#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3pck s ALA 302 N 0.00 2.47 0.02 3.55 0.00 -1.26 -5.06 121.76 121.49 3pck s ALA 302 Ca 0.00 0.47 0.02 0.00 0.00 0.00 0.00 51.96 52.46 3pck s ALA 302 Cb 0.00 -3.30 -0.02 0.00 0.00 0.00 0.00 23.12 19.81 3pck s ALA 302 CO 0.00 -1.30 -0.08 -0.65 0.00 0.00 0.00 175.76 173.74 3pck s GLN 303 N -4.24 0.54 -1.09 0.00 -0.21 -1.26 -5.09 119.66 108.31 3pck s GLN 303 Ca 0.65 -0.55 -0.22 0.00 0.02 0.00 0.00 55.36 55.27 3pck s GLN 303 Cb -0.19 -0.42 0.04 0.00 1.00 0.00 0.00 33.01 33.44 3pck s GLN 303 CO 0.44 0.10 1.59 0.34 -2.12 0.00 0.00 175.29 175.63 3pck s ASP 304 N -0.98 6.40 0.00 5.90 2.15 -1.26 -4.59 116.67 124.29 3pck s ASP 304 Ca -0.04 -1.63 0.00 0.00 0.43 0.00 0.00 52.55 51.31 3pck s ASP 304 Cb -0.07 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.98 3pck s ASP 304 CO 0.00 -1.60 0.11 -0.46 -0.17 0.00 0.00 175.17 173.05 3pck n ASN 305 N 9.47 0.22 -4.39 -0.34 0.23 -1.26 -5.02 115.26 114.16 3pck n ASN 305 Ca 0.38 -0.59 -0.20 0.00 -0.53 0.00 0.00 54.58 53.63 3pck n ASN 305 Cb 0.49 0.71 -0.10 0.00 -2.08 0.00 0.00 39.78 38.80 3pck n ASN 305 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 3pck s SER 306 N -0.71 2.78 0.04 0.53 0.01 -1.26 -3.43 113.70 111.66 3pck s SER 306 Ca 0.00 -1.09 0.06 0.00 1.31 0.00 0.00 55.95 56.23 3pck s SER 306 Cb 0.00 -0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.04 3pck s SER 306 CO 0.00 -0.21 -0.16 -0.13 0.41 0.00 0.00 173.24 173.15 3pck s ARG 307 N -3.66 1.06 -0.04 12.44 1.81 0.76 -4.85 118.95 126.47 3pck s ARG 307 Ca 0.26 -0.84 0.05 0.00 -1.72 0.00 0.00 55.73 53.48 3pck s ARG 307 Cb 0.00 -1.12 -0.02 0.00 -0.45 0.00 0.00 34.95 33.37 3pck s ARG 307 CO 0.10 0.28 -0.18 -0.06 -0.68 0.00 0.00 175.30 174.75 3pck s PHE 308 N -0.87 2.58 0.24 -0.53 0.40 -1.26 -1.57 117.98 116.99 3pck s PHE 308 Ca 0.03 -0.29 -0.31 0.00 -0.60 0.00 0.00 56.93 55.76 3pck s PHE 308 Cb -0.08 -1.60 -0.13 0.00 0.51 0.00 0.00 43.02 41.72 3pck s PHE 308 CO 0.02 0.09 1.56 0.28 0.70 0.00 0.00 175.22 177.86 3pck n VAL 309 N 2.42 0.68 -1.81 -0.44 0.31 -0.72 -4.89 118.33 113.89 3pck n VAL 309 Ca -0.17 -0.17 -0.42 0.00 -0.01 0.00 0.00 64.34 63.57 3pck n VAL 309 Cb 0.52 -1.76 -0.03 0.00 -0.91 0.00 0.00 33.84 31.66 3pck n VAL 309 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3pck s ILE 310 N 0.31 2.24 0.44 2.52 -1.09 -1.26 -4.71 121.20 119.65 3pck s ILE 310 Ca 0.69 0.17 -0.25 0.00 -2.23 0.00 0.00 60.65 59.04 3pck s ILE 310 Cb -0.57 -3.11 -0.08 0.00 -1.58 0.00 0.00 42.46 37.12 3pck s ILE 310 CO 0.45 0.01 1.37 -0.13 -1.23 0.00 0.00 174.94 175.41 3pck s ARG 311 N 1.07 3.74 -0.60 2.79 0.52 -1.26 -4.96 118.95 120.25 3pck s ARG 311 Ca 0.72 2.29 -0.19 0.00 -0.52 0.00 0.00 55.73 58.03 3pck s ARG 311 Cb -0.47 -2.65 0.10 0.00 0.52 0.00 0.00 34.95 32.45 3pck s ARG 311 CO 0.33 -0.73 0.73 0.34 0.02 0.00 0.00 175.30 175.98 3pck s ASP 312 N -0.66 6.19 0.00 0.23 -1.08 -1.26 -4.90 116.67 115.19 3pck s ASP 312 Ca 0.61 -1.41 0.20 0.00 -0.52 0.00 0.00 52.55 51.42 3pck s ASP 312 Cb -0.41 -2.31 1.04 0.00 -1.46 0.00 0.00 42.92 39.78 3pck s ASP 312 CO 0.52 -1.14 1.61 0.54 0.52 0.00 0.00 175.17 177.23 3pck n ARG 313 N 6.43 0.34 0.00 4.34 1.74 -1.26 -1.38 116.66 126.88 3pck n ARG 313 Ca -0.09 0.08 0.11 0.00 -0.77 0.00 0.00 57.85 57.18 3pck n ARG 313 Cb 0.43 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.27 3pck n ARG 313 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3pck n ASN 314 N -1.24 0.63 -0.05 0.55 3.02 -1.26 -4.32 115.26 112.60 3pck n ASN 314 Ca 0.10 -0.55 -0.21 0.00 -0.03 0.00 0.00 54.58 53.90 3pck n ASN 314 Cb 0.14 1.21 -0.13 0.00 -0.61 0.00 0.00 39.78 40.39 3pck n ASN 314 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3pck h TRP 315 N 0.00 0.22 -4.30 3.10 2.91 -1.64 -3.44 115.95 112.80 3pck h TRP 315 Ca 0.00 -0.16 -0.51 0.00 1.13 0.00 0.00 58.89 59.34 3pck h TRP 315 Cb 0.68 -0.01 0.13 0.00 -0.51 0.00 0.00 29.16 29.45 3pck h TRP 315 CO 0.00 1.50 0.33 -1.01 -1.03 0.00 0.00 178.44 178.22 3pck s HIS 316 N -2.41 2.62 0.51 2.65 3.76 -0.94 -4.76 115.29 116.72 3pck s HIS 316 Ca -0.24 1.55 -0.22 0.00 -0.15 0.00 0.00 55.06 56.00 3pck s HIS 316 Cb 0.04 -3.05 -0.06 0.00 1.11 0.00 0.00 32.58 30.63 3pck s HIS 316 CO 0.69 -1.74 1.21 -1.25 -0.85 0.00 0.00 174.74 172.79 3pck s PRO 317 N -4.83 3.45 0.87 8.40 0.04 -1.26 -4.81 135.00 136.86 3pck s PRO 317 Ca 0.62 1.86 -0.12 0.00 0.04 0.00 0.00 61.00 63.40 3pck s PRO 317 Cb -0.17 -2.25 0.11 0.00 0.04 0.00 0.00 34.50 32.23 3pck s PRO 317 CO 0.54 -0.83 1.13 0.15 0.04 0.00 0.00 177.00 178.03 3pck s LYS 318 N -2.92 1.51 -0.03 4.56 -0.14 -1.24 -5.00 119.74 116.48 3pck s LYS 318 Ca 0.69 0.39 -0.26 0.00 -1.36 0.00 0.00 55.97 55.42 3pck s LYS 318 Cb -0.31 -1.87 -0.21 0.00 -1.68 0.00 0.00 37.83 33.76 3pck s LYS 318 CO 0.36 -1.96 1.21 0.00 -0.76 0.00 0.00 175.35 174.20 3pck h ALA 319 N -1.33 -0.00 -1.90 5.17 0.00 -1.95 -3.41 119.26 115.83 3pck h ALA 319 Ca -0.49 -0.27 -0.66 0.00 0.00 0.00 0.00 54.91 53.49 3pck h ALA 319 Cb 1.31 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.94 3pck h ALA 319 CO 0.61 -0.23 0.27 -1.17 0.00 0.00 0.00 179.25 178.73 3pck s LEU 320 N -9.13 4.77 -0.42 0.00 2.96 -1.26 -4.78 118.68 110.83 3pck s LEU 320 Ca -0.16 -0.94 0.02 0.00 -0.22 0.00 0.00 54.13 52.83 3pck s LEU 320 Cb 0.01 -2.48 0.16 0.00 0.50 0.00 0.00 46.19 44.38 3pck s LEU 320 CO 0.67 -1.12 0.30 0.42 -1.32 0.00 0.00 176.35 175.29 3pck s THR 321 N 3.20 0.64 0.48 3.68 -4.23 -1.26 -5.03 115.64 113.11 3pck s THR 321 Ca 0.19 -2.47 0.27 0.00 -1.18 0.00 0.00 61.69 58.51 3pck s THR 321 Cb -0.19 -1.45 0.47 0.00 1.34 0.00 0.00 72.50 72.67 3pck s THR 321 CO 0.12 -1.09 1.81 -0.65 -0.54 0.00 0.00 174.62 174.27 3pck h PRO 322 N 6.23 0.17 0.00 3.99 0.11 -1.94 -0.52 132.00 140.04 3pck h PRO 322 Ca 0.15 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 3pck h PRO 322 Cb 0.92 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 31.99 3pck h PRO 322 CO 0.38 0.11 -0.07 -0.44 -0.21 0.00 0.00 178.00 177.77 3pck h ASP 323 N 0.18 0.00 -3.08 -2.05 3.32 -1.96 -3.21 116.42 109.62 3pck h ASP 323 Ca 0.55 0.00 -0.73 0.00 0.02 0.00 0.00 57.03 56.86 3pck h ASP 323 Cb 1.80 0.00 -0.21 0.00 0.22 0.00 0.00 39.33 41.14 3pck h ASP 323 CO -0.13 0.07 0.34 -0.47 -1.72 0.00 0.00 179.24 177.33 3pck s TYR 324 N -4.47 3.33 0.20 4.55 5.04 -0.20 -4.84 117.35 120.95 3pck s TYR 324 Ca -0.04 -1.50 -0.23 0.00 -2.44 0.00 0.00 57.07 52.87 3pck s TYR 324 Cb 0.14 -4.03 0.11 0.00 0.35 0.00 0.00 41.96 38.53 3pck s TYR 324 CO 0.59 -1.24 1.52 1.63 -1.34 0.00 0.00 175.55 176.71 3pck n LYS 325 N 5.51 -0.32 0.32 4.97 5.02 -1.21 -1.99 118.16 130.46 3pck n LYS 325 Ca 0.10 1.50 0.19 0.00 -2.02 0.00 0.00 58.31 58.09 3pck n LYS 325 Cb 0.46 -2.22 1.08 0.00 -0.02 0.00 0.00 35.03 34.33 3pck n LYS 325 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3pck h THR 326 N 0.00 0.22 0.00 -0.18 2.02 -1.92 -1.59 112.91 111.47 3pck h THR 326 Ca 0.26 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.40 3pck h THR 326 Cb 0.51 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.90 3pck h THR 326 CO -0.96 0.00 -0.24 0.77 0.37 0.00 0.00 175.52 175.47 3pck h SER 327 N 0.00 0.00 0.04 4.18 4.64 -1.69 -2.84 113.55 117.89 3pck h SER 327 Ca 0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 3pck h SER 327 Cb 0.04 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.10 3pck h SER 327 CO -0.00 0.24 -0.18 0.40 -0.87 0.00 0.00 176.83 176.41 3pck h ILE 328 N 0.00 0.57 0.00 0.95 2.04 -1.44 -2.99 117.51 116.64 3pck h ILE 328 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pck h ILE 328 Cb 0.50 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 3pck h ILE 328 CO 0.03 0.00 -0.58 0.00 0.00 0.00 0.00 178.15 177.60 3pck n ALA 329 N -2.51 3.14 -1.32 1.87 0.00 -1.23 -4.15 120.51 116.31 3pck n ALA 329 Ca -0.06 -0.29 -0.09 0.00 0.00 0.00 0.00 53.44 53.01 3pck n ALA 329 Cb 0.23 -1.15 0.21 0.00 0.00 0.00 0.00 19.45 18.73 3pck n ALA 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3pck n ARG 330 N -1.87 2.19 -5.06 0.00 1.74 -1.07 -4.94 116.66 107.65 3pck n ARG 330 Ca 0.04 -3.10 -0.29 0.00 -0.77 0.00 0.00 57.85 53.72 3pck n ARG 330 Cb 0.40 -1.96 -0.17 0.00 -1.02 0.00 0.00 32.46 29.72 3pck n ARG 330 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3pck s SER 331 N -2.02 2.68 0.80 0.55 1.04 -1.14 -4.95 113.70 110.66 3pck s SER 331 Ca 0.49 -0.46 -0.13 0.00 0.48 0.00 0.00 55.95 56.33 3pck s SER 331 Cb 0.43 -0.97 0.08 0.00 0.10 0.00 0.00 66.02 65.65 3pck s SER 331 CO 0.05 0.17 1.19 -2.16 0.98 0.00 0.00 173.24 173.46 3pck s PRO 332 N 0.16 1.72 -0.02 4.02 0.04 -1.26 -4.93 135.00 134.74 3pck s PRO 332 Ca -0.10 1.69 0.11 0.00 0.04 0.00 0.00 61.00 62.73 3pck s PRO 332 Cb -0.15 -1.79 -0.16 0.00 0.04 0.00 0.00 34.50 32.44 3pck s PRO 332 CO 0.05 -2.13 0.22 0.54 0.04 0.00 0.00 177.00 175.72 3pck n ARG 333 N -3.29 0.38 -3.13 4.56 5.12 -1.26 -4.93 116.66 114.12 3pck n ARG 333 Ca 0.13 -0.09 -0.30 0.00 -1.93 0.00 0.00 57.85 55.65 3pck n ARG 333 Cb 0.51 -1.25 -0.04 0.00 -1.16 0.00 0.00 32.46 30.52 3pck n ARG 333 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3pck s GLN 334 N -2.72 3.75 0.53 5.56 -1.52 -1.26 -5.05 119.66 118.96 3pck s GLN 334 Ca -0.04 0.30 -0.20 0.00 -1.95 0.00 0.00 55.36 53.47 3pck s GLN 334 Cb 0.07 -2.52 -0.06 0.00 -0.22 0.00 0.00 33.01 30.28 3pck s GLN 334 CO 0.44 0.12 1.17 0.00 -0.25 0.00 0.00 175.29 176.76 3pck s ALA 335 N -2.16 2.75 0.53 6.09 0.00 -1.26 -4.99 121.76 122.72 3pck s ALA 335 Ca 0.48 0.92 -0.21 0.00 0.00 0.00 0.00 51.96 53.16 3pck s ALA 335 Cb -0.11 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.56 3pck s ALA 335 CO 0.28 -0.85 1.22 -0.51 0.00 0.00 0.00 175.76 175.89 3pck s LEU 336 N -3.63 3.83 -0.25 0.00 1.43 -1.26 -5.00 118.68 113.80 3pck s LEU 336 Ca 0.71 2.42 -0.13 0.00 -1.03 0.00 0.00 54.13 56.10 3pck s LEU 336 Cb -0.27 -4.41 -0.04 0.00 0.03 0.00 0.00 46.19 41.50 3pck s LEU 336 CO 0.31 -1.32 0.28 -0.69 0.23 0.00 0.00 176.35 175.17 3pck s VAL 337 N -1.53 5.25 0.06 -1.59 1.01 -1.26 -5.05 120.40 117.29 3pck s VAL 337 Ca 0.71 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 62.79 3pck s VAL 337 Cb -0.31 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 3pck s VAL 337 CO 0.36 0.24 1.01 -0.44 0.00 0.00 0.00 175.10 176.27 3pck s SER 338 N 1.43 7.37 0.07 3.32 0.01 -1.26 -5.05 113.70 119.60 3pck s SER 338 Ca 0.12 1.78 0.06 0.00 1.31 0.00 0.00 55.95 59.23 3pck s SER 338 Cb -0.15 -2.58 -0.03 0.00 0.21 0.00 0.00 66.02 63.47 3pck s SER 338 CO 0.09 -0.21 -0.17 0.27 0.41 0.00 0.00 173.24 173.62 3pck s ILE 339 N 0.56 1.37 0.50 1.44 -4.36 -1.26 -5.14 121.20 114.30 3pck s ILE 339 Ca 0.51 -1.33 -0.20 0.00 -0.26 0.00 0.00 60.65 59.37 3pck s ILE 339 Cb -0.23 -1.26 -0.08 0.00 1.25 0.00 0.00 42.46 42.14 3pck s ILE 339 CO 0.29 -0.09 1.04 -2.16 0.24 0.00 0.00 174.94 174.26 3pck s PRO 340 N -1.65 3.75 0.34 0.37 0.04 -1.26 -4.99 135.00 131.60 3pck s PRO 340 Ca 0.02 1.34 -0.28 0.00 0.04 0.00 0.00 61.00 62.12 3pck s PRO 340 Cb -0.10 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 3pck s PRO 340 CO 0.03 -0.47 1.20 -0.65 0.04 0.00 0.00 177.00 177.15 3pck s GLN 341 N -3.33 4.34 0.31 4.56 -0.21 -1.26 -5.02 119.66 119.04 3pck s GLN 341 Ca 0.67 1.98 0.04 0.00 0.02 0.00 0.00 55.36 58.07 3pck s GLN 341 Cb -0.16 -2.98 -0.03 0.00 1.00 0.00 0.00 33.01 30.84 3pck s GLN 341 CO 0.22 -0.12 0.21 -1.54 -2.12 0.00 0.00 175.29 171.94 3pck s SER 342 N -0.80 1.46 0.52 5.90 1.04 -1.26 -5.02 113.70 115.53 3pck s SER 342 Ca 0.50 -1.64 0.22 0.00 0.48 0.00 0.00 55.95 55.52 3pck s SER 342 Cb -0.35 0.48 1.34 0.00 0.10 0.00 0.00 66.02 67.59 3pck s SER 342 CO 0.45 -0.97 2.03 -0.29 0.98 0.00 0.00 173.24 175.44 3pck h ILE 343 N 2.21 0.80 -0.63 -1.02 2.10 -1.95 -0.50 117.51 118.52 3pck h ILE 343 Ca -0.30 -0.01 -0.05 0.00 1.08 0.00 0.00 64.86 65.58 3pck h ILE 343 Cb 1.24 0.76 -0.03 0.00 -1.09 0.00 0.00 36.82 37.71 3pck h ILE 343 CO 0.45 0.01 0.19 0.28 -1.08 0.00 0.00 178.15 178.00 3pck h SER 344 N 0.03 0.92 0.80 2.19 0.02 -1.96 -3.10 113.55 112.45 3pck h SER 344 Ca 0.20 -0.21 -0.14 0.00 -0.84 0.00 0.00 61.79 60.81 3pck h SER 344 Cb 0.77 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 3pck h SER 344 CO -0.01 0.88 -1.29 -0.33 -1.14 0.00 0.00 176.83 174.94 3pck h GLU 345 N 0.90 0.00 -0.15 3.45 3.07 -1.56 -3.39 114.58 116.91 3pck h GLU 345 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.06 3pck h GLU 345 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3pck h GLU 345 CO -0.01 0.26 0.00 0.25 -1.40 0.00 0.00 179.01 178.11 3pck n THR 346 N -2.88 0.18 -4.38 1.13 -2.24 -0.35 -2.54 114.28 103.19 3pck n THR 346 Ca -0.07 -0.44 -0.26 0.00 -2.27 0.00 0.00 64.05 61.00 3pck n THR 346 Cb 0.79 0.77 -0.09 0.00 -2.10 0.00 0.00 70.33 69.70 3pck n THR 346 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3pck s THR 347 N -1.82 2.13 -0.08 4.28 -4.23 -1.17 -4.74 115.64 110.01 3pck s THR 347 Ca 0.34 -1.85 -0.32 0.00 -1.18 0.00 0.00 61.69 58.68 3pck s THR 347 Cb 0.20 -2.99 0.13 0.00 1.34 0.00 0.00 72.50 71.19 3pck s THR 347 CO 0.30 0.00 1.31 -0.83 -0.54 0.00 0.00 174.62 174.86 3pck s GLY 348 N -3.81 -0.40 0.51 3.99 0.00 -1.24 -1.39 107.32 104.98 3pck s GLY 348 Ca 0.38 0.97 -0.20 0.00 0.00 0.00 0.00 44.72 45.87 3pck s GLY 348 CO 0.20 0.23 1.09 2.56 0.00 0.00 0.00 173.10 177.18 3pck s PRO 349 N -2.33 3.58 -0.17 2.90 0.04 -1.26 -4.86 135.00 132.90 3pck s PRO 349 Ca 0.13 1.50 -0.01 0.00 0.04 0.00 0.00 61.00 62.67 3pck s PRO 349 Cb 0.04 -2.06 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 3pck s PRO 349 CO -0.04 -0.64 -0.12 1.21 0.04 0.00 0.00 177.00 177.44 3pck s ASN 350 N -1.85 3.88 -0.19 6.66 3.84 -1.26 -4.88 114.94 121.13 3pck s ASN 350 Ca 0.70 -0.43 0.16 0.00 0.21 0.00 0.00 52.86 53.50 3pck s ASN 350 Cb -0.21 -1.62 0.77 0.00 -0.55 0.00 0.00 41.25 39.65 3pck s ASN 350 CO 0.24 0.07 1.69 0.49 -2.79 0.00 0.00 177.10 176.79 3pck n PHE 351 N 4.19 1.81 -0.28 0.43 3.72 -1.26 -4.59 117.46 121.47 3pck n PHE 351 Ca -0.19 -0.70 0.14 0.00 -0.05 0.00 0.00 57.45 56.65 3pck n PHE 351 Cb 0.52 -0.41 0.40 0.00 -0.94 0.00 0.00 39.48 39.04 3pck n PHE 351 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3pck h SER 352 N 3.85 0.62 -0.31 4.37 0.02 -1.96 -1.23 113.55 118.92 3pck h SER 352 Ca 0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3pck h SER 352 Cb 1.78 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 64.25 3pck h SER 352 CO 0.39 0.28 0.00 1.41 -1.14 0.00 0.00 176.83 177.77 3pck n HIS 353 N -4.59 0.39 -2.19 3.45 8.25 -1.26 -4.94 115.22 114.33 3pck n HIS 353 Ca 0.19 -0.20 -0.40 0.00 -0.26 0.00 0.00 57.72 57.05 3pck n HIS 353 Cb 0.55 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.64 3pck n HIS 353 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3pck s LEU 354 N -1.52 4.43 -0.98 2.41 2.96 -0.47 -4.93 118.68 120.59 3pck s LEU 354 Ca 0.36 2.59 -0.22 0.00 -0.22 0.00 0.00 54.13 56.63 3pck s LEU 354 Cb 0.21 -3.68 0.07 0.00 0.50 0.00 0.00 46.19 43.29 3pck s LEU 354 CO 0.30 -0.48 1.36 -0.83 -1.32 0.00 0.00 176.35 175.37 3pck s GLY 355 N -0.61 1.39 0.10 7.98 0.00 -1.26 -5.00 107.32 109.91 3pck s GLY 355 Ca 0.49 -2.31 -0.28 0.00 0.00 0.00 0.00 44.72 42.62 3pck s GLY 355 CO 0.50 2.52 0.88 -1.36 0.00 0.00 0.00 173.10 175.64 3pck s PHE 356 N 4.50 3.80 0.71 1.90 0.08 -1.26 -5.06 117.98 122.65 3pck s PHE 356 Ca 0.42 1.68 -0.11 0.00 0.12 0.00 0.00 56.93 59.03 3pck s PHE 356 Cb -0.02 -2.95 0.02 0.00 -0.57 0.00 0.00 43.02 39.50 3pck s PHE 356 CO -0.08 0.26 1.07 0.20 -0.10 0.00 0.00 175.22 176.58 3pck s GLY 357 N -0.16 1.65 0.31 4.36 0.00 -1.26 -4.97 107.32 107.24 3pck s GLY 357 Ca 0.43 -0.09 0.02 0.00 0.00 0.00 0.00 44.72 45.08 3pck s GLY 357 CO 0.27 0.25 1.88 0.00 0.00 0.00 0.00 173.10 175.50 3pck h ALA 358 N -0.75 1.58 -0.28 3.20 0.00 -2.02 -2.80 119.26 118.18 3pck h ALA 358 Ca -0.45 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 3pck h ALA 358 Cb 1.23 -0.22 -0.10 0.00 0.00 0.00 0.00 17.79 18.70 3pck h ALA 358 CO 0.59 0.23 -0.22 0.72 0.00 0.00 0.00 179.25 180.57 3pck n HIS 359 N -4.54 0.90 -0.06 0.00 8.25 -1.26 -4.76 115.22 113.74 3pck n HIS 359 Ca 0.16 -1.64 0.07 0.00 -0.26 0.00 0.00 57.72 56.05 3pck n HIS 359 Cb 0.30 -0.44 0.43 0.00 1.12 0.00 0.00 29.99 31.41 3pck n HIS 359 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3pck h ASP 360 N 1.07 0.48 0.08 0.41 5.19 -1.78 -2.21 116.42 119.65 3pck h ASP 360 Ca 0.18 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 3pck h ASP 360 Cb 1.46 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.87 3pck h ASP 360 CO 0.32 0.32 -0.45 0.00 -3.12 0.00 0.00 179.24 176.31 3pck n HIS 361 N -4.47 0.00 -3.75 4.55 1.44 -1.15 -2.12 115.22 109.71 3pck n HIS 361 Ca 0.06 0.00 -0.36 0.00 -2.01 0.00 0.00 57.72 55.41 3pck n HIS 361 Cb 0.18 -0.05 -0.11 0.00 0.12 0.00 0.00 29.99 30.14 3pck n HIS 361 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 3pck s ASP 362 N -2.54 5.27 0.56 4.39 -1.08 -0.83 -2.19 116.67 120.24 3pck s ASP 362 Ca 0.19 -2.27 0.36 0.00 -0.52 0.00 0.00 52.55 50.31 3pck s ASP 362 Cb 0.18 -1.84 1.66 0.00 -1.46 0.00 0.00 42.92 41.46 3pck s ASP 362 CO 0.58 -0.50 2.07 -0.07 0.52 0.00 0.00 175.17 177.78 3pck h LEU 363 N 7.77 0.00 -0.85 -1.34 4.07 -0.36 -0.29 115.31 124.30 3pck h LEU 363 Ca -0.10 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.78 3pck h LEU 363 Cb 1.02 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.75 3pck h LEU 363 CO 0.71 0.00 -0.40 -0.07 -1.08 0.00 0.00 178.44 177.60 3pck h LEU 364 N 0.00 0.00 0.00 1.67 4.07 -1.91 -3.37 115.31 115.77 3pck h LEU 364 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 3pck h LEU 364 Cb 0.33 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.07 3pck h LEU 364 CO 0.00 0.40 -1.08 0.18 -1.08 0.00 0.00 178.44 176.86 3pck n LEU 365 N -3.52 0.00 0.00 1.67 4.77 -0.77 -4.65 117.00 114.50 3pck n LEU 365 Ca -0.00 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 3pck n LEU 365 Cb 0.53 0.02 0.25 0.00 -2.33 0.00 0.00 43.42 41.89 3pck n LEU 365 CO 0.37 0.02 0.63 -0.46 -1.33 0.00 0.00 177.39 176.62 3pck n ASN 366 N -1.83 0.00 -0.03 -1.43 0.23 -0.19 -5.07 115.26 106.94 3pck n ASN 366 Ca -0.01 0.27 -0.03 0.00 -0.53 0.00 0.00 54.58 54.28 3pck n ASN 366 Cb 0.32 -0.36 -0.01 0.00 -2.08 0.00 0.00 39.78 37.65 3pck n ASN 366 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 3pck n PHE 367 N -1.36 0.00 0.00 -2.53 7.35 -1.26 -4.99 117.46 114.67 3pck n PHE 367 Ca 0.04 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.73 3pck n PHE 367 Cb 0.10 -0.16 0.00 0.00 0.35 0.00 0.00 39.48 39.77 3pck n PHE 367 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3pck n GLY 371 N 1.49 0.00 3.83 7.13 0.00 -1.26 -4.74 105.19 111.63 3pck n GLY 371 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.63 3pck n GLY 371 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3pck s LEU 372 N 0.00 4.11 0.61 0.99 1.02 -1.26 -4.86 118.68 119.29 3pck s LEU 372 Ca 0.00 0.28 -0.17 0.00 0.02 0.00 0.00 54.13 54.26 3pck s LEU 372 Cb 0.00 -2.28 -0.03 0.00 0.02 0.00 0.00 46.19 43.91 3pck s LEU 372 CO 0.00 0.31 1.12 -2.16 0.02 0.00 0.00 176.35 175.65 3pck s PRO 373 N -1.54 3.03 0.04 1.29 0.04 -1.26 -4.81 135.00 131.79 3pck s PRO 373 Ca 0.21 1.51 -0.19 0.00 0.04 0.00 0.00 61.00 62.57 3pck s PRO 373 Cb -0.12 -1.97 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 3pck s PRO 373 CO 0.12 -1.09 0.54 0.42 0.04 0.00 0.00 177.00 177.03 3pck s ILE 374 N -2.07 4.83 0.00 0.56 1.01 -1.26 -5.00 121.20 119.27 3pck s ILE 374 Ca 0.70 1.15 0.00 0.00 0.00 0.00 0.00 60.65 62.50 3pck s ILE 374 Cb -0.22 -3.87 0.00 0.00 0.01 0.00 0.00 42.46 38.38 3pck s ILE 374 CO 0.35 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.43 3pck n GLY 375 N 1.90 3.20 3.59 6.18 0.00 -1.26 -4.56 105.19 114.23 3pck n GLY 375 Ca -0.10 -1.75 -0.42 0.00 0.00 0.00 0.00 46.02 43.75 3pck n GLY 375 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3pck s GLU 376 N -2.01 3.20 0.10 1.61 2.02 -1.26 -4.90 118.70 117.46 3pck s GLU 376 Ca 0.00 1.31 -0.31 0.00 0.02 0.00 0.00 54.97 55.99 3pck s GLU 376 Cb 0.00 -4.23 -0.08 0.00 0.10 0.00 0.00 34.13 29.91 3pck s GLU 376 CO 0.00 -2.02 1.54 1.03 0.02 0.00 0.00 175.26 175.83 3pck s ARG 377 N 5.93 4.24 0.01 1.61 0.52 -1.26 -1.17 118.95 128.82 3pck s ARG 377 Ca 0.78 2.23 -0.11 0.00 -0.52 0.00 0.00 55.73 58.12 3pck s ARG 377 Cb -0.21 -3.39 0.01 0.00 0.52 0.00 0.00 34.95 31.88 3pck s ARG 377 CO 0.31 -0.61 0.22 0.96 0.02 0.00 0.00 175.30 176.20 3pck s ILE 378 N 1.86 0.08 -0.13 1.52 -4.36 0.13 -2.29 121.20 118.00 3pck s ILE 378 Ca 0.69 -0.68 -0.04 0.00 -0.26 0.00 0.00 60.65 60.36 3pck s ILE 378 Cb -0.39 -0.65 -0.03 0.00 1.25 0.00 0.00 42.46 42.63 3pck s ILE 378 CO 0.31 -0.38 0.01 -0.63 0.24 0.00 0.00 174.94 174.49 3pck s ILE 379 N -1.77 4.31 -0.23 8.37 1.01 0.48 -1.12 121.20 132.26 3pck s ILE 379 Ca -0.11 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.32 3pck s ILE 379 Cb -0.05 -2.87 0.03 0.00 0.01 0.00 0.00 42.46 39.58 3pck s ILE 379 CO 0.01 0.53 -0.12 -0.69 0.00 0.00 0.00 174.94 174.67 3pck s VAL 380 N -0.17 2.40 0.12 2.92 1.01 0.54 -1.29 120.40 125.93 3pck s VAL 380 Ca 0.05 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 60.88 3pck s VAL 380 Cb -0.13 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 3pck s VAL 380 CO 0.02 0.25 -0.06 0.00 0.00 0.00 0.00 175.10 175.31 3pck s ALA 381 N 1.25 1.09 0.00 5.51 0.00 -0.75 -0.27 121.76 128.59 3pck s ALA 381 Ca -0.01 -1.40 0.00 0.00 0.00 0.00 0.00 51.96 50.55 3pck s ALA 381 Cb -0.16 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.17 3pck s ALA 381 CO -0.07 -0.23 0.00 0.41 0.00 0.00 0.00 175.76 175.86 3pck n GLY 382 N -0.09 -1.09 3.06 0.00 0.00 -0.97 -0.44 105.19 105.65 3pck n GLY 382 Ca -0.11 -0.86 -0.18 0.00 0.00 0.00 0.00 46.02 44.87 3pck n GLY 382 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pck s ARG 383 N -0.50 0.76 -0.30 1.61 3.52 -1.26 -1.31 118.95 121.48 3pck s ARG 383 Ca 0.00 -0.48 -0.11 0.00 -0.13 0.00 0.00 55.73 55.01 3pck s ARG 383 Cb 0.00 -0.72 -0.03 0.00 -1.56 0.00 0.00 34.95 32.64 3pck s ARG 383 CO 0.00 0.19 0.20 0.08 -0.81 0.00 0.00 175.30 174.96 3pck s VAL 384 N -0.50 5.20 0.37 7.11 1.01 0.73 -1.29 120.40 133.02 3pck s VAL 384 Ca 0.02 -0.03 0.07 0.00 0.00 0.00 0.00 61.98 62.03 3pck s VAL 384 Cb -0.05 -3.56 -0.07 0.00 0.00 0.00 0.00 36.38 32.70 3pck s VAL 384 CO 0.00 0.15 -0.00 0.68 0.00 0.00 0.00 175.10 175.92 3pck s VAL 385 N 1.73 1.82 0.54 2.92 -7.23 -0.43 -1.39 120.40 118.36 3pck s VAL 385 Ca 0.06 -2.04 0.09 0.00 -1.81 0.00 0.00 61.98 58.28 3pck s VAL 385 Cb -0.17 -2.85 0.07 0.00 0.56 0.00 0.00 36.38 34.00 3pck s VAL 385 CO 0.10 -0.06 0.74 1.51 -0.31 0.00 0.00 175.10 177.08 3pck s ASP 386 N -3.62 5.19 0.62 4.85 1.47 0.63 -0.63 116.67 125.18 3pck s ASP 386 Ca 0.34 -0.78 0.35 0.00 1.18 0.00 0.00 52.55 53.64 3pck s ASP 386 Cb 0.08 0.13 2.02 0.00 -0.34 0.00 0.00 42.92 44.80 3pck s ASP 386 CO 0.17 -1.23 2.27 1.56 0.68 0.00 0.00 175.17 178.61 3pck h GLN 387 N 0.28 0.00 0.00 2.11 4.20 -1.19 -0.49 115.11 120.02 3pck h GLN 387 Ca -0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.39 3pck h GLN 387 Cb 1.29 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.07 3pck h GLN 387 CO 0.42 0.00 -0.16 0.66 -0.67 0.00 0.00 178.83 179.08 3pck n TYR 388 N -3.53 0.39 0.00 2.96 4.01 -1.26 -4.89 117.16 114.84 3pck n TYR 388 Ca -0.02 0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.83 3pck n TYR 388 Cb 0.12 -0.63 0.00 0.00 -0.31 0.00 0.00 39.34 38.52 3pck n TYR 388 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3pck n GLY 389 N 1.41 0.70 3.72 2.72 0.00 -0.19 -5.07 105.19 108.48 3pck n GLY 389 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 3pck n GLY 389 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3pck s LYS 390 N -0.99 4.51 0.67 1.61 2.20 -1.26 -4.72 119.74 121.76 3pck s LYS 390 Ca 0.00 1.18 -0.17 0.00 -0.36 0.00 0.00 55.97 56.62 3pck s LYS 390 Cb 0.00 -3.45 0.00 0.00 -1.51 0.00 0.00 37.83 32.88 3pck s LYS 390 CO 0.00 0.03 1.24 -2.14 -0.36 0.00 0.00 175.35 174.12 3pck s PRO 391 N 0.83 2.48 -0.40 4.03 0.02 -1.26 -0.27 135.00 140.42 3pck s PRO 391 Ca 0.45 1.90 0.03 0.00 0.02 0.00 0.00 61.00 63.41 3pck s PRO 391 Cb -0.20 -1.86 0.11 0.00 0.02 0.00 0.00 34.50 32.58 3pck s PRO 391 CO 0.24 -1.61 0.12 0.08 -0.33 0.00 0.00 177.00 175.50 3pck s VAL 392 N -1.66 2.45 0.54 3.83 1.01 -0.48 -4.81 120.40 121.28 3pck s VAL 392 Ca 0.78 -2.59 -0.10 0.00 0.00 0.00 0.00 61.98 60.07 3pck s VAL 392 Cb -0.33 -2.77 -0.05 0.00 0.00 0.00 0.00 36.38 33.24 3pck s VAL 392 CO 0.40 -0.66 0.93 -2.16 0.00 0.00 0.00 175.10 173.61 3pck s PRO 393 N 0.59 3.65 -1.39 2.72 0.04 -1.26 -4.32 135.00 135.03 3pck s PRO 393 Ca 0.12 0.59 -0.07 0.00 0.04 0.00 0.00 61.00 61.69 3pck s PRO 393 Cb -0.21 -2.20 0.00 0.00 0.04 0.00 0.00 34.50 32.13 3pck s PRO 393 CO -0.06 -0.37 0.37 0.09 0.04 0.00 0.00 177.00 177.07 3pck n ASN 394 N -2.30 -0.98 -4.60 6.66 4.13 -0.58 -4.94 115.26 112.65 3pck n ASN 394 Ca 0.04 -1.12 -0.30 0.00 1.68 0.00 0.00 54.58 54.88 3pck n ASN 394 Cb 0.54 -2.50 -0.09 0.00 -1.54 0.00 0.00 39.78 36.19 3pck n ASN 394 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 3pck s THR 395 N -3.98 3.51 -0.12 3.41 -1.32 -1.26 -4.60 115.64 111.28 3pck s THR 395 Ca 0.12 -1.21 -0.25 0.00 -1.21 0.00 0.00 61.69 59.14 3pck s THR 395 Cb -0.05 -2.65 -0.02 0.00 -1.51 0.00 0.00 72.50 68.27 3pck s THR 395 CO 0.93 0.11 0.80 -0.22 -2.21 0.00 0.00 174.62 174.03 3pck s LEU 396 N -2.23 4.23 -0.19 9.08 2.96 -1.26 -0.96 118.68 130.31 3pck s LEU 396 Ca 0.22 1.21 -0.00 0.00 -0.22 0.00 0.00 54.13 55.34 3pck s LEU 396 Cb -0.11 -3.21 0.01 0.00 0.50 0.00 0.00 46.19 43.38 3pck s LEU 396 CO 0.15 -0.30 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.03 3pck s VAL 397 N 1.65 2.41 0.02 1.68 1.01 -0.45 -1.89 120.40 124.82 3pck s VAL 397 Ca 0.39 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.60 3pck s VAL 397 Cb -0.17 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.15 3pck s VAL 397 CO 0.15 0.50 -0.19 -1.61 0.00 0.00 0.00 175.10 173.96 3pck s GLU 398 N 1.34 1.39 0.05 2.72 2.02 0.27 -0.58 118.70 125.90 3pck s GLU 398 Ca 0.05 -0.81 -0.05 0.00 0.02 0.00 0.00 54.97 54.18 3pck s GLU 398 Cb -0.13 -1.42 -0.01 0.00 0.10 0.00 0.00 34.13 32.66 3pck s GLU 398 CO -0.10 0.37 0.09 0.00 0.02 0.00 0.00 175.26 175.64 3pck s MET 399 N -0.87 0.64 -0.04 1.61 0.23 0.27 -0.17 119.30 120.97 3pck s MET 399 Ca 0.07 -0.87 -0.23 0.00 -1.03 0.00 0.00 55.69 53.63 3pck s MET 399 Cb -0.08 0.25 0.05 0.00 -1.53 0.00 0.00 34.83 33.52 3pck s MET 399 CO 0.01 -0.16 0.50 1.67 -2.03 0.00 0.00 175.02 175.00 3pck s TRP 400 N -3.07 -0.43 0.23 3.16 -2.14 -0.84 -1.28 118.94 114.57 3pck s TRP 400 Ca -0.01 0.75 -0.22 0.00 2.66 0.00 0.00 56.10 59.27 3pck s TRP 400 Cb 0.02 0.25 0.05 0.00 -3.10 0.00 0.00 33.47 30.68 3pck s TRP 400 CO -0.07 -0.48 0.86 1.14 -2.66 0.00 0.00 176.95 175.74 3pck s GLN 401 N -1.15 1.54 0.94 3.25 -2.07 -0.57 -0.71 119.66 120.90 3pck s GLN 401 Ca -0.11 -0.88 -0.13 0.00 -1.82 0.00 0.00 55.36 52.41 3pck s GLN 401 Cb -0.03 0.50 0.21 0.00 -1.09 0.00 0.00 33.01 32.60 3pck s GLN 401 CO 0.07 -0.71 1.28 0.00 -1.32 0.00 0.00 175.29 174.61 3pck s ALA 402 N -3.32 2.51 0.68 2.60 0.00 -1.26 -4.60 121.76 118.37 3pck s ALA 402 Ca 0.13 -1.44 -0.01 0.00 0.00 0.00 0.00 51.96 50.64 3pck s ALA 402 Cb -0.04 -2.55 0.02 0.00 0.00 0.00 0.00 23.12 20.55 3pck s ALA 402 CO 0.05 -2.36 0.13 0.27 0.00 0.00 0.00 175.76 173.85 3pck n ASN 403 N -3.64 0.09 0.25 0.00 0.23 -0.18 -4.53 115.26 107.48 3pck n ASN 403 Ca 0.17 -1.10 0.08 0.00 -0.53 0.00 0.00 54.58 53.20 3pck n ASN 403 Cb 0.59 -0.09 0.63 0.00 -2.08 0.00 0.00 39.78 38.83 3pck n ASN 403 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3pck h ALA 404 N -1.15 1.99 -0.02 -2.53 0.00 -1.80 -0.05 119.26 115.70 3pck h ALA 404 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3pck h ALA 404 Cb 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3pck h ALA 404 CO 0.04 0.01 -0.15 0.41 0.00 0.00 0.00 179.25 179.56 3pck n GLY 405 N -1.53 -0.04 0.93 0.00 0.00 -1.26 -3.12 105.19 100.16 3pck n GLY 405 Ca -0.03 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.49 3pck n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pck n GLY 406 N 1.29 0.73 3.68 -0.02 0.00 -0.60 -4.78 105.19 105.49 3pck n GLY 406 Ca 0.15 -0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.47 3pck n GLY 406 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pck s ARG 407 N -0.78 4.18 0.17 1.61 6.06 -1.26 -4.74 118.95 124.20 3pck s ARG 407 Ca 0.00 0.17 -0.13 0.00 -2.50 0.00 0.00 55.73 53.27 3pck s ARG 407 Cb 0.00 -3.52 -0.07 0.00 0.06 0.00 0.00 34.95 31.41 3pck s ARG 407 CO 0.00 -0.00 0.56 0.71 -2.50 0.00 0.00 175.30 174.06 3pck s TYR 408 N 1.20 3.55 -1.26 5.12 2.02 -1.26 -1.01 117.35 125.72 3pck s TYR 408 Ca 0.18 1.03 -0.10 0.00 -0.37 0.00 0.00 57.07 57.81 3pck s TYR 408 Cb -0.15 -2.35 0.18 0.00 -0.40 0.00 0.00 41.96 39.24 3pck s TYR 408 CO 0.07 0.38 1.79 -2.13 -1.57 0.00 0.00 175.55 174.09 3pck n ARG 409 N 0.53 3.65 -3.81 -0.62 0.63 -1.26 -4.75 116.66 111.03 3pck n ARG 409 Ca -0.04 -3.65 -0.13 0.00 -0.92 0.00 0.00 57.85 53.12 3pck n ARG 409 Cb 0.52 -2.91 -0.14 0.00 0.45 0.00 0.00 32.46 30.38 3pck n ARG 409 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 3pck s HIS 410 N 0.31 -0.12 0.22 -0.14 2.46 -1.26 -5.06 115.29 111.69 3pck s HIS 410 Ca 0.39 0.34 -0.15 0.00 0.47 0.00 0.00 55.06 56.11 3pck s HIS 410 Cb 0.07 -0.01 0.24 0.00 -0.13 0.00 0.00 32.58 32.75 3pck s HIS 410 CO 0.01 -0.09 1.60 0.87 -2.47 0.00 0.00 174.74 174.66 3pck h LYS 411 N 6.42 -0.04 0.00 2.88 1.57 -2.07 -0.41 116.57 124.92 3pck h LYS 411 Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 3pck h LYS 411 Cb 1.18 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.50 3pck h LYS 411 CO 0.44 -0.03 0.00 0.09 -0.57 0.00 0.00 179.45 179.38 3pck n ASN 412 N -5.46 0.00 -4.61 0.86 5.03 -1.26 -4.64 115.26 105.18 3pck n ASN 412 Ca 0.08 0.44 -0.41 0.00 0.87 0.00 0.00 54.58 55.56 3pck n ASN 412 Cb 0.36 -0.46 -0.06 0.00 -1.02 0.00 0.00 39.78 38.61 3pck n ASN 412 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3pck s ASP 413 N -2.92 6.56 0.00 6.41 2.15 -0.17 -4.90 116.67 123.81 3pck s ASP 413 Ca 0.03 0.53 0.14 0.00 0.43 0.00 0.00 52.55 53.68 3pck s ASP 413 Cb 0.04 -2.36 0.27 0.00 -0.30 0.00 0.00 42.92 40.56 3pck s ASP 413 CO 0.10 -0.53 1.16 0.54 -0.17 0.00 0.00 175.17 176.27 3pck n ARG 414 N 6.00 1.99 -1.72 4.34 5.12 -1.26 -4.92 116.66 126.20 3pck n ARG 414 Ca 0.01 -1.82 -0.43 0.00 -1.93 0.00 0.00 57.85 53.68 3pck n ARG 414 Cb 0.49 -1.32 -0.02 0.00 -1.16 0.00 0.00 32.46 30.45 3pck n ARG 414 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 3pck n TYR 415 N 0.82 2.58 0.29 -1.55 9.36 -1.26 -4.85 117.16 122.54 3pck n TYR 415 Ca 0.12 0.33 0.19 0.00 3.32 0.00 0.00 57.90 61.86 3pck n TYR 415 Cb 0.42 -2.54 0.98 0.00 -0.63 0.00 0.00 39.34 37.57 3pck n TYR 415 CO 0.00 0.00 0.00 1.37 0.22 0.00 0.00 176.86 178.45 3pck h LEU 416 N 4.46 0.00 -9.78 2.98 -0.00 -1.98 -3.43 115.31 107.56 3pck h LEU 416 Ca -0.46 0.00 -0.52 0.00 -0.00 0.00 0.00 57.88 56.89 3pck h LEU 416 Cb 1.25 0.00 0.05 0.00 -0.00 0.00 0.00 40.66 41.96 3pck h LEU 416 CO 0.77 0.00 0.67 0.00 -0.00 0.00 0.00 178.44 179.88 3pck s ALA 417 N -3.91 3.54 0.72 0.17 0.00 -1.26 -4.97 121.76 116.04 3pck s ALA 417 Ca -0.03 1.21 -0.12 0.00 0.00 0.00 0.00 51.96 53.02 3pck s ALA 417 Cb 0.11 -3.49 0.03 0.00 0.00 0.00 0.00 23.12 19.76 3pck s ALA 417 CO 0.36 -0.61 1.09 -1.25 0.00 0.00 0.00 175.76 175.34 3pck s PRO 418 N -0.90 2.61 0.50 0.00 0.04 -1.26 -4.72 135.00 131.27 3pck s PRO 418 Ca 0.54 1.17 -0.18 0.00 0.04 0.00 0.00 61.00 62.57 3pck s PRO 418 Cb -0.39 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.13 3pck s PRO 418 CO 0.45 -1.37 0.98 -0.51 0.04 0.00 0.00 177.00 176.59 3pck s LEU 419 N -5.49 3.69 -0.29 -3.56 1.43 -1.26 -4.69 118.68 108.51 3pck s LEU 419 Ca 0.62 1.62 -0.10 0.00 -1.03 0.00 0.00 54.13 55.25 3pck s LEU 419 Cb -0.17 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.50 3pck s LEU 419 CO 0.51 -0.58 0.15 -0.62 0.23 0.00 0.00 176.35 176.04 3pck s ASP 420 N -2.82 5.65 0.66 2.29 -1.08 -1.26 -4.98 116.67 115.14 3pck s ASP 420 Ca 0.60 -0.28 0.43 0.00 -0.52 0.00 0.00 52.55 52.79 3pck s ASP 420 Cb -0.10 -2.03 2.37 0.00 -1.46 0.00 0.00 42.92 41.70 3pck s ASP 420 CO 0.27 -0.12 2.36 1.55 0.52 0.00 0.00 175.17 179.75 3pck h PRO 421 N 8.35 0.00 -0.44 4.34 0.13 -1.97 -0.51 132.00 141.90 3pck h PRO 421 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3pck h PRO 421 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 3pck h PRO 421 CO 0.59 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.45 3pck n ASN 422 N -3.14 4.36 -3.90 1.44 4.13 -1.26 -4.96 115.26 111.93 3pck n ASN 422 Ca -0.03 -2.69 -0.24 0.00 1.68 0.00 0.00 54.58 53.30 3pck n ASN 422 Cb 0.08 -0.54 -0.17 0.00 -1.54 0.00 0.00 39.78 37.62 3pck n ASN 422 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3pck s PHE 423 N -2.27 1.11 -0.14 3.10 5.36 -0.20 -4.27 117.98 120.67 3pck s PHE 423 Ca 0.44 -0.43 -0.10 0.00 -0.96 0.00 0.00 56.93 55.88 3pck s PHE 423 Cb 0.32 -0.95 -0.03 0.00 -0.34 0.00 0.00 43.02 42.02 3pck s PHE 423 CO 0.16 -0.33 -0.19 0.41 -1.46 0.00 0.00 175.22 173.80 3pck n GLY 424 N 4.48 -0.91 0.00 13.12 0.00 -1.26 -4.67 105.19 115.95 3pck n GLY 424 Ca -0.17 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.67 3pck n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pck n GLY 425 N 1.60 1.07 3.28 -0.02 0.00 -1.26 -4.55 105.19 105.31 3pck n GLY 425 Ca -0.08 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 3pck n GLY 425 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3pck s VAL 426 N -2.00 2.09 0.05 1.61 1.01 -1.26 -1.51 120.40 120.40 3pck s VAL 426 Ca 0.00 -1.06 -0.06 0.00 0.00 0.00 0.00 61.98 60.86 3pck s VAL 426 Cb 0.00 -1.75 -0.01 0.00 0.00 0.00 0.00 36.38 34.62 3pck s VAL 426 CO 0.00 0.57 0.10 -0.83 0.00 0.00 0.00 175.10 174.94 3pck s GLY 427 N -0.24 0.20 -0.12 4.51 0.00 -0.40 -4.78 107.32 106.49 3pck s GLY 427 Ca -0.01 -0.67 -0.21 0.00 0.00 0.00 0.00 44.72 43.83 3pck s GLY 427 CO 0.03 -0.81 0.52 1.09 0.00 0.00 0.00 173.10 173.92 3pck s ARG 428 N -3.13 0.74 -0.22 2.90 1.70 -0.90 -0.56 118.95 119.48 3pck s ARG 428 Ca -0.01 0.40 -0.19 0.00 -0.47 0.00 0.00 55.73 55.47 3pck s ARG 428 Cb 0.02 0.35 0.06 0.00 -0.57 0.00 0.00 34.95 34.81 3pck s ARG 428 CO -0.07 -0.16 0.57 0.00 -1.08 0.00 0.00 175.30 174.56 3pck s LEU 430 N 0.52 4.30 0.60 0.00 2.96 -1.26 -1.34 118.68 124.45 3pck s LEU 430 Ca -0.02 0.75 -0.19 0.00 -0.22 0.00 0.00 54.13 54.45 3pck s LEU 430 Cb -0.04 -2.59 -0.03 0.00 0.50 0.00 0.00 46.19 44.03 3pck s LEU 430 CO -0.02 0.08 1.21 0.42 -1.32 0.00 0.00 176.35 176.71 3pck s THR 431 N 0.33 2.61 0.66 3.68 -4.23 -0.13 -4.84 115.64 113.71 3pck s THR 431 Ca 0.23 0.38 -0.08 0.00 -1.18 0.00 0.00 61.69 61.04 3pck s THR 431 Cb -0.15 -3.15 0.14 0.00 1.34 0.00 0.00 72.50 70.69 3pck s THR 431 CO 0.09 -0.08 0.89 -0.90 -0.54 0.00 0.00 174.62 174.08 3pck n ASP 432 N -1.61 0.44 -0.17 3.99 5.68 -0.21 -1.52 116.55 123.16 3pck n ASP 432 Ca 0.14 -1.55 0.25 0.00 -0.50 0.00 0.00 54.79 53.13 3pck n ASP 432 Cb 0.50 -0.65 0.67 0.00 -1.14 0.00 0.00 41.12 40.50 3pck n ASP 432 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3pck h SER 433 N -0.96 0.09 -0.41 -1.12 0.02 -1.95 0.16 113.55 109.38 3pck h SER 433 Ca -0.29 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 3pck h SER 433 Cb 0.89 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.43 3pck h SER 433 CO 0.24 0.03 0.00 0.47 -1.14 0.00 0.00 176.83 176.44 3pck n ASP 434 N -4.34 3.15 0.00 3.07 8.00 -1.26 -4.61 116.55 120.56 3pck n ASP 434 Ca 0.17 -1.95 0.00 0.00 0.71 0.00 0.00 54.79 53.72 3pck n ASP 434 Cb 0.86 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 3pck n ASP 434 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3pck n GLY 435 N 1.45 0.45 3.82 0.44 0.00 0.57 -4.74 105.19 107.18 3pck n GLY 435 Ca 0.19 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 45.08 3pck n GLY 435 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3pck s TYR 436 N -2.00 3.76 0.17 1.61 2.02 -1.26 -0.20 117.35 121.45 3pck s TYR 436 Ca 0.00 1.20 0.02 0.00 -0.37 0.00 0.00 57.07 57.92 3pck s TYR 436 Cb 0.00 -2.45 -0.05 0.00 -0.40 0.00 0.00 41.96 39.07 3pck s TYR 436 CO 0.00 0.56 -0.00 1.52 -1.57 0.00 0.00 175.55 176.06 3pck s TYR 437 N -1.18 1.18 -0.12 2.71 1.13 -0.42 -1.04 117.35 119.60 3pck s TYR 437 Ca 0.30 -1.01 -0.29 0.00 -1.41 0.00 0.00 57.07 54.66 3pck s TYR 437 Cb -0.18 -0.67 0.08 0.00 -1.10 0.00 0.00 41.96 40.08 3pck s TYR 437 CO 0.18 -0.21 0.73 -1.54 -2.51 0.00 0.00 175.55 172.21 3pck s SER 438 N -3.16 -0.64 0.09 -0.18 1.04 -1.26 -2.30 113.70 107.28 3pck s SER 438 Ca 0.23 0.86 0.03 0.00 0.48 0.00 0.00 55.95 57.55 3pck s SER 438 Cb 0.06 0.74 -0.04 0.00 0.10 0.00 0.00 66.02 66.89 3pck s SER 438 CO 0.03 -0.48 -0.09 -0.36 0.98 0.00 0.00 173.24 173.32 3pck s PHE 439 N -0.77 0.98 -0.10 5.02 0.08 0.63 -4.90 117.98 118.92 3pck s PHE 439 Ca -0.07 -0.68 0.01 0.00 0.12 0.00 0.00 56.93 56.31 3pck s PHE 439 Cb -0.01 -0.55 0.02 0.00 -0.57 0.00 0.00 43.02 41.91 3pck s PHE 439 CO 0.07 -0.04 -0.14 0.50 -0.10 0.00 0.00 175.22 175.51 3pck s ARG 440 N -2.84 2.05 0.00 0.44 3.52 -0.93 -0.34 118.95 120.85 3pck s ARG 440 Ca 0.05 -0.50 0.00 0.00 -0.13 0.00 0.00 55.73 55.15 3pck s ARG 440 Cb -0.02 -1.78 0.00 0.00 -1.56 0.00 0.00 34.95 31.59 3pck s ARG 440 CO -0.01 -0.08 0.00 -2.37 -0.81 0.00 0.00 175.30 172.03 3pck n THR 441 N 4.27 0.00 -4.32 4.11 5.66 -0.27 0.33 114.28 124.06 3pck n THR 441 Ca -0.19 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.57 3pck n THR 441 Cb 0.51 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.17 3pck n THR 441 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3pck s ILE 442 N -2.62 1.85 -0.12 1.09 -4.36 -1.26 -0.69 121.20 115.09 3pck s ILE 442 Ca 0.00 -1.68 -0.29 0.00 -0.26 0.00 0.00 60.65 58.42 3pck s ILE 442 Cb 0.00 -1.71 -0.03 0.00 1.25 0.00 0.00 42.46 41.97 3pck s ILE 442 CO 0.00 -0.09 1.37 -0.75 0.24 0.00 0.00 174.94 175.71 3pck s LYS 443 N -2.14 4.23 0.70 0.37 2.20 -0.32 -4.92 119.74 119.85 3pck s LYS 443 Ca 0.10 1.81 -0.14 0.00 -0.36 0.00 0.00 55.97 57.38 3pck s LYS 443 Cb -0.09 -3.80 0.02 0.00 -1.51 0.00 0.00 37.83 32.44 3pck s LYS 443 CO 0.05 -0.73 1.12 -1.25 -0.36 0.00 0.00 175.35 174.19 3pck s PRO 444 N 3.53 2.56 0.39 4.03 0.04 -1.26 -4.29 135.00 140.00 3pck s PRO 444 Ca 0.60 1.41 -0.00 0.00 0.04 0.00 0.00 61.00 63.05 3pck s PRO 444 Cb -0.25 -1.92 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 3pck s PRO 444 CO 0.19 -1.44 0.60 0.20 0.04 0.00 0.00 177.00 176.60 3pck s GLY 445 N -2.63 1.42 0.75 0.56 0.00 -0.13 -4.68 107.32 102.60 3pck s GLY 445 Ca 0.67 -0.91 -0.14 0.00 0.00 0.00 0.00 44.72 44.35 3pck s GLY 445 CO 0.45 -0.81 1.15 -4.14 0.00 0.00 0.00 173.10 169.75 3pck s PRO 446 N -4.42 2.16 -0.04 2.90 0.02 -1.26 -4.17 135.00 130.18 3pck s PRO 446 Ca 0.43 1.54 0.00 0.00 0.02 0.00 0.00 61.00 62.99 3pck s PRO 446 Cb -0.10 -1.86 0.03 0.00 0.02 0.00 0.00 34.50 32.59 3pck s PRO 446 CO 0.37 -1.78 -0.01 -0.47 -0.33 0.00 0.00 177.00 174.79 3pck s TYR 447 N -2.32 0.52 0.15 6.54 5.04 -0.98 -4.30 117.35 122.01 3pck s TYR 447 Ca 0.69 -0.09 -0.30 0.00 -2.44 0.00 0.00 57.07 54.93 3pck s TYR 447 Cb -0.24 -0.57 -0.07 0.00 0.35 0.00 0.00 41.96 41.43 3pck s TYR 447 CO 0.48 -0.19 1.00 -1.25 -1.34 0.00 0.00 175.55 174.25 3pck s PRO 448 N 1.20 4.70 0.08 4.97 0.04 -1.26 0.01 135.00 144.73 3pck s PRO 448 Ca -0.07 1.54 0.01 0.00 0.04 0.00 0.00 61.00 62.52 3pck s PRO 448 Cb -0.14 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.04 3pck s PRO 448 CO -0.02 0.23 -0.06 1.67 0.04 0.00 0.00 177.00 178.86 3pck s TRP 449 N -0.29 0.76 -1.18 0.56 1.48 -0.94 -4.92 118.94 114.42 3pck s TRP 449 Ca 0.47 -0.88 -0.19 0.00 -1.06 0.00 0.00 56.10 54.44 3pck s TRP 449 Cb -0.26 -0.46 0.09 0.00 -1.16 0.00 0.00 33.47 31.68 3pck s TRP 449 CO 0.32 -0.19 1.55 1.03 -4.06 0.00 0.00 176.95 175.60 3pck s ARG 450 N -3.47 3.87 0.00 3.25 0.52 -1.26 -4.30 118.95 117.56 3pck s ARG 450 Ca 0.07 -1.87 0.00 0.00 -0.52 0.00 0.00 55.73 53.41 3pck s ARG 450 Cb 0.03 -5.34 0.00 0.00 0.52 0.00 0.00 34.95 30.16 3pck s ARG 450 CO -0.05 -2.11 0.00 -1.71 0.02 0.00 0.00 175.30 171.45 3pck n ASN 451 N 7.82 0.00 -4.46 0.23 5.15 -1.26 -5.04 115.26 117.69 3pck n ASN 451 Ca 0.40 0.00 -0.29 0.00 -0.60 0.00 0.00 54.58 54.09 3pck n ASN 451 Cb 0.47 0.00 0.15 0.00 -0.53 0.00 0.00 39.78 39.87 3pck n ASN 451 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3pck s GLY 452 N -0.15 1.66 0.52 8.20 0.00 -1.26 -4.96 107.32 111.33 3pck s GLY 452 Ca 0.00 -0.87 0.26 0.00 0.00 0.00 0.00 44.72 44.10 3pck s GLY 452 CO 0.00 -0.22 2.08 -2.55 0.00 0.00 0.00 173.10 172.41 3pck h PRO 453 N -1.54 0.00 -1.79 2.90 0.11 -1.98 -3.32 132.00 126.38 3pck h PRO 453 Ca -0.46 0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.18 3pck h PRO 453 Cb 1.29 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 32.00 3pck h PRO 453 CO 0.51 0.12 -1.12 -1.71 -0.21 0.00 0.00 178.00 175.59 3pck n ASN 454 N -3.74 1.53 -4.80 -2.05 5.15 -1.26 -5.09 115.26 105.00 3pck n ASN 454 Ca -0.02 -3.05 -0.37 0.00 -0.60 0.00 0.00 54.58 50.54 3pck n ASN 454 Cb 0.23 -0.59 -0.06 0.00 -0.53 0.00 0.00 39.78 38.83 3pck n ASN 454 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3pck s ASP 455 N -2.75 6.54 -0.05 1.20 1.01 -1.25 -5.07 116.67 116.30 3pck s ASP 455 Ca 0.38 0.64 0.00 0.00 0.71 0.00 0.00 52.55 54.28 3pck s ASP 455 Cb 0.37 -2.17 0.02 0.00 1.01 0.00 0.00 42.92 42.15 3pck s ASP 455 CO -0.06 0.25 -0.02 0.26 0.21 0.00 0.00 175.17 175.81 3pck s TRP 456 N -0.40 0.59 0.14 4.23 0.52 -1.26 -2.22 118.94 120.54 3pck s TRP 456 Ca 0.18 -0.13 -0.30 0.00 0.02 0.00 0.00 56.10 55.87 3pck s TRP 456 Cb -0.14 -0.63 -0.07 0.00 -1.15 0.00 0.00 33.47 31.49 3pck s TRP 456 CO 0.07 -0.21 1.12 1.03 0.02 0.00 0.00 176.95 178.98 3pck s ARG 457 N 1.25 4.55 0.72 4.98 1.81 0.10 -4.80 118.95 127.56 3pck s ARG 457 Ca -0.06 1.72 -0.15 0.00 -1.72 0.00 0.00 55.73 55.52 3pck s ARG 457 Cb -0.13 -3.30 0.03 0.00 -0.45 0.00 0.00 34.95 31.10 3pck s ARG 457 CO -0.02 -0.02 1.20 -2.14 -0.68 0.00 0.00 175.30 173.63 3pck s PRO 458 N 0.08 2.21 0.21 3.54 0.02 -1.26 -2.32 135.00 137.48 3pck s PRO 458 Ca 0.52 1.72 -0.32 0.00 0.02 0.00 0.00 61.00 62.93 3pck s PRO 458 Cb -0.29 -1.85 -0.13 0.00 0.02 0.00 0.00 34.50 32.25 3pck s PRO 458 CO 0.33 -1.77 1.57 0.00 -0.33 0.00 0.00 177.00 176.80 3pck n ALA 459 N -2.69 1.75 -3.45 -1.55 0.00 -1.26 -4.72 120.51 108.59 3pck n ALA 459 Ca 0.13 0.42 -0.16 0.00 0.00 0.00 0.00 53.44 53.83 3pck n ALA 459 Cb 0.50 -2.38 -0.05 0.00 0.00 0.00 0.00 19.45 17.52 3pck n ALA 459 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3pck s HIS 460 N 0.60 -0.58 -0.11 0.00 -3.43 -1.26 -4.07 115.29 106.44 3pck s HIS 460 Ca 0.73 0.79 0.03 0.00 -0.80 0.00 0.00 55.06 55.81 3pck s HIS 460 Cb -0.61 0.43 -0.01 0.00 -1.43 0.00 0.00 32.58 30.96 3pck s HIS 460 CO 0.41 -0.67 -0.20 0.42 -2.00 0.00 0.00 174.74 172.70 3pck s ILE 461 N -2.05 2.41 0.19 -5.38 1.01 -0.66 -4.63 121.20 112.08 3pck s ILE 461 Ca -0.07 -0.89 -0.30 0.00 0.00 0.00 0.00 60.65 59.39 3pck s ILE 461 Cb -0.01 -1.96 -0.08 0.00 0.01 0.00 0.00 42.46 40.43 3pck s ILE 461 CO 0.02 0.55 0.97 -1.00 0.00 0.00 0.00 174.94 175.48 3pck s HIS 462 N 0.35 3.86 0.01 3.97 3.76 0.12 -0.85 115.29 126.51 3pck s HIS 462 Ca -0.16 1.83 0.07 0.00 -0.15 0.00 0.00 55.06 56.65 3pck s HIS 462 Cb -0.17 -3.06 -0.02 0.00 1.11 0.00 0.00 32.58 30.44 3pck s HIS 462 CO 0.08 0.20 -0.21 -0.06 -0.85 0.00 0.00 174.74 173.90 3pck s PHE 463 N -0.65 1.84 -0.07 1.40 0.40 0.64 -1.98 117.98 119.56 3pck s PHE 463 Ca 0.44 -0.36 0.02 0.00 -0.60 0.00 0.00 56.93 56.44 3pck s PHE 463 Cb -0.26 -1.15 0.01 0.00 0.51 0.00 0.00 43.02 42.13 3pck s PHE 463 CO 0.32 0.02 -0.13 0.20 0.70 0.00 0.00 175.22 176.33 3pck s GLY 464 N -0.75 0.86 -0.07 4.36 0.00 0.76 -0.98 107.32 111.50 3pck s GLY 464 Ca 0.08 -0.49 -0.00 0.00 0.00 0.00 0.00 44.72 44.31 3pck s GLY 464 CO 0.00 0.12 -0.05 -0.42 0.00 0.00 0.00 173.10 172.75 3pck s ILE 465 N 0.70 0.68 -0.03 0.90 1.09 0.70 -0.57 121.20 124.68 3pck s ILE 465 Ca -0.14 -0.13 -0.13 0.00 -1.10 0.00 0.00 60.65 59.16 3pck s ILE 465 Cb -0.16 -0.74 -0.07 0.00 -1.06 0.00 0.00 42.46 40.43 3pck s ILE 465 CO 0.03 0.29 0.59 0.77 -0.10 0.00 0.00 174.94 176.52 3pck h SER 466 N 7.81 -0.40 -4.18 3.58 4.64 -1.65 -0.38 113.55 122.96 3pck h SER 466 Ca -0.29 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 3pck h SER 466 Cb 1.14 0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3pck h SER 466 CO 0.38 -0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.94 3pck n GLY 467 N 0.47 -2.25 0.19 -0.77 0.00 -1.26 -2.37 105.19 99.21 3pck n GLY 467 Ca -0.06 -1.58 0.14 0.00 0.00 0.00 0.00 46.02 44.52 3pck n GLY 467 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3pck h PRO 468 N 0.00 0.00 -3.68 1.61 0.13 -1.93 -3.47 132.00 124.66 3pck h PRO 468 Ca 0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.99 3pck h PRO 468 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 3pck h PRO 468 CO 0.00 0.00 -0.04 -1.54 -0.23 0.00 0.00 178.00 176.19 3pck s SER 469 N -5.15 0.36 0.36 1.44 1.04 -1.26 -3.68 113.70 106.81 3pck s SER 469 Ca 0.05 -1.21 0.15 0.00 0.48 0.00 0.00 55.95 55.42 3pck s SER 469 Cb 0.09 0.69 0.69 0.00 0.10 0.00 0.00 66.02 67.58 3pck s SER 469 CO 0.54 -1.35 1.77 0.16 0.98 0.00 0.00 173.24 175.34 3pck h ILE 470 N 2.12 1.13 0.00 -1.02 3.07 -1.36 -1.69 117.51 119.76 3pck h ILE 470 Ca -0.28 -1.49 -0.01 0.00 1.55 0.00 0.00 64.86 64.63 3pck h ILE 470 Cb 1.25 1.84 -0.00 0.00 -0.27 0.00 0.00 36.82 39.63 3pck h ILE 470 CO 0.38 0.40 -0.07 0.00 -1.05 0.00 0.00 178.15 177.81 3pck h ALA 471 N 1.59 1.64 0.00 0.16 0.00 -1.73 -3.02 119.26 117.90 3pck h ALA 471 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3pck h ALA 471 Cb 0.81 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3pck h ALA 471 CO 0.05 0.09 -1.42 0.25 0.00 0.00 0.00 179.25 178.22 3pck n THR 472 N -4.11 0.05 -1.63 0.00 -2.24 -0.66 -4.95 114.28 100.74 3pck n THR 472 Ca -0.03 -0.27 -0.47 0.00 -2.27 0.00 0.00 64.05 61.01 3pck n THR 472 Cb 0.16 0.39 -0.04 0.00 -2.10 0.00 0.00 70.33 68.74 3pck n THR 472 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3pck n LYS 473 N -1.94 1.62 -3.82 -0.78 3.00 -1.00 -4.72 118.16 110.52 3pck n LYS 473 Ca 0.00 0.58 -0.12 0.00 -0.00 0.00 0.00 58.31 58.77 3pck n LYS 473 Cb 0.46 -2.19 -0.10 0.00 0.00 0.00 0.00 35.03 33.19 3pck n LYS 473 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3pck s LEU 474 N 0.45 1.25 -0.06 3.14 2.96 -0.15 -5.03 118.68 121.23 3pck s LEU 474 Ca 0.73 0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.80 3pck s LEU 474 Cb -0.76 0.82 0.01 0.00 0.50 0.00 0.00 46.19 46.76 3pck s LEU 474 CO 0.49 -0.26 -0.15 -0.63 -1.32 0.00 0.00 176.35 174.47 3pck s ILE 475 N -0.74 1.35 0.01 6.68 1.01 -1.26 -0.21 121.20 128.04 3pck s ILE 475 Ca -0.08 -0.63 -0.00 0.00 0.00 0.00 0.00 60.65 59.94 3pck s ILE 475 Cb -0.05 -1.20 0.00 0.00 0.01 0.00 0.00 42.46 41.23 3pck s ILE 475 CO 0.02 0.40 0.02 1.07 0.00 0.00 0.00 174.94 176.45 3pck n THR 476 N 3.55 0.00 -3.84 2.92 5.66 -0.15 -5.02 114.28 117.40 3pck n THR 476 Ca -0.21 -0.04 -0.12 0.00 -3.05 0.00 0.00 64.05 60.63 3pck n THR 476 Cb 0.52 0.03 -0.12 0.00 -1.55 0.00 0.00 70.33 69.22 3pck n THR 476 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3pck s GLN 477 N -2.01 0.21 -0.11 1.09 -0.21 -1.26 -0.26 119.66 117.11 3pck s GLN 477 Ca 0.01 0.05 -0.10 0.00 0.02 0.00 0.00 55.36 55.34 3pck s GLN 477 Cb -0.00 0.10 -0.05 0.00 1.00 0.00 0.00 33.01 34.06 3pck s GLN 477 CO 0.01 -0.04 0.21 -1.17 -2.12 0.00 0.00 175.29 172.18 3pck s LEU 478 N -0.24 4.37 0.30 2.90 0.20 -0.03 -4.83 118.68 121.36 3pck s LEU 478 Ca -0.03 0.55 0.11 0.00 0.69 0.00 0.00 54.13 55.45 3pck s LEU 478 Cb -0.02 -2.21 -0.05 0.00 -0.43 0.00 0.00 46.19 43.48 3pck s LEU 478 CO 0.00 0.34 -0.15 -0.31 -0.29 0.00 0.00 176.35 175.94 3pck s TYR 479 N -0.75 2.35 -0.21 5.38 2.02 0.25 -1.66 117.35 124.74 3pck s TYR 479 Ca 0.16 -0.37 -0.10 0.00 -0.37 0.00 0.00 57.07 56.39 3pck s TYR 479 Cb -0.13 -1.12 -0.05 0.00 -0.40 0.00 0.00 41.96 40.26 3pck s TYR 479 CO 0.05 0.67 0.13 -0.06 -1.57 0.00 0.00 175.55 174.78 3pck s PHE 480 N -2.52 3.39 0.05 2.71 0.40 -1.26 -0.30 117.98 120.46 3pck s PHE 480 Ca 0.31 0.30 -0.37 0.00 -0.60 0.00 0.00 56.93 56.57 3pck s PHE 480 Cb -0.03 -2.18 -0.19 0.00 0.51 0.00 0.00 43.02 41.13 3pck s PHE 480 CO 0.16 0.24 1.09 -1.91 0.70 0.00 0.00 175.22 175.50 3pck n GLU 481 N 3.67 0.38 -0.71 0.44 2.13 -0.94 -1.81 120.64 123.79 3pck n GLU 481 Ca -0.16 0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.80 3pck n GLU 481 Cb 0.52 -1.62 0.00 0.00 0.27 0.00 0.00 31.44 30.61 3pck n GLU 481 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3pck n GLY 482 N 1.83 1.02 3.63 8.31 0.00 -1.26 -4.99 105.19 113.72 3pck n GLY 482 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 3pck n GLY 482 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3pck s ASP 483 N -2.88 5.86 0.60 1.61 -1.08 -0.75 -4.86 116.67 115.18 3pck s ASP 483 Ca 0.00 2.21 0.38 0.00 -0.52 0.00 0.00 52.55 54.62 3pck s ASP 483 Cb 0.00 -2.52 1.91 0.00 -1.46 0.00 0.00 42.92 40.85 3pck s ASP 483 CO 0.00 -1.59 2.19 1.55 0.52 0.00 0.00 175.17 177.85 3pck h PRO 484 N 13.22 0.00 0.00 4.34 0.13 -1.94 -2.66 132.00 145.09 3pck h PRO 484 Ca -0.45 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.64 3pck h PRO 484 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 3pck h PRO 484 CO 0.95 0.02 -0.22 -0.07 -0.23 0.00 0.00 178.00 178.45 3pck h LEU 485 N 0.00 0.00 -0.35 1.56 3.38 -1.96 -3.37 115.31 114.58 3pck h LEU 485 Ca -0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3pck h LEU 485 Cb 0.23 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.89 3pck h LEU 485 CO 0.00 0.22 -0.51 0.40 0.09 0.00 0.00 178.44 178.64 3pck h ILE 486 N 0.00 0.04 0.00 1.22 2.04 -1.86 -2.26 117.51 116.69 3pck h ILE 486 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pck h ILE 486 Cb 0.68 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3pck h ILE 486 CO 0.03 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.37 3pck n PRO 487 N -5.40 0.15 0.00 2.37 -0.04 -1.26 -2.35 135.00 128.47 3pck n PRO 487 Ca -0.03 0.54 0.11 0.00 -0.04 0.00 0.00 63.50 64.08 3pck n PRO 487 Cb 0.35 -1.89 0.07 0.00 -0.04 0.00 0.00 33.50 32.00 3pck n PRO 487 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3pck n MET 488 N -2.18 0.05 -2.62 0.54 2.81 -0.86 -4.95 117.12 109.91 3pck n MET 488 Ca 0.00 -0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.46 3pck n MET 488 Cb 0.11 -1.52 -0.02 0.00 -0.71 0.00 0.00 33.22 31.08 3pck n MET 488 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3pck h PRO 490 N 7.32 0.55 -0.39 0.00 0.11 -1.90 0.18 132.00 137.87 3pck h PRO 490 Ca -0.29 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3pck h PRO 490 Cb 1.13 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.09 3pck h PRO 490 CO 0.89 0.36 0.26 0.82 -0.21 0.00 0.00 178.00 180.12 3pck h ILE 491 N 0.57 1.10 -0.15 4.15 2.04 -1.92 -1.56 117.51 121.72 3pck h ILE 491 Ca 0.23 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.91 3pck h ILE 491 Cb 0.10 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 3pck h ILE 491 CO -0.14 0.10 0.10 0.58 0.00 0.00 0.00 178.15 178.79 3pck h VAL 492 N 0.52 1.05 0.00 1.67 2.07 -1.77 -2.13 116.25 117.66 3pck h VAL 492 Ca 0.14 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.56 3pck h VAL 492 Cb -0.06 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 3pck h VAL 492 CO -0.03 0.05 0.00 0.29 0.02 0.00 0.00 177.57 177.89 3pck n LYS 493 N -4.97 0.04 0.31 1.57 5.02 0.61 -1.43 118.16 119.31 3pck n LYS 493 Ca -0.04 0.48 0.21 0.00 -2.02 0.00 0.00 58.31 56.93 3pck n LYS 493 Cb 0.03 -1.62 1.03 0.00 -0.02 0.00 0.00 35.03 34.45 3pck n LYS 493 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3pck h SER 494 N 0.00 0.00 -3.60 4.39 4.64 -0.58 -3.37 113.55 115.04 3pck h SER 494 Ca 0.00 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 60.68 3pck h SER 494 Cb 0.07 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.02 3pck h SER 494 CO 0.00 0.00 -0.01 -0.63 -0.87 0.00 0.00 176.83 175.32 3pck s ILE 495 N -3.97 5.00 0.20 0.95 1.01 -0.51 -3.68 121.20 120.20 3pck s ILE 495 Ca -0.03 0.49 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 3pck s ILE 495 Cb 0.11 -3.96 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 3pck s ILE 495 CO 0.44 -0.18 1.53 0.00 0.00 0.00 0.00 174.94 176.74 3pck h ALA 496 N 8.38 0.73 -2.45 9.38 0.00 -1.86 -3.44 119.26 130.00 3pck h ALA 496 Ca -0.28 -0.48 -0.63 0.00 0.00 0.00 0.00 54.91 53.52 3pck h ALA 496 Cb 1.13 -0.09 -0.14 0.00 0.00 0.00 0.00 17.79 18.68 3pck h ALA 496 CO 0.77 0.67 0.02 1.21 0.00 0.00 0.00 179.25 181.93 3pck s ASN 497 N -6.89 6.39 0.57 0.00 3.04 -1.26 -4.94 114.94 111.85 3pck s ASN 497 Ca -0.08 0.22 0.26 0.00 0.04 0.00 0.00 52.86 53.31 3pck s ASN 497 Cb 0.12 -2.29 1.57 0.00 -1.54 0.00 0.00 41.25 39.10 3pck s ASN 497 CO 0.84 -0.45 2.10 1.55 -3.04 0.00 0.00 177.10 178.10 3pck h PRO 498 N 8.30 0.00 -0.18 0.43 0.13 -2.00 0.23 132.00 138.91 3pck h PRO 498 Ca -0.28 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.77 3pck h PRO 498 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.24 3pck h PRO 498 CO 0.77 0.00 -0.27 0.93 -0.23 0.00 0.00 178.00 179.20 3pck h GLU 499 N 0.00 0.34 -0.28 0.86 5.08 -1.98 -2.47 114.58 116.13 3pck h GLU 499 Ca 0.10 -0.13 -0.17 0.00 -1.00 0.00 0.00 59.36 58.16 3pck h GLU 499 Cb 0.48 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 3pck h GLU 499 CO -0.00 0.59 -0.52 0.00 -1.00 0.00 0.00 179.01 178.08 3pck h ALA 500 N 1.42 0.55 -0.47 3.43 0.00 -0.90 -3.14 119.26 120.14 3pck h ALA 500 Ca 0.05 -0.50 0.04 0.00 0.00 0.00 0.00 54.91 54.50 3pck h ALA 500 Cb 0.64 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 3pck h ALA 500 CO 0.05 0.68 0.23 0.28 0.00 0.00 0.00 179.25 180.48 3pck h VAL 501 N 0.62 0.94 -0.89 0.00 2.07 -1.13 -2.04 116.25 115.82 3pck h VAL 501 Ca 0.02 -0.15 0.18 0.00 0.82 0.00 0.00 66.70 67.57 3pck h VAL 501 Cb 1.11 0.46 -0.07 0.00 -1.52 0.00 0.00 31.29 31.26 3pck h VAL 501 CO 0.11 0.08 0.58 1.56 0.02 0.00 0.00 177.57 179.93 3pck h GLN 502 N 0.45 0.49 0.00 1.57 1.08 -1.41 -0.85 115.11 116.43 3pck h GLN 502 Ca 0.21 -0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.38 3pck h GLN 502 Cb 0.13 -0.11 -0.00 0.00 -0.05 0.00 0.00 27.48 27.45 3pck h GLN 502 CO -0.16 0.32 -0.02 1.96 -0.95 0.00 0.00 178.83 179.98 3pck h GLN 503 N 0.50 0.00 -0.01 1.46 4.20 -1.38 -2.15 115.11 117.73 3pck h GLN 503 Ca 0.46 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.17 3pck h GLN 503 Cb 1.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.79 3pck h GLN 503 CO -0.20 0.02 -0.25 1.28 -0.67 0.00 0.00 178.83 179.01 3pck n LEU 504 N -3.51 1.09 -4.54 1.46 4.77 -0.33 -4.86 117.00 111.08 3pck n LEU 504 Ca -0.03 -0.29 -0.41 0.00 -0.03 0.00 0.00 56.01 55.25 3pck n LEU 504 Cb 0.11 -0.11 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3pck n LEU 504 CO 0.25 0.20 0.14 -0.63 -1.33 0.00 0.00 177.39 176.03 3pck s ILE 505 N -2.47 5.08 0.36 -0.08 1.01 -0.81 -0.58 121.20 123.71 3pck s ILE 505 Ca 0.25 0.13 -0.27 0.00 0.00 0.00 0.00 60.65 60.76 3pck s ILE 505 Cb 0.19 -3.93 -0.09 0.00 0.01 0.00 0.00 42.46 38.64 3pck s ILE 505 CO 0.51 -0.21 1.24 0.00 0.00 0.00 0.00 174.94 176.48 3pck s ALA 506 N 2.23 3.32 -0.12 9.38 0.00 0.59 -4.84 121.76 132.32 3pck s ALA 506 Ca 0.15 1.11 -0.04 0.00 0.00 0.00 0.00 51.96 53.18 3pck s ALA 506 Cb -0.16 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 3pck s ALA 506 CO 0.13 -0.59 0.05 0.15 0.00 0.00 0.00 175.76 175.50 3pck s LYS 507 N -2.02 3.33 0.07 0.00 -0.14 -0.45 -2.22 119.74 118.32 3pck s LYS 507 Ca 0.53 -0.32 -0.35 0.00 -1.36 0.00 0.00 55.97 54.47 3pck s LYS 507 Cb -0.35 -2.99 -0.14 0.00 -1.68 0.00 0.00 37.83 32.66 3pck s LYS 507 CO 0.46 0.63 1.60 -0.11 -0.76 0.00 0.00 175.35 177.16 3pck n LEU 508 N 2.42 2.84 -3.87 3.17 7.94 -1.26 -0.60 117.00 127.63 3pck n LEU 508 Ca -0.19 1.07 -0.30 0.00 -1.11 0.00 0.00 56.01 55.49 3pck n LEU 508 Cb 0.54 -1.35 -0.14 0.00 0.53 0.00 0.00 43.42 43.00 3pck n LEU 508 CO 0.31 -0.40 -0.19 -0.62 -1.11 0.00 0.00 177.39 175.37 3pck s ASP 509 N 1.59 4.11 0.41 1.96 -1.08 0.39 -4.83 116.67 119.23 3pck s ASP 509 Ca 0.84 -2.94 0.10 0.00 -0.52 0.00 0.00 52.55 50.03 3pck s ASP 509 Cb -0.76 -1.45 0.87 0.00 -1.46 0.00 0.00 42.92 40.12 3pck s ASP 509 CO 0.44 -0.23 1.97 0.24 0.52 0.00 0.00 175.17 178.11 3pck h MET 510 N 6.51 0.26 0.00 4.34 2.86 -1.93 -2.01 114.93 124.96 3pck h MET 510 Ca -0.05 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.54 3pck h MET 510 Cb 0.90 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.51 3pck h MET 510 CO 0.63 0.32 -0.03 -0.91 1.06 0.00 0.00 176.91 177.97 3pck h ASN 511 N 0.25 0.00 -0.02 1.22 2.35 -1.95 -2.80 115.58 114.64 3pck h ASN 511 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3pck h ASN 511 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 3pck h ASN 511 CO 0.01 0.03 -0.13 -3.20 -1.65 0.00 0.00 177.43 172.49 3pck n ASN 512 N -3.17 2.28 -4.79 5.81 5.15 -0.77 -4.97 115.26 114.81 3pck n ASN 512 Ca -0.00 -1.64 -0.35 0.00 -0.60 0.00 0.00 54.58 51.99 3pck n ASN 512 Cb 0.26 0.16 -0.02 0.00 -0.53 0.00 0.00 39.78 39.65 3pck n ASN 512 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3pck s ALA 513 N -1.74 2.83 -0.50 5.20 0.00 -1.06 -4.73 121.76 121.77 3pck s ALA 513 Ca 0.19 0.71 -0.16 0.00 0.00 0.00 0.00 51.96 52.71 3pck s ALA 513 Cb 0.15 -3.30 0.09 0.00 0.00 0.00 0.00 23.12 20.06 3pck s ALA 513 CO 0.31 -0.49 0.44 -0.80 0.00 0.00 0.00 175.76 175.22 3pck s ASN 514 N -1.83 6.17 0.22 0.00 -0.87 -0.21 -5.01 114.94 113.40 3pck s ASN 514 Ca 0.68 -1.49 -0.30 0.00 -1.57 0.00 0.00 52.86 50.18 3pck s ASN 514 Cb -0.20 -2.20 -0.15 0.00 -0.02 0.00 0.00 41.25 38.68 3pck s ASN 514 CO 0.24 -0.73 1.02 -2.65 -2.57 0.00 0.00 177.10 172.41 3pck n PRO 515 N 5.25 1.09 -1.46 -0.60 -0.02 -1.26 -0.71 135.00 137.29 3pck n PRO 515 Ca -0.13 0.39 -0.16 0.00 -2.02 0.00 0.00 63.50 61.57 3pck n PRO 515 Cb 0.42 -1.77 -0.07 0.00 -0.02 0.00 0.00 33.50 32.06 3pck n PRO 515 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3pck n MET 516 N 1.22 -1.48 0.02 -0.52 2.81 -1.26 -4.68 117.12 113.22 3pck n MET 516 Ca 0.13 1.03 0.00 0.00 -1.81 0.00 0.00 57.70 57.05 3pck n MET 516 Cb 0.28 -5.36 0.00 0.00 -0.71 0.00 0.00 33.22 27.42 3pck n MET 516 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3pck n ASP 517 N -1.06 0.04 -3.71 7.83 2.03 0.11 -5.15 116.55 116.64 3pck n ASP 517 Ca -0.16 0.06 -0.14 0.00 0.52 0.00 0.00 54.79 55.06 3pck n ASP 517 Cb 0.59 0.03 -0.08 0.00 -0.72 0.00 0.00 41.12 40.94 3pck n ASP 517 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3pck s LEU 519 N -1.39 2.80 0.01 0.00 1.43 -0.97 -1.05 118.68 119.52 3pck s LEU 519 Ca -0.12 0.15 -0.08 0.00 -1.03 0.00 0.00 54.13 53.05 3pck s LEU 519 Cb -0.04 -2.43 0.00 0.00 0.03 0.00 0.00 46.19 43.75 3pck s LEU 519 CO 0.05 -2.20 0.15 0.00 0.23 0.00 0.00 176.35 174.57 3pck s ALA 520 N -3.52 -0.33 0.01 4.21 0.00 -1.26 -0.39 121.76 120.48 3pck s ALA 520 Ca 0.68 -0.17 0.05 0.00 0.00 0.00 0.00 51.96 52.53 3pck s ALA 520 Cb -0.06 0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 3pck s ALA 520 CO 0.49 -0.24 -0.17 0.71 0.00 0.00 0.00 175.76 176.55 3pck s TYR 521 N -1.64 1.46 -0.20 0.00 1.51 -0.41 0.15 117.35 118.22 3pck s TYR 521 Ca -0.13 -0.32 -0.06 0.00 -1.01 0.00 0.00 57.07 55.56 3pck s TYR 521 Cb -0.06 -0.90 -0.03 0.00 -0.11 0.00 0.00 41.96 40.86 3pck s TYR 521 CO 0.01 0.02 0.01 0.50 -1.11 0.00 0.00 175.55 174.98 3pck s ARG 522 N -0.77 3.69 -0.23 -0.62 6.06 0.23 -1.81 118.95 125.49 3pck s ARG 522 Ca 0.05 -0.49 -0.04 0.00 -2.50 0.00 0.00 55.73 52.75 3pck s ARG 522 Cb -0.07 -3.11 0.08 0.00 0.06 0.00 0.00 34.95 31.91 3pck s ARG 522 CO 0.00 0.06 0.11 0.12 -2.50 0.00 0.00 175.30 173.09 3pck s PHE 523 N 0.89 0.28 0.16 5.12 5.36 0.41 -1.34 117.98 128.87 3pck s PHE 523 Ca 0.02 -0.60 -0.07 0.00 -0.96 0.00 0.00 56.93 55.31 3pck s PHE 523 Cb -0.14 -0.81 -0.06 0.00 -0.34 0.00 0.00 43.02 41.67 3pck s PHE 523 CO 0.02 -0.67 0.43 -0.51 -1.46 0.00 0.00 175.22 173.03 3pck s ASP 524 N 2.11 6.55 -0.04 6.13 1.01 -1.26 -3.98 116.67 127.19 3pck s ASP 524 Ca 0.05 0.71 0.04 0.00 0.71 0.00 0.00 52.55 54.07 3pck s ASP 524 Cb -0.16 -2.14 -0.00 0.00 1.01 0.00 0.00 42.92 41.63 3pck s ASP 524 CO -0.22 0.03 -0.17 -0.63 0.21 0.00 0.00 175.17 174.38 3pck s ILE 525 N -1.67 1.45 -0.21 0.77 1.01 -0.41 -4.95 121.20 117.20 3pck s ILE 525 Ca 0.42 -0.73 -0.03 0.00 0.00 0.00 0.00 60.65 60.30 3pck s ILE 525 Cb -0.12 -1.24 -0.01 0.00 0.01 0.00 0.00 42.46 41.10 3pck s ILE 525 CO 0.23 0.42 -0.06 -0.69 0.00 0.00 0.00 174.94 174.83 3pck s VAL 526 N -0.01 3.24 0.34 2.92 1.01 -1.26 -1.31 120.40 125.33 3pck s VAL 526 Ca -0.03 -0.54 0.07 0.00 0.00 0.00 0.00 61.98 61.48 3pck s VAL 526 Cb -0.11 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.80 3pck s VAL 526 CO 0.02 0.44 0.38 -0.76 0.00 0.00 0.00 175.10 175.19 3pck s LEU 527 N 1.33 3.78 0.21 3.92 1.43 0.20 -4.93 118.68 124.61 3pck s LEU 527 Ca 0.04 -0.35 -0.32 0.00 -1.03 0.00 0.00 54.13 52.47 3pck s LEU 527 Cb -0.14 -2.48 -0.15 0.00 0.03 0.00 0.00 46.19 43.45 3pck s LEU 527 CO -0.03 -0.40 1.24 0.54 0.23 0.00 0.00 176.35 177.93 3pck n ARG 528 N -1.51 1.53 -1.65 1.70 1.74 -1.26 -0.85 116.66 116.36 3pck n ARG 528 Ca -0.01 0.54 -0.45 0.00 -0.77 0.00 0.00 57.85 57.17 3pck n ARG 528 Cb 0.59 -2.09 -0.02 0.00 -1.02 0.00 0.00 32.46 29.92 3pck n ARG 528 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3pck n GLY 529 N 1.98 0.50 3.27 -0.13 0.00 -1.26 -4.34 105.19 105.20 3pck n GLY 529 Ca 0.13 0.45 -0.34 0.00 0.00 0.00 0.00 46.02 46.26 3pck n GLY 529 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3pck s GLN 530 N -0.82 3.26 0.14 1.61 0.74 -1.26 -1.76 119.66 121.58 3pck s GLN 530 Ca 0.65 -0.70 0.04 0.00 0.05 0.00 0.00 55.36 55.41 3pck s GLN 530 Cb -0.67 -2.79 -0.04 0.00 1.10 0.00 0.00 33.01 30.60 3pck s GLN 530 CO 0.54 -0.11 -0.10 -0.98 -0.55 0.00 0.00 175.29 174.09 3pck s ARG 531 N 1.16 1.04 0.40 1.67 1.70 -0.61 -4.97 118.95 119.35 3pck s ARG 531 Ca 0.01 -1.42 -0.20 0.00 -0.47 0.00 0.00 55.73 53.65 3pck s ARG 531 Cb -0.14 -0.62 -0.10 0.00 -0.57 0.00 0.00 34.95 33.51 3pck s ARG 531 CO -0.04 0.08 0.90 -1.59 -1.08 0.00 0.00 175.30 173.57 3pck s LYS 532 N -3.65 4.21 0.56 3.89 -2.85 -1.26 -0.17 119.74 120.46 3pck s LYS 532 Ca 0.16 1.03 -0.18 0.00 -1.00 0.00 0.00 55.97 55.98 3pck s LYS 532 Cb 0.02 -2.29 -0.05 0.00 -2.06 0.00 0.00 37.83 33.45 3pck s LYS 532 CO 0.01 0.04 1.09 0.95 0.10 0.00 0.00 175.35 177.53 3pck s THR 533 N -2.09 3.48 -0.13 3.79 -4.23 -1.22 -4.77 115.64 110.47 3pck s THR 533 Ca 0.59 0.83 -0.12 0.00 -1.18 0.00 0.00 61.69 61.81 3pck s THR 533 Cb -0.10 -3.32 0.03 0.00 1.34 0.00 0.00 72.50 70.45 3pck s THR 533 CO 0.15 -0.28 0.35 -1.38 -0.54 0.00 0.00 174.62 172.92 3pck s HIS 534 N -2.06 -0.38 -0.96 3.99 -3.43 -1.26 -4.92 115.29 106.27 3pck s HIS 534 Ca 0.68 0.92 -0.04 0.00 -0.80 0.00 0.00 55.06 55.83 3pck s HIS 534 Cb -0.20 0.13 0.03 0.00 -1.43 0.00 0.00 32.58 31.12 3pck s HIS 534 CO 0.30 -0.20 0.19 1.19 -2.00 0.00 0.00 174.74 174.22 3pck n PHE 535 N 2.82 -1.65 1.30 0.38 3.72 -1.26 -5.25 117.46 117.52 3pck n PHE 535 Ca -0.13 0.19 0.10 0.00 -0.05 0.00 0.00 57.45 57.56 3pck n PHE 535 Cb 0.57 -2.46 0.62 0.00 -0.94 0.00 0.00 39.48 37.27 3pck n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10