#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3pch s ALA 302 N 0.00 2.89 0.06 3.55 0.00 -1.26 -5.07 121.76 121.93 3pch s ALA 302 Ca 0.00 0.14 0.05 0.00 0.00 0.00 0.00 51.96 52.15 3pch s ALA 302 Cb 0.00 -3.15 -0.03 0.00 0.00 0.00 0.00 23.12 19.94 3pch s ALA 302 CO 0.00 -0.74 -0.13 -0.65 0.00 0.00 0.00 175.76 174.23 3pch s GLN 303 N -4.59 0.82 -1.09 0.00 -0.21 -1.26 -5.08 119.66 108.25 3pch s GLN 303 Ca 0.59 -0.85 -0.22 0.00 0.02 0.00 0.00 55.36 54.90 3pch s GLN 303 Cb -0.13 -0.81 0.04 0.00 1.00 0.00 0.00 33.01 33.11 3pch s GLN 303 CO 0.44 0.19 1.58 0.34 -2.12 0.00 0.00 175.29 175.72 3pch s ASP 304 N -1.49 6.45 0.00 5.90 2.15 -1.26 -4.62 116.67 123.80 3pch s ASP 304 Ca -0.01 -1.67 0.00 0.00 0.43 0.00 0.00 52.55 51.29 3pch s ASP 304 Cb -0.09 -2.57 0.00 0.00 -0.30 0.00 0.00 42.92 39.96 3pch s ASP 304 CO 0.02 -1.55 0.32 -0.46 -0.17 0.00 0.00 175.17 173.33 3pch n ASN 305 N 9.28 0.64 -4.31 -0.34 0.23 -1.26 -5.03 115.26 114.48 3pch n ASN 305 Ca 0.38 -0.89 -0.16 0.00 -0.53 0.00 0.00 54.58 53.38 3pch n ASN 305 Cb 0.49 0.15 -0.10 0.00 -2.08 0.00 0.00 39.78 38.24 3pch n ASN 305 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 3pch s SER 306 N -0.15 2.04 -0.00 0.53 0.01 -1.26 -3.59 113.70 111.28 3pch s SER 306 Ca 0.00 -1.09 0.04 0.00 1.31 0.00 0.00 55.95 56.21 3pch s SER 306 Cb 0.00 -0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.18 3pch s SER 306 CO 0.00 -0.35 -0.12 -0.13 0.41 0.00 0.00 173.24 173.05 3pch s ARG 307 N -3.76 0.95 -0.09 12.44 1.81 0.13 -4.85 118.95 125.58 3pch s ARG 307 Ca 0.22 -0.48 -0.00 0.00 -1.72 0.00 0.00 55.73 53.75 3pch s ARG 307 Cb 0.03 -0.92 -0.03 0.00 -0.45 0.00 0.00 34.95 33.58 3pch s ARG 307 CO 0.05 0.25 -0.06 -0.06 -0.68 0.00 0.00 175.30 174.80 3pch s PHE 308 N -0.37 2.96 0.24 -0.53 0.08 -1.26 -1.39 117.98 117.70 3pch s PHE 308 Ca 0.04 -0.08 -0.31 0.00 0.12 0.00 0.00 56.93 56.69 3pch s PHE 308 Cb -0.05 -1.78 -0.13 0.00 -0.57 0.00 0.00 43.02 40.49 3pch s PHE 308 CO -0.00 0.22 1.42 0.28 -0.10 0.00 0.00 175.22 177.04 3pch n VAL 309 N 2.59 0.91 -1.78 -0.44 0.31 -0.18 -4.89 118.33 114.84 3pch n VAL 309 Ca -0.18 -0.23 -0.41 0.00 -0.01 0.00 0.00 64.34 63.51 3pch n VAL 309 Cb 0.53 -1.49 -0.00 0.00 -0.91 0.00 0.00 33.84 31.97 3pch n VAL 309 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3pch s ILE 310 N -0.01 2.01 0.30 2.52 -1.09 -1.26 -4.71 121.20 118.96 3pch s ILE 310 Ca 0.69 0.01 -0.29 0.00 -2.23 0.00 0.00 60.65 58.82 3pch s ILE 310 Cb -0.65 -3.01 -0.10 0.00 -1.58 0.00 0.00 42.46 37.13 3pch s ILE 310 CO 0.49 0.00 1.18 -0.13 -1.23 0.00 0.00 174.94 175.25 3pch s ARG 311 N -2.00 4.51 -0.62 2.79 0.52 -1.26 -4.97 118.95 117.93 3pch s ARG 311 Ca 0.54 1.96 -0.21 0.00 -0.52 0.00 0.00 55.73 57.50 3pch s ARG 311 Cb -0.47 -3.12 0.08 0.00 0.52 0.00 0.00 34.95 31.96 3pch s ARG 311 CO 0.63 0.04 0.83 0.34 0.02 0.00 0.00 175.30 177.16 3pch s ASP 312 N -0.74 6.19 0.00 0.23 -1.08 -1.26 -4.88 116.67 115.13 3pch s ASP 312 Ca 0.47 -1.14 0.22 0.00 -0.52 0.00 0.00 52.55 51.58 3pch s ASP 312 Cb -0.35 -2.36 1.14 0.00 -1.46 0.00 0.00 42.92 39.89 3pch s ASP 312 CO 0.45 -1.26 1.72 0.54 0.52 0.00 0.00 175.17 177.14 3pch n ARG 313 N 7.02 0.35 0.04 4.34 1.74 -1.26 -1.52 116.66 127.37 3pch n ARG 313 Ca -0.06 0.07 0.11 0.00 -0.77 0.00 0.00 57.85 57.20 3pch n ARG 313 Cb 0.44 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.29 3pch n ARG 313 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3pch n ASN 314 N -1.26 0.39 -0.06 0.55 3.02 -1.26 -4.22 115.26 112.43 3pch n ASN 314 Ca 0.11 0.09 -0.16 0.00 -0.03 0.00 0.00 54.58 54.60 3pch n ASN 314 Cb 0.17 1.30 -0.13 0.00 -0.61 0.00 0.00 39.78 40.51 3pch n ASN 314 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3pch h TRP 315 N 0.00 0.08 -4.19 3.10 2.91 -1.68 -3.43 115.95 112.73 3pch h TRP 315 Ca 0.00 -0.06 -0.50 0.00 1.13 0.00 0.00 58.89 59.47 3pch h TRP 315 Cb 0.97 -0.00 0.14 0.00 -0.51 0.00 0.00 29.16 29.76 3pch h TRP 315 CO 0.00 1.10 0.28 -1.01 -1.03 0.00 0.00 178.44 177.79 3pch s HIS 316 N -2.27 2.46 0.49 2.65 3.76 -0.92 -4.75 115.29 116.72 3pch s HIS 316 Ca -0.19 1.38 -0.22 0.00 -0.15 0.00 0.00 55.06 55.88 3pch s HIS 316 Cb -0.01 -3.11 -0.07 0.00 1.11 0.00 0.00 32.58 30.50 3pch s HIS 316 CO 0.70 -2.10 1.16 -1.25 -0.85 0.00 0.00 174.74 172.40 3pch s PRO 317 N -4.93 3.58 0.73 8.40 0.04 -1.26 -4.78 135.00 136.77 3pch s PRO 317 Ca 0.62 1.74 -0.11 0.00 0.04 0.00 0.00 61.00 63.29 3pch s PRO 317 Cb -0.17 -2.26 0.03 0.00 0.04 0.00 0.00 34.50 32.14 3pch s PRO 317 CO 0.56 -0.70 1.09 0.15 0.04 0.00 0.00 177.00 178.15 3pch s LYS 318 N -2.91 2.62 0.02 4.56 -0.14 -1.25 -5.00 119.74 117.63 3pch s LYS 318 Ca 0.67 0.54 -0.24 0.00 -1.36 0.00 0.00 55.97 55.58 3pch s LYS 318 Cb -0.28 -1.99 -0.18 0.00 -1.68 0.00 0.00 37.83 33.71 3pch s LYS 318 CO 0.33 -1.22 1.40 0.00 -0.76 0.00 0.00 175.35 175.10 3pch h ALA 319 N -0.79 0.05 -2.05 5.17 0.00 -1.95 -3.41 119.26 116.27 3pch h ALA 319 Ca -0.46 -0.19 -0.69 0.00 0.00 0.00 0.00 54.91 53.57 3pch h ALA 319 Cb 1.26 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 18.85 3pch h ALA 319 CO 0.62 -0.26 0.05 -1.17 0.00 0.00 0.00 179.25 178.50 3pch s LEU 320 N -9.46 5.09 -0.45 0.00 2.96 -1.26 -4.74 118.68 110.82 3pch s LEU 320 Ca -0.15 -1.06 0.03 0.00 -0.22 0.00 0.00 54.13 52.74 3pch s LEU 320 Cb 0.03 -2.40 0.16 0.00 0.50 0.00 0.00 46.19 44.48 3pch s LEU 320 CO 0.68 -0.94 0.33 0.42 -1.32 0.00 0.00 176.35 175.52 3pch s THR 321 N 2.62 0.82 0.44 3.68 -4.23 -1.26 -5.03 115.64 112.68 3pch s THR 321 Ca 0.14 -2.72 0.29 0.00 -1.18 0.00 0.00 61.69 58.22 3pch s THR 321 Cb -0.21 -1.57 0.48 0.00 1.34 0.00 0.00 72.50 72.54 3pch s THR 321 CO 0.10 -1.12 1.64 -0.65 -0.54 0.00 0.00 174.62 174.05 3pch h PRO 322 N 5.98 0.11 0.00 3.99 0.11 -1.93 0.31 132.00 140.57 3pch h PRO 322 Ca 0.18 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 3pch h PRO 322 Cb 0.90 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 31.98 3pch h PRO 322 CO 0.42 0.07 -0.11 -0.44 -0.21 0.00 0.00 178.00 177.73 3pch h ASP 323 N 0.11 0.00 -3.23 -2.05 3.32 -1.95 -3.18 116.42 109.44 3pch h ASP 323 Ca 0.80 0.00 -0.75 0.00 0.02 0.00 0.00 57.03 57.10 3pch h ASP 323 Cb 2.48 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 41.81 3pch h ASP 323 CO -0.40 0.11 0.29 -0.47 -1.72 0.00 0.00 179.24 177.04 3pch s TYR 324 N -4.61 3.43 0.25 4.55 5.04 0.11 -4.85 117.35 121.27 3pch s TYR 324 Ca -0.04 -1.62 -0.10 0.00 -2.44 0.00 0.00 57.07 52.87 3pch s TYR 324 Cb 0.15 -3.98 0.38 0.00 0.35 0.00 0.00 41.96 38.86 3pch s TYR 324 CO 0.64 -1.18 1.58 0.87 -1.34 0.00 0.00 175.55 176.12 3pch h LYS 325 N 8.37 -0.00 -0.33 4.97 1.57 -1.76 -2.08 116.57 127.32 3pch h LYS 325 Ca 0.03 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.87 3pch h LYS 325 Cb 1.05 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.34 3pch h LYS 325 CO 0.93 -0.00 0.23 1.15 -0.57 0.00 0.00 179.45 181.18 3pch h THR 326 N -0.00 0.93 -0.19 -0.16 2.02 -1.92 -1.26 112.91 112.34 3pch h THR 326 Ca 0.42 -0.06 0.05 0.00 0.77 0.00 0.00 66.41 67.59 3pch h THR 326 Cb 0.63 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 3pch h THR 326 CO -0.90 0.03 0.14 0.77 0.37 0.00 0.00 175.52 175.94 3pch h SER 327 N 0.18 0.00 0.17 4.18 4.64 -1.67 -2.83 113.55 118.21 3pch h SER 327 Ca 0.15 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.48 3pch h SER 327 Cb 0.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 3pch h SER 327 CO -0.02 0.00 -0.23 0.40 -0.87 0.00 0.00 176.83 176.10 3pch h ILE 328 N 0.00 0.49 0.00 0.95 2.04 -1.36 -2.90 117.51 116.72 3pch h ILE 328 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 3pch h ILE 328 Cb 0.38 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.95 3pch h ILE 328 CO -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 178.15 177.84 3pch n ALA 329 N -2.53 2.78 -1.36 1.87 0.00 -1.17 -4.01 120.51 116.09 3pch n ALA 329 Ca -0.07 -0.18 -0.11 0.00 0.00 0.00 0.00 53.44 53.07 3pch n ALA 329 Cb 0.27 -1.30 0.20 0.00 0.00 0.00 0.00 19.45 18.62 3pch n ALA 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3pch n ARG 330 N -1.88 2.06 -4.68 0.00 1.74 -1.08 -4.96 116.66 107.87 3pch n ARG 330 Ca 0.05 -3.12 -0.23 0.00 -0.77 0.00 0.00 57.85 53.78 3pch n ARG 330 Cb 0.39 -1.95 -0.15 0.00 -1.02 0.00 0.00 32.46 29.73 3pch n ARG 330 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3pch s SER 331 N -2.06 1.74 0.77 0.55 1.04 -1.11 -4.92 113.70 109.71 3pch s SER 331 Ca 0.49 -0.27 -0.12 0.00 0.48 0.00 0.00 55.95 56.53 3pch s SER 331 Cb 0.43 -0.24 0.06 0.00 0.10 0.00 0.00 66.02 66.37 3pch s SER 331 CO 0.04 0.17 1.14 -2.84 0.98 0.00 0.00 173.24 172.73 3pch s PRO 332 N -0.27 2.03 -0.07 4.02 0.02 -1.26 -4.95 135.00 134.52 3pch s PRO 332 Ca 0.04 1.47 0.12 0.00 0.02 0.00 0.00 61.00 62.65 3pch s PRO 332 Cb -0.06 -1.85 -0.18 0.00 0.02 0.00 0.00 34.50 32.43 3pch s PRO 332 CO -0.00 -1.86 0.17 0.54 -0.33 0.00 0.00 177.00 175.51 3pch n ARG 333 N -3.26 1.20 -2.93 5.54 5.12 -1.26 -4.91 116.66 116.16 3pch n ARG 333 Ca 0.11 -0.06 -0.31 0.00 -1.93 0.00 0.00 57.85 55.66 3pch n ARG 333 Cb 0.52 -1.31 -0.04 0.00 -1.16 0.00 0.00 32.46 30.47 3pch n ARG 333 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 3pch s GLN 334 N -2.61 3.81 0.55 5.56 -1.52 -1.26 -5.06 119.66 119.14 3pch s GLN 334 Ca -0.05 0.49 -0.19 0.00 -1.95 0.00 0.00 55.36 53.66 3pch s GLN 334 Cb 0.06 -2.41 -0.06 0.00 -0.22 0.00 0.00 33.01 30.38 3pch s GLN 334 CO 0.52 0.01 1.09 0.00 -0.25 0.00 0.00 175.29 176.66 3pch s ALA 335 N -2.28 2.73 0.42 6.09 0.00 -1.26 -5.00 121.76 122.47 3pch s ALA 335 Ca 0.51 0.65 -0.26 0.00 0.00 0.00 0.00 51.96 52.87 3pch s ALA 335 Cb -0.10 -3.30 -0.08 0.00 0.00 0.00 0.00 23.12 19.63 3pch s ALA 335 CO 0.28 -0.69 1.33 -0.51 0.00 0.00 0.00 175.76 176.18 3pch s LEU 336 N -3.94 4.17 -0.26 0.00 1.43 -1.26 -4.99 118.68 113.83 3pch s LEU 336 Ca 0.69 2.72 -0.16 0.00 -1.03 0.00 0.00 54.13 56.34 3pch s LEU 336 Cb -0.20 -3.93 -0.03 0.00 0.03 0.00 0.00 46.19 42.06 3pch s LEU 336 CO 0.28 -0.96 0.44 -0.69 0.23 0.00 0.00 176.35 175.65 3pch s VAL 337 N -1.25 5.13 0.15 -1.59 1.01 -1.26 -5.05 120.40 117.54 3pch s VAL 337 Ca 0.59 0.72 -0.30 0.00 0.00 0.00 0.00 61.98 62.98 3pch s VAL 337 Cb -0.39 -3.76 -0.07 0.00 0.00 0.00 0.00 36.38 32.16 3pch s VAL 337 CO 0.50 0.13 1.02 -0.44 0.00 0.00 0.00 175.10 176.32 3pch s SER 338 N 1.57 7.40 0.04 3.32 0.01 -1.26 -5.05 113.70 119.73 3pch s SER 338 Ca 0.18 1.94 0.04 0.00 1.31 0.00 0.00 55.95 59.43 3pch s SER 338 Cb -0.16 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.46 3pch s SER 338 CO 0.09 -0.12 -0.13 0.27 0.41 0.00 0.00 173.24 173.76 3pch s ILE 339 N -0.20 1.02 0.57 1.44 -4.36 -1.26 -5.14 121.20 113.27 3pch s ILE 339 Ca 0.48 -0.98 -0.19 0.00 -0.26 0.00 0.00 60.65 59.69 3pch s ILE 339 Cb -0.26 -0.94 -0.05 0.00 1.25 0.00 0.00 42.46 42.46 3pch s ILE 339 CO 0.32 -0.03 1.17 -2.16 0.24 0.00 0.00 174.94 174.48 3pch s PRO 340 N -1.15 3.16 0.25 0.37 0.04 -1.26 -4.98 135.00 131.43 3pch s PRO 340 Ca 0.00 1.74 -0.30 0.00 0.04 0.00 0.00 61.00 62.49 3pch s PRO 340 Cb -0.08 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.39 3pch s PRO 340 CO 0.01 -1.03 1.16 -0.65 0.04 0.00 0.00 177.00 176.53 3pch s GLN 341 N -3.29 4.55 0.30 4.56 -0.21 -1.26 -5.01 119.66 119.30 3pch s GLN 341 Ca 0.75 1.88 0.03 0.00 0.02 0.00 0.00 55.36 58.04 3pch s GLN 341 Cb -0.28 -3.19 -0.04 0.00 1.00 0.00 0.00 33.01 30.50 3pch s GLN 341 CO 0.30 0.05 0.16 -1.54 -2.12 0.00 0.00 175.29 172.15 3pch s SER 342 N -0.47 1.46 0.39 5.90 1.04 -1.26 -5.02 113.70 115.75 3pch s SER 342 Ca 0.48 -1.55 0.13 0.00 0.48 0.00 0.00 55.95 55.49 3pch s SER 342 Cb -0.33 0.38 0.95 0.00 0.10 0.00 0.00 66.02 67.12 3pch s SER 342 CO 0.41 -0.88 1.88 -0.29 0.98 0.00 0.00 173.24 175.34 3pch h ILE 343 N 2.24 0.78 -0.83 -1.02 2.10 -1.96 0.30 117.51 119.12 3pch h ILE 343 Ca -0.34 -0.18 0.02 0.00 1.08 0.00 0.00 64.86 65.44 3pch h ILE 343 Cb 1.25 0.20 -0.04 0.00 -1.09 0.00 0.00 36.82 37.13 3pch h ILE 343 CO 0.52 0.10 0.55 0.28 -1.08 0.00 0.00 178.15 178.52 3pch h SER 344 N 0.54 0.93 0.30 2.19 0.02 -1.96 -3.02 113.55 112.54 3pch h SER 344 Ca 0.43 -0.02 -0.29 0.00 -0.84 0.00 0.00 61.79 61.07 3pch h SER 344 Cb 0.87 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 63.13 3pch h SER 344 CO -0.17 0.66 -1.96 -0.62 -1.14 0.00 0.00 176.83 173.60 3pch n GLU 345 N -4.42 0.65 0.00 3.45 4.71 -0.07 -4.47 120.64 120.50 3pch n GLU 345 Ca 0.10 0.14 0.14 0.00 -0.01 0.00 0.00 57.16 57.53 3pch n GLU 345 Cb 0.05 -1.67 0.64 0.00 -1.01 0.00 0.00 31.44 29.45 3pch n GLU 345 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 3pch n THR 346 N -2.86 0.00 -4.23 2.62 -2.24 -0.26 -2.50 114.28 104.82 3pch n THR 346 Ca -0.22 -0.08 -0.25 0.00 -2.27 0.00 0.00 64.05 61.22 3pch n THR 346 Cb 1.04 -0.04 -0.08 0.00 -2.10 0.00 0.00 70.33 69.15 3pch n THR 346 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3pch s THR 347 N -2.33 2.23 -0.07 4.28 -4.23 -1.14 -4.62 115.64 109.76 3pch s THR 347 Ca 0.33 -1.76 -0.32 0.00 -1.18 0.00 0.00 61.69 58.76 3pch s THR 347 Cb 0.20 -2.99 0.14 0.00 1.34 0.00 0.00 72.50 71.19 3pch s THR 347 CO 0.44 0.00 1.39 -0.83 -0.54 0.00 0.00 174.62 175.08 3pch s GLY 348 N -3.87 -0.47 0.60 3.99 0.00 -1.23 -0.84 107.32 105.50 3pch s GLY 348 Ca 0.40 0.85 -0.18 0.00 0.00 0.00 0.00 44.72 45.79 3pch s GLY 348 CO 0.22 0.41 1.15 2.56 0.00 0.00 0.00 173.10 177.44 3pch s PRO 349 N -2.14 3.01 -0.19 2.90 0.04 -1.26 -4.83 135.00 132.54 3pch s PRO 349 Ca 0.15 1.64 -0.01 0.00 0.04 0.00 0.00 61.00 62.82 3pch s PRO 349 Cb 0.07 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.65 3pch s PRO 349 CO -0.06 -1.13 -0.13 1.21 0.04 0.00 0.00 177.00 176.93 3pch s ASN 350 N -1.92 3.69 -0.04 6.66 3.84 -1.26 -4.90 114.94 121.02 3pch s ASN 350 Ca 0.73 -0.51 0.20 0.00 0.21 0.00 0.00 52.86 53.49 3pch s ASN 350 Cb -0.25 -1.59 0.62 0.00 -0.55 0.00 0.00 41.25 39.48 3pch s ASN 350 CO 0.33 0.02 1.52 0.49 -2.79 0.00 0.00 177.10 176.68 3pch n PHE 351 N 4.50 1.07 -0.29 0.43 3.72 -1.26 -4.58 117.46 121.05 3pch n PHE 351 Ca -0.19 -0.49 0.22 0.00 -0.05 0.00 0.00 57.45 56.94 3pch n PHE 351 Cb 0.51 -0.08 0.53 0.00 -0.94 0.00 0.00 39.48 39.50 3pch n PHE 351 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 3pch h SER 352 N 3.92 0.40 -0.17 4.37 0.02 -1.96 0.09 113.55 120.23 3pch h SER 352 Ca 0.00 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 3pch h SER 352 Cb 1.06 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.59 3pch h SER 352 CO 0.07 0.11 0.00 1.41 -1.14 0.00 0.00 176.83 177.29 3pch n HIS 353 N -4.54 0.20 -2.09 3.45 8.25 -1.26 -4.91 115.22 114.32 3pch n HIS 353 Ca 0.23 -0.10 -0.41 0.00 -0.26 0.00 0.00 57.72 57.18 3pch n HIS 353 Cb 0.83 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.91 3pch n HIS 353 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3pch s LEU 354 N -1.70 4.41 -0.84 2.41 2.96 0.02 -4.91 118.68 121.03 3pch s LEU 354 Ca 0.34 2.64 -0.23 0.00 -0.22 0.00 0.00 54.13 56.66 3pch s LEU 354 Cb 0.20 -3.63 0.06 0.00 0.50 0.00 0.00 46.19 43.32 3pch s LEU 354 CO 0.29 -0.60 1.22 -0.83 -1.32 0.00 0.00 176.35 175.11 3pch s GLY 355 N -0.03 1.31 0.12 7.98 0.00 -1.26 -5.00 107.32 110.44 3pch s GLY 355 Ca 0.54 -2.01 -0.26 0.00 0.00 0.00 0.00 44.72 43.00 3pch s GLY 355 CO 0.47 2.40 0.81 -1.36 0.00 0.00 0.00 173.10 175.41 3pch s PHE 356 N 4.53 3.84 0.68 1.90 0.40 -1.26 -5.06 117.98 123.02 3pch s PHE 356 Ca 0.34 1.62 -0.12 0.00 -0.60 0.00 0.00 56.93 58.18 3pch s PHE 356 Cb -0.07 -2.84 0.01 0.00 0.51 0.00 0.00 43.02 40.62 3pch s PHE 356 CO 0.02 0.39 1.07 0.20 0.70 0.00 0.00 175.22 177.59 3pch s GLY 357 N -0.62 1.78 0.36 4.36 0.00 -1.26 -4.95 107.32 106.99 3pch s GLY 357 Ca 0.38 0.19 0.09 0.00 0.00 0.00 0.00 44.72 45.38 3pch s GLY 357 CO 0.26 0.51 1.88 0.00 0.00 0.00 0.00 173.10 175.76 3pch h ALA 358 N -0.50 1.82 -0.15 3.20 0.00 -2.03 -2.82 119.26 118.77 3pch h ALA 358 Ca -0.44 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 3pch h ALA 358 Cb 1.22 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 3pch h ALA 358 CO 0.56 -0.04 -0.19 0.72 0.00 0.00 0.00 179.25 180.30 3pch n HIS 359 N -4.54 0.49 -0.12 0.00 8.25 -1.26 -4.74 115.22 113.30 3pch n HIS 359 Ca 0.16 -1.35 0.10 0.00 -0.26 0.00 0.00 57.72 56.38 3pch n HIS 359 Cb 0.43 -0.32 0.45 0.00 1.12 0.00 0.00 29.99 31.67 3pch n HIS 359 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3pch h ASP 360 N 0.90 0.47 -0.53 0.41 5.19 -1.79 -0.83 116.42 120.25 3pch h ASP 360 Ca 0.07 0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 3pch h ASP 360 Cb 1.28 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.70 3pch h ASP 360 CO 0.16 0.29 0.00 0.00 -3.12 0.00 0.00 179.24 176.57 3pch n HIS 361 N -4.48 0.69 -3.96 4.55 1.44 -1.18 -2.14 115.22 110.14 3pch n HIS 361 Ca 0.10 -0.35 -0.30 0.00 -2.01 0.00 0.00 57.72 55.16 3pch n HIS 361 Cb 0.33 -0.00 -0.14 0.00 0.12 0.00 0.00 29.99 30.30 3pch n HIS 361 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 3pch s ASP 362 N -1.28 4.44 0.35 4.39 -1.08 -0.32 -1.89 116.67 121.28 3pch s ASP 362 Ca 0.43 -2.71 0.25 0.00 -0.52 0.00 0.00 52.55 50.00 3pch s ASP 362 Cb 0.24 -1.61 1.24 0.00 -1.46 0.00 0.00 42.92 41.33 3pch s ASP 362 CO 0.32 -0.28 1.77 -0.07 0.52 0.00 0.00 175.17 177.43 3pch h LEU 363 N 6.88 0.00 -0.53 -1.34 4.07 -0.35 0.20 115.31 124.23 3pch h LEU 363 Ca -0.07 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.78 3pch h LEU 363 Cb 0.93 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.66 3pch h LEU 363 CO 0.63 0.00 -0.54 -0.07 -1.08 0.00 0.00 178.44 177.37 3pch h LEU 364 N 0.00 0.00 -0.03 1.67 4.07 -1.91 -3.37 115.31 115.74 3pch h LEU 364 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3pch h LEU 364 Cb 0.16 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.90 3pch h LEU 364 CO 0.00 0.54 0.00 0.18 -1.08 0.00 0.00 178.44 178.08 3pch n LEU 365 N -3.47 0.03 -0.03 1.67 4.77 -0.65 -4.57 117.00 114.75 3pch n LEU 365 Ca 0.00 -0.46 0.03 0.00 -0.03 0.00 0.00 56.01 55.55 3pch n LEU 365 Cb 0.65 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.90 3pch n LEU 365 CO 0.40 0.01 0.61 -0.46 -1.33 0.00 0.00 177.39 176.62 3pch n ASN 366 N -0.86 0.09 0.00 -1.43 0.23 0.62 -5.02 115.26 108.89 3pch n ASN 366 Ca 0.00 -1.83 0.00 0.00 -0.53 0.00 0.00 54.58 52.22 3pch n ASN 366 Cb 0.00 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.69 3pch n ASN 366 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 3pch n PHE 367 N -0.53 0.00 -0.18 -2.53 7.35 -1.26 -4.92 117.46 115.39 3pch n PHE 367 Ca 0.05 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.74 3pch n PHE 367 Cb 0.03 0.42 0.00 0.00 0.35 0.00 0.00 39.48 40.28 3pch n PHE 367 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3pch n GLY 371 N 1.65 0.00 3.85 7.13 0.00 -1.26 -4.07 105.19 112.49 3pch n GLY 371 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 3pch n GLY 371 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3pch s LEU 372 N -1.12 4.25 0.82 0.99 2.96 -1.26 -4.83 118.68 120.49 3pch s LEU 372 Ca 0.00 0.39 -0.11 0.00 -0.22 0.00 0.00 54.13 54.20 3pch s LEU 372 Cb 0.00 -2.12 0.09 0.00 0.50 0.00 0.00 46.19 44.66 3pch s LEU 372 CO 0.00 0.38 1.12 -2.16 -1.32 0.00 0.00 176.35 174.37 3pch s PRO 373 N -1.17 1.80 -0.12 0.98 0.04 -1.26 -4.82 135.00 130.45 3pch s PRO 373 Ca 0.17 1.34 -0.11 0.00 0.04 0.00 0.00 61.00 62.44 3pch s PRO 373 Cb -0.12 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.54 3pch s PRO 373 CO 0.06 -2.01 0.25 0.42 0.04 0.00 0.00 177.00 175.76 3pch s ILE 374 N -2.75 5.33 0.00 0.56 1.01 -1.26 -5.01 121.20 119.07 3pch s ILE 374 Ca 0.64 0.45 0.00 0.00 0.00 0.00 0.00 60.65 61.74 3pch s ILE 374 Cb -0.20 -3.55 0.00 0.00 0.01 0.00 0.00 42.46 38.72 3pch s ILE 374 CO 0.56 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.61 3pch n GLY 375 N 2.69 2.02 3.63 6.18 0.00 -1.26 -4.43 105.19 114.03 3pch n GLY 375 Ca -0.15 -1.75 -0.43 0.00 0.00 0.00 0.00 46.02 43.69 3pch n GLY 375 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3pch s GLU 376 N -1.60 3.95 0.04 1.61 2.02 -1.26 -4.90 118.70 118.55 3pch s GLU 376 Ca 0.00 1.34 -0.31 0.00 0.02 0.00 0.00 54.97 56.02 3pch s GLU 376 Cb 0.00 -3.88 -0.07 0.00 0.10 0.00 0.00 34.13 30.29 3pch s GLU 376 CO 0.00 -1.08 1.44 1.03 0.02 0.00 0.00 175.26 176.67 3pch s ARG 377 N 4.12 4.28 0.00 1.61 0.52 -1.26 -0.82 118.95 127.40 3pch s ARG 377 Ca 0.57 2.05 -0.12 0.00 -0.52 0.00 0.00 55.73 57.71 3pch s ARG 377 Cb -0.18 -3.49 0.02 0.00 0.52 0.00 0.00 34.95 31.82 3pch s ARG 377 CO 0.22 -0.56 0.26 0.96 0.02 0.00 0.00 175.30 176.20 3pch s ILE 378 N 2.07 0.07 -0.13 1.52 -4.36 -0.20 -2.06 121.20 118.12 3pch s ILE 378 Ca 0.66 -0.60 -0.04 0.00 -0.26 0.00 0.00 60.65 60.41 3pch s ILE 378 Cb -0.34 -0.64 -0.03 0.00 1.25 0.00 0.00 42.46 42.69 3pch s ILE 378 CO 0.28 -0.33 0.02 -0.63 0.24 0.00 0.00 174.94 174.52 3pch s ILE 379 N -1.62 4.40 -0.20 8.37 1.01 -0.24 -0.45 121.20 132.47 3pch s ILE 379 Ca -0.12 -0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.34 3pch s ILE 379 Cb -0.05 -2.91 0.02 0.00 0.01 0.00 0.00 42.46 39.53 3pch s ILE 379 CO 0.02 0.55 -0.15 -0.69 0.00 0.00 0.00 174.94 174.67 3pch s VAL 380 N -0.31 2.40 0.05 2.92 1.01 0.52 -0.95 120.40 126.05 3pch s VAL 380 Ca 0.07 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.10 3pch s VAL 380 Cb -0.12 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.13 3pch s VAL 380 CO 0.02 0.42 -0.03 0.00 0.00 0.00 0.00 175.10 175.51 3pch s ALA 381 N 1.31 0.48 0.00 5.51 0.00 -0.51 0.47 121.76 129.02 3pch s ALA 381 Ca 0.03 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.85 3pch s ALA 381 Cb -0.14 0.25 0.00 0.00 0.00 0.00 0.00 23.12 23.23 3pch s ALA 381 CO -0.09 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 175.74 3pch n GLY 382 N 0.29 -1.31 3.19 0.00 0.00 -0.96 -0.25 105.19 106.16 3pch n GLY 382 Ca -0.15 -0.93 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 3pch n GLY 382 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pch s ARG 383 N -0.66 1.28 -0.23 1.61 3.52 -1.26 -1.38 118.95 121.84 3pch s ARG 383 Ca 0.00 -0.79 -0.07 0.00 -0.13 0.00 0.00 55.73 54.74 3pch s ARG 383 Cb 0.00 -1.32 -0.03 0.00 -1.56 0.00 0.00 34.95 32.04 3pch s ARG 383 CO 0.00 0.34 0.07 0.08 -0.81 0.00 0.00 175.30 174.99 3pch s VAL 384 N -0.67 4.54 0.22 7.11 1.01 0.20 -1.48 120.40 131.34 3pch s VAL 384 Ca 0.06 -0.10 0.04 0.00 0.00 0.00 0.00 61.98 61.97 3pch s VAL 384 Cb -0.08 -3.10 -0.05 0.00 0.00 0.00 0.00 36.38 33.16 3pch s VAL 384 CO 0.01 0.38 -0.03 0.68 0.00 0.00 0.00 175.10 176.14 3pch s VAL 385 N 1.16 1.14 0.53 2.92 -7.23 -0.68 -0.34 120.40 117.89 3pch s VAL 385 Ca 0.05 -2.05 0.07 0.00 -1.81 0.00 0.00 61.98 58.24 3pch s VAL 385 Cb -0.14 -2.28 0.06 0.00 0.56 0.00 0.00 36.38 34.57 3pch s VAL 385 CO 0.03 -0.38 0.73 1.51 -0.31 0.00 0.00 175.10 176.68 3pch s ASP 386 N -3.30 5.25 0.64 4.85 -4.77 0.74 0.45 116.67 120.53 3pch s ASP 386 Ca 0.27 -0.55 0.38 0.00 -3.30 0.00 0.00 52.55 49.34 3pch s ASP 386 Cb 0.05 -0.21 2.11 0.00 -1.09 0.00 0.00 42.92 43.78 3pch s ASP 386 CO 0.08 -1.16 2.27 1.56 0.70 0.00 0.00 175.17 178.62 3pch h GLN 387 N 0.27 0.00 -0.00 2.11 4.20 -1.33 0.13 115.11 120.49 3pch h GLN 387 Ca -0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.35 3pch h GLN 387 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 3pch h GLN 387 CO 0.43 0.00 -0.17 0.66 -0.67 0.00 0.00 178.83 179.09 3pch n TYR 388 N -3.34 0.00 -0.26 2.96 4.01 -1.26 -4.90 117.16 114.36 3pch n TYR 388 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 3pch n TYR 388 Cb 0.14 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 38.89 3pch n TYR 388 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3pch n GLY 389 N 1.38 0.75 3.72 2.72 0.00 0.45 -5.05 105.19 109.16 3pch n GLY 389 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 3pch n GLY 389 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3pch s LYS 390 N -0.74 4.55 0.62 1.61 2.20 -1.25 -4.73 119.74 122.00 3pch s LYS 390 Ca 0.00 1.25 -0.18 0.00 -0.36 0.00 0.00 55.97 56.68 3pch s LYS 390 Cb 0.00 -3.43 -0.02 0.00 -1.51 0.00 0.00 37.83 32.87 3pch s LYS 390 CO 0.00 0.07 1.25 -2.14 -0.36 0.00 0.00 175.35 174.17 3pch s PRO 391 N 0.64 2.74 -0.51 4.03 0.02 -1.26 -0.18 135.00 140.47 3pch s PRO 391 Ca 0.46 1.94 0.01 0.00 0.02 0.00 0.00 61.00 63.43 3pch s PRO 391 Cb -0.21 -1.89 0.13 0.00 0.02 0.00 0.00 34.50 32.56 3pch s PRO 391 CO 0.25 -1.42 0.27 0.08 -0.33 0.00 0.00 177.00 175.86 3pch s VAL 392 N -1.51 2.94 0.53 3.83 1.01 0.53 -4.80 120.40 122.93 3pch s VAL 392 Ca 0.80 -2.94 -0.16 0.00 0.00 0.00 0.00 61.98 59.68 3pch s VAL 392 Cb -0.34 -3.01 -0.07 0.00 0.00 0.00 0.00 36.38 32.96 3pch s VAL 392 CO 0.37 -0.78 1.00 -2.16 0.00 0.00 0.00 175.10 173.52 3pch s PRO 393 N 0.10 3.85 -1.48 2.72 0.04 -1.26 -4.18 135.00 134.80 3pch s PRO 393 Ca 0.15 0.97 -0.03 0.00 0.04 0.00 0.00 61.00 62.14 3pch s PRO 393 Cb -0.23 -2.12 0.02 0.00 0.04 0.00 0.00 34.50 32.21 3pch s PRO 393 CO -0.03 -0.35 0.38 0.09 0.04 0.00 0.00 177.00 177.13 3pch n ASN 394 N -1.71 -0.43 -4.67 6.66 4.13 -0.78 -4.94 115.26 113.52 3pch n ASN 394 Ca 0.07 -1.07 -0.29 0.00 1.68 0.00 0.00 54.58 54.97 3pch n ASN 394 Cb 0.54 -2.71 -0.08 0.00 -1.54 0.00 0.00 39.78 35.99 3pch n ASN 394 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 3pch s THR 395 N -3.96 3.87 -0.24 3.41 -1.32 -1.26 -4.54 115.64 111.61 3pch s THR 395 Ca 0.10 -1.11 -0.24 0.00 -1.21 0.00 0.00 61.69 59.24 3pch s THR 395 Cb -0.06 -2.86 -0.01 0.00 -1.51 0.00 0.00 72.50 68.07 3pch s THR 395 CO 0.92 0.08 0.79 -0.22 -2.21 0.00 0.00 174.62 173.97 3pch s LEU 396 N -2.41 4.08 -0.24 9.08 2.96 -1.26 -0.04 118.68 130.84 3pch s LEU 396 Ca 0.25 0.98 -0.01 0.00 -0.22 0.00 0.00 54.13 55.13 3pch s LEU 396 Cb -0.11 -3.12 0.03 0.00 0.50 0.00 0.00 46.19 43.48 3pch s LEU 396 CO 0.18 -0.48 -0.09 -0.69 -1.32 0.00 0.00 176.35 173.95 3pch s VAL 397 N 2.75 2.66 0.01 1.68 1.01 0.40 -1.68 120.40 127.24 3pch s VAL 397 Ca 0.33 -1.10 0.07 0.00 0.00 0.00 0.00 61.98 61.28 3pch s VAL 397 Cb -0.15 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.85 3pch s VAL 397 CO 0.08 0.21 -0.21 -1.61 0.00 0.00 0.00 175.10 173.57 3pch s GLU 398 N 1.29 2.11 0.05 2.72 2.02 -0.09 0.61 118.70 127.40 3pch s GLU 398 Ca -0.00 -0.94 -0.09 0.00 0.02 0.00 0.00 54.97 53.96 3pch s GLU 398 Cb -0.17 -2.15 -0.00 0.00 0.10 0.00 0.00 34.13 31.92 3pch s GLU 398 CO -0.06 0.56 0.17 0.00 0.02 0.00 0.00 175.26 175.95 3pch s MET 399 N -1.07 0.69 0.06 1.61 0.23 0.50 0.70 119.30 122.03 3pch s MET 399 Ca 0.12 -0.70 -0.15 0.00 -1.03 0.00 0.00 55.69 53.93 3pch s MET 399 Cb -0.10 0.28 0.02 0.00 -1.53 0.00 0.00 34.83 33.50 3pch s MET 399 CO 0.02 -0.20 0.33 1.67 -2.03 0.00 0.00 175.02 174.82 3pch s TRP 400 N -2.77 -0.13 0.22 3.16 -2.14 -0.30 -1.48 118.94 115.50 3pch s TRP 400 Ca -0.04 -0.05 -0.21 0.00 2.66 0.00 0.00 56.10 58.46 3pch s TRP 400 Cb -0.00 0.13 0.07 0.00 -3.10 0.00 0.00 33.47 30.57 3pch s TRP 400 CO -0.05 -0.56 0.97 1.14 -2.66 0.00 0.00 176.95 175.79 3pch s GLN 401 N -2.90 1.49 0.80 3.25 -2.07 -0.45 -0.39 119.66 119.39 3pch s GLN 401 Ca -0.03 -0.94 -0.04 0.00 -1.82 0.00 0.00 55.36 52.53 3pch s GLN 401 Cb 0.00 0.43 0.16 0.00 -1.09 0.00 0.00 33.01 32.51 3pch s GLN 401 CO -0.06 -0.70 1.10 0.00 -1.32 0.00 0.00 175.29 174.32 3pch s ALA 402 N -2.39 3.37 0.61 2.60 0.00 -1.26 -4.60 121.76 120.10 3pch s ALA 402 Ca 0.19 -1.73 -0.01 0.00 0.00 0.00 0.00 51.96 50.41 3pch s ALA 402 Cb -0.03 -2.13 0.03 0.00 0.00 0.00 0.00 23.12 20.99 3pch s ALA 402 CO 0.06 -1.80 0.20 0.27 0.00 0.00 0.00 175.76 174.48 3pch n ASN 403 N -3.12 0.17 -0.01 0.00 0.23 0.01 -4.53 115.26 108.02 3pch n ASN 403 Ca 0.17 -1.17 0.08 0.00 -0.53 0.00 0.00 54.58 53.13 3pch n ASN 403 Cb 0.60 -0.13 0.48 0.00 -2.08 0.00 0.00 39.78 38.65 3pch n ASN 403 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3pch h ALA 404 N -0.93 1.86 -0.07 -2.53 0.00 -1.77 -0.97 119.26 114.84 3pch h ALA 404 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3pch h ALA 404 Cb 0.21 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3pch h ALA 404 CO 0.06 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.79 3pch n GLY 405 N -1.50 0.12 1.61 0.00 0.00 -1.26 -3.29 105.19 100.87 3pch n GLY 405 Ca 0.05 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.63 3pch n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pch n GLY 406 N 1.17 0.53 3.72 -0.02 0.00 -0.65 -4.81 105.19 105.13 3pch n GLY 406 Ca 0.18 -0.86 -0.35 0.00 0.00 0.00 0.00 46.02 44.99 3pch n GLY 406 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3pch s ARG 407 N -1.83 4.13 0.07 1.61 6.06 -1.26 -4.75 118.95 122.98 3pch s ARG 407 Ca 0.00 -0.23 -0.07 0.00 -2.50 0.00 0.00 55.73 52.93 3pch s ARG 407 Cb 0.00 -3.38 -0.05 0.00 0.06 0.00 0.00 34.95 31.57 3pch s ARG 407 CO 0.00 0.32 0.34 0.71 -2.50 0.00 0.00 175.30 174.17 3pch s TYR 408 N 0.30 3.55 -1.19 5.12 2.02 -1.26 -0.81 117.35 125.08 3pch s TYR 408 Ca 0.08 0.63 -0.11 0.00 -0.37 0.00 0.00 57.07 57.29 3pch s TYR 408 Cb -0.11 -2.04 0.20 0.00 -0.40 0.00 0.00 41.96 39.61 3pch s TYR 408 CO -0.02 0.53 1.44 -2.13 -1.57 0.00 0.00 175.55 173.80 3pch n ARG 409 N 0.74 3.52 -3.74 -0.62 0.63 -1.26 -4.75 116.66 111.18 3pch n ARG 409 Ca -0.08 -3.98 -0.12 0.00 -0.92 0.00 0.00 57.85 52.75 3pch n ARG 409 Cb 0.52 -2.88 -0.11 0.00 0.45 0.00 0.00 32.46 30.45 3pch n ARG 409 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 3pch s HIS 410 N 0.47 -0.43 0.30 -0.14 2.46 -1.26 -5.06 115.29 111.62 3pch s HIS 410 Ca 0.39 1.03 0.05 0.00 0.47 0.00 0.00 55.06 57.00 3pch s HIS 410 Cb -0.02 0.16 0.75 0.00 -0.13 0.00 0.00 32.58 33.33 3pch s HIS 410 CO -0.01 -0.22 1.74 1.57 -2.47 0.00 0.00 174.74 175.34 3pch h LYS 411 N 5.96 0.56 0.00 2.88 2.10 -2.07 -1.07 116.57 124.92 3pch h LYS 411 Ca -0.29 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.32 3pch h LYS 411 Cb 1.18 -0.13 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 3pch h LYS 411 CO 0.29 0.37 0.00 0.09 -2.00 0.00 0.00 179.45 178.20 3pch n ASN 412 N -4.90 0.00 -4.59 7.07 5.03 -1.26 -4.71 115.26 111.90 3pch n ASN 412 Ca 0.23 0.46 -0.42 0.00 0.87 0.00 0.00 54.58 55.71 3pch n ASN 412 Cb 0.63 -0.48 -0.05 0.00 -1.02 0.00 0.00 39.78 38.86 3pch n ASN 412 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3pch s ASP 413 N -2.96 6.55 0.00 6.41 2.15 -0.41 -4.88 116.67 123.54 3pch s ASP 413 Ca 0.09 0.36 0.16 0.00 0.43 0.00 0.00 52.55 53.60 3pch s ASP 413 Cb 0.12 -2.40 0.31 0.00 -0.30 0.00 0.00 42.92 40.65 3pch s ASP 413 CO 0.32 -0.74 1.22 0.54 -0.17 0.00 0.00 175.17 176.35 3pch n ARG 414 N 6.43 2.13 -1.71 4.34 5.12 -1.26 -4.91 116.66 126.80 3pch n ARG 414 Ca 0.03 -1.95 -0.43 0.00 -1.93 0.00 0.00 57.85 53.57 3pch n ARG 414 Cb 0.48 -1.37 -0.01 0.00 -1.16 0.00 0.00 32.46 30.40 3pch n ARG 414 CO 0.00 0.00 0.00 0.98 -1.93 0.00 0.00 177.63 176.68 3pch n TYR 415 N 0.99 2.40 0.30 -1.55 9.36 -1.26 -4.85 117.16 122.54 3pch n TYR 415 Ca 0.14 0.47 0.19 0.00 3.32 0.00 0.00 57.90 62.02 3pch n TYR 415 Cb 0.47 -2.46 0.85 0.00 -0.63 0.00 0.00 39.34 37.57 3pch n TYR 415 CO 0.00 0.00 0.00 1.37 0.22 0.00 0.00 176.86 178.45 3pch h LEU 416 N 3.28 0.00 -9.93 2.98 -0.00 -1.97 -3.44 115.31 106.23 3pch h LEU 416 Ca -0.46 0.00 -0.53 0.00 -0.00 0.00 0.00 57.88 56.88 3pch h LEU 416 Cb 1.27 0.00 0.09 0.00 -0.00 0.00 0.00 40.66 42.02 3pch h LEU 416 CO 0.68 0.00 0.70 0.00 -0.00 0.00 0.00 178.44 179.82 3pch s ALA 417 N -3.80 3.46 0.76 0.17 0.00 -1.26 -4.96 121.76 116.13 3pch s ALA 417 Ca -0.01 1.42 -0.11 0.00 0.00 0.00 0.00 51.96 53.26 3pch s ALA 417 Cb 0.10 -3.55 0.04 0.00 0.00 0.00 0.00 23.12 19.72 3pch s ALA 417 CO 0.49 -0.92 1.08 -1.25 0.00 0.00 0.00 175.76 175.16 3pch s PRO 418 N -2.07 2.44 0.47 0.00 0.04 -1.26 -4.77 135.00 129.84 3pch s PRO 418 Ca 0.53 0.78 -0.16 0.00 0.04 0.00 0.00 61.00 62.20 3pch s PRO 418 Cb -0.43 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.09 3pch s PRO 418 CO 0.57 -1.41 0.92 -0.51 0.04 0.00 0.00 177.00 176.61 3pch s LEU 419 N -5.69 3.72 -0.31 -3.56 1.43 -1.26 -4.71 118.68 108.31 3pch s LEU 419 Ca 0.60 1.47 -0.11 0.00 -1.03 0.00 0.00 54.13 55.06 3pch s LEU 419 Cb -0.14 -4.38 -0.02 0.00 0.03 0.00 0.00 46.19 41.68 3pch s LEU 419 CO 0.55 -0.50 0.18 -0.62 0.23 0.00 0.00 176.35 176.18 3pch s ASP 420 N -2.96 5.75 0.60 2.29 -1.08 -1.26 -4.98 116.67 115.03 3pch s ASP 420 Ca 0.57 -0.36 0.30 0.00 -0.52 0.00 0.00 52.55 52.54 3pch s ASP 420 Cb -0.10 -2.06 1.67 0.00 -1.46 0.00 0.00 42.92 40.97 3pch s ASP 420 CO 0.29 -0.16 2.05 1.55 0.52 0.00 0.00 175.17 179.42 3pch h PRO 421 N 8.38 0.00 -0.56 4.34 0.13 -1.97 -2.12 132.00 140.21 3pch h PRO 421 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 3pch h PRO 421 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3pch h PRO 421 CO 0.60 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.46 3pch n ASN 422 N -3.62 4.66 -3.93 1.44 5.03 -1.26 -4.95 115.26 112.62 3pch n ASN 422 Ca 0.02 -2.57 -0.23 0.00 0.87 0.00 0.00 54.58 52.67 3pch n ASN 422 Cb 0.38 -0.56 -0.17 0.00 -1.02 0.00 0.00 39.78 38.41 3pch n ASN 422 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 3pch s PHE 423 N -2.07 1.15 -0.20 3.10 5.36 -0.80 -4.07 117.98 120.45 3pch s PHE 423 Ca 0.48 -0.43 -0.15 0.00 -0.96 0.00 0.00 56.93 55.87 3pch s PHE 423 Cb 0.33 -0.94 -0.09 0.00 -0.34 0.00 0.00 43.02 41.99 3pch s PHE 423 CO 0.20 -0.30 -0.21 0.41 -1.46 0.00 0.00 175.22 173.86 3pch n GLY 424 N 4.24 -0.68 0.00 13.12 0.00 -1.26 -4.70 105.19 115.90 3pch n GLY 424 Ca -0.20 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.65 3pch n GLY 424 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3pch n GLY 425 N 1.45 1.11 3.18 -0.02 0.00 -1.26 -4.51 105.19 105.14 3pch n GLY 425 Ca -0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.52 3pch n GLY 425 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3pch s VAL 426 N -2.00 1.52 0.02 1.61 1.01 -1.26 -1.34 120.40 119.96 3pch s VAL 426 Ca 0.00 -0.81 -0.08 0.00 0.00 0.00 0.00 61.98 61.09 3pch s VAL 426 Cb 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 35.11 3pch s VAL 426 CO 0.00 0.43 0.15 -0.83 0.00 0.00 0.00 175.10 174.85 3pch s GLY 427 N -0.33 0.06 -0.05 4.51 0.00 -0.55 -4.73 107.32 106.23 3pch s GLY 427 Ca 0.04 -0.24 -0.06 0.00 0.00 0.00 0.00 44.72 44.46 3pch s GLY 427 CO 0.00 -0.40 0.16 1.09 0.00 0.00 0.00 173.10 173.96 3pch s ARG 428 N -1.98 0.28 -0.13 2.90 1.70 -0.91 -0.37 118.95 120.44 3pch s ARG 428 Ca -0.10 0.07 -0.11 0.00 -0.47 0.00 0.00 55.73 55.12 3pch s ARG 428 Cb -0.04 0.13 0.04 0.00 -0.57 0.00 0.00 34.95 34.50 3pch s ARG 428 CO -0.01 -0.05 0.35 0.00 -1.08 0.00 0.00 175.30 174.51 3pch s LEU 430 N 0.53 4.17 0.63 0.00 2.96 -1.26 -0.45 118.68 125.27 3pch s LEU 430 Ca -0.03 0.39 -0.18 0.00 -0.22 0.00 0.00 54.13 54.09 3pch s LEU 430 Cb -0.04 -2.34 -0.02 0.00 0.50 0.00 0.00 46.19 44.29 3pch s LEU 430 CO -0.03 0.03 1.28 0.42 -1.32 0.00 0.00 176.35 176.73 3pch s THR 431 N 0.94 2.14 0.24 3.68 -4.23 0.94 -4.84 115.64 114.50 3pch s THR 431 Ca 0.15 0.09 -0.04 0.00 -1.18 0.00 0.00 61.69 60.70 3pch s THR 431 Cb -0.14 -3.03 0.06 0.00 1.34 0.00 0.00 72.50 70.72 3pch s THR 431 CO 0.05 -0.02 0.33 -0.90 -0.54 0.00 0.00 174.62 173.54 3pch n ASP 432 N -1.81 0.05 0.18 3.99 5.68 0.01 -1.87 116.55 122.77 3pch n ASP 432 Ca 0.15 -1.13 0.14 0.00 -0.50 0.00 0.00 54.79 53.45 3pch n ASP 432 Cb 0.48 -0.25 0.71 0.00 -1.14 0.00 0.00 41.12 40.92 3pch n ASP 432 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3pch h SER 433 N -0.42 0.00 -0.51 -1.12 0.02 -1.94 -0.85 113.55 108.72 3pch h SER 433 Ca -0.11 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 3pch h SER 433 Cb 0.30 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.84 3pch h SER 433 CO 0.08 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.24 3pch n ASP 434 N -4.32 3.08 -0.03 3.07 8.00 -1.26 -4.54 116.55 120.55 3pch n ASP 434 Ca 0.02 -1.97 -0.00 0.00 0.71 0.00 0.00 54.79 53.54 3pch n ASP 434 Cb 0.28 -0.34 -0.00 0.00 -0.02 0.00 0.00 41.12 41.04 3pch n ASP 434 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3pch n GLY 435 N 1.43 0.46 3.80 0.44 0.00 -0.33 -4.67 105.19 106.32 3pch n GLY 435 Ca 0.19 -0.47 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 3pch n GLY 435 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3pch s TYR 436 N -1.99 3.82 0.13 1.61 2.02 -1.26 0.60 117.35 122.27 3pch s TYR 436 Ca 0.00 1.40 0.01 0.00 -0.37 0.00 0.00 57.07 58.11 3pch s TYR 436 Cb 0.00 -2.60 -0.04 0.00 -0.40 0.00 0.00 41.96 38.92 3pch s TYR 436 CO 0.00 0.53 -0.01 1.52 -1.57 0.00 0.00 175.55 176.01 3pch s TYR 437 N -1.19 0.96 -0.14 2.71 -0.85 -0.48 -0.81 117.35 117.55 3pch s TYR 437 Ca 0.33 -1.03 -0.29 0.00 -0.52 0.00 0.00 57.07 55.56 3pch s TYR 437 Cb -0.20 -0.56 0.08 0.00 0.38 0.00 0.00 41.96 41.65 3pch s TYR 437 CO 0.22 -0.27 0.73 -1.54 -1.52 0.00 0.00 175.55 173.16 3pch s SER 438 N -3.08 -0.66 0.06 -0.18 1.04 -1.26 -2.28 113.70 107.34 3pch s SER 438 Ca 0.18 0.94 0.02 0.00 0.48 0.00 0.00 55.95 57.57 3pch s SER 438 Cb 0.06 0.84 -0.03 0.00 0.10 0.00 0.00 66.02 66.99 3pch s SER 438 CO -0.01 -0.46 -0.08 -0.36 0.98 0.00 0.00 173.24 173.31 3pch s PHE 439 N -0.62 0.76 -0.08 5.02 0.08 0.18 -4.90 117.98 118.42 3pch s PHE 439 Ca -0.06 -0.60 0.04 0.00 0.12 0.00 0.00 56.93 56.42 3pch s PHE 439 Cb -0.02 -0.45 0.00 0.00 -0.57 0.00 0.00 43.02 41.99 3pch s PHE 439 CO 0.06 -0.09 -0.19 0.50 -0.10 0.00 0.00 175.22 175.40 3pch s ARG 440 N -2.16 2.36 0.00 0.44 3.52 -0.79 -0.35 118.95 121.97 3pch s ARG 440 Ca -0.04 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 54.88 3pch s ARG 440 Cb -0.06 -1.87 0.00 0.00 -1.56 0.00 0.00 34.95 31.46 3pch s ARG 440 CO -0.01 0.15 0.00 -2.37 -0.81 0.00 0.00 175.30 172.26 3pch n THR 441 N 3.52 0.00 -4.54 4.11 5.66 0.40 0.33 114.28 123.76 3pch n THR 441 Ca -0.20 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.50 3pch n THR 441 Cb 0.52 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.18 3pch n THR 441 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 175.07 172.29 3pch s ILE 442 N -2.90 2.48 0.00 1.09 -4.36 -1.26 -1.03 121.20 115.22 3pch s ILE 442 Ca 0.00 -1.50 -0.30 0.00 -0.26 0.00 0.00 60.65 58.58 3pch s ILE 442 Cb 0.00 -2.07 -0.06 0.00 1.25 0.00 0.00 42.46 41.58 3pch s ILE 442 CO 0.00 0.20 1.58 -0.75 0.24 0.00 0.00 174.94 176.21 3pch s LYS 443 N -1.78 4.21 0.61 0.37 2.20 0.00 -4.93 119.74 120.43 3pch s LYS 443 Ca 0.15 2.17 -0.17 0.00 -0.36 0.00 0.00 55.97 57.76 3pch s LYS 443 Cb -0.10 -3.73 -0.03 0.00 -1.51 0.00 0.00 37.83 32.46 3pch s LYS 443 CO 0.06 -0.73 1.11 -1.25 -0.36 0.00 0.00 175.35 174.18 3pch s PRO 444 N 3.09 3.07 0.27 4.03 0.04 -1.26 -4.30 135.00 139.94 3pch s PRO 444 Ca 0.71 1.47 -0.00 0.00 0.04 0.00 0.00 61.00 63.21 3pch s PRO 444 Cb -0.35 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.17 3pch s PRO 444 CO 0.29 -1.05 0.47 0.20 0.04 0.00 0.00 177.00 176.96 3pch s GLY 445 N -2.26 1.59 0.91 0.56 0.00 -0.46 -4.66 107.32 103.00 3pch s GLY 445 Ca 0.69 -0.85 -0.11 0.00 0.00 0.00 0.00 44.72 44.45 3pch s GLY 445 CO 0.35 -0.79 1.10 2.56 0.00 0.00 0.00 173.10 176.32 3pch s PRO 446 N -3.78 1.13 -0.12 2.90 0.04 -1.26 -4.05 135.00 129.87 3pch s PRO 446 Ca 0.40 1.08 -0.20 0.00 0.04 0.00 0.00 61.00 62.32 3pch s PRO 446 Cb -0.10 -1.77 0.05 0.00 0.04 0.00 0.00 34.50 32.71 3pch s PRO 446 CO 0.32 -2.41 0.50 1.52 0.04 0.00 0.00 177.00 176.97 3pch s TYR 447 N -2.79 -0.49 0.46 0.56 1.13 -0.97 -4.27 117.35 110.98 3pch s TYR 447 Ca 0.64 1.04 -0.21 0.00 -1.41 0.00 0.00 57.07 57.13 3pch s TYR 447 Cb -0.20 0.21 -0.09 0.00 -1.10 0.00 0.00 41.96 40.79 3pch s TYR 447 CO 0.58 -0.37 1.05 -1.25 -2.51 0.00 0.00 175.55 173.04 3pch s PRO 448 N -0.45 3.90 0.01 -3.49 0.04 -1.26 0.29 135.00 134.04 3pch s PRO 448 Ca -0.06 1.43 -0.11 0.00 0.04 0.00 0.00 61.00 62.30 3pch s PRO 448 Cb -0.03 -2.24 0.01 0.00 0.04 0.00 0.00 34.50 32.28 3pch s PRO 448 CO 0.04 -0.35 0.22 1.67 0.04 0.00 0.00 177.00 178.61 3pch s TRP 449 N -1.86 -0.03 -1.18 0.56 1.48 -0.51 -4.88 118.94 112.53 3pch s TRP 449 Ca 0.64 -0.06 -0.20 0.00 -1.06 0.00 0.00 56.10 55.42 3pch s TRP 449 Cb -0.19 0.01 0.06 0.00 -1.16 0.00 0.00 33.47 32.19 3pch s TRP 449 CO 0.23 -0.38 1.63 1.03 -4.06 0.00 0.00 176.95 175.40 3pch s ARG 450 N -1.84 3.76 0.00 3.25 0.52 -1.26 -4.26 118.95 119.12 3pch s ARG 450 Ca -0.11 -1.59 0.00 0.00 -0.52 0.00 0.00 55.73 53.52 3pch s ARG 450 Cb -0.04 -5.45 0.00 0.00 0.52 0.00 0.00 34.95 29.98 3pch s ARG 450 CO 0.00 -2.31 0.00 -1.71 0.02 0.00 0.00 175.30 171.30 3pch n ASN 451 N 8.87 0.00 -4.22 0.23 5.15 -1.26 -5.04 115.26 118.99 3pch n ASN 451 Ca 0.42 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 54.11 3pch n ASN 451 Cb 0.48 0.00 0.18 0.00 -0.53 0.00 0.00 39.78 39.91 3pch n ASN 451 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3pch s GLY 452 N -0.27 1.75 0.47 8.20 0.00 -1.26 -4.95 107.32 111.25 3pch s GLY 452 Ca 0.00 -1.11 0.32 0.00 0.00 0.00 0.00 44.72 43.92 3pch s GLY 452 CO 0.00 -0.37 1.94 -2.55 0.00 0.00 0.00 173.10 172.12 3pch h PRO 453 N -1.61 0.00 -1.20 2.90 0.11 -1.97 -3.32 132.00 126.90 3pch h PRO 453 Ca -0.45 0.00 -0.38 0.00 0.11 0.00 0.00 66.00 65.28 3pch h PRO 453 Cb 1.25 0.00 -0.35 0.00 0.11 0.00 0.00 31.00 32.01 3pch h PRO 453 CO 0.42 0.00 -1.04 -1.71 -0.21 0.00 0.00 178.00 175.46 3pch n ASN 454 N -2.79 0.48 -4.84 -2.05 5.15 -1.26 -5.08 115.26 104.87 3pch n ASN 454 Ca 0.00 -2.91 -0.37 0.00 -0.60 0.00 0.00 54.58 50.70 3pch n ASN 454 Cb 0.23 -0.16 -0.06 0.00 -0.53 0.00 0.00 39.78 39.26 3pch n ASN 454 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 3pch s ASP 455 N -2.46 6.55 -0.04 1.20 1.01 -1.25 -5.06 116.67 116.61 3pch s ASP 455 Ca 0.31 0.65 -0.00 0.00 0.71 0.00 0.00 52.55 54.23 3pch s ASP 455 Cb 0.39 -2.15 0.03 0.00 1.01 0.00 0.00 42.92 42.19 3pch s ASP 455 CO -0.03 0.33 -0.01 0.26 0.21 0.00 0.00 175.17 175.93 3pch s TRP 456 N -0.80 0.47 0.20 4.23 0.52 -1.26 -1.42 118.94 120.88 3pch s TRP 456 Ca 0.18 -0.06 -0.30 0.00 0.02 0.00 0.00 56.10 55.94 3pch s TRP 456 Cb -0.14 -0.56 -0.08 0.00 -1.15 0.00 0.00 33.47 31.54 3pch s TRP 456 CO 0.07 -0.19 1.07 1.03 0.02 0.00 0.00 176.95 178.95 3pch s ARG 457 N 1.29 4.64 0.74 4.98 1.81 0.14 -4.77 118.95 127.79 3pch s ARG 457 Ca -0.06 1.68 -0.14 0.00 -1.72 0.00 0.00 55.73 55.49 3pch s ARG 457 Cb -0.13 -3.27 0.04 0.00 -0.45 0.00 0.00 34.95 31.14 3pch s ARG 457 CO -0.02 0.16 1.17 -2.14 -0.68 0.00 0.00 175.30 173.79 3pch s PRO 458 N -0.61 2.18 0.14 3.54 0.02 -1.26 -2.30 135.00 136.72 3pch s PRO 458 Ca 0.47 1.59 -0.34 0.00 0.02 0.00 0.00 61.00 62.74 3pch s PRO 458 Cb -0.29 -1.86 -0.14 0.00 0.02 0.00 0.00 34.50 32.23 3pch s PRO 458 CO 0.35 -1.77 1.54 0.00 -0.33 0.00 0.00 177.00 176.79 3pch n ALA 459 N -2.89 0.94 -3.29 -1.55 0.00 -1.26 -4.75 120.51 107.70 3pch n ALA 459 Ca 0.12 0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.88 3pch n ALA 459 Cb 0.51 -2.30 -0.05 0.00 0.00 0.00 0.00 19.45 17.61 3pch n ALA 459 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3pch s HIS 460 N 0.87 -0.42 -0.12 0.00 -3.43 -1.26 -3.98 115.29 106.95 3pch s HIS 460 Ca 0.80 0.40 0.02 0.00 -0.80 0.00 0.00 55.06 55.48 3pch s HIS 460 Cb -0.73 0.36 0.01 0.00 -1.43 0.00 0.00 32.58 30.79 3pch s HIS 460 CO 0.40 -0.67 -0.17 0.42 -2.00 0.00 0.00 174.74 172.72 3pch s ILE 461 N -2.70 1.65 0.13 -5.38 1.01 -0.01 -4.64 121.20 111.25 3pch s ILE 461 Ca -0.04 -0.73 -0.30 0.00 0.00 0.00 0.00 60.65 59.58 3pch s ILE 461 Cb -0.00 -1.49 -0.07 0.00 0.01 0.00 0.00 42.46 40.91 3pch s ILE 461 CO -0.04 0.47 1.15 -1.00 0.00 0.00 0.00 174.94 175.53 3pch s HIS 462 N 0.96 3.50 -0.00 3.97 3.76 0.47 -0.41 115.29 127.55 3pch s HIS 462 Ca -0.06 1.45 0.07 0.00 -0.15 0.00 0.00 55.06 56.37 3pch s HIS 462 Cb -0.15 -3.36 -0.02 0.00 1.11 0.00 0.00 32.58 30.17 3pch s HIS 462 CO -0.02 -0.96 -0.21 -0.06 -0.85 0.00 0.00 174.74 172.64 3pch s PHE 463 N 0.35 1.83 -0.07 1.40 0.40 0.29 -1.15 117.98 121.03 3pch s PHE 463 Ca 0.54 -0.35 0.03 0.00 -0.60 0.00 0.00 56.93 56.54 3pch s PHE 463 Cb -0.30 -1.16 0.01 0.00 0.51 0.00 0.00 43.02 42.08 3pch s PHE 463 CO 0.33 -0.00 -0.16 0.20 0.70 0.00 0.00 175.22 176.29 3pch s GLY 464 N -0.63 0.94 -0.08 4.36 0.00 0.22 -0.23 107.32 111.91 3pch s GLY 464 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 44.72 44.22 3pch s GLY 464 CO -0.00 -0.03 -0.06 -0.42 0.00 0.00 0.00 173.10 172.59 3pch s ILE 465 N 0.54 0.77 -0.03 0.90 1.09 0.12 -0.91 121.20 123.68 3pch s ILE 465 Ca -0.15 -0.19 -0.12 0.00 -1.10 0.00 0.00 60.65 59.09 3pch s ILE 465 Cb -0.16 -0.80 -0.07 0.00 -1.06 0.00 0.00 42.46 40.37 3pch s ILE 465 CO 0.05 0.30 0.58 0.77 -0.10 0.00 0.00 174.94 176.54 3pch h SER 466 N 7.70 -0.37 -3.92 3.58 4.64 -1.60 -0.24 113.55 123.34 3pch h SER 466 Ca -0.30 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3pch h SER 466 Cb 1.15 0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 63.33 3pch h SER 466 CO 0.41 -0.02 -0.01 0.61 -0.87 0.00 0.00 176.83 176.95 3pch n GLY 467 N 0.49 -2.13 0.19 -0.77 0.00 -1.26 -2.35 105.19 99.36 3pch n GLY 467 Ca -0.05 -1.45 0.06 0.00 0.00 0.00 0.00 46.02 44.58 3pch n GLY 467 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3pch h PRO 468 N 0.00 0.00 -4.68 1.61 0.13 -1.93 -3.47 132.00 123.66 3pch h PRO 468 Ca 0.00 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.77 3pch h PRO 468 Cb 0.02 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.02 3pch h PRO 468 CO 0.00 0.36 -0.49 -1.54 -0.23 0.00 0.00 178.00 176.10 3pch s SER 469 N -6.39 1.05 0.44 1.44 1.04 -1.26 -3.48 113.70 106.54 3pch s SER 469 Ca 0.01 -1.59 0.21 0.00 0.48 0.00 0.00 55.95 55.06 3pch s SER 469 Cb 0.10 0.51 1.01 0.00 0.10 0.00 0.00 66.02 67.75 3pch s SER 469 CO 0.68 -1.02 1.90 0.16 0.98 0.00 0.00 173.24 175.94 3pch h ILE 470 N 2.29 0.81 0.00 -1.02 3.07 -1.08 -1.25 117.51 120.34 3pch h ILE 470 Ca -0.29 -1.03 -0.04 0.00 1.55 0.00 0.00 64.86 65.05 3pch h ILE 470 Cb 1.24 1.63 -0.01 0.00 -0.27 0.00 0.00 36.82 39.41 3pch h ILE 470 CO 0.42 0.25 -0.19 0.00 -1.05 0.00 0.00 178.15 177.58 3pch h ALA 471 N 1.74 1.46 0.00 0.16 0.00 -1.72 -3.08 119.26 117.82 3pch h ALA 471 Ca -0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 3pch h ALA 471 Cb 0.61 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3pch h ALA 471 CO 0.03 0.24 -1.13 0.25 0.00 0.00 0.00 179.25 178.65 3pch n THR 472 N -3.99 0.24 -1.59 0.00 -2.24 -0.50 -4.92 114.28 101.27 3pch n THR 472 Ca -0.02 -0.33 -0.51 0.00 -2.27 0.00 0.00 64.05 60.92 3pch n THR 472 Cb 0.28 0.08 -0.06 0.00 -2.10 0.00 0.00 70.33 68.53 3pch n THR 472 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 3pch n LYS 473 N -2.13 1.20 -3.82 -0.78 3.00 -0.99 -4.73 118.16 109.91 3pch n LYS 473 Ca 0.01 0.43 -0.12 0.00 -0.00 0.00 0.00 58.31 58.63 3pch n LYS 473 Cb 0.47 -2.06 -0.10 0.00 0.00 0.00 0.00 35.03 33.34 3pch n LYS 473 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 3pch s LEU 474 N 0.53 1.23 -0.07 3.14 2.96 -0.10 -5.02 118.68 121.35 3pch s LEU 474 Ca 0.82 0.14 0.04 0.00 -0.22 0.00 0.00 54.13 54.92 3pch s LEU 474 Cb -0.92 0.84 -0.00 0.00 0.50 0.00 0.00 46.19 46.60 3pch s LEU 474 CO 0.47 -0.26 -0.20 -0.63 -1.32 0.00 0.00 176.35 174.41 3pch s ILE 475 N -0.72 1.73 0.05 6.68 1.01 -1.26 0.11 121.20 128.80 3pch s ILE 475 Ca -0.08 -0.86 -0.01 0.00 0.00 0.00 0.00 60.65 59.70 3pch s ILE 475 Cb -0.05 -1.49 0.00 0.00 0.01 0.00 0.00 42.46 40.94 3pch s ILE 475 CO 0.02 0.49 0.09 1.07 0.00 0.00 0.00 174.94 176.60 3pch n THR 476 N 3.29 0.00 -4.15 2.92 5.66 0.68 -5.02 114.28 117.66 3pch n THR 476 Ca -0.19 -0.23 -0.16 0.00 -3.05 0.00 0.00 64.05 60.42 3pch n THR 476 Cb 0.52 0.16 -0.14 0.00 -1.55 0.00 0.00 70.33 69.32 3pch n THR 476 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 175.07 170.92 3pch s GLN 477 N -2.09 0.42 -0.19 1.09 -0.21 -1.26 -0.55 119.66 116.88 3pch s GLN 477 Ca 0.04 -0.21 -0.09 0.00 0.02 0.00 0.00 55.36 55.13 3pch s GLN 477 Cb -0.00 -0.40 -0.05 0.00 1.00 0.00 0.00 33.01 33.56 3pch s GLN 477 CO 0.03 0.11 0.09 -1.17 -2.12 0.00 0.00 175.29 172.23 3pch s LEU 478 N -0.17 4.00 0.36 2.90 0.20 0.45 -4.81 118.68 121.62 3pch s LEU 478 Ca 0.02 0.16 0.08 0.00 0.69 0.00 0.00 54.13 55.07 3pch s LEU 478 Cb -0.02 -2.02 -0.03 0.00 -0.43 0.00 0.00 46.19 43.68 3pch s LEU 478 CO -0.00 0.18 0.23 -0.31 -0.29 0.00 0.00 176.35 176.16 3pch s TYR 479 N 0.34 2.76 -0.11 5.38 2.02 0.62 -0.83 117.35 127.53 3pch s TYR 479 Ca 0.05 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.34 3pch s TYR 479 Cb -0.12 -1.82 -0.03 0.00 -0.40 0.00 0.00 41.96 39.60 3pch s TYR 479 CO -0.01 0.19 -0.03 -0.06 -1.57 0.00 0.00 175.55 174.08 3pch s PHE 480 N -2.42 3.07 -0.03 2.71 0.40 -1.26 -0.05 117.98 120.41 3pch s PHE 480 Ca 0.41 -0.02 -0.37 0.00 -0.60 0.00 0.00 56.93 56.35 3pch s PHE 480 Cb -0.03 -1.84 -0.16 0.00 0.51 0.00 0.00 43.02 41.50 3pch s PHE 480 CO 0.25 0.25 1.53 -1.91 0.70 0.00 0.00 175.22 176.04 3pch n GLU 481 N 2.69 1.36 -0.19 0.44 2.13 -0.81 -1.99 120.64 124.27 3pch n GLU 481 Ca -0.18 0.49 0.00 0.00 0.66 0.00 0.00 57.16 58.13 3pch n GLU 481 Cb 0.53 -2.18 0.00 0.00 0.27 0.00 0.00 31.44 30.06 3pch n GLU 481 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3pch n GLY 482 N 3.28 1.95 3.60 8.31 0.00 -1.26 -4.99 105.19 116.07 3pch n GLY 482 Ca 0.21 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.77 3pch n GLY 482 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3pch n ASP 483 N 0.00 3.25 0.15 1.61 -0.08 -0.84 -4.84 116.55 115.80 3pch n ASP 483 Ca 0.00 0.54 0.12 0.00 -1.51 0.00 0.00 54.79 53.94 3pch n ASP 483 Cb 0.00 -1.45 0.54 0.00 2.34 0.00 0.00 41.12 42.55 3pch n ASP 483 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 3pch h PRO 484 N 12.45 0.00 0.00 -0.67 0.13 -1.94 -1.77 132.00 140.20 3pch h PRO 484 Ca -0.42 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.70 3pch h PRO 484 Cb 1.26 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 3pch h PRO 484 CO 0.97 0.00 -0.05 -0.07 -0.23 0.00 0.00 178.00 178.62 3pch h LEU 485 N 0.00 0.00 -0.19 1.56 3.38 -1.95 -3.38 115.31 114.73 3pch h LEU 485 Ca 0.00 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 3pch h LEU 485 Cb 0.27 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 3pch h LEU 485 CO 0.00 0.05 -0.51 0.40 0.09 0.00 0.00 178.44 178.47 3pch h ILE 486 N 0.00 0.04 0.00 1.22 2.04 -1.70 -1.34 117.51 117.76 3pch h ILE 486 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pch h ILE 486 Cb 0.92 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3pch h ILE 486 CO 0.01 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.35 3pch n PRO 487 N -5.43 0.03 0.02 2.37 -0.04 -1.26 -2.17 135.00 128.52 3pch n PRO 487 Ca -0.05 0.36 0.11 0.00 -0.04 0.00 0.00 63.50 63.88 3pch n PRO 487 Cb 0.37 -1.57 -0.04 0.00 -0.04 0.00 0.00 33.50 32.22 3pch n PRO 487 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 3pch n MET 488 N -1.63 0.31 -2.45 0.54 2.81 -0.55 -4.95 117.12 111.21 3pch n MET 488 Ca 0.02 -0.04 -0.43 0.00 -1.81 0.00 0.00 57.70 55.45 3pch n MET 488 Cb 0.12 -1.56 -0.02 0.00 -0.71 0.00 0.00 33.22 31.05 3pch n MET 488 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3pch h PRO 490 N 7.95 0.10 -0.16 0.00 0.11 -1.90 0.40 132.00 138.49 3pch h PRO 490 Ca -0.28 -0.02 -0.07 0.00 0.11 0.00 0.00 66.00 65.75 3pch h PRO 490 Cb 1.12 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.21 3pch h PRO 490 CO 0.95 0.20 -0.16 0.82 -0.21 0.00 0.00 178.00 179.59 3pch h ILE 491 N 0.10 1.34 -0.19 4.15 2.04 -1.92 -2.06 117.51 120.98 3pch h ILE 491 Ca 0.02 -1.33 -0.00 0.00 1.00 0.00 0.00 64.86 64.55 3pch h ILE 491 Cb 0.23 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 3pch h ILE 491 CO 0.01 0.39 0.11 0.58 0.00 0.00 0.00 178.15 179.25 3pch h VAL 492 N 0.03 1.08 0.00 1.67 2.07 -1.71 -1.42 116.25 117.97 3pch h VAL 492 Ca 0.02 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.36 3pch h VAL 492 Cb 0.70 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.33 3pch h VAL 492 CO 0.04 0.07 0.00 0.29 0.02 0.00 0.00 177.57 177.99 3pch n LYS 493 N -4.93 0.06 0.25 1.57 5.02 0.14 -1.36 118.16 118.90 3pch n LYS 493 Ca -0.04 0.21 0.11 0.00 -2.02 0.00 0.00 58.31 56.58 3pch n LYS 493 Cb 0.05 -1.50 0.64 0.00 -0.02 0.00 0.00 35.03 34.20 3pch n LYS 493 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3pch h SER 494 N 0.00 0.00 -3.49 4.39 4.64 -0.51 -3.38 113.55 115.21 3pch h SER 494 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3pch h SER 494 Cb 0.03 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.03 3pch h SER 494 CO 0.00 0.16 0.80 -0.63 -0.87 0.00 0.00 176.83 176.29 3pch s ILE 495 N -4.14 4.25 0.19 0.95 1.01 -0.46 -3.91 121.20 119.08 3pch s ILE 495 Ca -0.02 0.87 -0.09 0.00 0.00 0.00 0.00 60.65 61.41 3pch s ILE 495 Cb 0.13 -4.59 0.10 0.00 0.01 0.00 0.00 42.46 38.12 3pch s ILE 495 CO 0.61 -1.08 1.70 0.00 0.00 0.00 0.00 174.94 176.18 3pch h ALA 496 N 9.29 0.91 -2.22 9.38 0.00 -1.85 -3.43 119.26 131.33 3pch h ALA 496 Ca -0.24 -0.25 -0.61 0.00 0.00 0.00 0.00 54.91 53.81 3pch h ALA 496 Cb 1.06 -0.26 -0.11 0.00 0.00 0.00 0.00 17.79 18.49 3pch h ALA 496 CO 1.11 0.64 0.38 1.21 0.00 0.00 0.00 179.25 182.60 3pch s ASN 497 N -6.44 6.62 0.45 0.00 3.04 -1.26 -4.93 114.94 112.42 3pch s ASN 497 Ca -0.12 0.55 0.16 0.00 0.04 0.00 0.00 52.86 53.49 3pch s ASN 497 Cb 0.14 -2.40 1.11 0.00 -1.54 0.00 0.00 41.25 38.57 3pch s ASN 497 CO 0.84 -0.65 1.98 1.55 -3.04 0.00 0.00 177.10 177.78 3pch h PRO 498 N 8.25 0.31 -0.15 0.43 0.13 -2.00 0.13 132.00 139.09 3pch h PRO 498 Ca -0.25 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.82 3pch h PRO 498 Cb 1.10 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.15 3pch h PRO 498 CO 0.89 0.20 -0.12 0.93 -0.23 0.00 0.00 178.00 179.68 3pch h GLU 499 N 0.32 0.24 -0.06 0.86 5.08 -1.97 -2.51 114.58 116.53 3pch h GLU 499 Ca 0.28 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.41 3pch h GLU 499 Cb 0.67 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 3pch h GLU 499 CO -0.07 0.37 -0.72 0.00 -1.00 0.00 0.00 179.01 177.59 3pch h ALA 500 N 1.66 0.67 -0.57 3.43 0.00 -1.11 -3.06 119.26 120.28 3pch h ALA 500 Ca 0.05 -0.61 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 3pch h ALA 500 Cb 0.35 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3pch h ALA 500 CO 0.02 0.78 0.21 0.28 0.00 0.00 0.00 179.25 180.54 3pch h VAL 501 N 0.20 1.23 -0.79 0.00 2.07 -1.15 -2.45 116.25 115.36 3pch h VAL 501 Ca -0.02 -0.74 0.16 0.00 0.82 0.00 0.00 66.70 66.91 3pch h VAL 501 Cb 1.28 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 31.64 3pch h VAL 501 CO 0.12 0.28 0.53 1.56 0.02 0.00 0.00 177.57 180.07 3pch h GLN 502 N 0.78 0.42 0.00 1.57 1.08 -1.36 -0.62 115.11 116.99 3pch h GLN 502 Ca 0.19 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.35 3pch h GLN 502 Cb 0.23 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 27.56 3pch h GLN 502 CO -0.01 0.28 -0.05 1.96 -0.95 0.00 0.00 178.83 180.06 3pch h GLN 503 N 0.44 0.00 -0.03 1.46 4.20 -1.47 -2.16 115.11 117.55 3pch h GLN 503 Ca 0.39 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.10 3pch h GLN 503 Cb 0.89 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.67 3pch h GLN 503 CO -0.13 0.05 0.00 1.28 -0.67 0.00 0.00 178.83 179.35 3pch n LEU 504 N -4.00 1.23 -4.49 1.46 4.77 -0.24 -4.84 117.00 110.89 3pch n LEU 504 Ca -0.03 -0.42 -0.42 0.00 -0.03 0.00 0.00 56.01 55.11 3pch n LEU 504 Cb 0.13 -0.01 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 3pch n LEU 504 CO 0.30 0.21 -0.09 -0.63 -1.33 0.00 0.00 177.39 175.86 3pch s ILE 505 N -1.98 5.27 0.25 -0.08 1.01 -0.81 -0.28 121.20 124.57 3pch s ILE 505 Ca 0.39 -0.49 -0.30 0.00 0.00 0.00 0.00 60.65 60.25 3pch s ILE 505 Cb 0.21 -3.85 -0.10 0.00 0.01 0.00 0.00 42.46 38.73 3pch s ILE 505 CO 0.33 -0.20 1.36 0.00 0.00 0.00 0.00 174.94 176.43 3pch s ALA 506 N 1.70 3.56 -0.09 9.38 0.00 0.93 -4.81 121.76 132.43 3pch s ALA 506 Ca 0.05 1.23 -0.07 0.00 0.00 0.00 0.00 51.96 53.17 3pch s ALA 506 Cb -0.18 -3.51 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 3pch s ALA 506 CO 0.10 -0.64 0.18 0.15 0.00 0.00 0.00 175.76 175.56 3pch s LYS 507 N -0.56 3.50 0.18 0.00 -0.14 -0.38 -1.92 119.74 120.42 3pch s LYS 507 Ca 0.56 -0.08 -0.32 0.00 -1.36 0.00 0.00 55.97 54.76 3pch s LYS 507 Cb -0.39 -3.18 -0.12 0.00 -1.68 0.00 0.00 37.83 32.46 3pch s LYS 507 CO 0.43 0.75 1.72 -0.11 -0.76 0.00 0.00 175.35 177.38 3pch n LEU 508 N 1.79 3.83 -3.80 3.17 7.94 -1.26 -0.40 117.00 128.27 3pch n LEU 508 Ca -0.18 1.05 -0.29 0.00 -1.11 0.00 0.00 56.01 55.48 3pch n LEU 508 Cb 0.54 -1.54 -0.13 0.00 0.53 0.00 0.00 43.42 42.82 3pch n LEU 508 CO 0.34 0.09 -0.19 -0.62 -1.11 0.00 0.00 177.39 175.90 3pch s ASP 509 N 1.41 3.93 0.45 1.96 -1.08 0.15 -4.83 116.67 118.65 3pch s ASP 509 Ca 0.77 -3.00 0.13 0.00 -0.52 0.00 0.00 52.55 49.93 3pch s ASP 509 Cb -0.54 -1.30 1.00 0.00 -1.46 0.00 0.00 42.92 40.62 3pch s ASP 509 CO 0.34 -0.22 2.01 0.24 0.52 0.00 0.00 175.17 178.07 3pch h MET 510 N 6.35 0.10 -0.03 4.34 2.86 -1.93 -2.38 114.93 124.24 3pch h MET 510 Ca 0.01 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3pch h MET 510 Cb 0.88 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.52 3pch h MET 510 CO 0.59 0.20 -0.01 -0.91 1.06 0.00 0.00 176.91 177.84 3pch h ASN 511 N 0.10 0.04 0.03 1.22 2.35 -1.95 -2.77 115.58 114.60 3pch h ASN 511 Ca 0.02 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 3pch h ASN 511 Cb 0.23 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.59 3pch h ASN 511 CO 0.01 0.06 -0.49 -3.20 -1.65 0.00 0.00 177.43 172.16 3pch n ASN 512 N -4.50 1.78 -4.80 5.81 5.15 -0.90 -4.96 115.26 112.84 3pch n ASN 512 Ca -0.02 -1.37 -0.33 0.00 -0.60 0.00 0.00 54.58 52.25 3pch n ASN 512 Cb 0.12 0.47 -0.00 0.00 -0.53 0.00 0.00 39.78 39.83 3pch n ASN 512 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3pch s ALA 513 N -2.53 2.77 -0.39 5.20 0.00 -1.05 -4.76 121.76 121.00 3pch s ALA 513 Ca 0.18 0.51 -0.14 0.00 0.00 0.00 0.00 51.96 52.52 3pch s ALA 513 Cb 0.18 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 20.06 3pch s ALA 513 CO 0.59 -0.65 0.28 -0.80 0.00 0.00 0.00 175.76 175.18 3pch s ASN 514 N -2.40 6.05 0.28 0.00 0.01 0.10 -5.00 114.94 113.98 3pch s ASN 514 Ca 0.66 -0.81 -0.29 0.00 -0.71 0.00 0.00 52.86 51.71 3pch s ASN 514 Cb -0.17 -2.14 -0.14 0.00 0.41 0.00 0.00 41.25 39.21 3pch s ASN 514 CO 0.30 -0.40 1.11 -2.65 -1.51 0.00 0.00 177.10 173.95 3pch n PRO 515 N 5.13 1.54 -1.94 -0.60 -0.02 -1.26 -0.57 135.00 137.28 3pch n PRO 515 Ca -0.11 0.54 -0.14 0.00 -2.02 0.00 0.00 63.50 61.76 3pch n PRO 515 Cb 0.47 -1.99 -0.03 0.00 -0.02 0.00 0.00 33.50 31.93 3pch n PRO 515 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 3pch n MET 516 N 0.89 -1.72 0.00 -0.52 2.81 -1.26 -4.70 117.12 112.62 3pch n MET 516 Ca 0.09 0.77 0.00 0.00 -1.81 0.00 0.00 57.70 56.75 3pch n MET 516 Cb 0.32 -5.21 0.00 0.00 -0.71 0.00 0.00 33.22 27.62 3pch n MET 516 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 3pch n ASP 517 N -1.26 0.00 -3.79 7.83 2.03 0.26 -5.15 116.55 116.48 3pch n ASP 517 Ca -0.16 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.03 3pch n ASP 517 Cb 0.55 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.86 3pch n ASP 517 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3pch s LEU 519 N -1.01 2.77 -0.01 0.00 1.43 -0.88 -0.72 118.68 120.27 3pch s LEU 519 Ca -0.11 0.13 -0.13 0.00 -1.03 0.00 0.00 54.13 52.99 3pch s LEU 519 Cb -0.05 -2.24 0.02 0.00 0.03 0.00 0.00 46.19 43.95 3pch s LEU 519 CO 0.03 -2.53 0.26 0.00 0.23 0.00 0.00 176.35 174.34 3pch s ALA 520 N -3.72 -0.66 -0.02 4.21 0.00 -1.26 -1.08 121.76 119.23 3pch s ALA 520 Ca 0.72 0.18 0.04 0.00 0.00 0.00 0.00 51.96 52.91 3pch s ALA 520 Cb -0.04 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.17 3pch s ALA 520 CO 0.51 -0.26 -0.14 0.71 0.00 0.00 0.00 175.76 176.59 3pch s TYR 521 N -1.42 1.28 -0.18 0.00 1.51 -0.12 0.30 117.35 118.72 3pch s TYR 521 Ca -0.13 -0.27 -0.06 0.00 -1.01 0.00 0.00 57.07 55.60 3pch s TYR 521 Cb -0.06 -0.84 -0.03 0.00 -0.11 0.00 0.00 41.96 40.92 3pch s TYR 521 CO 0.03 -0.05 0.03 0.50 -1.11 0.00 0.00 175.55 174.95 3pch s ARG 522 N -0.21 3.81 -0.27 -0.62 6.06 0.47 -1.42 118.95 126.77 3pch s ARG 522 Ca 0.03 -0.43 -0.04 0.00 -2.50 0.00 0.00 55.73 52.80 3pch s ARG 522 Cb -0.07 -3.13 0.10 0.00 0.06 0.00 0.00 34.95 31.92 3pch s ARG 522 CO -0.00 0.18 0.15 0.12 -2.50 0.00 0.00 175.30 173.26 3pch s PHE 523 N 0.58 0.16 0.13 5.12 5.36 0.66 -1.25 117.98 128.75 3pch s PHE 523 Ca 0.01 -0.67 -0.10 0.00 -0.96 0.00 0.00 56.93 55.21 3pch s PHE 523 Cb -0.13 -0.79 -0.06 0.00 -0.34 0.00 0.00 43.02 41.69 3pch s PHE 523 CO 0.02 -0.80 0.46 -0.51 -1.46 0.00 0.00 175.22 172.93 3pch s ASP 524 N 2.15 6.66 -0.05 6.13 1.01 -1.26 -4.02 116.67 127.29 3pch s ASP 524 Ca 0.08 0.86 0.06 0.00 0.71 0.00 0.00 52.55 54.26 3pch s ASP 524 Cb -0.16 -2.20 -0.01 0.00 1.01 0.00 0.00 42.92 41.56 3pch s ASP 524 CO -0.32 0.09 -0.23 -0.63 0.21 0.00 0.00 175.17 174.29 3pch s ILE 525 N -1.53 1.87 -0.24 0.77 1.01 -0.55 -4.94 121.20 117.59 3pch s ILE 525 Ca 0.38 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 60.02 3pch s ILE 525 Cb -0.13 -1.58 -0.00 0.00 0.01 0.00 0.00 42.46 40.75 3pch s ILE 525 CO 0.20 0.52 -0.00 -0.69 0.00 0.00 0.00 174.94 174.97 3pch s VAL 526 N -0.10 3.58 0.30 2.92 1.01 -1.25 -1.68 120.40 125.18 3pch s VAL 526 Ca -0.04 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.44 3pch s VAL 526 Cb -0.13 -2.70 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 3pch s VAL 526 CO 0.03 0.32 0.46 -0.76 0.00 0.00 0.00 175.10 175.16 3pch s LEU 527 N 1.49 4.12 0.26 3.92 1.43 0.17 -4.92 118.68 125.15 3pch s LEU 527 Ca 0.05 0.17 -0.29 0.00 -1.03 0.00 0.00 54.13 53.02 3pch s LEU 527 Cb -0.15 -3.01 -0.14 0.00 0.03 0.00 0.00 46.19 42.91 3pch s LEU 527 CO -0.01 -0.24 1.09 0.54 0.23 0.00 0.00 176.35 177.95 3pch n ARG 528 N -1.62 1.38 -1.86 1.70 1.74 -1.26 -1.16 116.66 115.59 3pch n ARG 528 Ca -0.06 0.49 -0.41 0.00 -0.77 0.00 0.00 57.85 57.10 3pch n ARG 528 Cb 0.57 -1.92 -0.02 0.00 -1.02 0.00 0.00 32.46 30.08 3pch n ARG 528 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3pch s GLY 529 N -0.35 2.26 -0.17 -0.13 0.00 -1.26 -4.33 107.32 103.34 3pch s GLY 529 Ca 0.63 1.49 -0.06 0.00 0.00 0.00 0.00 44.72 46.78 3pch s GLY 529 CO 0.57 2.43 0.04 1.62 0.00 0.00 0.00 173.10 177.76 3pch s GLN 530 N -0.62 3.86 0.08 2.90 0.74 -1.26 -1.01 119.66 124.35 3pch s GLN 530 Ca 0.61 -0.38 0.01 0.00 0.05 0.00 0.00 55.36 55.65 3pch s GLN 530 Cb -0.46 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.49 3pch s GLN 530 CO 0.48 0.29 -0.06 -0.98 -0.55 0.00 0.00 175.29 174.47 3pch s ARG 531 N 0.29 0.74 0.54 1.67 1.70 -0.49 -4.97 118.95 118.44 3pch s ARG 531 Ca 0.02 -1.22 -0.16 0.00 -0.47 0.00 0.00 55.73 53.90 3pch s ARG 531 Cb -0.13 -0.13 -0.07 0.00 -0.57 0.00 0.00 34.95 34.05 3pch s ARG 531 CO 0.01 -0.03 1.00 -1.59 -1.08 0.00 0.00 175.30 173.61 3pch s LYS 532 N -3.49 3.83 0.53 3.89 -2.85 -1.26 -0.69 119.74 119.69 3pch s LYS 532 Ca 0.07 0.94 -0.19 0.00 -1.00 0.00 0.00 55.97 55.80 3pch s LYS 532 Cb 0.03 -2.12 -0.07 0.00 -2.06 0.00 0.00 37.83 33.62 3pch s LYS 532 CO -0.05 -0.37 1.06 0.95 0.10 0.00 0.00 175.35 177.04 3pch s THR 533 N -2.70 3.68 -0.04 3.79 -4.23 -1.24 -4.72 115.64 110.18 3pch s THR 533 Ca 0.59 0.98 -0.11 0.00 -1.18 0.00 0.00 61.69 61.96 3pch s THR 533 Cb -0.11 -3.40 0.02 0.00 1.34 0.00 0.00 72.50 70.35 3pch s THR 533 CO 0.36 -0.30 0.25 -1.38 -0.54 0.00 0.00 174.62 173.01 3pch s HIS 534 N -2.08 -0.17 -1.25 3.99 -3.43 -1.26 -4.92 115.29 106.18 3pch s HIS 534 Ca 0.67 0.34 -0.16 0.00 -0.80 0.00 0.00 55.06 55.12 3pch s HIS 534 Cb -0.17 0.06 0.16 0.00 -1.43 0.00 0.00 32.58 31.20 3pch s HIS 534 CO 0.26 -0.27 0.40 1.19 -2.00 0.00 0.00 174.74 174.31 3pch n PHE 535 N 1.95 -1.15 1.92 0.38 3.72 -1.26 -5.24 117.46 117.78 3pch n PHE 535 Ca -0.19 0.46 0.16 0.00 -0.05 0.00 0.00 57.45 57.83 3pch n PHE 535 Cb 0.57 -1.42 0.89 0.00 -0.94 0.00 0.00 39.48 38.57 3pch n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10