#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 2.23 0.06 0.55 0.00 -1.26 -5.06 121.76 118.28 3pch s ALA 302 Ca 0.00 0.68 0.05 0.00 0.00 0.00 0.00 51.96 52.69 3pch s ALA 302 Cb 0.00 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.70 3pch s ALA 302 CO 0.00 -1.67 -0.14 -0.65 0.00 0.00 0.00 175.76 173.29 3pch s GLN 303 N -4.09 0.89 -1.10 0.00 -0.21 -1.26 -5.08 119.66 108.80 3pch s GLN 303 Ca 0.70 -0.87 -0.20 0.00 0.02 0.00 0.00 55.36 55.01 3pch s GLN 303 Cb -0.24 -0.91 0.09 0.00 1.00 0.00 0.00 33.01 32.95 3pch s GLN 303 CO 0.45 0.21 1.46 0.34 -2.12 0.00 0.00 175.29 175.64 3pch s ASP 304 N -1.47 6.69 0.00 5.90 2.15 -1.26 -4.70 116.67 123.98 3pch s ASP 304 Ca 0.00 -2.03 0.00 0.00 0.43 0.00 0.00 52.55 50.95 3pch s ASP 304 Cb -0.09 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 3pch s ASP 304 CO 0.02 -1.23 0.58 -0.46 -0.17 0.00 0.00 175.17 173.91 3pch n ASN 305 N 7.89 1.12 -4.16 -0.34 0.23 -1.26 -5.01 115.26 113.73 3pch n ASN 305 Ca 0.36 -1.27 -0.15 0.00 -0.53 0.00 0.00 54.58 52.99 3pch n ASN 305 Cb 0.48 0.00 -0.11 0.00 -2.08 0.00 0.00 39.78 38.07 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 -0.27 1.39 0.13 0.53 0.01 -1.26 -3.87 113.70 110.36 3pch s SER 306 Ca 0.00 -0.75 0.10 0.00 1.31 0.00 0.00 55.95 56.61 3pch s SER 306 Cb 0.00 0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.19 3pch s SER 306 CO 0.00 -0.23 -0.23 -0.13 0.41 0.00 0.00 173.24 173.06 3pch s ARG 307 N -2.48 1.57 -0.07 12.44 1.81 0.88 -4.85 118.95 128.26 3pch s ARG 307 Ca 0.02 -1.30 0.05 0.00 -1.72 0.00 0.00 55.73 52.79 3pch s ARG 307 Cb -0.05 -1.98 -0.01 0.00 -0.45 0.00 0.00 34.95 32.46 3pch s ARG 307 CO 0.00 0.46 -0.24 -0.06 -0.68 0.00 0.00 175.30 174.78 3pch s PHE 308 N -1.15 2.37 0.21 -0.53 0.40 -1.26 -0.88 117.98 117.14 3pch s PHE 308 Ca 0.16 -0.77 -0.32 0.00 -0.60 0.00 0.00 56.93 55.40 3pch s PHE 308 Cb -0.10 -1.57 -0.14 0.00 0.51 0.00 0.00 43.02 41.73 3pch s PHE 308 CO 0.08 -0.26 1.47 0.28 0.70 0.00 0.00 175.22 177.50 3pch n VAL 309 N 3.10 0.61 -1.72 -0.44 0.31 0.25 -4.87 118.33 115.57 3pch n VAL 309 Ca -0.18 -0.15 -0.42 0.00 -0.01 0.00 0.00 64.34 63.57 3pch n VAL 309 Cb 0.52 -1.51 -0.01 0.00 -0.91 0.00 0.00 33.84 31.93 3pch n VAL 309 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 3pch n ILE 310 N 2.44 1.40 -2.09 2.52 2.08 -1.26 -4.73 119.36 119.72 3pch n ILE 310 Ca 0.13 -0.35 -0.38 0.00 0.56 0.00 0.00 62.75 62.71 3pch n ILE 310 Cb 0.31 -1.77 0.00 0.00 -0.75 0.00 0.00 39.64 37.43 3pch n ILE 310 CO 0.00 0.00 0.00 -0.13 0.56 0.00 0.00 176.55 176.98 3pch s ARG 311 N -1.09 3.66 -0.59 0.38 0.52 -1.26 -4.98 118.95 115.58 3pch s ARG 311 Ca 0.61 1.98 -0.18 0.00 -0.52 0.00 0.00 55.73 57.62 3pch s ARG 311 Cb -0.54 -2.46 0.12 0.00 0.52 0.00 0.00 34.95 32.59 3pch s ARG 311 CO 0.55 -0.69 0.65 0.34 0.02 0.00 0.00 175.30 176.16 3pch s ASP 312 N -1.11 6.22 0.00 0.23 -1.08 -1.26 -4.90 116.67 114.77 3pch s ASP 312 Ca 0.64 -1.62 0.24 0.00 -0.52 0.00 0.00 52.55 51.29 3pch s ASP 312 Cb -0.34 -2.27 1.44 0.00 -1.46 0.00 0.00 42.92 40.29 3pch s ASP 312 CO 0.41 -1.01 1.81 0.54 0.52 0.00 0.00 175.17 177.44 3pch n ARG 313 N 5.88 0.76 0.03 4.34 1.74 -1.26 -1.42 116.66 126.73 3pch n ARG 313 Ca -0.09 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.09 3pch n ARG 313 Cb 0.42 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.26 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 -1.00 0.36 -0.08 0.55 3.02 -1.26 -4.39 115.26 112.47 3pch n ASN 314 Ca 0.18 0.14 -0.15 0.00 -0.03 0.00 0.00 54.58 54.72 3pch n ASN 314 Cb 0.08 1.29 -0.12 0.00 -0.61 0.00 0.00 39.78 40.42 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 0.00 -4.22 3.10 2.91 -1.66 -3.43 115.95 112.65 3pch h TRP 315 Ca -0.03 0.00 -0.51 0.00 1.13 0.00 0.00 58.89 59.48 3pch h TRP 315 Cb 1.07 0.00 0.11 0.00 -0.51 0.00 0.00 29.16 29.83 3pch h TRP 315 CO 0.00 1.08 0.36 -1.01 -1.03 0.00 0.00 178.44 177.85 3pch s HIS 316 N -2.24 2.62 0.66 2.65 3.76 -0.97 -4.73 115.29 117.03 3pch s HIS 316 Ca -0.21 1.55 -0.17 0.00 -0.15 0.00 0.00 55.06 56.08 3pch s HIS 316 Cb -0.01 -3.14 -0.00 0.00 1.11 0.00 0.00 32.58 30.54 3pch s HIS 316 CO 0.66 -1.70 1.25 -1.25 -0.85 0.00 0.00 174.74 172.84 3pch s PRO 317 N -4.26 2.53 0.78 8.40 0.04 -1.26 -4.81 135.00 136.42 3pch s PRO 317 Ca 0.66 1.93 -0.10 0.00 0.04 0.00 0.00 61.00 63.52 3pch s PRO 317 Cb -0.20 -1.86 0.08 0.00 0.04 0.00 0.00 34.50 32.56 3pch s PRO 317 CO 0.44 -1.57 1.12 0.15 0.04 0.00 0.00 177.00 177.18 3pch s LYS 318 N -3.51 1.96 -0.04 4.56 -0.14 -1.25 -4.97 119.74 116.35 3pch s LYS 318 Ca 0.79 -0.09 -0.26 0.00 -1.36 0.00 0.00 55.97 55.05 3pch s LYS 318 Cb -0.34 -2.04 -0.21 0.00 -1.68 0.00 0.00 37.83 33.56 3pch s LYS 318 CO 0.40 -1.51 1.17 0.00 -0.76 0.00 0.00 175.35 174.65 3pch h ALA 319 N -0.91 0.01 -2.44 5.17 0.00 -1.95 -3.41 119.26 115.73 3pch h ALA 319 Ca -0.45 -0.30 -0.69 0.00 0.00 0.00 0.00 54.91 53.47 3pch h ALA 319 Cb 1.32 -0.00 -0.18 0.00 0.00 0.00 0.00 17.79 18.92 3pch h ALA 319 CO 0.61 -0.19 -0.23 -1.17 0.00 0.00 0.00 179.25 178.27 3pch s LEU 320 N -9.02 4.75 -0.40 0.00 2.96 -1.26 -4.77 118.68 110.93 3pch s LEU 320 Ca -0.16 -0.55 0.03 0.00 -0.22 0.00 0.00 54.13 53.22 3pch s LEU 320 Cb 0.01 -2.37 0.16 0.00 0.50 0.00 0.00 46.19 44.49 3pch s LEU 320 CO 0.68 -0.51 0.31 0.42 -1.32 0.00 0.00 176.35 175.93 3pch s THR 321 N 2.09 0.36 0.60 3.68 -4.23 -1.26 -5.03 115.64 111.85 3pch s THR 321 Ca 0.12 -2.42 0.29 0.00 -1.18 0.00 0.00 61.69 58.50 3pch s THR 321 Cb -0.17 -1.27 0.40 0.00 1.34 0.00 0.00 72.50 72.81 3pch s THR 321 CO 0.13 -1.16 1.64 1.55 -0.54 0.00 0.00 174.62 176.25 3pch h PRO 322 N 6.04 0.00 0.00 3.99 0.13 -1.94 0.16 132.00 140.38 3pch h PRO 322 Ca 0.20 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.30 3pch h PRO 322 Cb 0.92 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.05 3pch h PRO 322 CO 0.35 0.00 -0.16 -0.44 -0.23 0.00 0.00 178.00 177.51 3pch h ASP 323 N 0.00 0.00 -2.86 1.44 3.32 -1.96 -3.23 116.42 113.14 3pch h ASP 323 Ca 0.36 0.00 -0.72 0.00 0.02 0.00 0.00 57.03 56.69 3pch h ASP 323 Cb 2.00 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 41.35 3pch h ASP 323 CO -0.00 0.16 0.54 -0.47 -1.72 0.00 0.00 179.24 177.75 3pch s TYR 324 N -3.79 3.26 0.28 4.55 5.04 0.55 -4.83 117.35 122.42 3pch s TYR 324 Ca -0.00 -1.47 -0.00 0.00 -2.44 0.00 0.00 57.07 53.15 3pch s TYR 324 Cb 0.11 -4.13 0.65 0.00 0.35 0.00 0.00 41.96 38.94 3pch s TYR 324 CO 0.61 -1.34 1.64 0.87 -1.34 0.00 0.00 175.55 175.99 3pch h LYS 325 N 8.62 0.17 -0.22 4.97 1.57 -1.78 -1.55 116.57 128.34 3pch h LYS 325 Ca 0.07 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.88 3pch h LYS 325 Cb 1.04 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 3pch h LYS 325 CO 1.01 0.11 0.15 1.15 -0.57 0.00 0.00 179.45 181.31 3pch h THR 326 N 0.17 0.96 0.00 -0.16 2.02 -1.91 -2.03 112.91 111.96 3pch h THR 326 Ca 0.52 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.65 3pch h THR 326 Cb 1.03 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 68.26 3pch h THR 326 CO -0.67 0.02 -0.03 0.77 0.37 0.00 0.00 175.52 175.98 3pch h SER 327 N 0.13 0.00 0.39 4.18 4.64 -1.57 -2.98 113.55 118.34 3pch h SER 327 Ca 0.10 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.41 3pch h SER 327 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 3pch h SER 327 CO -0.01 0.03 -0.28 0.40 -0.87 0.00 0.00 176.83 176.10 3pch h ILE 328 N 0.00 0.42 0.00 0.95 2.04 -1.50 -2.83 117.51 116.59 3pch h ILE 328 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3pch h ILE 328 Cb 0.20 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 36.70 3pch h ILE 328 CO 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 178.15 178.04 3pch h ALA 329 N -0.12 0.93 -0.73 1.87 0.00 -1.77 -3.35 119.26 116.10 3pch h ALA 329 Ca -0.04 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 54.37 3pch h ALA 329 Cb 0.56 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.04 3pch h ALA 329 CO 0.01 0.00 -0.17 0.54 0.00 0.00 0.00 179.25 179.63 3pch n ARG 330 N -2.35 2.94 -4.37 0.00 1.74 -1.13 -4.95 116.66 108.55 3pch n ARG 330 Ca 0.05 -3.70 -0.20 0.00 -0.77 0.00 0.00 57.85 53.23 3pch n ARG 330 Cb 0.45 -2.18 -0.15 0.00 -1.02 0.00 0.00 32.46 29.56 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 -2.86 1.18 0.73 0.55 1.04 -1.08 -4.90 113.70 108.36 3pch s SER 331 Ca 0.53 -0.18 -0.15 0.00 0.48 0.00 0.00 55.95 56.63 3pch s SER 331 Cb 0.44 -0.33 0.04 0.00 0.10 0.00 0.00 66.02 66.26 3pch s SER 331 CO 0.02 0.06 1.23 -2.84 0.98 0.00 0.00 173.24 172.68 3pch s PRO 332 N 0.24 2.10 -0.04 4.02 0.02 -1.26 -4.94 135.00 135.13 3pch s PRO 332 Ca -0.04 1.85 0.16 0.00 0.02 0.00 0.00 61.00 62.99 3pch s PRO 332 Cb -0.09 -1.82 -0.25 0.00 0.02 0.00 0.00 34.50 32.36 3pch s PRO 332 CO 0.00 -1.89 0.33 0.54 -0.33 0.00 0.00 177.00 175.66 3pch n ARG 333 N -2.67 0.61 -3.34 5.54 5.12 -1.26 -4.90 116.66 115.77 3pch n ARG 333 Ca 0.14 -0.14 -0.31 0.00 -1.93 0.00 0.00 57.85 55.62 3pch n ARG 333 Cb 0.50 -1.39 -0.04 0.00 -1.16 0.00 0.00 32.46 30.36 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 -3.07 3.74 0.51 5.56 -1.52 -1.26 -5.06 119.66 118.56 3pch s GLN 334 Ca -0.06 0.20 -0.21 0.00 -1.95 0.00 0.00 55.36 53.34 3pch s GLN 334 Cb 0.10 -2.62 -0.06 0.00 -0.22 0.00 0.00 33.01 30.20 3pch s GLN 334 CO 0.68 0.25 1.16 0.00 -0.25 0.00 0.00 175.29 177.14 3pch s ALA 335 N -1.96 2.82 0.62 6.09 0.00 -1.26 -4.99 121.76 123.08 3pch s ALA 335 Ca 0.47 0.92 -0.18 0.00 0.00 0.00 0.00 51.96 53.16 3pch s ALA 335 Cb -0.11 -3.39 -0.02 0.00 0.00 0.00 0.00 23.12 19.60 3pch s ALA 335 CO 0.25 -0.77 1.19 -0.51 0.00 0.00 0.00 175.76 175.92 3pch s LEU 336 N -3.43 3.59 -0.28 0.00 1.43 -1.26 -4.99 118.68 113.73 3pch s LEU 336 Ca 0.69 2.33 -0.10 0.00 -1.03 0.00 0.00 54.13 56.02 3pch s LEU 336 Cb -0.27 -4.59 -0.04 0.00 0.03 0.00 0.00 46.19 41.32 3pch s LEU 336 CO 0.32 -1.68 0.17 -0.69 0.23 0.00 0.00 176.35 174.70 3pch s VAL 337 N -1.73 5.03 0.22 -1.59 1.01 -1.26 -5.07 120.40 117.00 3pch s VAL 337 Ca 0.76 -0.00 -0.30 0.00 0.00 0.00 0.00 61.98 62.44 3pch s VAL 337 Cb -0.29 -3.42 -0.08 0.00 0.00 0.00 0.00 36.38 32.59 3pch s VAL 337 CO 0.35 0.22 1.02 -0.44 0.00 0.00 0.00 175.10 176.26 3pch s SER 338 N 1.71 7.44 0.01 3.32 0.01 -1.26 -5.05 113.70 119.88 3pch s SER 338 Ca 0.07 2.04 0.01 0.00 1.31 0.00 0.00 55.95 59.37 3pch s SER 338 Cb -0.16 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.45 3pch s SER 338 CO 0.09 -0.04 -0.03 0.27 0.41 0.00 0.00 173.24 173.94 3pch s ILE 339 N -0.79 0.19 0.72 1.44 -4.36 -1.26 -5.16 121.20 111.99 3pch s ILE 339 Ca 0.45 -0.36 -0.15 0.00 -0.26 0.00 0.00 60.65 60.33 3pch s ILE 339 Cb -0.28 -0.21 0.03 0.00 1.25 0.00 0.00 42.46 43.25 3pch s ILE 339 CO 0.35 -0.11 1.20 -2.16 0.24 0.00 0.00 174.94 174.46 3pch s PRO 340 N -0.50 2.20 0.15 0.37 0.04 -1.26 -4.96 135.00 131.04 3pch s PRO 340 Ca -0.04 1.75 -0.30 0.00 0.04 0.00 0.00 61.00 62.45 3pch s PRO 340 Cb -0.04 -1.84 -0.07 0.00 0.04 0.00 0.00 34.50 32.60 3pch s PRO 340 CO -0.00 -1.79 0.97 -0.65 0.04 0.00 0.00 177.00 175.57 3pch s GLN 341 N -3.90 4.72 0.35 4.56 -0.21 -1.26 -5.01 119.66 118.91 3pch s GLN 341 Ca 0.74 1.49 0.03 0.00 0.02 0.00 0.00 55.36 57.65 3pch s GLN 341 Cb -0.29 -3.35 -0.04 0.00 1.00 0.00 0.00 33.01 30.34 3pch s GLN 341 CO 0.45 0.26 0.13 -1.54 -2.12 0.00 0.00 175.29 172.47 3pch s SER 342 N -0.26 2.19 0.50 5.90 1.04 -1.26 -5.00 113.70 116.82 3pch s SER 342 Ca 0.46 -1.57 0.25 0.00 0.48 0.00 0.00 55.95 55.57 3pch s SER 342 Cb -0.25 0.34 1.34 0.00 0.10 0.00 0.00 66.02 67.56 3pch s SER 342 CO 0.31 -0.85 1.92 -0.29 0.98 0.00 0.00 173.24 175.31 3pch h ILE 343 N 2.03 0.66 -0.97 -1.02 2.10 -1.96 0.10 117.51 118.44 3pch h ILE 343 Ca -0.36 -0.04 0.04 0.00 1.08 0.00 0.00 64.86 65.58 3pch h ILE 343 Cb 1.26 0.53 -0.06 0.00 -1.09 0.00 0.00 36.82 37.46 3pch h ILE 343 CO 0.57 0.02 0.64 0.28 -1.08 0.00 0.00 178.15 178.58 3pch h SER 344 N 0.11 1.06 0.42 2.19 0.02 -1.96 -2.97 113.55 112.41 3pch h SER 344 Ca 0.37 -0.01 -0.30 0.00 -0.84 0.00 0.00 61.79 61.01 3pch h SER 344 Cb 1.30 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 63.55 3pch h SER 344 CO -0.05 0.72 -1.81 -0.62 -1.14 0.00 0.00 176.83 173.93 3pch n GLU 345 N -4.47 0.64 -0.15 3.45 4.71 0.14 -4.40 120.64 120.56 3pch n GLU 345 Ca 0.13 0.25 0.10 0.00 -0.01 0.00 0.00 57.16 57.62 3pch n GLU 345 Cb 0.10 -1.75 0.29 0.00 -1.01 0.00 0.00 31.44 29.07 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 -2.99 0.39 -4.64 2.62 -2.24 0.01 -2.80 114.28 104.63 3pch n THR 346 Ca -0.19 -0.50 -0.29 0.00 -2.27 0.00 0.00 64.05 60.81 3pch n THR 346 Cb 1.06 0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 69.64 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 -1.61 1.85 -0.09 4.28 -4.23 -1.13 -4.69 115.64 110.03 3pch s THR 347 Ca 0.32 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.52 3pch s THR 347 Cb 0.18 -2.87 0.12 0.00 1.34 0.00 0.00 72.50 71.27 3pch s THR 347 CO 0.25 0.00 1.39 -0.83 -0.54 0.00 0.00 174.62 174.89 3pch s GLY 348 N -3.73 -0.33 0.44 3.99 0.00 -1.24 -1.31 107.32 105.13 3pch s GLY 348 Ca 0.30 0.49 -0.24 0.00 0.00 0.00 0.00 44.72 45.28 3pch s GLY 348 CO 0.16 3.91 1.17 2.56 0.00 0.00 0.00 173.10 180.90 3pch s PRO 349 N -2.03 3.85 -0.23 2.90 0.04 -1.26 -4.84 135.00 133.44 3pch s PRO 349 Ca 0.25 1.81 -0.02 0.00 0.04 0.00 0.00 61.00 63.07 3pch s PRO 349 Cb 0.03 -2.50 0.01 0.00 0.04 0.00 0.00 34.50 32.08 3pch s PRO 349 CO -0.04 -0.48 -0.07 1.21 0.04 0.00 0.00 177.00 177.65 3pch s ASN 350 N -1.27 4.14 -0.02 6.66 3.84 -1.26 -4.85 114.94 122.19 3pch s ASN 350 Ca 0.61 -0.62 0.14 0.00 0.21 0.00 0.00 52.86 53.20 3pch s ASN 350 Cb -0.30 -1.67 0.43 0.00 -0.55 0.00 0.00 41.25 39.16 3pch s ASN 350 CO 0.36 -0.06 1.34 0.49 -2.79 0.00 0.00 177.10 176.44 3pch n PHE 351 N 4.72 0.73 -0.30 0.43 3.72 -1.26 -4.58 117.46 120.92 3pch n PHE 351 Ca -0.18 -0.34 0.22 0.00 -0.05 0.00 0.00 57.45 57.10 3pch n PHE 351 Cb 0.49 -0.05 0.51 0.00 -0.94 0.00 0.00 39.48 39.49 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 2.73 0.43 -0.39 4.37 0.02 -1.96 0.01 113.55 118.76 3pch h SER 352 Ca 0.00 0.07 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 3pch h SER 352 Cb 0.75 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.28 3pch h SER 352 CO 0.04 0.12 0.00 1.41 -1.14 0.00 0.00 176.83 177.26 3pch n HIS 353 N -4.58 0.51 -2.25 3.45 8.25 -1.26 -4.91 115.22 114.43 3pch n HIS 353 Ca 0.23 -0.26 -0.40 0.00 -0.26 0.00 0.00 57.72 57.03 3pch n HIS 353 Cb 0.82 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.90 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 -1.26 4.46 -0.71 2.41 2.96 -0.01 -4.95 118.68 121.57 3pch s LEU 354 Ca 0.35 2.52 -0.21 0.00 -0.22 0.00 0.00 54.13 56.56 3pch s LEU 354 Cb 0.19 -3.66 0.09 0.00 0.50 0.00 0.00 46.19 43.30 3pch s LEU 354 CO 0.26 -0.40 0.97 -0.83 -1.32 0.00 0.00 176.35 175.03 3pch s GLY 355 N -0.67 1.54 0.12 7.98 0.00 -1.26 -5.02 107.32 110.01 3pch s GLY 355 Ca 0.48 -2.10 -0.22 0.00 0.00 0.00 0.00 44.72 42.88 3pch s GLY 355 CO 0.48 2.00 0.66 -1.36 0.00 0.00 0.00 173.10 174.88 3pch s PHE 356 N 3.60 3.85 0.73 1.90 0.40 -1.26 -5.07 117.98 122.12 3pch s PHE 356 Ca 0.23 1.43 -0.11 0.00 -0.60 0.00 0.00 56.93 57.89 3pch s PHE 356 Cb -0.15 -2.62 0.03 0.00 0.51 0.00 0.00 43.02 40.79 3pch s PHE 356 CO 0.05 0.55 1.07 0.20 0.70 0.00 0.00 175.22 177.80 3pch s GLY 357 N -1.14 1.67 0.35 4.36 0.00 -1.26 -4.95 107.32 106.36 3pch s GLY 357 Ca 0.32 0.16 0.06 0.00 0.00 0.00 0.00 44.72 45.25 3pch s GLY 357 CO 0.22 0.48 1.94 0.00 0.00 0.00 0.00 173.10 175.74 3pch h ALA 358 N -0.88 1.70 -0.27 3.20 0.00 -2.02 -2.67 119.26 118.32 3pch h ALA 358 Ca -0.44 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.32 3pch h ALA 358 Cb 1.22 -0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.73 3pch h ALA 358 CO 0.55 0.17 -0.17 0.72 0.00 0.00 0.00 179.25 180.51 3pch n HIS 359 N -4.49 0.84 0.16 0.00 8.25 -1.26 -4.75 115.22 113.97 3pch n HIS 359 Ca 0.12 -1.56 0.06 0.00 -0.26 0.00 0.00 57.72 56.08 3pch n HIS 359 Cb 0.26 -0.43 0.53 0.00 1.12 0.00 0.00 29.99 31.47 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 1.01 0.16 -0.33 0.41 5.19 -1.75 -1.97 116.42 119.13 3pch h ASP 360 Ca 0.17 -0.01 0.00 0.00 -0.62 0.00 0.00 57.03 56.57 3pch h ASP 360 Cb 1.50 -0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.97 3pch h ASP 360 CO 0.30 0.17 0.00 0.00 -3.12 0.00 0.00 179.24 176.58 3pch n HIS 361 N -4.46 0.43 -3.84 4.55 1.44 -1.15 -2.16 115.22 110.02 3pch n HIS 361 Ca -0.01 -0.26 -0.34 0.00 -2.01 0.00 0.00 57.72 55.10 3pch n HIS 361 Cb 0.12 -0.00 -0.12 0.00 0.12 0.00 0.00 29.99 30.11 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 -1.32 4.92 0.01 4.39 -1.08 -0.74 -1.94 116.67 120.91 3pch s ASP 362 Ca 0.33 -2.59 0.11 0.00 -0.52 0.00 0.00 52.55 49.88 3pch s ASP 362 Cb 0.19 -1.75 0.48 0.00 -1.46 0.00 0.00 42.92 40.38 3pch s ASP 362 CO 0.27 -0.38 1.36 0.18 0.52 0.00 0.00 175.17 177.12 3pch n LEU 363 N 3.78 0.02 0.04 -1.34 4.32 0.13 -0.78 117.00 123.17 3pch n LEU 363 Ca 0.04 0.51 -0.07 0.00 -0.02 0.00 0.00 56.01 56.47 3pch n LEU 363 Cb 0.38 -0.50 -0.12 0.00 -1.62 0.00 0.00 43.42 41.55 3pch n LEU 363 CO 0.32 -0.32 -0.03 -0.07 -1.22 0.00 0.00 177.39 176.06 3pch h LEU 364 N 0.00 0.00 0.00 2.23 4.07 -1.91 -3.40 115.31 116.30 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 0.19 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.93 3pch h LEU 364 CO 0.00 0.98 -1.39 0.18 -1.08 0.00 0.00 178.44 177.13 3pch n LEU 365 N -3.26 0.00 0.00 1.67 4.77 -0.52 -4.59 117.00 115.07 3pch n LEU 365 Ca -0.05 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.01 3pch n LEU 365 Cb 0.96 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.51 3pch n LEU 365 CO 0.46 0.00 0.71 -0.46 -1.33 0.00 0.00 177.39 176.77 3pch n ASN 366 N -1.80 0.00 0.11 -1.43 0.23 0.04 -5.05 115.26 107.36 3pch n ASN 366 Ca -0.02 -1.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.03 3pch n ASN 366 Cb 0.23 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 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 -0.82 -1.94 -0.22 -2.53 7.35 -1.26 -4.92 117.46 113.11 3pch n PHE 367 Ca 0.12 0.34 0.00 0.00 -0.76 0.00 0.00 57.45 57.15 3pch n PHE 367 Cb 0.05 0.56 0.00 0.00 0.35 0.00 0.00 39.48 40.45 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 1.53 0.00 3.84 7.13 0.00 -1.26 -4.10 105.19 112.33 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 1.08 0.00 0.00 0.00 173.32 174.40 3pch s LEU 372 N -1.58 4.21 0.62 0.99 1.02 -1.26 -4.84 118.68 117.85 3pch s LEU 372 Ca 0.00 0.39 -0.18 0.00 0.02 0.00 0.00 54.13 54.36 3pch s LEU 372 Cb 0.00 -2.06 -0.02 0.00 0.02 0.00 0.00 46.19 44.13 3pch s LEU 372 CO 0.00 0.39 1.18 -2.84 0.02 0.00 0.00 176.35 175.10 3pch s PRO 373 N -1.09 2.85 -0.08 1.29 0.02 -1.26 -4.80 135.00 131.93 3pch s PRO 373 Ca 0.16 1.73 -0.20 0.00 0.02 0.00 0.00 61.00 62.70 3pch s PRO 373 Cb -0.12 -1.93 -0.04 0.00 0.02 0.00 0.00 34.50 32.43 3pch s PRO 373 CO 0.05 -1.28 0.57 0.42 -0.33 0.00 0.00 177.00 176.44 3pch s ILE 374 N -1.79 5.10 0.00 2.83 1.01 -1.26 -4.99 121.20 122.11 3pch s ILE 374 Ca 0.75 1.17 0.00 0.00 0.00 0.00 0.00 60.65 62.57 3pch s ILE 374 Cb -0.28 -3.91 0.00 0.00 0.01 0.00 0.00 42.46 38.28 3pch s ILE 374 CO 0.36 0.31 0.00 0.61 0.00 0.00 0.00 174.94 176.22 3pch n GLY 375 N 3.10 2.29 3.63 6.18 0.00 -1.26 -4.41 105.19 114.71 3pch n GLY 375 Ca -0.05 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 43.98 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 -1.86 3.75 -0.03 1.61 2.02 -1.26 -4.90 118.70 118.03 3pch s GLU 376 Ca 0.00 1.55 -0.30 0.00 0.02 0.00 0.00 54.97 56.24 3pch s GLU 376 Cb 0.00 -4.03 -0.04 0.00 0.10 0.00 0.00 34.13 30.15 3pch s GLU 376 CO 0.00 -1.34 1.34 1.03 0.02 0.00 0.00 175.26 176.31 3pch s ARG 377 N 4.72 4.29 0.04 1.61 0.52 -1.26 -1.13 118.95 127.75 3pch s ARG 377 Ca 0.70 1.86 -0.04 0.00 -0.52 0.00 0.00 55.73 57.73 3pch s ARG 377 Cb -0.23 -3.60 -0.02 0.00 0.52 0.00 0.00 34.95 31.62 3pch s ARG 377 CO 0.29 -0.56 0.07 0.96 0.02 0.00 0.00 175.30 176.08 3pch s ILE 378 N 2.51 0.15 -0.14 1.52 -4.36 -0.03 -1.87 121.20 118.98 3pch s ILE 378 Ca 0.61 -1.22 -0.03 0.00 -0.26 0.00 0.00 60.65 59.75 3pch s ILE 378 Cb -0.29 -1.00 -0.03 0.00 1.25 0.00 0.00 42.46 42.39 3pch s ILE 378 CO 0.24 -0.67 -0.03 -0.63 0.24 0.00 0.00 174.94 174.09 3pch s ILE 379 N -2.88 3.99 -0.22 8.37 1.01 -0.18 -0.20 121.20 131.11 3pch s ILE 379 Ca -0.03 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.30 3pch s ILE 379 Cb 0.00 -2.73 0.03 0.00 0.01 0.00 0.00 42.46 39.78 3pch s ILE 379 CO -0.06 0.52 -0.15 -0.69 0.00 0.00 0.00 174.94 174.56 3pch s VAL 380 N 0.08 2.23 0.05 2.92 1.01 0.40 -1.07 120.40 126.02 3pch s VAL 380 Ca 0.00 -1.18 -0.01 0.00 0.00 0.00 0.00 61.98 60.79 3pch s VAL 380 Cb -0.13 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 3pch s VAL 380 CO 0.03 0.30 -0.03 0.00 0.00 0.00 0.00 175.10 175.40 3pch s ALA 381 N 1.23 0.50 0.00 5.51 0.00 -0.87 0.13 121.76 128.26 3pch s ALA 381 Ca -0.00 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.76 3pch s ALA 381 Cb -0.16 0.27 0.00 0.00 0.00 0.00 0.00 23.12 23.24 3pch s ALA 381 CO -0.09 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.71 3pch n GLY 382 N 0.11 -1.25 3.22 0.00 0.00 -1.03 -0.47 105.19 105.77 3pch n GLY 382 Ca -0.14 -0.95 -0.20 0.00 0.00 0.00 0.00 46.02 44.72 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 -0.76 0.94 -0.23 1.61 3.52 -1.25 -1.71 118.95 121.07 3pch s ARG 383 Ca 0.00 -1.04 -0.06 0.00 -0.13 0.00 0.00 55.73 54.50 3pch s ARG 383 Cb 0.00 -1.03 -0.02 0.00 -1.56 0.00 0.00 34.95 32.34 3pch s ARG 383 CO 0.00 0.23 0.02 0.08 -0.81 0.00 0.00 175.30 174.82 3pch s VAL 384 N -1.29 3.94 0.22 7.11 1.01 0.80 -0.60 120.40 131.60 3pch s VAL 384 Ca 0.02 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.74 3pch s VAL 384 Cb -0.10 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 3pch s VAL 384 CO 0.03 0.38 -0.03 0.68 0.00 0.00 0.00 175.10 176.16 3pch s VAL 385 N 1.47 1.15 0.54 2.92 -7.23 -0.25 -0.11 120.40 118.89 3pch s VAL 385 Ca 0.05 -2.05 0.08 0.00 -1.81 0.00 0.00 61.98 58.25 3pch s VAL 385 Cb -0.15 -2.28 0.07 0.00 0.56 0.00 0.00 36.38 34.58 3pch s VAL 385 CO 0.01 -0.39 0.75 1.51 -0.31 0.00 0.00 175.10 176.67 3pch s ASP 386 N -3.30 5.20 0.60 4.85 -4.77 0.17 -0.51 116.67 118.91 3pch s ASP 386 Ca 0.27 -0.67 0.31 0.00 -3.30 0.00 0.00 52.55 49.16 3pch s ASP 386 Cb 0.05 -0.02 1.84 0.00 -1.09 0.00 0.00 42.92 43.70 3pch s ASP 386 CO 0.08 -1.22 2.20 1.56 0.70 0.00 0.00 175.17 178.49 3pch h GLN 387 N 0.24 0.00 -0.01 2.11 4.20 -1.42 0.25 115.11 120.49 3pch h GLN 387 Ca -0.33 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.38 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 0.42 0.00 -0.03 0.66 -0.67 0.00 0.00 178.83 179.22 3pch n TYR 388 N -3.68 0.00 -0.78 2.96 4.01 -1.26 -4.90 117.16 113.51 3pch n TYR 388 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3pch n TYR 388 Cb 0.18 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 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 1.14 0.60 3.73 2.72 0.00 0.89 -5.03 105.19 109.23 3pch n GLY 389 Ca 0.20 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.42 4.42 0.60 1.61 2.20 -1.25 -4.76 119.74 122.13 3pch s LYS 390 Ca 0.00 0.84 -0.20 0.00 -0.36 0.00 0.00 55.97 56.25 3pch s LYS 390 Cb 0.00 -3.42 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 3pch s LYS 390 CO 0.00 0.15 1.26 -2.30 -0.36 0.00 0.00 175.35 174.10 3pch n PRO 391 N 3.47 1.30 -3.74 4.03 -0.02 -1.26 -0.66 135.00 138.12 3pch n PRO 391 Ca -0.03 0.49 -0.36 0.00 -2.02 0.00 0.00 63.50 61.59 3pch n PRO 391 Cb 0.51 -2.48 -0.10 0.00 -0.02 0.00 0.00 33.50 31.41 3pch n PRO 391 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3pch s VAL 392 N -1.37 3.56 0.49 -1.45 1.01 0.84 -4.82 120.40 118.67 3pch s VAL 392 Ca 0.77 -2.85 -0.15 0.00 0.00 0.00 0.00 61.98 59.76 3pch s VAL 392 Cb -0.40 -3.35 -0.07 0.00 0.00 0.00 0.00 36.38 32.55 3pch s VAL 392 CO 0.45 -0.84 0.94 -2.16 0.00 0.00 0.00 175.10 173.48 3pch s PRO 393 N 0.11 3.90 -1.55 2.72 0.04 -1.26 -4.27 135.00 134.68 3pch s PRO 393 Ca 0.16 0.84 -0.09 0.00 0.04 0.00 0.00 61.00 61.95 3pch s PRO 393 Cb -0.21 -2.19 0.07 0.00 0.04 0.00 0.00 34.50 32.21 3pch s PRO 393 CO -0.03 -0.22 0.58 0.09 0.04 0.00 0.00 177.00 177.45 3pch n ASN 394 N -1.53 -1.72 -4.64 6.66 4.13 0.09 -4.93 115.26 113.31 3pch n ASN 394 Ca 0.06 -1.02 -0.31 0.00 1.68 0.00 0.00 54.58 54.99 3pch n ASN 394 Cb 0.54 -2.86 -0.09 0.00 -1.54 0.00 0.00 39.78 35.83 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 -3.66 3.82 -0.15 3.41 -1.32 -1.26 -4.51 115.64 111.97 3pch s THR 395 Ca 0.36 -0.89 -0.22 0.00 -1.21 0.00 0.00 61.69 59.72 3pch s THR 395 Cb -0.19 -2.75 -0.03 0.00 -1.51 0.00 0.00 72.50 68.02 3pch s THR 395 CO 0.91 0.25 0.69 -0.22 -2.21 0.00 0.00 174.62 174.04 3pch s LEU 396 N -1.87 4.21 -0.19 9.08 2.96 -1.26 -0.47 118.68 131.14 3pch s LEU 396 Ca 0.21 1.01 0.01 0.00 -0.22 0.00 0.00 54.13 55.14 3pch s LEU 396 Cb -0.11 -3.01 0.03 0.00 0.50 0.00 0.00 46.19 43.60 3pch s LEU 396 CO 0.13 -0.24 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.10 3pch s VAL 397 N 1.56 1.76 0.12 1.68 1.01 0.09 -1.40 120.40 125.23 3pch s VAL 397 Ca 0.33 -0.97 0.10 0.00 0.00 0.00 0.00 61.98 61.44 3pch s VAL 397 Cb -0.16 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.43 3pch s VAL 397 CO 0.13 0.29 -0.23 -1.61 0.00 0.00 0.00 175.10 173.68 3pch s GLU 398 N 1.37 1.59 -0.01 2.72 2.02 -0.43 -0.22 118.70 125.74 3pch s GLU 398 Ca 0.01 -1.26 -0.12 0.00 0.02 0.00 0.00 54.97 53.62 3pch s GLU 398 Cb -0.15 -2.00 0.01 0.00 0.10 0.00 0.00 34.13 32.09 3pch s GLU 398 CO -0.09 0.47 0.24 0.00 0.02 0.00 0.00 175.26 175.90 3pch s MET 399 N -2.06 0.60 0.02 1.61 0.23 0.05 -0.70 119.30 119.05 3pch s MET 399 Ca 0.16 -0.28 -0.09 0.00 -1.03 0.00 0.00 55.69 54.45 3pch s MET 399 Cb -0.10 0.26 0.00 0.00 -1.53 0.00 0.00 34.83 33.46 3pch s MET 399 CO 0.08 -0.16 0.17 1.67 -2.03 0.00 0.00 175.02 174.75 3pch s TRP 400 N -1.38 0.06 0.10 3.16 -2.14 -0.72 -0.82 118.94 117.19 3pch s TRP 400 Ca -0.14 -0.23 -0.26 0.00 2.66 0.00 0.00 56.10 58.13 3pch s TRP 400 Cb -0.06 -0.04 0.08 0.00 -3.10 0.00 0.00 33.47 30.34 3pch s TRP 400 CO 0.03 -0.37 0.99 1.14 -2.66 0.00 0.00 176.95 176.08 3pch s GLN 401 N -2.11 1.02 1.01 3.25 -2.07 -0.48 -0.44 119.66 119.84 3pch s GLN 401 Ca -0.09 -0.54 -0.16 0.00 -1.82 0.00 0.00 55.36 52.75 3pch s GLN 401 Cb -0.03 0.36 0.20 0.00 -1.09 0.00 0.00 33.01 32.45 3pch s GLN 401 CO -0.02 -0.47 1.22 0.00 -1.32 0.00 0.00 175.29 174.71 3pch s ALA 402 N -3.14 1.73 0.76 2.60 0.00 -1.26 -4.56 121.76 117.89 3pch s ALA 402 Ca 0.11 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 51.10 3pch s ALA 402 Cb -0.01 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.25 3pch s ALA 402 CO -0.00 -2.68 0.00 0.27 0.00 0.00 0.00 175.76 173.35 3pch n ASN 403 N -4.01 0.00 0.29 0.00 0.23 0.45 -4.55 115.26 107.67 3pch n ASN 403 Ca 0.13 -0.87 0.14 0.00 -0.53 0.00 0.00 54.58 53.44 3pch n ASN 403 Cb 0.60 0.00 0.86 0.00 -2.08 0.00 0.00 39.78 39.16 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 -1.44 1.59 -0.02 -2.53 0.00 -1.77 -1.72 119.26 113.37 3pch h ALA 404 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3pch h ALA 404 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3pch h ALA 404 CO 0.00 0.01 -0.16 0.41 0.00 0.00 0.00 179.25 179.51 3pch n GLY 405 N -1.32 0.18 0.81 0.00 0.00 -1.26 -3.29 105.19 100.30 3pch n GLY 405 Ca -0.03 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.44 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 1.32 0.79 3.69 -0.02 0.00 -0.78 -4.77 105.19 105.42 3pch n GLY 406 Ca 0.14 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.62 4.28 0.04 1.61 6.06 -1.26 -4.75 118.95 124.31 3pch s ARG 407 Ca 0.00 0.48 -0.09 0.00 -2.50 0.00 0.00 55.73 53.63 3pch s ARG 407 Cb 0.00 -3.49 -0.05 0.00 0.06 0.00 0.00 34.95 31.46 3pch s ARG 407 CO 0.00 0.01 0.34 0.71 -2.50 0.00 0.00 175.30 173.85 3pch s TYR 408 N 1.11 3.59 -1.21 5.12 2.02 -1.26 -0.41 117.35 126.32 3pch s TYR 408 Ca 0.26 0.71 -0.11 0.00 -0.37 0.00 0.00 57.07 57.56 3pch s TYR 408 Cb -0.15 -2.09 0.19 0.00 -0.40 0.00 0.00 41.96 39.51 3pch s TYR 408 CO 0.11 0.57 1.51 -2.13 -1.57 0.00 0.00 175.55 174.04 3pch n ARG 409 N 1.10 3.54 -3.73 -0.62 0.63 -1.26 -4.74 116.66 111.57 3pch n ARG 409 Ca -0.10 -3.90 -0.13 0.00 -0.92 0.00 0.00 57.85 52.80 3pch n ARG 409 Cb 0.53 -2.91 -0.10 0.00 0.45 0.00 0.00 32.46 30.42 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 0.58 -0.45 0.39 -0.14 2.46 -1.26 -5.05 115.29 111.82 3pch s HIS 410 Ca 0.40 1.07 0.14 0.00 0.47 0.00 0.00 55.06 57.15 3pch s HIS 410 Cb -0.00 0.16 0.99 0.00 -0.13 0.00 0.00 32.58 33.60 3pch s HIS 410 CO -0.00 -0.23 1.84 1.57 -2.47 0.00 0.00 174.74 175.45 3pch h LYS 411 N 5.81 0.49 0.00 2.88 2.10 -2.07 -1.91 116.57 123.87 3pch h LYS 411 Ca -0.29 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 3pch h LYS 411 Cb 1.18 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.40 3pch h LYS 411 CO 0.27 0.33 0.00 0.09 -2.00 0.00 0.00 179.45 178.14 3pch n ASN 412 N -4.56 0.06 -4.57 7.07 5.03 -1.26 -4.77 115.26 112.26 3pch n ASN 412 Ca 0.20 0.51 -0.43 0.00 0.87 0.00 0.00 54.58 55.73 3pch n ASN 412 Cb 0.65 -0.52 -0.04 0.00 -1.02 0.00 0.00 39.78 38.85 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 -3.12 6.53 0.00 6.41 2.15 -0.72 -4.88 116.67 123.04 3pch s ASP 413 Ca 0.12 0.22 0.17 0.00 0.43 0.00 0.00 52.55 53.50 3pch s ASP 413 Cb 0.16 -2.44 0.25 0.00 -0.30 0.00 0.00 42.92 40.59 3pch s ASP 413 CO 0.47 -0.95 1.17 0.54 -0.17 0.00 0.00 175.17 176.23 3pch n ARG 414 N 6.94 1.88 -1.60 4.34 3.00 -1.26 -4.90 116.66 125.05 3pch n ARG 414 Ca 0.06 -1.81 -0.43 0.00 -0.01 0.00 0.00 57.85 55.66 3pch n ARG 414 Cb 0.48 -1.37 0.00 0.00 0.00 0.00 0.00 32.46 31.58 3pch n ARG 414 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61 3pch n TYR 415 N 1.03 1.15 0.28 -1.55 9.36 -1.26 -4.87 117.16 121.30 3pch n TYR 415 Ca 0.13 0.61 0.17 0.00 3.32 0.00 0.00 57.90 62.14 3pch n TYR 415 Cb 0.47 -2.23 0.79 0.00 -0.63 0.00 0.00 39.34 37.74 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 1.70 0.00 -9.84 2.98 -0.00 -1.99 -3.44 115.31 104.72 3pch h LEU 416 Ca -0.42 0.00 -0.53 0.00 -0.00 0.00 0.00 57.88 56.93 3pch h LEU 416 Cb 1.34 0.00 0.08 0.00 -0.00 0.00 0.00 40.66 42.08 3pch h LEU 416 CO 0.58 0.03 0.76 0.00 -0.00 0.00 0.00 178.44 179.81 3pch s ALA 417 N -3.82 3.60 0.83 0.17 0.00 -1.26 -4.95 121.76 116.33 3pch s ALA 417 Ca -0.01 1.42 -0.11 0.00 0.00 0.00 0.00 51.96 53.27 3pch s ALA 417 Cb 0.10 -3.57 0.09 0.00 0.00 0.00 0.00 23.12 19.74 3pch s ALA 417 CO 0.53 -0.84 1.09 -1.25 0.00 0.00 0.00 175.76 175.29 3pch s PRO 418 N -1.21 1.82 0.60 0.00 0.04 -1.26 -4.72 135.00 130.28 3pch s PRO 418 Ca 0.56 1.04 -0.11 0.00 0.04 0.00 0.00 61.00 62.52 3pch s PRO 418 Cb -0.44 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 3pch s PRO 418 CO 0.52 -1.91 1.01 -0.51 0.04 0.00 0.00 177.00 176.15 3pch s LEU 419 N -6.06 3.29 -0.28 -3.56 1.43 -1.26 -4.73 118.68 107.50 3pch s LEU 419 Ca 0.62 1.42 -0.07 0.00 -1.03 0.00 0.00 54.13 55.07 3pch s LEU 419 Cb -0.18 -4.45 -0.01 0.00 0.03 0.00 0.00 46.19 41.59 3pch s LEU 419 CO 0.56 -0.83 0.09 -0.62 0.23 0.00 0.00 176.35 175.79 3pch s ASP 420 N -4.05 5.18 0.56 2.29 -1.08 -1.26 -4.98 116.67 113.33 3pch s ASP 420 Ca 0.55 -0.51 0.29 0.00 -0.52 0.00 0.00 52.55 52.36 3pch s ASP 420 Cb -0.11 -1.91 1.46 0.00 -1.46 0.00 0.00 42.92 40.90 3pch s ASP 420 CO 0.51 -0.14 1.92 1.55 0.52 0.00 0.00 175.17 179.53 3pch h PRO 421 N 8.26 0.00 -0.69 4.34 0.13 -1.96 0.34 132.00 142.42 3pch h PRO 421 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3pch h PRO 421 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 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 -4.08 3.89 -4.03 1.44 4.13 -1.26 -4.93 115.26 110.43 3pch n ASN 422 Ca 0.13 -2.00 -0.26 0.00 1.68 0.00 0.00 54.58 54.12 3pch n ASN 422 Cb 0.77 -0.46 -0.17 0.00 -1.54 0.00 0.00 39.78 38.39 3pch n ASN 422 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 3pch s PHE 423 N -1.09 1.67 -0.10 3.10 5.36 0.11 -4.35 117.98 122.67 3pch s PHE 423 Ca 0.48 -0.70 -0.07 0.00 -0.96 0.00 0.00 56.93 55.68 3pch s PHE 423 Cb 0.25 -1.23 -0.02 0.00 -0.34 0.00 0.00 43.02 41.68 3pch s PHE 423 CO 0.33 -0.38 -0.13 0.41 -1.46 0.00 0.00 175.22 174.00 3pch n GLY 424 N 4.07 -0.84 0.00 13.12 0.00 -1.26 -4.65 105.19 115.63 3pch n GLY 424 Ca -0.20 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.69 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 1.65 1.39 3.10 -0.02 0.00 -1.26 -4.48 105.19 105.57 3pch n GLY 425 Ca -0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 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 1.06 0.12 1.61 1.01 -1.26 -1.39 120.40 119.55 3pch s VAL 426 Ca 0.00 -0.62 -0.12 0.00 0.00 0.00 0.00 61.98 61.23 3pch s VAL 426 Cb 0.00 -0.89 0.01 0.00 0.00 0.00 0.00 36.38 35.50 3pch s VAL 426 CO 0.00 0.26 0.32 -0.83 0.00 0.00 0.00 175.10 174.85 3pch s GLY 427 N -0.41 -0.01 -0.09 4.51 0.00 -0.00 -4.78 107.32 106.54 3pch s GLY 427 Ca 0.05 -0.40 -0.21 0.00 0.00 0.00 0.00 44.72 44.15 3pch s GLY 427 CO -0.00 -0.57 0.50 1.09 0.00 0.00 0.00 173.10 174.12 3pch s ARG 428 N -3.86 0.77 -0.22 2.90 1.70 -0.92 -0.77 118.95 118.57 3pch s ARG 428 Ca 0.06 0.28 -0.22 0.00 -0.47 0.00 0.00 55.73 55.38 3pch s ARG 428 Cb 0.03 0.36 0.06 0.00 -0.57 0.00 0.00 34.95 34.83 3pch s ARG 428 CO -0.09 -0.19 0.63 0.00 -1.08 0.00 0.00 175.30 174.57 3pch s LEU 430 N 0.17 4.13 0.54 0.00 2.96 -1.26 -0.73 118.68 124.49 3pch s LEU 430 Ca -0.01 0.18 -0.21 0.00 -0.22 0.00 0.00 54.13 53.87 3pch s LEU 430 Cb -0.04 -2.16 -0.05 0.00 0.50 0.00 0.00 46.19 44.44 3pch s LEU 430 CO 0.02 0.06 1.29 0.42 -1.32 0.00 0.00 176.35 176.82 3pch s THR 431 N 1.00 2.38 0.20 3.68 -4.23 0.38 -4.86 115.64 114.20 3pch s THR 431 Ca 0.09 0.28 -0.03 0.00 -1.18 0.00 0.00 61.69 60.85 3pch s THR 431 Cb -0.13 -3.14 0.05 0.00 1.34 0.00 0.00 72.50 70.62 3pch s THR 431 CO 0.04 -0.01 0.27 -0.90 -0.54 0.00 0.00 174.62 173.48 3pch n ASP 432 N -1.02 0.02 0.02 3.99 5.68 -0.59 -0.73 116.55 123.92 3pch n ASP 432 Ca 0.10 -1.10 0.18 0.00 -0.50 0.00 0.00 54.79 53.47 3pch n ASP 432 Cb 0.46 -0.21 0.66 0.00 -1.14 0.00 0.00 41.12 40.89 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 -0.36 0.05 -0.25 -1.12 0.02 -1.95 -1.84 113.55 108.11 3pch h SER 433 Ca -0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.86 3pch h SER 433 Cb 0.24 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.78 3pch h SER 433 CO 0.06 0.03 0.00 0.47 -1.14 0.00 0.00 176.83 176.25 3pch n ASP 434 N -4.41 2.87 0.00 3.07 8.00 -1.26 -4.64 116.55 120.18 3pch n ASP 434 Ca 0.08 -1.91 0.00 0.00 0.71 0.00 0.00 54.79 53.68 3pch n ASP 434 Cb 0.51 -0.16 0.00 0.00 -0.02 0.00 0.00 41.12 41.46 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 1.38 0.68 3.79 0.44 0.00 -0.69 -4.70 105.19 106.08 3pch n GLY 435 Ca 0.18 -0.03 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.00 3.83 0.07 1.61 2.02 -1.26 -0.14 117.35 121.48 3pch s TYR 436 Ca 0.00 1.58 0.00 0.00 -0.37 0.00 0.00 57.07 58.28 3pch s TYR 436 Cb 0.00 -2.74 -0.04 0.00 -0.40 0.00 0.00 41.96 38.78 3pch s TYR 436 CO 0.00 0.45 -0.05 1.52 -1.57 0.00 0.00 175.55 175.90 3pch s TYR 437 N -1.28 0.71 -0.16 2.71 -0.85 -0.69 -1.54 117.35 116.25 3pch s TYR 437 Ca 0.38 -0.99 -0.28 0.00 -0.52 0.00 0.00 57.07 55.66 3pch s TYR 437 Cb -0.21 -0.45 0.08 0.00 0.38 0.00 0.00 41.96 41.76 3pch s TYR 437 CO 0.25 -0.26 0.77 -1.54 -1.52 0.00 0.00 175.55 173.24 3pch s SER 438 N -2.98 -0.63 0.08 -0.18 1.04 -1.26 -2.45 113.70 107.31 3pch s SER 438 Ca 0.09 0.93 0.05 0.00 0.48 0.00 0.00 55.95 57.51 3pch s SER 438 Cb 0.07 0.85 -0.03 0.00 0.10 0.00 0.00 66.02 67.00 3pch s SER 438 CO -0.07 -0.41 -0.13 -0.36 0.98 0.00 0.00 173.24 173.24 3pch s PHE 439 N -0.52 1.18 -0.12 5.02 0.08 0.12 -4.87 117.98 118.87 3pch s PHE 439 Ca -0.05 -0.50 0.02 0.00 0.12 0.00 0.00 56.93 56.52 3pch s PHE 439 Cb -0.02 -0.66 0.01 0.00 -0.57 0.00 0.00 43.02 41.78 3pch s PHE 439 CO 0.04 0.05 -0.18 0.50 -0.10 0.00 0.00 175.22 175.54 3pch s ARG 440 N -1.97 2.51 0.00 0.44 3.52 -0.82 -0.45 118.95 122.19 3pch s ARG 440 Ca -0.00 -0.67 0.00 0.00 -0.13 0.00 0.00 55.73 54.93 3pch s ARG 440 Cb -0.09 -2.08 0.00 0.00 -1.56 0.00 0.00 34.95 31.22 3pch s ARG 440 CO 0.02 -0.04 0.00 -2.37 -0.81 0.00 0.00 175.30 172.10 3pch n THR 441 N 4.14 0.00 -4.97 4.11 5.66 0.72 0.22 114.28 124.16 3pch n THR 441 Ca -0.19 0.00 -0.28 0.00 -3.05 0.00 0.00 64.05 60.52 3pch n THR 441 Cb 0.51 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.14 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 -2.86 1.83 0.01 1.09 -5.25 -1.26 -0.85 121.20 113.91 3pch s ILE 442 Ca 0.00 -1.11 -0.30 0.00 -0.99 0.00 0.00 60.65 58.25 3pch s ILE 442 Cb 0.00 -1.54 -0.07 0.00 2.95 0.00 0.00 42.46 43.79 3pch s ILE 442 CO 0.00 0.41 1.71 -0.75 -1.79 0.00 0.00 174.94 174.52 3pch s LYS 443 N -0.82 4.18 0.68 0.37 2.20 -0.28 -4.91 119.74 121.15 3pch s LYS 443 Ca 0.09 2.32 -0.13 0.00 -0.36 0.00 0.00 55.97 57.89 3pch s LYS 443 Cb -0.09 -3.87 0.01 0.00 -1.51 0.00 0.00 37.83 32.37 3pch s LYS 443 CO 0.00 -0.82 1.09 -1.25 -0.36 0.00 0.00 175.35 174.01 3pch s PRO 444 N 3.58 2.82 0.22 4.03 0.04 -1.26 -4.38 135.00 140.05 3pch s PRO 444 Ca 0.76 1.23 -0.05 0.00 0.04 0.00 0.00 61.00 62.99 3pch s PRO 444 Cb -0.37 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.15 3pch s PRO 444 CO 0.33 -1.22 0.47 0.20 0.04 0.00 0.00 177.00 176.82 3pch s GLY 445 N -3.00 2.01 0.95 0.56 0.00 -0.72 -4.67 107.32 102.46 3pch s GLY 445 Ca 0.63 -0.57 -0.12 0.00 0.00 0.00 0.00 44.72 44.66 3pch s GLY 445 CO 0.46 -0.48 1.09 2.56 0.00 0.00 0.00 173.10 176.73 3pch s PRO 446 N -3.14 0.85 -0.12 2.90 0.04 -1.26 -4.03 135.00 130.25 3pch s PRO 446 Ca 0.43 0.70 -0.23 0.00 0.04 0.00 0.00 61.00 61.94 3pch s PRO 446 Cb -0.11 -1.77 0.06 0.00 0.04 0.00 0.00 34.50 32.71 3pch s PRO 446 CO 0.27 -2.49 0.57 1.52 0.04 0.00 0.00 177.00 176.91 3pch s TYR 447 N -2.93 -0.56 0.45 0.56 -0.85 -1.05 -4.14 117.35 108.84 3pch s TYR 447 Ca 0.64 1.16 -0.23 0.00 -0.52 0.00 0.00 57.07 58.13 3pch s TYR 447 Cb -0.18 0.27 -0.08 0.00 0.38 0.00 0.00 41.96 42.34 3pch s TYR 447 CO 0.57 -0.44 1.13 -1.25 -1.52 0.00 0.00 175.55 174.05 3pch s PRO 448 N -0.55 3.83 0.04 -3.49 0.04 -1.26 -0.16 135.00 133.45 3pch s PRO 448 Ca -0.07 1.68 -0.08 0.00 0.04 0.00 0.00 61.00 62.57 3pch s PRO 448 Cb -0.03 -2.39 -0.00 0.00 0.04 0.00 0.00 34.50 32.12 3pch s PRO 448 CO 0.05 -0.47 0.15 1.67 0.04 0.00 0.00 177.00 178.44 3pch s TRP 449 N -1.62 0.13 -1.33 0.56 1.48 -0.92 -4.90 118.94 112.35 3pch s TRP 449 Ca 0.63 -0.41 -0.17 0.00 -1.06 0.00 0.00 56.10 55.09 3pch s TRP 449 Cb -0.26 -0.08 0.02 0.00 -1.16 0.00 0.00 33.47 31.99 3pch s TRP 449 CO 0.31 -0.41 2.02 0.54 -4.06 0.00 0.00 176.95 175.35 3pch n ARG 450 N 0.63 2.77 0.00 3.25 1.74 -1.26 -4.33 116.66 119.46 3pch n ARG 450 Ca -0.18 -2.76 0.00 0.00 -0.77 0.00 0.00 57.85 54.14 3pch n ARG 450 Cb 0.59 -3.35 0.00 0.00 -1.02 0.00 0.00 32.46 28.68 3pch n ARG 450 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3pch n ASN 451 N 7.49 0.00 -4.04 0.55 5.15 -1.26 -5.03 115.26 118.13 3pch n ASN 451 Ca 0.50 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 54.18 3pch n ASN 451 Cb 0.42 0.00 0.20 0.00 -0.53 0.00 0.00 39.78 39.87 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 0.00 1.81 0.51 8.20 0.00 -1.26 -4.96 107.32 111.62 3pch s GLY 452 Ca 0.00 -1.27 0.33 0.00 0.00 0.00 0.00 44.72 43.78 3pch s GLY 452 CO 0.00 -0.47 1.99 -2.55 0.00 0.00 0.00 173.10 172.07 3pch h PRO 453 N -1.72 0.00 -1.24 2.90 0.11 -1.97 -3.28 132.00 126.80 3pch h PRO 453 Ca -0.44 0.00 -0.39 0.00 0.11 0.00 0.00 66.00 65.28 3pch h PRO 453 Cb 1.22 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.93 3pch h PRO 453 CO 0.34 0.00 -1.19 -1.71 -0.21 0.00 0.00 178.00 175.23 3pch n ASN 454 N -2.92 1.26 -4.80 -2.05 5.15 -1.26 -5.10 115.26 105.54 3pch n ASN 454 Ca 0.00 -2.78 -0.38 0.00 -0.60 0.00 0.00 54.58 50.81 3pch n ASN 454 Cb 0.25 -0.54 -0.06 0.00 -0.53 0.00 0.00 39.78 38.90 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 -2.94 6.94 -0.07 1.20 1.01 -1.24 -5.07 116.67 116.51 3pch s ASP 455 Ca 0.30 1.12 -0.01 0.00 0.71 0.00 0.00 52.55 54.67 3pch s ASP 455 Cb 0.43 -2.32 0.03 0.00 1.01 0.00 0.00 42.92 42.07 3pch s ASP 455 CO 0.01 0.24 -0.00 0.26 0.21 0.00 0.00 175.17 175.88 3pch s TRP 456 N -0.80 0.67 0.24 4.23 0.52 -1.26 -2.16 118.94 120.39 3pch s TRP 456 Ca 0.27 -0.17 -0.30 0.00 0.02 0.00 0.00 56.10 55.92 3pch s TRP 456 Cb -0.18 -0.78 -0.09 0.00 -1.15 0.00 0.00 33.47 31.27 3pch s TRP 456 CO 0.16 -0.31 1.19 1.03 0.02 0.00 0.00 176.95 179.05 3pch s ARG 457 N 1.81 4.51 0.72 4.98 1.81 0.77 -4.77 118.95 128.79 3pch s ARG 457 Ca 0.03 1.93 -0.14 0.00 -1.72 0.00 0.00 55.73 55.82 3pch s ARG 457 Cb -0.13 -3.19 0.03 0.00 -0.45 0.00 0.00 34.95 31.22 3pch s ARG 457 CO -0.05 -0.02 1.15 -2.14 -0.68 0.00 0.00 175.30 173.57 3pch s PRO 458 N -0.90 2.33 0.20 3.54 0.02 -1.26 -2.51 135.00 136.42 3pch s PRO 458 Ca 0.50 1.54 -0.32 0.00 0.02 0.00 0.00 61.00 62.74 3pch s PRO 458 Cb -0.34 -1.88 -0.14 0.00 0.02 0.00 0.00 34.50 32.16 3pch s PRO 458 CO 0.41 -1.64 1.29 0.00 -0.33 0.00 0.00 177.00 176.73 3pch n ALA 459 N -2.79 0.21 -3.12 -1.55 0.00 -1.26 -4.74 120.51 107.26 3pch n ALA 459 Ca 0.12 0.44 -0.11 0.00 0.00 0.00 0.00 53.44 53.88 3pch n ALA 459 Cb 0.51 -2.16 -0.04 0.00 0.00 0.00 0.00 19.45 17.76 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 -0.10 -0.29 -0.13 0.00 -3.43 -1.26 -4.02 115.29 106.05 3pch s HIS 460 Ca 0.71 0.04 0.02 0.00 -0.80 0.00 0.00 55.06 55.03 3pch s HIS 460 Cb -0.75 0.32 0.01 0.00 -1.43 0.00 0.00 32.58 30.74 3pch s HIS 460 CO 0.51 -0.72 -0.19 0.42 -2.00 0.00 0.00 174.74 172.76 3pch s ILE 461 N -3.60 1.85 0.24 -5.38 1.01 -0.67 -4.61 121.20 110.05 3pch s ILE 461 Ca 0.01 -0.85 -0.30 0.00 0.00 0.00 0.00 60.65 59.52 3pch s ILE 461 Cb 0.01 -1.66 -0.09 0.00 0.01 0.00 0.00 42.46 40.73 3pch s ILE 461 CO -0.11 0.51 1.01 -1.00 0.00 0.00 0.00 174.94 175.35 3pch s HIS 462 N 0.95 3.80 0.05 3.97 3.76 0.42 -1.25 115.29 126.98 3pch s HIS 462 Ca -0.05 1.81 0.04 0.00 -0.15 0.00 0.00 55.06 56.71 3pch s HIS 462 Cb -0.15 -3.12 -0.02 0.00 1.11 0.00 0.00 32.58 30.40 3pch s HIS 462 CO -0.03 -0.01 -0.13 -0.06 -0.85 0.00 0.00 174.74 173.66 3pch s PHE 463 N -1.02 1.13 -0.03 1.40 0.40 -0.43 -1.76 117.98 117.67 3pch s PHE 463 Ca 0.43 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.39 3pch s PHE 463 Cb -0.28 -0.66 0.01 0.00 0.51 0.00 0.00 43.02 42.60 3pch s PHE 463 CO 0.35 0.03 -0.05 0.20 0.70 0.00 0.00 175.22 176.45 3pch s GLY 464 N -1.31 0.40 -0.04 4.36 0.00 0.12 -0.32 107.32 110.52 3pch s GLY 464 Ca -0.01 -0.14 0.01 0.00 0.00 0.00 0.00 44.72 44.59 3pch s GLY 464 CO 0.01 0.17 -0.06 -0.42 0.00 0.00 0.00 173.10 172.81 3pch s ILE 465 N 0.49 0.64 -0.11 0.90 1.09 0.58 -1.31 121.20 123.49 3pch s ILE 465 Ca -0.06 -0.20 -0.05 0.00 -1.10 0.00 0.00 60.65 59.23 3pch s ILE 465 Cb -0.10 -0.63 -0.04 0.00 -1.06 0.00 0.00 42.46 40.63 3pch s ILE 465 CO 0.00 0.24 0.13 0.77 -0.10 0.00 0.00 174.94 175.98 3pch h SER 466 N 6.98 -0.00 -4.04 3.58 4.64 -1.53 0.13 113.55 123.31 3pch h SER 466 Ca -0.36 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 60.79 3pch h SER 466 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 3pch h SER 466 CO 0.48 0.58 0.00 0.61 -0.87 0.00 0.00 176.83 177.63 3pch n GLY 467 N 1.74 -2.33 0.00 -0.77 0.00 -1.26 -2.50 105.19 100.07 3pch n GLY 467 Ca -0.02 -1.55 0.09 0.00 0.00 0.00 0.00 46.02 44.54 3pch n GLY 467 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3pch n PRO 468 N -0.85 0.02 -3.95 1.61 -0.04 -1.26 -4.87 135.00 125.66 3pch n PRO 468 Ca 0.00 0.17 -0.09 0.00 -0.04 0.00 0.00 63.50 63.54 3pch n PRO 468 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 3pch n PRO 468 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3pch s SER 469 N -2.97 0.04 0.43 3.54 1.04 -1.26 -3.68 113.70 110.84 3pch s SER 469 Ca 0.10 -0.97 0.22 0.00 0.48 0.00 0.00 55.95 55.77 3pch s SER 469 Cb 0.12 0.68 0.93 0.00 0.10 0.00 0.00 66.02 67.85 3pch s SER 469 CO 0.34 -1.31 1.84 0.16 0.98 0.00 0.00 173.24 175.25 3pch h ILE 470 N 2.13 0.73 -0.01 -1.02 3.07 -1.30 -2.13 117.51 118.98 3pch h ILE 470 Ca -0.26 -1.15 -0.07 0.00 1.55 0.00 0.00 64.86 64.93 3pch h ILE 470 Cb 1.25 1.73 -0.01 0.00 -0.27 0.00 0.00 36.82 39.52 3pch h ILE 470 CO 0.34 0.26 -0.33 0.00 -1.05 0.00 0.00 178.15 177.37 3pch h ALA 471 N 1.73 1.44 0.00 0.16 0.00 -1.77 -2.88 119.26 117.94 3pch h ALA 471 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3pch h ALA 471 Cb 0.71 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.44 3pch h ALA 471 CO 0.03 0.42 -1.13 0.25 0.00 0.00 0.00 179.25 178.83 3pch n THR 472 N -4.14 0.44 -1.65 0.00 -2.24 -1.02 -4.94 114.28 100.73 3pch n THR 472 Ca -0.02 -0.47 -0.45 0.00 -2.27 0.00 0.00 64.05 60.84 3pch n THR 472 Cb 0.38 -0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.39 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 -2.46 1.81 -3.81 -0.78 3.00 -0.83 -4.75 118.16 110.33 3pch n LYS 473 Ca -0.00 0.64 -0.12 0.00 -0.00 0.00 0.00 58.31 58.82 3pch n LYS 473 Cb 0.53 -2.19 -0.10 0.00 0.00 0.00 0.00 35.03 33.26 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 -0.07 1.15 -0.08 3.14 2.96 0.46 -5.01 118.68 121.23 3pch s LEU 474 Ca 0.63 0.12 0.03 0.00 -0.22 0.00 0.00 54.13 54.69 3pch s LEU 474 Cb -0.66 0.94 0.01 0.00 0.50 0.00 0.00 46.19 46.97 3pch s LEU 474 CO 0.56 -0.31 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.47 3pch s ILE 475 N -0.88 1.62 0.10 6.68 1.01 -1.26 -0.31 121.20 128.16 3pch s ILE 475 Ca -0.10 -0.76 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 3pch s ILE 475 Cb -0.05 -1.42 0.00 0.00 0.01 0.00 0.00 42.46 41.00 3pch s ILE 475 CO 0.02 0.46 0.14 1.07 0.00 0.00 0.00 174.94 176.64 3pch n THR 476 N 3.66 0.00 -4.09 2.92 5.66 0.56 -5.00 114.28 117.99 3pch n THR 476 Ca -0.21 -0.50 -0.14 0.00 -3.05 0.00 0.00 64.05 60.15 3pch n THR 476 Cb 0.52 0.31 -0.14 0.00 -1.55 0.00 0.00 70.33 69.48 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 -2.22 0.38 -0.18 1.09 -0.21 -1.26 -1.31 119.66 115.95 3pch s GLN 477 Ca 0.08 -0.30 -0.09 0.00 0.02 0.00 0.00 55.36 55.07 3pch s GLN 477 Cb -0.00 -0.30 -0.05 0.00 1.00 0.00 0.00 33.01 33.66 3pch s GLN 477 CO 0.06 0.07 0.12 -1.17 -2.12 0.00 0.00 175.29 172.25 3pch s LEU 478 N -0.48 4.18 0.25 2.90 0.20 -0.38 -4.80 118.68 120.55 3pch s LEU 478 Ca -0.02 0.25 0.10 0.00 0.69 0.00 0.00 54.13 55.15 3pch s LEU 478 Cb -0.04 -2.07 -0.04 0.00 -0.43 0.00 0.00 46.19 43.61 3pch s LEU 478 CO -0.00 0.22 -0.08 -0.31 -0.29 0.00 0.00 176.35 175.89 3pch s TYR 479 N 0.11 2.56 -0.17 5.38 2.02 0.15 -1.66 117.35 125.73 3pch s TYR 479 Ca 0.09 -0.26 -0.09 0.00 -0.37 0.00 0.00 57.07 56.44 3pch s TYR 479 Cb -0.11 -1.15 -0.05 0.00 -0.40 0.00 0.00 41.96 40.25 3pch s TYR 479 CO -0.01 0.63 0.12 -0.06 -1.57 0.00 0.00 175.55 174.66 3pch s PHE 480 N -2.26 3.43 -0.01 2.71 0.40 -1.26 0.05 117.98 121.05 3pch s PHE 480 Ca 0.30 0.35 -0.39 0.00 -0.60 0.00 0.00 56.93 56.58 3pch s PHE 480 Cb -0.06 -2.08 -0.19 0.00 0.51 0.00 0.00 43.02 41.19 3pch s PHE 480 CO 0.17 0.39 1.20 -1.91 0.70 0.00 0.00 175.22 175.78 3pch n GLU 481 N 3.09 0.38 -0.73 0.44 2.13 -0.25 -1.35 120.64 124.35 3pch n GLU 481 Ca -0.17 0.14 0.00 0.00 0.66 0.00 0.00 57.16 57.79 3pch n GLU 481 Cb 0.53 -1.69 0.00 0.00 0.27 0.00 0.00 31.44 30.55 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 2.02 1.21 3.65 8.31 0.00 -1.26 -4.98 105.19 114.14 3pch n GLY 482 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 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 3.96 0.27 1.61 -0.08 -0.45 -4.85 116.55 117.01 3pch n ASP 483 Ca 0.00 0.77 0.18 0.00 -1.51 0.00 0.00 54.79 54.22 3pch n ASP 483 Cb 0.00 -1.52 0.79 0.00 2.34 0.00 0.00 41.12 42.73 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 11.44 0.00 0.00 -0.67 0.13 -1.93 -2.80 132.00 138.16 3pch h PRO 484 Ca -0.48 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.55 3pch h PRO 484 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 3pch h PRO 484 CO 0.94 0.00 -0.45 -0.07 -0.23 0.00 0.00 178.00 178.19 3pch h LEU 485 N 0.00 0.00 -0.70 1.56 3.38 -1.95 -3.36 115.31 114.25 3pch h LEU 485 Ca 0.00 0.00 0.11 0.00 0.09 0.00 0.00 57.88 58.08 3pch h LEU 485 Cb 0.35 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.98 3pch h LEU 485 CO 0.00 0.45 -0.41 0.40 0.09 0.00 0.00 178.44 178.97 3pch h ILE 486 N 0.00 0.09 0.00 1.22 2.04 -1.86 -0.66 117.51 118.33 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 0.88 0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.05 3pch h ILE 486 CO 0.06 0.00 0.00 -0.65 0.00 0.00 0.00 178.15 177.56 3pch h PRO 487 N -0.15 0.00 0.00 2.37 0.11 -1.80 -2.99 132.00 129.54 3pch h PRO 487 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 3pch h PRO 487 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 3pch h PRO 487 CO -0.77 0.00 -0.71 -1.33 -0.21 0.00 0.00 178.00 174.99 3pch n MET 488 N -2.71 0.20 -2.56 1.05 2.81 -0.27 -4.93 117.12 110.71 3pch n MET 488 Ca -0.00 0.03 -0.43 0.00 -1.81 0.00 0.00 57.70 55.50 3pch n MET 488 Cb 0.19 -1.60 -0.02 0.00 -0.71 0.00 0.00 33.22 31.08 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 7.57 0.21 0.06 0.00 0.11 -1.90 0.50 132.00 138.56 3pch h PRO 490 Ca -0.27 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.80 3pch h PRO 490 Cb 1.11 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3pch h PRO 490 CO 0.93 0.29 -0.03 0.82 -0.21 0.00 0.00 178.00 179.80 3pch h ILE 491 N 0.20 1.24 -0.19 4.15 2.04 -1.92 -1.70 117.51 121.34 3pch h ILE 491 Ca 0.05 -1.15 0.05 0.00 1.00 0.00 0.00 64.86 64.80 3pch h ILE 491 Cb 0.25 1.98 -0.05 0.00 -0.74 0.00 0.00 36.82 38.27 3pch h ILE 491 CO 0.01 0.28 -0.10 0.58 0.00 0.00 0.00 178.15 178.92 3pch h VAL 492 N -0.61 0.68 0.00 1.67 2.07 -1.78 -0.92 116.25 117.37 3pch h VAL 492 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3pch h VAL 492 Cb 0.53 0.68 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3pch h VAL 492 CO 0.01 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.89 3pch n LYS 493 N -5.26 0.02 0.33 1.57 5.02 0.17 -0.56 118.16 119.46 3pch n LYS 493 Ca -0.02 0.35 0.21 0.00 -2.02 0.00 0.00 58.31 56.83 3pch n LYS 493 Cb 0.18 -1.50 1.12 0.00 -0.02 0.00 0.00 35.03 34.81 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 -3.57 4.39 4.64 -0.18 -3.36 113.55 115.47 3pch h SER 494 Ca 0.00 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.71 3pch h SER 494 Cb 0.05 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 62.03 3pch h SER 494 CO 0.00 0.00 0.39 -0.63 -0.87 0.00 0.00 176.83 175.72 3pch s ILE 495 N -4.18 4.69 0.15 0.95 1.01 0.27 -3.78 121.20 120.31 3pch s ILE 495 Ca -0.04 0.75 -0.12 0.00 0.00 0.00 0.00 60.65 61.24 3pch s ILE 495 Cb 0.13 -4.26 0.01 0.00 0.01 0.00 0.00 42.46 38.35 3pch s ILE 495 CO 0.45 -0.55 1.57 0.00 0.00 0.00 0.00 174.94 176.41 3pch h ALA 496 N 8.67 0.66 -2.24 9.38 0.00 -1.85 -3.43 119.26 130.45 3pch h ALA 496 Ca -0.25 -0.33 -0.63 0.00 0.00 0.00 0.00 54.91 53.71 3pch h ALA 496 Cb 1.09 -0.17 -0.13 0.00 0.00 0.00 0.00 17.79 18.58 3pch h ALA 496 CO 0.93 0.54 0.23 1.21 0.00 0.00 0.00 179.25 182.17 3pch s ASN 497 N -6.50 6.45 0.47 0.00 3.04 -1.26 -4.96 114.94 112.18 3pch s ASN 497 Ca -0.12 0.12 0.21 0.00 0.04 0.00 0.00 52.86 53.11 3pch s ASN 497 Cb 0.12 -2.35 1.22 0.00 -1.54 0.00 0.00 41.25 38.69 3pch s ASN 497 CO 0.84 -0.69 1.94 1.55 -3.04 0.00 0.00 177.10 177.70 3pch h PRO 498 N 8.57 0.22 -0.79 0.43 0.13 -1.99 0.24 132.00 138.81 3pch h PRO 498 Ca -0.26 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.83 3pch h PRO 498 Cb 1.10 -0.05 -0.04 0.00 0.13 0.00 0.00 31.00 32.14 3pch h PRO 498 CO 0.88 0.15 0.38 0.93 -0.23 0.00 0.00 178.00 180.10 3pch h GLU 499 N 0.23 1.13 -0.58 0.86 3.07 -1.98 -2.38 114.58 114.92 3pch h GLU 499 Ca 0.34 -0.16 -0.09 0.00 -0.50 0.00 0.00 59.36 58.95 3pch h GLU 499 Cb 1.02 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.70 3pch h GLU 499 CO -0.07 0.87 0.01 0.00 -1.40 0.00 0.00 179.01 178.42 3pch h ALA 500 N 1.29 0.91 -0.78 3.43 0.00 -0.88 -2.86 119.26 120.37 3pch h ALA 500 Ca 0.27 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3pch h ALA 500 Cb 0.11 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3pch h ALA 500 CO -0.03 0.65 0.46 0.28 0.00 0.00 0.00 179.25 180.60 3pch h VAL 501 N 0.93 1.22 -0.58 0.00 2.07 -1.12 -2.10 116.25 116.66 3pch h VAL 501 Ca 0.17 -0.50 0.07 0.00 0.82 0.00 0.00 66.70 67.26 3pch h VAL 501 Cb 0.52 0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 3pch h VAL 501 CO 0.03 0.23 0.39 1.56 0.02 0.00 0.00 177.57 179.80 3pch h GLN 502 N 1.07 0.51 0.00 1.57 1.08 -1.20 -1.90 115.11 116.24 3pch h GLN 502 Ca 0.28 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.45 3pch h GLN 502 Cb -0.03 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 27.29 3pch h GLN 502 CO -0.05 0.34 0.00 0.94 -0.95 0.00 0.00 178.83 179.11 3pch n GLN 503 N -4.48 0.14 -0.03 1.46 7.27 -0.79 -2.03 117.38 118.92 3pch n GLN 503 Ca 0.08 0.40 0.12 0.00 0.07 0.00 0.00 57.00 57.68 3pch n GLN 503 Cb 0.26 -1.78 0.17 0.00 2.41 0.00 0.00 30.24 31.30 3pch n GLN 503 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 3pch n LEU 504 N -2.04 2.90 -4.55 1.69 4.77 -0.71 -4.90 117.00 114.15 3pch n LEU 504 Ca 0.02 -1.02 -0.41 0.00 -0.03 0.00 0.00 56.01 54.57 3pch n LEU 504 Cb 0.19 -0.04 -0.09 0.00 -2.33 0.00 0.00 43.42 41.15 3pch n LEU 504 CO 0.17 0.51 0.06 -0.63 -1.33 0.00 0.00 177.39 176.17 3pch s ILE 505 N -1.92 5.15 0.23 -0.08 1.01 -0.86 0.32 121.20 125.05 3pch s ILE 505 Ca 0.31 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.75 3pch s ILE 505 Cb 0.20 -3.84 -0.09 0.00 0.01 0.00 0.00 42.46 38.75 3pch s ILE 505 CO 0.31 -0.10 0.95 0.00 0.00 0.00 0.00 174.94 176.09 3pch s ALA 506 N 2.06 3.33 -0.13 9.38 0.00 0.11 -4.85 121.76 131.67 3pch s ALA 506 Ca 0.13 0.62 -0.07 0.00 0.00 0.00 0.00 51.96 52.64 3pch s ALA 506 Cb -0.16 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 3pch s ALA 506 CO 0.12 0.18 0.13 0.15 0.00 0.00 0.00 175.76 176.34 3pch s LYS 507 N -1.09 3.51 0.12 0.00 -0.14 -0.92 -1.09 119.74 120.13 3pch s LYS 507 Ca 0.42 -0.15 -0.33 0.00 -1.36 0.00 0.00 55.97 54.54 3pch s LYS 507 Cb -0.26 -3.20 -0.13 0.00 -1.68 0.00 0.00 37.83 32.57 3pch s LYS 507 CO 0.32 0.72 1.70 -0.11 -0.76 0.00 0.00 175.35 177.22 3pch n LEU 508 N 2.17 3.47 -3.84 3.17 7.94 -1.26 -1.42 117.00 127.24 3pch n LEU 508 Ca -0.19 1.04 -0.30 0.00 -1.11 0.00 0.00 56.01 55.45 3pch n LEU 508 Cb 0.55 -1.46 -0.13 0.00 0.53 0.00 0.00 43.42 42.90 3pch n LEU 508 CO 0.32 -0.09 -0.19 -0.62 -1.11 0.00 0.00 177.39 175.69 3pch s ASP 509 N 1.86 4.03 0.45 1.96 2.15 0.33 -4.87 116.67 122.58 3pch s ASP 509 Ca 0.81 -2.96 0.19 0.00 0.43 0.00 0.00 52.55 51.02 3pch s ASP 509 Cb -0.62 -1.37 1.05 0.00 -0.30 0.00 0.00 42.92 41.68 3pch s ASP 509 CO 0.39 -0.23 1.95 0.24 -0.17 0.00 0.00 175.17 177.36 3pch h MET 510 N 6.44 0.00 0.00 4.34 2.86 -1.92 -2.44 114.93 124.21 3pch h MET 510 Ca -0.02 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 3pch h MET 510 Cb 0.89 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.55 3pch h MET 510 CO 0.60 0.23 -0.12 -0.91 1.06 0.00 0.00 176.91 177.77 3pch h ASN 511 N 0.00 0.00 0.01 1.22 2.35 -1.93 -2.93 115.58 114.29 3pch h ASN 511 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3pch h ASN 511 Cb 0.47 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.84 3pch h ASN 511 CO 0.03 0.12 -0.56 -3.20 -1.65 0.00 0.00 177.43 172.17 3pch n ASN 512 N -3.62 1.79 -4.77 5.81 5.15 -0.93 -4.99 115.26 113.70 3pch n ASN 512 Ca -0.02 -1.38 -0.33 0.00 -0.60 0.00 0.00 54.58 52.26 3pch n ASN 512 Cb 0.24 0.55 0.06 0.00 -0.53 0.00 0.00 39.78 40.11 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 -2.58 2.38 -0.39 5.20 0.00 -1.11 -4.74 121.76 120.52 3pch s ALA 513 Ca 0.17 0.50 -0.08 0.00 0.00 0.00 0.00 51.96 52.54 3pch s ALA 513 Cb 0.18 -3.32 0.06 0.00 0.00 0.00 0.00 23.12 20.04 3pch s ALA 513 CO 0.62 -1.46 0.20 -0.80 0.00 0.00 0.00 175.76 174.32 3pch s ASN 514 N -2.76 5.51 0.27 0.00 0.01 0.52 -5.00 114.94 113.49 3pch s ASN 514 Ca 0.66 -1.39 -0.29 0.00 -0.71 0.00 0.00 52.86 51.13 3pch s ASN 514 Cb -0.20 -1.94 -0.14 0.00 0.41 0.00 0.00 41.25 39.38 3pch s ASN 514 CO 0.46 -0.46 1.03 -2.65 -1.51 0.00 0.00 177.10 173.97 3pch n PRO 515 N 4.86 1.31 -1.72 -0.60 -0.02 -1.26 -0.53 135.00 137.04 3pch n PRO 515 Ca -0.10 0.46 -0.19 0.00 -2.02 0.00 0.00 63.50 61.65 3pch n PRO 515 Cb 0.44 -1.85 -0.07 0.00 -0.02 0.00 0.00 33.50 32.00 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 0.94 -1.35 0.00 -0.52 2.81 -1.26 -4.73 117.12 113.01 3pch n MET 516 Ca 0.11 1.11 0.00 0.00 -1.81 0.00 0.00 57.70 57.10 3pch n MET 516 Cb 0.31 -5.46 0.00 0.00 -0.71 0.00 0.00 33.22 27.36 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 -1.15 0.00 -3.82 7.83 2.03 0.31 -5.15 116.55 116.60 3pch n ASP 517 Ca -0.20 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.01 3pch n ASP 517 Cb 0.63 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.95 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 -2.22 2.92 -0.04 0.00 1.43 -0.78 -0.36 118.68 119.64 3pch s LEU 519 Ca -0.03 0.06 -0.07 0.00 -1.03 0.00 0.00 54.13 53.06 3pch s LEU 519 Cb 0.00 -2.53 0.01 0.00 0.03 0.00 0.00 46.19 43.70 3pch s LEU 519 CO -0.05 -1.82 0.16 0.00 0.23 0.00 0.00 176.35 174.87 3pch s ALA 520 N -3.25 -0.40 0.07 4.21 0.00 -1.25 -1.01 121.76 120.13 3pch s ALA 520 Ca 0.64 0.25 0.08 0.00 0.00 0.00 0.00 51.96 52.93 3pch s ALA 520 Cb -0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.89 3pch s ALA 520 CO 0.45 -0.14 -0.22 0.71 0.00 0.00 0.00 175.76 176.56 3pch s TYR 521 N -0.52 1.93 -0.11 0.00 1.51 -0.23 0.12 117.35 120.06 3pch s TYR 521 Ca -0.06 -0.39 0.03 0.00 -1.01 0.00 0.00 57.07 55.64 3pch s TYR 521 Cb -0.04 -1.12 0.00 0.00 -0.11 0.00 0.00 41.96 40.69 3pch s TYR 521 CO 0.01 0.15 -0.23 0.50 -1.11 0.00 0.00 175.55 174.87 3pch s ARG 522 N -1.45 3.07 -0.23 -0.62 6.06 -0.51 -2.05 118.95 123.23 3pch s ARG 522 Ca 0.08 -0.86 -0.04 0.00 -2.50 0.00 0.00 55.73 52.41 3pch s ARG 522 Cb -0.09 -2.36 0.08 0.00 0.06 0.00 0.00 34.95 32.63 3pch s ARG 522 CO 0.03 0.13 0.12 0.12 -2.50 0.00 0.00 175.30 173.20 3pch s PHE 523 N 0.47 0.22 0.21 5.12 5.36 0.38 -2.17 117.98 127.58 3pch s PHE 523 Ca -0.15 -0.57 -0.07 0.00 -0.96 0.00 0.00 56.93 55.18 3pch s PHE 523 Cb -0.17 -0.78 -0.06 0.00 -0.34 0.00 0.00 43.02 41.67 3pch s PHE 523 CO 0.06 -0.68 0.49 -0.51 -1.46 0.00 0.00 175.22 173.12 3pch s ASP 524 N 2.13 6.54 -0.02 6.13 1.01 -1.26 -3.79 116.67 127.40 3pch s ASP 524 Ca 0.06 0.76 0.05 0.00 0.71 0.00 0.00 52.55 54.13 3pch s ASP 524 Cb -0.16 -2.16 -0.01 0.00 1.01 0.00 0.00 42.92 41.60 3pch s ASP 524 CO -0.23 -0.06 -0.18 -0.63 0.21 0.00 0.00 175.17 174.28 3pch s ILE 525 N -1.82 1.46 -0.17 0.77 1.01 0.23 -4.93 121.20 117.74 3pch s ILE 525 Ca 0.44 -0.77 -0.00 0.00 0.00 0.00 0.00 60.65 60.32 3pch s ILE 525 Cb -0.11 -1.23 0.00 0.00 0.01 0.00 0.00 42.46 41.13 3pch s ILE 525 CO 0.24 0.42 -0.15 -0.69 0.00 0.00 0.00 174.94 174.76 3pch s VAL 526 N -0.28 2.59 0.29 2.92 1.01 -1.25 -1.09 120.40 124.58 3pch s VAL 526 Ca 0.04 -0.78 0.06 0.00 0.00 0.00 0.00 61.98 61.30 3pch s VAL 526 Cb -0.09 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 3pch s VAL 526 CO 0.00 0.51 0.33 -0.76 0.00 0.00 0.00 175.10 175.18 3pch s LEU 527 N 1.08 3.94 0.15 3.92 1.43 0.33 -4.93 118.68 124.61 3pch s LEU 527 Ca -0.00 -0.21 -0.34 0.00 -1.03 0.00 0.00 54.13 52.56 3pch s LEU 527 Cb -0.14 -2.55 -0.16 0.00 0.03 0.00 0.00 46.19 43.37 3pch s LEU 527 CO -0.05 -0.21 1.21 0.54 0.23 0.00 0.00 176.35 178.07 3pch n ARG 528 N -1.40 1.19 -2.01 1.70 1.74 -1.26 -1.37 116.66 115.25 3pch n ARG 528 Ca -0.05 0.42 -0.40 0.00 -0.77 0.00 0.00 57.85 57.05 3pch n ARG 528 Cb 0.58 -1.96 -0.01 0.00 -1.02 0.00 0.00 32.46 30.05 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 0.12 2.96 -0.16 -0.13 0.00 -1.26 -4.34 107.32 104.51 3pch s GLY 529 Ca 0.76 1.33 -0.02 0.00 0.00 0.00 0.00 44.72 46.79 3pch s GLY 529 CO 0.51 1.96 -0.08 1.62 0.00 0.00 0.00 173.10 177.11 3pch s GLN 530 N -2.05 3.47 0.14 2.90 0.74 -1.26 -0.58 119.66 123.02 3pch s GLN 530 Ca 0.53 -0.62 0.03 0.00 0.05 0.00 0.00 55.36 55.35 3pch s GLN 530 Cb -0.41 -2.80 -0.04 0.00 1.10 0.00 0.00 33.01 30.86 3pch s GLN 530 CO 0.54 0.14 -0.05 -0.98 -0.55 0.00 0.00 175.29 174.39 3pch s ARG 531 N 0.58 1.02 0.46 1.67 1.70 -0.06 -4.98 118.95 119.35 3pch s ARG 531 Ca -0.05 -1.45 -0.21 0.00 -0.47 0.00 0.00 55.73 53.55 3pch s ARG 531 Cb -0.15 -0.38 -0.09 0.00 -0.57 0.00 0.00 34.95 33.76 3pch s ARG 531 CO 0.03 -0.03 1.01 -1.59 -1.08 0.00 0.00 175.30 173.64 3pch s LYS 532 N -3.83 3.96 0.59 3.89 -2.85 -1.26 -0.08 119.74 120.16 3pch s LYS 532 Ca 0.18 1.28 -0.17 0.00 -1.00 0.00 0.00 55.97 56.27 3pch s LYS 532 Cb 0.05 -2.14 -0.03 0.00 -2.06 0.00 0.00 37.83 33.64 3pch s LYS 532 CO 0.00 -0.28 1.08 0.95 0.10 0.00 0.00 175.35 177.20 3pch s THR 533 N -2.04 3.56 -0.07 3.79 -4.23 -1.25 -4.72 115.64 110.68 3pch s THR 533 Ca 0.65 0.79 -0.13 0.00 -1.18 0.00 0.00 61.69 61.82 3pch s THR 533 Cb -0.14 -3.30 0.03 0.00 1.34 0.00 0.00 72.50 70.43 3pch s THR 533 CO 0.18 -0.39 0.33 -1.38 -0.54 0.00 0.00 174.62 172.82 3pch s HIS 534 N -2.27 -0.27 -1.88 3.99 -3.43 -1.26 -4.93 115.29 105.23 3pch s HIS 534 Ca 0.66 0.58 -0.24 0.00 -0.80 0.00 0.00 55.06 55.26 3pch s HIS 534 Cb -0.18 0.11 0.23 0.00 -1.43 0.00 0.00 32.58 31.31 3pch s HIS 534 CO 0.35 -0.29 0.60 1.19 -2.00 0.00 0.00 174.74 174.59 3pch n PHE 535 N 2.04 -1.18 1.98 0.38 3.72 -1.26 -5.23 117.46 117.90 3pch n PHE 535 Ca -0.18 0.69 0.16 0.00 -0.05 0.00 0.00 57.45 58.08 3pch n PHE 535 Cb 0.57 -1.91 0.93 0.00 -0.94 0.00 0.00 39.48 38.13 3pch n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10