#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ykm s ALA 302 N 0.00 3.53 0.27 3.55 0.00 -1.26 -5.09 121.76 122.76 1ykm s ALA 302 Ca 0.00 0.14 0.11 0.00 0.00 0.00 0.00 51.96 52.21 1ykm s ALA 302 Cb 0.00 -2.75 -0.05 0.00 0.00 0.00 0.00 23.12 20.32 1ykm s ALA 302 CO 0.00 0.33 -0.12 -0.65 0.00 0.00 0.00 175.76 175.32 1ykm s GLN 303 N -0.96 1.93 -0.78 0.00 -0.21 -1.26 -5.10 119.66 113.28 1ykm s GLN 303 Ca 0.32 -1.61 -0.17 0.00 0.02 0.00 0.00 55.36 53.92 1ykm s GLN 303 Cb -0.20 -1.94 0.16 0.00 1.00 0.00 0.00 33.01 32.03 1ykm s GLN 303 CO 0.21 0.35 0.83 0.34 -2.12 0.00 0.00 175.29 174.90 1ykm s ASP 304 N -3.55 6.55 0.00 5.90 2.15 -1.26 -4.70 116.67 121.76 1ykm s ASP 304 Ca 0.30 -2.16 0.00 0.00 0.43 0.00 0.00 52.55 51.12 1ykm s ASP 304 Cb -0.06 -2.28 0.00 0.00 -0.30 0.00 0.00 42.92 40.28 1ykm s ASP 304 CO 0.17 -0.85 0.05 -0.46 -0.17 0.00 0.00 175.17 173.91 1ykm n ASN 305 N 5.31 0.10 -4.57 -0.34 0.23 -1.26 -5.04 115.26 109.68 1ykm n ASN 305 Ca 0.09 -0.40 -0.28 0.00 -0.53 0.00 0.00 54.58 53.46 1ykm n ASN 305 Cb 0.46 0.41 -0.09 0.00 -2.08 0.00 0.00 39.78 38.47 1ykm n ASN 305 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 1ykm s SER 306 N -0.41 4.31 -0.01 0.53 0.01 -1.26 -2.78 113.70 114.09 1ykm s SER 306 Ca 0.00 -0.52 0.03 0.00 1.31 0.00 0.00 55.95 56.77 1ykm s SER 306 Cb 0.00 -0.76 -0.01 0.00 0.21 0.00 0.00 66.02 65.46 1ykm s SER 306 CO 0.00 0.12 -0.11 -0.13 0.41 0.00 0.00 173.24 173.53 1ykm s ARG 307 N -2.67 0.95 -0.07 12.44 1.81 0.22 -4.85 118.95 126.78 1ykm s ARG 307 Ca 0.24 -0.39 0.01 0.00 -1.72 0.00 0.00 55.73 53.87 1ykm s ARG 307 Cb -0.09 -0.91 -0.03 0.00 -0.45 0.00 0.00 34.95 33.47 1ykm s ARG 307 CO 0.15 0.22 -0.08 -0.06 -0.68 0.00 0.00 175.30 174.85 1ykm s PHE 308 N -0.17 2.91 0.33 -0.53 0.40 -1.26 -1.32 117.98 118.33 1ykm s PHE 308 Ca 0.03 -0.02 -0.29 0.00 -0.60 0.00 0.00 56.93 56.05 1ykm s PHE 308 Cb -0.05 -1.71 -0.12 0.00 0.51 0.00 0.00 43.02 41.65 1ykm s PHE 308 CO -0.00 0.30 1.51 0.28 0.70 0.00 0.00 175.22 178.00 1ykm n VAL 309 N 2.27 1.52 -1.96 -0.44 0.31 -0.23 -4.92 118.33 114.89 1ykm n VAL 309 Ca -0.18 -0.38 -0.41 0.00 -0.01 0.00 0.00 64.34 63.36 1ykm n VAL 309 Cb 0.53 -1.89 -0.02 0.00 -0.91 0.00 0.00 33.84 31.55 1ykm n VAL 309 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1ykm s ILE 310 N -0.58 2.49 0.24 2.52 -1.09 -1.26 -4.71 121.20 118.81 1ykm s ILE 310 Ca 0.59 0.43 -0.30 0.00 -2.23 0.00 0.00 60.65 59.14 1ykm s ILE 310 Cb -0.51 -3.27 -0.10 0.00 -1.58 0.00 0.00 42.46 37.00 1ykm s ILE 310 CO 0.56 0.08 1.38 -0.13 -1.23 0.00 0.00 174.94 175.60 1ykm s ARG 311 N -0.71 4.32 -0.58 2.79 0.52 -1.26 -4.97 118.95 119.06 1ykm s ARG 311 Ca 0.58 2.20 -0.22 0.00 -0.52 0.00 0.00 55.73 57.77 1ykm s ARG 311 Cb -0.43 -3.14 0.06 0.00 0.52 0.00 0.00 34.95 31.96 1ykm s ARG 311 CO 0.47 -0.33 0.86 0.34 0.02 0.00 0.00 175.30 176.66 1ykm s ASP 312 N 0.25 6.25 0.00 0.23 -1.08 -1.26 -4.90 116.67 116.16 1ykm s ASP 312 Ca 0.57 -0.76 0.07 0.00 -0.52 0.00 0.00 52.55 51.91 1ykm s ASP 312 Cb -0.40 -2.39 0.33 0.00 -1.46 0.00 0.00 42.92 39.00 1ykm s ASP 312 CO 0.42 -1.22 1.22 0.54 0.52 0.00 0.00 175.17 176.66 1ykm n ARG 313 N 7.18 1.13 -0.00 4.34 1.74 -1.26 -2.66 116.66 127.12 1ykm n ARG 313 Ca -0.03 -0.20 0.08 0.00 -0.77 0.00 0.00 57.85 56.94 1ykm n ARG 313 Cb 0.46 -1.12 -0.11 0.00 -1.02 0.00 0.00 32.46 30.67 1ykm n ARG 313 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1ykm n ASN 314 N -0.41 0.97 -0.06 0.55 3.02 -1.26 -4.42 115.26 113.64 1ykm n ASN 314 Ca 0.05 -0.42 -0.21 0.00 -0.03 0.00 0.00 54.58 53.98 1ykm n ASN 314 Cb 0.06 1.40 -0.12 0.00 -0.61 0.00 0.00 39.78 40.51 1ykm n ASN 314 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1ykm h TRP 315 N 0.00 0.14 -4.29 3.10 2.91 -1.93 -3.43 115.95 112.45 1ykm h TRP 315 Ca 0.00 -0.10 -0.51 0.00 1.13 0.00 0.00 58.89 59.41 1ykm h TRP 315 Cb 0.59 -0.01 0.10 0.00 -0.51 0.00 0.00 29.16 29.33 1ykm h TRP 315 CO 0.00 1.45 0.35 -1.01 -1.03 0.00 0.00 178.44 178.21 1ykm s HIS 316 N -2.38 2.84 0.53 2.65 3.76 -1.13 -4.77 115.29 116.78 1ykm s HIS 316 Ca -0.25 1.50 -0.21 0.00 -0.15 0.00 0.00 55.06 55.96 1ykm s HIS 316 Cb 0.04 -3.00 -0.06 0.00 1.11 0.00 0.00 32.58 30.68 1ykm s HIS 316 CO 0.66 -1.48 1.19 -1.25 -0.85 0.00 0.00 174.74 173.01 1ykm s PRO 317 N -4.72 3.37 0.80 8.40 0.04 -1.26 -4.84 135.00 136.80 1ykm s PRO 317 Ca 0.61 1.79 -0.11 0.00 0.04 0.00 0.00 61.00 63.33 1ykm s PRO 317 Cb -0.16 -2.15 0.07 0.00 0.04 0.00 0.00 34.50 32.30 1ykm s PRO 317 CO 0.51 -0.88 1.09 0.15 0.04 0.00 0.00 177.00 177.91 1ykm s LYS 318 N -3.05 2.03 0.02 4.56 -0.14 -1.24 -4.98 119.74 116.94 1ykm s LYS 318 Ca 0.71 0.69 -0.22 0.00 -1.36 0.00 0.00 55.97 55.79 1ykm s LYS 318 Cb -0.29 -1.91 -0.17 0.00 -1.68 0.00 0.00 37.83 33.79 1ykm s LYS 318 CO 0.33 -1.67 1.31 0.00 -0.76 0.00 0.00 175.35 174.57 1ykm h ALA 319 N -1.13 0.14 -2.20 5.17 0.00 -1.95 -3.41 119.26 115.89 1ykm h ALA 319 Ca -0.47 -0.30 -0.71 0.00 0.00 0.00 0.00 54.91 53.43 1ykm h ALA 319 Cb 1.27 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.82 1ykm h ALA 319 CO 0.58 -0.03 -0.15 -1.17 0.00 0.00 0.00 179.25 178.48 1ykm s LEU 320 N -9.14 5.35 -0.45 0.00 2.96 -1.26 -4.77 118.68 111.37 1ykm s LEU 320 Ca -0.15 -1.16 0.02 0.00 -0.22 0.00 0.00 54.13 52.62 1ykm s LEU 320 Cb 0.04 -2.30 0.14 0.00 0.50 0.00 0.00 46.19 44.57 1ykm s LEU 320 CO 0.73 -0.77 0.27 0.42 -1.32 0.00 0.00 176.35 175.68 1ykm s THR 321 N 2.09 1.18 0.40 3.68 -4.23 -1.26 -5.05 115.64 112.45 1ykm s THR 321 Ca 0.09 -2.60 0.26 0.00 -1.18 0.00 0.00 61.69 58.26 1ykm s THR 321 Cb -0.22 -1.82 0.42 0.00 1.34 0.00 0.00 72.50 72.21 1ykm s THR 321 CO 0.09 -0.97 1.57 -2.65 -0.54 0.00 0.00 174.62 172.12 1ykm n PRO 322 N 3.36 -0.05 0.27 3.99 -0.02 -1.26 -1.32 135.00 139.97 1ykm n PRO 322 Ca 0.13 1.33 0.11 0.00 -2.02 0.00 0.00 63.50 63.05 1ykm n PRO 322 Cb 0.37 -2.48 0.73 0.00 -0.02 0.00 0.00 33.50 32.10 1ykm n PRO 322 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1ykm h ASP 323 N 0.00 0.00 -3.55 2.55 3.32 -1.96 -3.10 116.42 113.68 1ykm h ASP 323 Ca 0.86 0.00 -0.77 0.00 0.02 0.00 0.00 57.03 57.14 1ykm h ASP 323 Cb 2.50 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 41.81 1ykm h ASP 323 CO -0.64 0.08 0.27 -0.47 -1.72 0.00 0.00 179.24 176.76 1ykm s TYR 324 N -4.53 3.69 0.34 4.55 5.04 -0.43 -4.86 117.35 121.14 1ykm s TYR 324 Ca -0.04 -1.94 0.14 0.00 -2.44 0.00 0.00 57.07 52.79 1ykm s TYR 324 Cb 0.15 -3.91 1.07 0.00 0.35 0.00 0.00 41.96 39.62 1ykm s TYR 324 CO 0.61 -1.08 1.66 0.87 -1.34 0.00 0.00 175.55 176.27 1ykm h LYS 325 N 7.87 0.31 0.00 4.97 1.57 -1.76 -2.02 116.57 127.50 1ykm h LYS 325 Ca 0.13 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 1ykm h LYS 325 Cb 1.02 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.26 1ykm h LYS 325 CO 0.83 0.20 -0.08 1.15 -0.57 0.00 0.00 179.45 180.99 1ykm h THR 326 N 0.31 0.27 0.00 -0.16 2.02 -1.92 -2.82 112.91 110.62 1ykm h THR 326 Ca 0.73 -0.53 0.00 0.00 0.77 0.00 0.00 66.41 67.38 1ykm h THR 326 Cb 1.65 1.41 0.00 0.00 -1.74 0.00 0.00 68.15 69.47 1ykm h THR 326 CO -0.61 0.07 0.00 0.77 0.37 0.00 0.00 175.52 176.12 1ykm h SER 327 N 0.00 0.00 -0.41 4.18 4.64 -1.66 -3.18 113.55 117.13 1ykm h SER 327 Ca -0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1ykm h SER 327 Cb 0.40 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.48 1ykm h SER 327 CO 0.01 0.00 0.06 0.40 -0.87 0.00 0.00 176.83 176.43 1ykm h ILE 328 N 0.00 1.24 -0.00 0.95 2.04 -1.67 -3.08 117.51 116.99 1ykm h ILE 328 Ca 0.00 -0.87 0.00 0.00 1.00 0.00 0.00 64.86 64.99 1ykm h ILE 328 Cb 0.48 1.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1ykm h ILE 328 CO 0.00 0.30 -0.61 0.00 0.00 0.00 0.00 178.15 177.84 1ykm n ALA 329 N -2.37 3.82 -1.62 1.87 0.00 -1.23 -4.33 120.51 116.64 1ykm n ALA 329 Ca -0.00 -0.43 -0.12 0.00 0.00 0.00 0.00 53.44 52.89 1ykm n ALA 329 Cb 0.24 -1.02 0.14 0.00 0.00 0.00 0.00 19.45 18.80 1ykm n ALA 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ykm n ARG 330 N -1.39 2.36 -4.53 0.00 1.74 -1.19 -4.99 116.66 108.67 1ykm n ARG 330 Ca 0.06 -3.49 -0.23 0.00 -0.77 0.00 0.00 57.85 53.42 1ykm n ARG 330 Cb 0.34 -1.96 -0.16 0.00 -1.02 0.00 0.00 32.46 29.65 1ykm n ARG 330 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ykm s SER 331 N -2.85 1.57 0.23 0.55 1.04 -1.17 -4.95 113.70 108.13 1ykm s SER 331 Ca 0.48 -0.25 -0.30 0.00 0.48 0.00 0.00 55.95 56.35 1ykm s SER 331 Cb 0.41 -0.58 -0.10 0.00 0.10 0.00 0.00 66.02 65.86 1ykm s SER 331 CO -0.00 0.06 1.44 -2.84 0.98 0.00 0.00 173.24 172.88 1ykm s PRO 332 N 0.42 4.27 0.23 4.02 0.02 -1.26 -4.92 135.00 137.78 1ykm s PRO 332 Ca -0.09 2.29 0.20 0.00 0.02 0.00 0.00 61.00 63.42 1ykm s PRO 332 Cb -0.13 -3.12 0.05 0.00 0.02 0.00 0.00 34.50 31.32 1ykm s PRO 332 CO 0.02 -0.43 1.19 0.00 -0.33 0.00 0.00 177.00 177.45 1ykm h ARG 333 N 5.28 0.00 -6.57 5.54 2.47 -2.00 -3.46 114.38 115.63 1ykm h ARG 333 Ca -0.45 0.00 -0.51 0.00 -1.26 0.00 0.00 59.98 57.76 1ykm h ARG 333 Cb 1.22 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.53 1ykm h ARG 333 CO 0.79 0.18 -0.10 -0.65 0.56 0.00 0.00 179.97 180.76 1ykm s GLN 334 N -3.14 3.63 0.50 0.04 -1.52 -1.26 -5.07 119.66 112.85 1ykm s GLN 334 Ca 0.01 0.04 -0.20 0.00 -1.95 0.00 0.00 55.36 53.26 1ykm s GLN 334 Cb 0.08 -2.60 -0.07 0.00 -0.22 0.00 0.00 33.01 30.20 1ykm s GLN 334 CO 0.76 0.14 1.09 0.00 -0.25 0.00 0.00 175.29 177.03 1ykm s ALA 335 N -2.19 2.81 0.23 6.09 0.00 -1.26 -5.00 121.76 122.44 1ykm s ALA 335 Ca 0.45 0.73 -0.30 0.00 0.00 0.00 0.00 51.96 52.84 1ykm s ALA 335 Cb -0.10 -3.31 -0.09 0.00 0.00 0.00 0.00 23.12 19.62 1ykm s ALA 335 CO 0.32 -0.53 1.16 -0.51 0.00 0.00 0.00 175.76 176.20 1ykm s LEU 336 N -3.54 4.49 -0.16 0.00 1.43 -1.26 -5.00 118.68 114.64 1ykm s LEU 336 Ca 0.69 2.28 -0.23 0.00 -1.03 0.00 0.00 54.13 55.84 1ykm s LEU 336 Cb -0.21 -3.62 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 1ykm s LEU 336 CO 0.24 -0.29 0.71 -0.69 0.23 0.00 0.00 176.35 176.55 1ykm s VAL 337 N -0.56 4.98 -0.20 -1.59 1.01 -1.26 -5.03 120.40 117.74 1ykm s VAL 337 Ca 0.49 1.38 -0.25 0.00 0.00 0.00 0.00 61.98 63.60 1ykm s VAL 337 Cb -0.33 -4.02 -0.01 0.00 0.00 0.00 0.00 36.38 32.02 1ykm s VAL 337 CO 0.39 0.11 0.84 -0.44 0.00 0.00 0.00 175.10 176.01 1ykm s SER 338 N 1.10 6.92 0.13 3.32 0.01 -1.26 -5.06 113.70 118.86 1ykm s SER 338 Ca 0.33 1.14 0.10 0.00 1.31 0.00 0.00 55.95 58.83 1ykm s SER 338 Cb -0.16 -2.45 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 1ykm s SER 338 CO 0.12 -0.46 -0.25 0.27 0.41 0.00 0.00 173.24 173.33 1ykm s ILE 339 N 2.48 2.16 0.69 1.44 -4.36 -1.26 -5.14 121.20 117.22 1ykm s ILE 339 Ca 0.37 -1.75 -0.11 0.00 -0.26 0.00 0.00 60.65 58.91 1ykm s ILE 339 Cb -0.16 -1.93 0.00 0.00 1.25 0.00 0.00 42.46 41.62 1ykm s ILE 339 CO 0.10 0.04 1.06 -2.16 0.24 0.00 0.00 174.94 174.21 1ykm s PRO 340 N -2.10 3.01 0.12 0.37 0.04 -1.26 -5.01 135.00 130.17 1ykm s PRO 340 Ca 0.13 0.92 -0.30 0.00 0.04 0.00 0.00 61.00 61.79 1ykm s PRO 340 Cb -0.10 -2.00 -0.06 0.00 0.04 0.00 0.00 34.50 32.38 1ykm s PRO 340 CO 0.06 -1.04 1.08 -0.65 0.04 0.00 0.00 177.00 176.49 1ykm s GLN 341 N -5.07 4.57 0.00 4.56 -0.21 -1.26 -5.02 119.66 117.25 1ykm s GLN 341 Ca 0.58 1.65 0.00 0.00 0.02 0.00 0.00 55.36 57.60 1ykm s GLN 341 Cb -0.14 -3.33 -0.00 0.00 1.00 0.00 0.00 33.01 30.54 1ykm s GLN 341 CO 0.55 0.02 0.00 -1.13 -2.12 0.00 0.00 175.29 172.61 1ykm n SER 342 N 2.95 0.81 0.24 5.90 3.41 -1.26 -4.99 113.62 120.68 1ykm n SER 342 Ca 0.04 -1.03 0.08 0.00 -0.26 0.00 0.00 58.87 57.71 1ykm n SER 342 Cb 0.47 0.01 0.61 0.00 -0.26 0.00 0.00 64.21 65.05 1ykm n SER 342 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1ykm h ILE 343 N 1.01 0.92 -0.07 -1.33 2.10 -1.96 -1.10 117.51 117.08 1ykm h ILE 343 Ca -0.00 -0.48 -0.11 0.00 1.08 0.00 0.00 64.86 65.35 1ykm h ILE 343 Cb 0.01 1.27 -0.01 0.00 -1.09 0.00 0.00 36.82 37.00 1ykm h ILE 343 CO 0.01 0.13 -0.45 0.28 -1.08 0.00 0.00 178.15 177.03 1ykm h SER 344 N 0.00 0.16 0.09 2.19 0.02 -1.96 -3.09 113.55 110.96 1ykm h SER 344 Ca -0.00 -0.07 -0.36 0.00 -0.84 0.00 0.00 61.79 60.51 1ykm h SER 344 Cb 0.26 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 62.69 1ykm h SER 344 CO 0.02 0.60 -2.27 -0.62 -1.14 0.00 0.00 176.83 173.41 1ykm n GLU 345 N -3.99 0.68 0.00 3.45 4.71 -0.98 -4.51 120.64 120.00 1ykm n GLU 345 Ca -0.02 0.10 0.13 0.00 -0.01 0.00 0.00 57.16 57.36 1ykm n GLU 345 Cb 0.50 -1.58 0.48 0.00 -1.01 0.00 0.00 31.44 29.83 1ykm n GLU 345 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1ykm n THR 346 N -2.97 0.00 -3.90 2.62 -2.24 -0.45 -3.40 114.28 103.94 1ykm n THR 346 Ca -0.33 -0.02 -0.21 0.00 -2.27 0.00 0.00 64.05 61.22 1ykm n THR 346 Cb 1.09 -0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 69.18 1ykm n THR 346 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1ykm s THR 347 N -2.86 3.89 0.08 4.28 -4.23 -1.17 -4.67 115.64 110.97 1ykm s THR 347 Ca 0.17 -1.36 -0.27 0.00 -1.18 0.00 0.00 61.69 59.06 1ykm s THR 347 Cb 0.19 -3.28 0.08 0.00 1.34 0.00 0.00 72.50 70.83 1ykm s THR 347 CO 0.58 -0.23 0.92 -0.83 -0.54 0.00 0.00 174.62 174.52 1ykm s GLY 348 N -3.95 -0.34 0.51 3.99 0.00 -1.22 -2.76 107.32 103.53 1ykm s GLY 348 Ca 0.38 0.52 -0.21 0.00 0.00 0.00 0.00 44.72 45.41 1ykm s GLY 348 CO 0.26 0.15 1.15 2.56 0.00 0.00 0.00 173.10 177.22 1ykm s PRO 349 N -3.22 3.53 -0.17 2.90 0.04 -1.26 -4.85 135.00 131.97 1ykm s PRO 349 Ca 0.09 1.69 0.01 0.00 0.04 0.00 0.00 61.00 62.83 1ykm s PRO 349 Cb -0.01 -2.18 0.01 0.00 0.04 0.00 0.00 34.50 32.36 1ykm s PRO 349 CO -0.03 -0.72 -0.19 1.21 0.04 0.00 0.00 177.00 177.31 1ykm s ASN 350 N -1.58 3.25 -0.35 6.66 3.84 -1.26 -4.90 114.94 120.60 1ykm s ASN 350 Ca 0.69 -0.61 0.07 0.00 0.21 0.00 0.00 52.86 53.22 1ykm s ASN 350 Cb -0.26 -1.50 0.69 0.00 -0.55 0.00 0.00 41.25 39.63 1ykm s ASN 350 CO 0.30 0.02 1.80 0.49 -2.79 0.00 0.00 177.10 176.92 1ykm n PHE 351 N 4.47 2.55 0.12 0.43 3.01 -1.26 -4.60 117.46 122.17 1ykm n PHE 351 Ca -0.20 -1.35 0.04 0.00 1.01 0.00 0.00 57.45 56.95 1ykm n PHE 351 Cb 0.51 -0.75 0.46 0.00 -0.01 0.00 0.00 39.48 39.69 1ykm n PHE 351 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1ykm h SER 352 N 2.06 0.24 -0.56 4.37 0.02 -1.96 -2.70 113.55 115.02 1ykm h SER 352 Ca 0.37 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 1ykm h SER 352 Cb 2.44 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 64.92 1ykm h SER 352 CO 0.82 0.27 0.00 1.41 -1.14 0.00 0.00 176.83 178.20 1ykm n HIS 353 N -4.40 1.09 -2.67 3.45 8.25 -1.26 -4.92 115.22 114.75 1ykm n HIS 353 Ca -0.00 -0.46 -0.41 0.00 -0.26 0.00 0.00 57.72 56.59 1ykm n HIS 353 Cb 0.16 -0.14 -0.04 0.00 1.12 0.00 0.00 29.99 31.09 1ykm n HIS 353 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1ykm s LEU 354 N -1.39 4.50 -1.12 2.41 2.96 -1.02 -4.96 118.68 120.06 1ykm s LEU 354 Ca 0.41 1.88 -0.21 0.00 -0.22 0.00 0.00 54.13 55.99 1ykm s LEU 354 Cb 0.25 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.41 1ykm s LEU 354 CO 0.23 -0.10 1.54 -0.83 -1.32 0.00 0.00 176.35 175.87 1ykm s GLY 355 N -0.06 1.42 0.22 7.98 0.00 -1.26 -4.99 107.32 110.62 1ykm s GLY 355 Ca 0.47 -2.51 -0.30 0.00 0.00 0.00 0.00 44.72 42.38 1ykm s GLY 355 CO 0.31 2.68 1.16 -1.36 0.00 0.00 0.00 173.10 175.89 1ykm s PHE 356 N 4.62 3.47 0.73 1.90 0.08 -1.26 -5.04 117.98 122.49 1ykm s PHE 356 Ca 0.48 1.52 -0.11 0.00 0.12 0.00 0.00 56.93 58.95 1ykm s PHE 356 Cb 0.01 -3.38 0.03 0.00 -0.57 0.00 0.00 43.02 39.11 1ykm s PHE 356 CO -0.04 -0.97 1.08 0.20 -0.10 0.00 0.00 175.22 175.39 1ykm s GLY 357 N -0.21 1.64 0.55 4.36 0.00 -1.26 -4.96 107.32 107.44 1ykm s GLY 357 Ca 0.50 -0.11 0.31 0.00 0.00 0.00 0.00 44.72 45.42 1ykm s GLY 357 CO 0.38 0.26 2.11 0.00 0.00 0.00 0.00 173.10 175.85 1ykm h ALA 358 N -0.83 1.22 -0.06 3.20 0.00 -2.03 -3.07 119.26 117.68 1ykm h ALA 358 Ca -0.45 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1ykm h ALA 358 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1ykm h ALA 358 CO 0.59 0.10 0.00 0.72 0.00 0.00 0.00 179.25 180.66 1ykm n HIS 359 N -3.50 0.15 0.30 0.00 8.25 -1.26 -4.79 115.22 114.37 1ykm n HIS 359 Ca -0.02 -0.75 0.18 0.00 -0.26 0.00 0.00 57.72 56.87 1ykm n HIS 359 Cb 0.21 -0.12 0.97 0.00 1.12 0.00 0.00 29.99 32.18 1ykm n HIS 359 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 1ykm h ASP 360 N 0.40 0.00 -0.01 0.41 5.19 -1.84 -0.48 116.42 120.10 1ykm h ASP 360 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1ykm h ASP 360 Cb 0.84 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.35 1ykm h ASP 360 CO 0.03 0.00 -0.32 0.00 -3.12 0.00 0.00 179.24 175.82 1ykm n HIS 361 N -2.84 0.00 -3.61 4.55 1.44 -1.22 -1.03 115.22 112.52 1ykm n HIS 361 Ca -0.02 0.00 -0.40 0.00 -2.01 0.00 0.00 57.72 55.29 1ykm n HIS 361 Cb 0.16 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.19 1ykm n HIS 361 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1ykm s ASP 362 N -1.66 5.65 0.00 4.39 3.68 -0.19 -2.17 116.67 126.38 1ykm s ASP 362 Ca 0.08 -2.50 0.18 0.00 2.13 0.00 0.00 52.55 52.44 1ykm s ASP 362 Cb 0.09 -1.96 0.80 0.00 -1.45 0.00 0.00 42.92 40.40 1ykm s ASP 362 CO 0.34 -0.51 1.57 0.18 0.13 0.00 0.00 175.17 176.88 1ykm n LEU 363 N 4.05 0.00 0.09 -1.34 4.32 0.23 -0.84 117.00 123.51 1ykm n LEU 363 Ca 0.04 0.45 0.12 0.00 -0.02 0.00 0.00 56.01 56.61 1ykm n LEU 363 Cb 0.41 -0.45 0.27 0.00 -1.62 0.00 0.00 43.42 42.02 1ykm n LEU 363 CO 0.36 -0.17 0.58 -0.07 -1.22 0.00 0.00 177.39 176.87 1ykm h LEU 364 N 0.00 0.00 0.00 2.23 4.07 -1.92 -3.39 115.31 116.31 1ykm h LEU 364 Ca 0.00 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.85 1ykm h LEU 364 Cb 0.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.02 1ykm h LEU 364 CO 0.00 0.06 -0.25 0.18 -1.08 0.00 0.00 178.44 177.35 1ykm n LEU 365 N -2.22 0.00 0.00 1.67 4.77 -0.82 -4.60 117.00 115.80 1ykm n LEU 365 Ca 0.04 -0.14 0.10 0.00 -0.03 0.00 0.00 56.01 55.98 1ykm n LEU 365 Cb 0.44 0.00 0.62 0.00 -2.33 0.00 0.00 43.42 42.15 1ykm n LEU 365 CO 0.34 0.00 0.87 -0.46 -1.33 0.00 0.00 177.39 176.81 1ykm n ASN 366 N -0.65 0.00 -0.02 -1.43 0.23 -0.02 -3.66 115.26 109.71 1ykm n ASN 366 Ca 0.00 -1.15 -0.03 0.00 -0.53 0.00 0.00 54.58 52.87 1ykm n ASN 366 Cb 0.00 0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 37.68 1ykm n ASN 366 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 1ykm n PHE 367 N -0.86 0.00 0.00 -2.53 7.35 -1.26 -4.99 117.46 115.16 1ykm n PHE 367 Ca 0.16 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.85 1ykm n PHE 367 Cb 0.07 -0.16 0.00 0.00 0.35 0.00 0.00 39.48 39.74 1ykm n PHE 367 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1ykm n ASN 368 N -2.57 0.00 0.00 -2.13 4.05 -1.24 -4.97 115.26 108.41 1ykm n ASN 368 Ca -0.07 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.96 1ykm n ASN 368 Cb 0.58 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.59 1ykm n ASN 368 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1ykm n ASN 369 N 1.15 0.74 0.00 1.20 3.02 -1.26 -4.97 115.26 115.14 1ykm n ASN 369 Ca 0.00 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1ykm n ASN 369 Cb 0.00 0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 1ykm n ASN 369 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ykm n GLY 370 N 0.03 0.29 0.00 7.41 0.00 -1.26 -5.07 105.19 106.59 1ykm n GLY 370 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1ykm n GLY 370 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ykm n GLY 371 N 0.00 3.35 3.89 -0.02 0.00 -1.26 -5.17 105.19 105.97 1ykm n GLY 371 Ca 0.00 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 1ykm n GLY 371 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ykm s LEU 372 N 0.00 4.33 0.50 0.99 1.02 -1.26 -4.81 118.68 119.46 1ykm s LEU 372 Ca 0.00 0.60 -0.21 0.00 0.02 0.00 0.00 54.13 54.54 1ykm s LEU 372 Cb 0.00 -2.96 -0.07 0.00 0.02 0.00 0.00 46.19 43.18 1ykm s LEU 372 CO 0.00 0.17 1.13 -2.84 0.02 0.00 0.00 176.35 174.83 1ykm s PRO 373 N -2.12 3.56 -0.15 1.29 0.02 -1.26 -4.89 135.00 131.44 1ykm s PRO 373 Ca 0.33 1.65 -0.23 0.00 0.02 0.00 0.00 61.00 62.78 1ykm s PRO 373 Cb -0.13 -2.17 -0.03 0.00 0.02 0.00 0.00 34.50 32.19 1ykm s PRO 373 CO 0.20 -0.69 0.69 0.42 -0.33 0.00 0.00 177.00 177.29 1ykm s ILE 374 N -1.70 5.00 0.00 2.83 1.01 -1.26 -4.96 121.20 122.12 1ykm s ILE 374 Ca 0.69 1.36 0.00 0.00 0.00 0.00 0.00 60.65 62.70 1ykm s ILE 374 Cb -0.25 -4.01 0.00 0.00 0.01 0.00 0.00 42.46 38.21 1ykm s ILE 374 CO 0.29 0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.98 1ykm n GLY 375 N 3.49 2.39 3.63 6.18 0.00 -1.26 -4.42 105.19 115.19 1ykm n GLY 375 Ca -0.00 -1.45 -0.43 0.00 0.00 0.00 0.00 46.02 44.14 1ykm n GLY 375 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ykm s GLU 376 N -1.95 3.82 -0.18 1.61 2.02 -1.26 -4.90 118.70 117.87 1ykm s GLU 376 Ca 0.00 1.43 -0.29 0.00 0.02 0.00 0.00 54.97 56.12 1ykm s GLU 376 Cb 0.00 -3.97 -0.03 0.00 0.10 0.00 0.00 34.13 30.23 1ykm s GLU 376 CO 0.00 -1.26 1.60 1.03 0.02 0.00 0.00 175.26 176.65 1ykm s ARG 377 N 4.51 3.92 0.12 1.61 0.52 -1.26 -1.22 118.95 127.14 1ykm s ARG 377 Ca 0.64 1.78 0.03 0.00 -0.52 0.00 0.00 55.73 57.67 1ykm s ARG 377 Cb -0.20 -4.00 -0.04 0.00 0.52 0.00 0.00 34.95 31.22 1ykm s ARG 377 CO 0.27 -1.14 -0.08 0.96 0.02 0.00 0.00 175.30 175.32 1ykm s ILE 378 N 4.80 0.91 -0.12 1.52 -4.36 -0.23 -1.87 121.20 121.86 1ykm s ILE 378 Ca 0.70 -1.97 0.02 0.00 -0.26 0.00 0.00 60.65 59.15 1ykm s ILE 378 Cb -0.27 -1.73 -0.01 0.00 1.25 0.00 0.00 42.46 41.71 1ykm s ILE 378 CO 0.28 -0.80 -0.18 -0.63 0.24 0.00 0.00 174.94 173.85 1ykm s ILE 379 N -3.40 2.57 -0.36 8.37 1.01 -0.34 -1.37 121.20 127.68 1ykm s ILE 379 Ca 0.13 -0.83 -0.04 0.00 0.00 0.00 0.00 60.65 59.91 1ykm s ILE 379 Cb 0.03 -2.04 0.07 0.00 0.01 0.00 0.00 42.46 40.53 1ykm s ILE 379 CO -0.02 0.54 0.12 -0.69 0.00 0.00 0.00 174.94 174.89 1ykm s VAL 380 N 0.35 3.46 0.20 2.92 1.01 -0.17 0.01 120.40 128.19 1ykm s VAL 380 Ca -0.15 -1.50 0.08 0.00 0.00 0.00 0.00 61.98 60.41 1ykm s VAL 380 Cb -0.17 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.06 1ykm s VAL 380 CO 0.07 -0.34 -0.15 0.00 0.00 0.00 0.00 175.10 174.68 1ykm s ALA 381 N 1.29 2.02 0.00 5.51 0.00 -0.62 -0.43 121.76 129.53 1ykm s ALA 381 Ca 0.01 -1.64 0.00 0.00 0.00 0.00 0.00 51.96 50.32 1ykm s ALA 381 Cb -0.21 -0.10 0.00 0.00 0.00 0.00 0.00 23.12 22.81 1ykm s ALA 381 CO -0.00 0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.25 1ykm n GLY 382 N -0.31 -1.26 3.06 0.00 0.00 -1.08 -1.41 105.19 104.18 1ykm n GLY 382 Ca -0.08 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.86 1ykm n GLY 382 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ykm s ARG 383 N -0.34 1.11 -0.37 1.61 3.52 -1.25 -1.92 118.95 121.31 1ykm s ARG 383 Ca 0.00 -0.41 -0.13 0.00 -0.13 0.00 0.00 55.73 55.05 1ykm s ARG 383 Cb 0.00 -1.04 0.00 0.00 -1.56 0.00 0.00 34.95 32.36 1ykm s ARG 383 CO 0.00 0.20 0.26 0.08 -0.81 0.00 0.00 175.30 175.03 1ykm s VAL 384 N -0.04 5.14 0.40 7.11 1.01 0.39 -1.27 120.40 133.13 1ykm s VAL 384 Ca 0.00 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.53 1ykm s VAL 384 Cb -0.07 -3.76 -0.06 0.00 0.00 0.00 0.00 36.38 32.49 1ykm s VAL 384 CO 0.00 -0.16 0.04 0.68 0.00 0.00 0.00 175.10 175.66 1ykm s VAL 385 N 1.68 1.45 0.34 2.92 -7.23 -0.08 -1.46 120.40 118.01 1ykm s VAL 385 Ca 0.05 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.26 1ykm s VAL 385 Cb -0.18 -2.71 0.04 0.00 0.56 0.00 0.00 36.38 34.09 1ykm s VAL 385 CO 0.10 0.00 0.32 -0.90 -0.31 0.00 0.00 175.10 174.31 1ykm n ASP 386 N -0.98 1.83 0.19 4.85 3.85 -0.44 -0.63 116.55 125.22 1ykm n ASP 386 Ca -0.07 -2.09 0.14 0.00 -0.71 0.00 0.00 54.79 52.06 1ykm n ASP 386 Cb 0.67 -0.10 0.66 0.00 -1.35 0.00 0.00 41.12 41.00 1ykm n ASP 386 CO 0.00 0.00 0.00 1.56 -1.01 0.00 0.00 177.20 177.75 1ykm h GLN 387 N 0.00 0.00 -0.01 0.11 4.20 -1.48 -2.02 115.11 115.90 1ykm h GLN 387 Ca -0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.51 1ykm h GLN 387 Cb 0.77 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.55 1ykm h GLN 387 CO 0.30 0.00 -0.41 0.66 -0.67 0.00 0.00 178.83 178.71 1ykm n TYR 388 N -2.48 0.00 -0.46 2.96 4.02 -1.26 -4.94 117.16 115.00 1ykm n TYR 388 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1ykm n TYR 388 Cb 0.15 -0.09 0.00 0.00 -0.02 0.00 0.00 39.34 39.37 1ykm n TYR 388 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ykm n GLY 389 N 1.40 0.75 3.71 2.72 0.00 -0.76 -5.05 105.19 107.95 1ykm n GLY 389 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1ykm n GLY 389 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ykm s LYS 390 N -0.54 4.50 0.51 1.61 2.20 -1.26 -4.76 119.74 122.01 1ykm s LYS 390 Ca 0.00 1.58 -0.22 0.00 -0.36 0.00 0.00 55.97 56.98 1ykm s LYS 390 Cb 0.00 -3.40 -0.06 0.00 -1.51 0.00 0.00 37.83 32.86 1ykm s LYS 390 CO 0.00 -0.14 1.24 -2.14 -0.36 0.00 0.00 175.35 173.95 1ykm s PRO 391 N 1.00 3.40 -0.60 4.03 0.02 -1.26 -1.33 135.00 140.25 1ykm s PRO 391 Ca 0.55 1.93 -0.08 0.00 0.02 0.00 0.00 61.00 63.42 1ykm s PRO 391 Cb -0.25 -2.26 0.16 0.00 0.02 0.00 0.00 34.50 32.17 1ykm s PRO 391 CO 0.29 -0.89 0.47 0.08 -0.33 0.00 0.00 177.00 176.61 1ykm s VAL 392 N -1.48 4.35 0.56 3.83 1.01 -0.53 -4.86 120.40 123.28 1ykm s VAL 392 Ca 0.69 -2.33 -0.13 0.00 0.00 0.00 0.00 61.98 60.21 1ykm s VAL 392 Cb -0.33 -3.81 -0.06 0.00 0.00 0.00 0.00 36.38 32.19 1ykm s VAL 392 CO 0.38 -0.87 0.99 -2.16 0.00 0.00 0.00 175.10 173.45 1ykm s PRO 393 N 0.63 3.75 -1.49 2.72 0.04 -1.26 -4.37 135.00 135.01 1ykm s PRO 393 Ca 0.12 0.80 -0.05 0.00 0.04 0.00 0.00 61.00 61.90 1ykm s PRO 393 Cb -0.21 -2.13 0.04 0.00 0.04 0.00 0.00 34.50 32.24 1ykm s PRO 393 CO -0.04 -0.40 0.52 0.09 0.04 0.00 0.00 177.00 177.22 1ykm n ASN 394 N -2.15 -1.20 -4.59 6.66 4.13 -1.02 -4.97 115.26 112.11 1ykm n ASN 394 Ca 0.06 -1.01 -0.30 0.00 1.68 0.00 0.00 54.58 55.01 1ykm n ASN 394 Cb 0.54 -2.96 -0.10 0.00 -1.54 0.00 0.00 39.78 35.72 1ykm n ASN 394 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1ykm s THR 395 N -3.78 3.44 -0.09 3.41 -1.32 -1.26 -4.57 115.64 111.47 1ykm s THR 395 Ca 0.22 -1.24 -0.27 0.00 -1.21 0.00 0.00 61.69 59.18 1ykm s THR 395 Cb -0.12 -2.62 -0.02 0.00 -1.51 0.00 0.00 72.50 68.23 1ykm s THR 395 CO 0.90 0.11 0.89 -0.22 -2.21 0.00 0.00 174.62 174.09 1ykm s LEU 396 N -2.23 4.27 -0.19 9.08 2.96 -1.26 -1.50 118.68 129.81 1ykm s LEU 396 Ca 0.22 1.40 0.01 0.00 -0.22 0.00 0.00 54.13 55.54 1ykm s LEU 396 Cb -0.11 -3.38 0.03 0.00 0.50 0.00 0.00 46.19 43.23 1ykm s LEU 396 CO 0.14 -0.33 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.00 1ykm s VAL 397 N 1.59 1.88 0.06 1.68 1.01 -1.26 -1.55 120.40 123.82 1ykm s VAL 397 Ca 0.44 -0.98 0.08 0.00 0.00 0.00 0.00 61.98 61.53 1ykm s VAL 397 Cb -0.18 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.36 1ykm s VAL 397 CO 0.19 0.37 -0.21 -1.61 0.00 0.00 0.00 175.10 173.83 1ykm s GLU 398 N 1.33 1.87 -0.04 2.72 2.02 0.98 -4.34 118.70 123.24 1ykm s GLU 398 Ca 0.02 -1.09 -0.09 0.00 0.02 0.00 0.00 54.97 53.82 1ykm s GLU 398 Cb -0.15 -2.08 0.02 0.00 0.10 0.00 0.00 34.13 32.02 1ykm s GLU 398 CO -0.10 0.51 0.22 0.00 0.02 0.00 0.00 175.26 175.91 1ykm s MET 399 N -1.56 0.42 0.02 1.61 0.23 0.02 -0.53 119.30 119.50 1ykm s MET 399 Ca 0.14 -0.01 -0.03 0.00 -1.03 0.00 0.00 55.69 54.76 1ykm s MET 399 Cb -0.10 0.19 -0.01 0.00 -1.53 0.00 0.00 34.83 33.37 1ykm s MET 399 CO 0.05 -0.09 0.05 1.67 -2.03 0.00 0.00 175.02 174.67 1ykm s TRP 400 N -0.65 0.18 0.39 3.16 -2.14 -1.05 -0.53 118.94 118.30 1ykm s TRP 400 Ca -0.07 -0.40 -0.15 0.00 2.66 0.00 0.00 56.10 58.13 1ykm s TRP 400 Cb -0.04 -0.14 0.06 0.00 -3.10 0.00 0.00 33.47 30.25 1ykm s TRP 400 CO 0.01 -0.25 0.80 1.14 -2.66 0.00 0.00 176.95 175.99 1ykm s GLN 401 N -1.66 2.24 0.57 3.25 -2.07 -0.63 -1.13 119.66 120.24 1ykm s GLN 401 Ca -0.13 -1.46 0.02 0.00 -1.82 0.00 0.00 55.36 51.97 1ykm s GLN 401 Cb -0.07 0.62 0.05 0.00 -1.09 0.00 0.00 33.01 32.52 1ykm s GLN 401 CO -0.01 -1.05 0.79 0.00 -1.32 0.00 0.00 175.29 173.70 1ykm s ALA 402 N -2.17 3.97 0.75 2.60 0.00 -1.26 -4.63 121.76 121.02 1ykm s ALA 402 Ca 0.16 -1.47 0.00 0.00 0.00 0.00 0.00 51.96 50.65 1ykm s ALA 402 Cb -0.05 -1.99 0.00 0.00 0.00 0.00 0.00 23.12 21.08 1ykm s ALA 402 CO 0.12 -0.82 0.00 0.27 0.00 0.00 0.00 175.76 175.32 1ykm n ASN 403 N -2.37 0.00 0.29 0.00 0.23 -0.42 -4.45 115.26 108.54 1ykm n ASN 403 Ca 0.10 -0.57 0.15 0.00 -0.53 0.00 0.00 54.58 53.73 1ykm n ASN 403 Cb 0.60 0.00 0.87 0.00 -2.08 0.00 0.00 39.78 39.17 1ykm n ASN 403 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ykm h ALA 404 N -1.53 1.32 -0.02 -2.53 0.00 -1.77 -0.99 119.26 113.74 1ykm h ALA 404 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ykm h ALA 404 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ykm h ALA 404 CO 0.00 0.06 -0.12 0.41 0.00 0.00 0.00 179.25 179.60 1ykm n GLY 405 N -0.96 0.62 1.03 0.00 0.00 -1.26 -3.43 105.19 101.20 1ykm n GLY 405 Ca -0.02 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.35 1ykm n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ykm n GLY 406 N 1.35 0.72 3.72 -0.02 0.00 -1.02 -4.78 105.19 105.15 1ykm n GLY 406 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1ykm n GLY 406 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1ykm s ARG 407 N -0.63 4.44 0.05 1.61 6.06 -1.26 -4.71 118.95 124.51 1ykm s ARG 407 Ca 0.00 0.89 0.01 0.00 -2.50 0.00 0.00 55.73 54.13 1ykm s ARG 407 Cb 0.00 -3.45 -0.04 0.00 0.06 0.00 0.00 34.95 31.52 1ykm s ARG 407 CO 0.00 0.06 0.14 -1.21 -2.50 0.00 0.00 175.30 171.79 1ykm s GLU 408 N 0.80 3.17 -1.21 5.12 2.02 -1.26 -1.30 118.70 126.04 1ykm s GLU 408 Ca 0.38 -0.53 -0.16 0.00 0.02 0.00 0.00 54.97 54.68 1ykm s GLU 408 Cb -0.18 -2.90 0.13 0.00 0.10 0.00 0.00 34.13 31.29 1ykm s GLU 408 CO 0.18 0.60 1.50 0.50 0.02 0.00 0.00 175.26 178.07 1ykm s ARG 409 N -2.30 4.01 -0.01 1.61 3.52 -1.26 -4.83 118.95 119.69 1ykm s ARG 409 Ca 0.30 -2.30 -0.19 0.00 -0.13 0.00 0.00 55.73 53.41 1ykm s ARG 409 Cb -0.13 -5.20 0.03 0.00 -1.56 0.00 0.00 34.95 28.09 1ykm s ARG 409 CO 0.23 -1.93 0.40 -1.58 -0.81 0.00 0.00 175.30 171.61 1ykm s HIS 410 N 2.56 -0.29 0.32 5.12 2.46 -1.26 -5.08 115.29 119.12 1ykm s HIS 410 Ca 0.45 0.44 0.04 0.00 0.47 0.00 0.00 55.06 56.46 1ykm s HIS 410 Cb -0.01 0.18 0.56 0.00 -0.13 0.00 0.00 32.58 33.18 1ykm s HIS 410 CO 0.01 -0.46 1.83 0.87 -2.47 0.00 0.00 174.74 174.52 1ykm h LYS 411 N 3.56 0.49 -0.00 2.88 6.56 -2.08 -3.06 116.57 124.92 1ykm h LYS 411 Ca -0.29 -0.13 0.00 0.00 -1.06 0.00 0.00 60.65 59.17 1ykm h LYS 411 Cb 1.17 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 32.77 1ykm h LYS 411 CO 0.40 0.58 -0.01 0.09 -2.06 0.00 0.00 179.45 178.46 1ykm n ASN 412 N -4.23 0.04 -4.40 0.86 5.03 -1.26 -4.65 115.26 106.65 1ykm n ASN 412 Ca 0.01 -0.33 -0.44 0.00 0.87 0.00 0.00 54.58 54.69 1ykm n ASN 412 Cb 0.29 -0.22 -0.04 0.00 -1.02 0.00 0.00 39.78 38.80 1ykm n ASN 412 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1ykm s ASP 413 N -2.46 6.25 -0.36 6.41 2.15 -1.16 -4.90 116.67 122.60 1ykm s ASP 413 Ca 0.32 -1.42 0.08 0.00 0.43 0.00 0.00 52.55 51.96 1ykm s ASP 413 Cb 0.21 -2.34 0.71 0.00 -0.30 0.00 0.00 42.92 41.20 1ykm s ASP 413 CO 0.45 -1.18 1.82 0.54 -0.17 0.00 0.00 175.17 176.63 1ykm n ARG 414 N 6.64 3.17 -2.13 4.34 5.12 -1.26 -4.89 116.66 127.64 1ykm n ARG 414 Ca -0.04 -3.07 -0.41 0.00 -1.93 0.00 0.00 57.85 52.40 1ykm n ARG 414 Cb 0.44 -2.18 -0.03 0.00 -1.16 0.00 0.00 32.46 29.53 1ykm n ARG 414 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 1ykm s TYR 415 N -3.10 3.15 -1.13 -1.55 5.04 -1.26 -4.91 117.35 113.59 1ykm s TYR 415 Ca 0.55 1.15 0.04 0.00 -2.44 0.00 0.00 57.07 56.38 1ykm s TYR 415 Cb 0.45 -3.69 0.19 0.00 0.35 0.00 0.00 41.96 39.25 1ykm s TYR 415 CO 0.12 -2.20 1.09 1.47 -1.34 0.00 0.00 175.55 174.69 1ykm n LEU 416 N 2.39 0.00 -4.72 6.97 -0.00 -1.26 -4.72 117.00 115.65 1ykm n LEU 416 Ca 0.06 0.44 -0.42 0.00 -0.00 0.00 0.00 56.01 56.09 1ykm n LEU 416 Cb 0.42 -0.44 -0.03 0.00 -0.00 0.00 0.00 43.42 43.37 1ykm n LEU 416 CO 0.59 -0.37 0.89 0.00 -0.00 0.00 0.00 177.39 178.49 1ykm s ALA 417 N -2.87 3.42 0.85 1.47 0.00 -1.26 -5.00 121.76 118.37 1ykm s ALA 417 Ca 0.03 0.90 -0.10 0.00 0.00 0.00 0.00 51.96 52.79 1ykm s ALA 417 Cb 0.03 -3.43 0.10 0.00 0.00 0.00 0.00 23.12 19.82 1ykm s ALA 417 CO 0.07 -0.40 1.11 -1.25 0.00 0.00 0.00 175.76 175.29 1ykm s PRO 418 N 0.44 1.62 0.35 0.00 0.04 -1.26 -4.74 135.00 131.44 1ykm s PRO 418 Ca 0.56 1.30 -0.18 0.00 0.04 0.00 0.00 61.00 62.72 1ykm s PRO 418 Cb -0.31 -1.81 -0.10 0.00 0.04 0.00 0.00 34.50 32.32 1ykm s PRO 418 CO 0.33 -2.13 0.81 -0.51 0.04 0.00 0.00 177.00 175.53 1ykm s LEU 419 N -6.25 4.06 -0.37 -3.56 1.43 -1.26 -4.75 118.68 107.98 1ykm s LEU 419 Ca 0.64 1.44 -0.15 0.00 -1.03 0.00 0.00 54.13 55.02 1ykm s LEU 419 Cb -0.20 -4.17 0.00 0.00 0.03 0.00 0.00 46.19 41.85 1ykm s LEU 419 CO 0.57 -0.23 0.35 -0.62 0.23 0.00 0.00 176.35 176.66 1ykm s ASP 420 N -2.17 6.15 0.33 2.29 -1.08 -1.26 -4.96 116.67 115.98 1ykm s ASP 420 Ca 0.55 -0.49 0.21 0.00 -0.52 0.00 0.00 52.55 52.30 1ykm s ASP 420 Cb -0.11 -2.19 1.14 0.00 -1.46 0.00 0.00 42.92 40.30 1ykm s ASP 420 CO 0.17 -0.41 1.63 -0.81 0.52 0.00 0.00 175.17 176.26 1ykm n PRO 421 N 5.36 0.14 -0.29 4.34 -0.04 -1.26 -1.25 135.00 142.00 1ykm n PRO 421 Ca -0.09 0.63 0.08 0.00 -0.04 0.00 0.00 63.50 64.08 1ykm n PRO 421 Cb 0.48 -1.99 0.23 0.00 -0.04 0.00 0.00 33.50 32.18 1ykm n PRO 421 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ykm n ASN 422 N -2.25 3.46 -3.97 3.54 5.03 -1.26 -4.52 115.26 115.28 1ykm n ASN 422 Ca -0.01 -2.10 -0.21 0.00 0.87 0.00 0.00 54.58 53.12 1ykm n ASN 422 Cb 0.07 -0.36 -0.16 0.00 -1.02 0.00 0.00 39.78 38.32 1ykm n ASN 422 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1ykm s PHE 423 N -1.19 0.98 -0.18 3.10 2.19 -0.38 -4.35 117.98 118.15 1ykm s PHE 423 Ca 0.34 -0.28 -0.11 0.00 0.33 0.00 0.00 56.93 57.21 1ykm s PHE 423 Cb 0.19 -0.74 -0.08 0.00 -1.31 0.00 0.00 43.02 41.09 1ykm s PHE 423 CO 0.21 -0.16 -0.26 0.41 1.83 0.00 0.00 175.22 177.26 1ykm n GLY 424 N 3.59 -0.35 0.16 13.12 0.00 -1.26 -4.69 105.19 115.76 1ykm n GLY 424 Ca -0.21 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1ykm n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ykm n GLY 425 N 1.79 1.76 3.08 -0.02 0.00 -1.26 -4.51 105.19 106.03 1ykm n GLY 425 Ca -0.32 -0.07 -0.22 0.00 0.00 0.00 0.00 46.02 45.41 1ykm n GLY 425 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ykm s VAL 426 N -2.00 1.06 0.05 1.61 1.01 -1.26 -1.60 120.40 119.26 1ykm s VAL 426 Ca 0.00 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.25 1ykm s VAL 426 Cb 0.00 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.52 1ykm s VAL 426 CO 0.00 0.30 0.40 -0.83 0.00 0.00 0.00 175.10 174.97 1ykm s GLY 427 N -0.18 -0.25 0.27 4.51 0.00 0.31 -4.76 107.32 107.22 1ykm s GLY 427 Ca 0.03 0.23 -0.08 0.00 0.00 0.00 0.00 44.72 44.89 1ykm s GLY 427 CO -0.00 -0.02 0.44 1.09 0.00 0.00 0.00 173.10 174.61 1ykm s ARG 428 N -2.62 1.62 -0.03 2.90 1.70 -0.19 -0.80 118.95 121.53 1ykm s ARG 428 Ca -0.04 -1.45 0.00 0.00 -0.47 0.00 0.00 55.73 53.77 1ykm s ARG 428 Cb -0.01 0.44 0.03 0.00 -0.57 0.00 0.00 34.95 34.84 1ykm s ARG 428 CO -0.03 -0.66 0.01 -1.17 -1.08 0.00 0.00 175.30 172.37 1ykm s LEU 430 N -3.10 1.13 0.59 -1.89 2.96 -1.26 -3.41 118.68 113.70 1ykm s LEU 430 Ca 0.27 0.00 -0.18 0.00 -0.22 0.00 0.00 54.13 54.00 1ykm s LEU 430 Cb 0.00 -0.16 -0.04 0.00 0.50 0.00 0.00 46.19 46.50 1ykm s LEU 430 CO 0.13 -0.11 1.17 0.42 -1.32 0.00 0.00 176.35 176.63 1ykm s THR 431 N 1.04 2.87 0.00 3.68 -4.23 -0.56 -4.88 115.64 113.56 1ykm s THR 431 Ca -0.10 0.52 0.00 0.00 -1.18 0.00 0.00 61.69 60.94 1ykm s THR 431 Cb -0.13 -3.18 0.00 0.00 1.34 0.00 0.00 72.50 70.53 1ykm s THR 431 CO -0.02 -0.14 0.00 -0.90 -0.54 0.00 0.00 174.62 173.02 1ykm n ASP 432 N -1.63 0.00 -0.05 3.99 5.68 -0.85 -2.43 116.55 121.26 1ykm n ASP 432 Ca 0.13 -0.97 0.13 0.00 -0.50 0.00 0.00 54.79 53.57 1ykm n ASP 432 Cb 0.50 0.00 0.53 0.00 -1.14 0.00 0.00 41.12 41.01 1ykm n ASP 432 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1ykm h SER 433 N 0.00 0.30 -0.63 -1.12 0.02 -1.96 -1.67 113.55 108.50 1ykm h SER 433 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1ykm h SER 433 Cb 0.00 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.48 1ykm h SER 433 CO 0.00 0.18 0.00 0.47 -1.14 0.00 0.00 176.83 176.34 1ykm n ASP 434 N -4.46 3.43 -0.01 3.07 8.00 -1.26 -4.56 116.55 120.75 1ykm n ASP 434 Ca 0.09 -2.02 -0.00 0.00 0.71 0.00 0.00 54.79 53.57 1ykm n ASP 434 Cb 0.38 -0.43 -0.00 0.00 -0.02 0.00 0.00 41.12 41.05 1ykm n ASP 434 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ykm n GLY 435 N 1.48 0.46 3.78 0.44 0.00 -0.63 -4.77 105.19 105.96 1ykm n GLY 435 Ca 0.21 -0.40 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1ykm n GLY 435 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ykm s TYR 436 N -1.99 3.81 0.25 1.61 1.51 -1.26 -0.46 117.35 120.81 1ykm s TYR 436 Ca 0.00 1.39 0.06 0.00 -1.01 0.00 0.00 57.07 57.51 1ykm s TYR 436 Cb 0.00 -2.63 -0.05 0.00 -0.11 0.00 0.00 41.96 39.16 1ykm s TYR 436 CO 0.00 0.49 -0.07 1.52 -1.11 0.00 0.00 175.55 176.38 1ykm s TYR 437 N -0.83 1.80 -0.24 2.71 -0.85 -0.81 -2.00 117.35 117.14 1ykm s TYR 437 Ca 0.32 -0.71 -0.23 0.00 -0.52 0.00 0.00 57.07 55.93 1ykm s TYR 437 Cb -0.20 -0.99 0.06 0.00 0.38 0.00 0.00 41.96 41.21 1ykm s TYR 437 CO 0.21 0.23 0.65 -1.54 -1.52 0.00 0.00 175.55 173.58 1ykm s SER 438 N -3.38 -0.67 0.12 -0.18 1.04 -1.26 -2.64 113.70 106.72 1ykm s SER 438 Ca 0.27 1.30 0.04 0.00 0.48 0.00 0.00 55.95 58.04 1ykm s SER 438 Cb 0.03 1.31 -0.04 0.00 0.10 0.00 0.00 66.02 67.43 1ykm s SER 438 CO 0.10 -0.23 -0.11 -0.36 0.98 0.00 0.00 173.24 173.62 1ykm s PHE 439 N 0.32 1.18 -0.12 5.02 0.40 0.43 -4.90 117.98 120.31 1ykm s PHE 439 Ca -0.00 -0.67 -0.01 0.00 -0.60 0.00 0.00 56.93 55.65 1ykm s PHE 439 Cb -0.04 -0.63 0.03 0.00 0.51 0.00 0.00 43.02 42.89 1ykm s PHE 439 CO 0.01 0.05 -0.05 0.50 0.70 0.00 0.00 175.22 176.43 1ykm s ARG 440 N -3.06 1.25 0.04 0.44 3.52 -0.92 -1.00 118.95 119.22 1ykm s ARG 440 Ca 0.09 -0.24 -0.00 0.00 -0.13 0.00 0.00 55.73 55.45 1ykm s ARG 440 Cb -0.02 -1.57 0.00 0.00 -1.56 0.00 0.00 34.95 31.81 1ykm s ARG 440 CO 0.01 -0.33 0.07 -2.37 -0.81 0.00 0.00 175.30 171.86 1ykm n THR 441 N 4.98 0.00 -4.15 4.11 5.66 -0.47 -0.60 114.28 123.81 1ykm n THR 441 Ca -0.11 -0.21 -0.30 0.00 -3.05 0.00 0.00 64.05 60.38 1ykm n THR 441 Cb 0.49 0.14 -0.08 0.00 -1.55 0.00 0.00 70.33 69.33 1ykm n THR 441 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 1ykm s ILE 442 N -2.53 3.86 -0.11 1.09 -4.36 -1.26 -1.07 121.20 116.83 1ykm s ILE 442 Ca 0.03 -1.06 -0.29 0.00 -0.26 0.00 0.00 60.65 59.07 1ykm s ILE 442 Cb -0.00 -2.83 -0.04 0.00 1.25 0.00 0.00 42.46 40.83 1ykm s ILE 442 CO 0.02 0.11 1.57 -0.75 0.24 0.00 0.00 174.94 176.14 1ykm s LYS 443 N -2.29 4.11 0.65 0.37 2.20 -0.36 -4.90 119.74 119.53 1ykm s LYS 443 Ca 0.25 1.98 -0.16 0.00 -0.36 0.00 0.00 55.97 57.68 1ykm s LYS 443 Cb -0.12 -3.95 -0.00 0.00 -1.51 0.00 0.00 37.83 32.25 1ykm s LYS 443 CO 0.17 -0.91 1.14 -1.25 -0.36 0.00 0.00 175.35 174.14 1ykm s PRO 444 N 4.06 2.76 0.24 4.03 0.04 -1.26 -4.36 135.00 140.51 1ykm s PRO 444 Ca 0.69 1.52 0.04 0.00 0.04 0.00 0.00 61.00 63.30 1ykm s PRO 444 Cb -0.29 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.28 1ykm s PRO 444 CO 0.26 -1.31 0.37 0.20 0.04 0.00 0.00 177.00 176.57 1ykm s GLY 445 N -2.30 1.30 0.75 0.56 0.00 -0.40 -4.66 107.32 102.56 1ykm s GLY 445 Ca 0.70 -1.16 -0.11 0.00 0.00 0.00 0.00 44.72 44.15 1ykm s GLY 445 CO 0.40 -1.17 1.09 2.56 0.00 0.00 0.00 173.10 175.97 1ykm s PRO 446 N -3.91 2.46 0.02 2.90 0.04 -1.26 -3.90 135.00 131.35 1ykm s PRO 446 Ca 0.35 1.14 -0.09 0.00 0.04 0.00 0.00 61.00 62.44 1ykm s PRO 446 Cb -0.09 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.53 1ykm s PRO 446 CO 0.30 -1.49 0.18 1.52 0.04 0.00 0.00 177.00 177.55 1ykm s TYR 447 N -2.89 0.04 0.46 0.56 -0.85 -1.18 -4.19 117.35 109.31 1ykm s TYR 447 Ca 0.61 -0.20 -0.04 0.00 -0.52 0.00 0.00 57.07 56.92 1ykm s TYR 447 Cb -0.17 -0.03 -0.03 0.00 0.38 0.00 0.00 41.96 42.10 1ykm s TYR 447 CO 0.54 -0.37 0.74 -1.25 -1.52 0.00 0.00 175.55 173.70 1ykm s PRO 448 N -2.07 3.51 0.05 -3.49 0.04 -1.26 -0.60 135.00 131.18 1ykm s PRO 448 Ca -0.09 0.09 -0.16 0.00 0.04 0.00 0.00 61.00 60.88 1ykm s PRO 448 Cb -0.04 -2.43 0.03 0.00 0.04 0.00 0.00 34.50 32.10 1ykm s PRO 448 CO -0.01 -0.16 0.35 1.67 0.04 0.00 0.00 177.00 178.89 1ykm s TRP 449 N -2.67 -0.17 -1.26 0.56 1.48 -1.14 -4.91 118.94 110.83 1ykm s TRP 449 Ca 0.46 0.06 -0.17 0.00 -1.06 0.00 0.00 56.10 55.39 1ykm s TRP 449 Cb -0.10 0.15 0.09 0.00 -1.16 0.00 0.00 33.47 32.45 1ykm s TRP 449 CO 0.43 -0.54 1.64 1.03 -4.06 0.00 0.00 176.95 175.45 1ykm s ARG 450 N -2.59 3.99 0.00 3.25 0.52 -1.26 -4.43 118.95 118.43 1ykm s ARG 450 Ca -0.05 -2.10 0.00 0.00 -0.52 0.00 0.00 55.73 53.07 1ykm s ARG 450 Cb -0.01 -5.41 0.00 0.00 0.52 0.00 0.00 34.95 30.06 1ykm s ARG 450 CO -0.03 -2.13 0.00 -1.71 0.02 0.00 0.00 175.30 171.45 1ykm n ASN 451 N 7.72 0.00 -4.85 0.23 5.15 -1.26 -5.04 115.26 117.21 1ykm n ASN 451 Ca 0.45 0.00 -0.25 0.00 -0.60 0.00 0.00 54.58 54.18 1ykm n ASN 451 Cb 0.45 0.00 0.08 0.00 -0.53 0.00 0.00 39.78 39.78 1ykm n ASN 451 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1ykm s GLY 452 N -0.96 1.73 0.56 8.20 0.00 -1.26 -4.98 107.32 110.60 1ykm s GLY 452 Ca 0.00 -1.14 0.36 0.00 0.00 0.00 0.00 44.72 43.94 1ykm s GLY 452 CO 0.00 -0.71 2.10 -2.55 0.00 0.00 0.00 173.10 171.93 1ykm h PRO 453 N -0.52 0.00 -0.97 2.90 0.11 -1.98 -3.27 132.00 128.27 1ykm h PRO 453 Ca -0.43 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.33 1ykm h PRO 453 Cb 1.30 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 32.04 1ykm h PRO 453 CO 0.54 0.00 -1.10 -1.71 -0.21 0.00 0.00 178.00 175.53 1ykm n ASN 454 N -2.94 0.96 -4.77 -2.05 5.15 -1.26 -5.10 115.26 105.26 1ykm n ASN 454 Ca -0.01 -2.72 -0.38 0.00 -0.60 0.00 0.00 54.58 50.87 1ykm n ASN 454 Cb 0.18 -0.33 -0.06 0.00 -0.53 0.00 0.00 39.78 39.03 1ykm n ASN 454 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1ykm s ASP 455 N -2.82 6.70 -0.07 1.20 1.01 -1.24 -5.07 116.67 116.38 1ykm s ASP 455 Ca 0.28 0.83 0.01 0.00 0.71 0.00 0.00 52.55 54.38 1ykm s ASP 455 Cb 0.44 -2.25 0.02 0.00 1.01 0.00 0.00 42.92 42.14 1ykm s ASP 455 CO 0.01 0.16 -0.07 0.26 0.21 0.00 0.00 175.17 175.74 1ykm s TRP 456 N -0.15 1.17 0.29 4.23 0.52 -1.26 -2.88 118.94 120.86 1ykm s TRP 456 Ca 0.23 -0.45 -0.29 0.00 0.02 0.00 0.00 56.10 55.62 1ykm s TRP 456 Cb -0.15 -0.96 -0.09 0.00 -1.15 0.00 0.00 33.47 31.11 1ykm s TRP 456 CO 0.11 -0.32 1.07 1.03 0.02 0.00 0.00 176.95 178.86 1ykm s ARG 457 N 1.14 4.61 0.94 4.98 1.81 0.24 -4.75 118.95 127.92 1ykm s ARG 457 Ca -0.07 1.73 -0.12 0.00 -1.72 0.00 0.00 55.73 55.55 1ykm s ARG 457 Cb -0.14 -3.12 0.15 0.00 -0.45 0.00 0.00 34.95 31.40 1ykm s ARG 457 CO -0.01 0.21 1.11 -2.14 -0.68 0.00 0.00 175.30 173.78 1ykm s PRO 458 N -1.55 0.93 0.12 3.54 0.02 -1.26 -3.08 135.00 133.71 1ykm s PRO 458 Ca 0.46 0.47 -0.31 0.00 0.02 0.00 0.00 61.00 61.64 1ykm s PRO 458 Cb -0.30 -1.80 -0.09 0.00 0.02 0.00 0.00 34.50 32.33 1ykm s PRO 458 CO 0.38 -2.38 1.62 0.00 -0.33 0.00 0.00 177.00 176.29 1ykm s ALA 459 N -3.10 3.73 0.13 -1.55 0.00 -1.26 -4.70 121.76 115.02 1ykm s ALA 459 Ca 0.64 1.30 -0.13 0.00 0.00 0.00 0.00 51.96 53.77 1ykm s ALA 459 Cb -0.17 -3.66 0.01 0.00 0.00 0.00 0.00 23.12 19.30 1ykm s ALA 459 CO 0.56 -0.95 0.33 -3.38 0.00 0.00 0.00 175.76 172.31 1ykm s HIS 460 N 1.93 0.04 -0.08 0.00 -3.43 -1.26 -4.05 115.29 108.44 1ykm s HIS 460 Ca 0.72 -0.41 0.01 0.00 -0.80 0.00 0.00 55.06 54.59 1ykm s HIS 460 Cb -0.42 0.12 0.02 0.00 -1.43 0.00 0.00 32.58 30.86 1ykm s HIS 460 CO 0.32 -0.69 -0.10 0.42 -2.00 0.00 0.00 174.74 172.69 1ykm s ILE 461 N -3.86 1.05 0.19 -5.38 1.01 -0.97 -4.52 121.20 108.72 1ykm s ILE 461 Ca 0.07 -0.38 -0.28 0.00 0.00 0.00 0.00 60.65 60.06 1ykm s ILE 461 Cb 0.03 -1.01 -0.08 0.00 0.01 0.00 0.00 42.46 41.41 1ykm s ILE 461 CO -0.08 0.35 0.88 -1.00 0.00 0.00 0.00 174.94 175.10 1ykm s HIS 462 N 1.11 3.93 0.17 3.97 3.76 -0.28 -0.35 115.29 127.59 1ykm s HIS 462 Ca -0.06 1.80 0.11 0.00 -0.15 0.00 0.00 55.06 56.75 1ykm s HIS 462 Cb -0.14 -2.92 -0.04 0.00 1.11 0.00 0.00 32.58 30.59 1ykm s HIS 462 CO -0.01 0.43 -0.25 -0.06 -0.85 0.00 0.00 174.74 174.00 1ykm s PHE 463 N -0.96 2.31 -0.14 1.40 0.40 0.30 -2.53 117.98 118.76 1ykm s PHE 463 Ca 0.40 -0.36 -0.04 0.00 -0.60 0.00 0.00 56.93 56.33 1ykm s PHE 463 Cb -0.24 -1.19 0.06 0.00 0.51 0.00 0.00 43.02 42.16 1ykm s PHE 463 CO 0.30 0.44 0.15 0.20 0.70 0.00 0.00 175.22 177.00 1ykm s GLY 464 N -2.43 0.14 -0.13 4.36 0.00 0.31 -1.32 107.32 108.24 1ykm s GLY 464 Ca 0.18 0.18 0.02 0.00 0.00 0.00 0.00 44.72 45.10 1ykm s GLY 464 CO 0.08 1.80 -0.21 -0.42 0.00 0.00 0.00 173.10 174.36 1ykm s ILE 465 N 2.25 2.23 -0.07 0.90 1.09 0.08 -0.01 121.20 127.66 1ykm s ILE 465 Ca 0.04 -0.93 -0.14 0.00 -1.10 0.00 0.00 60.65 58.52 1ykm s ILE 465 Cb -0.14 -1.89 -0.10 0.00 -1.06 0.00 0.00 42.46 39.27 1ykm s ILE 465 CO -0.08 0.54 0.52 0.77 -0.10 0.00 0.00 174.94 176.59 1ykm h SER 466 N 7.12 -0.19 -4.04 3.58 4.64 -1.57 -1.63 113.55 121.46 1ykm h SER 466 Ca -0.28 -0.20 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1ykm h SER 466 Cb 1.20 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1ykm h SER 466 CO 0.53 0.35 0.00 0.61 -0.87 0.00 0.00 176.83 177.46 1ykm n GLY 467 N 1.01 -2.24 0.24 -0.77 0.00 -1.26 -2.85 105.19 99.32 1ykm n GLY 467 Ca -0.05 -1.52 0.09 0.00 0.00 0.00 0.00 46.02 44.54 1ykm n GLY 467 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ykm h PRO 468 N 0.00 0.00 -4.43 1.61 0.11 -1.93 -3.46 132.00 123.89 1ykm h PRO 468 Ca 0.00 0.00 -0.34 0.00 0.11 0.00 0.00 66.00 65.77 1ykm h PRO 468 Cb 0.00 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.01 1ykm h PRO 468 CO 0.00 0.16 -0.33 -1.54 -0.21 0.00 0.00 178.00 176.08 1ykm s SER 469 N -6.52 1.10 0.24 -2.05 1.04 -1.26 -3.44 113.70 102.80 1ykm s SER 469 Ca -0.03 -1.56 0.25 0.00 0.48 0.00 0.00 55.95 55.09 1ykm s SER 469 Cb 0.14 0.60 0.86 0.00 0.10 0.00 0.00 66.02 67.72 1ykm s SER 469 CO 0.64 -1.17 1.76 2.30 0.98 0.00 0.00 173.24 177.75 1ykm n ILE 470 N -0.55 0.68 0.11 -1.02 -5.35 -1.11 -2.49 119.36 109.63 1ykm n ILE 470 Ca 0.03 -0.14 -0.02 0.00 -0.27 0.00 0.00 62.75 62.36 1ykm n ILE 470 Cb 0.62 -0.77 0.04 0.00 -1.74 0.00 0.00 39.64 37.80 1ykm n ILE 470 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ykm h ALA 471 N 2.42 0.65 0.00 -1.28 0.00 -1.83 -3.21 119.26 116.01 1ykm h ALA 471 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1ykm h ALA 471 Cb 0.63 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1ykm h ALA 471 CO 0.00 0.88 -0.80 0.25 0.00 0.00 0.00 179.25 179.58 1ykm n THR 472 N -3.43 0.09 -1.65 0.00 -2.24 -1.04 -4.94 114.28 101.07 1ykm n THR 472 Ca 0.00 -0.11 -0.47 0.00 -2.27 0.00 0.00 64.05 61.20 1ykm n THR 472 Cb 0.76 0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 69.29 1ykm n THR 472 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1ykm n LYS 473 N -1.72 1.84 -3.78 -0.78 3.00 -1.07 -4.74 118.16 110.92 1ykm n LYS 473 Ca 0.04 0.66 -0.13 0.00 -0.00 0.00 0.00 58.31 58.88 1ykm n LYS 473 Cb 0.38 -2.33 -0.11 0.00 0.00 0.00 0.00 35.03 32.97 1ykm n LYS 473 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1ykm s LEU 474 N 0.48 0.93 -0.11 3.14 2.96 -0.61 -5.03 118.68 120.44 1ykm s LEU 474 Ca 0.74 0.56 0.03 0.00 -0.22 0.00 0.00 54.13 55.25 1ykm s LEU 474 Cb -0.73 0.96 0.01 0.00 0.50 0.00 0.00 46.19 46.93 1ykm s LEU 474 CO 0.46 -0.10 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.55 1ykm s ILE 475 N 0.16 1.92 0.03 6.68 1.01 -1.26 -0.74 121.20 128.99 1ykm s ILE 475 Ca -0.00 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.74 1ykm s ILE 475 Cb -0.02 -1.68 -0.00 0.00 0.01 0.00 0.00 42.46 40.77 1ykm s ILE 475 CO 0.00 0.53 0.03 1.07 0.00 0.00 0.00 174.94 176.57 1ykm n THR 476 N 3.78 0.00 -4.24 2.92 5.66 -0.44 -5.00 114.28 116.97 1ykm n THR 476 Ca -0.20 -0.21 -0.17 0.00 -3.05 0.00 0.00 64.05 60.43 1ykm n THR 476 Cb 0.52 0.11 -0.15 0.00 -1.55 0.00 0.00 70.33 69.27 1ykm n THR 476 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 1ykm s GLN 477 N -2.11 0.54 -0.16 1.09 -0.21 -1.26 -0.54 119.66 117.02 1ykm s GLN 477 Ca 0.03 -0.23 -0.10 0.00 0.02 0.00 0.00 55.36 55.08 1ykm s GLN 477 Cb 0.00 -0.52 -0.05 0.00 1.00 0.00 0.00 33.01 33.44 1ykm s GLN 477 CO 0.02 0.14 0.19 -1.17 -2.12 0.00 0.00 175.29 172.35 1ykm s LEU 478 N -0.14 4.29 0.27 2.90 0.20 0.52 -4.85 118.68 121.88 1ykm s LEU 478 Ca 0.02 0.41 0.11 0.00 0.69 0.00 0.00 54.13 55.36 1ykm s LEU 478 Cb -0.03 -2.18 -0.05 0.00 -0.43 0.00 0.00 46.19 43.50 1ykm s LEU 478 CO -0.00 0.24 -0.11 -0.31 -0.29 0.00 0.00 176.35 175.87 1ykm s TYR 479 N -0.10 2.47 -0.10 5.38 1.51 0.20 -2.29 117.35 124.42 1ykm s TYR 479 Ca 0.13 -0.28 -0.04 0.00 -1.01 0.00 0.00 57.07 55.87 1ykm s TYR 479 Cb -0.12 -1.08 -0.04 0.00 -0.11 0.00 0.00 41.96 40.61 1ykm s TYR 479 CO 0.02 0.68 0.04 -0.06 -1.11 0.00 0.00 175.55 175.12 1ykm s PHE 480 N -2.42 3.29 -0.15 2.71 0.40 -1.26 -0.25 117.98 120.30 1ykm s PHE 480 Ca 0.31 0.28 -0.39 0.00 -0.60 0.00 0.00 56.93 56.53 1ykm s PHE 480 Cb -0.06 -1.85 -0.16 0.00 0.51 0.00 0.00 43.02 41.46 1ykm s PHE 480 CO 0.17 0.53 1.58 -1.91 0.70 0.00 0.00 175.22 176.29 1ykm n GLU 481 N 2.17 1.09 -0.12 0.44 2.13 -0.71 -2.46 120.64 123.17 1ykm n GLU 481 Ca -0.19 0.40 0.00 0.00 0.66 0.00 0.00 57.16 58.03 1ykm n GLU 481 Cb 0.54 -2.06 0.00 0.00 0.27 0.00 0.00 31.44 30.19 1ykm n GLU 481 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ykm n GLY 482 N 3.54 1.96 3.59 8.31 0.00 -1.26 -5.01 105.19 116.32 1ykm n GLY 482 Ca 0.24 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.80 1ykm n GLY 482 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ykm n ASP 483 N 0.00 3.19 0.00 1.61 4.64 -1.03 -4.85 116.55 120.11 1ykm n ASP 483 Ca 0.00 0.49 0.03 0.00 -1.38 0.00 0.00 54.79 53.94 1ykm n ASP 483 Cb 0.00 -1.45 0.17 0.00 -1.04 0.00 0.00 41.12 38.79 1ykm n ASP 483 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 1ykm n PRO 484 N 8.06 0.06 0.05 -0.67 -0.04 -1.26 -2.46 135.00 138.74 1ykm n PRO 484 Ca 0.30 0.28 0.12 0.00 -0.04 0.00 0.00 63.50 64.16 1ykm n PRO 484 Cb 0.37 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.58 1ykm n PRO 484 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1ykm n LEU 485 N -1.36 0.61 -0.05 1.53 4.77 -1.26 -4.32 117.00 116.92 1ykm n LEU 485 Ca 0.03 0.25 -0.09 0.00 -0.03 0.00 0.00 56.01 56.17 1ykm n LEU 485 Cb 0.06 -0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 40.89 1ykm n LEU 485 CO 0.06 -0.03 0.91 0.40 -1.33 0.00 0.00 177.39 177.40 1ykm h ILE 486 N 0.00 0.94 0.00 -0.08 2.04 -1.87 -2.74 117.51 115.80 1ykm h ILE 486 Ca 0.00 -0.06 0.00 0.00 1.00 0.00 0.00 64.86 65.80 1ykm h ILE 486 Cb 0.67 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.50 1ykm h ILE 486 CO 0.00 0.03 0.00 -0.65 0.00 0.00 0.00 178.15 177.53 1ykm h PRO 487 N 0.17 0.00 0.00 2.37 0.11 -1.83 -3.14 132.00 129.68 1ykm h PRO 487 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1ykm h PRO 487 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 1ykm h PRO 487 CO -0.10 0.00 -0.68 -1.33 -0.21 0.00 0.00 178.00 175.68 1ykm n MET 488 N -2.37 0.02 -2.90 1.05 2.81 -1.05 -4.92 117.12 109.76 1ykm n MET 488 Ca 0.02 0.00 -0.41 0.00 -1.81 0.00 0.00 57.70 55.50 1ykm n MET 488 Cb 0.26 -1.51 -0.04 0.00 -0.71 0.00 0.00 33.22 31.22 1ykm n MET 488 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1ykm h PRO 490 N 7.21 0.00 -0.03 0.00 0.11 -1.92 0.59 132.00 137.97 1ykm h PRO 490 Ca -0.32 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.56 1ykm h PRO 490 Cb 1.15 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.27 1ykm h PRO 490 CO 0.82 0.06 -0.92 0.82 -0.21 0.00 0.00 178.00 178.57 1ykm h ILE 491 N 0.00 1.34 -0.21 4.15 2.04 -1.93 -2.68 117.51 120.23 1ykm h ILE 491 Ca -0.00 -2.28 -0.14 0.00 1.00 0.00 0.00 64.86 63.44 1ykm h ILE 491 Cb 0.12 2.31 0.00 0.00 -0.74 0.00 0.00 36.82 38.51 1ykm h ILE 491 CO 0.01 0.69 -0.42 0.58 0.00 0.00 0.00 178.15 179.01 1ykm h VAL 492 N 0.33 1.32 0.00 1.67 2.07 -1.75 -3.06 116.25 116.82 1ykm h VAL 492 Ca -0.08 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.79 1ykm h VAL 492 Cb 1.56 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.16 1ykm h VAL 492 CO 0.17 0.51 0.00 0.29 0.02 0.00 0.00 177.57 178.56 1ykm n LYS 493 N -4.22 0.63 0.07 1.57 5.02 0.15 -2.44 118.16 118.95 1ykm n LYS 493 Ca -0.06 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.35 1ykm n LYS 493 Cb 0.55 -1.36 0.45 0.00 -0.02 0.00 0.00 35.03 34.65 1ykm n LYS 493 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1ykm n SER 494 N -0.86 0.41 -4.57 4.39 3.41 -1.01 -4.44 113.62 110.95 1ykm n SER 494 Ca 0.11 0.57 -0.39 0.00 -0.26 0.00 0.00 58.87 58.90 1ykm n SER 494 Cb 0.05 -0.67 -0.10 0.00 -0.26 0.00 0.00 64.21 63.22 1ykm n SER 494 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1ykm s ILE 495 N -3.13 5.27 0.13 -1.33 1.01 -1.02 -3.66 121.20 118.47 1ykm s ILE 495 Ca 0.08 0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.72 1ykm s ILE 495 Cb 0.12 -3.64 -0.08 0.00 0.01 0.00 0.00 42.46 38.87 1ykm s ILE 495 CO 0.44 0.12 1.43 0.00 0.00 0.00 0.00 174.94 176.92 1ykm h ALA 496 N 8.39 0.50 -2.23 9.38 0.00 -1.86 -3.44 119.26 130.00 1ykm h ALA 496 Ca -0.33 -0.50 -0.57 0.00 0.00 0.00 0.00 54.91 53.51 1ykm h ALA 496 Cb 1.17 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.82 1ykm h ALA 496 CO 0.61 0.68 0.60 1.21 0.00 0.00 0.00 179.25 182.35 1ykm s ASN 497 N -6.92 7.12 0.51 0.00 3.04 -1.26 -4.95 114.94 112.47 1ykm s ASN 497 Ca -0.11 1.39 0.25 0.00 0.04 0.00 0.00 52.86 54.43 1ykm s ASN 497 Cb 0.10 -2.53 1.36 0.00 -1.54 0.00 0.00 41.25 38.65 1ykm s ASN 497 CO 0.89 -0.51 2.05 -0.65 -3.04 0.00 0.00 177.10 175.84 1ykm h PRO 498 N 7.28 0.00 0.00 0.43 0.11 -2.00 -2.23 132.00 135.59 1ykm h PRO 498 Ca -0.26 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1ykm h PRO 498 Cb 1.11 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1ykm h PRO 498 CO 0.89 0.14 -0.04 0.93 -0.21 0.00 0.00 178.00 179.70 1ykm h GLU 499 N 0.00 0.00 0.00 1.05 5.08 -1.98 -3.05 114.58 115.67 1ykm h GLU 499 Ca -0.00 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.14 1ykm h GLU 499 Cb 0.34 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1ykm h GLU 499 CO 0.02 0.04 -1.18 0.00 -1.00 0.00 0.00 179.01 176.89 1ykm h ALA 500 N 1.96 0.51 -0.28 3.43 0.00 -1.77 -3.25 119.26 119.86 1ykm h ALA 500 Ca -0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 54.91 53.79 1ykm h ALA 500 Cb 0.72 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1ykm h ALA 500 CO 0.01 1.28 -0.23 0.28 0.00 0.00 0.00 179.25 180.58 1ykm h VAL 501 N 0.00 1.26 -0.19 0.00 2.07 -1.51 -2.99 116.25 114.90 1ykm h VAL 501 Ca -0.09 -1.26 -0.03 0.00 0.82 0.00 0.00 66.70 66.14 1ykm h VAL 501 Cb 1.80 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 1ykm h VAL 501 CO 0.11 0.40 0.01 1.56 0.02 0.00 0.00 177.57 179.67 1ykm h GLN 502 N 0.48 0.27 0.00 1.57 1.08 -1.58 -2.24 115.11 114.70 1ykm h GLN 502 Ca 0.07 -0.04 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1ykm h GLN 502 Cb 0.66 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.04 1ykm h GLN 502 CO 0.05 0.30 0.00 1.96 -0.95 0.00 0.00 178.83 180.19 1ykm h GLN 503 N 0.27 0.00 -0.01 1.46 4.20 -1.61 -2.71 115.11 116.71 1ykm h GLN 503 Ca 0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1ykm h GLN 503 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 1ykm h GLN 503 CO 0.00 0.00 -0.33 1.28 -0.67 0.00 0.00 178.83 179.11 1ykm n LEU 504 N -2.64 1.58 -4.58 1.46 4.77 -0.84 -4.87 117.00 111.87 1ykm n LEU 504 Ca 0.01 -0.52 -0.40 0.00 -0.03 0.00 0.00 56.01 55.07 1ykm n LEU 504 Cb 0.27 -0.06 -0.09 0.00 -2.33 0.00 0.00 43.42 41.21 1ykm n LEU 504 CO 0.23 0.29 0.12 -0.63 -1.33 0.00 0.00 177.39 176.08 1ykm s ILE 505 N -2.45 5.11 0.11 -0.08 1.01 -1.03 -0.63 121.20 123.25 1ykm s ILE 505 Ca 0.23 0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.96 1ykm s ILE 505 Cb 0.19 -3.83 -0.06 0.00 0.01 0.00 0.00 42.46 38.78 1ykm s ILE 505 CO 0.53 -0.03 0.97 0.00 0.00 0.00 0.00 174.94 176.40 1ykm s ALA 506 N 2.18 3.24 0.11 9.38 0.00 0.65 -4.89 121.76 132.44 1ykm s ALA 506 Ca 0.16 0.58 -0.07 0.00 0.00 0.00 0.00 51.96 52.63 1ykm s ALA 506 Cb -0.16 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.62 1ykm s ALA 506 CO 0.11 -0.04 0.38 0.15 0.00 0.00 0.00 175.76 176.36 1ykm s LYS 507 N 0.04 3.68 0.02 0.00 -0.14 -0.87 -1.74 119.74 120.73 1ykm s LYS 507 Ca 0.47 0.04 -0.30 0.00 -1.36 0.00 0.00 55.97 54.82 1ykm s LYS 507 Cb -0.23 -2.92 -0.07 0.00 -1.68 0.00 0.00 37.83 32.93 1ykm s LYS 507 CO 0.30 0.52 1.56 -1.17 -0.76 0.00 0.00 175.35 175.80 1ykm s LEU 508 N -2.26 4.34 -0.59 3.17 2.96 -1.26 -1.05 118.68 123.98 1ykm s LEU 508 Ca 0.37 2.29 -0.01 0.00 -0.22 0.00 0.00 54.13 56.56 1ykm s LEU 508 Cb -0.13 -3.56 0.15 0.00 0.50 0.00 0.00 46.19 43.16 1ykm s LEU 508 CO 0.21 -0.83 0.38 -0.62 -1.32 0.00 0.00 176.35 174.17 1ykm s ASP 509 N 2.40 5.01 0.52 3.68 -1.08 0.51 -4.87 116.67 122.84 1ykm s ASP 509 Ca 0.70 -2.86 0.31 0.00 -0.52 0.00 0.00 52.55 50.18 1ykm s ASP 509 Cb -0.35 -1.80 1.12 0.00 -1.46 0.00 0.00 42.92 40.43 1ykm s ASP 509 CO 0.29 -0.34 1.89 0.24 0.52 0.00 0.00 175.17 177.78 1ykm h MET 510 N 6.93 0.00 -0.05 4.34 2.86 -1.94 -3.07 114.93 124.01 1ykm h MET 510 Ca -0.03 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.42 1ykm h MET 510 Cb 0.94 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.59 1ykm h MET 510 CO 0.70 0.01 -0.77 -0.91 1.06 0.00 0.00 176.91 177.00 1ykm h ASN 511 N 0.00 0.39 -0.12 1.22 2.35 -1.94 -3.12 115.58 114.36 1ykm h ASN 511 Ca -0.00 -0.27 0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1ykm h ASN 511 Cb 0.63 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1ykm h ASN 511 CO 0.00 1.02 0.00 -3.20 -1.65 0.00 0.00 177.43 173.60 1ykm n ASN 512 N -3.79 2.18 -4.79 5.81 5.15 -1.17 -4.95 115.26 113.71 1ykm n ASN 512 Ca -0.04 -1.74 -0.35 0.00 -0.60 0.00 0.00 54.58 51.84 1ykm n ASN 512 Cb 0.73 -0.07 -0.03 0.00 -0.53 0.00 0.00 39.78 39.88 1ykm n ASN 512 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ykm s ALA 513 N -1.87 2.94 -0.44 5.20 0.00 -1.18 -4.75 121.76 121.66 1ykm s ALA 513 Ca 0.34 0.66 -0.16 0.00 0.00 0.00 0.00 51.96 52.81 1ykm s ALA 513 Cb 0.20 -3.27 0.04 0.00 0.00 0.00 0.00 23.12 20.09 1ykm s ALA 513 CO 0.30 -0.31 0.40 -0.80 0.00 0.00 0.00 175.76 175.35 1ykm s ASN 514 N -1.80 6.16 0.27 0.00 0.01 -0.35 -5.01 114.94 114.21 1ykm s ASN 514 Ca 0.64 -0.99 -0.30 0.00 -0.71 0.00 0.00 52.86 51.50 1ykm s ASN 514 Cb -0.19 -2.20 -0.13 0.00 0.41 0.00 0.00 41.25 39.14 1ykm s ASN 514 CO 0.23 -0.59 1.30 -2.65 -1.51 0.00 0.00 177.10 173.88 1ykm n PRO 515 N 5.39 1.90 -1.44 -0.60 -0.02 -1.26 -1.44 135.00 137.53 1ykm n PRO 515 Ca -0.10 0.67 -0.15 0.00 -2.02 0.00 0.00 63.50 61.90 1ykm n PRO 515 Cb 0.46 -2.26 -0.07 0.00 -0.02 0.00 0.00 33.50 31.61 1ykm n PRO 515 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1ykm n MET 516 N 1.43 -1.23 0.00 -0.52 2.81 -1.26 -4.76 117.12 113.59 1ykm n MET 516 Ca 0.10 1.03 0.00 0.00 -1.81 0.00 0.00 57.70 57.02 1ykm n MET 516 Cb 0.32 -5.25 0.00 0.00 -0.71 0.00 0.00 33.22 27.58 1ykm n MET 516 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1ykm n ASP 517 N -0.75 0.00 -3.89 7.83 2.03 -0.83 -5.17 116.55 115.77 1ykm n ASP 517 Ca -0.15 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.06 1ykm n ASP 517 Cb 0.54 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.85 1ykm n ASP 517 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1ykm s LEU 519 N -1.86 2.87 -0.02 0.00 1.43 -0.78 -1.22 118.68 119.10 1ykm s LEU 519 Ca -0.08 -0.05 -0.08 0.00 -1.03 0.00 0.00 54.13 52.89 1ykm s LEU 519 Cb -0.03 -2.22 0.01 0.00 0.03 0.00 0.00 46.19 43.97 1ykm s LEU 519 CO -0.02 -2.15 0.17 0.00 0.23 0.00 0.00 176.35 174.57 1ykm s ALA 520 N -3.43 -0.40 0.03 4.21 0.00 -1.25 -1.20 121.76 119.72 1ykm s ALA 520 Ca 0.68 0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.78 1ykm s ALA 520 Cb -0.05 0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1ykm s ALA 520 CO 0.47 -0.18 -0.19 0.71 0.00 0.00 0.00 175.76 176.57 1ykm s TYR 521 N -1.01 1.68 -0.15 0.00 1.51 0.10 -0.36 117.35 119.12 1ykm s TYR 521 Ca -0.11 -0.35 -0.03 0.00 -1.01 0.00 0.00 57.07 55.56 1ykm s TYR 521 Cb -0.06 -1.02 -0.03 0.00 -0.11 0.00 0.00 41.96 40.74 1ykm s TYR 521 CO 0.01 0.05 -0.04 0.50 -1.11 0.00 0.00 175.55 174.96 1ykm s ARG 522 N -0.95 3.66 -0.27 -0.62 6.06 -0.22 -1.59 118.95 125.01 1ykm s ARG 522 Ca 0.06 -0.53 -0.03 0.00 -2.50 0.00 0.00 55.73 52.74 1ykm s ARG 522 Cb -0.08 -2.90 0.11 0.00 0.06 0.00 0.00 34.95 32.14 1ykm s ARG 522 CO 0.01 0.24 0.18 0.12 -2.50 0.00 0.00 175.30 173.36 1ykm s PHE 523 N 0.35 0.02 -0.06 5.12 5.36 -0.50 -2.04 117.98 126.23 1ykm s PHE 523 Ca -0.05 -0.52 -0.18 0.00 -0.96 0.00 0.00 56.93 55.22 1ykm s PHE 523 Cb -0.14 -0.71 -0.05 0.00 -0.34 0.00 0.00 43.02 41.78 1ykm s PHE 523 CO 0.03 -0.81 0.50 -0.51 -1.46 0.00 0.00 175.22 172.97 1ykm s ASP 524 N 2.20 6.79 -0.14 6.13 1.01 -1.26 -3.92 116.67 127.48 1ykm s ASP 524 Ca 0.08 0.94 -0.04 0.00 0.71 0.00 0.00 52.55 54.25 1ykm s ASP 524 Cb -0.15 -2.30 -0.03 0.00 1.01 0.00 0.00 42.92 41.44 1ykm s ASP 524 CO -0.31 0.08 -0.02 -0.63 0.21 0.00 0.00 175.17 174.50 1ykm s ILE 525 N 0.10 4.07 -0.23 0.77 1.01 -0.40 -4.94 121.20 121.57 1ykm s ILE 525 Ca 0.27 -0.30 -0.02 0.00 0.00 0.00 0.00 60.65 60.60 1ykm s ILE 525 Cb -0.16 -2.77 0.02 0.00 0.01 0.00 0.00 42.46 39.56 1ykm s ILE 525 CO 0.13 0.52 -0.08 -0.69 0.00 0.00 0.00 174.94 174.82 1ykm s VAL 526 N 0.07 2.85 0.47 2.92 1.01 -1.26 -0.91 120.40 125.56 1ykm s VAL 526 Ca 0.01 -0.91 0.08 0.00 0.00 0.00 0.00 61.98 61.15 1ykm s VAL 526 Cb -0.13 -2.39 0.03 0.00 0.00 0.00 0.00 36.38 33.89 1ykm s VAL 526 CO 0.02 0.29 0.65 -0.76 0.00 0.00 0.00 175.10 175.30 1ykm s LEU 527 N 1.35 3.49 0.30 3.92 1.43 0.20 -4.92 118.68 124.45 1ykm s LEU 527 Ca 0.02 -0.48 -0.29 0.00 -1.03 0.00 0.00 54.13 52.34 1ykm s LEU 527 Cb -0.16 -2.43 -0.12 0.00 0.03 0.00 0.00 46.19 43.51 1ykm s LEU 527 CO -0.05 -0.95 1.43 0.54 0.23 0.00 0.00 176.35 177.55 1ykm n ARG 528 N -2.00 2.32 -1.95 1.70 1.74 -1.26 -1.58 116.66 115.63 1ykm n ARG 528 Ca 0.10 0.82 -0.42 0.00 -0.77 0.00 0.00 57.85 57.58 1ykm n ARG 528 Cb 0.60 -2.49 -0.03 0.00 -1.02 0.00 0.00 32.46 29.51 1ykm n ARG 528 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1ykm s GLY 529 N 0.09 1.58 -0.17 -0.13 0.00 -1.26 -4.33 107.32 103.10 1ykm s GLY 529 Ca 0.61 1.31 -0.09 0.00 0.00 0.00 0.00 44.72 46.54 1ykm s GLY 529 CO 0.55 2.69 0.15 1.62 0.00 0.00 0.00 173.10 178.11 1ykm s GLN 530 N 1.59 3.96 0.05 2.90 0.74 -1.26 -1.07 119.66 126.57 1ykm s GLN 530 Ca 0.71 -0.17 -0.03 0.00 0.05 0.00 0.00 55.36 55.92 1ykm s GLN 530 Cb -0.42 -3.35 -0.03 0.00 1.10 0.00 0.00 33.01 30.31 1ykm s GLN 530 CO 0.31 0.45 0.02 -0.98 -0.55 0.00 0.00 175.29 174.55 1ykm s ARG 531 N -0.08 0.59 0.52 1.67 1.70 -0.44 -4.96 118.95 117.95 1ykm s ARG 531 Ca 0.11 -1.01 -0.17 0.00 -0.47 0.00 0.00 55.73 54.18 1ykm s ARG 531 Cb -0.11 0.22 -0.07 0.00 -0.57 0.00 0.00 34.95 34.41 1ykm s ARG 531 CO 0.00 -0.13 1.01 -1.59 -1.08 0.00 0.00 175.30 173.51 1ykm s LYS 532 N -3.32 3.81 0.39 3.89 -2.85 -1.26 -0.61 119.74 119.78 1ykm s LYS 532 Ca 0.01 1.09 -0.25 0.00 -1.00 0.00 0.00 55.97 55.82 1ykm s LYS 532 Cb 0.03 -2.11 -0.09 0.00 -2.06 0.00 0.00 37.83 33.61 1ykm s LYS 532 CO -0.08 -0.40 1.12 0.95 0.10 0.00 0.00 175.35 177.04 1ykm s THR 533 N -2.45 3.39 -0.09 3.79 -4.23 -1.12 -4.75 115.64 110.18 1ykm s THR 533 Ca 0.61 1.15 -0.08 0.00 -1.18 0.00 0.00 61.69 62.20 1ykm s THR 533 Cb -0.12 -3.64 0.03 0.00 1.34 0.00 0.00 72.50 70.11 1ykm s THR 533 CO 0.29 0.09 0.24 -1.38 -0.54 0.00 0.00 174.62 173.33 1ykm s HIS 534 N -1.47 -0.28 -1.51 3.99 -3.43 -1.26 -4.92 115.29 106.41 1ykm s HIS 534 Ca 0.56 0.68 0.00 0.00 -0.80 0.00 0.00 55.06 55.50 1ykm s HIS 534 Cb -0.28 0.08 0.00 0.00 -1.43 0.00 0.00 32.58 30.96 1ykm s HIS 534 CO 0.35 -0.15 0.00 1.19 -2.00 0.00 0.00 174.74 174.13 1ykm n PHE 535 N 3.20 -0.86 -3.09 0.38 3.01 -1.26 -4.97 117.46 113.87 1ykm n PHE 535 Ca -0.15 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 57.92 1ykm n PHE 535 Cb 0.57 -3.16 -0.06 0.00 -0.01 0.00 0.00 39.48 36.83 1ykm n PHE 535 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1ykm s GLU 536 N -4.41 4.42 -1.79 -1.08 2.02 -1.26 -3.72 118.70 112.89 1ykm s GLU 536 Ca 0.00 0.97 0.00 0.00 0.02 0.00 0.00 54.97 55.96 1ykm s GLU 536 Cb 0.00 -3.29 0.00 0.00 0.10 0.00 0.00 34.13 30.94 1ykm s GLU 536 CO 0.00 0.50 0.00 0.09 0.02 0.00 0.00 175.26 175.87 1ykm n ASN 537 N 2.05 -5.24 0.00 -0.19 3.02 -1.26 -5.22 115.26 108.42 1ykm n ASN 537 Ca -0.06 0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.75 1ykm n ASN 537 Cb 0.50 -4.34 0.00 0.00 -0.61 0.00 0.00 39.78 35.33 1ykm n ASN 537 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64