAL 456 N 2.76 2.93 0.07 5.18 -7.23 -1.26 -5.13 120.40 117.72 3n9n s VAL 456 Ca 0.59 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.79 3n9n s VAL 456 Cb 0.16 -2.96 -0.00 0.00 0.56 0.00 0.00 36.38 34.14 3n9n s VAL 456 CO -0.06 0.00 0.03 -1.54 -0.31 0.00 0.00 175.10 173.22 3n9n n SER 457 N -1.91 0.82 0.00 4.85 3.41 -1.26 -4.72 113.62 114.82 3n9n n SER 457 Ca 0.08 -1.38 0.00 0.00 -0.26 0.00 0.00 58.87 57.32 3n9n n SER 457 Cb 0.59 0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.74 3n9n n SER 457 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3n9n n GLY 458 N 1.52 1.91 0.30 5.00 0.00 -1.26 -1.04 105.19 111.61 3n9n n GLY 458 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.79 3n9n n GLY 458 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n9n h ALA 459 N -0.20 1.42 -0.96 4.61 0.00 -1.99 -1.78 119.26 120.36 3n9n h ALA 459 Ca 0.00 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.80 3n9n h ALA 459 Cb 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.55 3n9n h ALA 459 CO 0.00 0.43 0.63 0.93 0.00 0.00 0.00 179.25 181.24 3n9n h GLU 460 N 0.65 1.18 -0.25 0.00 5.08 -1.89 0.15 114.58 119.50 3n9n h GLU 460 Ca 0.15 -0.07 -0.19 0.00 -1.00 0.00 0.00 59.36 58.25 3n9n h GLU 460 Cb 0.18 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.16 3n9n h GLU 460 CO -0.01 0.78 -0.59 -0.92 -1.00 0.00 0.00 179.01 177.27 3n9n h TYR 461 N 1.22 1.03 -0.46 4.33 3.20 -0.28 -1.91 116.97 124.10 3n9n h TYR 461 Ca 0.38 -0.38 0.01 0.00 3.14 0.00 0.00 58.73 61.88 3n9n h TYR 461 Cb -0.00 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.05 3n9n h TYR 461 CO -0.00 1.20 0.29 0.82 -1.64 0.00 0.00 178.16 178.83 3n9n h ILE 462 N 0.61 1.08 -0.46 1.81 1.08 -0.62 -1.05 117.51 119.96 3n9n h ILE 462 Ca 0.00 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.27 3n9n h ILE 462 Cb 1.19 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 35.36 3n9n h ILE 462 CO 0.13 0.11 0.29 0.11 -0.69 0.00 0.00 178.15 178.10 3n9n h LYS 463 N 0.59 0.61 0.01 2.37 1.57 -0.66 -0.53 116.57 120.53 3n9n h LYS 463 Ca 0.18 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.93 3n9n h LYS 463 Cb -0.03 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.13 3n9n h LYS 463 CO -0.06 0.42 -0.08 1.25 -0.57 0.00 0.00 179.45 180.41 3n9n h LEU 464 N 0.63 -0.23 -0.75 2.94 7.12 -0.40 -1.56 115.31 123.07 3n9n h LEU 464 Ca 0.17 0.03 -0.10 0.00 0.13 0.00 0.00 57.88 58.12 3n9n h LEU 464 Cb -0.05 0.09 -0.02 0.00 -0.53 0.00 0.00 40.66 40.16 3n9n h LEU 464 CO -0.03 -0.12 -0.08 -0.07 -0.13 0.00 0.00 178.44 178.00 3n9n h LEU 465 N -0.15 0.85 -0.68 2.25 3.38 -0.59 -2.94 115.31 117.44 3n9n h LEU 465 Ca 0.03 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.66 3n9n h LEU 465 Cb 0.18 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 3n9n h LEU 465 CO -0.07 0.96 0.06 1.56 0.09 0.00 0.00 178.44 181.04 3n9n h GLN 466 N 0.78 1.07 -7.18 1.13 4.20 -0.79 -3.37 115.11 110.96 3n9n h GLN 466 Ca 0.13 -0.31 -0.48 0.00 0.06 0.00 0.00 58.65 58.05 3n9n h GLN 466 Cb 0.59 -0.11 0.05 0.00 0.30 0.00 0.00 27.48 28.30 3n9n h GLN 466 CO 0.04 1.01 0.38 1.03 -0.67 0.00 0.00 178.83 180.62 3n9n s ARG 467 N -5.12 3.53 0.00 1.46 0.52 -0.62 -4.90 118.95 113.83 3n9n s ARG 467 Ca -0.12 1.17 -0.01 0.00 -0.52 0.00 0.00 55.73 56.25 3n9n s ARG 467 Cb 0.14 -2.06 -0.06 0.00 0.52 0.00 0.00 34.95 33.49 3n9n s ARG 467 CO 0.85 -0.64 2.09 0.39 0.02 0.00 0.00 175.30 178.02 3n9n n GLU 468 N -1.78 1.08 0.00 3.54 1.02 -1.26 -4.21 120.64 119.03 3n9n n GLU 468 Ca 0.08 -0.22 0.13 0.00 -0.02 0.00 0.00 57.16 57.13 3n9n n GLU 468 Cb 0.53 -1.29 0.22 0.00 -0.02 0.00 0.00 31.44 30.89 3n9n n GLU 468 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3n9n n GLU 469 N 1.83 2.07 -2.58 3.49 1.02 -1.11 -4.93 120.64 120.42 3n9n n GLU 469 Ca 0.09 -1.59 -0.41 0.00 -0.02 0.00 0.00 57.16 55.24 3n9n n GLU 469 Cb 0.52 -1.47 -0.04 0.00 -0.02 0.00 0.00 31.44 30.43 3n9n n GLU 469 CO 0.00 0.00 0.00 -0.47 1.18 0.00 0.00 177.13 177.84 3n9n s TYR 470 N -2.03 3.69 -0.03 -0.32 5.04 -1.22 -4.94 117.35 117.54 3n9n s TYR 470 Ca 0.30 1.71 0.04 0.00 -2.44 0.00 0.00 57.07 56.69 3n9n s TYR 470 Cb 0.20 -3.19 -0.01 0.00 0.35 0.00 0.00 41.96 39.31 3n9n s TYR 470 CO 0.32 -0.29 -0.17 -0.51 -1.34 0.00 0.00 175.55 173.57 3n9n s LEU 471 N -0.73 1.93 0.36 6.97 1.43 -1.26 -5.08 118.68 122.31 3n9n s LEU 471 Ca 0.46 -0.33 -0.28 0.00 -1.03 0.00 0.00 54.13 52.95 3n9n s LEU 471 Cb -0.29 -0.92 -0.12 0.00 0.03 0.00 0.00 46.19 44.90 3n9n s LEU 471 CO 0.35 0.16 1.36 -2.65 0.23 0.00 0.00 176.35 175.80 3n9n n PRO 472 N 3.04 2.30 -0.11 1.29 -0.02 -1.26 -4.90 135.00 135.33 3n9n n PRO 472 Ca -0.17 0.81 0.09 0.00 -2.02 0.00 0.00 63.50 62.20 3n9n n PRO 472 Cb 0.53 -2.45 0.43 0.00 -0.02 0.00 0.00 33.50 31.99 3n9n n PRO 472 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3n9n h GLU 473 N 2.64 0.55 0.00 -0.52 4.57 -1.99 -1.53 114.58 118.29 3n9n h GLU 473 Ca -0.48 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 3n9n h GLU 473 Cb 1.27 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.74 3n9n h GLU 473 CO 0.63 0.36 0.00 -0.40 -1.18 0.00 0.00 179.01 178.42 3n9n n ASP 474 N -4.48 0.00 0.00 1.04 3.85 -1.26 -1.95 116.55 113.75 3n9n n ASP 474 Ca 0.09 -0.09 0.11 0.00 -0.71 0.00 0.00 54.79 54.19 3n9n n ASP 474 Cb 0.27 -0.28 -0.01 0.00 -1.35 0.00 0.00 41.12 39.76 3n9n n ASP 474 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3n9n n GLN 475 N -1.28 0.00 -2.37 0.11 6.02 -0.58 -4.94 117.38 114.35 3n9n n GLN 475 Ca 0.12 -0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.68 3n9n n GLN 475 Cb 0.20 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.93 3n9n n GLN 475 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3n9n s ARG 476 N -3.00 4.23 0.03 -1.09 3.52 -0.82 -4.91 118.95 116.90 3n9n s ARG 476 Ca 0.09 1.73 -0.31 0.00 -0.13 0.00 0.00 55.73 57.11 3n9n s ARG 476 Cb 0.16 -3.79 -0.10 0.00 -1.56 0.00 0.00 34.95 29.67 3n9n s ARG 476 CO 0.82 -0.72 1.94 -2.30 -0.81 0.00 0.00 175.30 174.23 3n9n n PRO 477 N 6.66 2.75 -3.42 5.12 -0.02 -1.26 -4.93 135.00 139.90 3n9n n PRO 477 Ca 0.14 1.01 -0.44 0.00 -2.02 0.00 0.00 63.50 62.19 3n9n n PRO 477 Cb 0.45 -2.94 -0.06 0.00 -0.02 0.00 0.00 33.50 30.93 3n9n n PRO 477 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3n9n s LYS 478 N 4.15 2.98 0.00 -0.52 1.02 -1.26 -4.73 119.74 121.38 3n9n s LYS 478 Ca 0.89 -2.02 0.00 0.00 0.02 0.00 0.00 55.97 54.86 3n9n s LYS 478 Cb -0.48 -4.18 0.00 0.00 -0.52 0.00 0.00 37.83 32.65 3n9n s LYS 478 CO 0.43 -1.27 0.02 1.33 -0.92 0.00 0.00 175.35 174.95 3n9n n VAL 479 N 4.62 0.00 0.91 3.17 0.24 -1.26 -4.92 118.33 121.10 3n9n n VAL 479 Ca -0.02 0.00 0.12 0.00 -2.04 0.00 0.00 64.34 62.39 3n9n n VAL 479 Cb 0.42 0.88 0.18 0.00 -1.47 0.00 0.00 33.84 33.85 3n9n n VAL 479 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 3n9n n GLU 480 N 0.00 0.06 -3.57 7.34 2.13 -1.23 0.50 120.64 125.86 3n9n n GLU 480 Ca 0.00 0.01 -0.29 0.00 0.66 0.00 0.00 57.16 57.54 3n9n n GLU 480 Cb 0.28 -1.53 -0.12 0.00 0.27 0.00 0.00 31.44 30.34 3n9n n GLU 480 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 3n9n s GLN 481 N -3.04 0.94 0.01 5.31 -0.21 -1.26 -4.20 119.66 117.21 3n9n s GLN 481 Ca 0.09 -1.73 0.00 0.00 0.02 0.00 0.00 55.36 53.74 3n9n s GLN 481 Cb 0.17 -1.81 -0.04 0.00 1.00 0.00 0.00 33.01 32.33 3n9n s GLN 481 CO 0.73 -1.21 0.06 -0.06 -2.12 0.00 0.00 175.29 172.69 3n9n s PHE 482 N 0.62 3.22 -0.13 0.91 0.08 0.85 -1.80 117.98 121.72 3n9n s PHE 482 Ca 0.19 0.16 -0.02 0.00 0.12 0.00 0.00 56.93 57.38 3n9n s PHE 482 Cb -0.21 -1.71 -0.02 0.00 -0.57 0.00 0.00 43.02 40.51 3n9n s PHE 482 CO -0.02 0.52 -0.07 0.00 -0.10 0.00 0.00 175.22 175.56 3n9n s LEU 484 N 0.12 1.94 -0.04 0.00 1.02 0.36 -3.20 118.68 118.89 3n9n s LEU 484 Ca -0.03 -0.39 -0.01 0.00 0.02 0.00 0.00 54.13 53.73 3n9n s LEU 484 Cb -0.14 -1.05 0.03 0.00 0.02 0.00 0.00 46.19 45.05 3n9n s LEU 484 CO 0.03 0.17 0.02 0.00 0.02 0.00 0.00 176.35 176.59 3n9n s ALA 485 N 0.03 0.30 0.03 4.21 0.00 -0.94 0.09 121.76 125.47 3n9n s ALA 485 Ca -0.04 0.16 0.03 0.00 0.00 0.00 0.00 51.96 52.11 3n9n s ALA 485 Cb -0.12 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 3n9n s ALA 485 CO 0.03 -0.25 -0.10 0.20 0.00 0.00 0.00 175.76 175.64 3n9n s GLY 486 N 1.48 0.56 0.42 0.00 0.00 -1.02 -1.91 107.32 106.85 3n9n s GLY 486 Ca -0.04 -0.64 -0.23 0.00 0.00 0.00 0.00 44.72 43.82 3n9n s GLY 486 CO -0.03 -0.63 1.03 1.06 0.00 0.00 0.00 173.10 174.53 3n9n s MET 487 N -0.94 4.12 0.32 2.90 -1.94 -0.82 -1.36 119.30 121.57 3n9n s MET 487 Ca -0.01 1.42 -0.28 0.00 -1.71 0.00 0.00 55.69 55.11 3n9n s MET 487 Cb -0.07 -2.42 -0.13 0.00 2.01 0.00 0.00 34.83 34.23 3n9n s MET 487 CO 0.01 -0.17 1.22 0.00 -0.01 0.00 0.00 175.02 176.07 3n9n n ALA 488 N -0.29 0.84 -0.42 3.03 0.00 -1.26 -1.78 120.51 120.61 3n9n n ALA 488 Ca 0.06 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.87 3n9n n ALA 488 Cb 0.51 -2.19 0.00 0.00 0.00 0.00 0.00 19.45 17.77 3n9n n ALA 488 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n9n n GLY 489 N 1.00 0.77 3.79 0.00 0.00 0.14 -4.92 105.19 105.96 3n9n n GLY 489 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3n9n n GLY 489 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3n9n s SER 490 N -2.99 6.69 -0.02 1.61 0.01 -0.74 -4.86 113.70 113.40 3n9n s SER 490 Ca 0.00 1.98 0.01 0.00 1.31 0.00 0.00 55.95 59.24 3n9n s SER 490 Cb 0.00 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.67 3n9n s SER 490 CO 0.00 -0.54 -0.01 -0.47 0.41 0.00 0.00 173.24 172.63 3n9n s TYR 491 N -1.78 0.34 -0.12 2.43 5.04 -1.26 -0.72 117.35 121.28 3n9n s TYR 491 Ca 0.60 -0.03 0.01 0.00 -2.44 0.00 0.00 57.07 55.21 3n9n s TYR 491 Cb -0.19 -0.37 -0.01 0.00 0.35 0.00 0.00 41.96 41.73 3n9n s TYR 491 CO 0.24 -0.10 -0.16 0.99 -1.34 0.00 0.00 175.55 175.19 3n9n s THR 492 N 0.74 2.82 0.75 4.34 2.01 0.12 -4.94 115.64 121.47 3n9n s THR 492 Ca -0.08 -0.75 -0.08 0.00 0.31 0.00 0.00 61.69 61.09 3n9n s THR 492 Cb -0.11 -2.16 0.08 0.00 0.01 0.00 0.00 72.50 70.32 3n9n s THR 492 CO -0.01 0.53 1.07 -0.62 -0.69 0.00 0.00 174.62 174.91 3n9n s ASP 493 N 0.33 4.60 0.33 3.53 2.15 -1.26 -0.57 116.67 125.78 3n9n s ASP 493 Ca -0.13 0.48 -0.28 0.00 0.43 0.00 0.00 52.55 53.05 3n9n s ASP 493 Cb -0.16 -1.04 -0.12 0.00 -0.30 0.00 0.00 42.92 41.29 3n9n s ASP 493 CO 0.06 -1.76 1.32 0.49 -0.17 0.00 0.00 175.17 175.11 3n9n n PHE 494 N -3.07 2.31 -3.59 -5.34 3.01 -1.26 -4.49 117.46 105.03 3n9n n PHE 494 Ca 0.09 0.53 -0.05 0.00 1.01 0.00 0.00 57.45 59.03 3n9n n PHE 494 Cb 0.61 -2.43 -0.02 0.00 -0.01 0.00 0.00 39.48 37.63 3n9n n PHE 494 CO 0.00 0.00 0.00 -3.38 1.01 0.00 0.00 176.76 174.39 3n9n s HIS 495 N -0.95 -0.19 -0.11 1.38 -3.43 -0.96 -4.93 115.29 106.11 3n9n s HIS 495 Ca 0.57 0.07 -0.01 0.00 -0.80 0.00 0.00 55.06 54.88 3n9n s HIS 495 Cb -0.57 0.55 -0.03 0.00 -1.43 0.00 0.00 32.58 31.10 3n9n s HIS 495 CO 0.61 -0.43 -0.06 0.08 -2.00 0.00 0.00 174.74 172.94 3n9n s VAL 496 N -2.79 3.76 0.40 -5.38 1.01 -1.26 -1.53 120.40 114.61 3n9n s VAL 496 Ca 0.09 -0.43 -0.27 0.00 0.00 0.00 0.00 61.98 61.37 3n9n s VAL 496 Cb -0.00 -2.58 -0.10 0.00 0.00 0.00 0.00 36.38 33.70 3n9n s VAL 496 CO -0.05 0.55 1.42 -1.81 0.00 0.00 0.00 175.10 175.22 3n9n s ASP 497 N -0.27 6.23 0.35 3.32 1.01 -1.26 -4.85 116.67 121.20 3n9n s ASP 497 Ca 0.04 2.92 -0.27 0.00 0.71 0.00 0.00 52.55 55.95 3n9n s ASP 497 Cb -0.13 -2.66 -0.12 0.00 1.01 0.00 0.00 42.92 41.03 3n9n s ASP 497 CO 0.02 -0.93 1.17 2.22 0.21 0.00 0.00 175.17 177.86 3n9n n PHE 498 N 0.24 1.84 -0.91 4.23 1.16 -1.26 -1.52 117.46 121.23 3n9n n PHE 498 Ca 0.03 0.58 0.00 0.00 -1.87 0.00 0.00 57.45 56.19 3n9n n PHE 498 Cb 0.41 -2.34 0.00 0.00 -1.61 0.00 0.00 39.48 35.94 3n9n n PHE 498 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 3n9n n GLY 499 N 0.95 0.49 2.25 4.97 0.00 -1.26 -2.09 105.19 110.50 3n9n n GLY 499 Ca 0.07 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 3n9n n GLY 499 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n9n n GLY 500 N -1.81 0.02 3.76 -0.02 0.00 -0.58 -4.66 105.19 101.90 3n9n n GLY 500 Ca 0.00 -0.37 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 3n9n n GLY 500 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3n9n s SER 501 N -2.48 5.33 0.69 1.61 1.04 -0.89 -4.18 113.70 114.82 3n9n s SER 501 Ca 0.00 2.25 -0.10 0.00 0.48 0.00 0.00 55.95 58.59 3n9n s SER 501 Cb 0.00 -2.59 0.02 0.00 0.10 0.00 0.00 66.02 63.56 3n9n s SER 501 CO 0.00 -1.49 1.05 -0.44 0.98 0.00 0.00 173.24 173.34 3n9n s SER 502 N -1.81 5.35 -0.01 7.02 0.01 0.43 -4.56 113.70 120.13 3n9n s SER 502 Ca 0.74 0.95 -0.00 0.00 1.31 0.00 0.00 55.95 58.95 3n9n s SER 502 Cb -0.26 -1.75 0.01 0.00 0.21 0.00 0.00 66.02 64.22 3n9n s SER 502 CO 0.32 -1.34 0.01 -0.69 0.41 0.00 0.00 173.24 171.95 3n9n s VAL 503 N -3.28 -0.02 0.07 3.43 1.01 -0.02 -1.81 120.40 119.79 3n9n s VAL 503 Ca 0.58 0.06 0.07 0.00 0.00 0.00 0.00 61.98 62.68 3n9n s VAL 503 Cb -0.11 -0.03 -0.04 0.00 0.00 0.00 0.00 36.38 36.20 3n9n s VAL 503 CO 0.49 0.02 -0.12 -0.72 0.00 0.00 0.00 175.10 174.77 3n9n s TYR 504 N 0.30 2.69 -0.32 5.22 -0.85 -0.81 -0.94 117.35 122.64 3n9n s TYR 504 Ca -0.02 -0.18 0.05 0.00 -0.52 0.00 0.00 57.07 56.40 3n9n s TYR 504 Cb -0.04 -1.46 0.18 0.00 0.38 0.00 0.00 41.96 41.02 3n9n s TYR 504 CO -0.01 0.37 0.50 -0.47 -1.52 0.00 0.00 175.55 174.42 3n9n s TYR 505 N -1.10 -1.33 -0.19 -3.49 5.04 -0.57 -1.64 117.35 114.07 3n9n s TYR 505 Ca 0.18 0.42 -0.05 0.00 -2.44 0.00 0.00 57.07 55.18 3n9n s TYR 505 Cb -0.11 0.05 -0.03 0.00 0.35 0.00 0.00 41.96 42.23 3n9n s TYR 505 CO 0.10 -1.05 -0.01 -1.58 -1.34 0.00 0.00 175.55 171.67 3n9n s HIS 506 N 2.37 3.04 -0.59 4.97 5.65 0.45 -0.88 115.29 130.30 3n9n s HIS 506 Ca 0.12 -0.40 -0.23 0.00 0.25 0.00 0.00 55.06 54.80 3n9n s HIS 506 Cb -0.10 -2.05 0.05 0.00 -1.18 0.00 0.00 32.58 29.30 3n9n s HIS 506 CO -0.21 -0.17 0.94 0.42 -0.65 0.00 0.00 174.74 175.07 3n9n s ILE 507 N 0.80 4.37 0.03 0.89 -1.09 -0.66 -1.43 121.20 124.11 3n9n s ILE 507 Ca 0.00 0.01 -0.21 0.00 -2.23 0.00 0.00 60.65 58.22 3n9n s ILE 507 Cb -0.14 -4.59 -0.15 0.00 -1.58 0.00 0.00 42.46 35.99 3n9n s ILE 507 CO 0.02 -1.25 1.32 0.25 -1.23 0.00 0.00 174.94 174.05 3n9n h LEU 508 N 11.11 0.35 -7.51 2.97 5.85 -1.39 0.37 115.31 127.07 3n9n h LEU 508 Ca -0.27 -0.50 -0.18 0.00 0.84 0.00 0.00 57.88 57.77 3n9n h LEU 508 Cb 1.07 -0.10 -0.26 0.00 0.37 0.00 0.00 40.66 41.74 3n9n h LEU 508 CO 1.12 0.78 -0.48 -0.54 -0.34 0.00 0.00 178.44 178.98 3n9n s LYS 509 N -4.23 0.23 0.00 1.25 1.02 -0.73 -4.46 119.74 112.82 3n9n s LYS 509 Ca -0.14 0.30 0.00 0.00 0.02 0.00 0.00 55.97 56.15 3n9n s LYS 509 Cb 0.05 0.10 0.00 0.00 -0.52 0.00 0.00 37.83 37.45 3n9n s LYS 509 CO 0.75 -0.04 0.00 0.41 -0.92 0.00 0.00 175.35 175.55 3n9n n GLY 510 N 3.07 0.30 3.59 -3.33 0.00 -1.26 -0.41 105.19 107.15 3n9n n GLY 510 Ca -0.14 -1.80 -0.14 0.00 0.00 0.00 0.00 46.02 43.94 3n9n n GLY 510 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n9n s GLU 511 N 0.00 0.82 0.03 1.61 2.12 -1.26 -1.97 118.70 120.05 3n9n s GLU 511 Ca 0.00 0.61 0.03 0.00 0.36 0.00 0.00 54.97 55.97 3n9n s GLU 511 Cb 0.00 0.40 -0.02 0.00 0.26 0.00 0.00 34.13 34.77 3n9n s GLU 511 CO 0.00 -0.17 -0.10 0.15 -0.54 0.00 0.00 175.26 174.59 3n9n s LYS 512 N -0.30 0.71 -0.21 4.30 -0.14 -0.22 -3.88 119.74 120.00 3n9n s LYS 512 Ca -0.03 -0.64 0.01 0.00 -1.36 0.00 0.00 55.97 53.94 3n9n s LYS 512 Cb -0.03 -0.64 0.03 0.00 -1.68 0.00 0.00 37.83 35.51 3n9n s LYS 512 CO 0.03 0.15 -0.15 0.42 -0.76 0.00 0.00 175.35 175.04 3n9n s ILE 513 N -0.86 2.31 -0.05 2.17 1.01 -0.41 -0.20 121.20 125.17 3n9n s ILE 513 Ca -0.02 -1.08 -0.12 0.00 0.00 0.00 0.00 60.65 59.43 3n9n s ILE 513 Cb -0.07 -2.10 -0.05 0.00 0.01 0.00 0.00 42.46 40.25 3n9n s ILE 513 CO 0.01 0.35 0.32 -0.36 0.00 0.00 0.00 174.94 175.25 3n9n s PHE 514 N 1.27 3.67 -0.20 3.97 0.40 0.13 -0.80 117.98 126.41 3n9n s PHE 514 Ca 0.01 0.82 -0.01 0.00 -0.60 0.00 0.00 56.93 57.15 3n9n s PHE 514 Cb -0.15 -2.18 0.01 0.00 0.51 0.00 0.00 43.02 41.20 3n9n s PHE 514 CO -0.09 0.64 -0.13 0.71 0.70 0.00 0.00 175.22 177.05 3n9n s TYR 515 N -0.93 2.86 0.09 0.36 2.02 0.44 -1.18 117.35 121.00 3n9n s TYR 515 Ca 0.20 -1.28 0.05 0.00 -0.37 0.00 0.00 57.07 55.67 3n9n s TYR 515 Cb -0.15 -2.00 -0.03 0.00 -0.40 0.00 0.00 41.96 39.38 3n9n s TYR 515 CO 0.10 -0.66 -0.12 0.96 -1.57 0.00 0.00 175.55 174.25 3n9n s ILE 516 N 1.33 1.05 -0.04 2.71 -4.36 -0.15 -0.40 121.20 121.35 3n9n s ILE 516 Ca 0.04 -1.47 -0.03 0.00 -0.26 0.00 0.00 60.65 58.94 3n9n s ILE 516 Cb -0.14 -1.21 0.02 0.00 1.25 0.00 0.00 42.46 42.38 3n9n s ILE 516 CO -0.08 -0.38 0.09 0.00 0.24 0.00 0.00 174.94 174.81 3n9n s ALA 517 N -1.83 -0.19 0.66 2.27 0.00 0.31 -0.37 121.76 122.62 3n9n s ALA 517 Ca 0.02 0.34 -0.17 0.00 0.00 0.00 0.00 51.96 52.14 3n9n s ALA 517 Cb -0.07 -0.22 0.00 0.00 0.00 0.00 0.00 23.12 22.84 3n9n s ALA 517 CO 0.02 -0.07 1.26 0.00 0.00 0.00 0.00 175.76 176.97 3n9n s ALA 518 N 0.38 2.32 -1.50 0.00 0.00 -1.26 -2.26 121.76 119.44 3n9n s ALA 518 Ca -0.03 1.11 -0.10 0.00 0.00 0.00 0.00 51.96 52.94 3n9n s ALA 518 Cb -0.04 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.56 3n9n s ALA 518 CO -0.01 -1.63 2.59 -0.35 0.00 0.00 0.00 175.76 176.36 3n9n n PRO 519 N -2.09 3.68 -3.37 0.00 -0.04 -1.26 -4.73 135.00 127.18 3n9n n PRO 519 Ca 0.15 -2.65 -0.23 0.00 -0.04 0.00 0.00 63.50 60.73 3n9n n PRO 519 Cb 0.49 -2.89 -0.01 0.00 -0.04 0.00 0.00 33.50 31.05 3n9n n PRO 519 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3n9n s THR 520 N 1.60 4.77 0.23 0.52 -4.23 -1.26 -4.91 115.64 112.36 3n9n s THR 520 Ca 0.59 -0.59 -0.07 0.00 -1.18 0.00 0.00 61.69 60.43 3n9n s THR 520 Cb 0.16 -3.73 0.20 0.00 1.34 0.00 0.00 72.50 70.47 3n9n s THR 520 CO -0.07 -0.44 1.84 -0.33 -0.54 0.00 0.00 174.62 175.09 3n9n h GLU 521 N 0.74 1.23 -0.27 3.99 4.39 -1.98 0.54 114.58 123.22 3n9n h GLU 521 Ca -0.49 -0.15 0.04 0.00 0.34 0.00 0.00 59.36 59.10 3n9n h GLU 521 Cb 1.23 -0.24 -0.04 0.00 -0.10 0.00 0.00 28.75 29.60 3n9n h GLU 521 CO 0.59 0.91 0.01 0.37 -1.16 0.00 0.00 179.01 179.74 3n9n h GLN 522 N 1.23 0.10 -0.43 2.33 4.15 -1.96 0.23 115.11 120.76 3n9n h GLN 522 Ca 0.31 -0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.67 3n9n h GLN 522 Cb 0.05 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.70 3n9n h GLN 522 CO -0.05 0.06 0.06 -0.91 -1.93 0.00 0.00 178.83 176.07 3n9n h ASN 523 N 0.10 0.68 -0.93 -0.69 2.35 -1.68 -1.90 115.58 113.52 3n9n h ASN 523 Ca 0.13 -0.27 0.04 0.00 -0.55 0.00 0.00 56.30 55.65 3n9n h ASN 523 Cb 0.16 -0.18 -0.05 0.00 0.05 0.00 0.00 38.32 38.29 3n9n h ASN 523 CO -0.20 0.78 0.60 -0.26 -1.65 0.00 0.00 177.43 176.70 3n9n h PHE 524 N 0.57 1.13 -0.29 1.19 0.04 0.44 0.29 116.94 120.31 3n9n h PHE 524 Ca 0.13 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.90 3n9n h PHE 524 Cb 0.39 -0.38 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 3n9n h PHE 524 CO 0.03 0.65 0.07 0.00 -0.60 0.00 0.00 178.31 178.46 3n9n h ALA 525 N 1.38 0.38 -0.86 2.45 0.00 -0.38 0.12 119.26 122.36 3n9n h ALA 525 Ca 0.37 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.14 3n9n h ALA 525 Cb 0.00 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3n9n h ALA 525 CO -0.12 0.04 0.56 0.00 0.00 0.00 0.00 179.25 179.72 3n9n h ALA 526 N 0.90 1.11 -0.28 0.00 0.00 -1.06 -2.24 119.26 117.69 3n9n h ALA 526 Ca 0.09 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.88 3n9n h ALA 526 Cb 0.29 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3n9n h ALA 526 CO 0.00 0.42 -0.12 -0.92 0.00 0.00 0.00 179.25 178.63 3n9n h TYR 527 N 1.10 0.66 -0.80 0.00 3.20 -0.71 -1.35 116.97 119.06 3n9n h TYR 527 Ca 0.33 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 62.05 3n9n h TYR 527 Cb -0.03 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.04 3n9n h TYR 527 CO -0.02 0.81 0.52 0.37 -1.64 0.00 0.00 178.16 178.20 3n9n h GLN 528 N 0.32 1.06 -0.18 1.82 4.15 -0.86 0.32 115.11 121.74 3n9n h GLN 528 Ca 0.06 -0.07 -0.08 0.00 0.77 0.00 0.00 58.65 59.34 3n9n h GLN 528 Cb 0.63 -0.24 -0.00 0.00 0.21 0.00 0.00 27.48 28.08 3n9n h GLN 528 CO 0.04 0.72 -0.18 0.00 -1.93 0.00 0.00 178.83 177.47 3n9n h ALA 529 N 1.48 0.27 -0.93 3.38 0.00 -1.29 -2.30 119.26 119.86 3n9n h ALA 529 Ca 0.29 -0.34 0.04 0.00 0.00 0.00 0.00 54.91 54.90 3n9n h ALA 529 Cb -0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 3n9n h ALA 529 CO -0.06 0.18 0.60 1.25 0.00 0.00 0.00 179.25 181.22 3n9n h HIS 530 N 0.10 1.12 0.00 0.00 -0.00 -0.79 -0.65 115.15 114.93 3n9n h HIS 530 Ca 0.03 0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 60.36 3n9n h HIS 530 Cb 0.72 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 27.75 3n9n h HIS 530 CO 0.08 0.63 -0.34 1.49 -0.00 0.00 0.00 177.93 179.79 3n9n h GLU 531 N 1.14 0.00 0.00 5.26 4.57 -0.88 -3.29 114.58 121.39 3n9n h GLU 531 Ca 0.38 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.56 3n9n h GLU 531 Cb 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 3n9n h GLU 531 CO -0.13 0.34 -1.57 0.25 -1.18 0.00 0.00 179.01 176.72 3n9n n THR 532 N -3.37 0.04 -2.50 0.32 -2.24 -0.87 -4.91 114.28 100.75 3n9n n THR 532 Ca 0.01 -0.33 -0.37 0.00 -2.27 0.00 0.00 64.05 61.08 3n9n n THR 532 Cb 0.54 0.30 -0.04 0.00 -2.10 0.00 0.00 70.33 69.03 3n9n n THR 532 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3n9n s SER 533 N -4.05 6.78 0.14 3.42 0.15 -0.30 -4.94 113.70 114.90 3n9n s SER 533 Ca -0.02 2.11 0.27 0.00 0.70 0.00 0.00 55.95 59.01 3n9n s SER 533 Cb 0.14 -2.60 0.96 0.00 -1.71 0.00 0.00 66.02 62.82 3n9n s SER 533 CO 0.88 -0.48 1.82 -2.65 1.20 0.00 0.00 173.24 174.01 3n9n n PRO 534 N 0.11 0.17 -1.66 5.44 -0.02 -1.26 -4.86 135.00 132.92 3n9n n PRO 534 Ca 0.04 0.15 -0.44 0.00 -2.02 0.00 0.00 63.50 61.23 3n9n n PRO 534 Cb 0.48 -1.70 -0.01 0.00 -0.02 0.00 0.00 33.50 32.25 3n9n n PRO 534 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3n9n n ASP 535 N -2.00 2.39 0.00 2.55 2.03 -1.26 -4.90 116.55 115.36 3n9n n ASP 535 Ca 0.06 1.18 0.00 0.00 0.52 0.00 0.00 54.79 56.55 3n9n n ASP 535 Cb 0.39 -1.42 0.00 0.00 -0.72 0.00 0.00 41.12 39.37 3n9n n ASP 535 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 3n9n n THR 536 N 0.71 0.00 0.52 5.18 5.66 -1.26 -4.77 114.28 120.32 3n9n n THR 536 Ca 0.08 -0.29 0.06 0.00 -3.05 0.00 0.00 64.05 60.84 3n9n n THR 536 Cb 0.34 1.38 0.01 0.00 -1.55 0.00 0.00 70.33 70.50 3n9n n THR 536 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3n9n n THR 537 N -0.05 0.00 -4.03 1.09 -2.24 -1.26 -1.11 114.28 106.68 3n9n n THR 537 Ca 0.00 -0.39 -0.35 0.00 -2.27 0.00 0.00 64.05 61.04 3n9n n THR 537 Cb 0.10 1.15 -0.12 0.00 -2.10 0.00 0.00 70.33 69.36 3n9n n THR 537 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3n9n s THR 538 N -1.45 4.06 0.00 4.28 2.01 -1.26 -4.74 115.64 118.54 3n9n s THR 538 Ca 0.10 -0.27 -0.30 0.00 0.31 0.00 0.00 61.69 61.53 3n9n s THR 538 Cb 0.10 -2.85 -0.05 0.00 0.01 0.00 0.00 72.50 69.71 3n9n s THR 538 CO 0.28 0.42 1.24 0.86 -0.69 0.00 0.00 174.62 176.72 3n9n s TRP 539 N 1.04 3.22 0.32 4.92 -0.00 -1.26 -4.91 118.94 122.28 3n9n s TRP 539 Ca 0.02 1.17 0.11 0.00 -0.00 0.00 0.00 56.10 57.40 3n9n s TRP 539 Cb -0.14 -3.47 0.93 0.00 -0.00 0.00 0.00 33.47 30.79 3n9n s TRP 539 CO 0.02 -1.51 1.72 0.35 -0.00 0.00 0.00 176.95 177.52 3n9n h PHE 540 N 7.27 0.99 -0.43 5.86 3.57 -2.00 0.22 116.94 132.43 3n9n h PHE 540 Ca -0.38 0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.24 3n9n h PHE 540 Cb 1.18 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.62 3n9n h PHE 540 CO 0.71 0.02 0.29 0.78 -2.23 0.00 0.00 178.31 177.88 3n9n h GLY 541 N 0.53 0.31 2.00 2.40 0.00 -1.98 -1.37 103.07 104.96 3n9n h GLY 541 Ca 0.66 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.89 3n9n h GLY 541 CO -0.50 0.07 0.00 1.22 0.00 0.00 0.00 176.54 177.33 3n9n n ASP 542 N -4.46 0.00 0.00 0.19 10.43 0.77 -3.08 116.55 120.39 3n9n n ASP 542 Ca 0.06 0.50 0.00 0.00 2.57 0.00 0.00 54.79 57.92 3n9n n ASP 542 Cb 0.33 -0.50 0.00 0.00 1.84 0.00 0.00 41.12 42.78 3n9n n ASP 542 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 3n9n n ILE 543 N -1.51 0.26 -0.10 0.53 -5.35 -0.56 -4.73 119.36 107.90 3n9n n ILE 543 Ca 0.04 -0.53 0.05 0.00 -0.27 0.00 0.00 62.75 62.05 3n9n n ILE 543 Cb 0.21 1.01 0.26 0.00 -1.74 0.00 0.00 39.64 39.38 3n9n n ILE 543 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3n9n n ALA 544 N -0.13 3.20 -3.78 -1.28 0.00 -0.92 -4.92 120.51 112.69 3n9n n ALA 544 Ca 0.00 -1.18 -0.25 0.00 0.00 0.00 0.00 53.44 52.01 3n9n n ALA 544 Cb 0.13 -1.06 0.04 0.00 0.00 0.00 0.00 19.45 18.56 3n9n n ALA 544 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3n9n n ASN 545 N 0.54 -3.43 -0.90 0.00 2.85 -1.26 -1.60 115.26 111.45 3n9n n ASN 545 Ca 0.18 -0.76 -0.11 0.00 -0.11 0.00 0.00 54.58 53.78 3n9n n ASN 545 Cb 0.78 -4.14 -0.04 0.00 1.24 0.00 0.00 39.78 37.62 3n9n n ASN 545 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3n9n n GLY 546 N -1.66 0.91 0.16 8.20 0.00 -1.26 -4.91 105.19 106.63 3n9n n GLY 546 Ca -0.11 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 45.51 3n9n n GLY 546 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n9n h ALA 547 N 0.11 0.86 -2.17 4.61 0.00 -1.61 -3.45 119.26 117.60 3n9n h ALA 547 Ca -0.23 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.10 3n9n h ALA 547 Cb 0.80 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 3n9n h ALA 547 CO 0.31 0.00 0.66 0.08 0.00 0.00 0.00 179.25 180.30 3n9n s VAL 548 N -3.22 4.75 0.20 0.00 1.01 -1.26 -4.37 120.40 117.52 3n9n s VAL 548 Ca 0.06 1.86 0.08 0.00 0.00 0.00 0.00 61.98 63.98 3n9n s VAL 548 Cb 0.08 -4.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.18 3n9n s VAL 548 CO 0.69 -0.13 -0.02 -0.54 0.00 0.00 0.00 175.10 175.10 3n9n s LYS 549 N 2.98 2.30 -0.16 2.72 -0.14 0.50 -4.39 119.74 123.55 3n9n s LYS 549 Ca 0.41 -1.24 -0.03 0.00 -1.36 0.00 0.00 55.97 53.75 3n9n s LYS 549 Cb -0.15 -2.26 -0.02 0.00 -1.68 0.00 0.00 37.83 33.72 3n9n s LYS 549 CO 0.07 0.42 -0.05 0.50 -0.76 0.00 0.00 175.35 175.54 3n9n s ARG 550 N -3.15 3.61 -0.04 1.68 3.52 0.30 -0.97 118.95 123.91 3n9n s ARG 550 Ca 0.28 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 55.33 3n9n s ARG 550 Cb -0.08 -2.90 0.03 0.00 -1.56 0.00 0.00 34.95 30.44 3n9n s ARG 550 CO 0.18 0.19 -0.01 0.54 -0.81 0.00 0.00 175.30 175.39 3n9n s VAL 551 N 0.49 0.29 -0.06 7.11 0.11 -0.32 -4.18 120.40 123.85 3n9n s VAL 551 Ca -0.04 0.04 -0.11 0.00 -2.93 0.00 0.00 61.98 58.94 3n9n s VAL 551 Cb -0.14 -0.38 -0.05 0.00 -1.53 0.00 0.00 36.38 34.27 3n9n s VAL 551 CO 0.03 0.18 0.29 -0.69 -3.33 0.00 0.00 175.10 171.58 3n9n s VAL 552 N 1.15 5.24 -0.11 2.04 1.01 -1.26 -0.69 120.40 127.78 3n9n s VAL 552 Ca -0.08 0.56 0.01 0.00 0.00 0.00 0.00 61.98 62.47 3n9n s VAL 552 Cb -0.14 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.69 3n9n s VAL 552 CO -0.02 0.59 -0.11 -0.63 0.00 0.00 0.00 175.10 174.93 3n9n s ILE 553 N -1.02 1.25 0.42 2.22 1.09 0.72 -4.99 121.20 120.89 3n9n s ILE 553 Ca 0.20 -0.46 0.08 0.00 -1.10 0.00 0.00 60.65 59.37 3n9n s ILE 553 Cb -0.15 -1.20 -0.01 0.00 -1.06 0.00 0.00 42.46 40.05 3n9n s ILE 553 CO 0.09 0.40 0.44 -0.54 -0.10 0.00 0.00 174.94 175.23 3n9n s LYS 554 N 1.37 2.63 0.10 2.79 1.02 -1.26 -1.05 119.74 125.33 3n9n s LYS 554 Ca -0.00 -1.44 -0.36 0.00 0.02 0.00 0.00 55.97 54.19 3n9n s LYS 554 Cb -0.14 -2.50 -0.17 0.00 -0.52 0.00 0.00 37.83 34.50 3n9n s LYS 554 CO -0.06 -0.22 1.15 -1.91 -0.92 0.00 0.00 175.35 173.39 3n9n n GLU 555 N -1.65 0.75 0.00 1.68 2.13 -0.83 -1.10 120.64 121.62 3n9n n GLU 555 Ca 0.05 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.14 3n9n n GLU 555 Cb 0.61 -1.78 0.00 0.00 0.27 0.00 0.00 31.44 30.54 3n9n n GLU 555 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3n9n n GLY 556 N 2.05 2.36 3.91 8.31 0.00 0.13 -5.01 105.19 116.93 3n9n n GLY 556 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 3n9n n GLY 556 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n9n s GLN 557 N -0.50 3.62 -0.04 1.61 -0.21 -0.26 -4.33 119.66 119.56 3n9n s GLN 557 Ca 0.00 0.01 0.04 0.00 0.02 0.00 0.00 55.36 55.42 3n9n s GLN 557 Cb 0.00 -2.62 -0.00 0.00 1.00 0.00 0.00 33.01 31.39 3n9n s GLN 557 CO 0.00 0.18 -0.14 0.99 -2.12 0.00 0.00 175.29 174.20 3n9n s THR 558 N -2.15 1.19 -0.12 -0.19 2.01 -0.09 -1.65 115.64 114.65 3n9n s THR 558 Ca 0.44 -0.58 -0.04 0.00 0.31 0.00 0.00 61.69 61.82 3n9n s THR 558 Cb -0.11 -1.04 -0.03 0.00 0.01 0.00 0.00 72.50 71.33 3n9n s THR 558 CO 0.31 0.35 0.02 -0.22 -0.69 0.00 0.00 174.62 174.39 3n9n s LEU 559 N 0.11 3.62 -0.21 4.42 2.96 -0.06 -0.37 118.68 129.15 3n9n s LEU 559 Ca -0.04 0.11 0.01 0.00 -0.22 0.00 0.00 54.13 53.99 3n9n s LEU 559 Cb -0.11 -1.86 0.05 0.00 0.50 0.00 0.00 46.19 44.78 3n9n s LEU 559 CO 0.02 0.31 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.49 3n9n s LEU 560 N -0.44 2.50 -0.16 -0.68 1.43 0.22 -1.51 118.68 120.04 3n9n s LEU 560 Ca 0.08 -1.00 -0.00 0.00 -1.03 0.00 0.00 54.13 52.18 3n9n s LEU 560 Cb -0.12 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 44.81 3n9n s LEU 560 CO 0.02 -0.16 -0.15 -0.63 0.23 0.00 0.00 176.35 175.66 3n9n s ILE 561 N 1.34 2.67 1.05 -0.59 1.01 -0.11 -1.40 121.20 125.17 3n9n s ILE 561 Ca -0.03 -0.76 -0.18 0.00 0.00 0.00 0.00 60.65 59.68 3n9n s ILE 561 Cb -0.17 -2.13 0.25 0.00 0.01 0.00 0.00 42.46 40.41 3n9n s ILE 561 CO -0.08 0.51 1.30 -2.16 0.00 0.00 0.00 174.94 174.51 3n9n s PRO 562 N 0.94 -0.11 0.37 2.79 0.05 -1.26 -0.84 135.00 136.94 3n9n s PRO 562 Ca -0.03 -0.46 -0.28 0.00 0.05 0.00 0.00 61.00 60.28 3n9n s PRO 562 Cb -0.15 -1.76 -0.11 0.00 0.05 0.00 0.00 34.50 32.53 3n9n s PRO 562 CO -0.02 -2.91 1.45 0.00 0.05 0.00 0.00 177.00 175.58 3n9n s ALA 563 N -3.75 3.56 0.00 8.56 0.00 -1.26 -3.85 121.76 125.01 3n9n s ALA 563 Ca 0.76 1.52 0.00 0.00 0.00 0.00 0.00 51.96 54.24 3n9n s ALA 563 Cb -0.03 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.50 3n9n s ALA 563 CO 0.54 -0.99 0.00 0.41 0.00 0.00 0.00 175.76 175.72 3n9n n GLY 564 N 0.52 1.99 3.68 0.00 0.00 -1.26 -4.85 105.19 105.26 3n9n n GLY 564 Ca 0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 3n9n n GLY 564 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3n9n s TRP 565 N -2.33 2.00 -0.05 1.61 0.52 -1.25 -4.35 118.94 115.10 3n9n s TRP 565 Ca 0.00 0.04 -0.29 0.00 0.02 0.00 0.00 56.10 55.87 3n9n s TRP 565 Cb 0.00 -4.06 -0.02 0.00 -1.15 0.00 0.00 33.47 28.23 3n9n s TRP 565 CO 0.00 -4.47 0.95 0.42 0.02 0.00 0.00 176.95 173.87 3n9n s ILE 566 N 3.37 4.86 -0.10 2.03 1.01 -0.96 -4.51 121.20 126.90 3n9n s ILE 566 Ca 0.79 1.96 -0.16 0.00 0.00 0.00 0.00 60.65 63.24 3n9n s ILE 566 Cb -0.40 -4.28 0.04 0.00 0.01 0.00 0.00 42.46 37.83 3n9n s ILE 566 CO 0.35 0.12 0.41 -1.38 0.00 0.00 0.00 174.94 174.43 3n9n s HIS 567 N 1.35 -0.39 0.23 3.97 -3.43 -0.58 -0.53 115.29 115.91 3n9n s HIS 567 Ca 0.49 0.85 0.09 0.00 -0.80 0.00 0.00 55.06 55.69 3n9n s HIS 567 Cb -0.20 0.16 -0.04 0.00 -1.43 0.00 0.00 32.58 31.07 3n9n s HIS 567 CO 0.23 -0.31 -0.03 0.00 -2.00 0.00 0.00 174.74 172.63 3n9n s ALA 568 N -0.40 3.09 -0.01 -1.38 0.00 0.47 -2.26 121.76 121.28 3n9n s ALA 568 Ca -0.05 -1.58 -0.00 0.00 0.00 0.00 0.00 51.96 50.33 3n9n s ALA 568 Cb -0.03 -0.77 0.01 0.00 0.00 0.00 0.00 23.12 22.33 3n9n s ALA 568 CO 0.03 0.35 0.02 0.54 0.00 0.00 0.00 175.76 176.69 3n9n s VAL 569 N -2.10 -0.03 -0.10 0.00 0.11 0.26 -0.42 120.40 118.13 3n9n s VAL 569 Ca 0.29 0.10 -0.03 0.00 -2.93 0.00 0.00 61.98 59.41 3n9n s VAL 569 Cb -0.07 -0.05 -0.03 0.00 -1.53 0.00 0.00 36.38 34.70 3n9n s VAL 569 CO 0.18 0.04 0.03 -0.22 -3.33 0.00 0.00 175.10 171.81 3n9n s LEU 570 N 0.52 3.77 -0.60 2.54 2.96 0.02 -0.70 118.68 127.18 3n9n s LEU 570 Ca -0.04 0.21 -0.04 0.00 -0.22 0.00 0.00 54.13 54.04 3n9n s LEU 570 Cb -0.06 -1.88 0.15 0.00 0.50 0.00 0.00 46.19 44.90 3n9n s LEU 570 CO -0.01 0.37 0.42 -0.89 -1.32 0.00 0.00 176.35 174.92 3n9n s THR 571 N -0.85 3.80 0.33 3.68 2.01 0.10 -1.28 115.64 123.43 3n9n s THR 571 Ca 0.13 -2.73 0.19 0.00 0.31 0.00 0.00 61.69 59.59 3n9n s THR 571 Cb -0.12 -3.49 0.17 0.00 0.01 0.00 0.00 72.50 69.08 3n9n s THR 571 CO 0.03 -0.85 1.88 -0.65 -0.69 0.00 0.00 174.62 174.34 3n9n h PRO 572 N 7.31 0.00 -4.34 4.92 0.11 -1.87 0.40 132.00 138.53 3n9n h PRO 572 Ca -0.04 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.83 3n9n h PRO 572 Cb 0.98 0.00 -0.22 0.00 0.11 0.00 0.00 31.00 31.87 3n9n h PRO 572 CO 0.72 0.28 -0.73 0.08 -0.21 0.00 0.00 178.00 178.15 3n9n s VAL 573 N -4.05 0.39 0.13 3.15 1.01 -1.26 -4.31 120.40 115.45 3n9n s VAL 573 Ca -0.02 -0.91 -0.34 0.00 0.00 0.00 0.00 61.98 60.71 3n9n s VAL 573 Cb 0.13 -0.46 -0.17 0.00 0.00 0.00 0.00 36.38 35.88 3n9n s VAL 573 CO 0.67 -0.35 1.03 0.47 0.00 0.00 0.00 175.10 176.91 3n9n n ASP 574 N 1.70 0.50 -4.01 3.32 10.43 -1.26 -4.27 116.55 122.97 3n9n n ASP 574 Ca -0.22 1.14 -0.08 0.00 2.57 0.00 0.00 54.79 58.20 3n9n n ASP 574 Cb 0.55 -1.08 -0.10 0.00 1.84 0.00 0.00 41.12 42.33 3n9n n ASP 574 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3n9n s SER 575 N -0.17 0.32 -0.05 -2.24 0.01 -0.46 -4.02 113.70 107.10 3n9n s SER 575 Ca 0.77 -0.71 -0.02 0.00 1.31 0.00 0.00 55.95 57.31 3n9n s SER 575 Cb -0.99 0.17 0.03 0.00 0.21 0.00 0.00 66.02 65.45 3n9n s SER 575 CO 0.54 -0.48 0.04 -0.22 0.41 0.00 0.00 173.24 173.54 3n9n s LEU 576 N -2.22 0.30 0.01 2.44 2.96 0.45 -2.42 118.68 120.21 3n9n s LEU 576 Ca -0.04 0.03 0.05 0.00 -0.22 0.00 0.00 54.13 53.95 3n9n s LEU 576 Cb -0.01 -0.22 -0.02 0.00 0.50 0.00 0.00 46.19 46.45 3n9n s LEU 576 CO -0.06 -0.23 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.91 3n9n s VAL 577 N 2.06 1.17 -0.15 1.68 1.01 0.11 -0.96 120.40 125.33 3n9n s VAL 577 Ca 0.04 -0.79 0.00 0.00 0.00 0.00 0.00 61.98 61.24 3n9n s VAL 577 Cb -0.12 -1.01 -0.00 0.00 0.00 0.00 0.00 36.38 35.25 3n9n s VAL 577 CO -0.04 0.21 -0.15 -0.36 0.00 0.00 0.00 175.10 174.76 3n9n s PHE 578 N -0.54 2.78 0.05 5.22 0.40 -0.52 -0.48 117.98 124.90 3n9n s PHE 578 Ca 0.04 -0.96 0.00 0.00 -0.60 0.00 0.00 56.93 55.42 3n9n s PHE 578 Cb -0.07 -1.88 -0.00 0.00 0.51 0.00 0.00 43.02 41.58 3n9n s PHE 578 CO 0.00 -0.42 0.06 0.41 0.70 0.00 0.00 175.22 175.97 3n9n n GLY 579 N 3.96 3.36 3.63 4.36 0.00 -0.58 -0.41 105.19 119.50 3n9n n GLY 579 Ca -0.19 -1.54 -0.03 0.00 0.00 0.00 0.00 46.02 44.26 3n9n n GLY 579 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3n9n s GLY 580 N -1.36 -0.08 0.08 -0.02 0.00 -0.65 -0.10 107.32 105.19 3n9n s GLY 580 Ca 0.05 2.31 0.07 0.00 0.00 0.00 0.00 44.72 47.15 3n9n s GLY 580 CO 0.04 0.88 -0.12 -1.31 0.00 0.00 0.00 173.10 172.59 3n9n s ASN 581 N -1.47 4.26 0.11 1.64 -0.87 0.18 -1.93 114.94 116.87 3n9n s ASN 581 Ca 0.09 -0.38 -0.17 0.00 -1.57 0.00 0.00 52.86 50.82 3n9n s ASN 581 Cb -0.01 -0.79 0.04 0.00 -0.02 0.00 0.00 41.25 40.47 3n9n s ASN 581 CO -0.05 0.20 0.43 0.72 -2.57 0.00 0.00 177.10 175.83 3n9n s PHE 582 N -1.13 -0.26 0.04 2.20 -0.12 -0.75 -3.55 117.98 114.41 3n9n s PHE 582 Ca 0.19 0.02 0.04 0.00 -0.05 0.00 0.00 56.93 57.13 3n9n s PHE 582 Cb -0.11 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.53 3n9n s PHE 582 CO 0.11 -0.69 -0.03 -0.51 -0.05 0.00 0.00 175.22 174.05 3n9n s LEU 583 N -2.62 3.35 0.03 -1.99 1.43 -1.26 -0.43 118.68 117.19 3n9n s LEU 583 Ca 0.01 -0.14 -0.11 0.00 -1.03 0.00 0.00 54.13 52.86 3n9n s LEU 583 Cb 0.01 -2.00 0.01 0.00 0.03 0.00 0.00 46.19 44.24 3n9n s LEU 583 CO -0.10 0.24 0.22 -1.38 0.23 0.00 0.00 176.35 175.56 3n9n s HIS 584 N -1.14 -0.01 0.41 0.29 -3.43 -1.26 -0.91 115.29 109.24 3n9n s HIS 584 Ca 0.21 -0.13 0.09 0.00 -0.80 0.00 0.00 55.06 54.43 3n9n s HIS 584 Cb -0.11 0.01 0.89 0.00 -1.43 0.00 0.00 32.58 31.94 3n9n s HIS 584 CO 0.12 -0.41 2.01 -0.07 -2.00 0.00 0.00 174.74 174.39 3n9n h LEU 585 N 3.60 0.48 -2.01 5.38 4.07 -1.96 -1.56 115.31 123.31 3n9n h LEU 585 Ca -0.31 -0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.64 3n9n h LEU 585 Cb 1.19 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.82 3n9n h LEU 585 CO 0.45 0.32 0.00 1.23 -1.08 0.00 0.00 178.44 179.36 3n9n h GLY 586 N 0.55 0.00 -1.00 0.83 0.00 -1.84 -2.36 103.07 99.25 3n9n h GLY 586 Ca 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.52 3n9n h GLY 586 CO -0.06 0.00 -0.19 0.70 0.00 0.00 0.00 176.54 176.99 3n9n n ASN 587 N -2.85 2.36 0.07 0.19 3.02 -0.59 -4.60 115.26 112.85 3n9n n ASN 587 Ca -0.01 -3.51 -0.12 0.00 -0.03 0.00 0.00 54.58 50.91 3n9n n ASN 587 Cb 0.15 -0.53 -0.06 0.00 -0.61 0.00 0.00 39.78 38.74 3n9n n ASN 587 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3n9n h LEU 588 N 0.80 -0.28 -0.02 3.41 5.85 -1.37 0.11 115.31 123.82 3n9n h LEU 588 Ca 0.05 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.83 3n9n h LEU 588 Cb 1.20 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.31 3n9n h LEU 588 CO 0.12 -0.15 -0.15 -0.33 -0.34 0.00 0.00 178.44 177.59 3n9n h GLU 589 N -0.19 -0.23 -0.48 1.25 5.08 -1.88 -0.57 114.58 117.56 3n9n h GLU 589 Ca 0.02 0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 3n9n h GLU 589 Cb 0.22 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 3n9n h GLU 589 CO -0.07 -0.15 0.26 1.98 -1.00 0.00 0.00 179.01 180.02 3n9n h MET 590 N -0.24 0.65 -0.28 2.33 4.05 -1.87 0.12 114.93 119.69 3n9n h MET 590 Ca 0.06 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.39 3n9n h MET 590 Cb 0.31 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.97 3n9n h MET 590 CO -0.16 0.49 0.09 1.96 0.23 0.00 0.00 176.91 179.51 3n9n h GLN 591 N 0.66 0.44 -0.65 0.39 4.20 -0.16 -0.57 115.11 119.43 3n9n h GLN 591 Ca 0.17 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.79 3n9n h GLN 591 Cb 0.03 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.71 3n9n h GLN 591 CO -0.03 0.50 0.40 0.52 -0.67 0.00 0.00 178.83 179.56 3n9n h MET 592 N 0.30 0.87 -0.41 1.46 2.86 -0.52 -0.93 114.93 118.55 3n9n h MET 592 Ca 0.09 -0.07 0.06 0.00 -2.06 0.00 0.00 59.70 57.73 3n9n h MET 592 Cb 0.24 -0.19 -0.06 0.00 0.06 0.00 0.00 31.60 31.66 3n9n h MET 592 CO -0.00 0.60 0.08 -0.09 1.06 0.00 0.00 176.91 178.56 3n9n h ARG 593 N 0.88 0.21 -0.44 1.72 9.65 -0.55 0.32 114.38 126.16 3n9n h ARG 593 Ca 0.23 -0.01 -0.06 0.00 -1.10 0.00 0.00 59.98 59.04 3n9n h ARG 593 Cb -0.05 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.46 3n9n h ARG 593 CO -0.05 0.14 0.02 0.28 2.80 0.00 0.00 179.97 183.16 3n9n h VAL 594 N 0.21 1.23 -0.80 0.20 2.07 -0.88 -1.45 116.25 116.82 3n9n h VAL 594 Ca 0.20 -0.91 -0.01 0.00 0.82 0.00 0.00 66.70 66.80 3n9n h VAL 594 Cb 0.24 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 3n9n h VAL 594 CO -0.26 0.32 0.47 0.22 0.02 0.00 0.00 177.57 178.34 3n9n h TYR 595 N 0.67 1.07 -0.60 1.57 3.20 -0.16 0.17 116.97 122.90 3n9n h TYR 595 Ca 0.14 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 3n9n h TYR 595 Cb 0.39 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 38.29 3n9n h TYR 595 CO 0.02 0.73 0.16 0.45 -1.64 0.00 0.00 178.16 177.88 3n9n h HIS 596 N 1.10 0.99 0.22 -3.82 3.86 -0.56 -0.96 115.15 115.98 3n9n h HIS 596 Ca 0.29 -0.11 0.01 0.00 -1.16 0.00 0.00 60.37 59.39 3n9n h HIS 596 Cb -0.02 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.14 3n9n h HIS 596 CO -0.00 0.83 -0.28 1.25 0.86 0.00 0.00 177.93 180.59 3n9n h LEU 597 N 0.86 -0.78 -0.56 2.43 5.85 -0.68 0.11 115.31 122.54 3n9n h LEU 597 Ca 0.19 0.08 0.08 0.00 0.84 0.00 0.00 57.88 59.07 3n9n h LEU 597 Cb 0.33 0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.57 3n9n h LEU 597 CO -0.00 -0.39 0.20 -0.33 -0.34 0.00 0.00 178.44 177.58 3n9n h GLU 598 N -0.56 0.37 -0.48 1.25 5.08 -0.54 -1.20 114.58 118.50 3n9n h GLU 598 Ca 0.01 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3n9n h GLU 598 Cb 0.54 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 3n9n h GLU 598 CO -0.10 0.24 0.08 -0.91 -1.00 0.00 0.00 179.01 177.32 3n9n h ASN 599 N 0.38 0.75 -0.52 1.42 2.35 -0.93 0.18 115.58 119.21 3n9n h ASN 599 Ca 0.28 -0.26 0.05 0.00 -0.55 0.00 0.00 56.30 55.83 3n9n h ASN 599 Cb 0.33 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.45 3n9n h ASN 599 CO -0.29 0.82 0.24 0.00 -1.65 0.00 0.00 177.43 176.55 3n9n h ALA 600 N 0.96 0.66 -0.59 -0.83 0.00 -0.68 -1.97 119.26 116.82 3n9n h ALA 600 Ca 0.14 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 3n9n h ALA 600 Cb 0.38 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3n9n h ALA 600 CO 0.01 -0.13 0.08 0.82 0.00 0.00 0.00 179.25 180.03 3n9n h ILE 601 N 0.46 1.26 0.00 0.00 2.04 -0.85 -2.90 117.51 117.52 3n9n h ILE 601 Ca 0.24 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.08 3n9n h ILE 601 Cb 0.19 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 3n9n h ILE 601 CO -0.19 0.37 0.00 0.03 0.00 0.00 0.00 178.15 178.36 3n9n h ARG 602 N 0.88 0.00 -0.21 2.37 3.08 -0.21 -1.67 114.38 118.62 3n9n h ARG 602 Ca 0.18 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.11 3n9n h ARG 602 Cb 0.45 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.50 3n9n h ARG 602 CO 0.01 0.00 -0.34 0.87 -1.07 0.00 0.00 179.97 179.45 3n9n h LYS 603 N 0.00 0.60 0.28 0.04 1.57 -1.15 -3.36 116.57 114.55 3n9n h LYS 603 Ca 0.00 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 3n9n h LYS 603 Cb 0.32 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.67 3n9n h LYS 603 CO 0.00 0.97 -0.13 0.93 -0.57 0.00 0.00 179.45 180.65 3n9n h GLU 604 N 0.29 -0.36 -6.07 3.15 3.07 -1.52 -3.47 114.58 109.67 3n9n h GLU 604 Ca 0.02 0.02 -0.58 0.00 -0.50 0.00 0.00 59.36 58.32 3n9n h GLU 604 Cb 0.92 0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.88 3n9n h GLU 604 CO 0.08 -0.24 -0.40 0.96 -1.40 0.00 0.00 179.01 178.01 3n9n s ILE 605 N -2.88 5.27 -0.38 3.13 -5.25 -0.67 -5.07 121.20 115.35 3n9n s ILE 605 Ca -0.05 -0.24 -0.13 0.00 -0.99 0.00 0.00 60.65 59.24 3n9n s ILE 605 Cb 0.01 -3.65 0.02 0.00 2.95 0.00 0.00 42.46 41.78 3n9n s ILE 605 CO 0.16 0.03 0.25 -0.13 -1.79 0.00 0.00 174.94 173.47 3n9n s ARG 606 N -2.75 3.03 0.51 0.37 0.52 -1.26 -4.40 118.95 114.96 3n9n s ARG 606 Ca 0.38 -0.96 0.02 0.00 -0.52 0.00 0.00 55.73 54.64 3n9n s ARG 606 Cb -0.12 -3.85 -0.01 0.00 0.52 0.00 0.00 34.95 31.49 3n9n s ARG 606 CO 0.27 -0.67 0.04 0.45 0.02 0.00 0.00 175.30 175.41 3n9n s SER 607 N 1.64 4.17 -0.02 0.23 0.15 -1.26 -5.14 113.70 113.48 3n9n s SER 607 Ca 0.04 -1.61 -0.07 0.00 0.70 0.00 0.00 55.95 55.01 3n9n s SER 607 Cb -0.19 0.49 -0.05 0.00 -1.71 0.00 0.00 66.02 64.56 3n9n s SER 607 CO 0.09 -0.87 0.25 -1.61 1.20 0.00 0.00 173.24 172.30 3n9n s GLU 608 N -3.91 3.58 0.60 5.44 2.02 -1.26 -4.99 118.70 120.18 3n9n s GLU 608 Ca 0.09 -0.05 0.33 0.00 0.02 0.00 0.00 54.97 55.36 3n9n s GLU 608 Cb 0.01 -3.12 1.93 0.00 0.10 0.00 0.00 34.13 33.06 3n9n s GLU 608 CO 0.05 0.68 2.27 0.93 0.02 0.00 0.00 175.26 179.21 3n9n h GLU 609 N 4.26 0.00 0.00 1.61 5.08 -2.01 -2.24 114.58 121.29 3n9n h GLU 609 Ca -0.51 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 3n9n h GLU 609 Cb 1.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 3n9n h GLU 609 CO 0.64 0.01 0.00 1.57 -1.00 0.00 0.00 179.01 180.23 3n9n h LYS 610 N 0.00 0.00 -0.17 2.33 2.10 -2.00 -1.75 116.57 117.08 3n9n h LYS 610 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3n9n h LYS 610 Cb 0.03 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.36 3n9n h LYS 610 CO 0.00 0.00 0.00 1.19 -2.00 0.00 0.00 179.45 178.64 3n9n n PHE 611 N -2.96 0.22 -4.46 0.07 3.01 -0.84 -4.86 117.46 107.65 3n9n n PHE 611 Ca 0.01 -0.11 -0.24 0.00 1.01 0.00 0.00 57.45 58.11 3n9n n PHE 611 Cb 0.28 0.00 -0.10 0.00 -0.01 0.00 0.00 39.48 39.65 3n9n n PHE 611 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 3n9n s TYR 612 N -1.78 2.33 -0.01 1.38 1.51 -0.66 -4.74 117.35 115.38 3n9n s TYR 612 Ca 0.30 -0.34 -0.30 0.00 -1.01 0.00 0.00 57.07 55.73 3n9n s TYR 612 Cb 0.16 -1.04 -0.08 0.00 -0.11 0.00 0.00 41.96 40.89 3n9n s TYR 612 CO 0.24 0.70 1.91 0.12 -1.11 0.00 0.00 175.55 177.40 3n9n s PHE 613 N -2.51 1.45 0.11 2.71 5.36 -1.26 -4.89 117.98 118.96 3n9n s PHE 613 Ca 0.30 -0.20 -0.34 0.00 -0.96 0.00 0.00 56.93 55.74 3n9n s PHE 613 Cb -0.04 -4.14 -0.13 0.00 -0.34 0.00 0.00 43.02 38.37 3n9n s PHE 613 CO 0.15 -4.97 1.66 -2.30 -1.46 0.00 0.00 175.22 168.30 3n9n n PRO 614 N 7.56 2.20 -3.95 10.12 -0.02 -1.26 -3.00 135.00 146.65 3n9n n PRO 614 Ca 0.20 0.80 -0.29 0.00 -2.02 0.00 0.00 63.50 62.18 3n9n n PRO 614 Cb 0.42 -2.59 0.01 0.00 -0.02 0.00 0.00 33.50 31.32 3n9n n PRO 614 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3n9n n ASN 615 N 4.21 -3.32 0.18 2.55 3.02 -1.26 -4.62 115.26 116.02 3n9n n ASN 615 Ca 0.18 -0.86 -0.15 0.00 -0.03 0.00 0.00 54.58 53.72 3n9n n ASN 615 Cb 0.29 -3.58 -0.08 0.00 -0.61 0.00 0.00 39.78 35.81 3n9n n ASN 615 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 3n9n h PHE 616 N -1.90 -1.06 -0.01 3.10 3.57 -1.94 -1.11 116.94 117.58 3n9n h PHE 616 Ca -0.59 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 60.92 3n9n h PHE 616 Cb 1.37 0.43 -0.00 0.00 2.79 0.00 0.00 35.95 40.54 3n9n h PHE 616 CO 0.56 -0.51 0.01 0.93 -2.23 0.00 0.00 178.31 177.06 3n9n h GLU 617 N -0.71 0.02 -0.82 1.11 5.08 -1.90 -2.71 114.58 114.66 3n9n h GLU 617 Ca -0.01 -0.00 0.16 0.00 -1.00 0.00 0.00 59.36 58.51 3n9n h GLU 617 Cb 0.68 -0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.83 3n9n h GLU 617 CO -0.14 0.19 0.37 1.25 -1.00 0.00 0.00 179.01 179.69 3n9n h LEU 618 N -0.15 0.38 -0.98 1.33 5.85 -1.94 0.10 115.31 119.90 3n9n h LEU 618 Ca 0.00 0.11 0.11 0.00 0.84 0.00 0.00 57.88 58.95 3n9n h LEU 618 Cb 0.18 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.20 3n9n h LEU 618 CO -0.00 0.13 0.61 0.25 -0.34 0.00 0.00 178.44 179.09 3n9n h LEU 619 N 0.50 0.90 -0.16 2.25 6.46 -0.87 -0.98 115.31 123.40 3n9n h LEU 619 Ca 0.46 0.05 -0.23 0.00 -0.12 0.00 0.00 57.88 58.04 3n9n h LEU 619 Cb 0.72 -0.13 0.01 0.00 -0.73 0.00 0.00 40.66 40.53 3n9n h LEU 619 CO -0.41 0.48 -0.82 0.45 -0.62 0.00 0.00 178.44 177.52 3n9n h HIS 620 N 0.97 1.01 -0.76 1.25 3.86 -0.88 -0.46 115.15 120.14 3n9n h HIS 620 Ca 0.48 -0.46 0.07 0.00 -1.16 0.00 0.00 60.37 59.30 3n9n h HIS 620 Cb 0.46 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 28.71 3n9n h HIS 620 CO -0.01 1.29 0.44 -1.49 0.86 0.00 0.00 177.93 179.02 3n9n h TRP 621 N 0.49 0.80 -0.13 2.45 4.06 -0.68 0.63 115.95 123.57 3n9n h TRP 621 Ca -0.06 0.03 -0.20 0.00 2.06 0.00 0.00 58.89 60.72 3n9n h TRP 621 Cb 1.45 -0.25 0.00 0.00 -1.00 0.00 0.00 29.16 29.36 3n9n h TRP 621 CO 0.08 0.36 -0.72 0.52 -3.56 0.00 0.00 178.44 175.13 3n9n h MET 622 N 0.78 0.61 -0.44 0.49 2.86 -1.10 -1.26 114.93 116.86 3n9n h MET 622 Ca 0.35 -0.47 -0.07 0.00 -2.06 0.00 0.00 59.70 57.45 3n9n h MET 622 Cb 0.25 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 3n9n h MET 622 CO -0.21 1.09 0.00 -0.92 1.06 0.00 0.00 176.91 177.94 3n9n h TYR 623 N 0.42 0.85 0.15 -0.22 5.03 -0.62 0.42 116.97 123.00 3n9n h TYR 623 Ca -0.03 -0.15 -0.01 0.00 2.58 0.00 0.00 58.73 61.12 3n9n h TYR 623 Cb 1.31 -0.22 0.00 0.00 1.55 0.00 0.00 36.73 39.37 3n9n h TYR 623 CO 0.06 0.83 -0.07 1.98 -1.32 0.00 0.00 178.16 179.64 3n9n h MET 624 N 0.62 -0.19 0.46 1.82 4.05 -0.87 -0.78 114.93 120.04 3n9n h MET 624 Ca 0.13 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.54 3n9n h MET 624 Cb 0.49 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.34 3n9n h MET 624 CO 0.02 -0.10 -0.22 -0.09 0.23 0.00 0.00 176.91 176.75 3n9n h ARG 625 N -0.24 -0.60 0.00 0.39 2.43 -1.10 0.34 114.38 115.60 3n9n h ARG 625 Ca -0.02 0.04 -0.06 0.00 -0.81 0.00 0.00 59.98 59.13 3n9n h ARG 625 Cb 0.18 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.86 3n9n h ARG 625 CO 0.03 -0.33 -0.44 -0.91 -1.51 0.00 0.00 179.97 176.82 3n9n h ASN 626 N -0.78 0.00 0.00 -3.80 4.21 -0.22 -3.39 115.58 111.61 3n9n h ASN 626 Ca -0.06 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.45 3n9n h ASN 626 Cb 0.55 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.75 3n9n h ASN 626 CO 0.10 0.27 0.00 0.52 -1.29 0.00 0.00 177.43 177.04 3n9n n VAL 627 N -3.10 0.00 -0.11 2.81 0.31 -0.35 -4.70 118.33 113.19 3n9n n VAL 627 Ca 0.02 0.07 -0.07 0.00 -0.01 0.00 0.00 64.34 64.34 3n9n n VAL 627 Cb 0.65 -0.95 0.01 0.00 -0.91 0.00 0.00 33.84 32.64 3n9n n VAL 627 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3n9n h LEU 628 N 0.00 0.30 -0.30 7.52 4.07 -1.44 -2.22 115.31 123.23 3n9n h LEU 628 Ca 0.00 0.01 0.07 0.00 0.08 0.00 0.00 57.88 58.04 3n9n h LEU 628 Cb 0.00 -0.05 -0.07 0.00 1.08 0.00 0.00 40.66 41.62 3n9n h LEU 628 CO 0.00 0.22 -0.14 0.25 -1.08 0.00 0.00 178.44 177.70 3n9n h LEU 629 N 0.40 -0.46 -0.47 1.67 6.46 -1.11 0.10 115.31 121.91 3n9n h LEU 629 Ca 0.15 0.11 0.02 0.00 -0.12 0.00 0.00 57.88 58.04 3n9n h LEU 629 Cb 0.04 0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.19 3n9n h LEU 629 CO -0.09 -0.17 0.28 -0.08 -0.62 0.00 0.00 178.44 177.77 3n9n h GLU 630 N -0.09 0.56 -0.64 1.25 4.81 -1.69 1.00 114.58 119.78 3n9n h GLU 630 Ca 0.16 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.34 3n9n h GLU 630 Cb 0.32 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 3n9n h GLU 630 CO -0.36 0.37 0.33 0.87 -0.73 0.00 0.00 179.01 179.49 3n9n h LYS 631 N 0.57 0.90 -0.33 1.92 1.57 -0.76 -0.38 116.57 120.07 3n9n h LYS 631 Ca 0.19 -0.12 -0.09 0.00 -1.87 0.00 0.00 60.65 58.76 3n9n h LYS 631 Cb -0.00 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 3n9n h LYS 631 CO -0.08 0.70 -0.13 0.82 -0.57 0.00 0.00 179.45 180.19 3n9n h ILE 632 N 0.88 1.29 -0.32 1.86 2.04 -0.70 -2.43 117.51 120.12 3n9n h ILE 632 Ca 0.22 -1.22 0.03 0.00 1.00 0.00 0.00 64.86 64.89 3n9n h ILE 632 Cb 0.07 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3n9n h ILE 632 CO -0.03 0.40 0.12 0.74 0.00 0.00 0.00 178.15 179.38 3n9n h THR 633 N 0.45 0.93 -0.22 -0.27 2.02 -0.57 -0.24 112.91 115.02 3n9n h THR 633 Ca 0.08 -0.09 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 3n9n h THR 633 Cb 0.65 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 3n9n h THR 633 CO 0.04 0.05 0.12 -0.33 0.37 0.00 0.00 175.52 175.77 3n9n h GLU 634 N 0.27 0.31 -0.32 6.66 5.08 -1.06 -0.51 114.58 125.01 3n9n h GLU 634 Ca 0.14 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.50 3n9n h GLU 634 Cb 0.10 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 3n9n h GLU 634 CO -0.13 0.29 0.08 0.00 -1.00 0.00 0.00 179.01 178.25 3n9n h ALA 635 N 1.00 0.35 -0.89 3.43 0.00 -1.23 -2.11 119.26 119.81 3n9n h ALA 635 Ca 0.08 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.14 3n9n h ALA 635 Cb 0.07 0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.85 3n9n h ALA 635 CO -0.01 -0.33 0.53 -0.91 0.00 0.00 0.00 179.25 178.53 3n9n h ASN 636 N 0.20 0.77 0.77 0.00 2.35 -0.55 -2.21 115.58 116.91 3n9n h ASN 636 Ca 0.15 0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.93 3n9n h ASN 636 Cb 0.15 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.41 3n9n h ASN 636 CO -0.18 0.44 -0.04 1.56 -1.65 0.00 0.00 177.43 177.56 3n9n h GLN 637 N 0.88 0.00 0.00 0.81 4.20 -0.41 -3.43 115.11 117.15 3n9n h GLN 637 Ca 0.43 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.14 3n9n h GLN 637 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 3n9n h GLN 637 CO -0.25 0.04 0.00 -0.85 -0.67 0.00 0.00 178.83 177.10 3n9n n GLU 638 N -3.18 3.72 0.00 1.46 0.00 -0.83 -5.04 120.64 116.77 3n9n n GLU 638 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 3n9n n GLU 638 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.71 3n9n n GLU 638 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3n9n n GLY 639 N 5.00 0.00 3.16 -1.84 0.00 -1.26 -4.94 105.19 105.31 3n9n n GLY 639 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 3n9n n GLY 639 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3n9n s SER 640 N 0.00 -0.72 -0.49 1.61 0.15 -1.24 -4.95 113.70 108.05 3n9n s SER 640 Ca 0.00 0.48 -0.29 0.00 0.70 0.00 0.00 55.95 56.84 3n9n s SER 640 Cb 0.00 1.62 0.03 0.00 -1.71 0.00 0.00 66.02 65.96 3n9n s SER 640 CO 0.00 -0.14 1.12 -0.62 1.20 0.00 0.00 173.24 174.81 3n9n s ASP 641 N 2.91 6.60 0.64 5.45 -1.08 -1.26 -4.59 116.67 125.34 3n9n s ASP 641 Ca 0.05 0.40 0.38 0.00 -0.52 0.00 0.00 52.55 52.86 3n9n s ASP 641 Cb -0.11 -2.54 2.16 0.00 -1.46 0.00 0.00 42.92 40.96 3n9n s ASP 641 CO -0.14 -1.26 2.31 0.24 0.52 0.00 0.00 175.17 176.84 3n9n h MET 642 N 9.25 0.00 0.00 4.34 2.86 -1.93 -2.18 114.93 127.27 3n9n h MET 642 Ca -0.23 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.41 3n9n h MET 642 Cb 1.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.72 3n9n h MET 642 CO 1.13 0.00 0.01 0.00 1.06 0.00 0.00 176.91 179.11 3n9n h ARG 643 N 0.00 0.00 0.04 1.72 3.08 -1.91 0.24 114.38 117.55 3n9n h ARG 643 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 3n9n h ARG 643 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 3n9n h ARG 643 CO -0.00 0.00 -0.02 0.93 -1.07 0.00 0.00 179.97 179.81 3n9n h GLU 644 N 0.00 -0.06 -0.34 0.04 4.39 -1.81 -3.34 114.58 113.47 3n9n h GLU 644 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3n9n h GLU 644 Cb 0.02 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3n9n h GLU 644 CO 0.00 -0.04 0.00 1.04 -1.16 0.00 0.00 179.01 178.85 3n9n n GLN 645 N -2.59 3.14 -2.23 2.33 1.13 -1.22 -4.63 117.38 113.31 3n9n n GLN 645 Ca -0.01 -2.69 -0.03 0.00 -1.94 0.00 0.00 57.00 52.33 3n9n n GLN 645 Cb 0.02 -1.75 0.08 0.00 0.11 0.00 0.00 30.24 28.70 3n9n n GLN 645 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3n9n n GLU 646 N -0.05 1.00 -0.30 -1.09 1.02 0.73 -4.96 120.64 116.98 3n9n n GLU 646 Ca 0.20 -1.08 0.02 0.00 -0.02 0.00 0.00 57.16 56.28 3n9n n GLU 646 Cb 0.81 0.42 0.16 0.00 -0.02 0.00 0.00 31.44 32.81 3n9n n GLU 646 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3n9n h LYS 647 N 0.73 0.84 -0.27 3.49 1.63 -1.39 -1.72 116.57 119.87 3n9n h LYS 647 Ca -0.44 -0.05 0.01 0.00 -0.85 0.00 0.00 60.65 59.32 3n9n h LYS 647 Cb 1.29 -0.19 -0.02 0.00 -0.60 0.00 0.00 32.23 32.72 3n9n h LYS 647 CO -0.20 0.56 0.16 -2.95 -3.45 0.00 0.00 179.45 173.57 3n9n h ASN 648 N 0.87 0.27 -0.57 4.20 -0.00 -1.92 -1.12 115.58 117.31 3n9n h ASN 648 Ca 0.39 0.00 0.01 0.00 -0.00 0.00 0.00 56.30 56.70 3n9n h ASN 648 Cb 0.29 -0.06 -0.03 0.00 -0.00 0.00 0.00 38.32 38.53 3n9n h ASN 648 CO -0.22 0.20 0.38 0.40 -0.00 0.00 0.00 177.43 178.18 3n9n h ILE 649 N 0.34 1.15 0.72 6.14 1.08 -1.83 -2.30 117.51 122.81 3n9n h ILE 649 Ca 0.11 -0.27 -0.03 0.00 -0.39 0.00 0.00 64.86 64.27 3n9n h ILE 649 Cb -0.01 0.31 0.00 0.00 -3.07 0.00 0.00 36.82 34.06 3n9n h ILE 649 CO -0.04 0.14 -0.37 -0.25 -0.69 0.00 0.00 178.15 176.93 3n9n h TRP 650 N 0.77 -0.98 -0.50 1.37 2.91 -1.01 -1.89 115.95 116.63 3n9n h TRP 650 Ca 0.21 -0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.21 3n9n h TRP 650 Cb -0.09 0.33 -0.02 0.00 -0.51 0.00 0.00 29.16 28.87 3n9n h TRP 650 CO -0.03 -0.59 0.30 1.79 -1.03 0.00 0.00 178.44 178.87 3n9n h THR 651 N -1.01 1.14 -0.48 2.65 1.35 -1.18 -1.49 112.91 113.89 3n9n h THR 651 Ca -0.10 -0.32 -0.04 0.00 -0.55 0.00 0.00 66.41 65.40 3n9n h THR 651 Cb 0.79 0.44 -0.02 0.00 -1.73 0.00 0.00 68.15 67.63 3n9n h THR 651 CO 0.14 0.15 0.14 0.00 -0.25 0.00 0.00 175.52 175.70 3n9n h ALA 652 N 1.64 0.64 -0.39 6.62 0.00 -1.36 -2.22 119.26 124.19 3n9n h ALA 652 Ca 0.18 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.97 3n9n h ALA 652 Cb -0.02 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 17.51 3n9n h ALA 652 CO -0.03 0.30 -0.05 0.77 0.00 0.00 0.00 179.25 180.24 3n9n h SER 653 N 0.65 -0.26 -0.28 0.00 0.02 -0.43 0.29 113.55 113.55 3n9n h SER 653 Ca 0.15 0.10 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 3n9n h SER 653 Cb 0.29 0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 3n9n h SER 653 CO -0.00 -0.09 0.18 1.56 -1.14 0.00 0.00 176.83 177.34 3n9n h GLN 654 N 0.05 0.37 -0.00 3.45 4.20 -1.39 0.37 115.11 122.15 3n9n h GLN 654 Ca 0.19 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 3n9n h GLN 654 Cb 0.28 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 3n9n h GLN 654 CO -0.36 0.26 0.00 0.82 -0.67 0.00 0.00 178.83 178.88 3n9n h ILE 655 N 0.36 1.05 -0.48 2.54 2.04 -0.89 -0.56 117.51 121.57 3n9n h ILE 655 Ca 0.10 -0.14 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 3n9n h ILE 655 Cb -0.02 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.18 3n9n h ILE 655 CO -0.02 0.04 0.21 -0.03 0.00 0.00 0.00 178.15 178.35 3n9n h MET 656 N -0.06 0.71 -0.17 2.37 4.05 -0.29 -2.49 114.93 119.05 3n9n h MET 656 Ca 0.00 -0.12 0.04 0.00 -0.28 0.00 0.00 59.70 59.34 3n9n h MET 656 Cb 0.06 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 30.70 3n9n h MET 656 CO -0.00 0.62 -0.06 -0.22 0.23 0.00 0.00 176.91 177.48 3n9n h LYS 657 N 0.64 -0.02 -0.83 0.39 3.64 -0.07 -0.56 116.57 119.75 3n9n h LYS 657 Ca 0.16 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 59.60 3n9n h LYS 657 Cb 0.16 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.94 3n9n h LYS 657 CO -0.02 -0.02 0.55 0.00 -2.27 0.00 0.00 179.45 177.69 3n9n h ALA 658 N 1.14 1.55 -0.28 5.00 0.00 -0.98 0.32 119.26 126.01 3n9n h ALA 658 Ca 0.08 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3n9n h ALA 658 Cb 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3n9n h ALA 658 CO -0.18 0.34 -0.05 1.49 0.00 0.00 0.00 179.25 180.84 3n9n h GLU 659 N 0.96 0.53 0.00 0.00 4.57 -0.96 -2.93 114.58 116.75 3n9n h GLU 659 Ca 0.35 -0.20 -0.09 0.00 -1.18 0.00 0.00 59.36 58.24 3n9n h GLU 659 Cb 0.15 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.70 3n9n h GLU 659 CO -0.12 0.72 -0.42 0.52 -1.18 0.00 0.00 179.01 178.53 3n9n h MET 660 N 0.29 0.00 -0.64 1.92 2.86 -0.03 -1.77 114.93 117.56 3n9n h MET 660 Ca 0.07 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.70 3n9n h MET 660 Cb 0.52 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.15 3n9n h MET 660 CO 0.02 0.42 0.33 0.93 1.06 0.00 0.00 176.91 179.68 3n9n h GLU 661 N 0.00 0.89 -0.45 1.72 4.39 -0.33 -0.35 114.58 120.45 3n9n h GLU 661 Ca -0.00 -0.10 -0.11 0.00 0.34 0.00 0.00 59.36 59.48 3n9n h GLU 661 Cb 0.77 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 3n9n h GLU 661 CO 0.06 0.67 -0.16 0.00 -1.16 0.00 0.00 179.01 178.41 3n9n h ARG 662 N 0.89 0.91 -0.49 2.33 3.08 -1.16 -2.21 114.38 117.72 3n9n h ARG 662 Ca 0.22 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 3n9n h ARG 662 Cb 0.05 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.04 3n9n h ARG 662 CO -0.03 1.02 0.28 -1.49 -1.07 0.00 0.00 179.97 178.68 3n9n h TRP 663 N 0.74 0.67 0.20 3.04 6.55 -1.02 -1.87 115.95 124.25 3n9n h TRP 663 Ca 0.11 -0.01 -0.00 0.00 0.95 0.00 0.00 58.89 59.94 3n9n h TRP 663 Cb 0.72 -0.22 -0.01 0.00 -0.86 0.00 0.00 29.16 28.80 3n9n h TRP 663 CO 0.05 0.48 -0.14 0.52 -1.05 0.00 0.00 178.44 178.30 3n9n h MET 664 N 0.66 -0.33 -0.83 0.49 2.86 -0.99 -0.38 114.93 116.40 3n9n h MET 664 Ca 0.18 0.02 0.10 0.00 -2.06 0.00 0.00 59.70 57.94 3n9n h MET 664 Cb 0.02 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 31.70 3n9n h MET 664 CO -0.03 -0.22 0.54 0.22 1.06 0.00 0.00 176.91 178.48 3n9n h ASP 665 N -0.34 0.71 -0.36 1.22 3.58 -1.34 -1.03 116.42 118.86 3n9n h ASP 665 Ca -0.01 0.02 -0.13 0.00 0.42 0.00 0.00 57.03 57.33 3n9n h ASP 665 Cb 0.30 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 3n9n h ASP 665 CO -0.00 0.41 -0.27 -0.09 -2.88 0.00 0.00 179.24 176.42 3n9n h ARG 666 N 0.78 0.81 -0.13 0.28 2.43 -0.79 -0.56 114.38 117.20 3n9n h ARG 666 Ca 0.39 -0.40 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 3n9n h ARG 666 Cb 0.46 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 3n9n h ARG 666 CO -0.16 1.03 -0.18 1.49 -1.51 0.00 0.00 179.97 180.64 3n9n h GLU 667 N 0.60 0.22 0.08 0.20 4.81 -0.20 -2.07 114.58 118.21 3n9n h GLU 667 Ca 0.07 -0.06 -0.26 0.00 -0.13 0.00 0.00 59.36 58.98 3n9n h GLU 667 Cb 0.84 -0.03 0.02 0.00 0.63 0.00 0.00 28.75 30.22 3n9n h GLU 667 CO 0.07 0.40 -1.08 -0.07 -0.73 0.00 0.00 179.01 177.60 3n9n h LEU 668 N 0.20 0.82 -1.40 1.64 3.38 -1.06 0.67 115.31 119.56 3n9n h LEU 668 Ca 0.04 -0.80 -0.02 0.00 0.09 0.00 0.00 57.88 57.19 3n9n h LEU 668 Cb 0.45 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3n9n h LEU 668 CO 0.03 1.53 0.19 0.03 0.09 0.00 0.00 178.44 180.30 3n9n h ARG 669 N 0.21 0.59 0.00 1.13 3.08 -0.78 -3.34 114.38 115.28 3n9n h ARG 669 Ca -0.16 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.82 3n9n h ARG 669 Cb 1.76 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 31.70 3n9n h ARG 669 CO 0.21 0.47 -0.29 1.47 -1.07 0.00 0.00 179.97 180.76 3n9n n LEU 670 N -4.39 0.04 0.00 3.04 -0.00 -0.81 -5.10 117.00 109.78 3n9n n LEU 670 Ca 0.03 -0.62 0.00 0.00 -0.00 0.00 0.00 56.01 55.42 3n9n n LEU 670 Cb 0.13 -0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.55 3n9n n LEU 670 CO 0.37 0.16 0.00 0.61 -0.00 0.00 0.00 177.39 178.52 3n9n n GLY 671 N -0.02 -1.95 3.65 1.47 0.00 0.23 -4.97 105.19 103.60 3n9n n GLY 671 Ca 0.00 -1.51 -0.29 0.00 0.00 0.00 0.00 46.02 44.22 3n9n n GLY 671 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3n9n s PRO 672 N -2.53 0.47 0.00 1.61 0.02 -1.25 -4.61 135.00 128.71 3n9n s PRO 672 Ca 0.00 0.82 0.00 0.00 0.02 0.00 0.00 61.00 61.84 3n9n s PRO 672 Cb 0.00 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.80 3n9n s PRO 672 CO 0.00 -2.78 0.00 0.39 -0.33 0.00 0.00 177.00 174.28 3n9n n GLU 673 N -4.25 3.54 -0.34 5.54 4.71 -1.26 -5.05 120.64 123.53 3n9n n GLU 673 Ca 0.06 0.00 -0.10 0.00 -0.01 0.00 0.00 57.16 57.11 3n9n n GLU 673 Cb 0.55 0.00 0.09 0.00 -1.01 0.00 0.00 31.44 31.07 3n9n n GLU 673 CO 0.00 0.00 0.00 1.63 0.09 0.00 0.00 177.13 178.85 3n9n n LYS 674 N 0.00 -1.84 -1.74 3.49 4.76 -1.26 -4.97 118.16 116.60 3n9n n LYS 674 Ca 0.00 -0.59 -0.38 0.00 -2.87 0.00 0.00 58.31 54.47 3n9n n LYS 674 Cb 0.00 -0.57 0.06 0.00 -1.84 0.00 0.00 35.03 32.68 3n9n n LYS 674 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3n9n s ASN 675 N -2.51 4.91 0.34 4.39 4.22 -1.26 -4.76 114.94 120.27 3n9n s ASN 675 Ca 0.24 2.72 0.00 0.00 -2.14 0.00 0.00 52.86 53.68 3n9n s ASN 675 Cb -0.02 -2.63 0.00 0.00 1.28 0.00 0.00 41.25 39.88 3n9n s ASN 675 CO 0.19 -1.81 0.00 0.00 -2.04 0.00 0.00 177.10 173.44 3n9n n ALA 676 N -1.46 -3.24 -0.04 3.54 0.00 -1.26 -5.00 120.51 113.05 3n9n n ALA 676 Ca 0.13 0.48 -0.03 0.00 0.00 0.00 0.00 53.44 54.02 3n9n n ALA 676 Cb 0.46 -1.17 -0.09 0.00 0.00 0.00 0.00 19.45 18.66 3n9n n ALA 676 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3n9n n ILE 677 N -3.91 0.61 -3.78 0.00 5.41 -1.26 -4.90 119.36 111.52 3n9n n ILE 677 Ca -0.01 -0.42 -0.37 0.00 1.00 0.00 0.00 62.75 62.95 3n9n n ILE 677 Cb 0.57 -0.54 -0.13 0.00 -0.71 0.00 0.00 39.64 38.84 3n9n n ILE 677 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 3n9n s LEU 678 N -4.62 3.62 0.63 1.39 1.43 -1.26 -5.09 118.68 114.79 3n9n s LEU 678 Ca -0.05 -0.55 -0.18 0.00 -1.03 0.00 0.00 54.13 52.31 3n9n s LEU 678 Cb 0.04 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 3n9n s LEU 678 CO 0.45 -0.13 1.30 -2.84 0.23 0.00 0.00 176.35 175.36 3n9n s PRO 679 N 1.52 2.63 0.43 1.29 0.02 -1.26 -4.87 135.00 134.77 3n9n s PRO 679 Ca 0.04 2.08 0.15 0.00 0.02 0.00 0.00 61.00 63.28 3n9n s PRO 679 Cb -0.16 -1.89 1.04 0.00 0.02 0.00 0.00 34.50 33.51 3n9n s PRO 679 CO 0.02 -1.54 1.95 1.15 -0.33 0.00 0.00 177.00 178.25 3n9n h THR 680 N 0.66 0.85 -0.43 0.99 2.02 -2.00 -2.35 112.91 112.65 3n9n h THR 680 Ca -0.51 -0.14 -0.11 0.00 0.77 0.00 0.00 66.41 66.42 3n9n h THR 680 Cb 1.33 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 3n9n h THR 680 CO 0.54 0.07 -0.17 -0.78 0.37 0.00 0.00 175.52 175.55 3n9n h ASP 681 N 0.41 0.89 -0.78 4.18 -0.00 -1.99 -1.54 116.42 117.59 3n9n h ASP 681 Ca 0.32 -0.39 -0.03 0.00 -0.00 0.00 0.00 57.03 56.93 3n9n h ASP 681 Cb 0.69 -0.25 -0.04 0.00 -0.00 0.00 0.00 39.33 39.74 3n9n h ASP 681 CO -0.09 1.08 0.38 0.44 -0.00 0.00 0.00 179.24 181.05 3n9n h ASP 682 N 0.69 1.02 0.38 2.28 3.45 -1.80 -1.21 116.42 121.24 3n9n h ASP 682 Ca 0.10 -0.12 -0.02 0.00 0.43 0.00 0.00 57.03 57.42 3n9n h ASP 682 Cb 0.73 -0.26 0.00 0.00 -0.56 0.00 0.00 39.33 39.24 3n9n h ASP 682 CO 0.06 0.86 -0.18 0.11 -1.57 0.00 0.00 179.24 178.51 3n9n h LYS 683 N 1.12 -0.49 -0.76 3.56 1.57 -1.22 -1.29 116.57 119.07 3n9n h LYS 683 Ca 0.27 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 59.22 3n9n h LYS 683 Cb 0.11 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.48 3n9n h LYS 683 CO -0.04 -0.29 0.50 -0.97 -0.57 0.00 0.00 179.45 178.09 3n9n h ASN 684 N -0.58 0.44 -0.08 0.86 -0.00 -1.04 -0.04 115.58 115.14 3n9n h ASN 684 Ca -0.05 0.02 -0.19 0.00 -0.00 0.00 0.00 56.30 56.08 3n9n h ASN 684 Cb 0.43 -0.07 0.00 0.00 -0.00 0.00 0.00 38.32 38.69 3n9n h ASN 684 CO 0.09 0.24 -0.66 0.11 -0.00 0.00 0.00 177.43 177.21 3n9n h LYS 685 N 0.48 0.70 -0.04 6.67 1.57 -0.90 -1.21 116.57 123.84 3n9n h LYS 685 Ca 0.37 -0.50 -0.00 0.00 -1.87 0.00 0.00 60.65 58.64 3n9n h LYS 685 Cb 0.76 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 33.16 3n9n h LYS 685 CO -0.13 1.12 0.01 0.82 -0.57 0.00 0.00 179.45 180.71 3n9n h ILE 686 N 0.51 1.19 -0.81 1.86 2.04 -0.17 -2.26 117.51 119.87 3n9n h ILE 686 Ca -0.02 -0.56 0.06 0.00 1.00 0.00 0.00 64.86 65.34 3n9n h ILE 686 Cb 1.25 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 38.76 3n9n h ILE 686 CO 0.13 0.15 0.50 0.24 0.00 0.00 0.00 178.15 179.17 3n9n h MET 687 N -0.15 0.89 -0.50 2.37 2.86 -1.00 0.25 114.93 119.64 3n9n h MET 687 Ca 0.01 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 3n9n h MET 687 Cb 0.24 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.67 3n9n h MET 687 CO 0.00 0.59 0.32 0.82 1.06 0.00 0.00 176.91 179.70 3n9n h ILE 688 N 0.92 1.10 -0.24 -1.22 2.04 -1.15 0.25 117.51 119.21 3n9n h ILE 688 Ca 0.35 -0.22 -0.10 0.00 1.00 0.00 0.00 64.86 65.89 3n9n h ILE 688 Cb 0.14 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 3n9n h ILE 688 CO -0.16 0.12 -0.27 -1.28 0.00 0.00 0.00 178.15 176.56 3n9n h SER 689 N 0.65 0.48 -0.07 1.72 0.87 -0.69 -1.83 113.55 114.68 3n9n h SER 689 Ca 0.19 -0.17 -0.02 0.00 -1.23 0.00 0.00 61.79 60.57 3n9n h SER 689 Cb -0.04 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 61.78 3n9n h SER 689 CO -0.06 0.74 -0.03 0.58 -0.53 0.00 0.00 176.83 177.53 3n9n h VAL 690 N 0.42 1.31 -0.92 2.23 2.07 0.04 -2.55 116.25 118.85 3n9n h VAL 690 Ca 0.06 -1.00 0.08 0.00 0.82 0.00 0.00 66.70 66.66 3n9n h VAL 690 Cb 0.69 1.85 -0.07 0.00 -1.52 0.00 0.00 31.29 32.24 3n9n h VAL 690 CO 0.05 0.28 0.57 0.03 0.02 0.00 0.00 177.57 178.52 3n9n h ARG 691 N -0.23 0.98 0.51 1.57 3.08 -0.38 -0.68 114.38 119.23 3n9n h ARG 691 Ca 0.02 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 59.98 3n9n h ARG 691 Cb 0.45 -0.22 0.01 0.00 0.08 0.00 0.00 29.97 30.29 3n9n h ARG 691 CO 0.01 0.65 -0.25 -0.22 -1.07 0.00 0.00 179.97 179.09 3n9n h LYS 692 N 1.01 -0.66 -0.09 0.04 3.64 -1.24 0.59 116.57 119.85 3n9n h LYS 692 Ca 0.41 0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.78 3n9n h LYS 692 Cb 0.25 0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3n9n h LYS 692 CO -0.20 -0.41 -0.21 1.96 -2.27 0.00 0.00 179.45 178.32 3n9n h GLN 693 N -0.76 0.15 -0.14 1.90 1.08 -1.29 -0.87 115.11 115.17 3n9n h GLN 693 Ca -0.07 -0.04 -0.06 0.00 -1.45 0.00 0.00 58.65 57.03 3n9n h GLN 693 Cb 0.56 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.97 3n9n h GLN 693 CO 0.12 0.36 -0.14 0.82 -0.95 0.00 0.00 178.83 179.03 3n9n h ILE 694 N 0.14 1.35 -0.46 2.54 2.04 -0.95 -1.63 117.51 120.54 3n9n h ILE 694 Ca 0.02 -1.31 -0.03 0.00 1.00 0.00 0.00 64.86 64.55 3n9n h ILE 694 Cb 0.46 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.42 3n9n h ILE 694 CO 0.03 0.38 0.16 -0.08 0.00 0.00 0.00 178.15 178.64 3n9n h GLU 695 N -0.05 0.66 -0.02 2.37 4.57 -0.53 -1.93 114.58 119.66 3n9n h GLU 695 Ca 0.02 -0.10 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 3n9n h GLU 695 Cb 0.67 -0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 3n9n h GLU 695 CO 0.03 0.57 -0.00 0.82 -1.18 0.00 0.00 179.01 179.25 3n9n h ILE 696 N 0.66 1.26 -0.71 2.32 2.04 -1.08 -2.72 117.51 119.27 3n9n h ILE 696 Ca 0.16 -0.78 0.05 0.00 1.00 0.00 0.00 64.86 65.28 3n9n h ILE 696 Cb 0.17 1.76 -0.04 0.00 -0.74 0.00 0.00 36.82 37.97 3n9n h ILE 696 CO -0.01 0.21 0.47 -0.61 0.00 0.00 0.00 178.15 178.20 3n9n h GLN 697 N -0.29 0.79 -0.23 2.37 5.75 -0.99 -1.73 115.11 120.78 3n9n h GLN 697 Ca 0.00 -0.05 -0.01 0.00 -0.15 0.00 0.00 58.65 58.44 3n9n h GLN 697 Cb 0.33 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 3n9n h GLN 697 CO 0.00 0.52 0.09 1.79 -2.65 0.00 0.00 178.83 178.58 3n9n h THR 698 N 0.81 1.16 -0.96 2.39 1.35 -1.30 -1.26 112.91 115.11 3n9n h THR 698 Ca 0.29 -0.50 0.17 0.00 -0.55 0.00 0.00 66.41 65.83 3n9n h THR 698 Cb 0.14 1.07 -0.09 0.00 -1.73 0.00 0.00 68.15 67.55 3n9n h THR 698 CO -0.09 0.16 0.61 0.11 -0.25 0.00 0.00 175.52 176.06 3n9n h LYS 699 N 0.22 0.67 -0.30 4.72 1.57 -1.01 0.57 116.57 123.00 3n9n h LYS 699 Ca 0.08 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.72 3n9n h LYS 699 Cb 0.17 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 3n9n h LYS 699 CO -0.01 0.44 -0.22 0.82 -0.57 0.00 0.00 179.45 179.91 3n9n h ILE 700 N 0.69 1.26 0.00 1.86 2.04 -0.92 -1.21 117.51 121.24 3n9n h ILE 700 Ca 0.51 -1.26 -0.18 0.00 1.00 0.00 0.00 64.86 64.93 3n9n h ILE 700 Cb 0.87 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.21 3n9n h ILE 700 CO -0.27 0.41 -0.83 1.56 0.00 0.00 0.00 178.15 179.02 3n9n h GLN 701 N 0.51 0.09 -0.02 2.37 4.20 0.67 -2.20 115.11 120.74 3n9n h GLN 701 Ca 0.08 -0.09 -0.15 0.00 0.06 0.00 0.00 58.65 58.54 3n9n h GLN 701 Cb 0.67 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 3n9n h GLN 701 CO 0.05 0.86 -0.69 -0.91 -0.67 0.00 0.00 178.83 177.48 3n9n h ASN 702 N 0.05 0.13 0.21 1.46 2.35 0.09 -3.31 115.58 116.55 3n9n h ASN 702 Ca -0.02 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.63 3n9n h ASN 702 Cb 1.45 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.78 3n9n h ASN 702 CO 0.12 0.77 -0.10 0.00 -1.65 0.00 0.00 177.43 176.57 3n9n h ALA 703 N 1.23 -0.28 0.00 -0.83 0.00 -1.17 -3.51 119.26 114.70 3n9n h ALA 703 Ca -0.01 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3n9n h ALA 703 Cb 1.22 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3n9n h ALA 703 CO 0.10 -0.34 0.00 1.63 0.00 0.00 0.00 179.25 180.64