#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ndm s VAL 302 N 0.00 2.96 -0.01 6.31 0.11 -1.26 -4.38 120.40 124.12 1ndm s VAL 302 Ca 0.00 -1.74 0.05 0.00 -2.93 0.00 0.00 61.98 57.36 1ndm s VAL 302 Cb 0.00 -2.45 -0.01 0.00 -1.53 0.00 0.00 36.38 32.39 1ndm s VAL 302 CO 0.00 -0.10 -0.15 -1.10 -3.33 0.00 0.00 175.10 170.42 1ndm s GLN 303 N -2.74 1.21 0.08 1.54 -0.21 0.16 -4.95 119.66 114.75 1ndm s GLN 303 Ca 0.23 -0.56 0.05 0.00 0.02 0.00 0.00 55.36 55.10 1ndm s GLN 303 Cb -0.09 -1.18 -0.03 0.00 1.00 0.00 0.00 33.01 32.71 1ndm s GLN 303 CO 0.13 0.32 -0.13 -0.51 -2.12 0.00 0.00 175.29 172.99 1ndm s LEU 304 N -0.42 2.32 -0.23 2.90 1.02 -1.26 -0.98 118.68 122.03 1ndm s LEU 304 Ca 0.06 -0.68 -0.12 0.00 0.02 0.00 0.00 54.13 53.41 1ndm s LEU 304 Cb -0.06 -0.45 0.08 0.00 0.02 0.00 0.00 46.19 45.78 1ndm s LEU 304 CO -0.00 -0.13 0.54 -1.58 0.02 0.00 0.00 176.35 175.19 1ndm s GLN 305 N -2.07 0.52 0.28 1.70 0.74 -0.78 -4.07 119.66 115.99 1ndm s GLN 305 Ca 0.00 1.04 -0.13 0.00 0.05 0.00 0.00 55.36 56.32 1ndm s GLN 305 Cb -0.08 0.14 -0.08 0.00 1.10 0.00 0.00 33.01 34.09 1ndm s GLN 305 CO 0.02 -0.17 0.66 -1.21 -0.55 0.00 0.00 175.29 174.04 1ndm s GLU 306 N 1.72 3.95 -0.18 1.67 8.01 -1.26 -1.04 118.70 131.58 1ndm s GLU 306 Ca -0.09 0.53 -0.23 0.00 0.01 0.00 0.00 54.97 55.20 1ndm s GLU 306 Cb -0.08 -2.56 0.06 0.00 -4.31 0.00 0.00 34.13 27.25 1ndm s GLU 306 CO -0.16 0.24 0.61 -1.54 0.01 0.00 0.00 175.26 174.42 1ndm s SER 307 N -2.24 -0.61 0.00 -0.19 1.04 0.71 -4.84 113.70 107.57 1ndm s SER 307 Ca 0.50 1.04 0.00 0.00 0.48 0.00 0.00 55.95 57.97 1ndm s SER 307 Cb -0.11 1.03 0.00 0.00 0.10 0.00 0.00 66.02 67.04 1ndm s SER 307 CO 0.19 -0.32 0.00 0.61 0.98 0.00 0.00 173.24 174.70 1ndm n GLY 308 N 2.23 2.51 3.51 7.32 0.00 -1.26 0.28 105.19 119.78 1ndm n GLY 308 Ca -0.15 -1.05 -0.47 0.00 0.00 0.00 0.00 46.02 44.35 1ndm n GLY 308 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ndm n PRO 309 N -1.04 0.73 0.04 1.61 -0.02 -1.26 -4.88 135.00 130.18 1ndm n PRO 309 Ca 0.00 0.26 0.12 0.00 -2.02 0.00 0.00 63.50 61.86 1ndm n PRO 309 Cb 0.00 -1.50 0.21 0.00 -0.02 0.00 0.00 33.50 32.19 1ndm n PRO 309 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ndm n SER 310 N 1.64 0.60 -4.05 2.55 3.41 -1.26 -4.79 113.62 111.72 1ndm n SER 310 Ca 0.14 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.50 1ndm n SER 310 Cb 0.27 0.20 -0.16 0.00 -0.26 0.00 0.00 64.21 64.26 1ndm n SER 310 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1ndm s LEU 311 N -3.77 1.71 -0.01 1.04 2.96 -1.26 -0.69 118.68 118.66 1ndm s LEU 311 Ca 0.08 -0.31 0.02 0.00 -0.22 0.00 0.00 54.13 53.70 1ndm s LEU 311 Cb 0.15 -0.86 -0.01 0.00 0.50 0.00 0.00 46.19 45.97 1ndm s LEU 311 CO 0.71 0.06 -0.07 -0.69 -1.32 0.00 0.00 176.35 175.04 1ndm s VAL 312 N 0.55 0.53 0.29 1.68 1.01 -0.19 -4.95 120.40 119.32 1ndm s VAL 312 Ca -0.13 -0.29 -0.13 0.00 0.00 0.00 0.00 61.98 61.43 1ndm s VAL 312 Cb -0.15 -0.45 -0.08 0.00 0.00 0.00 0.00 36.38 35.70 1ndm s VAL 312 CO 0.04 0.15 0.66 -0.54 0.00 0.00 0.00 175.10 175.41 1ndm s LYS 313 N -0.16 3.91 0.31 2.72 1.02 -1.26 -1.61 119.74 124.68 1ndm s LYS 313 Ca 0.03 0.50 -0.28 0.00 0.02 0.00 0.00 55.97 56.24 1ndm s LYS 313 Cb -0.03 -2.52 -0.13 0.00 -0.52 0.00 0.00 37.83 34.64 1ndm s LYS 313 CO -0.00 0.21 1.15 -2.30 -0.92 0.00 0.00 175.35 173.49 1ndm n PRO 314 N -0.32 1.74 0.00 -1.68 -0.02 -1.26 -1.07 135.00 132.39 1ndm n PRO 314 Ca 0.02 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1ndm n PRO 314 Cb 0.53 -2.09 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 1ndm n PRO 314 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ndm n SER 315 N 1.01 0.00 -4.85 2.55 3.41 0.17 -4.93 113.62 110.98 1ndm n SER 315 Ca 0.07 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.39 1ndm n SER 315 Cb 0.34 -0.09 0.10 0.00 -0.26 0.00 0.00 64.21 64.29 1ndm n SER 315 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ndm s GLN 316 N 0.00 1.85 -0.16 4.33 -1.52 -0.24 -3.96 119.66 119.97 1ndm s GLN 316 Ca 0.00 0.29 -0.09 0.00 -1.95 0.00 0.00 55.36 53.61 1ndm s GLN 316 Cb 0.00 -1.92 -0.05 0.00 -0.22 0.00 0.00 33.01 30.82 1ndm s GLN 316 CO 0.00 -1.71 0.15 0.95 -0.25 0.00 0.00 175.29 174.43 1ndm s THR 317 N -3.40 5.44 -0.11 -0.19 -4.23 -1.26 -3.04 115.64 108.86 1ndm s THR 317 Ca 0.62 0.23 -0.19 0.00 -1.18 0.00 0.00 61.69 61.17 1ndm s THR 317 Cb -0.13 -3.45 -0.04 0.00 1.34 0.00 0.00 72.50 70.22 1ndm s THR 317 CO 0.51 0.52 0.50 -0.22 -0.54 0.00 0.00 174.62 175.39 1ndm s LEU 318 N -0.26 4.29 -0.02 4.79 0.20 0.50 -4.92 118.68 123.26 1ndm s LEU 318 Ca 0.12 0.86 0.04 0.00 0.69 0.00 0.00 54.13 55.84 1ndm s LEU 318 Cb -0.12 -2.73 -0.01 0.00 -0.43 0.00 0.00 46.19 42.91 1ndm s LEU 318 CO 0.01 0.00 -0.13 -0.44 -0.29 0.00 0.00 176.35 175.50 1ndm s SER 319 N 0.56 1.63 0.04 3.68 0.01 -1.26 -0.04 113.70 118.32 1ndm s SER 319 Ca 0.27 -0.25 0.01 0.00 1.31 0.00 0.00 55.95 57.29 1ndm s SER 319 Cb -0.15 -0.27 -0.03 0.00 0.21 0.00 0.00 66.02 65.77 1ndm s SER 319 CO 0.11 0.15 -0.06 -0.76 0.41 0.00 0.00 173.24 173.09 1ndm s LEU 320 N -0.17 2.32 -0.03 2.44 1.43 -0.18 -4.37 118.68 120.12 1ndm s LEU 320 Ca 0.02 -0.65 0.07 0.00 -1.03 0.00 0.00 54.13 52.54 1ndm s LEU 320 Cb -0.07 -0.03 -0.02 0.00 0.03 0.00 0.00 46.19 46.11 1ndm s LEU 320 CO 0.00 -0.32 -0.25 -0.89 0.23 0.00 0.00 176.35 175.13 1ndm s THR 321 N -2.04 1.95 -0.25 5.49 2.01 0.14 -1.64 115.64 121.31 1ndm s THR 321 Ca -0.07 -1.05 0.02 0.00 0.31 0.00 0.00 61.69 60.91 1ndm s THR 321 Cb -0.06 -1.63 0.05 0.00 0.01 0.00 0.00 72.50 70.88 1ndm s THR 321 CO -0.02 0.55 -0.12 0.00 -0.69 0.00 0.00 174.62 174.34 1ndm s SER 323 N 1.16 6.69 -0.02 0.00 0.01 -0.21 -2.14 113.70 119.19 1ndm s SER 323 Ca -0.06 0.81 0.08 0.00 1.31 0.00 0.00 55.95 58.10 1ndm s SER 323 Cb -0.18 -2.27 -0.02 0.00 0.21 0.00 0.00 66.02 63.75 1ndm s SER 323 CO -0.06 0.07 -0.25 -0.69 0.41 0.00 0.00 173.24 172.72 1ndm s VAL 324 N 0.30 2.15 0.03 3.43 1.01 -1.03 -1.87 120.40 124.42 1ndm s VAL 324 Ca 0.25 -1.10 0.02 0.00 0.00 0.00 0.00 61.98 61.15 1ndm s VAL 324 Cb -0.15 -1.76 -0.02 0.00 0.00 0.00 0.00 36.38 34.45 1ndm s VAL 324 CO 0.10 0.56 -0.08 0.42 0.00 0.00 0.00 175.10 176.10 1ndm s THR 325 N -0.64 0.59 0.00 3.92 -4.23 -0.15 -4.84 115.64 110.30 1ndm s THR 325 Ca 0.10 -0.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 1ndm s THR 325 Cb -0.10 -0.60 0.00 0.00 1.34 0.00 0.00 72.50 73.14 1ndm s THR 325 CO -0.01 -0.18 0.00 0.61 -0.54 0.00 0.00 174.62 174.50 1ndm n GLY 326 N 1.94 0.32 3.64 3.99 0.00 -1.26 0.36 105.19 114.20 1ndm n GLY 326 Ca -0.19 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.79 1ndm n GLY 326 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ndm s ASP 327 N -2.49 -0.33 0.30 1.61 2.15 -1.26 -4.50 116.67 112.14 1ndm s ASP 327 Ca 0.00 0.58 -0.30 0.00 0.43 0.00 0.00 52.55 53.26 1ndm s ASP 327 Cb 0.00 0.89 -0.11 0.00 -0.30 0.00 0.00 42.92 43.39 1ndm s ASP 327 CO 0.00 -0.10 1.58 -0.55 -0.17 0.00 0.00 175.17 175.94 1ndm s SER 328 N 0.75 6.38 0.11 -0.34 0.15 -1.26 -4.94 113.70 114.55 1ndm s SER 328 Ca -0.03 2.95 -0.18 0.00 0.70 0.00 0.00 55.95 59.39 1ndm s SER 328 Cb -0.04 -2.64 -0.05 0.00 -1.71 0.00 0.00 66.02 61.58 1ndm s SER 328 CO -0.12 -0.90 1.67 -0.29 1.20 0.00 0.00 173.24 174.80 1ndm h ILE 329 N 3.37 1.16 0.00 6.45 6.09 -1.94 -2.56 117.51 130.08 1ndm h ILE 329 Ca -0.47 -0.47 0.00 0.00 -1.37 0.00 0.00 64.86 62.55 1ndm h ILE 329 Cb 1.22 0.96 0.00 0.00 0.47 0.00 0.00 36.82 39.47 1ndm h ILE 329 CO 0.78 0.16 0.00 0.35 -3.07 0.00 0.00 178.15 176.38 1ndm n THR 330 N -4.78 0.78 -0.63 2.19 -2.24 -1.26 -2.89 114.28 105.44 1ndm n THR 330 Ca -0.02 0.19 -0.18 0.00 -2.27 0.00 0.00 64.05 61.77 1ndm n THR 330 Cb 0.11 -0.90 0.12 0.00 -2.10 0.00 0.00 70.33 67.56 1ndm n THR 330 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ndm n SER 331 N -1.55 3.95 -3.93 3.42 2.88 -0.97 -4.88 113.62 112.56 1ndm n SER 331 Ca 0.04 -3.16 0.04 0.00 -1.33 0.00 0.00 58.87 54.46 1ndm n SER 331 Cb 0.21 -0.77 0.01 0.00 -0.75 0.00 0.00 64.21 62.91 1ndm n SER 331 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1ndm s ASP 332 N -0.63 0.00 -0.16 -3.46 3.68 -1.14 -4.87 116.67 110.09 1ndm s ASP 332 Ca 0.41 -0.11 -0.07 0.00 2.13 0.00 0.00 52.55 54.90 1ndm s ASP 332 Cb 0.34 0.08 -0.04 0.00 -1.45 0.00 0.00 42.92 41.85 1ndm s ASP 332 CO 0.07 -0.16 0.09 -0.31 0.13 0.00 0.00 175.17 174.98 1ndm s TYR 333 N -2.01 3.35 0.04 -5.34 1.51 -1.26 -4.24 117.35 109.40 1ndm s TYR 333 Ca 0.31 0.24 0.06 0.00 -1.01 0.00 0.00 57.07 56.67 1ndm s TYR 333 Cb -0.00 -2.04 -0.02 0.00 -0.11 0.00 0.00 41.96 39.79 1ndm s TYR 333 CO -0.02 0.34 -0.17 -1.58 -1.11 0.00 0.00 175.55 173.01 1ndm s TRP 334 N -0.06 1.49 0.35 2.71 0.52 -0.60 -1.78 118.94 121.56 1ndm s TRP 334 Ca 0.08 -0.36 0.04 0.00 0.02 0.00 0.00 56.10 55.88 1ndm s TRP 334 Cb -0.12 -0.89 -0.07 0.00 -1.15 0.00 0.00 33.47 31.25 1ndm s TRP 334 CO 0.01 0.06 0.05 -1.12 0.02 0.00 0.00 176.95 175.97 1ndm s SER 335 N -1.15 2.72 -0.04 2.95 0.01 0.89 -1.80 113.70 117.28 1ndm s SER 335 Ca 0.04 -1.39 -0.01 0.00 1.31 0.00 0.00 55.95 55.90 1ndm s SER 335 Cb -0.08 -0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.05 1ndm s SER 335 CO 0.01 -0.59 0.03 0.26 0.41 0.00 0.00 173.24 173.37 1ndm s TRP 336 N -3.17 0.22 0.03 2.43 0.52 -0.93 -2.00 118.94 116.04 1ndm s TRP 336 Ca 0.35 0.10 0.05 0.00 0.02 0.00 0.00 56.10 56.63 1ndm s TRP 336 Cb 0.09 -0.47 -0.02 0.00 -1.15 0.00 0.00 33.47 31.92 1ndm s TRP 336 CO 0.16 -0.18 -0.15 0.42 0.02 0.00 0.00 176.95 177.22 1ndm s ILE 337 N 1.66 1.17 0.12 2.03 1.09 0.53 -0.86 121.20 126.94 1ndm s ILE 337 Ca -0.01 -0.95 0.08 0.00 -1.10 0.00 0.00 60.65 58.67 1ndm s ILE 337 Cb -0.13 -1.04 -0.04 0.00 -1.06 0.00 0.00 42.46 40.20 1ndm s ILE 337 CO -0.03 0.08 -0.20 0.00 -0.10 0.00 0.00 174.94 174.69 1ndm s ARG 338 N -0.99 1.16 -0.14 2.79 1.70 -0.44 0.30 118.95 123.31 1ndm s ARG 338 Ca 0.03 -1.23 0.00 0.00 -0.47 0.00 0.00 55.73 54.06 1ndm s ARG 338 Cb -0.07 -1.35 0.02 0.00 -0.57 0.00 0.00 34.95 32.98 1ndm s ARG 338 CO 0.01 0.30 -0.14 0.21 -1.08 0.00 0.00 175.30 174.60 1ndm s LYS 339 N -2.17 2.23 0.60 3.89 2.20 0.30 -0.20 119.74 126.60 1ndm s LYS 339 Ca 0.09 -0.53 -0.13 0.00 -0.36 0.00 0.00 55.97 55.04 1ndm s LYS 339 Cb -0.09 -2.06 -0.04 0.00 -1.51 0.00 0.00 37.83 34.13 1ndm s LYS 339 CO 0.05 -0.23 1.02 -0.06 -0.36 0.00 0.00 175.35 175.77 1ndm s PHE 340 N 1.49 3.51 0.42 4.03 0.08 0.37 -1.28 117.98 126.60 1ndm s PHE 340 Ca 0.05 1.36 0.25 0.00 0.12 0.00 0.00 56.93 58.70 1ndm s PHE 340 Cb -0.13 -2.77 1.28 0.00 -0.57 0.00 0.00 43.02 40.84 1ndm s PHE 340 CO -0.10 -0.68 1.70 -1.35 -0.10 0.00 0.00 175.22 174.68 1ndm h PRO 341 N -0.03 0.22 -0.67 0.24 0.11 -1.89 0.81 132.00 130.79 1ndm h PRO 341 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1ndm h PRO 341 Cb 1.19 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1ndm h PRO 341 CO 0.61 0.14 0.00 0.41 -0.21 0.00 0.00 178.00 178.95 1ndm n GLY 342 N -1.51 0.70 3.78 -0.55 0.00 -1.26 -4.86 105.19 101.50 1ndm n GLY 342 Ca 0.31 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1ndm n GLY 342 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ndm n ASN 343 N -0.15 0.00 -4.77 1.61 3.02 0.28 -5.00 115.26 110.26 1ndm n ASN 343 Ca 0.00 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.14 1ndm n ASN 343 Cb 0.18 -0.34 -0.01 0.00 -0.61 0.00 0.00 39.78 39.01 1ndm n ASN 343 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1ndm s LYS 344 N 0.00 4.12 -0.11 3.52 1.02 -1.24 -4.63 119.74 122.42 1ndm s LYS 344 Ca 0.00 2.57 -0.06 0.00 0.02 0.00 0.00 55.97 58.50 1ndm s LYS 344 Cb 0.00 -2.99 -0.04 0.00 -0.52 0.00 0.00 37.83 34.28 1ndm s LYS 344 CO 0.00 -0.57 0.10 -0.51 -0.92 0.00 0.00 175.35 173.45 1ndm s LEU 345 N -1.36 4.15 -0.07 3.17 1.43 -1.26 -0.48 118.68 124.26 1ndm s LEU 345 Ca 0.57 0.37 0.02 0.00 -1.03 0.00 0.00 54.13 54.07 1ndm s LEU 345 Cb -0.47 -2.00 0.01 0.00 0.03 0.00 0.00 46.19 43.77 1ndm s LEU 345 CO 0.56 0.40 -0.13 -0.70 0.23 0.00 0.00 176.35 176.71 1ndm s GLU 346 N -0.96 1.79 -0.33 1.70 2.12 0.72 -5.00 118.70 118.74 1ndm s GLU 346 Ca 0.14 -0.43 -0.26 0.00 0.36 0.00 0.00 54.97 54.78 1ndm s GLU 346 Cb -0.12 -1.50 0.01 0.00 0.26 0.00 0.00 34.13 32.78 1ndm s GLU 346 CO 0.03 0.00 0.90 -0.47 -0.54 0.00 0.00 175.26 175.19 1ndm s TYR 347 N 0.77 3.15 -0.01 5.30 5.04 -1.26 -1.33 117.35 129.00 1ndm s TYR 347 Ca -0.12 0.88 -0.20 0.00 -2.44 0.00 0.00 57.07 55.19 1ndm s TYR 347 Cb -0.16 -3.48 -0.28 0.00 0.35 0.00 0.00 41.96 38.39 1ndm s TYR 347 CO 0.02 -0.71 1.01 0.52 -1.34 0.00 0.00 175.55 175.06 1ndm h MET 348 N 8.24 0.40 0.00 4.97 2.86 -1.36 -3.42 114.93 126.63 1ndm h MET 348 Ca -0.23 -0.55 0.00 0.00 -2.06 0.00 0.00 59.70 56.86 1ndm h MET 348 Cb 1.08 0.18 0.00 0.00 0.06 0.00 0.00 31.60 32.92 1ndm h MET 348 CO 0.95 1.22 0.00 0.41 1.06 0.00 0.00 176.91 180.55 1ndm n GLY 349 N 1.39 0.54 3.30 8.32 0.00 -1.16 -1.46 105.19 116.12 1ndm n GLY 349 Ca -0.13 -1.21 -0.09 0.00 0.00 0.00 0.00 46.02 44.59 1ndm n GLY 349 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ndm s TYR 350 N -2.00 0.11 -0.00 1.61 -0.85 -0.39 -2.18 117.35 113.65 1ndm s TYR 350 Ca 0.00 -0.49 0.07 0.00 -0.52 0.00 0.00 57.07 56.13 1ndm s TYR 350 Cb 0.00 0.06 -0.02 0.00 0.38 0.00 0.00 41.96 42.38 1ndm s TYR 350 CO 0.00 -0.66 -0.21 -1.50 -1.52 0.00 0.00 175.55 171.66 1ndm s ILE 351 N -3.88 1.65 0.07 -3.49 2.07 -0.75 -0.51 121.20 116.36 1ndm s ILE 351 Ca 0.08 -0.95 0.00 0.00 -1.41 0.00 0.00 60.65 58.37 1ndm s ILE 351 Cb 0.03 -1.38 0.00 0.00 0.13 0.00 0.00 42.46 41.24 1ndm s ILE 351 CO -0.07 0.41 0.01 -1.54 -1.91 0.00 0.00 174.94 171.84 1ndm n SER 352 N 2.43 2.02 -0.24 4.50 3.41 -0.18 -1.57 113.62 123.99 1ndm n SER 352 Ca -0.16 -1.31 0.03 0.00 -0.26 0.00 0.00 58.87 57.17 1ndm n SER 352 Cb 0.53 0.04 0.15 0.00 -0.26 0.00 0.00 64.21 64.67 1ndm n SER 352 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1ndm h TYR 353 N 0.94 0.57 0.00 7.33 -0.00 -1.87 -1.55 116.97 122.38 1ndm h TYR 353 Ca -0.06 0.03 0.00 0.00 0.00 0.00 0.00 58.73 58.70 1ndm h TYR 353 Cb 0.18 -0.15 0.00 0.00 0.00 0.00 0.00 36.73 36.77 1ndm h TYR 353 CO 0.00 0.16 0.00 -1.13 -0.00 0.00 0.00 178.16 177.19 1ndm n SER 354 N -4.92 0.00 0.00 0.10 3.41 -1.26 -4.79 113.62 106.16 1ndm n SER 354 Ca 0.12 0.31 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 1ndm n SER 354 Cb 0.32 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.87 1ndm n SER 354 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ndm n GLY 355 N 0.06 0.41 3.77 5.00 0.00 -0.58 -5.05 105.19 108.80 1ndm n GLY 355 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 1ndm n GLY 355 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ndm s SER 356 N -2.64 6.28 0.19 1.61 1.04 -1.26 -4.75 113.70 114.18 1ndm s SER 356 Ca 0.00 2.40 0.09 0.00 0.48 0.00 0.00 55.95 58.92 1ndm s SER 356 Cb 0.00 -2.61 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 1ndm s SER 356 CO 0.00 -0.85 -0.18 0.42 0.98 0.00 0.00 173.24 173.61 1ndm s THR 357 N -1.44 1.92 -0.12 2.02 -4.23 -1.26 -1.01 115.64 111.53 1ndm s THR 357 Ca 0.60 -2.06 -0.00 0.00 -1.18 0.00 0.00 61.69 59.05 1ndm s THR 357 Cb -0.31 -1.97 0.03 0.00 1.34 0.00 0.00 72.50 71.58 1ndm s THR 357 CO 0.39 -0.38 -0.08 -0.31 -0.54 0.00 0.00 174.62 173.70 1ndm s TYR 358 N -2.30 1.53 0.07 3.99 2.02 0.33 -4.99 117.35 117.99 1ndm s TYR 358 Ca 0.19 -0.78 0.06 0.00 -0.37 0.00 0.00 57.07 56.17 1ndm s TYR 358 Cb -0.05 -1.26 -0.04 0.00 -0.40 0.00 0.00 41.96 40.22 1ndm s TYR 358 CO 0.08 -0.53 -0.10 0.71 -1.57 0.00 0.00 175.55 174.15 1ndm s TYR 359 N 1.69 2.77 -0.10 2.71 2.02 -1.26 -1.26 117.35 123.92 1ndm s TYR 359 Ca 0.05 -0.13 -0.30 0.00 -0.37 0.00 0.00 57.07 56.32 1ndm s TYR 359 Cb -0.13 -1.49 -0.02 0.00 -0.40 0.00 0.00 41.96 39.92 1ndm s TYR 359 CO -0.08 0.39 1.19 -1.58 -1.57 0.00 0.00 175.55 173.89 1ndm s HIS 360 N -1.12 3.14 0.64 2.71 2.46 -0.54 -4.89 115.29 117.70 1ndm s HIS 360 Ca 0.19 1.21 0.29 0.00 0.47 0.00 0.00 55.06 57.22 1ndm s HIS 360 Cb -0.11 -3.41 1.53 0.00 -0.13 0.00 0.00 32.58 30.46 1ndm s HIS 360 CO 0.11 -1.26 1.88 -1.00 -2.47 0.00 0.00 174.74 172.00 1ndm h PRO 361 N 7.62 0.00 0.00 2.88 0.13 -1.95 0.19 132.00 140.88 1ndm h PRO 361 Ca -0.31 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.82 1ndm h PRO 361 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 1ndm h PRO 361 CO 0.91 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.34 1ndm h SER 362 N 0.00 0.00 0.06 1.44 4.64 -1.97 -1.25 113.55 116.47 1ndm h SER 362 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1ndm h SER 362 Cb 0.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.93 1ndm h SER 362 CO -0.00 0.00 -0.05 0.18 -0.87 0.00 0.00 176.83 176.09 1ndm n LEU 363 N -2.62 1.18 -4.19 5.97 4.32 0.68 -4.96 117.00 117.39 1ndm n LEU 363 Ca -0.00 -0.37 -0.31 0.00 -0.02 0.00 0.00 56.01 55.31 1ndm n LEU 363 Cb 0.15 -0.03 -0.06 0.00 -1.62 0.00 0.00 43.42 41.86 1ndm n LEU 363 CO 0.18 0.20 -0.29 0.29 -1.22 0.00 0.00 177.39 176.56 1ndm n LYS 364 N -0.17 -2.14 -2.92 3.23 5.02 -0.47 -1.44 118.16 119.26 1ndm n LYS 364 Ca 0.18 0.26 -0.21 0.00 -2.02 0.00 0.00 58.31 56.52 1ndm n LYS 364 Cb 0.32 -4.28 0.01 0.00 -0.02 0.00 0.00 35.03 31.06 1ndm n LYS 364 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 1ndm n SER 365 N -2.85 -5.31 -0.00 4.39 7.64 -1.26 -4.86 113.62 111.36 1ndm n SER 365 Ca -0.22 -0.20 0.10 0.00 1.01 0.00 0.00 58.87 59.56 1ndm n SER 365 Cb 0.64 -4.35 -0.12 0.00 -1.01 0.00 0.00 64.21 59.36 1ndm n SER 365 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ndm n ARG 366 N -3.65 0.14 -3.71 1.43 1.74 -0.52 -4.97 116.66 107.11 1ndm n ARG 366 Ca -0.12 -0.04 -0.37 0.00 -0.77 0.00 0.00 57.85 56.55 1ndm n ARG 366 Cb 0.61 -1.51 -0.06 0.00 -1.02 0.00 0.00 32.46 30.49 1ndm n ARG 366 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1ndm s ILE 367 N -3.11 5.29 -0.05 0.55 2.07 -1.26 -1.03 121.20 123.65 1ndm s ILE 367 Ca 0.05 0.44 0.02 0.00 -1.41 0.00 0.00 60.65 59.75 1ndm s ILE 367 Cb 0.16 -3.55 0.02 0.00 0.13 0.00 0.00 42.46 39.22 1ndm s ILE 367 CO 0.87 0.56 -0.08 -0.55 -1.91 0.00 0.00 174.94 173.83 1ndm s SER 368 N -1.17 1.29 -0.20 4.50 0.15 0.09 -5.00 113.70 113.36 1ndm s SER 368 Ca 0.21 -0.20 0.01 0.00 0.70 0.00 0.00 55.95 56.66 1ndm s SER 368 Cb -0.14 -0.60 0.04 0.00 -1.71 0.00 0.00 66.02 63.61 1ndm s SER 368 CO 0.10 -0.01 -0.11 -0.63 1.20 0.00 0.00 173.24 173.79 1ndm s ILE 369 N 0.75 1.70 0.13 6.45 1.01 -1.26 -1.56 121.20 128.43 1ndm s ILE 369 Ca -0.13 -1.01 0.08 0.00 0.00 0.00 0.00 60.65 59.58 1ndm s ILE 369 Cb -0.15 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.54 1ndm s ILE 369 CO 0.02 0.20 -0.17 0.42 0.00 0.00 0.00 174.94 175.41 1ndm s THR 370 N 1.38 1.62 -0.03 2.92 -4.23 -1.12 -4.95 115.64 111.22 1ndm s THR 370 Ca -0.01 -1.75 0.03 0.00 -1.18 0.00 0.00 61.69 58.78 1ndm s THR 370 Cb -0.16 -1.66 -0.03 0.00 1.34 0.00 0.00 72.50 71.99 1ndm s THR 370 CO -0.08 -0.29 -0.09 0.00 -0.54 0.00 0.00 174.62 173.62 1ndm s ARG 371 N -2.52 2.59 0.40 3.99 1.70 -1.26 0.11 118.95 123.96 1ndm s ARG 371 Ca 0.11 -0.66 -0.24 0.00 -0.47 0.00 0.00 55.73 54.46 1ndm s ARG 371 Cb -0.07 -2.50 -0.09 0.00 -0.57 0.00 0.00 34.95 31.73 1ndm s ARG 371 CO 0.05 0.63 1.10 0.34 -1.08 0.00 0.00 175.30 176.33 1ndm s ASP 372 N -1.07 6.62 0.44 -2.89 -1.08 0.08 -4.95 116.67 113.81 1ndm s ASP 372 Ca 0.14 2.16 0.10 0.00 -0.52 0.00 0.00 52.55 54.44 1ndm s ASP 372 Cb -0.11 -2.60 0.97 0.00 -1.46 0.00 0.00 42.92 39.72 1ndm s ASP 372 CO 0.04 -0.59 2.05 0.74 0.52 0.00 0.00 175.17 177.93 1ndm h THR 373 N 2.20 1.09 0.00 1.71 2.02 -1.99 -3.40 112.91 114.54 1ndm h THR 373 Ca -0.48 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 66.42 1ndm h THR 373 Cb 1.23 0.82 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 1ndm h THR 373 CO 0.62 0.10 0.00 -1.54 0.37 0.00 0.00 175.52 175.08 1ndm n SER 374 N -4.45 0.00 -0.03 4.18 3.41 -1.26 -4.94 113.62 110.54 1ndm n SER 374 Ca 0.00 -1.00 0.11 0.00 -0.26 0.00 0.00 58.87 57.73 1ndm n SER 374 Cb 0.12 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.19 1ndm n SER 374 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ndm n LYS 375 N 0.00 0.08 -2.74 4.33 5.02 -1.26 -4.97 118.16 118.61 1ndm n LYS 375 Ca 0.00 -0.05 -0.10 0.00 -2.02 0.00 0.00 58.31 56.14 1ndm n LYS 375 Cb 0.28 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 33.84 1ndm n LYS 375 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1ndm n ASN 376 N -1.42 -2.97 -3.73 4.39 5.15 -1.26 -4.91 115.26 110.50 1ndm n ASN 376 Ca 0.05 -0.39 -0.12 0.00 -0.60 0.00 0.00 54.58 53.52 1ndm n ASN 376 Cb 0.34 -3.27 -0.11 0.00 -0.53 0.00 0.00 39.78 36.21 1ndm n ASN 376 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1ndm s GLN 377 N -4.47 0.41 0.35 1.20 -0.21 -1.26 -2.45 119.66 113.23 1ndm s GLN 377 Ca 0.09 0.58 0.09 0.00 0.02 0.00 0.00 55.36 56.14 1ndm s GLN 377 Cb -0.01 0.14 -0.06 0.00 1.00 0.00 0.00 33.01 34.08 1ndm s GLN 377 CO 0.44 -0.08 0.01 1.52 -2.12 0.00 0.00 175.29 175.05 1ndm s TYR 378 N 0.51 2.53 0.27 0.91 1.13 -0.91 -0.74 117.35 121.05 1ndm s TYR 378 Ca -0.03 -0.47 0.07 0.00 -1.41 0.00 0.00 57.07 55.23 1ndm s TYR 378 Cb -0.04 -1.52 -0.06 0.00 -1.10 0.00 0.00 41.96 39.24 1ndm s TYR 378 CO -0.03 0.47 -0.08 0.71 -2.51 0.00 0.00 175.55 174.12 1ndm s TYR 379 N -2.55 1.93 -0.08 -3.49 1.51 0.30 -1.68 117.35 113.29 1ndm s TYR 379 Ca 0.35 -0.67 0.02 0.00 -1.01 0.00 0.00 57.07 55.76 1ndm s TYR 379 Cb 0.01 -1.06 0.01 0.00 -0.11 0.00 0.00 41.96 40.81 1ndm s TYR 379 CO 0.19 0.31 -0.14 -1.17 -1.11 0.00 0.00 175.55 173.63 1ndm s LEU 380 N -3.43 1.67 -0.06 -1.29 2.96 -0.65 -2.80 118.68 115.08 1ndm s LEU 380 Ca 0.28 -0.35 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 1ndm s LEU 380 Cb 0.03 -0.93 0.02 0.00 0.50 0.00 0.00 46.19 45.81 1ndm s LEU 380 CO 0.11 0.03 -0.07 -1.10 -1.32 0.00 0.00 176.35 174.00 1ndm s GLN 381 N 0.76 1.17 -0.13 1.98 -0.21 -0.60 -1.01 119.66 121.62 1ndm s GLN 381 Ca -0.12 -0.22 -0.00 0.00 0.02 0.00 0.00 55.36 55.03 1ndm s GLN 381 Cb -0.16 -1.08 0.03 0.00 1.00 0.00 0.00 33.01 32.80 1ndm s GLN 381 CO 0.03 -0.05 -0.08 -1.17 -2.12 0.00 0.00 175.29 171.89 1ndm s LEU 382 N 0.87 1.38 0.63 2.90 2.96 0.94 -0.73 118.68 127.63 1ndm s LEU 382 Ca -0.11 -0.41 -0.07 0.00 -0.22 0.00 0.00 54.13 53.31 1ndm s LEU 382 Cb -0.15 -0.92 0.01 0.00 0.50 0.00 0.00 46.19 45.63 1ndm s LEU 382 CO 0.01 -0.12 0.96 0.20 -1.32 0.00 0.00 176.35 176.08 1ndm s ASN 383 N 1.65 5.50 -0.94 3.68 0.01 -0.20 -0.37 114.94 124.26 1ndm s ASN 383 Ca 0.04 0.80 -0.22 0.00 -0.71 0.00 0.00 52.86 52.77 1ndm s ASN 383 Cb -0.13 -1.72 0.03 0.00 0.41 0.00 0.00 41.25 39.84 1ndm s ASN 383 CO -0.09 -1.17 0.56 -1.20 -1.51 0.00 0.00 177.10 173.69 1ndm n SER 384 N -2.71 -3.63 -4.88 -1.22 7.64 -1.25 -4.91 113.62 102.66 1ndm n SER 384 Ca 0.05 -1.04 -0.30 0.00 1.01 0.00 0.00 58.87 58.60 1ndm n SER 384 Cb 0.58 -1.34 -0.00 0.00 -1.01 0.00 0.00 64.21 62.43 1ndm n SER 384 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1ndm s VAL 385 N -3.49 4.76 0.30 0.44 -7.23 -1.17 -4.70 120.40 109.31 1ndm s VAL 385 Ca 0.30 0.66 0.04 0.00 -1.81 0.00 0.00 61.98 61.17 1ndm s VAL 385 Cb -0.17 -3.83 -0.02 0.00 0.56 0.00 0.00 36.38 32.92 1ndm s VAL 385 CO 0.81 -0.91 0.15 0.35 -0.31 0.00 0.00 175.10 175.19 1ndm n THR 386 N -2.25 0.00 0.27 5.32 -2.24 -1.26 -0.66 114.28 113.46 1ndm n THR 386 Ca 0.04 -1.90 0.10 0.00 -2.27 0.00 0.00 64.05 60.02 1ndm n THR 386 Cb 0.54 0.77 0.49 0.00 -2.10 0.00 0.00 70.33 70.03 1ndm n THR 386 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ndm n THR 387 N -0.66 1.02 0.39 4.28 -2.24 -1.26 -1.32 114.28 114.49 1ndm n THR 387 Ca -0.01 0.47 0.13 0.00 -2.27 0.00 0.00 64.05 62.37 1ndm n THR 387 Cb 0.48 -1.43 0.51 0.00 -2.10 0.00 0.00 70.33 67.80 1ndm n THR 387 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1ndm h GLU 388 N 0.00 0.00 -0.27 -0.78 3.07 -1.95 -2.33 114.58 112.32 1ndm h GLU 388 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ndm h GLU 388 Cb 0.17 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1ndm h GLU 388 CO 0.00 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.36 1ndm n ASP 389 N -2.34 2.43 -4.66 1.42 8.00 -0.44 -4.88 116.55 116.08 1ndm n ASP 389 Ca 0.02 -1.85 -0.42 0.00 0.71 0.00 0.00 54.79 53.25 1ndm n ASP 389 Cb 0.24 -0.17 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1ndm n ASP 389 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ndm s THR 390 N -1.66 3.65 0.01 -3.53 2.01 -0.88 -4.80 115.64 110.44 1ndm s THR 390 Ca 0.34 0.78 -0.25 0.00 0.31 0.00 0.00 61.69 62.87 1ndm s THR 390 Cb 0.19 -3.51 0.08 0.00 0.01 0.00 0.00 72.50 69.27 1ndm s THR 390 CO 0.28 -0.08 1.16 0.00 -0.69 0.00 0.00 174.62 175.29 1ndm n ALA 391 N 7.17 -3.25 -2.70 7.40 0.00 -0.42 -4.31 120.51 124.40 1ndm n ALA 391 Ca 0.17 -0.79 -0.36 0.00 0.00 0.00 0.00 53.44 52.46 1ndm n ALA 391 Cb 0.43 0.20 -0.08 0.00 0.00 0.00 0.00 19.45 20.00 1ndm n ALA 391 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ndm s THR 392 N -2.03 5.35 -0.13 0.00 2.01 -0.41 -0.95 115.64 119.48 1ndm s THR 392 Ca 0.27 0.32 -0.03 0.00 0.31 0.00 0.00 61.69 62.55 1ndm s THR 392 Cb -0.01 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.93 1ndm s THR 392 CO 0.00 0.38 -0.01 -0.31 -0.69 0.00 0.00 174.62 173.99 1ndm s TYR 393 N 0.68 3.10 -0.02 4.92 1.51 0.65 -0.54 117.35 127.64 1ndm s TYR 393 Ca 0.11 -0.06 0.06 0.00 -1.01 0.00 0.00 57.07 56.16 1ndm s TYR 393 Cb -0.12 -1.91 -0.01 0.00 -0.11 0.00 0.00 41.96 39.80 1ndm s TYR 393 CO 0.02 0.18 -0.20 0.71 -1.11 0.00 0.00 175.55 175.15 1ndm s TYR 394 N -0.10 1.82 -0.02 2.71 2.02 0.15 -1.14 117.35 122.78 1ndm s TYR 394 Ca 0.03 -0.38 0.00 0.00 -0.37 0.00 0.00 57.07 56.36 1ndm s TYR 394 Cb -0.13 -1.18 -0.04 0.00 -0.40 0.00 0.00 41.96 40.21 1ndm s TYR 394 CO 0.02 -0.06 0.02 0.00 -1.57 0.00 0.00 175.55 173.96 1ndm s ALA 396 N -1.07 -0.48 0.43 0.00 0.00 -0.85 -1.36 121.76 118.43 1ndm s ALA 396 Ca 0.19 -0.46 -0.22 0.00 0.00 0.00 0.00 51.96 51.47 1ndm s ALA 396 Cb -0.12 0.69 -0.10 0.00 0.00 0.00 0.00 23.12 23.59 1ndm s ALA 396 CO 0.09 -0.62 0.99 0.50 0.00 0.00 0.00 175.76 176.72 1ndm s ARG 397 N -3.87 4.16 0.50 0.00 3.52 -0.54 -0.08 118.95 122.63 1ndm s ARG 397 Ca 0.08 1.26 0.28 0.00 -0.13 0.00 0.00 55.73 57.22 1ndm s ARG 397 Cb 0.03 -2.29 1.37 0.00 -1.56 0.00 0.00 34.95 32.50 1ndm s ARG 397 CO -0.08 -0.11 1.87 2.35 -0.81 0.00 0.00 175.30 178.52 1ndm h TRP 398 N 2.07 0.18 0.00 5.12 7.01 -1.66 0.46 115.95 129.12 1ndm h TRP 398 Ca -0.49 0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.52 1ndm h TRP 398 Cb 1.20 -0.05 0.00 0.00 -2.10 0.00 0.00 29.16 28.20 1ndm h TRP 398 CO 0.60 0.04 0.00 0.93 -2.79 0.00 0.00 178.44 177.22 1ndm h GLU 399 N 0.12 0.00 -0.49 2.65 4.39 -1.91 -3.45 114.58 115.89 1ndm h GLU 399 Ca 0.46 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.95 1ndm h GLU 399 Cb 1.61 0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 30.17 1ndm h GLU 399 CO -0.07 0.00 -0.19 -1.33 -1.16 0.00 0.00 179.01 176.26 1ndm n MET 400 N -2.59 -0.93 -0.07 2.33 2.81 0.16 -4.88 117.12 113.95 1ndm n MET 400 Ca -0.01 0.83 -0.20 0.00 -1.81 0.00 0.00 57.70 56.50 1ndm n MET 400 Cb 0.10 -4.83 -0.13 0.00 -0.71 0.00 0.00 33.22 27.65 1ndm n MET 400 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1ndm n ASP 401 N -0.13 2.04 -4.38 7.83 3.85 -1.26 -4.90 116.55 119.61 1ndm n ASP 401 Ca -0.10 0.07 -0.34 0.00 -0.71 0.00 0.00 54.79 53.70 1ndm n ASP 401 Cb 0.39 -0.66 -0.14 0.00 -1.35 0.00 0.00 41.12 39.36 1ndm n ASP 401 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1ndm s TYR 402 N -2.53 2.93 0.23 2.11 1.51 -1.26 -5.04 117.35 115.30 1ndm s TYR 402 Ca -0.29 -0.68 0.10 0.00 -1.01 0.00 0.00 57.07 55.19 1ndm s TYR 402 Cb 0.08 -1.98 -0.05 0.00 -0.11 0.00 0.00 41.96 39.90 1ndm s TYR 402 CO 0.67 -0.31 -0.17 -1.58 -1.11 0.00 0.00 175.55 173.06 1ndm s TRP 403 N 0.82 1.97 0.62 2.71 0.52 -1.26 -1.47 118.94 122.84 1ndm s TRP 403 Ca -0.02 -0.46 -0.06 0.00 0.02 0.00 0.00 56.10 55.58 1ndm s TRP 403 Cb -0.15 -0.89 0.03 0.00 -1.15 0.00 0.00 33.47 31.31 1ndm s TRP 403 CO 0.01 0.51 0.92 0.20 0.02 0.00 0.00 176.95 178.62 1ndm s GLY 404 N -3.35 1.64 0.56 0.98 0.00 -0.46 -4.47 107.32 102.22 1ndm s GLY 404 Ca 0.25 -0.81 0.31 0.00 0.00 0.00 0.00 44.72 44.48 1ndm s GLY 404 CO 0.10 -0.49 2.14 0.06 0.00 0.00 0.00 173.10 174.91 1ndm h GLN 405 N -0.28 0.00 0.00 2.90 3.07 -1.90 -3.45 115.11 115.45 1ndm h GLN 405 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.29 1ndm h GLN 405 Cb 1.28 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.84 1ndm h GLN 405 CO 0.60 0.07 0.00 0.41 0.09 0.00 0.00 178.83 180.00 1ndm n GLY 406 N -0.77 0.31 3.07 0.06 0.00 -1.26 -5.04 105.19 101.56 1ndm n GLY 406 Ca -0.02 -1.42 -0.20 0.00 0.00 0.00 0.00 46.02 44.38 1ndm n GLY 406 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ndm s THR 407 N -1.31 0.89 0.19 2.61 -1.32 -0.29 -4.91 115.64 111.49 1ndm s THR 407 Ca 0.00 -0.56 -0.20 0.00 -1.21 0.00 0.00 61.69 59.72 1ndm s THR 407 Cb 0.00 -0.76 -0.08 0.00 -1.51 0.00 0.00 72.50 70.15 1ndm s THR 407 CO 0.00 0.19 0.69 -0.44 -2.21 0.00 0.00 174.62 172.85 1ndm s SER 408 N -0.43 7.08 -0.03 8.08 0.01 -1.26 -0.25 113.70 126.90 1ndm s SER 408 Ca 0.03 1.40 -0.01 0.00 1.31 0.00 0.00 55.95 58.68 1ndm s SER 408 Cb -0.05 -2.41 0.03 0.00 0.21 0.00 0.00 66.02 63.80 1ndm s SER 408 CO -0.00 0.09 0.06 -0.69 0.41 0.00 0.00 173.24 173.11 1ndm s VAL 409 N -1.41 -0.04 -0.05 3.43 1.01 -0.13 -4.47 120.40 118.73 1ndm s VAL 409 Ca 0.40 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.58 1ndm s VAL 409 Cb -0.18 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 1ndm s VAL 409 CO 0.21 0.07 -0.17 -0.89 0.00 0.00 0.00 175.10 174.32 1ndm s THR 410 N 0.85 2.82 -0.32 3.92 2.01 0.13 -1.30 115.64 123.75 1ndm s THR 410 Ca -0.07 -0.81 -0.06 0.00 0.31 0.00 0.00 61.69 61.06 1ndm s THR 410 Cb -0.10 -2.08 0.03 0.00 0.01 0.00 0.00 72.50 70.36 1ndm s THR 410 CO -0.03 0.59 0.09 -0.69 -0.69 0.00 0.00 174.62 173.88 1ndm s VAL 411 N -0.66 3.79 0.04 3.82 1.01 -1.25 -1.02 120.40 126.12 1ndm s VAL 411 Ca 0.10 -0.98 -0.25 0.00 0.00 0.00 0.00 61.98 60.85 1ndm s VAL 411 Cb -0.11 -3.07 0.06 0.00 0.00 0.00 0.00 36.38 33.27 1ndm s VAL 411 CO 0.00 -0.07 0.58 -0.55 0.00 0.00 0.00 175.10 175.07 1ndm s SER 412 N 1.43 -0.53 -0.04 3.32 0.15 -0.63 -4.08 113.70 113.32 1ndm s SER 412 Ca -0.00 0.31 0.17 0.00 0.70 0.00 0.00 55.95 57.13 1ndm s SER 412 Cb -0.19 0.52 0.55 0.00 -1.71 0.00 0.00 66.02 65.20 1ndm s SER 412 CO 0.02 -0.73 1.46 -1.54 1.20 0.00 0.00 173.24 173.66 1ndm n SER 413 N 0.43 3.82 -4.79 5.45 3.41 -1.26 -4.19 113.62 116.49 1ndm n SER 413 Ca -0.18 -2.18 -0.32 0.00 -0.26 0.00 0.00 58.87 55.93 1ndm n SER 413 Cb 0.60 -0.43 0.05 0.00 -0.26 0.00 0.00 64.21 64.17 1ndm n SER 413 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ndm s ALA 414 N -1.32 2.53 0.07 7.33 0.00 -1.26 -5.05 121.76 124.05 1ndm s ALA 414 Ca 0.41 0.38 0.04 0.00 0.00 0.00 0.00 51.96 52.78 1ndm s ALA 414 Cb 0.24 -3.26 -0.04 0.00 0.00 0.00 0.00 23.12 20.05 1ndm s ALA 414 CO 0.24 -1.25 0.03 0.15 0.00 0.00 0.00 175.76 174.93 1ndm s LYS 415 N -4.40 2.70 -0.02 0.00 1.02 -1.26 -5.01 119.74 112.77 1ndm s LYS 415 Ca 0.63 -0.75 -0.39 0.00 0.02 0.00 0.00 55.97 55.49 1ndm s LYS 415 Cb -0.18 -2.63 -0.18 0.00 -0.52 0.00 0.00 37.83 34.33 1ndm s LYS 415 CO 0.45 0.56 1.32 2.41 -0.92 0.00 0.00 175.35 179.18 1ndm n THR 416 N 0.65 0.04 -3.69 2.17 -1.04 -1.26 -4.68 114.28 106.47 1ndm n THR 416 Ca -0.11 -0.01 -0.16 0.00 -2.04 0.00 0.00 64.05 61.74 1ndm n THR 416 Cb 0.52 -0.59 -0.15 0.00 -1.82 0.00 0.00 70.33 68.29 1ndm n THR 416 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1ndm s THR 417 N 0.85 -0.21 0.50 12.58 2.01 0.13 -4.92 115.64 126.59 1ndm s THR 417 Ca 0.89 0.30 -0.22 0.00 0.31 0.00 0.00 61.69 62.97 1ndm s THR 417 Cb -1.10 -0.29 -0.06 0.00 0.01 0.00 0.00 72.50 71.05 1ndm s THR 417 CO 0.54 0.12 1.19 0.00 -0.69 0.00 0.00 174.62 175.79 1ndm s ALA 418 N 1.97 2.86 0.45 7.40 0.00 -1.26 -1.44 121.76 131.73 1ndm s ALA 418 Ca -0.01 0.98 -0.17 0.00 0.00 0.00 0.00 51.96 52.76 1ndm s ALA 418 Cb -0.12 -3.41 -0.09 0.00 0.00 0.00 0.00 23.12 19.50 1ndm s ALA 418 CO -0.06 -0.83 0.92 -1.25 0.00 0.00 0.00 175.76 174.54 1ndm s PRO 419 N -2.89 4.05 0.12 0.00 0.04 -1.26 -4.51 135.00 130.55 1ndm s PRO 419 Ca 0.68 0.93 -0.19 0.00 0.04 0.00 0.00 61.00 62.46 1ndm s PRO 419 Cb -0.30 -2.22 -0.07 0.00 0.04 0.00 0.00 34.50 31.96 1ndm s PRO 419 CO 0.35 -0.10 0.61 -1.12 0.04 0.00 0.00 177.00 176.79 1ndm s SER 420 N -2.63 7.07 -0.20 6.66 0.01 0.63 -4.90 113.70 120.33 1ndm s SER 420 Ca 0.59 1.30 0.01 0.00 1.31 0.00 0.00 55.95 59.16 1ndm s SER 420 Cb -0.10 -2.37 0.04 0.00 0.21 0.00 0.00 66.02 63.80 1ndm s SER 420 CO 0.22 0.21 -0.10 -0.69 0.41 0.00 0.00 173.24 173.29 1ndm s VAL 421 N -1.23 1.58 -0.12 3.43 1.01 -1.26 -1.22 120.40 122.60 1ndm s VAL 421 Ca 0.33 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 1ndm s VAL 421 Cb -0.19 -1.67 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1ndm s VAL 421 CO 0.20 0.16 -0.06 -0.31 0.00 0.00 0.00 175.10 175.10 1ndm s TYR 422 N 1.42 2.97 0.08 5.22 2.02 0.03 -4.96 117.35 124.14 1ndm s TYR 422 Ca -0.01 -0.22 -0.30 0.00 -0.37 0.00 0.00 57.07 56.17 1ndm s TYR 422 Cb -0.16 -1.85 -0.05 0.00 -0.40 0.00 0.00 41.96 39.50 1ndm s TYR 422 CO -0.08 0.09 0.98 -1.25 -1.57 0.00 0.00 175.55 173.71 1ndm s PRO 423 N -0.09 4.65 -0.55 -1.71 0.04 -1.26 -0.93 135.00 135.14 1ndm s PRO 423 Ca 0.01 1.47 -0.06 0.00 0.04 0.00 0.00 61.00 62.45 1ndm s PRO 423 Cb -0.13 -3.39 0.14 0.00 0.04 0.00 0.00 34.50 31.16 1ndm s PRO 423 CO 0.03 0.12 0.39 -0.51 0.04 0.00 0.00 177.00 177.07 1ndm s LEU 424 N 0.29 5.57 0.33 -3.56 1.43 0.13 -4.93 118.68 117.94 1ndm s LEU 424 Ca 0.49 -2.33 -0.06 0.00 -1.03 0.00 0.00 54.13 51.19 1ndm s LEU 424 Cb -0.23 -1.94 -0.05 0.00 0.03 0.00 0.00 46.19 43.99 1ndm s LEU 424 CO 0.30 -0.54 0.63 0.00 0.23 0.00 0.00 176.35 176.96 1ndm s ALA 425 N 0.72 3.53 0.57 4.21 0.00 -1.26 -1.15 121.76 128.39 1ndm s ALA 425 Ca 0.11 -0.46 -0.19 0.00 0.00 0.00 0.00 51.96 51.42 1ndm s ALA 425 Cb -0.22 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.43 1ndm s ALA 425 CO -0.03 0.14 1.18 -1.25 0.00 0.00 0.00 175.76 175.79 1ndm s PRO 426 N -3.71 3.11 0.44 0.00 0.04 -1.26 -4.95 135.00 128.67 1ndm s PRO 426 Ca 0.46 1.75 -0.23 0.00 0.04 0.00 0.00 61.00 63.02 1ndm s PRO 426 Cb -0.11 -1.96 -0.10 0.00 0.04 0.00 0.00 34.50 32.37 1ndm s PRO 426 CO 0.31 -1.08 0.91 1.33 0.04 0.00 0.00 177.00 178.51 1ndm n VAL 427 N -1.48 2.42 -1.91 -0.36 0.24 -1.26 -4.87 118.33 111.10 1ndm n VAL 427 Ca 0.13 -0.50 -0.40 0.00 -2.04 0.00 0.00 64.34 61.52 1ndm n VAL 427 Cb 0.50 -1.02 -0.00 0.00 -1.47 0.00 0.00 33.84 31.85 1ndm n VAL 427 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ndm n GLY 429 N 0.59 2.78 1.94 0.00 0.00 -1.26 -5.15 105.19 104.09 1ndm n GLY 429 Ca 0.02 -1.86 -0.22 0.00 0.00 0.00 0.00 46.02 43.96 1ndm n GLY 429 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ndm n ASP 430 N 0.00 -1.88 -4.00 1.61 8.00 -1.26 -4.78 116.55 114.25 1ndm n ASP 430 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1ndm n ASP 430 Cb 0.00 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.77 1ndm n ASP 430 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1ndm n THR 431 N -2.25 4.02 -1.09 -3.53 -2.24 -1.26 -4.86 114.28 103.07 1ndm n THR 431 Ca -0.01 -4.00 -0.17 0.00 -2.27 0.00 0.00 64.05 57.60 1ndm n THR 431 Cb 0.44 -2.45 -0.14 0.00 -2.10 0.00 0.00 70.33 66.08 1ndm n THR 431 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ndm n THR 432 N 4.39 3.20 0.00 4.28 -2.24 -1.26 -4.85 114.28 117.80 1ndm n THR 432 Ca 0.44 -1.80 0.00 0.00 -2.27 0.00 0.00 64.05 60.42 1ndm n THR 432 Cb 0.39 -2.03 0.00 0.00 -2.10 0.00 0.00 70.33 66.60 1ndm n THR 432 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ndm n GLY 433 N 2.44 2.12 0.09 3.38 0.00 -1.26 -5.00 105.19 106.97 1ndm n GLY 433 Ca 0.48 -0.91 -0.13 0.00 0.00 0.00 0.00 46.02 45.46 1ndm n GLY 433 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1ndm h SER 434 N 0.00 0.27 -1.85 1.61 0.87 -1.98 -3.46 113.55 109.01 1ndm h SER 434 Ca 0.00 -0.32 -0.61 0.00 -1.23 0.00 0.00 61.79 59.63 1ndm h SER 434 Cb 0.00 -0.09 -0.12 0.00 -0.44 0.00 0.00 62.40 61.75 1ndm h SER 434 CO 0.00 1.26 -0.64 -0.94 -0.53 0.00 0.00 176.83 175.98 1ndm s SER 435 N -6.89 3.91 0.00 6.23 1.04 -1.26 -2.18 113.70 114.55 1ndm s SER 435 Ca -0.04 -1.18 0.02 0.00 0.48 0.00 0.00 55.95 55.22 1ndm s SER 435 Cb 0.08 -0.41 -0.01 0.00 0.10 0.00 0.00 66.02 65.78 1ndm s SER 435 CO 0.85 -0.29 -0.05 0.54 0.98 0.00 0.00 173.24 175.27 1ndm s VAL 436 N -2.61 0.41 -0.08 5.02 0.11 0.19 -4.57 120.40 118.87 1ndm s VAL 436 Ca 0.34 -0.36 0.04 0.00 -2.93 0.00 0.00 61.98 59.07 1ndm s VAL 436 Cb 0.04 -0.38 -0.01 0.00 -1.53 0.00 0.00 36.38 34.50 1ndm s VAL 436 CO 0.18 0.02 -0.22 0.42 -3.33 0.00 0.00 175.10 172.17 1ndm s THR 437 N -0.34 2.28 0.48 5.04 -4.23 -1.26 -0.49 115.64 117.11 1ndm s THR 437 Ca -0.00 -0.97 0.06 0.00 -1.18 0.00 0.00 61.69 59.60 1ndm s THR 437 Cb -0.03 -1.87 -0.00 0.00 1.34 0.00 0.00 72.50 71.94 1ndm s THR 437 CO -0.00 0.56 0.30 -0.76 -0.54 0.00 0.00 174.62 174.18 1ndm s LEU 438 N 0.06 2.91 0.21 4.79 2.01 0.78 -4.63 118.68 124.80 1ndm s LEU 438 Ca -0.09 -1.15 -0.11 0.00 0.01 0.00 0.00 54.13 52.80 1ndm s LEU 438 Cb -0.15 -1.37 -0.01 0.00 0.01 0.00 0.00 46.19 44.67 1ndm s LEU 438 CO 0.06 -0.84 0.39 -0.83 1.01 0.00 0.00 176.35 176.13 1ndm s GLY 439 N -4.11 0.57 -0.04 -3.19 0.00 -0.30 -1.28 107.32 98.97 1ndm s GLY 439 Ca 0.36 -0.92 -0.01 0.00 0.00 0.00 0.00 44.72 44.15 1ndm s GLY 439 CO 0.21 -0.74 0.08 0.00 0.00 0.00 0.00 173.10 172.64 1ndm s LEU 441 N 1.32 2.94 -0.34 0.00 2.96 -0.11 -1.22 118.68 124.23 1ndm s LEU 441 Ca -0.07 -0.37 -0.08 0.00 -0.22 0.00 0.00 54.13 53.40 1ndm s LEU 441 Cb -0.12 -1.75 0.03 0.00 0.50 0.00 0.00 46.19 44.85 1ndm s LEU 441 CO -0.04 -0.01 0.13 -0.69 -1.32 0.00 0.00 176.35 174.42 1ndm s VAL 442 N 1.45 4.02 0.03 1.68 1.01 0.10 -0.79 120.40 127.91 1ndm s VAL 442 Ca 0.05 -1.01 0.05 0.00 0.00 0.00 0.00 61.98 61.08 1ndm s VAL 442 Cb -0.14 -3.25 -0.02 0.00 0.00 0.00 0.00 36.38 32.97 1ndm s VAL 442 CO -0.02 -0.17 -0.15 -0.75 0.00 0.00 0.00 175.10 174.01 1ndm s LYS 443 N 1.45 1.05 -0.57 2.72 2.20 -0.35 -0.32 119.74 125.92 1ndm s LYS 443 Ca -0.00 -0.77 -0.02 0.00 -0.36 0.00 0.00 55.97 54.82 1ndm s LYS 443 Cb -0.19 -1.07 0.00 0.00 -1.51 0.00 0.00 37.83 35.06 1ndm s LYS 443 CO 0.04 0.27 0.49 0.41 -0.36 0.00 0.00 175.35 176.20 1ndm n GLY 444 N 1.97 0.21 3.59 5.54 0.00 -0.57 -0.27 105.19 115.66 1ndm n GLY 444 Ca -0.17 -0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 1ndm n GLY 444 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ndm s TYR 445 N -3.15 2.49 -0.29 1.61 1.13 -1.01 -4.38 117.35 113.75 1ndm s TYR 445 Ca 0.15 -0.47 -0.25 0.00 -1.41 0.00 0.00 57.07 55.09 1ndm s TYR 445 Cb -0.06 -1.45 0.15 0.00 -1.10 0.00 0.00 41.96 39.49 1ndm s TYR 445 CO 0.32 0.52 1.17 0.12 -2.51 0.00 0.00 175.55 175.17 1ndm s PHE 446 N -2.56 -0.33 0.01 -3.49 5.36 -0.52 -0.82 117.98 115.62 1ndm s PHE 446 Ca 0.34 0.80 -0.00 0.00 -0.96 0.00 0.00 56.93 57.10 1ndm s PHE 446 Cb 0.01 0.40 0.00 0.00 -0.34 0.00 0.00 43.02 43.09 1ndm s PHE 446 CO 0.18 -0.16 0.01 -0.35 -1.46 0.00 0.00 175.22 173.44 1ndm n PRO 447 N 2.06 0.40 -1.84 10.12 -0.04 -1.26 0.21 135.00 144.64 1ndm n PRO 447 Ca -0.12 -0.03 -0.30 0.00 -0.04 0.00 0.00 63.50 63.01 1ndm n PRO 447 Cb 0.56 -0.01 0.05 0.00 -0.04 0.00 0.00 33.50 34.07 1ndm n PRO 447 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1ndm s GLU 448 N -2.62 2.73 0.51 0.54 2.02 -1.26 -4.83 118.70 115.78 1ndm s GLU 448 Ca 0.01 0.48 0.02 0.00 0.02 0.00 0.00 54.97 55.49 1ndm s GLU 448 Cb -0.00 -2.00 0.02 0.00 0.10 0.00 0.00 34.13 32.24 1ndm s GLU 448 CO 0.01 -1.13 0.14 -0.35 0.02 0.00 0.00 175.26 173.94 1ndm n PRO 449 N -3.08 0.77 -4.35 0.39 -0.04 -1.26 -4.91 135.00 122.52 1ndm n PRO 449 Ca 0.07 -3.51 -0.21 0.00 -0.04 0.00 0.00 63.50 59.81 1ndm n PRO 449 Cb 0.57 0.75 -0.11 0.00 -0.04 0.00 0.00 33.50 34.67 1ndm n PRO 449 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ndm s VAL 450 N -2.74 1.85 -0.13 0.52 -7.23 -1.26 -4.20 120.40 107.21 1ndm s VAL 450 Ca 0.11 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.25 1ndm s VAL 450 Cb -0.01 -1.94 0.01 0.00 0.56 0.00 0.00 36.38 35.00 1ndm s VAL 450 CO 0.07 -0.41 -0.21 0.42 -0.31 0.00 0.00 175.10 174.66 1ndm s THR 451 N -2.36 1.96 -0.07 5.32 -4.23 0.04 -4.96 115.64 111.34 1ndm s THR 451 Ca 0.19 -0.92 0.05 0.00 -1.18 0.00 0.00 61.69 59.83 1ndm s THR 451 Cb -0.04 -1.74 -0.01 0.00 1.34 0.00 0.00 72.50 72.05 1ndm s THR 451 CO 0.07 0.53 -0.22 -0.22 -0.54 0.00 0.00 174.62 174.24 1ndm s LEU 452 N 0.84 2.24 0.10 4.79 0.20 -1.26 -0.88 118.68 124.71 1ndm s LEU 452 Ca -0.07 -0.45 0.01 0.00 0.69 0.00 0.00 54.13 54.31 1ndm s LEU 452 Cb -0.15 -1.43 -0.04 0.00 -0.43 0.00 0.00 46.19 44.13 1ndm s LEU 452 CO -0.02 0.24 -0.03 0.42 -0.29 0.00 0.00 176.35 176.67 1ndm s THR 454 N -0.15 0.52 -0.13 3.68 -4.23 -0.02 -4.99 115.64 110.33 1ndm s THR 454 Ca -0.03 -1.91 -0.01 0.00 -1.18 0.00 0.00 61.69 58.56 1ndm s THR 454 Cb -0.14 -1.76 -0.02 0.00 1.34 0.00 0.00 72.50 71.93 1ndm s THR 454 CO 0.04 -0.80 -0.10 0.26 -0.54 0.00 0.00 174.62 173.48 1ndm s TRP 455 N -3.74 2.88 -1.48 3.99 0.52 -1.26 -0.50 118.94 119.35 1ndm s TRP 455 Ca 0.14 -0.47 -0.04 0.00 0.02 0.00 0.00 56.10 55.75 1ndm s TRP 455 Cb 0.06 -1.85 0.04 0.00 -1.15 0.00 0.00 33.47 30.56 1ndm s TRP 455 CO -0.04 -0.10 0.49 0.09 0.02 0.00 0.00 176.95 177.41 1ndm n ASN 460 N 3.36 -0.99 -3.11 2.95 3.02 0.12 -0.59 115.26 120.02 1ndm n ASN 460 Ca -0.18 -1.02 -0.21 0.00 -0.03 0.00 0.00 54.58 53.14 1ndm n ASN 460 Cb 0.53 -2.93 0.01 0.00 -0.61 0.00 0.00 39.78 36.78 1ndm n ASN 460 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1ndm n SER 461 N -2.91 -4.51 0.00 6.41 7.64 -1.26 -1.36 113.62 117.64 1ndm n SER 461 Ca -0.22 -0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.39 1ndm n SER 461 Cb 0.64 -3.71 0.00 0.00 -1.01 0.00 0.00 64.21 60.13 1ndm n SER 461 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ndm n GLY 462 N -1.23 1.10 0.26 0.23 0.00 0.24 -4.91 105.19 100.88 1ndm n GLY 462 Ca -0.07 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.10 1ndm n GLY 462 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ndm h SER 463 N 0.00 0.00 -3.71 1.61 0.02 -1.06 -3.38 113.55 107.02 1ndm h SER 463 Ca 0.00 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.27 1ndm h SER 463 Cb 0.00 0.00 -0.36 0.00 0.14 0.00 0.00 62.40 62.18 1ndm h SER 463 CO 0.00 0.10 -0.70 -0.22 -1.14 0.00 0.00 176.83 174.87 1ndm s LEU 464 N -6.62 4.30 -0.01 5.07 2.96 -1.11 -4.91 118.68 118.36 1ndm s LEU 464 Ca -0.01 -1.69 0.01 0.00 -0.22 0.00 0.00 54.13 52.23 1ndm s LEU 464 Cb 0.11 -1.68 -0.02 0.00 0.50 0.00 0.00 46.19 45.10 1ndm s LEU 464 CO 0.57 -0.33 0.00 -1.54 -1.32 0.00 0.00 176.35 173.73 1ndm n SER 465 N 4.48 4.68 -4.78 3.68 3.41 -1.26 -4.24 113.62 119.59 1ndm n SER 465 Ca -0.07 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.19 1ndm n SER 465 Cb 0.42 0.54 -0.01 0.00 -0.26 0.00 0.00 64.21 64.90 1ndm n SER 465 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1ndm s SER 466 N -3.15 5.91 -1.62 4.04 0.01 -1.26 -3.37 113.70 114.26 1ndm s SER 466 Ca -0.01 2.12 0.00 0.00 1.31 0.00 0.00 55.95 59.38 1ndm s SER 466 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.66 1ndm s SER 466 CO 0.05 -1.09 0.00 0.61 0.41 0.00 0.00 173.24 173.23 1ndm n GLY 467 N 0.08 0.62 3.71 3.44 0.00 -1.26 -4.66 105.19 107.13 1ndm n GLY 467 Ca 0.11 -0.19 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 1ndm n GLY 467 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ndm s VAL 469 N -2.75 4.46 -0.18 1.61 1.01 -1.22 -0.84 120.40 122.50 1ndm s VAL 469 Ca 0.00 -0.24 -0.03 0.00 0.00 0.00 0.00 61.98 61.71 1ndm s VAL 469 Cb 0.00 -2.91 0.06 0.00 0.00 0.00 0.00 36.38 33.53 1ndm s VAL 469 CO 0.00 0.57 0.05 -1.00 0.00 0.00 0.00 175.10 174.71 1ndm s HIS 470 N -0.94 0.80 -0.24 5.22 3.76 -0.16 -4.99 115.29 118.73 1ndm s HIS 470 Ca 0.15 -0.69 -0.04 0.00 -0.15 0.00 0.00 55.06 54.33 1ndm s HIS 470 Cb -0.11 -0.93 0.01 0.00 1.11 0.00 0.00 32.58 32.65 1ndm s HIS 470 CO 0.04 -0.57 -0.03 0.99 -0.85 0.00 0.00 174.74 174.32 1ndm s THR 471 N 1.93 3.32 0.32 1.30 2.01 -1.26 -0.25 115.64 123.01 1ndm s THR 471 Ca 0.00 -0.70 -0.17 0.00 0.31 0.00 0.00 61.69 61.13 1ndm s THR 471 Cb -0.17 -2.60 -0.09 0.00 0.01 0.00 0.00 72.50 69.65 1ndm s THR 471 CO -0.08 0.29 0.77 -0.36 -0.69 0.00 0.00 174.62 174.54 1ndm s PHE 472 N 1.43 3.43 0.64 4.92 0.40 -0.68 -5.01 117.98 123.12 1ndm s PHE 472 Ca 0.03 1.32 -0.18 0.00 -0.60 0.00 0.00 56.93 57.51 1ndm s PHE 472 Cb -0.16 -2.61 -0.01 0.00 0.51 0.00 0.00 43.02 40.76 1ndm s PHE 472 CO -0.03 0.12 1.30 -2.14 0.70 0.00 0.00 175.22 175.18 1ndm s PRO 473 N -2.77 2.56 0.41 0.24 0.02 -1.26 -4.40 135.00 129.81 1ndm s PRO 473 Ca 0.53 2.08 -0.23 0.00 0.02 0.00 0.00 61.00 63.40 1ndm s PRO 473 Cb -0.12 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.46 1ndm s PRO 473 CO 0.18 -1.60 1.05 0.00 -0.33 0.00 0.00 177.00 176.30 1ndm s ALA 474 N -1.38 3.06 0.16 -1.55 0.00 -1.26 -4.81 121.76 115.98 1ndm s ALA 474 Ca 0.82 0.68 0.10 0.00 0.00 0.00 0.00 51.96 53.57 1ndm s ALA 474 Cb -0.38 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 1ndm s ALA 474 CO 0.40 -0.22 -0.23 0.14 0.00 0.00 0.00 175.76 175.86 1ndm s VAL 475 N -1.71 2.11 -0.16 0.00 -7.23 -0.06 -4.92 120.40 108.42 1ndm s VAL 475 Ca 0.59 -1.88 -0.24 0.00 -1.81 0.00 0.00 61.98 58.65 1ndm s VAL 475 Cb -0.21 -1.94 -0.02 0.00 0.56 0.00 0.00 36.38 34.77 1ndm s VAL 475 CO 0.26 -0.12 0.75 -0.22 -0.31 0.00 0.00 175.10 175.46 1ndm s LEU 476 N -2.43 4.19 -0.09 1.32 2.96 -1.26 -0.97 118.68 122.40 1ndm s LEU 476 Ca 0.16 1.07 0.02 0.00 -0.22 0.00 0.00 54.13 55.16 1ndm s LEU 476 Cb -0.08 -3.11 0.02 0.00 0.50 0.00 0.00 46.19 43.52 1ndm s LEU 476 CO 0.07 -0.31 -0.12 -1.58 -1.32 0.00 0.00 176.35 173.09 1ndm s GLN 477 N 1.85 1.80 -1.49 1.98 0.74 0.52 -4.81 119.66 120.25 1ndm s GLN 477 Ca 0.35 -0.42 -0.02 0.00 0.05 0.00 0.00 55.36 55.32 1ndm s GLN 477 Cb -0.17 -1.58 0.02 0.00 1.10 0.00 0.00 33.01 32.39 1ndm s GLN 477 CO 0.13 -0.06 0.29 0.45 -0.55 0.00 0.00 175.29 175.55 1ndm n SER 478 N 4.17 -0.08 0.00 6.67 2.88 -1.26 0.04 113.62 126.04 1ndm n SER 478 Ca -0.20 -1.12 0.00 0.00 -1.33 0.00 0.00 58.87 56.23 1ndm n SER 478 Cb 0.51 -2.45 0.00 0.00 -0.75 0.00 0.00 64.21 61.53 1ndm n SER 478 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1ndm n ASP 481 N -2.91 -1.72 -4.29 -3.46 10.43 -1.26 -4.96 116.55 108.37 1ndm n ASP 481 Ca -0.28 0.00 -0.17 0.00 2.57 0.00 0.00 54.79 56.91 1ndm n ASP 481 Cb 0.67 -1.86 -0.10 0.00 1.84 0.00 0.00 41.12 41.67 1ndm n ASP 481 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1ndm s LEU 482 N 0.00 2.50 0.46 0.64 1.43 0.11 -4.85 118.68 118.96 1ndm s LEU 482 Ca 0.00 -0.95 -0.06 0.00 -1.03 0.00 0.00 54.13 52.09 1ndm s LEU 482 Cb 0.00 -0.56 -0.04 0.00 0.03 0.00 0.00 46.19 45.61 1ndm s LEU 482 CO 0.00 -0.20 0.78 -0.31 0.23 0.00 0.00 176.35 176.85 1ndm s TYR 483 N -2.78 3.54 -0.08 0.29 2.02 -0.00 0.20 117.35 120.54 1ndm s TYR 483 Ca 0.17 0.85 -0.12 0.00 -0.37 0.00 0.00 57.07 57.60 1ndm s TYR 483 Cb -0.01 -2.32 0.03 0.00 -0.40 0.00 0.00 41.96 39.25 1ndm s TYR 483 CO 0.04 -0.23 0.31 0.99 -1.57 0.00 0.00 175.55 175.09 1ndm s THR 484 N -2.65 0.02 0.16 -0.71 2.01 -0.14 -1.52 115.64 112.82 1ndm s THR 484 Ca 0.48 -0.20 -0.15 0.00 0.31 0.00 0.00 61.69 62.13 1ndm s THR 484 Cb -0.10 -0.51 0.02 0.00 0.01 0.00 0.00 72.50 71.92 1ndm s THR 484 CO 0.42 -0.11 0.42 -0.22 -0.69 0.00 0.00 174.62 174.44 1ndm s LEU 485 N -0.42 0.41 0.15 4.42 0.20 0.56 -0.88 118.68 123.12 1ndm s LEU 485 Ca -0.05 -0.50 -0.08 0.00 0.69 0.00 0.00 54.13 54.18 1ndm s LEU 485 Cb -0.04 1.81 -0.01 0.00 -0.43 0.00 0.00 46.19 47.53 1ndm s LEU 485 CO 0.02 -0.94 0.25 -0.94 -0.29 0.00 0.00 176.35 174.45 1ndm s SER 486 N -2.86 0.07 -0.06 3.68 1.04 -1.26 0.02 113.70 114.33 1ndm s SER 486 Ca 0.08 -0.85 -0.07 0.00 0.48 0.00 0.00 55.95 55.59 1ndm s SER 486 Cb 0.01 0.41 0.02 0.00 0.10 0.00 0.00 66.02 66.55 1ndm s SER 486 CO -0.06 -0.85 0.18 -0.55 0.98 0.00 0.00 173.24 172.94 1ndm s SER 487 N -2.95 -0.16 0.13 7.02 0.15 -0.36 -1.69 113.70 115.84 1ndm s SER 487 Ca 0.15 0.28 0.10 0.00 0.70 0.00 0.00 55.95 57.19 1ndm s SER 487 Cb 0.04 0.35 -0.04 0.00 -1.71 0.00 0.00 66.02 64.66 1ndm s SER 487 CO -0.02 -0.11 -0.23 -0.94 1.20 0.00 0.00 173.24 173.14 1ndm s SER 488 N -0.14 3.55 -0.03 5.45 1.04 0.65 -0.80 113.70 123.43 1ndm s SER 488 Ca -0.02 -0.69 0.01 0.00 0.48 0.00 0.00 55.95 55.73 1ndm s SER 488 Cb -0.02 -0.35 0.02 0.00 0.10 0.00 0.00 66.02 65.77 1ndm s SER 488 CO 0.00 0.17 -0.02 0.54 0.98 0.00 0.00 173.24 174.92 1ndm s VAL 489 N -1.14 0.32 -0.15 5.02 0.11 -0.41 -0.99 120.40 123.15 1ndm s VAL 489 Ca 0.16 -0.01 -0.00 0.00 -2.93 0.00 0.00 61.98 59.20 1ndm s VAL 489 Cb -0.10 -0.37 -0.01 0.00 -1.53 0.00 0.00 36.38 34.37 1ndm s VAL 489 CO 0.08 0.17 -0.14 -0.89 -3.33 0.00 0.00 175.10 170.99 1ndm s THR 490 N 0.89 2.84 0.22 5.04 2.01 -0.02 -0.16 115.64 126.47 1ndm s THR 490 Ca -0.10 -0.71 0.00 0.00 0.31 0.00 0.00 61.69 61.19 1ndm s THR 490 Cb -0.13 -2.21 -0.05 0.00 0.01 0.00 0.00 72.50 70.13 1ndm s THR 490 CO -0.01 0.51 0.11 0.68 -0.69 0.00 0.00 174.62 175.22 1ndm s VAL 491 N 0.73 0.27 0.12 3.82 -7.23 0.35 -4.62 120.40 113.84 1ndm s VAL 491 Ca -0.06 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 57.80 1ndm s VAL 491 Cb -0.15 -2.55 -0.10 0.00 0.56 0.00 0.00 36.38 34.14 1ndm s VAL 491 CO 0.01 -0.02 1.74 0.28 -0.31 0.00 0.00 175.10 176.81 1ndm s THR 492 N -3.96 2.65 0.29 5.32 -1.32 -1.26 0.56 115.64 117.92 1ndm s THR 492 Ca 0.38 0.21 0.01 0.00 -1.21 0.00 0.00 61.69 61.09 1ndm s THR 492 Cb 0.07 -3.14 0.33 0.00 -1.51 0.00 0.00 72.50 68.25 1ndm s THR 492 CO 0.12 0.00 1.63 0.28 -2.21 0.00 0.00 174.62 174.44 1ndm h SER 493 N 8.20 -0.12 0.31 8.08 0.02 -1.68 0.19 113.55 128.55 1ndm h SER 493 Ca -0.44 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1ndm h SER 493 Cb 1.21 0.32 0.00 0.00 0.14 0.00 0.00 62.40 64.07 1ndm h SER 493 CO 0.94 -0.21 0.00 -1.54 -1.14 0.00 0.00 176.83 174.89 1ndm n SER 494 N -5.29 0.13 0.01 3.07 3.41 -1.26 -2.62 113.62 111.07 1ndm n SER 494 Ca 0.21 0.54 0.12 0.00 -0.26 0.00 0.00 58.87 59.48 1ndm n SER 494 Cb 0.69 -0.57 0.20 0.00 -0.26 0.00 0.00 64.21 64.27 1ndm n SER 494 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1ndm n THR 496 N -1.66 0.06 -4.77 6.66 5.66 0.05 -4.66 114.28 115.63 1ndm n THR 496 Ca 0.02 -0.06 -0.25 0.00 -3.05 0.00 0.00 64.05 60.71 1ndm n THR 496 Cb 0.11 0.24 -0.16 0.00 -1.55 0.00 0.00 70.33 68.97 1ndm n THR 496 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 1ndm s TRP 497 N -3.04 1.59 -2.14 1.09 -0.00 -1.08 0.47 118.94 115.83 1ndm s TRP 497 Ca 0.09 -0.44 0.26 0.00 -0.00 0.00 0.00 56.10 56.02 1ndm s TRP 497 Cb 0.17 -1.07 1.38 0.00 -0.00 0.00 0.00 33.47 33.95 1ndm s TRP 497 CO 0.72 -0.15 1.91 -0.35 -0.00 0.00 0.00 176.95 179.09 1ndm n PRO 498 N 3.13 1.23 -0.26 5.86 -0.04 -1.26 -4.93 135.00 138.72 1ndm n PRO 498 Ca -0.18 -0.34 -0.01 0.00 -0.04 0.00 0.00 63.50 62.94 1ndm n PRO 498 Cb 0.53 -1.43 0.06 0.00 -0.04 0.00 0.00 33.50 32.62 1ndm n PRO 498 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ndm h SER 500 N 0.77 -0.94 -3.59 3.54 4.64 -1.82 -3.03 113.55 113.11 1ndm h SER 500 Ca 0.00 0.24 -0.74 0.00 -0.47 0.00 0.00 61.79 60.82 1ndm h SER 500 Cb 0.16 0.54 -0.29 0.00 -0.31 0.00 0.00 62.40 62.51 1ndm h SER 500 CO 0.00 -0.28 -0.24 -1.10 -0.87 0.00 0.00 176.83 174.35 1ndm s GLN 501 N -6.13 2.85 0.55 4.77 -0.21 0.18 -5.05 119.66 116.61 1ndm s GLN 501 Ca -0.14 -2.11 -0.18 0.00 0.02 0.00 0.00 55.36 52.95 1ndm s GLN 501 Cb 0.20 -4.06 -0.14 0.00 1.00 0.00 0.00 33.01 30.01 1ndm s GLN 501 CO 0.73 -1.23 -0.10 0.45 -2.12 0.00 0.00 175.29 173.02 1ndm n SER 502 N 4.39 -3.55 -3.79 5.90 2.88 -1.15 -4.56 113.62 113.75 1ndm n SER 502 Ca 0.01 0.63 -0.22 0.00 -1.33 0.00 0.00 58.87 57.95 1ndm n SER 502 Cb 0.42 -0.88 -0.17 0.00 -0.75 0.00 0.00 64.21 62.82 1ndm n SER 502 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1ndm s ILE 503 N -1.97 0.37 -0.04 2.46 1.01 -1.26 -5.01 121.20 116.76 1ndm s ILE 503 Ca 0.57 0.10 0.05 0.00 0.00 0.00 0.00 60.65 61.37 1ndm s ILE 503 Cb -0.47 -0.51 -0.01 0.00 0.01 0.00 0.00 42.46 41.49 1ndm s ILE 503 CO 0.66 0.25 -0.20 -0.89 0.00 0.00 0.00 174.94 174.75 1ndm s THR 504 N 1.78 1.67 -0.06 2.92 2.01 -1.26 -1.31 115.64 121.40 1ndm s THR 504 Ca 0.02 -0.86 -0.19 0.00 0.31 0.00 0.00 61.69 60.97 1ndm s THR 504 Cb -0.13 -1.42 -0.05 0.00 0.01 0.00 0.00 72.50 70.92 1ndm s THR 504 CO -0.04 0.47 0.54 0.00 -0.69 0.00 0.00 174.62 174.90 1ndm s ASN 507 N 0.14 2.78 -0.08 0.00 -0.87 0.35 -0.36 114.94 116.90 1ndm s ASN 507 Ca 0.29 -0.51 0.01 0.00 -1.57 0.00 0.00 52.86 51.08 1ndm s ASN 507 Cb -0.17 -1.27 0.02 0.00 -0.02 0.00 0.00 41.25 39.81 1ndm s ASN 507 CO 0.14 0.08 -0.09 -0.69 -2.57 0.00 0.00 177.10 173.97 1ndm s VAL 508 N 0.71 0.98 0.00 1.60 1.01 0.14 -0.84 120.40 124.00 1ndm s VAL 508 Ca -0.11 -0.34 0.07 0.00 0.00 0.00 0.00 61.98 61.60 1ndm s VAL 508 Cb -0.16 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 1ndm s VAL 508 CO 0.02 0.34 -0.21 0.00 0.00 0.00 0.00 175.10 175.24 1ndm s ALA 509 N 1.09 2.41 -0.35 5.51 0.00 -0.06 -0.59 121.76 129.77 1ndm s ALA 509 Ca -0.07 -1.14 -0.00 0.00 0.00 0.00 0.00 51.96 50.75 1ndm s ALA 509 Cb -0.14 -0.68 0.12 0.00 0.00 0.00 0.00 23.12 22.41 1ndm s ALA 509 CO -0.01 0.55 0.16 -1.58 0.00 0.00 0.00 175.76 174.87 1ndm s HIS 510 N -0.76 1.58 0.13 0.00 2.46 0.66 -0.78 115.29 118.57 1ndm s HIS 510 Ca 0.12 -1.88 -0.25 0.00 0.47 0.00 0.00 55.06 53.53 1ndm s HIS 510 Cb -0.10 -1.62 -0.06 0.00 -0.13 0.00 0.00 32.58 30.68 1ndm s HIS 510 CO 0.02 -0.84 1.38 -2.30 -2.47 0.00 0.00 174.74 170.53 1ndm n PRO 511 N 4.38 -0.35 -0.34 2.88 -0.02 -1.26 -1.84 135.00 138.45 1ndm n PRO 511 Ca 0.03 1.36 0.13 0.00 -2.02 0.00 0.00 63.50 63.00 1ndm n PRO 511 Cb 0.39 -2.00 0.26 0.00 -0.02 0.00 0.00 33.50 32.13 1ndm n PRO 511 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ndm n ALA 512 N -3.23 0.46 0.29 3.55 0.00 -1.26 0.22 120.51 120.53 1ndm n ALA 512 Ca 0.02 1.05 0.12 0.00 0.00 0.00 0.00 53.44 54.62 1ndm n ALA 512 Cb 0.21 -0.75 0.24 0.00 0.00 0.00 0.00 19.45 19.15 1ndm n ALA 512 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ndm n SER 513 N -5.48 3.40 -3.90 0.00 3.41 -0.90 -4.97 113.62 105.19 1ndm n SER 513 Ca 0.22 -1.98 -0.25 0.00 -0.26 0.00 0.00 58.87 56.60 1ndm n SER 513 Cb 0.71 -0.28 -0.00 0.00 -0.26 0.00 0.00 64.21 64.38 1ndm n SER 513 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1ndm n SER 514 N 1.43 -0.96 -4.18 4.04 7.64 0.13 -4.98 113.62 116.75 1ndm n SER 514 Ca 0.20 -0.94 -0.20 0.00 1.01 0.00 0.00 58.87 58.94 1ndm n SER 514 Cb 0.59 -3.36 -0.13 0.00 -1.01 0.00 0.00 64.21 60.30 1ndm n SER 514 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ndm s THR 515 N -3.81 1.22 -0.16 0.44 -4.23 -1.17 -5.01 115.64 102.92 1ndm s THR 515 Ca 0.08 -1.24 -0.06 0.00 -1.18 0.00 0.00 61.69 59.30 1ndm s THR 515 Cb -0.04 -1.13 0.08 0.00 1.34 0.00 0.00 72.50 72.74 1ndm s THR 515 CO 0.87 -0.11 0.33 -0.75 -0.54 0.00 0.00 174.62 174.42 1ndm s LYS 516 N -1.55 0.23 0.19 3.99 2.20 -1.26 -0.25 119.74 123.29 1ndm s LYS 516 Ca 0.01 0.85 0.10 0.00 -0.36 0.00 0.00 55.97 56.57 1ndm s LYS 516 Cb -0.09 0.08 -0.04 0.00 -1.51 0.00 0.00 37.83 36.26 1ndm s LYS 516 CO 0.02 -0.29 -0.20 0.14 -0.36 0.00 0.00 175.35 174.66 1ndm s VAL 517 N 2.51 2.06 -0.06 4.02 -7.23 0.24 -4.94 120.40 117.00 1ndm s VAL 517 Ca 0.01 -2.01 0.04 0.00 -1.81 0.00 0.00 61.98 58.20 1ndm s VAL 517 Cb -0.12 -1.99 -0.02 0.00 0.56 0.00 0.00 36.38 34.81 1ndm s VAL 517 CO -0.11 -0.26 -0.17 -1.81 -0.31 0.00 0.00 175.10 172.44 1ndm s ASP 518 N -2.76 3.76 -0.23 4.85 -0.00 -1.26 -0.68 116.67 120.35 1ndm s ASP 518 Ca 0.19 -0.30 -0.03 0.00 -0.00 0.00 0.00 52.55 52.41 1ndm s ASP 518 Cb -0.06 -0.93 0.07 0.00 -0.00 0.00 0.00 42.92 42.00 1ndm s ASP 518 CO 0.08 0.29 0.07 -0.54 -0.00 0.00 0.00 175.17 175.08 1ndm s LYS 519 N -0.42 0.48 0.06 8.23 3.01 0.52 -4.96 119.74 126.65 1ndm s LYS 519 Ca 0.05 -0.49 -0.30 0.00 -1.01 0.00 0.00 55.97 54.21 1ndm s LYS 519 Cb -0.12 -1.88 -0.05 0.00 -1.01 0.00 0.00 37.83 34.77 1ndm s LYS 519 CO 0.02 -0.77 1.16 0.21 0.51 0.00 0.00 175.35 176.48 1ndm s LYS 520 N 1.91 4.46 0.00 1.68 2.20 -1.26 -0.72 119.74 128.00 1ndm s LYS 520 Ca 0.03 1.72 0.28 0.00 -0.36 0.00 0.00 55.97 57.64 1ndm s LYS 520 Cb -0.17 -3.36 1.70 0.00 -1.51 0.00 0.00 37.83 34.50 1ndm s LYS 520 CO -0.16 -0.21 2.04 -0.89 -0.36 0.00 0.00 175.35 175.77