#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1whu n SER 268 N 0.00 0.08 -3.77 1.61 7.64 -1.26 -4.98 113.62 112.95 1whu n SER 268 Ca 0.00 1.15 -0.13 0.00 1.01 0.00 0.00 58.87 60.90 1whu n SER 268 Cb 0.00 -1.07 -0.10 0.00 -1.01 0.00 0.00 64.21 62.03 1whu n SER 268 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1whu s SER 269 N -0.49 -0.25 0.00 6.43 1.04 -1.26 -5.02 113.70 114.16 1whu s SER 269 Ca 0.70 0.34 0.00 0.00 0.48 0.00 0.00 55.95 57.48 1whu s SER 269 Cb -0.93 0.48 0.00 0.00 0.10 0.00 0.00 66.02 65.67 1whu s SER 269 CO 0.56 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 175.10 1whu n GLY 270 N 2.06 0.74 3.68 7.32 0.00 -1.26 -5.08 105.19 112.65 1whu n GLY 270 Ca -0.17 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.63 1whu n GLY 270 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1whu s SER 271 N -1.34 7.21 -0.29 1.61 1.04 -1.26 -5.00 113.70 115.66 1whu s SER 271 Ca 0.00 1.49 -0.18 0.00 0.48 0.00 0.00 55.95 57.74 1whu s SER 271 Cb 0.00 -2.55 0.17 0.00 0.10 0.00 0.00 66.02 63.74 1whu s SER 271 CO 0.00 -0.49 1.15 -0.94 0.98 0.00 0.00 173.24 173.94 1whu s SER 272 N 1.12 -0.28 0.08 7.02 1.04 -1.26 -5.09 113.70 116.32 1whu s SER 272 Ca 0.47 0.47 -0.14 0.00 0.48 0.00 0.00 55.95 57.23 1whu s SER 272 Cb -0.18 0.94 0.05 0.00 0.10 0.00 0.00 66.02 66.94 1whu s SER 272 CO 0.15 -0.08 0.66 0.61 0.98 0.00 0.00 173.24 175.57 1whu n GLY 273 N 3.00 0.75 0.20 7.32 0.00 -1.26 -5.03 105.19 110.16 1whu n GLY 273 Ca -0.16 -1.03 -0.05 0.00 0.00 0.00 0.00 46.02 44.78 1whu n GLY 273 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1whu h PRO 274 N 0.00 0.38 -7.40 1.61 0.13 -2.04 -3.45 132.00 121.22 1whu h PRO 274 Ca -0.16 -0.20 -0.50 0.00 -0.87 0.00 0.00 66.00 64.28 1whu h PRO 274 Cb 0.72 0.01 0.08 0.00 0.13 0.00 0.00 31.00 31.94 1whu h PRO 274 CO 0.21 0.75 0.40 -0.65 -0.23 0.00 0.00 178.00 178.48 1whu s GLN 275 N -4.11 3.07 -0.19 0.86 -1.52 -1.26 -4.98 119.66 111.52 1whu s GLN 275 Ca -0.06 0.68 -0.29 0.00 -1.95 0.00 0.00 55.36 53.74 1whu s GLN 275 Cb 0.13 -2.03 -0.03 0.00 -0.22 0.00 0.00 33.01 30.86 1whu s GLN 275 CO 0.80 -0.93 1.57 0.21 -0.25 0.00 0.00 175.29 176.69 1whu s LYS 276 N -5.21 3.90 0.31 2.91 2.20 -1.26 -5.00 119.74 117.59 1whu s LYS 276 Ca 0.57 1.72 -0.00 0.00 -0.36 0.00 0.00 55.97 57.90 1whu s LYS 276 Cb -0.12 -4.00 -0.04 0.00 -1.51 0.00 0.00 37.83 32.17 1whu s LYS 276 CO 0.53 -1.17 0.52 0.42 -0.36 0.00 0.00 175.35 175.30 1whu s ILE 277 N 4.83 5.11 0.10 5.43 -1.09 -1.26 -5.08 121.20 129.24 1whu s ILE 277 Ca 0.69 -0.37 -0.21 0.00 -2.23 0.00 0.00 60.65 58.53 1whu s ILE 277 Cb -0.25 -3.82 -0.07 0.00 -1.58 0.00 0.00 42.46 36.73 1whu s ILE 277 CO 0.28 -0.46 0.64 -0.36 -1.23 0.00 0.00 174.94 173.81 1whu s PHE 278 N -2.20 3.84 0.10 3.97 0.40 -1.26 -5.08 117.98 117.75 1whu s PHE 278 Ca 0.40 1.39 0.00 0.00 -0.60 0.00 0.00 56.93 58.13 1whu s PHE 278 Cb -0.10 -2.59 -0.04 0.00 0.51 0.00 0.00 43.02 40.80 1whu s PHE 278 CO 0.34 0.57 0.26 0.95 0.70 0.00 0.00 175.22 178.04 1whu s THR 279 N -1.12 5.34 1.25 0.64 -4.23 -1.26 -5.11 115.64 111.14 1whu s THR 279 Ca 0.31 -0.42 -0.21 0.00 -1.18 0.00 0.00 61.69 60.19 1whu s THR 279 Cb -0.21 -3.67 0.31 0.00 1.34 0.00 0.00 72.50 70.27 1whu s THR 279 CO 0.21 0.04 1.11 -2.16 -0.54 0.00 0.00 174.62 173.29 1whu s PRO 280 N -2.78 -1.59 -0.07 3.99 0.04 -1.26 -4.94 135.00 128.39 1whu s PRO 280 Ca 0.36 -0.20 -0.30 0.00 0.04 0.00 0.00 61.00 60.91 1whu s PRO 280 Cb -0.12 -1.56 -0.04 0.00 0.04 0.00 0.00 34.50 32.81 1whu s PRO 280 CO 0.28 -3.93 1.51 0.45 0.04 0.00 0.00 177.00 175.34 1whu s SER 281 N -3.99 6.77 0.15 6.66 0.15 -1.26 -4.91 113.70 117.26 1whu s SER 281 Ca 0.72 2.07 -0.14 0.00 0.70 0.00 0.00 55.95 59.30 1whu s SER 281 Cb -0.08 -2.54 0.03 0.00 -1.71 0.00 0.00 66.02 61.72 1whu s SER 281 CO 0.56 -0.85 1.70 0.00 1.20 0.00 0.00 173.24 175.85 1whu h ALA 282 N 8.86 0.62 -0.95 5.45 0.00 -1.98 -1.62 119.26 129.65 1whu h ALA 282 Ca -0.36 -0.15 0.21 0.00 0.00 0.00 0.00 54.91 54.61 1whu h ALA 282 Cb 1.16 -0.19 -0.11 0.00 0.00 0.00 0.00 17.79 18.65 1whu h ALA 282 CO 0.95 0.23 0.52 1.05 0.00 0.00 0.00 179.25 182.00 1whu h GLU 283 N 0.63 0.57 0.00 0.00 4.11 -2.00 -0.04 114.58 117.85 1whu h GLU 283 Ca 0.16 -0.03 -0.21 0.00 0.07 0.00 0.00 59.36 59.35 1whu h GLU 283 Cb 0.20 -0.13 0.02 0.00 0.50 0.00 0.00 28.75 29.33 1whu h GLU 283 CO -0.01 0.38 -0.81 0.82 0.07 0.00 0.00 179.01 179.46 1whu h ILE 284 N 0.59 1.36 -0.81 -1.06 2.04 -1.90 -3.19 117.51 114.54 1whu h ILE 284 Ca 0.57 -2.16 0.10 0.00 1.00 0.00 0.00 64.86 64.38 1whu h ILE 284 Cb 0.99 2.51 -0.08 0.00 -0.74 0.00 0.00 36.82 39.50 1whu h ILE 284 CO -0.44 0.65 0.45 0.58 0.00 0.00 0.00 178.15 179.38 1whu h VAL 285 N 0.12 0.86 -0.55 1.67 2.07 -0.17 0.23 116.25 120.48 1whu h VAL 285 Ca -0.10 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.14 1whu h VAL 285 Cb 1.50 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 1whu h VAL 285 CO 0.16 0.13 0.21 0.11 0.02 0.00 0.00 177.57 178.20 1whu h LYS 286 N 0.73 0.79 0.01 1.57 6.56 -1.13 -2.39 116.57 122.70 1whu h LYS 286 Ca 0.40 -0.12 -0.19 0.00 -1.06 0.00 0.00 60.65 59.68 1whu h LYS 286 Cb 0.42 -0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 31.92 1whu h LYS 286 CO -0.27 0.66 -0.89 -0.92 -2.06 0.00 0.00 179.45 175.97 1whu h TYR 287 N 0.78 0.14 0.00 -1.35 3.20 -1.11 -3.14 116.97 115.50 1whu h TYR 287 Ca 0.19 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1whu h TYR 287 Cb 0.17 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.42 1whu h TYR 287 CO 0.01 0.93 -0.07 1.15 -1.64 0.00 0.00 178.16 178.53 1whu h THR 288 N 0.05 0.43 0.02 1.81 2.02 -0.12 -2.41 112.91 114.70 1whu h THR 288 Ca -0.03 -0.38 -0.27 0.00 0.77 0.00 0.00 66.41 66.50 1whu h THR 288 Cb 1.54 1.26 0.02 0.00 -1.74 0.00 0.00 68.15 69.23 1whu h THR 288 CO 0.13 0.07 -1.07 0.11 0.37 0.00 0.00 175.52 175.13 1whu h LYS 289 N 0.00 0.67 0.00 6.66 1.57 -1.46 0.42 116.57 124.43 1whu h LYS 289 Ca -0.00 -0.74 -0.02 0.00 -1.87 0.00 0.00 60.65 58.02 1whu h LYS 289 Cb 0.26 0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 1whu h LYS 289 CO 0.01 1.32 -0.07 0.82 -0.57 0.00 0.00 179.45 180.96 1whu h ILE 290 N 0.37 0.90 0.02 1.86 5.03 -1.50 0.63 117.51 124.82 1whu h ILE 290 Ca -0.13 -0.26 -0.40 0.00 -0.12 0.00 0.00 64.86 63.95 1whu h ILE 290 Cb 1.72 1.15 -0.06 0.00 -3.03 0.00 0.00 36.82 36.60 1whu h ILE 290 CO 0.21 0.07 -2.34 2.30 -0.68 0.00 0.00 178.15 177.71 1whu n ILE 291 N -4.23 1.55 -0.04 -0.67 -5.35 -1.16 -4.10 119.36 105.36 1whu n ILE 291 Ca -0.03 -0.49 -0.13 0.00 -0.27 0.00 0.00 62.75 61.83 1whu n ILE 291 Cb 0.15 -1.64 -0.08 0.00 -1.74 0.00 0.00 39.64 36.34 1whu n ILE 291 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1whu h ALA 292 N -0.29 0.13 -0.58 -1.28 0.00 -0.09 -3.05 119.26 114.10 1whu h ALA 292 Ca -0.57 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.06 1whu h ALA 292 Cb 1.80 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.56 1whu h ALA 292 CO -0.16 -0.06 0.00 -0.12 0.00 0.00 0.00 179.25 178.91 1whu n MET 293 N -4.69 0.00 -0.36 0.00 0.00 0.22 0.16 117.12 112.45 1whu n MET 293 Ca -0.07 0.59 -0.09 0.00 0.00 0.00 0.00 57.70 58.13 1whu n MET 293 Cb 0.30 -1.40 -0.08 0.00 0.00 0.00 0.00 33.22 32.03 1whu n MET 293 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1whu n GLU 294 N -2.05 -0.37 0.09 2.12 1.02 -1.25 -0.30 120.64 119.90 1whu n GLU 294 Ca 0.00 1.28 -0.07 0.00 -0.02 0.00 0.00 57.16 58.35 1whu n GLU 294 Cb 0.00 -1.88 -0.04 0.00 -0.02 0.00 0.00 31.44 29.50 1whu n GLU 294 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1whu h LYS 295 N 0.00 -0.35 -0.96 3.49 1.79 -1.42 0.31 116.57 119.43 1whu h LYS 295 Ca 0.14 0.02 0.20 0.00 -2.18 0.00 0.00 60.65 58.82 1whu h LYS 295 Cb 0.35 0.08 -0.18 0.00 -1.58 0.00 0.00 32.23 30.89 1whu h LYS 295 CO -0.80 -0.23 -0.22 1.28 -1.08 0.00 0.00 179.45 178.40 1whu n LEU 296 N -3.54 -0.33 -0.23 2.94 4.77 0.12 0.12 117.00 120.86 1whu n LEU 296 Ca -0.04 1.64 -0.08 0.00 -0.03 0.00 0.00 56.01 57.50 1whu n LEU 296 Cb 0.17 -0.50 0.03 0.00 -2.33 0.00 0.00 43.42 40.79 1whu n LEU 296 CO 0.09 -1.58 0.88 1.88 -1.33 0.00 0.00 177.39 177.33 1whu h TYR 297 N 0.00 1.17 0.04 -1.77 0.05 -0.31 -1.62 116.97 114.52 1whu h TYR 297 Ca 0.47 -0.17 -0.00 0.00 0.05 0.00 0.00 58.73 59.08 1whu h TYR 297 Cb 0.73 -0.32 -0.00 0.00 1.01 0.00 0.00 36.73 38.15 1whu h TYR 297 CO -0.72 0.99 -0.02 0.00 -1.05 0.00 0.00 178.16 177.35 1whu h ALA 298 N 1.04 -0.06 0.00 3.88 0.00 0.49 -0.79 119.26 123.81 1whu h ALA 298 Ca 0.20 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1whu h ALA 298 Cb 0.46 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1whu h ALA 298 CO 0.02 -0.53 -0.22 -0.39 0.00 0.00 0.00 179.25 178.13 1whu h VAL 299 N -0.06 1.04 0.38 0.00 -1.51 -0.68 -0.45 116.25 114.96 1whu h VAL 299 Ca -0.00 -0.77 -0.02 0.00 -1.23 0.00 0.00 66.70 64.68 1whu h VAL 299 Cb 0.05 1.43 0.00 0.00 -2.13 0.00 0.00 31.29 30.64 1whu h VAL 299 CO 0.01 0.21 -0.18 0.15 -1.23 0.00 0.00 177.57 176.53 1whu h PHE 300 N 0.00 -0.47 0.00 5.19 3.04 -0.74 0.41 116.94 124.37 1whu h PHE 300 Ca -0.00 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.94 1whu h PHE 300 Cb 0.41 0.16 0.00 0.00 2.56 0.00 0.00 35.95 39.08 1whu h PHE 300 CO 0.00 -0.15 0.00 0.00 -2.02 0.00 0.00 178.31 176.14 1whu h THR 301 N -0.98 0.00 0.00 4.41 1.03 -1.10 -3.26 112.91 113.01 1whu h THR 301 Ca -0.05 -0.34 0.00 0.00 -0.01 0.00 0.00 66.41 66.01 1whu h THR 301 Cb 0.53 1.25 0.00 0.00 -1.07 0.00 0.00 68.15 68.86 1whu h THR 301 CO 0.09 0.00 -0.12 -0.78 -0.01 0.00 0.00 175.52 174.70 1whu h ASP 302 N 0.00 0.00 -2.32 0.00 3.58 -1.04 -3.42 116.42 113.22 1whu h ASP 302 Ca 0.00 0.00 -0.64 0.00 0.42 0.00 0.00 57.03 56.81 1whu h ASP 302 Cb 0.36 0.00 -0.14 0.00 1.72 0.00 0.00 39.33 41.27 1whu h ASP 302 CO 0.00 0.41 0.82 -0.31 -2.88 0.00 0.00 179.24 177.28 1whu s TYR 303 N -1.54 2.77 -0.21 0.28 2.02 0.13 -4.81 117.35 115.98 1whu s TYR 303 Ca -0.03 -0.84 -0.17 0.00 -0.37 0.00 0.00 57.07 55.66 1whu s TYR 303 Cb 0.00 -4.38 -0.13 0.00 -0.40 0.00 0.00 41.96 37.06 1whu s TYR 303 CO 0.05 -1.67 -0.06 -1.91 -1.57 0.00 0.00 175.55 170.38 1whu n GLU 304 N 7.62 0.55 0.00 -0.62 2.13 -1.26 -4.73 120.64 124.33 1whu n GLU 304 Ca 0.12 0.45 0.00 0.00 0.66 0.00 0.00 57.16 58.39 1whu n GLU 304 Cb 0.48 -1.64 0.00 0.00 0.27 0.00 0.00 31.44 30.55 1whu n GLU 304 CO 0.00 0.00 0.00 0.72 -0.41 0.00 0.00 177.13 177.44 1whu n HIS 305 N -4.42 0.00 -1.46 4.31 8.25 -1.26 -4.80 115.22 115.84 1whu n HIS 305 Ca -0.32 0.00 -0.45 0.00 -0.26 0.00 0.00 57.72 56.69 1whu n HIS 305 Cb 0.65 -0.30 -0.11 0.00 1.12 0.00 0.00 29.99 31.34 1whu n HIS 305 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1whu n ASP 306 N -2.01 0.97 0.07 0.41 8.00 -1.26 -4.77 116.55 117.96 1whu n ASP 306 Ca 0.00 0.18 -0.18 0.00 0.71 0.00 0.00 54.79 55.50 1whu n ASP 306 Cb 0.00 -1.08 -0.14 0.00 -0.02 0.00 0.00 41.12 39.88 1whu n ASP 306 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1whu h LYS 307 N 12.82 0.29 -0.49 -1.24 1.57 -1.92 -3.01 116.57 124.59 1whu h LYS 307 Ca -0.12 -0.50 0.14 0.00 -1.87 0.00 0.00 60.65 58.30 1whu h LYS 307 Cb 1.32 0.19 -0.02 0.00 0.08 0.00 0.00 32.23 33.80 1whu h LYS 307 CO 1.25 1.17 0.37 -0.24 -0.57 0.00 0.00 179.45 181.42 1whu h VAL 308 N 0.08 0.71 0.09 0.50 3.04 -2.01 -0.04 116.25 118.62 1whu h VAL 308 Ca -0.26 0.00 -0.34 0.00 -1.01 0.00 0.00 66.70 65.09 1whu h VAL 308 Cb 2.04 0.74 -0.03 0.00 -2.01 0.00 0.00 31.29 32.04 1whu h VAL 308 CO 0.17 0.00 -1.87 0.28 -1.01 0.00 0.00 177.57 175.14 1whu h SER 309 N 0.00 0.30 0.65 3.17 0.02 -1.95 -3.27 113.55 112.47 1whu h SER 309 Ca 0.23 -0.64 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1whu h SER 309 Cb 0.97 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 63.41 1whu h SER 309 CO -0.00 1.57 0.00 -0.09 -1.14 0.00 0.00 176.83 177.17 1whu h ARG 310 N 0.05 0.00 0.09 3.45 2.43 -1.11 0.08 114.38 119.37 1whu h ARG 310 Ca -0.37 0.00 -0.23 0.00 -0.81 0.00 0.00 59.98 58.57 1whu h ARG 310 Cb 2.03 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 31.57 1whu h ARG 310 CO 0.10 0.00 -1.18 0.22 -1.51 0.00 0.00 179.97 177.59 1whu h ASP 311 N 0.00 0.29 1.57 -3.80 3.58 -1.17 -3.22 116.42 113.67 1whu h ASP 311 Ca 0.00 -0.83 0.00 0.00 0.42 0.00 0.00 57.03 56.62 1whu h ASP 311 Cb 0.33 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 41.28 1whu h ASP 311 CO 0.00 1.51 0.00 1.05 -2.88 0.00 0.00 179.24 178.92 1whu h GLU 312 N -0.49 0.00 -0.00 0.28 4.11 -1.57 -2.83 114.58 114.08 1whu h GLU 312 Ca -0.26 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.15 1whu h GLU 312 Cb 1.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.85 1whu h GLU 312 CO 0.02 0.00 -0.06 0.00 0.07 0.00 0.00 179.01 179.04 1whu h ALA 313 N 2.20 0.01 -0.31 1.06 0.00 -1.11 -2.29 119.26 118.83 1whu h ALA 313 Ca 0.00 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.39 1whu h ALA 313 Cb 0.78 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1whu h ALA 313 CO 0.00 -0.07 -0.33 0.28 0.00 0.00 0.00 179.25 179.13 1whu h VAL 314 N -0.69 1.28 0.00 0.00 2.07 -1.61 -2.57 116.25 114.73 1whu h VAL 314 Ca -0.01 -1.46 0.00 0.00 0.82 0.00 0.00 66.70 66.05 1whu h VAL 314 Cb 0.81 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 31.98 1whu h VAL 314 CO 0.01 0.47 0.00 -3.20 0.02 0.00 0.00 177.57 174.88 1whu n ASN 315 N -4.07 0.37 0.14 0.57 5.15 -1.07 -2.63 115.26 113.73 1whu n ASN 315 Ca -0.01 0.56 0.12 0.00 -0.60 0.00 0.00 54.58 54.65 1whu n ASN 315 Cb 0.48 -0.65 0.22 0.00 -0.53 0.00 0.00 39.78 39.31 1whu n ASN 315 CO 0.00 0.00 0.00 0.11 1.40 0.00 0.00 177.26 178.77 1whu h LYS 316 N 0.00 0.00 0.43 1.20 1.79 -0.98 -3.35 116.57 115.66 1whu h LYS 316 Ca 0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1whu h LYS 316 Cb 0.48 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.14 1whu h LYS 316 CO 0.00 0.00 -0.20 0.82 -1.08 0.00 0.00 179.45 178.99 1whu h ILE 317 N 0.00 0.43 -1.38 1.86 2.04 -1.50 -2.59 117.51 116.37 1whu h ILE 317 Ca 0.00 -0.55 0.46 0.00 1.00 0.00 0.00 64.86 65.77 1whu h ILE 317 Cb 0.88 0.63 -0.13 0.00 -0.74 0.00 0.00 36.82 37.46 1whu h ILE 317 CO 0.00 0.08 0.89 0.08 0.00 0.00 0.00 178.15 179.20 1whu h ARG 318 N -0.95 0.05 0.01 2.37 0.11 -1.73 1.50 114.38 115.74 1whu h ARG 318 Ca -0.06 -0.00 -0.25 0.00 0.10 0.00 0.00 59.98 59.77 1whu h ARG 318 Cb 0.56 -0.01 0.01 0.00 1.11 0.00 0.00 29.97 31.64 1whu h ARG 318 CO 0.10 0.03 -1.01 -0.07 0.10 0.00 0.00 179.97 179.12 1whu h LEU 319 N 0.05 0.72 0.03 0.08 3.38 -1.72 -2.97 115.31 114.88 1whu h LEU 319 Ca 0.85 -0.58 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1whu h LEU 319 Cb 2.74 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 43.27 1whu h LEU 319 CO -0.42 1.38 -0.01 -0.78 0.09 0.00 0.00 178.44 178.70 1whu h ASP 320 N 0.30 -0.03 -0.95 -0.43 3.58 0.23 -3.26 116.42 115.86 1whu h ASP 320 Ca -0.11 0.00 0.24 0.00 0.42 0.00 0.00 57.03 57.58 1whu h ASP 320 Cb 1.66 0.01 -0.18 0.00 1.72 0.00 0.00 39.33 42.54 1whu h ASP 320 CO 0.19 0.01 -0.05 0.71 -2.88 0.00 0.00 179.24 177.22 1whu h THR 321 N -0.11 0.07 -0.71 2.25 1.35 -0.87 0.36 112.91 115.25 1whu h THR 321 Ca -0.00 -0.01 0.14 0.00 -0.55 0.00 0.00 66.41 65.99 1whu h THR 321 Cb 0.03 0.05 -0.14 0.00 -1.73 0.00 0.00 68.15 66.36 1whu h THR 321 CO 0.01 0.00 -0.18 -0.33 -0.25 0.00 0.00 175.52 174.77 1whu h GLU 322 N 0.02 0.00 0.00 4.72 5.08 -1.65 1.07 114.58 123.82 1whu h GLU 322 Ca 0.54 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 1whu h GLU 322 Cb 1.02 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.27 1whu h GLU 322 CO -0.91 0.00 0.00 1.49 -1.00 0.00 0.00 179.01 178.59 1whu h GLU 323 N 0.00 0.00 0.00 2.33 4.81 -0.38 -0.75 114.58 120.59 1whu h GLU 323 Ca 0.34 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.47 1whu h GLU 323 Cb 0.52 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.89 1whu h GLU 323 CO -0.73 0.00 -0.83 1.25 -0.73 0.00 0.00 179.01 177.97 1whu h HIS 324 N 0.00 0.00 0.00 0.92 2.76 0.20 -3.31 115.15 115.72 1whu h HIS 324 Ca 0.00 0.00 -0.18 0.00 -2.20 0.00 0.00 60.37 57.99 1whu h HIS 324 Cb 0.64 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.57 1whu h HIS 324 CO 0.00 0.40 -1.28 1.28 -1.30 0.00 0.00 177.93 177.03 1whu n LEU 325 N -3.02 1.88 -0.12 0.26 4.77 0.19 -3.86 117.00 117.11 1whu n LEU 325 Ca -0.02 0.45 0.27 0.00 -0.03 0.00 0.00 56.01 56.68 1whu n LEU 325 Cb 0.72 -0.87 0.62 0.00 -2.33 0.00 0.00 43.42 41.56 1whu n LEU 325 CO 0.41 0.04 1.24 0.50 -1.33 0.00 0.00 177.39 178.25 1whu h LYS 326 N -1.00 0.00 0.14 3.23 3.11 -1.33 1.04 116.57 121.76 1whu h LYS 326 Ca -0.27 0.00 -0.28 0.00 -2.81 0.00 0.00 60.65 57.29 1whu h LYS 326 Cb 1.10 0.00 0.01 0.00 -1.00 0.00 0.00 32.23 32.33 1whu h LYS 326 CO -0.16 0.00 -1.27 1.05 -2.81 0.00 0.00 179.45 176.26 1whu h GLU 327 N 0.00 0.31 -0.36 1.90 4.11 -1.73 -3.31 114.58 115.49 1whu h GLU 327 Ca 0.39 -0.53 -0.16 0.00 0.07 0.00 0.00 59.36 59.14 1whu h GLU 327 Cb 2.12 0.20 -0.01 0.00 0.50 0.00 0.00 28.75 31.56 1whu h GLU 327 CO -0.00 1.25 -0.40 -0.22 0.07 0.00 0.00 179.01 179.71 1whu h LYS 328 N 0.09 0.88 -3.37 1.06 3.64 0.96 -3.37 116.57 116.46 1whu h LYS 328 Ca -0.15 -0.47 -0.66 0.00 -1.27 0.00 0.00 60.65 58.10 1whu h LYS 328 Cb 2.00 0.02 -0.39 0.00 -0.41 0.00 0.00 32.23 33.44 1whu h LYS 328 CO 0.21 1.12 -0.50 -0.06 -2.27 0.00 0.00 179.45 177.95 1whu s PHE 329 N -4.36 3.38 0.13 1.91 0.40 -0.53 -4.93 117.98 113.98 1whu s PHE 329 Ca -0.10 -3.07 -0.12 0.00 -0.60 0.00 0.00 56.93 53.04 1whu s PHE 329 Cb 0.11 -2.94 -0.05 0.00 0.51 0.00 0.00 43.02 40.65 1whu s PHE 329 CO 0.87 -0.73 1.46 -1.00 0.70 0.00 0.00 175.22 176.52 1whu h PRO 330 N 6.39 0.88 0.00 0.24 0.13 -1.74 -3.00 132.00 134.91 1whu h PRO 330 Ca 0.00 -0.46 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 1whu h PRO 330 Cb 0.88 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 32.02 1whu h PRO 330 CO 0.72 1.11 -0.17 1.05 -0.23 0.00 0.00 178.00 180.48 1whu h GLU 331 N 0.69 0.00 -7.18 0.86 4.11 -1.91 -3.44 114.58 107.70 1whu h GLU 331 Ca 0.06 0.00 -0.49 0.00 0.07 0.00 0.00 59.36 59.00 1whu h GLU 331 Cb 0.95 0.00 0.07 0.00 0.50 0.00 0.00 28.75 30.26 1whu h GLU 331 CO 0.09 0.17 0.38 0.08 0.07 0.00 0.00 179.01 179.80 1whu s VAL 332 N -3.97 3.70 0.32 -1.06 1.01 -1.13 -5.03 120.40 114.24 1whu s VAL 332 Ca -0.01 0.83 -0.20 0.00 0.00 0.00 0.00 61.98 62.60 1whu s VAL 332 Cb 0.12 -3.34 -0.09 0.00 0.00 0.00 0.00 36.38 33.06 1whu s VAL 332 CO 0.61 -0.45 0.82 -0.62 0.00 0.00 0.00 175.10 175.46 1whu s ASP 333 N -2.65 7.01 0.34 3.32 -1.08 -1.26 -4.97 116.67 117.38 1whu s ASP 333 Ca 0.65 1.52 0.03 0.00 -0.52 0.00 0.00 52.55 54.23 1whu s ASP 333 Cb -0.17 -2.46 0.63 0.00 -1.46 0.00 0.00 42.92 39.45 1whu s ASP 333 CO 0.36 -0.14 1.96 -0.61 0.52 0.00 0.00 175.17 177.25 1whu h GLN 334 N 2.70 0.87 0.00 4.34 4.15 -1.95 0.54 115.11 125.75 1whu h GLN 334 Ca -0.48 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 58.89 1whu h GLN 334 Cb 1.18 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.68 1whu h GLN 334 CO 0.64 0.57 0.00 0.34 -1.93 0.00 0.00 178.83 178.46 1whu n PHE 335 N -4.46 0.52 0.02 3.99 7.35 -1.26 -1.02 117.46 122.59 1whu n PHE 335 Ca 0.10 0.26 -0.02 0.00 -0.76 0.00 0.00 57.45 57.03 1whu n PHE 335 Cb 0.15 -0.91 -0.10 0.00 0.35 0.00 0.00 39.48 38.97 1whu n PHE 335 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1whu n GLU 336 N -2.02 0.63 0.12 -4.13 1.02 0.17 -2.70 120.64 113.73 1whu n GLU 336 Ca -0.00 0.23 0.03 0.00 -0.02 0.00 0.00 57.16 57.39 1whu n GLU 336 Cb 0.06 -1.79 0.01 0.00 -0.02 0.00 0.00 31.44 29.70 1whu n GLU 336 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 1whu h ILE 337 N 0.00 0.68 0.07 -3.67 5.03 -1.02 -3.00 117.51 115.60 1whu h ILE 337 Ca -0.20 -2.02 -0.33 0.00 -0.12 0.00 0.00 64.86 62.19 1whu h ILE 337 Cb 1.68 2.27 -0.03 0.00 -3.03 0.00 0.00 36.82 37.71 1whu h ILE 337 CO 0.05 0.39 -1.84 0.40 -0.68 0.00 0.00 178.15 176.47 1whu h ILE 338 N 0.00 0.76 0.00 -0.67 5.03 -1.57 -3.30 117.51 117.76 1whu h ILE 338 Ca -0.04 -2.53 -0.03 0.00 -0.12 0.00 0.00 64.86 62.14 1whu h ILE 338 Cb 1.38 2.49 -0.00 0.00 -3.03 0.00 0.00 36.82 37.65 1whu h ILE 338 CO 0.05 0.72 -0.16 -0.08 -0.68 0.00 0.00 178.15 178.01 1whu h GLU 339 N 0.04 0.00 0.13 2.37 4.81 -1.62 -3.27 114.58 117.03 1whu h GLU 339 Ca -0.35 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.87 1whu h GLU 339 Cb 2.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.41 1whu h GLU 339 CO 0.09 0.16 -0.06 0.77 -0.73 0.00 0.00 179.01 179.24 1whu h SER 340 N 0.00 -0.14 -0.83 1.04 0.02 -1.66 -3.31 113.55 108.67 1whu h SER 340 Ca -0.00 0.00 0.33 0.00 -0.84 0.00 0.00 61.79 61.28 1whu h SER 340 Cb 0.76 0.04 -0.15 0.00 0.14 0.00 0.00 62.40 63.18 1whu h SER 340 CO 0.02 0.06 0.38 0.33 -1.14 0.00 0.00 176.83 176.49 1whu n PHE 341 N -3.37 0.90 -0.14 3.45 7.35 -1.24 0.90 117.46 125.31 1whu n PHE 341 Ca -0.02 0.98 -0.05 0.00 -0.76 0.00 0.00 57.45 57.60 1whu n PHE 341 Cb 0.07 -1.35 0.02 0.00 0.35 0.00 0.00 39.48 38.56 1whu n PHE 341 CO 0.00 0.00 0.00 -0.91 -0.76 0.00 0.00 176.76 175.09 1whu h ASN 342 N 0.00 -0.74 0.12 -2.13 2.35 -1.64 0.19 115.58 113.72 1whu h ASN 342 Ca 0.67 0.17 -0.11 0.00 -0.55 0.00 0.00 56.30 56.48 1whu h ASN 342 Cb 1.74 0.40 -0.01 0.00 0.05 0.00 0.00 38.32 40.50 1whu h ASN 342 CO -0.66 -0.24 -0.39 0.40 -1.65 0.00 0.00 177.43 174.89 1whu h ILE 343 N -0.12 1.30 0.57 2.81 5.03 0.40 -3.27 117.51 124.24 1whu h ILE 343 Ca 0.22 -1.49 -0.03 0.00 -0.12 0.00 0.00 64.86 63.43 1whu h ILE 343 Cb 0.46 1.60 0.01 0.00 -3.03 0.00 0.00 36.82 35.86 1whu h ILE 343 CO -0.53 0.46 -0.28 0.58 -0.68 0.00 0.00 178.15 177.70 1whu h VAL 344 N 0.30 0.00 -0.26 1.67 2.07 -0.38 -2.97 116.25 116.67 1whu h VAL 344 Ca 0.03 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.49 1whu h VAL 344 Cb 0.81 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 1whu h VAL 344 CO 0.07 0.00 -0.15 0.00 0.02 0.00 0.00 177.57 177.50 1whu n ALA 345 N -2.45 -0.17 -0.36 1.67 0.00 0.45 -0.02 120.51 119.63 1whu n ALA 345 Ca -0.10 0.22 -0.01 0.00 0.00 0.00 0.00 53.44 53.56 1whu n ALA 345 Cb 0.30 0.23 0.05 0.00 0.00 0.00 0.00 19.45 20.03 1whu n ALA 345 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1whu h LYS 346 N 0.00 -0.02 -1.04 0.00 1.57 -1.64 0.89 116.57 116.33 1whu h LYS 346 Ca 0.04 0.00 0.34 0.00 -1.87 0.00 0.00 60.65 59.16 1whu h LYS 346 Cb 0.11 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.28 1whu h LYS 346 CO -0.25 -0.01 0.61 1.49 -0.57 0.00 0.00 179.45 180.72 1whu h GLU 347 N -0.02 0.27 0.02 3.15 4.57 -0.27 0.26 114.58 122.56 1whu h GLU 347 Ca 0.35 -0.02 -0.18 0.00 -1.18 0.00 0.00 59.36 58.33 1whu h GLU 347 Cb 0.61 -0.06 0.02 0.00 -0.16 0.00 0.00 28.75 29.15 1whu h GLU 347 CO -0.96 0.18 -0.72 0.28 -1.18 0.00 0.00 179.01 176.60 1whu h VAL 348 N 0.28 1.41 0.00 0.32 2.07 0.11 -3.29 116.25 117.15 1whu h VAL 348 Ca 0.74 -2.18 0.00 0.00 0.82 0.00 0.00 66.70 66.09 1whu h VAL 348 Cb 1.82 2.65 0.00 0.00 -1.52 0.00 0.00 31.29 34.24 1whu h VAL 348 CO -0.57 0.64 0.00 0.49 0.02 0.00 0.00 177.57 178.15 1whu n PHE 349 N -4.14 0.00 0.02 1.57 3.01 0.84 -0.62 117.46 118.13 1whu n PHE 349 Ca -0.11 0.00 0.19 0.00 1.01 0.00 0.00 57.45 58.54 1whu n PHE 349 Cb 0.74 -0.46 0.40 0.00 -0.01 0.00 0.00 39.48 40.15 1whu n PHE 349 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 1whu h ARG 350 N 0.00 0.00 0.01 -1.08 0.11 -1.56 0.50 114.38 112.36 1whu h ARG 350 Ca 0.00 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.08 1whu h ARG 350 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1whu h ARG 350 CO 0.00 0.00 -0.01 1.03 0.10 0.00 0.00 179.97 181.09 1whu h SER 351 N 0.00 -0.01 0.35 0.08 0.87 -0.94 -3.17 113.55 110.73 1whu h SER 351 Ca 0.28 -0.73 -0.02 0.00 -1.23 0.00 0.00 61.79 60.10 1whu h SER 351 Cb 2.23 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 64.20 1whu h SER 351 CO -0.00 0.83 -0.17 0.40 -0.53 0.00 0.00 176.83 177.35 1whu h ILE 352 N -0.96 0.37 -1.01 2.23 2.04 0.20 -1.01 117.51 119.37 1whu h ILE 352 Ca -0.00 -0.72 0.35 0.00 1.00 0.00 0.00 64.86 65.49 1whu h ILE 352 Cb 0.74 0.59 -0.16 0.00 -0.74 0.00 0.00 36.82 37.25 1whu h ILE 352 CO 0.00 0.08 0.57 0.40 0.00 0.00 0.00 178.15 179.20 1whu h ILE 353 N -1.01 0.23 0.20 -0.67 2.04 -0.92 -1.25 117.51 116.14 1whu h ILE 353 Ca -0.05 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 1whu h ILE 353 Cb 0.50 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.54 1whu h ILE 353 CO 0.08 0.05 -0.09 -0.07 0.00 0.00 0.00 178.15 178.11 1whu h LEU 354 N 0.25 -0.22 -0.96 1.44 -0.00 -1.56 0.03 115.31 114.28 1whu h LEU 354 Ca 0.76 -0.09 0.38 0.00 -0.00 0.00 0.00 57.88 58.94 1whu h LEU 354 Cb 1.82 0.06 -0.15 0.00 -0.00 0.00 0.00 40.66 42.39 1whu h LEU 354 CO -0.64 0.28 0.55 -3.20 -0.00 0.00 0.00 178.44 175.43 1whu n ASN 355 N -4.95 0.28 -0.06 -0.43 5.15 -0.38 -1.32 115.26 113.54 1whu n ASN 355 Ca -0.04 1.40 -0.03 0.00 -0.60 0.00 0.00 54.58 55.30 1whu n ASN 355 Cb 0.15 -0.68 -0.01 0.00 -0.53 0.00 0.00 39.78 38.71 1whu n ASN 355 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1whu h GLU 356 N 0.00 0.00 -3.45 1.20 4.39 -1.37 -3.44 114.58 111.92 1whu h GLU 356 Ca 0.75 0.00 -0.67 0.00 0.34 0.00 0.00 59.36 59.78 1whu h GLU 356 Cb 2.11 0.00 -0.38 0.00 -0.10 0.00 0.00 28.75 30.38 1whu h GLU 356 CO -0.61 0.01 -0.46 0.71 -1.16 0.00 0.00 179.01 177.51 1whu s TYR 357 N -2.01 3.35 0.63 4.33 2.02 -0.00 -5.09 117.35 120.58 1whu s TYR 357 Ca -0.10 -2.95 -0.17 0.00 -0.37 0.00 0.00 57.07 53.48 1whu s TYR 357 Cb 0.01 -3.03 -0.07 0.00 -0.40 0.00 0.00 41.96 38.47 1whu s TYR 357 CO 0.15 -0.78 0.54 0.36 -1.57 0.00 0.00 175.55 174.25 1whu n LYS 358 N 3.18 0.46 -3.57 -0.62 2.85 -0.60 -4.17 118.16 115.68 1whu n LYS 358 Ca 0.08 0.19 -0.17 0.00 -1.05 0.00 0.00 58.31 57.37 1whu n LYS 358 Cb 0.35 -1.77 -0.07 0.00 -0.65 0.00 0.00 35.03 32.90 1whu n LYS 358 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 1whu s ARG 359 N -2.36 0.97 -0.10 -1.58 6.06 -1.26 -5.01 118.95 115.66 1whu s ARG 359 Ca 0.68 0.44 -0.00 0.00 -2.50 0.00 0.00 55.73 54.35 1whu s ARG 359 Cb -0.41 0.46 0.02 0.00 0.06 0.00 0.00 34.95 35.09 1whu s ARG 359 CO 0.55 -0.25 -0.06 0.00 -2.50 0.00 0.00 175.30 173.04 1whu s ASP 361 N 1.68 1.63 0.00 0.00 -1.08 -1.26 -5.16 116.67 112.48 1whu s ASP 361 Ca 0.03 -1.53 0.00 0.00 -0.52 0.00 0.00 52.55 50.53 1whu s ASP 361 Cb -0.13 0.34 0.00 0.00 -1.46 0.00 0.00 42.92 41.67 1whu s ASP 361 CO -0.07 -0.85 0.00 0.61 0.52 0.00 0.00 175.17 175.38 1whu n GLY 362 N -0.60 0.49 2.63 2.66 0.00 -1.26 -5.01 105.19 104.10 1whu n GLY 362 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 1whu n GLY 362 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1whu n ARG 363 N 0.00 2.69 -1.62 1.61 5.12 -1.26 -4.91 116.66 118.29 1whu n ARG 363 Ca 0.00 -4.31 -0.31 0.00 -1.93 0.00 0.00 57.85 51.30 1whu n ARG 363 Cb 0.00 -2.03 -0.03 0.00 -1.16 0.00 0.00 32.46 29.24 1whu n ARG 363 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1whu n ASP 364 N -0.23 6.82 -2.95 0.55 5.75 -1.26 -4.90 116.55 120.33 1whu n ASP 364 Ca 0.30 -3.41 -0.13 0.00 -0.01 0.00 0.00 54.79 51.54 1whu n ASP 364 Cb 0.58 -1.18 -0.01 0.00 -1.03 0.00 0.00 41.12 39.48 1whu n ASP 364 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1whu n SER 365 N 0.41 -1.77 -3.85 -1.12 2.88 -1.26 -5.12 113.62 103.79 1whu n SER 365 Ca 0.50 -2.82 -0.29 0.00 -1.33 0.00 0.00 58.87 54.94 1whu n SER 365 Cb 0.45 3.12 -0.12 0.00 -0.75 0.00 0.00 64.21 66.90 1whu n SER 365 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1whu s GLY 366 N -3.18 2.56 0.89 0.46 0.00 -1.26 -5.10 107.32 101.68 1whu s GLY 366 Ca 0.24 -3.47 -0.11 0.00 0.00 0.00 0.00 44.72 41.38 1whu s GLY 366 CO 0.18 1.20 1.09 2.56 0.00 0.00 0.00 173.10 178.13 1whu s PRO 367 N -0.89 1.35 -0.18 2.90 0.04 -1.26 -5.02 135.00 131.94 1whu s PRO 367 Ca 0.23 0.85 -0.16 0.00 0.04 0.00 0.00 61.00 61.95 1whu s PRO 367 Cb -0.11 -1.82 -0.12 0.00 0.04 0.00 0.00 34.50 32.49 1whu s PRO 367 CO -0.11 -2.19 0.05 1.03 0.04 0.00 0.00 177.00 175.82 1whu h SER 368 N -1.51 0.00 -0.19 6.66 0.87 -2.02 -3.39 113.55 113.96 1whu h SER 368 Ca -0.49 -0.29 -0.01 0.00 -1.23 0.00 0.00 61.79 59.77 1whu h SER 368 Cb 1.28 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.23 1whu h SER 368 CO 0.54 1.18 0.08 -1.28 -0.53 0.00 0.00 176.83 176.82 1whu h SER 369 N -1.00 0.27 0.00 6.23 0.87 -2.03 -3.52 113.55 114.37 1whu h SER 369 Ca -0.20 -0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.19 1whu h SER 369 Cb 0.96 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.86 1whu h SER 369 CO -0.12 0.36 0.00 0.61 -0.53 0.00 0.00 176.83 177.15