#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 3.70 0.23 0.55 0.00 -1.26 -5.11 121.76 119.86 1ykm s ALA 302 Ca 0.00 -0.40 0.11 0.00 0.00 0.00 0.00 51.96 51.67 1ykm s ALA 302 Cb 0.00 -2.28 -0.05 0.00 0.00 0.00 0.00 23.12 20.79 1ykm s ALA 302 CO 0.00 0.58 -0.20 -0.65 0.00 0.00 0.00 175.76 175.50 1ykm s GLN 303 N -2.42 1.52 -1.02 0.00 1.11 -1.26 -5.09 119.66 112.51 1ykm s GLN 303 Ca 0.40 -1.63 -0.17 0.00 0.01 0.00 0.00 55.36 53.97 1ykm s GLN 303 Cb -0.13 -1.60 0.15 0.00 -1.01 0.00 0.00 33.01 30.43 1ykm s GLN 303 CO 0.21 0.31 1.20 0.34 0.01 0.00 0.00 175.29 177.36 1ykm s ASP 304 N -3.17 6.80 0.00 5.90 2.15 -1.26 -4.66 116.67 122.42 1ykm s ASP 304 Ca 0.24 -2.43 0.00 0.00 0.43 0.00 0.00 52.55 50.80 1ykm s ASP 304 Cb -0.05 -2.38 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 1ykm s ASP 304 CO 0.11 -0.91 0.13 -0.46 -0.17 0.00 0.00 175.17 173.87 1ykm n ASN 305 N 5.99 0.25 -4.34 -0.34 0.23 -1.26 -5.04 115.26 110.76 1ykm n ASN 305 Ca 0.27 -0.59 -0.24 0.00 -0.53 0.00 0.00 54.58 53.50 1ykm n ASN 305 Cb 0.47 0.48 -0.12 0.00 -2.08 0.00 0.00 39.78 38.53 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 -0.48 2.82 0.04 0.53 0.01 -1.26 -3.19 113.70 112.18 1ykm s SER 306 Ca 0.00 -0.81 0.06 0.00 1.31 0.00 0.00 55.95 56.51 1ykm s SER 306 Cb 0.00 -0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.03 1ykm s SER 306 CO 0.00 0.03 -0.17 -0.13 0.41 0.00 0.00 173.24 173.38 1ykm s ARG 307 N -2.49 1.16 -0.06 12.44 1.81 -0.05 -4.87 118.95 126.89 1ykm s ARG 307 Ca 0.14 -0.84 0.04 0.00 -1.72 0.00 0.00 55.73 53.35 1ykm s ARG 307 Cb -0.08 -1.22 -0.02 0.00 -0.45 0.00 0.00 34.95 33.18 1ykm s ARG 307 CO 0.07 0.31 -0.16 -0.06 -0.68 0.00 0.00 175.30 174.77 1ykm s PHE 308 N -0.81 2.67 0.27 -0.53 0.40 -1.26 -1.59 117.98 117.12 1ykm s PHE 308 Ca 0.05 -0.31 -0.31 0.00 -0.60 0.00 0.00 56.93 55.76 1ykm s PHE 308 Cb -0.08 -1.65 -0.12 0.00 0.51 0.00 0.00 43.02 41.67 1ykm s PHE 308 CO 0.01 0.07 1.51 0.28 0.70 0.00 0.00 175.22 177.79 1ykm n VAL 309 N 2.58 0.99 -1.93 -0.44 0.31 -0.53 -4.92 118.33 114.39 1ykm n VAL 309 Ca -0.17 -0.25 -0.41 0.00 -0.01 0.00 0.00 64.34 63.50 1ykm n VAL 309 Cb 0.52 -1.73 -0.02 0.00 -0.91 0.00 0.00 33.84 31.70 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 -0.03 2.43 0.30 2.52 -1.09 -1.26 -4.70 121.20 119.37 1ykm s ILE 310 Ca 0.66 0.37 -0.29 0.00 -2.23 0.00 0.00 60.65 59.16 1ykm s ILE 310 Cb -0.57 -3.24 -0.10 0.00 -1.58 0.00 0.00 42.46 36.97 1ykm s ILE 310 CO 0.49 0.07 1.31 -0.13 -1.23 0.00 0.00 174.94 175.45 1ykm s ARG 311 N -0.76 4.36 -0.61 2.79 0.52 -1.26 -4.97 118.95 119.02 1ykm s ARG 311 Ca 0.59 2.19 -0.20 0.00 -0.52 0.00 0.00 55.73 57.78 1ykm s ARG 311 Cb -0.44 -3.09 0.09 0.00 0.52 0.00 0.00 34.95 32.03 1ykm s ARG 311 CO 0.48 -0.20 0.79 0.34 0.02 0.00 0.00 175.30 176.73 1ykm s ASP 312 N -0.32 6.18 0.00 0.23 -1.08 -1.26 -4.91 116.67 115.52 1ykm s ASP 312 Ca 0.51 -1.30 0.05 0.00 -0.52 0.00 0.00 52.55 51.29 1ykm s ASP 312 Cb -0.39 -2.34 0.31 0.00 -1.46 0.00 0.00 42.92 39.04 1ykm s ASP 312 CO 0.50 -1.22 1.13 0.54 0.52 0.00 0.00 175.17 176.63 1ykm n ARG 313 N 6.76 0.92 -0.00 4.34 1.74 -1.26 -2.38 116.66 126.77 1ykm n ARG 313 Ca -0.08 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.09 1ykm n ARG 313 Cb 0.43 -1.09 -0.12 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 -0.59 0.88 -0.05 0.55 3.02 -1.26 -4.36 115.26 113.45 1ykm n ASN 314 Ca 0.04 -0.47 -0.21 0.00 -0.03 0.00 0.00 54.58 53.91 1ykm n ASN 314 Cb 0.02 1.39 -0.13 0.00 -0.61 0.00 0.00 39.78 40.45 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 0.21 -4.23 3.10 2.91 -1.89 -3.44 115.95 112.61 1ykm h TRP 315 Ca 0.00 -0.15 -0.50 0.00 1.13 0.00 0.00 58.89 59.37 1ykm h TRP 315 Cb 0.60 -0.01 0.09 0.00 -0.51 0.00 0.00 29.16 29.33 1ykm h TRP 315 CO 0.00 1.52 0.37 -1.01 -1.03 0.00 0.00 178.44 178.28 1ykm s HIS 316 N -2.42 2.82 0.63 2.65 3.76 -1.08 -4.76 115.29 116.89 1ykm s HIS 316 Ca -0.24 1.52 -0.17 0.00 -0.15 0.00 0.00 55.06 56.01 1ykm s HIS 316 Cb 0.05 -3.05 -0.02 0.00 1.11 0.00 0.00 32.58 30.67 1ykm s HIS 316 CO 0.68 -1.42 1.17 -1.25 -0.85 0.00 0.00 174.74 173.07 1ykm s PRO 317 N -4.31 2.84 0.72 8.40 0.04 -1.26 -4.84 135.00 136.59 1ykm s PRO 317 Ca 0.64 1.69 -0.11 0.00 0.04 0.00 0.00 61.00 63.25 1ykm s PRO 317 Cb -0.18 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.46 1ykm s PRO 317 CO 0.43 -1.28 1.09 0.15 0.04 0.00 0.00 177.00 177.44 1ykm s LYS 318 N -3.59 2.77 0.03 4.56 -0.14 -1.24 -4.98 119.74 117.15 1ykm s LYS 318 Ca 0.74 0.52 -0.21 0.00 -1.36 0.00 0.00 55.97 55.67 1ykm s LYS 318 Cb -0.27 -2.01 -0.15 0.00 -1.68 0.00 0.00 37.83 33.72 1ykm s LYS 318 CO 0.36 -1.11 1.33 0.00 -0.76 0.00 0.00 175.35 175.16 1ykm h ALA 319 N -0.71 0.19 -2.09 5.17 0.00 -1.95 -3.40 119.26 116.46 1ykm h ALA 319 Ca -0.45 -0.33 -0.73 0.00 0.00 0.00 0.00 54.91 53.40 1ykm h ALA 319 Cb 1.25 -0.04 -0.21 0.00 0.00 0.00 0.00 17.79 18.79 1ykm h ALA 319 CO 0.63 0.08 -0.11 -1.17 0.00 0.00 0.00 179.25 178.67 1ykm s LEU 320 N -9.08 5.63 -0.49 0.00 2.96 -1.26 -4.77 118.68 111.68 1ykm s LEU 320 Ca -0.14 -1.43 0.03 0.00 -0.22 0.00 0.00 54.13 52.37 1ykm s LEU 320 Cb 0.05 -2.27 0.15 0.00 0.50 0.00 0.00 46.19 44.62 1ykm s LEU 320 CO 0.75 -0.88 0.31 0.42 -1.32 0.00 0.00 176.35 175.63 1ykm s THR 321 N 2.07 1.43 0.51 3.68 -4.23 -1.26 -5.04 115.64 112.81 1ykm s THR 321 Ca 0.08 -2.91 0.36 0.00 -1.18 0.00 0.00 61.69 58.04 1ykm s THR 321 Cb -0.25 -1.98 0.57 0.00 1.34 0.00 0.00 72.50 72.17 1ykm s THR 321 CO 0.06 -1.00 1.72 1.55 -0.54 0.00 0.00 174.62 176.42 1ykm h PRO 322 N 6.22 0.06 -0.01 3.99 0.13 -1.93 -1.19 132.00 139.27 1ykm h PRO 322 Ca 0.09 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.18 1ykm h PRO 322 Cb 0.89 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 1ykm h PRO 322 CO 0.50 0.04 -0.14 -0.44 -0.23 0.00 0.00 178.00 177.73 1ykm h ASP 323 N 0.07 0.02 -3.12 1.44 3.32 -1.96 -3.11 116.42 113.08 1ykm h ASP 323 Ca 0.69 -0.00 -0.74 0.00 0.02 0.00 0.00 57.03 57.00 1ykm h ASP 323 Cb 2.56 -0.00 -0.22 0.00 0.22 0.00 0.00 39.33 41.89 1ykm h ASP 323 CO -0.11 0.17 0.40 -0.47 -1.72 0.00 0.00 179.24 177.51 1ykm s TYR 324 N -4.73 3.40 0.32 4.55 5.04 -0.45 -4.87 117.35 120.60 1ykm s TYR 324 Ca -0.04 -1.61 0.09 0.00 -2.44 0.00 0.00 57.07 53.07 1ykm s TYR 324 Cb 0.16 -4.04 0.91 0.00 0.35 0.00 0.00 41.96 39.35 1ykm s TYR 324 CO 0.70 -1.24 1.66 0.87 -1.34 0.00 0.00 175.55 176.20 1ykm h LYS 325 N 8.40 0.30 0.00 4.97 1.57 -1.76 -2.20 116.57 127.85 1ykm h LYS 325 Ca 0.07 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1ykm h LYS 325 Cb 1.04 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.28 1ykm h LYS 325 CO 0.95 0.20 0.00 1.15 -0.57 0.00 0.00 179.45 181.17 1ykm h THR 326 N 0.31 0.00 0.00 -0.16 2.02 -1.92 -2.82 112.91 110.34 1ykm h THR 326 Ca 0.65 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 67.52 1ykm h THR 326 Cb 1.39 1.23 0.00 0.00 -1.74 0.00 0.00 68.15 69.04 1ykm h THR 326 CO -0.61 0.00 0.00 0.77 0.37 0.00 0.00 175.52 176.05 1ykm h SER 327 N 0.00 0.00 -0.18 4.18 4.64 -1.69 -3.21 113.55 117.29 1ykm h SER 327 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1ykm h SER 327 Cb 0.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 1ykm h SER 327 CO 0.00 0.00 0.03 0.40 -0.87 0.00 0.00 176.83 176.39 1ykm h ILE 328 N 0.00 1.22 0.00 0.95 2.04 -1.67 -3.09 117.51 116.97 1ykm h ILE 328 Ca 0.00 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.13 1ykm h ILE 328 Cb 0.59 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 1ykm h ILE 328 CO 0.00 0.22 -0.57 0.00 0.00 0.00 0.00 178.15 177.81 1ykm n ALA 329 N -2.29 3.36 -1.68 1.87 0.00 -1.25 -4.17 120.51 116.35 1ykm n ALA 329 Ca -0.05 -0.32 -0.18 0.00 0.00 0.00 0.00 53.44 52.89 1ykm n ALA 329 Cb 0.19 -1.13 0.10 0.00 0.00 0.00 0.00 19.45 18.61 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 -1.69 2.72 -4.56 0.00 1.74 -1.21 -4.99 116.66 108.67 1ykm n ARG 330 Ca 0.05 -3.63 -0.23 0.00 -0.77 0.00 0.00 57.85 53.28 1ykm n ARG 330 Cb 0.37 -2.09 -0.16 0.00 -1.02 0.00 0.00 32.46 29.56 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 -2.88 1.57 0.20 0.55 1.04 -1.17 -4.93 113.70 108.07 1ykm s SER 331 Ca 0.51 -0.25 -0.30 0.00 0.48 0.00 0.00 55.95 56.39 1ykm s SER 331 Cb 0.43 -0.43 -0.09 0.00 0.10 0.00 0.00 66.02 66.03 1ykm s SER 331 CO 0.01 0.10 1.33 -2.84 0.98 0.00 0.00 173.24 172.82 1ykm s PRO 332 N 0.14 4.37 0.04 4.02 0.02 -1.26 -4.93 135.00 137.39 1ykm s PRO 332 Ca -0.03 2.09 0.13 0.00 0.02 0.00 0.00 61.00 63.20 1ykm s PRO 332 Cb -0.10 -3.19 -0.18 0.00 0.02 0.00 0.00 34.50 31.06 1ykm s PRO 332 CO 0.01 -0.29 0.86 0.00 -0.33 0.00 0.00 177.00 177.25 1ykm h ARG 333 N 5.48 0.00 -6.86 5.54 2.47 -2.00 -3.46 114.38 115.54 1ykm h ARG 333 Ca -0.45 0.00 -0.49 0.00 -1.26 0.00 0.00 59.98 57.78 1ykm h ARG 333 Cb 1.21 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.53 1ykm h ARG 333 CO 0.78 0.51 0.15 -0.65 0.56 0.00 0.00 179.97 181.32 1ykm s GLN 334 N -2.74 3.86 0.52 0.04 -1.52 -1.26 -5.05 119.66 113.51 1ykm s GLN 334 Ca -0.03 0.59 -0.20 0.00 -1.95 0.00 0.00 55.36 53.78 1ykm s GLN 334 Cb 0.08 -2.36 -0.07 0.00 -0.22 0.00 0.00 33.01 30.44 1ykm s GLN 334 CO 0.81 -0.02 1.09 0.00 -0.25 0.00 0.00 175.29 176.92 1ykm s ALA 335 N -2.31 2.77 0.31 6.09 0.00 -1.26 -5.01 121.76 122.36 1ykm s ALA 335 Ca 0.53 0.72 -0.29 0.00 0.00 0.00 0.00 51.96 52.93 1ykm s ALA 335 Cb -0.10 -3.31 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 1ykm s ALA 335 CO 0.28 -0.56 1.17 -0.51 0.00 0.00 0.00 175.76 176.13 1ykm s LEU 336 N -3.66 4.47 -0.15 0.00 1.43 -1.26 -5.01 118.68 114.50 1ykm s LEU 336 Ca 0.70 2.39 -0.20 0.00 -1.03 0.00 0.00 54.13 56.00 1ykm s LEU 336 Cb -0.20 -3.69 -0.03 0.00 0.03 0.00 0.00 46.19 42.29 1ykm s LEU 336 CO 0.24 -0.32 0.56 -0.69 0.23 0.00 0.00 176.35 176.37 1ykm s VAL 337 N -1.20 5.10 -0.06 -1.59 1.01 -1.26 -5.05 120.40 117.35 1ykm s VAL 337 Ca 0.47 1.10 -0.24 0.00 0.00 0.00 0.00 61.98 63.31 1ykm s VAL 337 Cb -0.34 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 1ykm s VAL 337 CO 0.44 0.23 0.74 -0.44 0.00 0.00 0.00 175.10 176.07 1ykm s SER 338 N 0.91 7.03 0.03 3.32 0.01 -1.26 -5.07 113.70 118.68 1ykm s SER 338 Ca 0.28 1.25 0.05 0.00 1.31 0.00 0.00 55.95 58.84 1ykm s SER 338 Cb -0.16 -2.43 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 1ykm s SER 338 CO 0.11 -0.15 -0.15 0.27 0.41 0.00 0.00 173.24 173.73 1ykm s ILE 339 N 0.92 1.20 0.60 1.44 -4.36 -1.26 -5.14 121.20 114.60 1ykm s ILE 339 Ca 0.39 -0.97 -0.16 0.00 -0.26 0.00 0.00 60.65 59.65 1ykm s ILE 339 Cb -0.18 -1.07 -0.03 0.00 1.25 0.00 0.00 42.46 42.43 1ykm s ILE 339 CO 0.19 0.09 1.09 -2.16 0.24 0.00 0.00 174.94 174.38 1ykm s PRO 340 N -1.02 3.17 0.21 0.37 0.04 -1.26 -4.99 135.00 131.52 1ykm s PRO 340 Ca 0.03 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 1ykm s PRO 340 Cb -0.08 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 32.38 1ykm s PRO 340 CO 0.01 -0.95 1.22 -0.65 0.04 0.00 0.00 177.00 176.67 1ykm s GLN 341 N -3.87 4.47 0.17 4.56 -0.21 -1.26 -5.02 119.66 118.51 1ykm s GLN 341 Ca 0.67 1.94 0.03 0.00 0.02 0.00 0.00 55.36 58.02 1ykm s GLN 341 Cb -0.19 -3.21 -0.01 0.00 1.00 0.00 0.00 33.01 30.60 1ykm s GLN 341 CO 0.35 -0.10 0.11 -1.13 -2.12 0.00 0.00 175.29 172.40 1ykm n SER 342 N 2.21 0.25 0.11 5.90 3.41 -1.26 -4.99 113.62 119.25 1ykm n SER 342 Ca 0.04 -2.04 0.17 0.00 -0.26 0.00 0.00 58.87 56.78 1ykm n SER 342 Cb 0.44 0.67 0.71 0.00 -0.26 0.00 0.00 64.21 65.77 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 1.43 0.72 -0.09 -1.33 2.10 -1.96 -0.01 117.51 118.37 1ykm h ILE 343 Ca -0.13 0.00 -0.12 0.00 1.08 0.00 0.00 64.86 65.69 1ykm h ILE 343 Cb 0.57 0.82 -0.01 0.00 -1.09 0.00 0.00 36.82 37.10 1ykm h ILE 343 CO 0.19 0.00 -0.50 0.28 -1.08 0.00 0.00 178.15 177.05 1ykm h SER 344 N 0.00 0.26 0.13 2.19 0.02 -1.96 -3.19 113.55 111.00 1ykm h SER 344 Ca 0.15 -0.12 -0.35 0.00 -0.84 0.00 0.00 61.79 60.63 1ykm h SER 344 Cb 0.67 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 63.07 1ykm h SER 344 CO -0.00 0.71 -2.21 -0.62 -1.14 0.00 0.00 176.83 173.57 1ykm n GLU 345 N -3.96 0.67 -0.12 3.45 4.71 -0.52 -4.48 120.64 120.40 1ykm n GLU 345 Ca -0.02 0.08 0.10 0.00 -0.01 0.00 0.00 57.16 57.31 1ykm n GLU 345 Cb 0.54 -1.60 0.31 0.00 -1.01 0.00 0.00 31.44 29.69 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 -2.86 0.31 -4.49 2.62 -2.24 -0.13 -3.35 114.28 104.13 1ykm n THR 346 Ca -0.29 -0.43 -0.24 0.00 -2.27 0.00 0.00 64.05 60.81 1ykm n THR 346 Cb 1.12 0.41 -0.10 0.00 -2.10 0.00 0.00 70.33 69.66 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 -1.69 2.25 0.07 4.28 -4.23 -1.21 -4.74 115.64 110.38 1ykm s THR 347 Ca 0.32 -2.28 -0.27 0.00 -1.18 0.00 0.00 61.69 58.28 1ykm s THR 347 Cb 0.17 -2.46 0.09 0.00 1.34 0.00 0.00 72.50 71.64 1ykm s THR 347 CO 0.25 -0.31 1.06 -0.83 -0.54 0.00 0.00 174.62 174.25 1ykm s GLY 348 N -3.54 -0.31 0.48 3.99 0.00 -1.22 -2.50 107.32 104.22 1ykm s GLY 348 Ca 0.31 0.44 -0.23 0.00 0.00 0.00 0.00 44.72 45.23 1ykm s GLY 348 CO 0.15 0.09 1.26 2.56 0.00 0.00 0.00 173.10 177.16 1ykm s PRO 349 N -2.98 3.57 -0.12 2.90 0.04 -1.26 -4.81 135.00 132.32 1ykm s PRO 349 Ca 0.12 2.01 0.01 0.00 0.04 0.00 0.00 61.00 63.18 1ykm s PRO 349 Cb 0.00 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 32.12 1ykm s PRO 349 CO -0.01 -0.78 -0.17 1.21 0.04 0.00 0.00 177.00 177.30 1ykm s ASN 350 N -1.10 3.70 -0.31 6.66 3.84 -1.26 -4.87 114.94 121.59 1ykm s ASN 350 Ca 0.65 -0.41 0.09 0.00 0.21 0.00 0.00 52.86 53.40 1ykm s ASN 350 Cb -0.35 -1.55 0.58 0.00 -0.55 0.00 0.00 41.25 39.39 1ykm s ASN 350 CO 0.42 0.15 1.61 0.49 -2.79 0.00 0.00 177.10 176.98 1ykm n PHE 351 N 3.60 1.70 0.21 0.43 3.01 -1.26 -4.66 117.46 120.49 1ykm n PHE 351 Ca -0.18 -1.49 0.05 0.00 1.01 0.00 0.00 57.45 56.83 1ykm n PHE 351 Cb 0.53 -0.59 0.44 0.00 -0.01 0.00 0.00 39.48 39.85 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 1.37 0.00 -0.14 4.37 0.02 -1.97 -2.92 113.55 114.28 1ykm h SER 352 Ca 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 1ykm h SER 352 Cb 2.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.54 1ykm h SER 352 CO 0.57 0.28 0.00 1.41 -1.14 0.00 0.00 176.83 177.95 1ykm n HIS 353 N -4.11 0.16 -2.47 3.45 8.25 -1.26 -4.93 115.22 114.31 1ykm n HIS 353 Ca -0.02 -0.08 -0.41 0.00 -0.26 0.00 0.00 57.72 56.95 1ykm n HIS 353 Cb 0.34 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.41 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 -1.77 4.50 -0.78 2.41 2.96 -1.11 -4.97 118.68 119.92 1ykm s LEU 354 Ca 0.34 2.17 -0.25 0.00 -0.22 0.00 0.00 54.13 56.17 1ykm s LEU 354 Cb 0.20 -3.61 0.05 0.00 0.50 0.00 0.00 46.19 43.33 1ykm s LEU 354 CO 0.30 -0.23 1.23 -0.83 -1.32 0.00 0.00 176.35 175.51 1ykm s GLY 355 N -0.28 1.10 0.09 7.98 0.00 -1.26 -5.01 107.32 109.94 1ykm s GLY 355 Ca 0.49 -1.69 -0.26 0.00 0.00 0.00 0.00 44.72 43.25 1ykm s GLY 355 CO 0.37 2.50 0.80 -1.36 0.00 0.00 0.00 173.10 175.41 1ykm s PHE 356 N 5.10 3.80 0.53 1.90 0.08 -1.26 -5.06 117.98 123.08 1ykm s PHE 356 Ca 0.34 1.57 -0.18 0.00 0.12 0.00 0.00 56.93 58.79 1ykm s PHE 356 Cb -0.08 -2.84 -0.06 0.00 -0.57 0.00 0.00 43.02 39.46 1ykm s PHE 356 CO 0.08 0.34 1.04 0.20 -0.10 0.00 0.00 175.22 176.78 1ykm s GLY 357 N -0.39 2.29 0.52 4.36 0.00 -1.26 -4.95 107.32 107.88 1ykm s GLY 357 Ca 0.39 0.46 0.16 0.00 0.00 0.00 0.00 44.72 45.73 1ykm s GLY 357 CO 0.25 0.77 2.15 0.00 0.00 0.00 0.00 173.10 176.27 1ykm h ALA 358 N 1.02 2.00 -0.29 3.20 0.00 -2.02 -2.70 119.26 120.47 1ykm h ALA 358 Ca -0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1ykm h ALA 358 Cb 1.21 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1ykm h ALA 358 CO 0.59 0.00 0.00 0.72 0.00 0.00 0.00 179.25 180.56 1ykm n HIS 359 N -4.54 0.96 0.17 0.00 8.25 -1.26 -4.70 115.22 114.10 1ykm n HIS 359 Ca -0.03 -0.83 0.08 0.00 -0.26 0.00 0.00 57.72 56.68 1ykm n HIS 359 Cb 0.09 -0.29 0.59 0.00 1.12 0.00 0.00 29.99 31.50 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 1.96 0.11 0.15 0.41 3.32 -1.77 -1.61 116.42 118.99 1ykm h ASP 360 Ca 0.00 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ykm h ASP 360 Cb 1.40 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.92 1ykm h ASP 360 CO 0.21 0.08 -0.54 0.00 -1.72 0.00 0.00 179.24 177.27 1ykm n HIS 361 N -4.51 0.00 -3.52 4.55 1.44 -1.18 -2.20 115.22 109.80 1ykm n HIS 361 Ca -0.00 0.00 -0.42 0.00 -2.01 0.00 0.00 57.72 55.29 1ykm n HIS 361 Cb 0.13 -0.08 -0.07 0.00 0.12 0.00 0.00 29.99 30.10 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 -2.70 5.90 0.00 4.39 3.68 -0.61 -2.44 116.67 124.90 1ykm s ASP 362 Ca 0.16 -2.35 0.19 0.00 2.13 0.00 0.00 52.55 52.69 1ykm s ASP 362 Cb 0.18 -2.04 1.03 0.00 -1.45 0.00 0.00 42.92 40.65 1ykm s ASP 362 CO 0.65 -0.59 1.57 0.18 0.13 0.00 0.00 175.17 177.11 1ykm n LEU 363 N 4.33 0.00 0.11 -1.34 4.32 0.30 -1.13 117.00 123.59 1ykm n LEU 363 Ca 0.01 0.18 0.11 0.00 -0.02 0.00 0.00 56.01 56.29 1ykm n LEU 363 Cb 0.42 -0.18 0.01 0.00 -1.62 0.00 0.00 43.42 42.05 1ykm n LEU 363 CO 0.39 -0.07 0.08 0.25 -1.22 0.00 0.00 177.39 176.83 1ykm h LEU 364 N 0.00 0.00 0.00 2.23 5.85 -1.91 -3.40 115.31 118.07 1ykm h LEU 364 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1ykm h LEU 364 Cb 0.11 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1ykm h LEU 364 CO 0.00 0.00 -0.29 0.18 -0.34 0.00 0.00 178.44 178.00 1ykm n LEU 365 N -2.71 0.00 0.00 2.25 4.77 -0.84 -4.64 117.00 115.84 1ykm n LEU 365 Ca 0.00 -0.22 0.11 0.00 -0.03 0.00 0.00 56.01 55.88 1ykm n LEU 365 Cb 0.55 0.00 0.56 0.00 -2.33 0.00 0.00 43.42 42.20 1ykm n LEU 365 CO 0.40 0.00 0.87 -0.46 -1.33 0.00 0.00 177.39 176.87 1ykm n ASN 366 N -0.86 0.00 -0.06 -1.43 0.23 -0.29 -3.61 115.26 109.25 1ykm n ASN 366 Ca 0.00 0.07 -0.07 0.00 -0.53 0.00 0.00 54.58 54.05 1ykm n ASN 366 Cb 0.00 -0.33 -0.06 0.00 -2.08 0.00 0.00 39.78 37.30 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 -1.33 0.00 0.00 -2.53 7.35 -1.26 -5.00 117.46 114.69 1ykm n PHE 367 Ca 0.10 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.79 1ykm n PHE 367 Cb 0.20 -0.47 0.00 0.00 0.35 0.00 0.00 39.48 39.56 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 -2.65 0.00 0.00 -2.13 4.05 -1.24 -4.96 115.26 108.34 1ykm n ASN 368 Ca -0.19 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.84 1ykm n ASN 368 Cb 0.76 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.77 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 0.48 0.92 0.00 1.20 3.02 -1.26 -4.95 115.26 114.66 1ykm n ASN 369 Ca 0.00 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.48 1ykm n ASN 369 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 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 -0.04 0.04 0.00 7.41 0.00 -1.26 -5.08 105.19 106.26 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 2.28 3.89 -0.02 0.00 -1.26 -5.17 105.19 104.90 1ykm n GLY 371 Ca 0.00 -0.79 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 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 4.31 0.55 0.99 1.02 -1.26 -4.80 118.68 119.49 1ykm s LEU 372 Ca 0.00 0.56 -0.18 0.00 0.02 0.00 0.00 54.13 54.52 1ykm s LEU 372 Cb 0.00 -3.07 -0.06 0.00 0.02 0.00 0.00 46.19 43.09 1ykm s LEU 372 CO 0.00 0.13 1.07 -2.84 0.02 0.00 0.00 176.35 174.74 1ykm s PRO 373 N -2.34 3.45 -0.22 1.29 0.02 -1.26 -4.88 135.00 131.06 1ykm s PRO 373 Ca 0.36 1.39 -0.20 0.00 0.02 0.00 0.00 61.00 62.57 1ykm s PRO 373 Cb -0.13 -2.04 -0.02 0.00 0.02 0.00 0.00 34.50 32.33 1ykm s PRO 373 CO 0.22 -0.73 0.60 0.42 -0.33 0.00 0.00 177.00 177.18 1ykm s ILE 374 N -2.09 5.03 0.00 2.83 1.01 -1.26 -4.97 121.20 121.75 1ykm s ILE 374 Ca 0.68 1.09 0.00 0.00 0.00 0.00 0.00 60.65 62.42 1ykm s ILE 374 Cb -0.19 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.37 1ykm s ILE 374 CO 0.28 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.93 1ykm n GLY 375 N 3.97 1.87 3.60 6.18 0.00 -1.26 -4.36 105.19 115.19 1ykm n GLY 375 Ca -0.02 -1.34 -0.43 0.00 0.00 0.00 0.00 46.02 44.23 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 -1.94 3.49 -0.08 1.61 2.02 -1.26 -4.88 118.70 117.66 1ykm s GLU 376 Ca 0.00 1.13 -0.29 0.00 0.02 0.00 0.00 54.97 55.82 1ykm s GLU 376 Cb 0.00 -4.09 -0.05 0.00 0.10 0.00 0.00 34.13 30.09 1ykm s GLU 376 CO 0.00 -1.67 1.72 1.03 0.02 0.00 0.00 175.26 176.36 1ykm s ARG 377 N 5.20 4.05 0.08 1.61 0.52 -1.26 -0.86 118.95 128.29 1ykm s ARG 377 Ca 0.68 2.14 0.01 0.00 -0.52 0.00 0.00 55.73 58.05 1ykm s ARG 377 Cb -0.17 -4.04 -0.04 0.00 0.52 0.00 0.00 34.95 31.22 1ykm s ARG 377 CO 0.33 -1.01 -0.06 0.96 0.02 0.00 0.00 175.30 175.54 1ykm s ILE 378 N 4.54 0.57 -0.12 1.52 -4.36 0.22 -2.13 121.20 121.44 1ykm s ILE 378 Ca 0.77 -1.87 0.01 0.00 -0.26 0.00 0.00 60.65 59.30 1ykm s ILE 378 Cb -0.33 -1.59 -0.01 0.00 1.25 0.00 0.00 42.46 41.78 1ykm s ILE 378 CO 0.31 -0.88 -0.17 -0.63 0.24 0.00 0.00 174.94 173.81 1ykm s ILE 379 N -3.59 2.68 -0.29 8.37 1.01 -0.08 -1.39 121.20 127.91 1ykm s ILE 379 Ca 0.10 -0.80 -0.04 0.00 0.00 0.00 0.00 60.65 59.91 1ykm s ILE 379 Cb 0.05 -2.09 0.03 0.00 0.01 0.00 0.00 42.46 40.45 1ykm s ILE 379 CO -0.06 0.54 0.02 -0.69 0.00 0.00 0.00 174.94 174.75 1ykm s VAL 380 N 0.35 3.42 0.21 2.92 1.01 0.31 -0.03 120.40 128.60 1ykm s VAL 380 Ca -0.14 -0.98 0.03 0.00 0.00 0.00 0.00 61.98 60.89 1ykm s VAL 380 Cb -0.17 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.35 1ykm s VAL 380 CO 0.07 0.05 0.01 0.00 0.00 0.00 0.00 175.10 175.23 1ykm s ALA 381 N 1.39 1.63 0.00 5.51 0.00 -0.42 -0.44 121.76 129.42 1ykm s ALA 381 Ca -0.00 -1.71 0.00 0.00 0.00 0.00 0.00 51.96 50.25 1ykm s ALA 381 Cb -0.18 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.52 1ykm s ALA 381 CO -0.00 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.87 1ykm n GLY 382 N -0.36 -1.12 3.15 0.00 0.00 -1.07 -0.91 105.19 104.88 1ykm n GLY 382 Ca -0.05 -0.93 -0.20 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.81 0.97 -0.32 1.61 3.52 -1.25 -1.59 118.95 121.08 1ykm s ARG 383 Ca 0.00 -0.75 -0.06 0.00 -0.13 0.00 0.00 55.73 54.79 1ykm s ARG 383 Cb 0.00 -0.98 0.03 0.00 -1.56 0.00 0.00 34.95 32.44 1ykm s ARG 383 CO 0.00 0.25 0.08 0.08 -0.81 0.00 0.00 175.30 174.90 1ykm s VAL 384 N -0.81 3.73 0.36 7.11 1.01 0.16 -0.69 120.40 131.26 1ykm s VAL 384 Ca 0.02 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.03 1ykm s VAL 384 Cb -0.08 -3.06 -0.07 0.00 0.00 0.00 0.00 36.38 33.18 1ykm s VAL 384 CO 0.01 -0.09 0.01 0.68 0.00 0.00 0.00 175.10 175.72 1ykm s VAL 385 N 1.41 1.66 0.49 2.92 -7.23 -0.31 -0.98 120.40 118.37 1ykm s VAL 385 Ca -0.01 -2.03 0.06 0.00 -1.81 0.00 0.00 61.98 58.20 1ykm s VAL 385 Cb -0.19 -2.83 0.06 0.00 0.56 0.00 0.00 36.38 33.98 1ykm s VAL 385 CO 0.02 -0.05 0.52 -0.90 -0.31 0.00 0.00 175.10 174.38 1ykm n ASP 386 N -0.80 2.18 0.32 4.85 3.85 -0.37 -0.38 116.55 126.19 1ykm n ASP 386 Ca -0.04 -2.49 0.20 0.00 -0.71 0.00 0.00 54.79 51.75 1ykm n ASP 386 Cb 0.66 -0.20 1.06 0.00 -1.35 0.00 0.00 41.12 41.29 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 -0.00 0.11 4.20 -1.45 -1.33 115.11 116.64 1ykm h GLN 387 Ca -0.27 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.44 1ykm h GLN 387 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1ykm h GLN 387 CO 0.40 0.01 -0.25 0.66 -0.67 0.00 0.00 178.83 178.98 1ykm n TYR 388 N -3.27 0.00 -0.33 2.96 4.02 -1.26 -4.92 117.16 114.35 1ykm n TYR 388 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.87 1ykm n TYR 388 Cb 0.12 -0.23 0.00 0.00 -0.02 0.00 0.00 39.34 39.20 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 0.67 3.72 2.72 0.00 -0.50 -5.06 105.19 108.14 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 -0.67 4.48 0.63 1.61 2.20 -1.26 -4.74 119.74 121.99 1ykm s LYS 390 Ca 0.00 1.76 -0.18 0.00 -0.36 0.00 0.00 55.97 57.19 1ykm s LYS 390 Cb 0.00 -3.32 -0.02 0.00 -1.51 0.00 0.00 37.83 32.98 1ykm s LYS 390 CO 0.00 -0.16 1.20 -2.14 -0.36 0.00 0.00 175.35 173.89 1ykm s PRO 391 N 0.59 2.80 -0.55 4.03 0.02 -1.26 -1.23 135.00 139.39 1ykm s PRO 391 Ca 0.56 1.76 -0.04 0.00 0.02 0.00 0.00 61.00 63.30 1ykm s PRO 391 Cb -0.30 -1.91 0.14 0.00 0.02 0.00 0.00 34.50 32.45 1ykm s PRO 391 CO 0.31 -1.33 0.37 0.08 -0.33 0.00 0.00 177.00 176.11 1ykm s VAL 392 N -1.75 3.76 0.52 3.83 1.01 -0.15 -4.83 120.40 122.79 1ykm s VAL 392 Ca 0.76 -2.49 -0.14 0.00 0.00 0.00 0.00 61.98 60.11 1ykm s VAL 392 Cb -0.29 -3.48 -0.07 0.00 0.00 0.00 0.00 36.38 32.54 1ykm s VAL 392 CO 0.36 -0.82 0.95 -2.16 0.00 0.00 0.00 175.10 173.43 1ykm s PRO 393 N 0.52 3.82 -1.43 2.72 0.04 -1.26 -4.30 135.00 135.11 1ykm s PRO 393 Ca 0.13 0.79 -0.01 0.00 0.04 0.00 0.00 61.00 61.95 1ykm s PRO 393 Cb -0.21 -2.18 0.01 0.00 0.04 0.00 0.00 34.50 32.16 1ykm s PRO 393 CO -0.04 -0.29 0.42 0.09 0.04 0.00 0.00 177.00 177.22 1ykm n ASN 394 N -1.83 -0.43 -4.67 6.66 4.13 -0.97 -4.97 115.26 113.17 1ykm n ASN 394 Ca 0.05 -1.02 -0.26 0.00 1.68 0.00 0.00 54.58 55.03 1ykm n ASN 394 Cb 0.54 -2.98 -0.07 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 -3.94 3.76 -0.22 3.41 -1.32 -1.26 -4.51 115.64 111.55 1ykm s THR 395 Ca 0.05 -1.43 -0.17 0.00 -1.21 0.00 0.00 61.69 58.93 1ykm s THR 395 Cb -0.02 -2.90 -0.04 0.00 -1.51 0.00 0.00 72.50 68.03 1ykm s THR 395 CO 0.89 -0.13 0.44 -0.22 -2.21 0.00 0.00 174.62 173.40 1ykm s LEU 396 N -3.01 4.12 -0.24 9.08 2.96 -1.26 -1.43 118.68 128.90 1ykm s LEU 396 Ca 0.28 0.52 -0.00 0.00 -0.22 0.00 0.00 54.13 54.70 1ykm s LEU 396 Cb -0.09 -2.57 0.03 0.00 0.50 0.00 0.00 46.19 44.06 1ykm s LEU 396 CO 0.19 -0.15 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.28 1ykm s VAL 397 N 1.67 2.58 0.05 1.68 1.01 -1.26 -1.75 120.40 124.38 1ykm s VAL 397 Ca 0.20 -1.11 0.07 0.00 0.00 0.00 0.00 61.98 61.13 1ykm s VAL 397 Cb -0.15 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 1ykm s VAL 397 CO 0.09 0.23 -0.16 -1.61 0.00 0.00 0.00 175.10 173.65 1ykm s GLU 398 N 1.28 2.10 -0.02 2.72 2.02 0.38 -4.36 118.70 122.81 1ykm s GLU 398 Ca -0.00 -0.98 -0.09 0.00 0.02 0.00 0.00 54.97 53.92 1ykm s GLU 398 Cb -0.16 -2.23 0.01 0.00 0.10 0.00 0.00 34.13 31.85 1ykm s GLU 398 CO -0.06 0.54 0.20 0.00 0.02 0.00 0.00 175.26 175.95 1ykm s MET 399 N -1.62 0.46 0.01 1.61 0.23 0.26 -0.29 119.30 119.95 1ykm s MET 399 Ca 0.16 -0.16 -0.03 0.00 -1.03 0.00 0.00 55.69 54.64 1ykm s MET 399 Cb -0.11 0.20 -0.01 0.00 -1.53 0.00 0.00 34.83 33.38 1ykm s MET 399 CO 0.07 -0.10 0.05 1.67 -2.03 0.00 0.00 175.02 174.67 1ykm s TRP 400 N -0.94 0.12 0.37 3.16 -2.14 -0.91 -0.82 118.94 117.78 1ykm s TRP 400 Ca -0.10 -0.26 -0.10 0.00 2.66 0.00 0.00 56.10 58.30 1ykm s TRP 400 Cb -0.05 -0.10 0.04 0.00 -3.10 0.00 0.00 33.47 30.26 1ykm s TRP 400 CO 0.02 -0.20 0.66 0.00 -2.66 0.00 0.00 176.95 174.77 1ykm n GLN 401 N 1.81 0.95 -2.80 3.25 10.64 -0.95 -0.83 117.38 129.45 1ykm n GLN 401 Ca -0.21 -2.35 -0.21 0.00 -1.83 0.00 0.00 57.00 52.39 1ykm n GLN 401 Cb 0.56 2.67 0.07 0.00 -0.86 0.00 0.00 30.24 32.68 1ykm n GLN 401 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ykm s ALA 402 N -2.29 4.18 0.53 2.61 0.00 -1.26 -4.67 121.76 120.87 1ykm s ALA 402 Ca 0.20 -1.83 -0.00 0.00 0.00 0.00 0.00 51.96 50.33 1ykm s ALA 402 Cb -0.03 -1.78 0.00 0.00 0.00 0.00 0.00 23.12 21.31 1ykm s ALA 402 CO 0.15 -1.03 0.03 0.27 0.00 0.00 0.00 175.76 175.17 1ykm n ASN 403 N -2.45 0.03 0.30 0.00 0.23 -0.62 -4.50 115.26 108.24 1ykm n ASN 403 Ca 0.14 -1.03 0.20 0.00 -0.53 0.00 0.00 54.58 53.36 1ykm n ASN 403 Cb 0.61 -0.02 1.06 0.00 -2.08 0.00 0.00 39.78 39.34 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 -0.80 1.00 0.00 -2.53 0.00 -1.76 -0.89 119.26 114.27 1ykm h ALA 404 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ykm h ALA 404 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1ykm h ALA 404 CO 0.01 0.00 -1.32 0.41 0.00 0.00 0.00 179.25 178.35 1ykm n GLY 405 N -1.07 -0.92 0.00 0.00 0.00 -1.26 -3.77 105.19 98.17 1ykm n GLY 405 Ca -0.02 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 1.42 1.07 3.71 -0.02 0.00 -0.92 -4.66 105.19 105.79 1ykm n GLY 406 Ca 0.01 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.83 4.28 -0.11 1.61 6.06 -1.26 -4.72 118.95 123.97 1ykm s ARG 407 Ca 0.00 0.32 -0.05 0.00 -2.50 0.00 0.00 55.73 53.49 1ykm s ARG 407 Cb 0.00 -3.47 -0.04 0.00 0.06 0.00 0.00 34.95 31.51 1ykm s ARG 407 CO 0.00 0.11 0.09 -1.21 -2.50 0.00 0.00 175.30 171.79 1ykm s GLU 408 N 0.82 3.31 -1.24 5.12 2.02 -1.26 -1.59 118.70 125.88 1ykm s GLU 408 Ca 0.22 -0.24 -0.20 0.00 0.02 0.00 0.00 54.97 54.78 1ykm s GLU 408 Cb -0.15 -3.06 -0.01 0.00 0.10 0.00 0.00 34.13 31.02 1ykm s GLU 408 CO 0.08 0.72 1.85 -2.13 0.02 0.00 0.00 175.26 175.80 1ykm n ARG 409 N 2.13 2.47 -3.69 1.61 0.63 -1.26 -4.76 116.66 113.79 1ykm n ARG 409 Ca -0.19 -2.87 -0.14 0.00 -0.92 0.00 0.00 57.85 53.73 1ykm n ARG 409 Cb 0.54 -3.56 -0.08 0.00 0.45 0.00 0.00 32.46 29.81 1ykm n ARG 409 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1ykm s HIS 410 N 7.01 -0.39 0.47 -0.14 2.46 -1.26 -5.07 115.29 118.37 1ykm s HIS 410 Ca 0.60 0.74 0.17 0.00 0.47 0.00 0.00 55.06 57.04 1ykm s HIS 410 Cb 0.03 0.20 1.16 0.00 -0.13 0.00 0.00 32.58 33.83 1ykm s HIS 410 CO 0.10 -0.41 2.05 0.87 -2.47 0.00 0.00 174.74 174.88 1ykm h LYS 411 N 4.05 0.00 0.00 2.88 6.56 -2.07 -2.92 116.57 125.07 1ykm h LYS 411 Ca -0.28 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.31 1ykm h LYS 411 Cb 1.17 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.83 1ykm h LYS 411 CO 0.35 0.13 -0.22 0.09 -2.06 0.00 0.00 179.45 177.73 1ykm n ASN 412 N -4.27 0.27 -4.49 0.86 5.03 -1.26 -4.71 115.26 106.69 1ykm n ASN 412 Ca -0.03 0.21 -0.43 0.00 0.87 0.00 0.00 54.58 55.21 1ykm n ASN 412 Cb 0.20 -0.20 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 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 -3.17 6.21 -0.30 6.41 2.15 -1.10 -4.88 116.67 121.99 1ykm s ASP 413 Ca 0.12 -0.72 0.11 0.00 0.43 0.00 0.00 52.55 52.49 1ykm s ASP 413 Cb 0.18 -2.46 0.68 0.00 -0.30 0.00 0.00 42.92 41.02 1ykm s ASP 413 CO 0.61 -1.48 1.71 0.54 -0.17 0.00 0.00 175.17 176.38 1ykm n ARG 414 N 8.03 3.30 -2.19 4.34 5.12 -1.26 -4.91 116.66 129.10 1ykm n ARG 414 Ca -0.01 -3.07 -0.41 0.00 -1.93 0.00 0.00 57.85 52.43 1ykm n ARG 414 Cb 0.47 -2.11 -0.03 0.00 -1.16 0.00 0.00 32.46 29.63 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 -3.02 3.21 -0.51 -1.55 5.04 -1.26 -4.92 117.35 114.33 1ykm s TYR 415 Ca 0.52 1.25 0.12 0.00 -2.44 0.00 0.00 57.07 56.51 1ykm s TYR 415 Cb 0.42 -3.63 0.65 0.00 0.35 0.00 0.00 41.96 39.75 1ykm s TYR 415 CO 0.11 -1.93 1.35 1.47 -1.34 0.00 0.00 175.55 175.22 1ykm n LEU 416 N 2.24 0.31 -4.70 6.97 -0.00 -1.26 -4.67 117.00 115.89 1ykm n LEU 416 Ca 0.05 0.63 -0.42 0.00 -0.00 0.00 0.00 56.01 56.27 1ykm n LEU 416 Cb 0.42 -0.67 -0.03 0.00 -0.00 0.00 0.00 43.42 43.15 1ykm n LEU 416 CO 0.58 -0.74 1.00 0.00 -0.00 0.00 0.00 177.39 178.24 1ykm s ALA 417 N -3.29 3.51 0.94 1.47 0.00 -1.26 -4.99 121.76 118.14 1ykm s ALA 417 Ca -0.01 0.89 -0.11 0.00 0.00 0.00 0.00 51.96 52.73 1ykm s ALA 417 Cb 0.03 -3.52 0.16 0.00 0.00 0.00 0.00 23.12 19.79 1ykm s ALA 417 CO 0.11 -0.66 1.09 -1.25 0.00 0.00 0.00 175.76 175.05 1ykm s PRO 418 N 1.61 0.86 0.37 0.00 0.04 -1.26 -4.72 135.00 131.91 1ykm s PRO 418 Ca 0.61 1.08 -0.16 0.00 0.04 0.00 0.00 61.00 62.58 1ykm s PRO 418 Cb -0.31 -1.74 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 1ykm s PRO 418 CO 0.28 -2.59 0.81 -0.51 0.04 0.00 0.00 177.00 175.03 1ykm s LEU 419 N -6.50 3.97 -0.37 -3.56 1.43 -1.26 -4.74 118.68 107.64 1ykm s LEU 419 Ca 0.65 1.39 -0.13 0.00 -1.03 0.00 0.00 54.13 55.01 1ykm s LEU 419 Cb -0.21 -4.22 0.01 0.00 0.03 0.00 0.00 46.19 41.79 1ykm s LEU 419 CO 0.59 -0.30 0.25 -0.62 0.23 0.00 0.00 176.35 176.50 1ykm s ASP 420 N -2.42 5.97 0.08 2.29 -1.08 -1.26 -4.97 116.67 115.29 1ykm s ASP 420 Ca 0.56 -0.71 0.05 0.00 -0.52 0.00 0.00 52.55 51.94 1ykm s ASP 420 Cb -0.10 -2.11 0.28 0.00 -1.46 0.00 0.00 42.92 39.53 1ykm s ASP 420 CO 0.19 -0.34 1.14 -0.81 0.52 0.00 0.00 175.17 175.88 1ykm n PRO 421 N 5.10 0.03 -0.16 4.34 -0.04 -1.26 -1.60 135.00 141.41 1ykm n PRO 421 Ca -0.12 0.52 0.05 0.00 -0.04 0.00 0.00 63.50 63.91 1ykm n PRO 421 Cb 0.48 -1.63 0.14 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.67 2.84 -3.96 3.54 4.13 -1.26 -4.50 115.26 114.38 1ykm n ASN 422 Ca -0.00 -2.07 -0.26 0.00 1.68 0.00 0.00 54.58 53.93 1ykm n ASN 422 Cb 0.03 -0.22 -0.17 0.00 -1.54 0.00 0.00 39.78 37.88 1ykm n ASN 422 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1ykm s PHE 423 N -1.12 1.52 -0.25 3.10 2.19 -0.63 -4.26 117.98 118.54 1ykm s PHE 423 Ca 0.21 -0.69 -0.17 0.00 0.33 0.00 0.00 56.93 56.61 1ykm s PHE 423 Cb 0.12 -1.19 -0.14 0.00 -1.31 0.00 0.00 43.02 40.49 1ykm s PHE 423 CO 0.13 -0.43 -0.15 0.41 1.83 0.00 0.00 175.22 177.01 1ykm n GLY 424 N 4.48 -0.61 0.81 13.12 0.00 -1.26 -4.72 105.19 117.00 1ykm n GLY 424 Ca -0.17 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 1.34 1.32 3.03 -0.02 0.00 -1.26 -4.56 105.19 105.03 1ykm n GLY 425 Ca -0.43 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.02 0.97 0.01 1.61 1.01 -1.26 -2.25 120.40 118.48 1ykm s VAL 426 Ca 0.00 -0.44 -0.14 0.00 0.00 0.00 0.00 61.98 61.40 1ykm s VAL 426 Cb 0.00 -0.87 0.02 0.00 0.00 0.00 0.00 36.38 35.54 1ykm s VAL 426 CO 0.00 0.30 0.31 -0.83 0.00 0.00 0.00 175.10 174.88 1ykm s GLY 427 N 0.30 -0.14 0.24 4.51 0.00 -0.01 -4.75 107.32 107.48 1ykm s GLY 427 Ca -0.06 0.19 -0.07 0.00 0.00 0.00 0.00 44.72 44.77 1ykm s GLY 427 CO 0.01 -0.03 0.35 1.09 0.00 0.00 0.00 173.10 174.53 1ykm s ARG 428 N -1.84 1.46 -0.02 2.90 1.70 -0.94 -0.58 118.95 121.63 1ykm s ARG 428 Ca -0.10 -1.44 0.00 0.00 -0.47 0.00 0.00 55.73 53.72 1ykm s ARG 428 Cb -0.03 0.39 0.02 0.00 -0.57 0.00 0.00 34.95 34.76 1ykm s ARG 428 CO 0.01 -0.57 0.02 -1.17 -1.08 0.00 0.00 175.30 172.51 1ykm s LEU 430 N -3.09 1.36 0.52 -1.89 2.96 -1.26 -3.08 118.68 114.19 1ykm s LEU 430 Ca 0.29 0.02 -0.20 0.00 -0.22 0.00 0.00 54.13 54.02 1ykm s LEU 430 Cb 0.02 -0.08 -0.06 0.00 0.50 0.00 0.00 46.19 46.57 1ykm s LEU 430 CO 0.11 -0.09 1.12 0.42 -1.32 0.00 0.00 176.35 176.60 1ykm s THR 431 N 0.75 3.23 0.00 3.68 -4.23 -0.52 -4.90 115.64 113.66 1ykm s THR 431 Ca -0.06 0.80 0.00 0.00 -1.18 0.00 0.00 61.69 61.25 1ykm s THR 431 Cb -0.09 -3.34 0.00 0.00 1.34 0.00 0.00 72.50 70.41 1ykm s THR 431 CO -0.02 -0.13 0.00 -0.90 -0.54 0.00 0.00 174.62 173.03 1ykm n ASP 432 N -1.08 -0.20 0.30 3.99 5.68 -0.75 -2.30 116.55 122.19 1ykm n ASP 432 Ca 0.10 -0.81 0.20 0.00 -0.50 0.00 0.00 54.79 53.78 1ykm n ASP 432 Cb 0.51 0.00 0.96 0.00 -1.14 0.00 0.00 41.12 41.44 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 -0.20 0.00 -0.47 -1.12 0.02 -1.95 -2.42 113.55 107.41 1ykm h SER 433 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1ykm h SER 433 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1ykm h SER 433 CO 0.00 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.16 1ykm n ASP 434 N -2.99 3.33 0.00 3.07 8.00 -1.26 -4.67 116.55 122.02 1ykm n ASP 434 Ca -0.01 -2.06 0.00 0.00 0.71 0.00 0.00 54.79 53.43 1ykm n ASP 434 Cb 0.16 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 40.93 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 0.82 0.70 3.78 0.44 0.00 -0.91 -4.75 105.19 105.27 1ykm n GLY 435 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.63 3.77 0.19 1.61 1.51 -1.26 -0.67 117.35 119.87 1ykm s TYR 436 Ca 0.00 1.66 0.03 0.00 -1.01 0.00 0.00 57.07 57.75 1ykm s TYR 436 Cb 0.00 -2.81 -0.05 0.00 -0.11 0.00 0.00 41.96 38.99 1ykm s TYR 436 CO 0.00 0.35 -0.03 1.52 -1.11 0.00 0.00 175.55 176.28 1ykm s TYR 437 N -1.42 1.39 -0.24 2.71 -0.85 -0.62 -1.81 117.35 116.51 1ykm s TYR 437 Ca 0.44 -0.91 -0.21 0.00 -0.52 0.00 0.00 57.07 55.87 1ykm s TYR 437 Cb -0.20 -0.78 0.06 0.00 0.38 0.00 0.00 41.96 41.42 1ykm s TYR 437 CO 0.25 -0.06 0.64 -1.54 -1.52 0.00 0.00 175.55 173.32 1ykm s SER 438 N -3.24 -0.69 0.05 -0.18 1.04 -1.26 -2.59 113.70 106.83 1ykm s SER 438 Ca 0.24 1.30 0.03 0.00 0.48 0.00 0.00 55.95 58.00 1ykm s SER 438 Cb 0.05 1.29 -0.02 0.00 0.10 0.00 0.00 66.02 67.44 1ykm s SER 438 CO 0.05 -0.22 -0.10 -0.36 0.98 0.00 0.00 173.24 173.59 1ykm s PHE 439 N 0.50 0.90 -0.17 5.02 0.40 0.41 -4.92 117.98 120.12 1ykm s PHE 439 Ca -0.01 -0.44 0.01 0.00 -0.60 0.00 0.00 56.93 55.88 1ykm s PHE 439 Cb -0.05 -0.52 0.03 0.00 0.51 0.00 0.00 43.02 42.99 1ykm s PHE 439 CO -0.02 -0.02 -0.14 0.50 0.70 0.00 0.00 175.22 176.25 1ykm s ARG 440 N -1.49 2.31 0.12 0.44 3.52 -1.02 -0.53 118.95 122.30 1ykm s ARG 440 Ca -0.05 -0.68 -0.01 0.00 -0.13 0.00 0.00 55.73 54.85 1ykm s ARG 440 Cb -0.09 -2.26 0.01 0.00 -1.56 0.00 0.00 34.95 31.04 1ykm s ARG 440 CO 0.01 -0.29 0.18 -2.37 -0.81 0.00 0.00 175.30 172.02 1ykm n THR 441 N 4.72 0.00 -4.09 4.11 5.66 -0.49 -0.53 114.28 123.66 1ykm n THR 441 Ca -0.17 -0.55 -0.30 0.00 -3.05 0.00 0.00 64.05 59.99 1ykm n THR 441 Cb 0.49 0.36 -0.07 0.00 -1.55 0.00 0.00 70.33 69.56 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 -2.59 4.28 -0.12 1.09 -4.36 -1.26 -0.61 121.20 117.64 1ykm s ILE 442 Ca 0.09 -0.93 -0.29 0.00 -0.26 0.00 0.00 60.65 59.26 1ykm s ILE 442 Cb -0.01 -3.08 -0.04 0.00 1.25 0.00 0.00 42.46 40.59 1ykm s ILE 442 CO 0.06 0.08 1.55 -0.75 0.24 0.00 0.00 174.94 176.13 1ykm s LYS 443 N -2.48 4.10 0.57 0.37 2.20 -0.04 -4.90 119.74 119.57 1ykm s LYS 443 Ca 0.28 1.94 -0.19 0.00 -0.36 0.00 0.00 55.97 57.64 1ykm s LYS 443 Cb -0.12 -3.95 -0.05 0.00 -1.51 0.00 0.00 37.83 32.21 1ykm s LYS 443 CO 0.21 -0.92 1.17 -1.25 -0.36 0.00 0.00 175.35 174.20 1ykm s PRO 444 N 4.06 3.16 0.29 4.03 0.04 -1.26 -4.35 135.00 140.97 1ykm s PRO 444 Ca 0.68 1.73 0.04 0.00 0.04 0.00 0.00 61.00 63.49 1ykm s PRO 444 Cb -0.29 -1.97 -0.03 0.00 0.04 0.00 0.00 34.50 32.26 1ykm s PRO 444 CO 0.26 -1.03 0.44 0.20 0.04 0.00 0.00 177.00 176.91 1ykm s GLY 445 N -1.67 1.31 0.78 0.56 0.00 -0.39 -4.63 107.32 103.28 1ykm s GLY 445 Ca 0.75 -1.16 -0.11 0.00 0.00 0.00 0.00 44.72 44.21 1ykm s GLY 445 CO 0.30 -1.13 1.09 -4.14 0.00 0.00 0.00 173.10 169.22 1ykm s PRO 446 N -4.13 2.21 0.00 2.90 0.02 -1.26 -3.93 135.00 130.81 1ykm s PRO 446 Ca 0.38 1.13 -0.12 0.00 0.02 0.00 0.00 61.00 62.40 1ykm s PRO 446 Cb -0.09 -1.89 0.01 0.00 0.02 0.00 0.00 34.50 32.55 1ykm s PRO 446 CO 0.32 -1.67 0.25 1.52 -0.33 0.00 0.00 177.00 177.09 1ykm s TYR 447 N -2.92 -0.09 0.62 6.54 -0.85 -1.17 -4.10 117.35 115.38 1ykm s TYR 447 Ca 0.61 0.07 -0.04 0.00 -0.52 0.00 0.00 57.07 57.19 1ykm s TYR 447 Cb -0.17 0.05 0.03 0.00 0.38 0.00 0.00 41.96 42.25 1ykm s TYR 447 CO 0.56 -0.38 0.90 -1.25 -1.52 0.00 0.00 175.55 173.86 1ykm s PRO 448 N -1.60 2.58 -0.01 -3.49 0.04 -1.26 -0.83 135.00 130.43 1ykm s PRO 448 Ca -0.12 -0.28 -0.27 0.00 0.04 0.00 0.00 61.00 60.37 1ykm s PRO 448 Cb -0.05 -2.29 0.06 0.00 0.04 0.00 0.00 34.50 32.26 1ykm s PRO 448 CO 0.02 -0.88 0.60 1.67 0.04 0.00 0.00 177.00 178.45 1ykm s TRP 449 N -3.01 -0.55 -1.34 0.56 1.48 -1.18 -4.88 118.94 110.01 1ykm s TRP 449 Ca 0.56 0.83 -0.17 0.00 -1.06 0.00 0.00 56.10 56.27 1ykm s TRP 449 Cb -0.11 0.38 0.06 0.00 -1.16 0.00 0.00 33.47 32.64 1ykm s TRP 449 CO 0.43 -0.62 1.88 0.54 -4.06 0.00 0.00 176.95 175.12 1ykm n ARG 450 N 0.71 3.08 0.00 3.25 1.74 -1.26 -4.47 116.66 119.70 1ykm n ARG 450 Ca -0.19 -3.08 0.00 0.00 -0.77 0.00 0.00 57.85 53.81 1ykm n ARG 450 Cb 0.58 -3.44 0.00 0.00 -1.02 0.00 0.00 32.46 28.58 1ykm n ARG 450 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1ykm n ASN 451 N 7.85 0.00 -4.64 0.55 5.15 -1.26 -5.05 115.26 117.86 1ykm n ASN 451 Ca 0.50 0.00 -0.27 0.00 -0.60 0.00 0.00 54.58 54.21 1ykm n ASN 451 Cb 0.44 0.00 0.11 0.00 -0.53 0.00 0.00 39.78 39.80 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 -0.67 1.73 0.56 8.20 0.00 -1.26 -4.97 107.32 110.90 1ykm s GLY 452 Ca 0.00 -1.18 0.32 0.00 0.00 0.00 0.00 44.72 43.86 1ykm s GLY 452 CO 0.00 -0.63 2.11 -2.55 0.00 0.00 0.00 173.10 172.04 1ykm h PRO 453 N -0.91 0.00 -0.96 2.90 0.11 -1.98 -3.30 132.00 127.87 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 1.28 0.00 -0.38 0.00 0.11 0.00 0.00 31.00 32.01 1ykm h PRO 453 CO 0.49 0.07 -1.13 -1.71 -0.21 0.00 0.00 178.00 175.51 1ykm n ASN 454 N -3.42 1.15 -4.80 -2.05 5.15 -1.26 -5.09 115.26 104.95 1ykm n ASN 454 Ca -0.02 -2.70 -0.38 0.00 -0.60 0.00 0.00 54.58 50.88 1ykm n ASN 454 Cb 0.22 -0.41 -0.06 0.00 -0.53 0.00 0.00 39.78 39.00 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 -2.95 6.78 -0.08 1.20 1.01 -1.25 -5.08 116.67 116.31 1ykm s ASP 455 Ca 0.27 0.92 0.01 0.00 0.71 0.00 0.00 52.55 54.46 1ykm s ASP 455 Cb 0.45 -2.27 0.02 0.00 1.01 0.00 0.00 42.92 42.13 1ykm s ASP 455 CO 0.03 0.22 -0.09 0.26 0.21 0.00 0.00 175.17 175.80 1ykm s TRP 456 N -0.53 1.32 0.08 4.23 0.52 -1.26 -3.11 118.94 120.18 1ykm s TRP 456 Ca 0.24 -0.55 -0.30 0.00 0.02 0.00 0.00 56.10 55.52 1ykm s TRP 456 Cb -0.16 -1.06 -0.05 0.00 -1.15 0.00 0.00 33.47 31.05 1ykm s TRP 456 CO 0.12 -0.36 1.07 1.03 0.02 0.00 0.00 176.95 178.84 1ykm s ARG 457 N 1.18 4.55 0.86 4.98 1.81 -0.01 -4.73 118.95 127.58 1ykm s ARG 457 Ca -0.05 1.60 -0.11 0.00 -1.72 0.00 0.00 55.73 55.45 1ykm s ARG 457 Cb -0.14 -3.37 0.10 0.00 -0.45 0.00 0.00 34.95 31.09 1ykm s ARG 457 CO -0.02 -0.05 1.09 -1.25 -0.68 0.00 0.00 175.30 174.39 1ykm s PRO 458 N 0.56 1.60 -0.03 3.54 0.04 -1.26 -3.04 135.00 136.41 1ykm s PRO 458 Ca 0.53 0.78 -0.33 0.00 0.04 0.00 0.00 61.00 62.03 1ykm s PRO 458 Cb -0.26 -1.85 -0.11 0.00 0.04 0.00 0.00 34.50 32.32 1ykm s PRO 458 CO 0.30 -2.00 1.90 0.00 0.04 0.00 0.00 177.00 177.24 1ykm n ALA 459 N -3.71 1.19 -2.63 8.56 0.00 -1.26 -4.77 120.51 117.89 1ykm n ALA 459 Ca 0.07 0.27 -0.09 0.00 0.00 0.00 0.00 53.44 53.69 1ykm n ALA 459 Cb 0.55 -2.56 -0.08 0.00 0.00 0.00 0.00 19.45 17.37 1ykm n ALA 459 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1ykm s HIS 460 N 3.99 0.14 -0.12 0.00 -3.43 -1.26 -3.95 115.29 110.65 1ykm s HIS 460 Ca 0.90 -0.51 0.01 0.00 -0.80 0.00 0.00 55.06 54.66 1ykm s HIS 460 Cb -0.60 -0.07 0.02 0.00 -1.43 0.00 0.00 32.58 30.50 1ykm s HIS 460 CO 0.47 -0.50 -0.14 0.42 -2.00 0.00 0.00 174.74 173.00 1ykm s ILE 461 N -3.45 1.47 0.27 -5.38 1.01 -1.02 -4.55 121.20 109.54 1ykm s ILE 461 Ca 0.02 -0.59 -0.29 0.00 0.00 0.00 0.00 60.65 59.78 1ykm s ILE 461 Cb 0.03 -1.37 -0.09 0.00 0.01 0.00 0.00 42.46 41.04 1ykm s ILE 461 CO -0.09 0.44 1.02 -1.00 0.00 0.00 0.00 174.94 175.31 1ykm s HIS 462 N 1.26 3.76 0.10 3.97 3.76 -0.01 -1.08 115.29 127.05 1ykm s HIS 462 Ca -0.01 1.80 0.08 0.00 -0.15 0.00 0.00 55.06 56.79 1ykm s HIS 462 Cb -0.14 -3.13 -0.04 0.00 1.11 0.00 0.00 32.58 30.39 1ykm s HIS 462 CO -0.06 -0.06 -0.21 -0.06 -0.85 0.00 0.00 174.74 173.49 1ykm s PHE 463 N -1.21 1.84 -0.07 1.40 0.40 -0.29 -2.13 117.98 117.92 1ykm s PHE 463 Ca 0.44 -0.41 -0.02 0.00 -0.60 0.00 0.00 56.93 56.33 1ykm s PHE 463 Cb -0.28 -1.01 0.03 0.00 0.51 0.00 0.00 43.02 42.27 1ykm s PHE 463 CO 0.36 0.22 0.04 0.20 0.70 0.00 0.00 175.22 176.73 1ykm s GLY 464 N -1.92 0.34 -0.09 4.36 0.00 0.60 -1.29 107.32 109.32 1ykm s GLY 464 Ca 0.07 -0.01 0.04 0.00 0.00 0.00 0.00 44.72 44.82 1ykm s GLY 464 CO 0.04 1.32 -0.23 -0.42 0.00 0.00 0.00 173.10 173.82 1ykm s ILE 465 N 2.08 1.94 -0.10 0.90 1.09 0.48 -0.47 121.20 127.10 1ykm s ILE 465 Ca 0.04 -0.95 -0.05 0.00 -1.10 0.00 0.00 60.65 58.59 1ykm s ILE 465 Cb -0.13 -1.68 -0.04 0.00 -1.06 0.00 0.00 42.46 39.55 1ykm s ILE 465 CO -0.05 0.53 0.14 0.77 -0.10 0.00 0.00 174.94 176.23 1ykm h SER 466 N 6.69 -0.01 -4.15 3.58 4.64 -1.63 -0.85 113.55 121.82 1ykm h SER 466 Ca -0.22 -0.16 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 1ykm h SER 466 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1ykm h SER 466 CO 0.47 0.57 0.00 0.61 -0.87 0.00 0.00 176.83 177.61 1ykm n GLY 467 N 1.72 -2.50 0.04 -0.77 0.00 -1.26 -2.67 105.19 99.75 1ykm n GLY 467 Ca -0.02 -1.61 0.10 0.00 0.00 0.00 0.00 46.02 44.49 1ykm n GLY 467 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ykm n PRO 468 N -0.70 0.07 -4.01 1.61 -0.04 -1.26 -4.86 135.00 125.80 1ykm n PRO 468 Ca 0.00 0.24 -0.11 0.00 -0.04 0.00 0.00 63.50 63.59 1ykm n PRO 468 Cb 0.00 -1.61 -0.04 0.00 -0.04 0.00 0.00 33.50 31.81 1ykm n PRO 468 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1ykm s SER 469 N -3.41 0.20 0.15 3.54 1.04 -1.26 -3.44 113.70 110.52 1ykm s SER 469 Ca 0.08 -1.12 0.25 0.00 0.48 0.00 0.00 55.95 55.64 1ykm s SER 469 Cb 0.11 0.62 0.93 0.00 0.10 0.00 0.00 66.02 67.78 1ykm s SER 469 CO 0.37 -1.22 1.77 2.30 0.98 0.00 0.00 173.24 177.44 1ykm n ILE 470 N -0.44 0.55 0.11 -1.02 -5.35 -1.04 -2.42 119.36 109.75 1ykm n ILE 470 Ca -0.01 -0.06 -0.02 0.00 -0.27 0.00 0.00 62.75 62.39 1ykm n ILE 470 Cb 0.62 -0.73 0.04 0.00 -1.74 0.00 0.00 39.64 37.83 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 2.57 0.65 0.00 -1.28 0.00 -1.83 -3.23 119.26 116.14 1ykm h ALA 471 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.25 1ykm h ALA 471 Cb 0.56 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1ykm h ALA 471 CO 0.00 0.91 -0.87 0.25 0.00 0.00 0.00 179.25 179.54 1ykm n THR 472 N -3.46 0.38 -1.60 0.00 -2.24 -1.01 -4.95 114.28 101.39 1ykm n THR 472 Ca 0.00 -0.35 -0.51 0.00 -2.27 0.00 0.00 64.05 60.92 1ykm n THR 472 Cb 0.76 -0.10 -0.05 0.00 -2.10 0.00 0.00 70.33 68.84 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 -2.24 1.34 -3.78 -0.78 3.00 -1.09 -4.76 118.16 109.86 1ykm n LYS 473 Ca 0.02 0.48 -0.13 0.00 -0.00 0.00 0.00 58.31 58.69 1ykm n LYS 473 Cb 0.47 -2.14 -0.11 0.00 0.00 0.00 0.00 35.03 33.25 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 0.57 0.97 -0.09 3.14 2.96 -0.32 -5.03 118.68 120.87 1ykm s LEU 474 Ca 0.82 0.53 0.04 0.00 -0.22 0.00 0.00 54.13 55.31 1ykm s LEU 474 Cb -0.89 0.91 -0.00 0.00 0.50 0.00 0.00 46.19 46.70 1ykm s LEU 474 CO 0.46 -0.09 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.52 1ykm s ILE 475 N 0.18 2.03 0.05 6.68 1.01 -1.26 -0.39 121.20 129.50 1ykm s ILE 475 Ca -0.00 -1.01 0.01 0.00 0.00 0.00 0.00 60.65 59.64 1ykm s ILE 475 Cb -0.02 -1.75 -0.00 0.00 0.01 0.00 0.00 42.46 40.69 1ykm s ILE 475 CO 0.00 0.55 0.05 1.07 0.00 0.00 0.00 174.94 176.61 1ykm n THR 476 N 3.47 0.00 -4.04 2.92 5.66 -0.41 -5.00 114.28 116.88 1ykm n THR 476 Ca -0.19 -0.30 -0.17 0.00 -3.05 0.00 0.00 64.05 60.34 1ykm n THR 476 Cb 0.53 0.16 -0.16 0.00 -1.55 0.00 0.00 70.33 69.31 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 -2.15 0.46 0.01 1.09 -0.21 -1.26 -1.14 119.66 116.46 1ykm s GLN 477 Ca 0.05 -0.03 -0.18 0.00 0.02 0.00 0.00 55.36 55.22 1ykm s GLN 477 Cb 0.00 -0.55 -0.06 0.00 1.00 0.00 0.00 33.01 33.40 1ykm s GLN 477 CO 0.03 -0.07 0.52 -1.17 -2.12 0.00 0.00 175.29 172.49 1ykm s LEU 478 N 0.74 4.46 0.28 2.90 0.20 -0.24 -4.84 118.68 122.18 1ykm s LEU 478 Ca -0.08 1.11 0.11 0.00 0.69 0.00 0.00 54.13 55.96 1ykm s LEU 478 Cb -0.11 -2.79 -0.05 0.00 -0.43 0.00 0.00 46.19 42.80 1ykm s LEU 478 CO -0.01 0.22 -0.17 -0.31 -0.29 0.00 0.00 176.35 175.79 1ykm s TYR 479 N -0.70 2.24 -0.07 5.38 1.51 0.58 -2.43 117.35 123.86 1ykm s TYR 479 Ca 0.28 -0.40 -0.04 0.00 -1.01 0.00 0.00 57.07 55.90 1ykm s TYR 479 Cb -0.18 -1.04 -0.04 0.00 -0.11 0.00 0.00 41.96 40.59 1ykm s TYR 479 CO 0.16 0.64 0.11 -0.06 -1.11 0.00 0.00 175.55 175.29 1ykm s PHE 480 N -2.59 3.44 0.02 2.71 0.40 -1.25 0.40 117.98 121.10 1ykm s PHE 480 Ca 0.30 0.36 -0.35 0.00 -0.60 0.00 0.00 56.93 56.64 1ykm s PHE 480 Cb -0.03 -1.85 -0.14 0.00 0.51 0.00 0.00 43.02 41.51 1ykm s PHE 480 CO 0.14 0.63 1.63 -1.91 0.70 0.00 0.00 175.22 176.41 1ykm n GLU 481 N 1.63 1.80 0.00 0.44 2.13 -0.67 -2.61 120.64 123.35 1ykm n GLU 481 Ca -0.16 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.31 1ykm n GLU 481 Cb 0.54 -2.41 0.00 0.00 0.27 0.00 0.00 31.44 29.84 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 3.59 2.52 3.56 8.31 0.00 -1.26 -5.00 105.19 116.91 1ykm n GLY 482 Ca 0.20 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.72 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 2.69 0.18 1.61 4.64 -1.07 -4.85 116.55 119.75 1ykm n ASP 483 Ca 0.00 0.60 0.13 0.00 -1.38 0.00 0.00 54.79 54.14 1ykm n ASP 483 Cb 0.00 -1.32 0.65 0.00 -1.04 0.00 0.00 41.12 39.40 1ykm n ASP 483 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1ykm h PRO 484 N 11.40 0.00 -0.00 -0.67 0.13 -1.94 -2.78 132.00 138.14 1ykm h PRO 484 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1ykm h PRO 484 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1ykm h PRO 484 CO 0.99 0.00 -0.18 1.28 -0.23 0.00 0.00 178.00 179.85 1ykm n LEU 485 N -2.39 0.24 -0.03 1.56 4.77 -1.26 -4.26 117.00 115.62 1ykm n LEU 485 Ca -0.01 0.25 -0.11 0.00 -0.03 0.00 0.00 56.01 56.12 1ykm n LEU 485 Cb 0.10 -0.36 -0.05 0.00 -2.33 0.00 0.00 43.42 40.77 1ykm n LEU 485 CO 0.14 0.05 0.86 0.40 -1.33 0.00 0.00 177.39 177.51 1ykm h ILE 486 N 0.08 1.13 0.00 -0.08 2.04 -1.88 -2.95 117.51 115.86 1ykm h ILE 486 Ca 0.00 -0.39 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1ykm h ILE 486 Cb 0.47 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 1ykm h ILE 486 CO 0.00 0.12 0.00 -0.81 0.00 0.00 0.00 178.15 177.46 1ykm n PRO 487 N -4.90 0.98 -0.00 2.37 -0.04 -1.26 -3.30 135.00 128.85 1ykm n PRO 487 Ca -0.05 0.00 0.06 0.00 -0.04 0.00 0.00 63.50 63.48 1ykm n PRO 487 Cb 0.10 -1.19 -0.09 0.00 -0.04 0.00 0.00 33.50 32.28 1ykm n PRO 487 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1ykm n MET 488 N -0.69 1.60 -2.75 0.54 2.81 -1.13 -4.98 117.12 112.52 1ykm n MET 488 Ca 0.09 -0.06 -0.42 0.00 -1.81 0.00 0.00 57.70 55.50 1ykm n MET 488 Cb 0.04 -1.21 -0.03 0.00 -0.71 0.00 0.00 33.22 31.31 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 7.23 0.00 -0.15 0.00 0.13 -1.91 -0.53 132.00 136.77 1ykm h PRO 490 Ca -0.28 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.64 1ykm h PRO 490 Cb 1.13 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.26 1ykm h PRO 490 CO 0.87 0.06 -0.75 0.82 -0.23 0.00 0.00 178.00 178.77 1ykm h ILE 491 N 0.00 1.30 -0.17 -3.56 2.04 -1.93 -2.53 117.51 112.67 1ykm h ILE 491 Ca -0.00 -1.99 -0.13 0.00 1.00 0.00 0.00 64.86 63.74 1ykm h ILE 491 Cb 0.27 1.98 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 1ykm h ILE 491 CO 0.01 0.62 -0.39 0.58 0.00 0.00 0.00 178.15 178.97 1ykm h VAL 492 N 0.48 1.34 0.00 1.67 2.07 -1.79 -3.04 116.25 116.99 1ykm h VAL 492 Ca -0.04 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.84 1ykm h VAL 492 Cb 1.36 1.96 0.00 0.00 -1.52 0.00 0.00 31.29 33.09 1ykm h VAL 492 CO 0.15 0.50 0.00 0.29 0.02 0.00 0.00 177.57 178.53 1ykm n LYS 493 N -4.28 0.42 0.26 1.57 5.02 -0.24 -1.88 118.16 119.02 1ykm n LYS 493 Ca -0.06 0.01 0.15 0.00 -2.02 0.00 0.00 58.31 56.39 1ykm n LYS 493 Cb 0.53 -1.50 0.59 0.00 -0.02 0.00 0.00 35.03 34.63 1ykm n LYS 493 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1ykm h SER 494 N 0.00 0.00 -3.53 4.39 4.64 -1.33 -3.38 113.55 114.34 1ykm h SER 494 Ca 0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 1ykm h SER 494 Cb 0.01 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 61.98 1ykm h SER 494 CO 0.00 0.04 0.09 -0.63 -0.87 0.00 0.00 176.83 175.46 1ykm s ILE 495 N -3.62 5.01 0.11 0.95 1.01 -0.79 -3.69 121.20 120.18 1ykm s ILE 495 Ca 0.02 1.00 -0.12 0.00 0.00 0.00 0.00 60.65 61.55 1ykm s ILE 495 Cb 0.09 -3.90 -0.16 0.00 0.01 0.00 0.00 42.46 38.50 1ykm s ILE 495 CO 0.57 0.03 1.31 0.00 0.00 0.00 0.00 174.94 176.86 1ykm h ALA 496 N 7.98 0.32 -2.20 9.38 0.00 -1.86 -3.45 119.26 129.44 1ykm h ALA 496 Ca -0.28 -0.61 -0.57 0.00 0.00 0.00 0.00 54.91 53.45 1ykm h ALA 496 Cb 1.13 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.85 1ykm h ALA 496 CO 0.75 0.69 0.64 1.21 0.00 0.00 0.00 179.25 182.54 1ykm s ASN 497 N -7.11 7.10 0.55 0.00 3.04 -1.26 -4.96 114.94 112.30 1ykm s ASN 497 Ca -0.10 1.36 0.33 0.00 0.04 0.00 0.00 52.86 54.49 1ykm s ASN 497 Cb 0.09 -2.52 1.56 0.00 -1.54 0.00 0.00 41.25 38.83 1ykm s ASN 497 CO 0.90 -0.55 2.07 1.55 -3.04 0.00 0.00 177.10 178.04 1ykm h PRO 498 N 7.35 0.00 0.00 0.43 0.13 -2.00 -2.35 132.00 135.55 1ykm h PRO 498 Ca -0.25 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.87 1ykm h PRO 498 Cb 1.10 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.23 1ykm h PRO 498 CO 0.91 0.07 -0.07 0.93 -0.23 0.00 0.00 178.00 179.61 1ykm h GLU 499 N 0.00 0.00 0.05 0.86 5.08 -1.99 -3.05 114.58 115.53 1ykm h GLU 499 Ca -0.00 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 1ykm h GLU 499 Cb 0.38 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1ykm h GLU 499 CO 0.01 0.07 -1.10 0.00 -1.00 0.00 0.00 179.01 176.99 1ykm h ALA 500 N 1.93 0.26 -0.09 3.43 0.00 -1.79 -3.20 119.26 119.80 1ykm h ALA 500 Ca -0.00 -0.91 -0.08 0.00 0.00 0.00 0.00 54.91 53.92 1ykm h ALA 500 Cb 0.85 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1ykm h ALA 500 CO 0.01 1.15 -0.32 0.28 0.00 0.00 0.00 179.25 180.38 1ykm h VAL 501 N 0.03 1.26 -0.18 0.00 2.07 -1.51 -2.89 116.25 115.03 1ykm h VAL 501 Ca -0.06 -1.23 -0.06 0.00 0.82 0.00 0.00 66.70 66.17 1ykm h VAL 501 Cb 1.85 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 33.15 1ykm h VAL 501 CO 0.16 0.37 -0.14 1.56 0.02 0.00 0.00 177.57 179.53 1ykm h GLN 502 N 0.15 0.29 0.00 1.57 1.08 -1.54 -2.47 115.11 114.19 1ykm h GLN 502 Ca 0.02 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1ykm h GLN 502 Cb 0.64 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.03 1ykm h GLN 502 CO 0.05 0.43 0.00 1.96 -0.95 0.00 0.00 178.83 180.32 1ykm h GLN 503 N 0.27 0.00 -0.02 1.46 4.20 -1.59 -2.54 115.11 116.89 1ykm h GLN 503 Ca 0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1ykm h GLN 503 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 1ykm h GLN 503 CO 0.02 0.00 -0.13 1.28 -0.67 0.00 0.00 178.83 179.33 1ykm n LEU 504 N -2.79 2.06 -4.55 1.46 4.77 -0.93 -4.87 117.00 112.16 1ykm n LEU 504 Ca 0.01 -0.69 -0.41 0.00 -0.03 0.00 0.00 56.01 54.88 1ykm n LEU 504 Cb 0.26 -0.02 -0.08 0.00 -2.33 0.00 0.00 43.42 41.25 1ykm n LEU 504 CO 0.24 0.35 0.16 -0.63 -1.33 0.00 0.00 177.39 176.19 1ykm s ILE 505 N -2.17 5.06 0.09 -0.08 1.01 -0.96 -0.30 121.20 123.85 1ykm s ILE 505 Ca 0.29 0.19 -0.30 0.00 0.00 0.00 0.00 60.65 60.82 1ykm s ILE 505 Cb 0.20 -3.93 -0.06 0.00 0.01 0.00 0.00 42.46 38.68 1ykm s ILE 505 CO 0.40 -0.21 1.10 0.00 0.00 0.00 0.00 174.94 176.23 1ykm s ALA 506 N 2.27 3.32 0.05 9.38 0.00 0.16 -4.88 121.76 132.07 1ykm s ALA 506 Ca 0.16 0.75 -0.08 0.00 0.00 0.00 0.00 51.96 52.79 1ykm s ALA 506 Cb -0.16 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.53 1ykm s ALA 506 CO 0.13 -0.29 0.34 0.15 0.00 0.00 0.00 175.76 176.09 1ykm s LYS 507 N 0.53 3.67 0.06 0.00 -0.14 -0.71 -1.68 119.74 121.48 1ykm s LYS 507 Ca 0.53 0.05 -0.31 0.00 -1.36 0.00 0.00 55.97 54.89 1ykm s LYS 507 Cb -0.27 -3.03 -0.07 0.00 -1.68 0.00 0.00 37.83 32.78 1ykm s LYS 507 CO 0.31 0.59 1.52 -1.17 -0.76 0.00 0.00 175.35 175.84 1ykm s LEU 508 N -1.89 4.35 -0.55 3.17 2.96 -1.26 -0.60 118.68 124.86 1ykm s LEU 508 Ca 0.31 2.34 -0.02 0.00 -0.22 0.00 0.00 54.13 56.54 1ykm s LEU 508 Cb -0.14 -3.57 0.14 0.00 0.50 0.00 0.00 46.19 43.13 1ykm s LEU 508 CO 0.18 -0.79 0.35 -0.62 -1.32 0.00 0.00 176.35 174.15 1ykm s ASP 509 N 1.95 5.18 0.52 3.68 -1.08 0.14 -4.85 116.67 122.21 1ykm s ASP 509 Ca 0.69 -2.61 0.31 0.00 -0.52 0.00 0.00 52.55 50.41 1ykm s ASP 509 Cb -0.37 -1.83 1.08 0.00 -1.46 0.00 0.00 42.92 40.35 1ykm s ASP 509 CO 0.30 -0.41 1.88 0.24 0.52 0.00 0.00 175.17 177.70 1ykm h MET 510 N 7.31 0.00 0.00 4.34 2.86 -1.94 -3.12 114.93 124.38 1ykm h MET 510 Ca -0.05 0.00 -0.18 0.00 -2.06 0.00 0.00 59.70 57.40 1ykm h MET 510 Cb 0.98 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.61 1ykm h MET 510 CO 0.71 0.00 -0.86 -0.91 1.06 0.00 0.00 176.91 176.91 1ykm h ASN 511 N 0.00 0.00 -0.58 1.22 2.35 -1.95 -3.20 115.58 113.42 1ykm h ASN 511 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1ykm h ASN 511 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1ykm h ASN 511 CO 0.00 0.86 0.00 -3.20 -1.65 0.00 0.00 177.43 173.44 1ykm n ASN 512 N -3.50 3.73 -4.82 5.81 5.15 -1.18 -4.96 115.26 115.49 1ykm n ASN 512 Ca -0.00 -2.00 -0.35 0.00 -0.60 0.00 0.00 54.58 51.63 1ykm n ASN 512 Cb 0.82 -0.38 -0.06 0.00 -0.53 0.00 0.00 39.78 39.63 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 -1.23 3.27 -0.39 5.20 0.00 -1.20 -4.72 121.76 122.69 1ykm s ALA 513 Ca 0.45 0.25 -0.18 0.00 0.00 0.00 0.00 51.96 52.48 1ykm s ALA 513 Cb 0.24 -2.94 0.01 0.00 0.00 0.00 0.00 23.12 20.43 1ykm s ALA 513 CO 0.33 0.26 0.48 -0.80 0.00 0.00 0.00 175.76 176.03 1ykm s ASN 514 N -1.94 6.25 0.32 0.00 0.01 -0.49 -5.01 114.94 114.08 1ykm s ASN 514 Ca 0.52 -0.34 -0.28 0.00 -0.71 0.00 0.00 52.86 52.05 1ykm s ASN 514 Cb -0.13 -2.25 -0.13 0.00 0.41 0.00 0.00 41.25 39.15 1ykm s ASN 514 CO 0.19 -0.54 1.24 -2.65 -1.51 0.00 0.00 177.10 173.83 1ykm n PRO 515 N 5.72 1.97 -1.03 -0.60 -0.02 -1.26 -1.92 135.00 137.86 1ykm n PRO 515 Ca -0.06 0.69 -0.01 0.00 -2.02 0.00 0.00 63.50 62.10 1ykm n PRO 515 Cb 0.48 -2.23 -0.00 0.00 -0.02 0.00 0.00 33.50 31.73 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 0.67 -1.74 0.00 -0.52 2.81 -1.26 -4.74 117.12 112.34 1ykm n MET 516 Ca 0.06 0.48 0.00 0.00 -1.81 0.00 0.00 57.70 56.43 1ykm n MET 516 Cb 0.35 -4.81 0.00 0.00 -0.71 0.00 0.00 33.22 28.05 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 -0.89 0.00 -3.91 7.83 2.03 -0.88 -5.16 116.55 115.57 1ykm n ASP 517 Ca -0.01 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.20 1ykm n ASP 517 Cb 0.45 0.00 -0.10 0.00 -0.72 0.00 0.00 41.12 40.75 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 -1.76 2.80 -0.02 0.00 1.43 -0.91 -1.40 118.68 118.82 1ykm s LEU 519 Ca -0.10 0.12 -0.06 0.00 -1.03 0.00 0.00 54.13 53.06 1ykm s LEU 519 Cb -0.05 -2.34 0.01 0.00 0.03 0.00 0.00 46.19 43.84 1ykm s LEU 519 CO -0.02 -2.30 0.13 0.00 0.23 0.00 0.00 176.35 174.40 1ykm s ALA 520 N -3.57 -0.31 0.02 4.21 0.00 -1.25 -0.90 121.76 119.95 1ykm s ALA 520 Ca 0.69 0.07 0.07 0.00 0.00 0.00 0.00 51.96 52.79 1ykm s ALA 520 Cb -0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.01 1ykm s ALA 520 CO 0.49 -0.15 -0.20 0.71 0.00 0.00 0.00 175.76 176.61 1ykm s TYR 521 N -0.77 1.79 -0.15 0.00 1.51 0.96 0.27 117.35 120.94 1ykm s TYR 521 Ca -0.09 -0.36 -0.03 0.00 -1.01 0.00 0.00 57.07 55.59 1ykm s TYR 521 Cb -0.05 -1.10 -0.02 0.00 -0.11 0.00 0.00 41.96 40.68 1ykm s TYR 521 CO 0.01 0.04 -0.07 0.50 -1.11 0.00 0.00 175.55 174.92 1ykm s ARG 522 N -0.89 3.56 -0.23 -0.62 6.06 0.24 -1.30 118.95 125.76 1ykm s ARG 522 Ca 0.07 -0.58 -0.04 0.00 -2.50 0.00 0.00 55.73 52.69 1ykm s ARG 522 Cb -0.08 -2.84 0.09 0.00 0.06 0.00 0.00 34.95 32.18 1ykm s ARG 522 CO 0.01 0.19 0.17 0.12 -2.50 0.00 0.00 175.30 173.29 1ykm s PHE 523 N 0.47 -0.01 -0.08 5.12 5.36 -0.09 -1.74 117.98 127.01 1ykm s PHE 523 Ca -0.05 -0.27 -0.14 0.00 -0.96 0.00 0.00 56.93 55.50 1ykm s PHE 523 Cb -0.15 -0.61 -0.05 0.00 -0.34 0.00 0.00 43.02 41.87 1ykm s PHE 523 CO 0.03 -0.68 0.35 -0.51 -1.46 0.00 0.00 175.22 172.96 1ykm s ASP 524 N 2.22 6.62 -0.15 6.13 1.01 -1.26 -3.93 116.67 127.30 1ykm s ASP 524 Ca 0.06 0.74 -0.04 0.00 0.71 0.00 0.00 52.55 54.02 1ykm s ASP 524 Cb -0.16 -2.21 -0.03 0.00 1.01 0.00 0.00 42.92 41.53 1ykm s ASP 524 CO -0.20 0.21 -0.01 -0.63 0.21 0.00 0.00 175.17 174.75 1ykm s ILE 525 N -0.31 4.18 -0.22 0.77 1.01 0.13 -4.95 121.20 121.82 1ykm s ILE 525 Ca 0.21 -0.26 -0.03 0.00 0.00 0.00 0.00 60.65 60.57 1ykm s ILE 525 Cb -0.15 -2.84 -0.00 0.00 0.01 0.00 0.00 42.46 39.48 1ykm s ILE 525 CO 0.09 0.50 -0.07 -0.69 0.00 0.00 0.00 174.94 174.77 1ykm s VAL 526 N 0.21 3.14 0.44 2.92 1.01 -1.26 -1.16 120.40 125.71 1ykm s VAL 526 Ca -0.00 -0.59 0.08 0.00 0.00 0.00 0.00 61.98 61.46 1ykm s VAL 526 Cb -0.13 -2.43 0.01 0.00 0.00 0.00 0.00 36.38 33.83 1ykm s VAL 526 CO 0.02 0.43 0.53 -0.76 0.00 0.00 0.00 175.10 175.31 1ykm s LEU 527 N 1.44 3.47 0.33 3.92 1.43 0.49 -4.94 118.68 124.82 1ykm s LEU 527 Ca 0.05 -0.61 -0.29 0.00 -1.03 0.00 0.00 54.13 52.25 1ykm s LEU 527 Cb -0.14 -2.28 -0.12 0.00 0.03 0.00 0.00 46.19 43.68 1ykm s LEU 527 CO -0.05 -0.81 1.45 0.54 0.23 0.00 0.00 176.35 177.71 1ykm n ARG 528 N -1.79 2.44 -2.04 1.70 1.74 -1.26 -1.46 116.66 115.98 1ykm n ARG 528 Ca 0.07 0.86 -0.42 0.00 -0.77 0.00 0.00 57.85 57.60 1ykm n ARG 528 Cb 0.60 -2.55 -0.03 0.00 -1.02 0.00 0.00 32.46 29.47 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 0.02 2.16 -0.21 -0.13 0.00 -1.26 -4.33 107.32 103.57 1ykm s GLY 529 Ca 0.58 1.29 -0.08 0.00 0.00 0.00 0.00 44.72 46.51 1ykm s GLY 529 CO 0.58 2.33 0.08 1.62 0.00 0.00 0.00 173.10 177.71 1ykm s GLN 530 N 0.11 3.92 0.16 2.90 0.74 -1.26 -1.46 119.66 124.77 1ykm s GLN 530 Ca 0.62 -0.36 0.03 0.00 0.05 0.00 0.00 55.36 55.70 1ykm s GLN 530 Cb -0.41 -3.29 -0.05 0.00 1.10 0.00 0.00 33.01 30.36 1ykm s GLN 530 CO 0.39 0.14 -0.05 -0.98 -0.55 0.00 0.00 175.29 174.23 1ykm s ARG 531 N 0.76 1.09 0.59 1.67 1.70 -0.62 -4.98 118.95 119.16 1ykm s ARG 531 Ca 0.04 -1.50 -0.09 0.00 -0.47 0.00 0.00 55.73 53.71 1ykm s ARG 531 Cb -0.13 -0.49 -0.04 0.00 -0.57 0.00 0.00 34.95 33.72 1ykm s ARG 531 CO 0.02 -0.02 0.97 -1.59 -1.08 0.00 0.00 175.30 173.60 1ykm s LYS 532 N -3.82 3.56 0.35 3.89 -2.85 -1.26 -0.87 119.74 118.74 1ykm s LYS 532 Ca 0.20 0.59 -0.26 0.00 -1.00 0.00 0.00 55.97 55.50 1ykm s LYS 532 Cb 0.04 -2.16 -0.09 0.00 -2.06 0.00 0.00 37.83 33.57 1ykm s LYS 532 CO 0.02 -0.49 1.04 0.95 0.10 0.00 0.00 175.35 176.97 1ykm s THR 533 N -3.07 3.77 -0.15 3.79 -4.23 -1.19 -4.68 115.64 109.88 1ykm s THR 533 Ca 0.53 1.49 -0.13 0.00 -1.18 0.00 0.00 61.69 62.40 1ykm s THR 533 Cb -0.11 -3.84 0.04 0.00 1.34 0.00 0.00 72.50 69.93 1ykm s THR 533 CO 0.52 0.14 0.39 -1.38 -0.54 0.00 0.00 174.62 173.74 1ykm s HIS 534 N -1.51 -0.43 -1.28 3.99 -3.43 -1.26 -4.94 115.29 106.42 1ykm s HIS 534 Ca 0.52 1.04 -0.01 0.00 -0.80 0.00 0.00 55.06 55.81 1ykm s HIS 534 Cb -0.24 0.15 0.01 0.00 -1.43 0.00 0.00 32.58 31.07 1ykm s HIS 534 CO 0.30 -0.21 0.10 1.19 -2.00 0.00 0.00 174.74 174.12 1ykm n PHE 535 N 2.91 -1.41 -3.42 0.38 3.01 -1.26 -4.98 117.46 112.70 1ykm n PHE 535 Ca -0.13 0.09 -0.38 0.00 1.01 0.00 0.00 57.45 58.04 1ykm n PHE 535 Cb 0.57 -3.19 -0.06 0.00 -0.01 0.00 0.00 39.48 36.79 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 -5.19 4.07 -1.73 -1.08 2.02 -1.26 -3.93 118.70 111.59 1ykm s GLU 536 Ca 0.07 0.48 0.00 0.00 0.02 0.00 0.00 54.97 55.54 1ykm s GLU 536 Cb -0.03 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.93 1ykm s GLU 536 CO 0.08 0.57 0.00 0.09 0.02 0.00 0.00 175.26 176.02 1ykm n ASN 537 N 2.20 -4.97 0.00 -0.19 3.02 -1.26 -5.23 115.26 108.83 1ykm n ASN 537 Ca -0.12 0.40 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 1ykm n ASN 537 Cb 0.52 -3.92 0.00 0.00 -0.61 0.00 0.00 39.78 35.77 1ykm n ASN 537 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64