#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 2.47 0.02 0.55 0.00 -1.26 -5.08 121.76 118.47 3pch s ALA 302 Ca 0.00 0.20 0.03 0.00 0.00 0.00 0.00 51.96 52.19 3pch s ALA 302 Cb 0.00 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.87 3pch s ALA 302 CO 0.00 -1.47 -0.10 -0.65 0.00 0.00 0.00 175.76 173.54 3pch s GLN 303 N -4.91 0.69 -0.81 0.00 -0.21 -1.26 -5.09 119.66 108.07 3pch s GLN 303 Ca 0.60 -0.56 -0.24 0.00 0.02 0.00 0.00 55.36 55.18 3pch s GLN 303 Cb -0.16 -0.63 0.05 0.00 1.00 0.00 0.00 33.01 33.28 3pch s GLN 303 CO 0.54 0.16 1.24 0.34 -2.12 0.00 0.00 175.29 175.45 3pch s ASP 304 N -0.87 6.29 0.00 5.90 2.15 -1.26 -4.68 116.67 124.20 3pch s ASP 304 Ca -0.01 -0.97 0.00 0.00 0.43 0.00 0.00 52.55 52.00 3pch s ASP 304 Cb -0.06 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.04 3pch s ASP 304 CO 0.00 -1.59 0.06 -0.46 -0.17 0.00 0.00 175.17 173.01 3pch n ASN 305 N 8.61 0.12 -4.40 -0.34 0.23 -1.26 -5.01 115.26 113.21 3pch n ASN 305 Ca 0.11 -0.47 -0.21 0.00 -0.53 0.00 0.00 54.58 53.48 3pch n ASN 305 Cb 0.49 0.61 -0.10 0.00 -2.08 0.00 0.00 39.78 38.69 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 -0.61 3.01 0.09 0.53 0.01 -1.26 -3.11 113.70 112.36 3pch s SER 306 Ca 0.00 -1.00 0.07 0.00 1.31 0.00 0.00 55.95 56.33 3pch s SER 306 Cb 0.00 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.99 3pch s SER 306 CO 0.00 -0.06 -0.19 -0.13 0.41 0.00 0.00 173.24 173.27 3pch s ARG 307 N -3.45 1.06 -0.13 12.44 1.81 0.50 -4.85 118.95 126.33 3pch s ARG 307 Ca 0.25 -1.08 0.03 0.00 -1.72 0.00 0.00 55.73 53.20 3pch s ARG 307 Cb -0.03 -1.24 0.01 0.00 -0.45 0.00 0.00 34.95 33.24 3pch s ARG 307 CO 0.10 0.29 -0.22 -0.06 -0.68 0.00 0.00 175.30 174.73 3pch s PHE 308 N -1.15 2.61 0.24 -0.53 0.08 -1.26 -1.03 117.98 116.94 3pch s PHE 308 Ca 0.04 -1.28 -0.30 0.00 0.12 0.00 0.00 56.93 55.52 3pch s PHE 308 Cb -0.10 -1.78 -0.15 0.00 -0.57 0.00 0.00 43.02 40.43 3pch s PHE 308 CO 0.03 -0.58 1.01 0.28 -0.10 0.00 0.00 175.22 175.87 3pch n VAL 309 N 3.99 1.61 -1.98 -0.44 0.31 -0.18 -4.84 118.33 116.80 3pch n VAL 309 Ca -0.20 -0.40 -0.41 0.00 -0.01 0.00 0.00 64.34 63.31 3pch n VAL 309 Cb 0.52 -0.84 -0.02 0.00 -0.91 0.00 0.00 33.84 32.59 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 -0.75 2.56 0.44 2.52 -1.09 -1.26 -4.74 121.20 118.87 3pch s ILE 310 Ca 0.64 0.48 -0.24 0.00 -2.23 0.00 0.00 60.65 59.29 3pch s ILE 310 Cb -0.78 -3.30 -0.08 0.00 -1.58 0.00 0.00 42.46 36.72 3pch s ILE 310 CO 0.57 0.08 1.23 -0.13 -1.23 0.00 0.00 174.94 175.46 3pch s ARG 311 N -0.53 3.82 -0.61 2.79 0.52 -1.26 -4.97 118.95 118.71 3pch s ARG 311 Ca 0.59 1.96 -0.19 0.00 -0.52 0.00 0.00 55.73 57.58 3pch s ARG 311 Cb -0.43 -2.57 0.11 0.00 0.52 0.00 0.00 34.95 32.58 3pch s ARG 311 CO 0.45 -0.55 0.72 0.34 0.02 0.00 0.00 175.30 176.28 3pch s ASP 312 N -1.06 6.21 0.00 0.23 -1.08 -1.26 -4.90 116.67 114.81 3pch s ASP 312 Ca 0.61 -1.48 0.19 0.00 -0.52 0.00 0.00 52.55 51.35 3pch s ASP 312 Cb -0.33 -2.30 1.07 0.00 -1.46 0.00 0.00 42.92 39.90 3pch s ASP 312 CO 0.42 -1.11 1.57 0.54 0.52 0.00 0.00 175.17 177.11 3pch n ARG 313 N 6.30 0.46 0.01 4.34 1.74 -1.26 -1.22 116.66 127.03 3pch n ARG 313 Ca -0.08 0.05 0.11 0.00 -0.77 0.00 0.00 57.85 57.15 3pch n ARG 313 Cb 0.43 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.28 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 -1.12 0.59 -0.07 0.55 3.02 -1.26 -4.37 115.26 112.60 3pch n ASN 314 Ca 0.12 -0.46 -0.19 0.00 -0.03 0.00 0.00 54.58 54.02 3pch n ASN 314 Cb 0.10 1.21 -0.12 0.00 -0.61 0.00 0.00 39.78 40.35 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 0.09 -4.32 3.10 2.91 -1.58 -3.43 115.95 112.72 3pch h TRP 315 Ca 0.00 -0.07 -0.51 0.00 1.13 0.00 0.00 58.89 59.44 3pch h TRP 315 Cb 0.71 -0.00 0.11 0.00 -0.51 0.00 0.00 29.16 29.47 3pch h TRP 315 CO 0.00 1.34 0.35 -1.01 -1.03 0.00 0.00 178.44 178.08 3pch s HIS 316 N -2.34 2.84 0.43 2.65 3.76 -0.85 -4.74 115.29 117.04 3pch s HIS 316 Ca -0.24 1.49 -0.25 0.00 -0.15 0.00 0.00 55.06 55.92 3pch s HIS 316 Cb 0.03 -2.97 -0.08 0.00 1.11 0.00 0.00 32.58 30.67 3pch s HIS 316 CO 0.66 -1.51 1.20 -1.25 -0.85 0.00 0.00 174.74 173.00 3pch s PRO 317 N -4.92 3.90 0.89 8.40 0.04 -1.26 -4.77 135.00 137.27 3pch s PRO 317 Ca 0.60 1.90 -0.12 0.00 0.04 0.00 0.00 61.00 63.42 3pch s PRO 317 Cb -0.16 -2.59 0.12 0.00 0.04 0.00 0.00 34.50 31.91 3pch s PRO 317 CO 0.55 -0.47 1.15 0.15 0.04 0.00 0.00 177.00 178.42 3pch s LYS 318 N -2.43 1.33 0.01 4.56 -0.14 -1.25 -5.00 119.74 116.81 3pch s LYS 318 Ca 0.60 0.21 -0.20 0.00 -1.36 0.00 0.00 55.97 55.22 3pch s LYS 318 Cb -0.32 -1.87 -0.21 0.00 -1.68 0.00 0.00 37.83 33.75 3pch s LYS 318 CO 0.40 -2.05 1.14 0.00 -0.76 0.00 0.00 175.35 174.08 3pch h ALA 319 N -1.39 0.11 -2.12 5.17 0.00 -1.95 -3.41 119.26 115.67 3pch h ALA 319 Ca -0.49 -0.50 -0.67 0.00 0.00 0.00 0.00 54.91 53.25 3pch h ALA 319 Cb 1.33 0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.96 3pch h ALA 319 CO 0.62 0.27 0.11 -1.17 0.00 0.00 0.00 179.25 179.09 3pch s LEU 320 N -8.52 4.70 -0.39 0.00 2.96 -1.26 -4.72 118.68 111.44 3pch s LEU 320 Ca -0.14 -0.62 0.03 0.00 -0.22 0.00 0.00 54.13 53.18 3pch s LEU 320 Cb 0.04 -2.59 0.16 0.00 0.50 0.00 0.00 46.19 44.30 3pch s LEU 320 CO 0.80 -0.86 0.30 0.42 -1.32 0.00 0.00 176.35 175.69 3pch s THR 321 N 2.80 0.23 0.49 3.68 -4.23 -1.26 -5.02 115.64 112.33 3pch s THR 321 Ca 0.19 -2.28 0.38 0.00 -1.18 0.00 0.00 61.69 58.79 3pch s THR 321 Cb -0.16 -1.17 0.58 0.00 1.34 0.00 0.00 72.50 73.08 3pch s THR 321 CO 0.15 -1.13 1.63 -0.65 -0.54 0.00 0.00 174.62 174.09 3pch h PRO 322 N 6.10 0.05 0.00 3.99 0.11 -1.94 0.18 132.00 140.49 3pch h PRO 322 Ca 0.19 -0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.25 3pch h PRO 322 Cb 0.94 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.03 3pch h PRO 322 CO 0.33 0.03 -0.23 -0.44 -0.21 0.00 0.00 178.00 177.48 3pch h ASP 323 N 0.05 0.00 -2.64 -2.05 3.32 -1.95 -3.26 116.42 109.89 3pch h ASP 323 Ca 0.83 0.00 -0.71 0.00 0.02 0.00 0.00 57.03 57.17 3pch h ASP 323 Cb 2.93 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 42.29 3pch h ASP 323 CO -0.23 0.23 0.71 -0.47 -1.72 0.00 0.00 179.24 177.76 3pch s TYR 324 N -4.24 3.22 0.29 4.55 5.04 0.62 -4.85 117.35 121.98 3pch s TYR 324 Ca -0.03 -1.48 -0.02 0.00 -2.44 0.00 0.00 57.07 53.10 3pch s TYR 324 Cb 0.14 -4.20 0.61 0.00 0.35 0.00 0.00 41.96 38.86 3pch s TYR 324 CO 0.66 -1.41 1.50 1.63 -1.34 0.00 0.00 175.55 176.59 3pch n LYS 325 N 6.13 -0.08 0.26 4.97 5.02 -1.23 -1.62 118.16 131.61 3pch n LYS 325 Ca 0.22 1.46 0.11 0.00 -2.02 0.00 0.00 58.31 58.07 3pch n LYS 325 Cb 0.49 -2.26 0.69 0.00 -0.02 0.00 0.00 35.03 33.93 3pch n LYS 325 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 3pch h THR 326 N 0.00 0.73 0.00 -0.18 2.02 -1.91 -2.53 112.91 111.03 3pch h THR 326 Ca 0.53 -0.46 -0.06 0.00 0.77 0.00 0.00 66.41 67.19 3pch h THR 326 Cb 0.99 1.28 -0.01 0.00 -1.74 0.00 0.00 68.15 68.67 3pch h THR 326 CO -0.93 0.11 -0.27 0.77 0.37 0.00 0.00 175.52 175.57 3pch h SER 327 N 0.00 0.00 0.11 4.18 4.64 -1.60 -2.45 113.55 118.44 3pch h SER 327 Ca -0.00 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.34 3pch h SER 327 Cb 0.27 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 3pch h SER 327 CO 0.02 0.27 -0.26 0.40 -0.87 0.00 0.00 176.83 176.38 3pch h ILE 328 N 0.00 0.42 0.00 0.95 2.04 -1.58 -2.32 117.51 117.02 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 0.50 0.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 3pch h ILE 328 CO 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 178.15 178.10 3pch h ALA 329 N 0.26 0.95 -0.61 1.87 0.00 -1.75 -3.31 119.26 116.67 3pch h ALA 329 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.69 3pch h ALA 329 Cb 0.50 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.14 3pch h ALA 329 CO -0.16 0.00 0.21 0.54 0.00 0.00 0.00 179.25 179.85 3pch n ARG 330 N -2.57 2.63 -5.13 0.00 1.74 -0.92 -4.94 116.66 107.47 3pch n ARG 330 Ca 0.05 -3.07 -0.31 0.00 -0.77 0.00 0.00 57.85 53.75 3pch n ARG 330 Cb 0.47 -2.02 -0.15 0.00 -1.02 0.00 0.00 32.46 29.74 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 -1.73 3.32 0.78 0.55 1.04 -0.90 -4.95 113.70 111.81 3pch s SER 331 Ca 0.50 -0.42 -0.13 0.00 0.48 0.00 0.00 55.95 56.38 3pch s SER 331 Cb 0.42 -0.46 0.07 0.00 0.10 0.00 0.00 66.02 66.15 3pch s SER 331 CO 0.08 0.31 1.15 -2.84 0.98 0.00 0.00 173.24 172.92 3pch s PRO 332 N -0.77 1.95 -0.07 4.02 0.02 -1.26 -4.97 135.00 133.92 3pch s PRO 332 Ca 0.11 1.51 0.14 0.00 0.02 0.00 0.00 61.00 62.78 3pch s PRO 332 Cb -0.10 -1.84 -0.20 0.00 0.02 0.00 0.00 34.50 32.38 3pch s PRO 332 CO 0.00 -1.93 0.20 0.54 -0.33 0.00 0.00 177.00 175.48 3pch n ARG 333 N -3.28 1.03 -2.86 5.54 5.12 -1.26 -4.92 116.66 116.03 3pch n ARG 333 Ca 0.12 -0.08 -0.31 0.00 -1.93 0.00 0.00 57.85 55.65 3pch n ARG 333 Cb 0.52 -1.35 -0.04 0.00 -1.16 0.00 0.00 32.46 30.42 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 -2.72 3.85 0.66 5.56 -1.52 -1.26 -5.05 119.66 119.17 3pch s GLN 334 Ca -0.06 0.57 -0.14 0.00 -1.95 0.00 0.00 55.36 53.78 3pch s GLN 334 Cb 0.07 -2.37 -0.00 0.00 -0.22 0.00 0.00 33.01 30.49 3pch s GLN 334 CO 0.60 -0.02 1.09 0.00 -0.25 0.00 0.00 175.29 176.70 3pch s ALA 335 N -2.32 2.55 0.61 6.09 0.00 -1.26 -5.00 121.76 122.43 3pch s ALA 335 Ca 0.53 0.41 -0.16 0.00 0.00 0.00 0.00 51.96 52.74 3pch s ALA 335 Cb -0.10 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.72 3pch s ALA 335 CO 0.28 -1.19 1.10 -0.51 0.00 0.00 0.00 175.76 175.44 3pch s LEU 336 N -4.96 3.51 -0.30 0.00 1.43 -1.26 -5.00 118.68 112.09 3pch s LEU 336 Ca 0.64 1.99 -0.12 0.00 -1.03 0.00 0.00 54.13 55.62 3pch s LEU 336 Cb -0.18 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.45 3pch s LEU 336 CO 0.43 -1.41 0.20 -0.69 0.23 0.00 0.00 176.35 175.12 3pch s VAL 337 N -2.23 5.24 0.18 -1.59 1.01 -1.26 -5.06 120.40 116.69 3pch s VAL 337 Ca 0.67 -0.01 -0.30 0.00 0.00 0.00 0.00 61.98 62.34 3pch s VAL 337 Cb -0.20 -3.58 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 3pch s VAL 337 CO 0.36 0.15 1.13 -0.44 0.00 0.00 0.00 175.10 176.30 3pch s SER 338 N 1.74 7.20 0.03 3.32 0.01 -1.26 -5.04 113.70 119.69 3pch s SER 338 Ca 0.07 2.13 0.02 0.00 1.31 0.00 0.00 55.95 59.47 3pch s SER 338 Cb -0.17 -2.60 -0.02 0.00 0.21 0.00 0.00 66.02 63.44 3pch s SER 338 CO 0.10 -0.27 -0.06 0.27 0.41 0.00 0.00 173.24 173.69 3pch s ILE 339 N -0.15 0.40 0.55 1.44 -4.36 -1.26 -5.15 121.20 112.67 3pch s ILE 339 Ca 0.51 -0.82 -0.20 0.00 -0.26 0.00 0.00 60.65 59.88 3pch s ILE 339 Cb -0.30 -0.45 -0.05 0.00 1.25 0.00 0.00 42.46 42.90 3pch s ILE 339 CO 0.35 -0.29 1.16 -2.16 0.24 0.00 0.00 174.94 174.25 3pch s PRO 340 N -1.18 3.28 0.27 0.37 0.04 -1.26 -4.99 135.00 131.53 3pch s PRO 340 Ca -0.08 1.71 -0.29 0.00 0.04 0.00 0.00 61.00 62.37 3pch s PRO 340 Cb -0.08 -2.03 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 3pch s PRO 340 CO -0.00 -0.93 1.17 -0.65 0.04 0.00 0.00 177.00 176.63 3pch s GLN 341 N -3.23 4.54 0.31 4.56 -0.21 -1.26 -5.01 119.66 119.36 3pch s GLN 341 Ca 0.73 1.92 0.04 0.00 0.02 0.00 0.00 55.36 58.07 3pch s GLN 341 Cb -0.27 -3.17 -0.03 0.00 1.00 0.00 0.00 33.01 30.54 3pch s GLN 341 CO 0.30 0.05 0.18 -1.54 -2.12 0.00 0.00 175.29 172.16 3pch s SER 342 N -0.56 1.62 0.53 5.90 1.04 -1.26 -5.01 113.70 115.96 3pch s SER 342 Ca 0.47 -1.60 0.29 0.00 0.48 0.00 0.00 55.95 55.60 3pch s SER 342 Cb -0.34 0.43 1.45 0.00 0.10 0.00 0.00 66.02 67.65 3pch s SER 342 CO 0.43 -0.92 1.92 -0.29 0.98 0.00 0.00 173.24 175.36 3pch h ILE 343 N 2.18 0.61 -0.75 -1.02 2.10 -1.95 0.55 117.51 119.22 3pch h ILE 343 Ca -0.32 -0.00 -0.03 0.00 1.08 0.00 0.00 64.86 65.58 3pch h ILE 343 Cb 1.25 0.60 -0.03 0.00 -1.09 0.00 0.00 36.82 37.54 3pch h ILE 343 CO 0.50 0.00 0.34 0.28 -1.08 0.00 0.00 178.15 178.19 3pch h SER 344 N 0.01 1.01 0.39 2.19 0.02 -1.95 -3.16 113.55 112.06 3pch h SER 344 Ca 0.37 -0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 61.11 3pch h SER 344 Cb 1.48 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 3pch h SER 344 CO -0.01 0.88 -1.67 -0.62 -1.14 0.00 0.00 176.83 174.27 3pch n GLU 345 N -4.36 0.64 -0.21 3.45 4.71 -0.12 -4.41 120.64 120.35 3pch n GLU 345 Ca 0.07 -0.02 0.10 0.00 -0.01 0.00 0.00 57.16 57.29 3pch n GLU 345 Cb 0.15 -1.65 0.26 0.00 -1.01 0.00 0.00 31.44 29.20 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 -2.53 0.56 -4.56 2.62 -2.24 -0.01 -2.82 114.28 105.31 3pch n THR 346 Ca -0.07 -0.65 -0.26 0.00 -2.27 0.00 0.00 64.05 60.80 3pch n THR 346 Cb 0.67 0.53 -0.11 0.00 -2.10 0.00 0.00 70.33 69.32 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 -1.44 1.63 -0.04 4.28 -4.23 -1.19 -4.74 115.64 109.90 3pch s THR 347 Ca 0.36 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.57 3pch s THR 347 Cb 0.20 -2.88 0.12 0.00 1.34 0.00 0.00 72.50 71.28 3pch s THR 347 CO 0.27 0.00 1.34 -0.83 -0.54 0.00 0.00 174.62 174.86 3pch s GLY 348 N -3.63 -0.36 0.52 3.99 0.00 -1.25 -1.25 107.32 105.35 3pch s GLY 348 Ca 0.34 0.57 -0.21 0.00 0.00 0.00 0.00 44.72 45.42 3pch s GLY 348 CO 0.16 1.97 1.20 2.56 0.00 0.00 0.00 173.10 179.00 3pch s PRO 349 N -2.18 3.42 -0.19 2.90 0.04 -1.26 -4.82 135.00 132.91 3pch s PRO 349 Ca 0.19 1.84 -0.00 0.00 0.04 0.00 0.00 61.00 63.07 3pch s PRO 349 Cb 0.04 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.38 3pch s PRO 349 CO -0.04 -0.85 -0.16 1.21 0.04 0.00 0.00 177.00 177.20 3pch s ASN 350 N -1.41 3.43 -0.05 6.66 3.84 -1.26 -4.85 114.94 121.29 3pch s ASN 350 Ca 0.69 -0.58 0.16 0.00 0.21 0.00 0.00 52.86 53.35 3pch s ASN 350 Cb -0.30 -1.54 0.56 0.00 -0.55 0.00 0.00 41.25 39.41 3pch s ASN 350 CO 0.35 0.00 1.45 0.49 -2.79 0.00 0.00 177.10 176.60 3pch n PHE 351 N 4.60 1.04 -0.21 0.43 3.72 -1.26 -4.58 117.46 121.19 3pch n PHE 351 Ca -0.20 -0.44 0.26 0.00 -0.05 0.00 0.00 57.45 57.01 3pch n PHE 351 Cb 0.50 -0.12 0.65 0.00 -0.94 0.00 0.00 39.48 39.57 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 3.35 0.15 -0.60 4.37 0.02 -1.96 -0.63 113.55 118.24 3pch h SER 352 Ca 0.00 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3pch h SER 352 Cb 1.04 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.57 3pch h SER 352 CO 0.11 0.05 0.00 1.41 -1.14 0.00 0.00 176.83 177.26 3pch n HIS 353 N -4.36 0.80 -2.20 3.45 8.25 -1.26 -4.91 115.22 114.98 3pch n HIS 353 Ca 0.20 -0.40 -0.41 0.00 -0.26 0.00 0.00 57.72 56.85 3pch n HIS 353 Cb 0.89 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.98 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 -1.18 4.45 -0.91 2.41 2.96 -0.25 -4.94 118.68 121.23 3pch s LEU 354 Ca 0.45 2.56 -0.18 0.00 -0.22 0.00 0.00 54.13 56.74 3pch s LEU 354 Cb 0.24 -3.64 0.15 0.00 0.50 0.00 0.00 46.19 43.44 3pch s LEU 354 CO 0.33 -0.46 1.06 -0.83 -1.32 0.00 0.00 176.35 175.12 3pch s GLY 355 N -0.40 2.06 0.28 7.98 0.00 -1.26 -5.02 107.32 110.96 3pch s GLY 355 Ca 0.50 -2.87 -0.28 0.00 0.00 0.00 0.00 44.72 42.07 3pch s GLY 355 CO 0.48 1.87 0.95 -1.36 0.00 0.00 0.00 173.10 175.04 3pch s PHE 356 N 2.23 3.85 0.67 1.90 0.08 -1.26 -5.05 117.98 120.39 3pch s PHE 356 Ca 0.30 1.85 -0.12 0.00 0.12 0.00 0.00 56.93 59.08 3pch s PHE 356 Cb -0.06 -2.97 -0.00 0.00 -0.57 0.00 0.00 43.02 39.42 3pch s PHE 356 CO -0.09 0.31 1.06 0.20 -0.10 0.00 0.00 175.22 176.60 3pch s GLY 357 N -1.35 1.83 0.37 4.36 0.00 -1.26 -4.95 107.32 106.32 3pch s GLY 357 Ca 0.45 0.22 0.08 0.00 0.00 0.00 0.00 44.72 45.47 3pch s GLY 357 CO 0.29 0.54 1.93 0.00 0.00 0.00 0.00 173.10 175.86 3pch h ALA 358 N -0.38 1.78 -0.18 3.20 0.00 -2.02 -2.68 119.26 118.98 3pch h ALA 358 Ca -0.45 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 3pch h ALA 358 Cb 1.22 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 3pch h ALA 358 CO 0.56 0.07 -0.34 0.72 0.00 0.00 0.00 179.25 180.26 3pch n HIS 359 N -4.50 0.56 -0.19 0.00 8.25 -1.26 -4.75 115.22 113.32 3pch n HIS 359 Ca 0.13 -1.59 0.08 0.00 -0.26 0.00 0.00 57.72 56.08 3pch n HIS 359 Cb 0.32 -0.36 0.37 0.00 1.12 0.00 0.00 29.99 31.43 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 1.05 0.64 -0.58 0.41 3.32 -1.75 -1.50 116.42 118.01 3pch h ASP 360 Ca 0.11 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.17 3pch h ASP 360 Cb 1.28 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.71 3pch h ASP 360 CO 0.19 0.40 0.00 0.00 -1.72 0.00 0.00 179.24 178.12 3pch n HIS 361 N -4.49 0.77 -3.90 4.55 1.44 -1.10 -2.40 115.22 110.10 3pch n HIS 361 Ca 0.12 -0.39 -0.32 0.00 -2.01 0.00 0.00 57.72 55.12 3pch n HIS 361 Cb 0.27 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.25 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 -1.14 4.60 0.00 4.39 -1.08 -0.57 -1.94 116.67 120.93 3pch s ASP 362 Ca 0.43 -2.85 0.10 0.00 -0.52 0.00 0.00 52.55 49.71 3pch s ASP 362 Cb 0.23 -1.69 0.48 0.00 -1.46 0.00 0.00 42.92 40.48 3pch s ASP 362 CO 0.31 -0.29 1.24 0.18 0.52 0.00 0.00 175.17 177.13 3pch n LEU 363 N 3.37 0.00 0.12 -1.34 4.32 0.50 -0.89 117.00 123.09 3pch n LEU 363 Ca 0.05 0.35 0.06 0.00 -0.02 0.00 0.00 56.01 56.45 3pch n LEU 363 Cb 0.35 -0.35 0.03 0.00 -1.62 0.00 0.00 43.42 41.82 3pch n LEU 363 CO 0.32 -0.24 0.27 -0.07 -1.22 0.00 0.00 177.39 176.46 3pch h LEU 364 N 0.00 0.00 -0.11 2.23 4.07 -1.92 -3.39 115.31 116.20 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 0.12 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.86 3pch h LEU 364 CO 0.00 0.31 0.00 0.18 -1.08 0.00 0.00 178.44 177.85 3pch n LEU 365 N -3.01 0.11 -0.08 1.67 4.77 -0.61 -4.57 117.00 115.28 3pch n LEU 365 Ca -0.01 -0.48 0.12 0.00 -0.03 0.00 0.00 56.01 55.61 3pch n LEU 365 Cb 0.68 0.00 0.70 0.00 -2.33 0.00 0.00 43.42 42.46 3pch n LEU 365 CO 0.40 0.03 0.95 -0.46 -1.33 0.00 0.00 177.39 176.97 3pch n ASN 366 N -0.75 0.24 0.00 -1.43 0.23 -0.07 -5.02 115.26 108.46 3pch n ASN 366 Ca 0.00 -1.28 0.00 0.00 -0.53 0.00 0.00 54.58 52.77 3pch n ASN 366 Cb 0.00 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 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 -0.72 0.00 0.00 -2.53 7.35 -1.26 -4.94 117.46 115.36 3pch n PHE 367 Ca 0.19 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.88 3pch n PHE 367 Cb 0.12 0.23 0.00 0.00 0.35 0.00 0.00 39.48 40.18 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 2.19 0.00 3.77 7.13 0.00 -1.26 -4.30 105.19 112.72 3pch n GLY 371 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 0.00 3.93 0.80 0.99 2.96 -1.26 -4.83 118.68 121.27 3pch s LEU 372 Ca 0.00 0.26 -0.12 0.00 -0.22 0.00 0.00 54.13 54.05 3pch s LEU 372 Cb 0.00 -2.00 0.08 0.00 0.50 0.00 0.00 46.19 44.77 3pch s LEU 372 CO 0.00 0.37 1.14 -2.84 -1.32 0.00 0.00 176.35 173.70 3pch s PRO 373 N -1.10 1.83 0.03 0.98 0.02 -1.26 -4.79 135.00 130.71 3pch s PRO 373 Ca 0.16 1.48 -0.12 0.00 0.02 0.00 0.00 61.00 62.54 3pch s PRO 373 Cb -0.12 -1.82 -0.06 0.00 0.02 0.00 0.00 34.50 32.52 3pch s PRO 373 CO 0.05 -2.02 0.39 0.42 -0.33 0.00 0.00 177.00 175.51 3pch s ILE 374 N -2.52 5.09 0.00 2.83 1.01 -1.26 -5.00 121.20 121.35 3pch s ILE 374 Ca 0.67 0.61 0.00 0.00 0.00 0.00 0.00 60.65 61.93 3pch s ILE 374 Cb -0.23 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.59 3pch s ILE 374 CO 0.52 0.44 0.00 0.61 0.00 0.00 0.00 174.94 176.52 3pch n GLY 375 N 1.39 2.46 3.62 6.18 0.00 -1.26 -4.43 105.19 113.15 3pch n GLY 375 Ca -0.11 -1.96 -0.43 0.00 0.00 0.00 0.00 46.02 43.52 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 -1.76 3.72 0.05 1.61 2.02 -1.26 -4.90 118.70 118.19 3pch s GLU 376 Ca 0.00 1.37 -0.31 0.00 0.02 0.00 0.00 54.97 56.05 3pch s GLU 376 Cb 0.00 -4.01 -0.07 0.00 0.10 0.00 0.00 34.13 30.15 3pch s GLU 376 CO 0.00 -1.38 1.43 1.03 0.02 0.00 0.00 175.26 176.36 3pch s ARG 377 N 4.72 4.29 -0.04 1.61 0.52 -1.26 -1.21 118.95 127.57 3pch s ARG 377 Ca 0.66 2.04 -0.11 0.00 -0.52 0.00 0.00 55.73 57.80 3pch s ARG 377 Cb -0.20 -3.47 0.02 0.00 0.52 0.00 0.00 34.95 31.82 3pch s ARG 377 CO 0.29 -0.54 0.26 0.96 0.02 0.00 0.00 175.30 176.28 3pch s ILE 378 N 1.98 0.04 -0.12 1.52 -4.36 0.69 -2.31 121.20 118.64 3pch s ILE 378 Ca 0.65 -0.37 -0.06 0.00 -0.26 0.00 0.00 60.65 60.61 3pch s ILE 378 Cb -0.34 -0.50 -0.04 0.00 1.25 0.00 0.00 42.46 42.83 3pch s ILE 378 CO 0.28 -0.20 0.11 -0.63 0.24 0.00 0.00 174.94 174.75 3pch s ILE 379 N -0.84 5.28 -0.24 8.37 1.01 0.06 -0.25 121.20 134.59 3pch s ILE 379 Ca -0.09 0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.71 3pch s ILE 379 Cb -0.05 -3.30 0.05 0.00 0.01 0.00 0.00 42.46 39.18 3pch s ILE 379 CO 0.02 0.61 -0.11 -0.69 0.00 0.00 0.00 174.94 174.77 3pch s VAL 380 N -0.93 2.02 0.15 2.92 1.01 0.10 -1.00 120.40 124.69 3pch s VAL 380 Ca 0.14 -1.44 0.01 0.00 0.00 0.00 0.00 61.98 60.69 3pch s VAL 380 Cb -0.12 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 3pch s VAL 380 CO 0.03 0.05 -0.01 0.00 0.00 0.00 0.00 175.10 175.18 3pch s ALA 381 N 1.19 1.22 0.00 5.51 0.00 -0.56 0.01 121.76 129.13 3pch s ALA 381 Ca -0.06 -1.53 0.00 0.00 0.00 0.00 0.00 51.96 50.37 3pch s ALA 381 Cb -0.19 0.50 0.00 0.00 0.00 0.00 0.00 23.12 23.44 3pch s ALA 381 CO -0.06 -0.32 0.00 0.41 0.00 0.00 0.00 175.76 175.79 3pch n GLY 382 N -0.19 -1.29 3.26 0.00 0.00 -1.08 -0.05 105.19 105.84 3pch n GLY 382 Ca -0.08 -0.93 -0.22 0.00 0.00 0.00 0.00 46.02 44.79 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 -0.62 1.05 -0.23 1.61 3.52 -1.26 -1.77 118.95 121.25 3pch s ARG 383 Ca 0.00 -1.13 -0.04 0.00 -0.13 0.00 0.00 55.73 54.43 3pch s ARG 383 Cb 0.00 -1.21 -0.01 0.00 -1.56 0.00 0.00 34.95 32.17 3pch s ARG 383 CO 0.00 0.28 -0.02 0.08 -0.81 0.00 0.00 175.30 174.83 3pch s VAL 384 N -1.30 3.52 0.19 7.11 1.01 0.18 -0.36 120.40 130.76 3pch s VAL 384 Ca 0.05 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.59 3pch s VAL 384 Cb -0.09 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.61 3pch s VAL 384 CO 0.04 0.39 -0.01 0.68 0.00 0.00 0.00 175.10 176.19 3pch s VAL 385 N 1.50 0.87 0.67 2.92 -7.23 0.65 -0.52 120.40 119.25 3pch s VAL 385 Ca 0.06 -2.01 0.04 0.00 -1.81 0.00 0.00 61.98 58.26 3pch s VAL 385 Cb -0.15 -2.17 0.12 0.00 0.56 0.00 0.00 36.38 34.74 3pch s VAL 385 CO -0.02 -0.45 0.93 1.51 -0.31 0.00 0.00 175.10 176.76 3pch s ASP 386 N -3.22 4.59 0.63 4.85 1.47 0.12 0.32 116.67 125.42 3pch s ASP 386 Ca 0.25 -0.67 0.40 0.00 1.18 0.00 0.00 52.55 53.71 3pch s ASP 386 Cb 0.05 0.28 2.10 0.00 -0.34 0.00 0.00 42.92 45.02 3pch s ASP 386 CO 0.05 -1.71 2.27 1.56 0.68 0.00 0.00 175.17 178.02 3pch h GLN 387 N -0.27 0.00 -0.01 2.11 4.20 -1.21 0.30 115.11 120.24 3pch h GLN 387 Ca -0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.39 3pch h GLN 387 Cb 1.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.05 3pch h GLN 387 CO 0.39 0.01 -0.05 0.66 -0.67 0.00 0.00 178.83 179.17 3pch n TYR 388 N -3.20 0.00 -0.84 2.96 4.01 -1.26 -4.89 117.16 113.94 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 0.13 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 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 1.17 0.55 3.78 2.72 0.00 0.09 -5.04 105.19 108.45 3pch n GLY 389 Ca 0.19 -0.33 -0.39 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.71 4.37 0.51 1.61 2.20 -1.25 -4.78 119.74 121.68 3pch s LYS 390 Ca 0.00 0.89 -0.21 0.00 -0.36 0.00 0.00 55.97 56.29 3pch s LYS 390 Cb 0.00 -3.30 -0.06 0.00 -1.51 0.00 0.00 37.83 32.96 3pch s LYS 390 CO 0.00 0.48 1.16 -1.25 -0.36 0.00 0.00 175.35 175.38 3pch s PRO 391 N -0.65 3.51 -0.53 4.03 0.04 -1.26 0.12 135.00 140.25 3pch s PRO 391 Ca 0.33 1.73 -0.03 0.00 0.04 0.00 0.00 61.00 63.06 3pch s PRO 391 Cb -0.20 -2.20 0.14 0.00 0.04 0.00 0.00 34.50 32.28 3pch s PRO 391 CO 0.21 -0.75 0.34 0.08 0.04 0.00 0.00 177.00 176.92 3pch s VAL 392 N -1.63 3.60 0.54 -0.36 1.01 0.32 -4.83 120.40 119.04 3pch s VAL 392 Ca 0.69 -2.52 -0.15 0.00 0.00 0.00 0.00 61.98 60.00 3pch s VAL 392 Cb -0.27 -3.39 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 3pch s VAL 392 CO 0.32 -0.80 1.00 -2.16 0.00 0.00 0.00 175.10 173.45 3pch s PRO 393 N 0.51 3.87 -1.47 2.72 0.04 -1.26 -4.17 135.00 135.24 3pch s PRO 393 Ca 0.13 0.92 -0.06 0.00 0.04 0.00 0.00 61.00 62.02 3pch s PRO 393 Cb -0.21 -2.12 0.05 0.00 0.04 0.00 0.00 34.50 32.25 3pch s PRO 393 CO -0.04 -0.33 0.64 0.09 0.04 0.00 0.00 177.00 177.40 3pch n ASN 394 N -1.81 -1.83 -4.53 6.66 5.03 -0.48 -4.94 115.26 113.36 3pch n ASN 394 Ca 0.06 -0.94 -0.30 0.00 0.87 0.00 0.00 54.58 54.27 3pch n ASN 394 Cb 0.54 -3.31 -0.11 0.00 -1.02 0.00 0.00 39.78 35.88 3pch n ASN 394 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 3pch s THR 395 N -3.66 3.14 -0.19 3.41 -1.32 -1.26 -4.53 115.64 111.24 3pch s THR 395 Ca 0.27 -1.20 -0.26 0.00 -1.21 0.00 0.00 61.69 59.28 3pch s THR 395 Cb -0.14 -2.40 -0.01 0.00 -1.51 0.00 0.00 72.50 68.44 3pch s THR 395 CO 0.87 0.23 0.89 -0.22 -2.21 0.00 0.00 174.62 174.18 3pch s LEU 396 N -1.82 4.15 -0.20 9.08 2.96 -1.26 -0.91 118.68 130.68 3pch s LEU 396 Ca 0.18 1.22 -0.00 0.00 -0.22 0.00 0.00 54.13 55.30 3pch s LEU 396 Cb -0.11 -3.31 0.01 0.00 0.50 0.00 0.00 46.19 43.28 3pch s LEU 396 CO 0.09 -0.47 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.81 3pch s VAL 397 N 2.45 2.47 -0.02 1.68 1.01 -0.53 -1.45 120.40 126.01 3pch s VAL 397 Ca 0.40 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.61 3pch s VAL 397 Cb -0.16 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.11 3pch s VAL 397 CO 0.11 0.48 -0.23 -1.61 0.00 0.00 0.00 175.10 173.85 3pch s GLU 398 N 1.34 1.92 0.06 2.72 2.02 0.28 -0.73 118.70 126.31 3pch s GLU 398 Ca 0.05 -0.81 0.01 0.00 0.02 0.00 0.00 54.97 54.24 3pch s GLU 398 Cb -0.14 -1.81 -0.03 0.00 0.10 0.00 0.00 34.13 32.25 3pch s GLU 398 CO -0.10 0.46 -0.06 0.00 0.02 0.00 0.00 175.26 175.59 3pch s MET 399 N -0.46 0.59 -0.02 1.61 0.23 0.14 -0.59 119.30 120.81 3pch s MET 399 Ca 0.07 -0.98 -0.18 0.00 -1.03 0.00 0.00 55.69 53.56 3pch s MET 399 Cb -0.09 -0.10 0.03 0.00 -1.53 0.00 0.00 34.83 33.14 3pch s MET 399 CO -0.00 -0.02 0.39 1.67 -2.03 0.00 0.00 175.02 175.03 3pch s TRP 400 N -2.52 -0.28 0.26 3.16 -2.14 -0.73 -1.30 118.94 115.39 3pch s TRP 400 Ca -0.02 0.43 -0.20 0.00 2.66 0.00 0.00 56.10 58.97 3pch s TRP 400 Cb -0.02 0.16 0.06 0.00 -3.10 0.00 0.00 33.47 30.57 3pch s TRP 400 CO -0.03 -0.44 0.90 1.14 -2.66 0.00 0.00 176.95 175.86 3pch s GLN 401 N -1.37 1.65 0.80 3.25 -2.07 -0.72 0.06 119.66 121.26 3pch s GLN 401 Ca -0.13 -1.02 -0.05 0.00 -1.82 0.00 0.00 55.36 52.34 3pch s GLN 401 Cb -0.04 0.49 0.17 0.00 -1.09 0.00 0.00 33.01 32.54 3pch s GLN 401 CO 0.05 -0.77 1.09 0.00 -1.32 0.00 0.00 175.29 174.35 3pch n ALA 402 N -0.57 -0.34 -2.05 2.60 0.00 -1.26 -4.62 120.51 114.26 3pch n ALA 402 Ca -0.05 -1.87 -0.06 0.00 0.00 0.00 0.00 53.44 51.46 3pch n ALA 402 Cb 0.60 0.19 0.03 0.00 0.00 0.00 0.00 19.45 20.27 3pch n ALA 402 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3pch n ASN 403 N -3.20 0.25 0.29 0.00 0.23 -0.15 -4.54 115.26 108.13 3pch n ASN 403 Ca 0.16 -1.24 0.14 0.00 -0.53 0.00 0.00 54.58 53.11 3pch n ASN 403 Cb 0.58 -0.18 0.87 0.00 -2.08 0.00 0.00 39.78 38.97 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 -0.86 1.59 -0.01 -2.53 0.00 -1.77 -0.32 119.26 115.37 3pch h ALA 404 Ca -0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3pch h ALA 404 Cb 0.30 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3pch h ALA 404 CO 0.08 0.01 -0.27 0.41 0.00 0.00 0.00 179.25 179.48 3pch n GLY 405 N -1.33 -0.64 1.65 0.00 0.00 -1.26 -3.38 105.19 100.23 3pch n GLY 405 Ca -0.03 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.59 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 1.35 0.58 3.63 -0.02 0.00 -0.23 -4.80 105.19 105.69 3pch n GLY 406 Ca 0.12 -0.81 -0.35 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.62 3.98 0.03 1.61 6.06 -1.26 -4.73 118.95 122.03 3pch s ARG 407 Ca 0.00 -0.33 -0.13 0.00 -2.50 0.00 0.00 55.73 52.77 3pch s ARG 407 Cb 0.00 -3.33 -0.06 0.00 0.06 0.00 0.00 34.95 31.63 3pch s ARG 407 CO 0.00 0.17 0.41 0.71 -2.50 0.00 0.00 175.30 174.09 3pch s TYR 408 N 0.67 3.67 -1.24 5.12 2.02 -1.26 -0.98 117.35 125.35 3pch s TYR 408 Ca 0.05 0.91 -0.12 0.00 -0.37 0.00 0.00 57.07 57.54 3pch s TYR 408 Cb -0.13 -2.24 0.16 0.00 -0.40 0.00 0.00 41.96 39.36 3pch s TYR 408 CO 0.01 0.59 1.60 -2.13 -1.57 0.00 0.00 175.55 174.06 3pch n ARG 409 N 1.45 3.43 -3.72 -0.62 0.63 -1.26 -4.74 116.66 111.83 3pch n ARG 409 Ca -0.12 -3.71 -0.12 0.00 -0.92 0.00 0.00 57.85 52.99 3pch n ARG 409 Cb 0.52 -3.03 -0.10 0.00 0.45 0.00 0.00 32.46 30.30 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 1.33 -0.50 0.28 -0.14 2.46 -1.26 -5.06 115.29 112.40 3pch s HIS 410 Ca 0.42 1.17 0.02 0.00 0.47 0.00 0.00 55.06 57.14 3pch s HIS 410 Cb 0.02 0.19 0.65 0.00 -0.13 0.00 0.00 32.58 33.31 3pch s HIS 410 CO 0.01 -0.25 1.73 1.57 -2.47 0.00 0.00 174.74 175.32 3pch h LYS 411 N 5.92 0.49 0.00 2.88 2.10 -2.07 -0.22 116.57 125.67 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 0.26 0.32 0.00 0.09 -2.00 0.00 0.00 179.45 178.12 3pch n ASN 412 N -4.96 0.00 -4.56 7.07 5.03 -1.26 -4.63 115.26 111.94 3pch n ASN 412 Ca 0.20 -0.05 -0.41 0.00 0.87 0.00 0.00 54.58 55.19 3pch n ASN 412 Cb 0.57 -0.23 -0.08 0.00 -1.02 0.00 0.00 39.78 39.01 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 -2.47 6.33 -0.14 6.41 2.15 -0.10 -4.89 116.67 123.96 3pch s ASP 413 Ca 0.17 0.04 0.16 0.00 0.43 0.00 0.00 52.55 53.35 3pch s ASP 413 Cb 0.11 -2.27 0.42 0.00 -0.30 0.00 0.00 42.92 40.88 3pch s ASP 413 CO 0.24 -0.47 1.32 0.54 -0.17 0.00 0.00 175.17 176.63 3pch n ARG 414 N 5.74 2.51 -2.05 4.34 5.12 -1.26 -4.90 116.66 126.15 3pch n ARG 414 Ca -0.04 -2.64 -0.41 0.00 -1.93 0.00 0.00 57.85 52.83 3pch n ARG 414 Cb 0.49 -1.66 -0.02 0.00 -1.16 0.00 0.00 32.46 30.11 3pch n ARG 414 CO 0.00 0.00 0.00 -0.47 -1.93 0.00 0.00 177.63 175.23 3pch s TYR 415 N -2.58 2.99 0.61 -1.55 5.04 -1.26 -4.90 117.35 115.71 3pch s TYR 415 Ca 0.36 1.26 0.33 0.00 -2.44 0.00 0.00 57.07 56.57 3pch s TYR 415 Cb 0.29 -3.76 1.91 0.00 0.35 0.00 0.00 41.96 40.74 3pch s TYR 415 CO 0.08 -2.24 2.22 1.37 -1.34 0.00 0.00 175.55 175.63 3pch h LEU 416 N 3.91 0.00 -9.91 6.97 -0.00 -1.98 -3.44 115.31 110.86 3pch h LEU 416 Ca -0.48 0.00 -0.54 0.00 -0.00 0.00 0.00 57.88 56.86 3pch h LEU 416 Cb 1.22 0.00 0.10 0.00 -0.00 0.00 0.00 40.66 41.98 3pch h LEU 416 CO 0.69 0.00 0.80 0.00 -0.00 0.00 0.00 178.44 179.94 3pch s ALA 417 N -4.50 3.61 0.74 0.17 0.00 -1.26 -4.95 121.76 115.57 3pch s ALA 417 Ca -0.05 1.57 -0.11 0.00 0.00 0.00 0.00 51.96 53.37 3pch s ALA 417 Cb 0.14 -3.62 0.04 0.00 0.00 0.00 0.00 23.12 19.68 3pch s ALA 417 CO 0.50 -1.03 1.09 -1.25 0.00 0.00 0.00 175.76 175.07 3pch s PRO 418 N -1.70 2.49 0.46 0.00 0.04 -1.26 -4.79 135.00 130.24 3pch s PRO 418 Ca 0.55 1.18 -0.14 0.00 0.04 0.00 0.00 61.00 62.63 3pch s PRO 418 Cb -0.47 -1.92 -0.07 0.00 0.04 0.00 0.00 34.50 32.08 3pch s PRO 418 CO 0.59 -1.47 0.89 -0.51 0.04 0.00 0.00 177.00 176.55 3pch s LEU 419 N -5.63 3.72 -0.33 -3.56 1.43 -1.26 -4.73 118.68 108.32 3pch s LEU 419 Ca 0.62 1.38 -0.10 0.00 -1.03 0.00 0.00 54.13 55.00 3pch s LEU 419 Cb -0.17 -4.29 0.01 0.00 0.03 0.00 0.00 46.19 41.76 3pch s LEU 419 CO 0.53 -0.50 0.17 -0.62 0.23 0.00 0.00 176.35 176.16 3pch s ASP 420 N -3.08 5.61 0.56 2.29 -1.08 -1.26 -4.98 116.67 114.74 3pch s ASP 420 Ca 0.56 -0.71 0.32 0.00 -0.52 0.00 0.00 52.55 52.20 3pch s ASP 420 Cb -0.10 -2.01 1.46 0.00 -1.46 0.00 0.00 42.92 40.82 3pch s ASP 420 CO 0.31 -0.27 1.83 1.55 0.52 0.00 0.00 175.17 179.12 3pch h PRO 421 N 8.38 0.00 -0.53 4.34 0.13 -1.97 0.16 132.00 142.52 3pch h PRO 421 Ca -0.30 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.65 3pch h PRO 421 Cb 1.13 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.15 3pch h PRO 421 CO 0.63 0.00 0.14 0.09 -0.23 0.00 0.00 178.00 178.64 3pch n ASN 422 N -4.00 3.75 -3.77 1.44 4.13 -1.26 -4.93 115.26 110.61 3pch n ASN 422 Ca 0.17 -3.39 -0.21 0.00 1.68 0.00 0.00 54.58 52.84 3pch n ASN 422 Cb 0.97 -0.67 -0.17 0.00 -1.54 0.00 0.00 39.78 38.37 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 -3.07 0.47 -0.05 3.10 5.36 0.56 -4.05 117.98 120.31 3pch s PHE 423 Ca 0.49 -0.04 -0.03 0.00 -0.96 0.00 0.00 56.93 56.38 3pch s PHE 423 Cb 0.41 -0.64 -0.01 0.00 -0.34 0.00 0.00 43.02 42.44 3pch s PHE 423 CO 0.08 -0.25 -0.06 0.78 -1.46 0.00 0.00 175.22 174.31 3pch h GLY 424 N 8.04 0.00 0.00 13.12 0.00 -1.83 -3.42 103.07 118.97 3pch h GLY 424 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.09 3pch h GLY 424 CO 0.30 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.45 3pch n GLY 425 N 1.72 1.38 3.22 4.60 0.00 -1.26 -4.44 105.19 110.41 3pch n GLY 425 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 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 1.83 0.03 1.61 1.01 -1.26 -1.75 120.40 119.87 3pch s VAL 426 Ca 0.00 -0.95 -0.06 0.00 0.00 0.00 0.00 61.98 60.98 3pch s VAL 426 Cb 0.00 -1.55 -0.01 0.00 0.00 0.00 0.00 36.38 34.82 3pch s VAL 426 CO 0.00 0.51 0.10 -0.83 0.00 0.00 0.00 175.10 174.88 3pch s GLY 427 N -0.13 0.16 -0.03 4.51 0.00 -0.42 -4.77 107.32 106.65 3pch s GLY 427 Ca -0.03 -0.51 -0.11 0.00 0.00 0.00 0.00 44.72 44.08 3pch s GLY 427 CO 0.03 -0.64 0.24 1.09 0.00 0.00 0.00 173.10 173.81 3pch s ARG 428 N -2.44 0.52 -0.27 2.90 1.70 -1.01 0.28 118.95 120.63 3pch s ARG 428 Ca -0.06 -0.15 -0.21 0.00 -0.47 0.00 0.00 55.73 54.84 3pch s ARG 428 Cb -0.02 0.23 0.07 0.00 -0.57 0.00 0.00 34.95 34.66 3pch s ARG 428 CO -0.04 -0.13 0.69 0.00 -1.08 0.00 0.00 175.30 174.74 3pch s LEU 430 N 0.90 4.35 0.55 0.00 2.96 -1.26 -1.46 118.68 124.72 3pch s LEU 430 Ca -0.04 0.77 -0.19 0.00 -0.22 0.00 0.00 54.13 54.44 3pch s LEU 430 Cb -0.05 -2.53 -0.06 0.00 0.50 0.00 0.00 46.19 44.05 3pch s LEU 430 CO -0.08 0.17 1.14 0.42 -1.32 0.00 0.00 176.35 176.69 3pch s THR 431 N -0.16 3.11 0.44 3.68 -4.23 -0.09 -4.85 115.64 113.54 3pch s THR 431 Ca 0.22 0.70 -0.07 0.00 -1.18 0.00 0.00 61.69 61.35 3pch s THR 431 Cb -0.15 -3.28 0.10 0.00 1.34 0.00 0.00 72.50 70.51 3pch s THR 431 CO 0.09 -0.15 0.60 -0.90 -0.54 0.00 0.00 174.62 173.72 3pch n ASP 432 N -1.30 0.03 0.21 3.99 5.68 0.59 -1.39 116.55 124.36 3pch n ASP 432 Ca 0.12 -1.21 0.18 0.00 -0.50 0.00 0.00 54.79 53.37 3pch n ASP 432 Cb 0.51 -0.46 0.84 0.00 -1.14 0.00 0.00 41.12 40.87 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 -0.79 0.00 -0.70 -1.12 0.02 -1.94 0.18 113.55 109.20 3pch h SER 433 Ca -0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.76 3pch h SER 433 Cb 0.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.07 3pch h SER 433 CO 0.14 0.00 0.00 0.47 -1.14 0.00 0.00 176.83 176.30 3pch n ASP 434 N -3.64 3.98 -0.21 3.07 8.00 -1.26 -4.61 116.55 121.88 3pch n ASP 434 Ca 0.02 -2.05 -0.03 0.00 0.71 0.00 0.00 54.79 53.45 3pch n ASP 434 Cb 0.37 -0.48 -0.01 0.00 -0.02 0.00 0.00 41.12 40.98 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 1.52 0.60 3.89 0.44 0.00 0.05 -4.71 105.19 106.98 3pch n GLY 435 Ca 0.24 -0.94 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 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 -2.10 3.53 0.10 1.61 2.02 -1.26 0.52 117.35 121.77 3pch s TYR 436 Ca 0.00 0.54 0.00 0.00 -0.37 0.00 0.00 57.07 57.25 3pch s TYR 436 Cb 0.00 -1.98 -0.04 0.00 -0.40 0.00 0.00 41.96 39.54 3pch s TYR 436 CO 0.00 0.54 -0.02 1.52 -1.57 0.00 0.00 175.55 176.01 3pch s TYR 437 N -1.46 0.80 -0.12 2.71 1.13 -0.73 -0.30 117.35 119.38 3pch s TYR 437 Ca 0.34 -1.03 -0.28 0.00 -1.41 0.00 0.00 57.07 54.69 3pch s TYR 437 Cb -0.13 -0.49 0.07 0.00 -1.10 0.00 0.00 41.96 40.31 3pch s TYR 437 CO 0.21 -0.30 0.66 -1.54 -2.51 0.00 0.00 175.55 172.08 3pch s SER 438 N -3.02 -0.65 0.08 -0.18 1.04 -1.26 -2.63 113.70 107.08 3pch s SER 438 Ca 0.14 0.92 0.05 0.00 0.48 0.00 0.00 55.95 57.54 3pch s SER 438 Cb 0.07 0.83 -0.03 0.00 0.10 0.00 0.00 66.02 66.99 3pch s SER 438 CO -0.04 -0.47 -0.14 -0.36 0.98 0.00 0.00 173.24 173.21 3pch s PHE 439 N -0.65 1.27 -0.10 5.02 0.08 0.10 -4.88 117.98 118.82 3pch s PHE 439 Ca -0.07 -0.49 0.02 0.00 0.12 0.00 0.00 56.93 56.51 3pch s PHE 439 Cb -0.02 -0.70 0.01 0.00 -0.57 0.00 0.00 43.02 41.74 3pch s PHE 439 CO 0.06 0.08 -0.15 0.50 -0.10 0.00 0.00 175.22 175.61 3pch s ARG 440 N -2.02 2.17 0.19 0.44 3.52 -0.82 0.03 118.95 122.45 3pch s ARG 440 Ca 0.01 -0.55 -0.07 0.00 -0.13 0.00 0.00 55.73 54.99 3pch s ARG 440 Cb -0.08 -1.81 0.03 0.00 -1.56 0.00 0.00 34.95 31.53 3pch s ARG 440 CO 0.02 -0.02 0.37 -2.37 -0.81 0.00 0.00 175.30 172.50 3pch n THR 441 N 4.04 0.00 -4.06 4.11 5.66 0.66 -0.37 114.28 124.32 3pch n THR 441 Ca -0.20 -0.47 -0.30 0.00 -3.05 0.00 0.00 64.05 60.03 3pch n THR 441 Cb 0.52 0.47 -0.07 0.00 -1.55 0.00 0.00 70.33 69.70 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 -2.57 4.49 -0.06 1.09 -4.36 -1.26 -0.22 121.20 118.30 3pch s ILE 442 Ca 0.08 -0.78 -0.30 0.00 -0.26 0.00 0.00 60.65 59.39 3pch s ILE 442 Cb -0.02 -3.16 -0.05 0.00 1.25 0.00 0.00 42.46 40.48 3pch s ILE 442 CO 0.06 0.13 1.51 -0.75 0.24 0.00 0.00 174.94 176.13 3pch s LYS 443 N -2.37 4.21 0.61 0.37 2.20 -0.35 -4.92 119.74 119.49 3pch s LYS 443 Ca 0.29 2.03 -0.18 0.00 -0.36 0.00 0.00 55.97 57.75 3pch s LYS 443 Cb -0.12 -3.83 -0.03 0.00 -1.51 0.00 0.00 37.83 32.34 3pch s LYS 443 CO 0.22 -0.75 1.16 -1.25 -0.36 0.00 0.00 175.35 174.36 3pch s PRO 444 N 3.51 2.98 0.30 4.03 0.04 -1.26 -4.34 135.00 140.26 3pch s PRO 444 Ca 0.67 1.64 -0.02 0.00 0.04 0.00 0.00 61.00 63.33 3pch s PRO 444 Cb -0.31 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 3pch s PRO 444 CO 0.26 -1.15 0.53 0.20 0.04 0.00 0.00 177.00 176.87 3pch s GLY 445 N -1.94 1.66 0.98 0.56 0.00 -0.59 -4.68 107.32 103.32 3pch s GLY 445 Ca 0.73 -0.73 -0.12 0.00 0.00 0.00 0.00 44.72 44.60 3pch s GLY 445 CO 0.34 -0.65 1.08 2.56 0.00 0.00 0.00 173.10 176.44 3pch s PRO 446 N -3.80 0.55 -0.08 2.90 0.04 -1.26 -4.10 135.00 129.24 3pch s PRO 446 Ca 0.42 0.92 -0.19 0.00 0.04 0.00 0.00 61.00 62.19 3pch s PRO 446 Cb -0.10 -1.72 0.04 0.00 0.04 0.00 0.00 34.50 32.76 3pch s PRO 446 CO 0.32 -2.76 0.45 1.52 0.04 0.00 0.00 177.00 176.58 3pch s TYR 447 N -2.76 -0.41 0.31 0.56 1.13 -1.09 -4.21 117.35 110.88 3pch s TYR 447 Ca 0.65 0.83 -0.27 0.00 -1.41 0.00 0.00 57.07 56.87 3pch s TYR 447 Cb -0.21 0.19 -0.10 0.00 -1.10 0.00 0.00 41.96 40.75 3pch s TYR 447 CO 0.59 -0.38 0.97 -1.25 -2.51 0.00 0.00 175.55 172.97 3pch s PRO 448 N -0.71 4.61 0.03 -3.49 0.04 -1.26 0.03 135.00 134.25 3pch s PRO 448 Ca -0.08 1.43 -0.00 0.00 0.04 0.00 0.00 61.00 62.39 3pch s PRO 448 Cb -0.03 -2.92 -0.03 0.00 0.04 0.00 0.00 34.50 31.56 3pch s PRO 448 CO 0.04 0.28 -0.03 1.67 0.04 0.00 0.00 177.00 179.00 3pch s TRP 449 N -1.47 0.36 -1.20 0.56 1.48 -0.73 -4.90 118.94 113.03 3pch s TRP 449 Ca 0.48 -0.71 -0.18 0.00 -1.06 0.00 0.00 56.10 54.63 3pch s TRP 449 Cb -0.22 -0.26 0.09 0.00 -1.16 0.00 0.00 33.47 31.91 3pch s TRP 449 CO 0.28 -0.25 1.59 1.03 -4.06 0.00 0.00 176.95 175.54 3pch s ARG 450 N -2.29 3.90 0.00 3.25 0.52 -1.26 -4.28 118.95 118.78 3pch s ARG 450 Ca -0.08 -1.90 0.00 0.00 -0.52 0.00 0.00 55.73 53.23 3pch s ARG 450 Cb -0.04 -5.38 0.00 0.00 0.52 0.00 0.00 34.95 30.05 3pch s ARG 450 CO -0.04 -2.13 0.00 -1.71 0.02 0.00 0.00 175.30 171.44 3pch n ASN 451 N 7.92 0.00 -4.36 0.23 5.15 -1.26 -5.04 115.26 117.89 3pch n ASN 451 Ca 0.42 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 54.11 3pch n ASN 451 Cb 0.47 0.00 0.15 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 -0.27 1.75 0.61 8.20 0.00 -1.26 -4.94 107.32 111.41 3pch s GLY 452 Ca 0.00 -1.20 0.36 0.00 0.00 0.00 0.00 44.72 43.88 3pch s GLY 452 CO 0.00 -0.52 2.27 -2.55 0.00 0.00 0.00 173.10 172.30 3pch h PRO 453 N -1.33 0.00 -1.44 2.90 0.11 -1.97 -3.28 132.00 126.99 3pch h PRO 453 Ca -0.43 0.00 -0.41 0.00 0.11 0.00 0.00 66.00 65.27 3pch h PRO 453 Cb 1.26 0.00 -0.37 0.00 0.11 0.00 0.00 31.00 31.99 3pch h PRO 453 CO 0.43 0.02 -1.11 -1.71 -0.21 0.00 0.00 178.00 175.42 3pch n ASN 454 N -3.45 0.71 -4.84 -2.05 5.15 -1.26 -5.08 115.26 104.44 3pch n ASN 454 Ca -0.03 -2.93 -0.37 0.00 -0.60 0.00 0.00 54.58 50.65 3pch n ASN 454 Cb 0.11 -0.35 -0.06 0.00 -0.53 0.00 0.00 39.78 38.96 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 -2.54 6.76 -0.02 1.20 1.01 -1.24 -5.05 116.67 116.79 3pch s ASP 455 Ca 0.34 0.92 -0.00 0.00 0.71 0.00 0.00 52.55 54.51 3pch s ASP 455 Cb 0.39 -2.23 0.03 0.00 1.01 0.00 0.00 42.92 42.11 3pch s ASP 455 CO -0.04 0.28 0.04 0.26 0.21 0.00 0.00 175.17 175.92 3pch s TRP 456 N -1.17 0.04 0.10 4.23 0.52 -1.26 -1.78 118.94 119.62 3pch s TRP 456 Ca 0.26 0.16 -0.30 0.00 0.02 0.00 0.00 56.10 56.24 3pch s TRP 456 Cb -0.16 -0.29 -0.06 0.00 -1.15 0.00 0.00 33.47 31.81 3pch s TRP 456 CO 0.14 -0.11 1.10 1.03 0.02 0.00 0.00 176.95 179.13 3pch s ARG 457 N 1.32 4.54 0.89 4.98 1.81 0.10 -4.78 118.95 127.82 3pch s ARG 457 Ca -0.06 1.66 -0.11 0.00 -1.72 0.00 0.00 55.73 55.50 3pch s ARG 457 Cb -0.13 -3.34 0.13 0.00 -0.45 0.00 0.00 34.95 31.16 3pch s ARG 457 CO -0.03 -0.05 1.16 -2.14 -0.68 0.00 0.00 175.30 173.56 3pch s PRO 458 N 0.39 1.13 0.24 3.54 0.02 -1.26 -2.66 135.00 136.40 3pch s PRO 458 Ca 0.53 1.60 -0.31 0.00 0.02 0.00 0.00 61.00 62.84 3pch s PRO 458 Cb -0.27 -1.74 -0.12 0.00 0.02 0.00 0.00 34.50 32.39 3pch s PRO 458 CO 0.31 -2.56 1.59 0.00 -0.33 0.00 0.00 177.00 176.02 3pch n ALA 459 N -4.04 2.20 -3.18 -1.55 0.00 -1.26 -4.72 120.51 107.95 3pch n ALA 459 Ca 0.12 0.40 -0.13 0.00 0.00 0.00 0.00 53.44 53.83 3pch n ALA 459 Cb 0.52 -2.43 -0.06 0.00 0.00 0.00 0.00 19.45 17.48 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 0.43 -0.31 -0.10 0.00 -3.43 -1.26 -4.20 115.29 106.43 3pch s HIS 460 Ca 0.70 0.25 0.04 0.00 -0.80 0.00 0.00 55.06 55.24 3pch s HIS 460 Cb -0.55 0.27 0.00 0.00 -1.43 0.00 0.00 32.58 30.87 3pch s HIS 460 CO 0.43 -0.62 -0.22 0.42 -2.00 0.00 0.00 174.74 172.75 3pch s ILE 461 N -2.69 1.96 0.21 -5.38 1.01 -0.56 -4.59 121.20 111.15 3pch s ILE 461 Ca -0.04 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.36 3pch s ILE 461 Cb -0.00 -1.70 -0.08 0.00 0.01 0.00 0.00 42.46 40.68 3pch s ILE 461 CO -0.04 0.54 0.99 -1.00 0.00 0.00 0.00 174.94 175.43 3pch s HIS 462 N 0.44 3.84 0.07 3.97 3.76 0.11 -0.02 115.29 127.46 3pch s HIS 462 Ca -0.17 1.82 0.06 0.00 -0.15 0.00 0.00 55.06 56.62 3pch s HIS 462 Cb -0.17 -3.08 -0.03 0.00 1.11 0.00 0.00 32.58 30.41 3pch s HIS 462 CO 0.07 0.13 -0.17 -0.06 -0.85 0.00 0.00 174.74 173.86 3pch s PHE 463 N -0.76 1.46 -0.03 1.40 0.40 0.07 -1.78 117.98 118.73 3pch s PHE 463 Ca 0.44 -0.41 0.01 0.00 -0.60 0.00 0.00 56.93 56.37 3pch s PHE 463 Cb -0.27 -0.83 0.02 0.00 0.51 0.00 0.00 43.02 42.45 3pch s PHE 463 CO 0.33 0.10 -0.04 0.20 0.70 0.00 0.00 175.22 176.51 3pch s GLY 464 N -1.57 0.39 -0.04 4.36 0.00 0.24 -0.01 107.32 110.69 3pch s GLY 464 Ca 0.02 -0.07 0.01 0.00 0.00 0.00 0.00 44.72 44.69 3pch s GLY 464 CO 0.03 0.31 -0.05 -0.42 0.00 0.00 0.00 173.10 172.97 3pch s ILE 465 N 0.69 0.54 -0.06 0.90 1.09 0.01 -0.55 121.20 123.82 3pch s ILE 465 Ca -0.09 -0.13 -0.06 0.00 -1.10 0.00 0.00 60.65 59.27 3pch s ILE 465 Cb -0.12 -0.57 -0.03 0.00 -1.06 0.00 0.00 42.46 40.68 3pch s ILE 465 CO -0.00 0.23 0.28 0.77 -0.10 0.00 0.00 174.94 176.11 3pch h SER 466 N 7.16 -0.19 -3.89 3.58 4.64 -1.53 0.35 113.55 123.67 3pch h SER 466 Ca -0.38 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 60.96 3pch h SER 466 Cb 1.15 0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3pch h SER 466 CO 0.47 0.22 -0.01 0.61 -0.87 0.00 0.00 176.83 177.25 3pch n GLY 467 N 1.18 -2.14 0.00 -0.77 0.00 -1.26 -2.22 105.19 99.98 3pch n GLY 467 Ca -0.03 -1.46 0.12 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.60 0.11 -3.85 1.61 -0.04 -1.26 -4.89 135.00 126.09 3pch n PRO 468 Ca 0.00 0.08 -0.07 0.00 -0.04 0.00 0.00 63.50 63.46 3pch n PRO 468 Cb 0.02 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.97 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 -2.86 -0.20 0.36 3.54 1.04 -1.26 -3.74 113.70 110.58 3pch s SER 469 Ca 0.15 -0.73 0.27 0.00 0.48 0.00 0.00 55.95 56.12 3pch s SER 469 Cb 0.16 0.76 1.03 0.00 0.10 0.00 0.00 66.02 68.07 3pch s SER 469 CO 0.42 -1.43 1.80 0.16 0.98 0.00 0.00 173.24 175.17 3pch h ILE 470 N 2.00 0.00 -0.21 -1.02 3.07 -1.29 -1.68 117.51 118.38 3pch h ILE 470 Ca -0.22 -0.42 -0.10 0.00 1.55 0.00 0.00 64.86 65.67 3pch h ILE 470 Cb 1.25 1.29 -0.01 0.00 -0.27 0.00 0.00 36.82 39.08 3pch h ILE 470 CO 0.27 0.00 -0.30 0.00 -1.05 0.00 0.00 178.15 177.07 3pch h ALA 471 N 2.19 1.09 0.00 0.16 0.00 -1.77 -3.25 119.26 117.68 3pch h ALA 471 Ca 0.00 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 3pch h ALA 471 Cb 0.51 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 3pch h ALA 471 CO 0.00 0.57 -1.12 0.25 0.00 0.00 0.00 179.25 178.95 3pch n THR 472 N -4.09 0.67 -1.57 0.00 -2.24 -0.66 -4.94 114.28 101.45 3pch n THR 472 Ca -0.01 -0.57 -0.48 0.00 -2.27 0.00 0.00 64.05 60.72 3pch n THR 472 Cb 0.43 -0.38 -0.04 0.00 -2.10 0.00 0.00 70.33 68.25 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 -2.68 1.13 -3.73 -0.78 3.00 -0.94 -4.73 118.16 109.42 3pch n LYS 473 Ca -0.02 0.40 -0.14 0.00 -0.00 0.00 0.00 58.31 58.56 3pch n LYS 473 Cb 0.59 -1.85 -0.09 0.00 0.00 0.00 0.00 35.03 33.69 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 0.72 0.56 -0.02 3.14 2.96 0.11 -5.02 118.68 121.13 3pch s LEU 474 Ca 0.70 0.42 0.08 0.00 -0.22 0.00 0.00 54.13 55.11 3pch s LEU 474 Cb -0.83 1.44 -0.02 0.00 0.50 0.00 0.00 46.19 47.28 3pch s LEU 474 CO 0.54 -0.35 -0.25 -0.63 -1.32 0.00 0.00 176.35 174.34 3pch s ILE 475 N -0.74 1.95 0.00 6.68 1.01 -1.26 -0.81 121.20 128.03 3pch s ILE 475 Ca -0.08 -1.07 0.00 0.00 0.00 0.00 0.00 60.65 59.50 3pch s ILE 475 Cb -0.04 -1.62 0.00 0.00 0.01 0.00 0.00 42.46 40.81 3pch s ILE 475 CO 0.03 0.54 0.00 1.07 0.00 0.00 0.00 174.94 176.58 3pch n THR 476 N 2.44 0.00 -3.95 2.92 5.66 0.99 -5.01 114.28 117.32 3pch n THR 476 Ca -0.16 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.71 3pch n THR 476 Cb 0.52 0.00 -0.14 0.00 -1.55 0.00 0.00 70.33 69.15 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 -1.94 0.12 -0.08 1.09 -0.21 -1.26 -0.75 119.66 116.62 3pch s GLN 477 Ca 0.00 -0.05 -0.11 0.00 0.02 0.00 0.00 55.36 55.22 3pch s GLN 477 Cb 0.00 -0.12 -0.05 0.00 1.00 0.00 0.00 33.01 33.84 3pch s GLN 477 CO 0.00 0.03 0.26 -1.17 -2.12 0.00 0.00 175.29 172.28 3pch s LEU 478 N -0.02 4.40 0.34 2.90 0.20 0.97 -4.85 118.68 122.63 3pch s LEU 478 Ca 0.00 0.65 0.10 0.00 0.69 0.00 0.00 54.13 55.56 3pch s LEU 478 Cb -0.01 -2.29 -0.06 0.00 -0.43 0.00 0.00 46.19 43.40 3pch s LEU 478 CO -0.00 0.33 -0.07 -0.31 -0.29 0.00 0.00 176.35 176.01 3pch s TYR 479 N -0.82 2.44 -0.19 5.38 2.02 0.33 -1.50 117.35 125.01 3pch s TYR 479 Ca 0.18 -0.46 -0.06 0.00 -0.37 0.00 0.00 57.07 56.35 3pch s TYR 479 Cb -0.14 -1.38 -0.03 0.00 -0.40 0.00 0.00 41.96 40.01 3pch s TYR 479 CO 0.07 0.57 0.04 -0.06 -1.57 0.00 0.00 175.55 174.60 3pch s PHE 480 N -2.57 3.15 -0.12 2.71 0.08 -1.26 0.15 117.98 120.12 3pch s PHE 480 Ca 0.33 -0.15 -0.40 0.00 0.12 0.00 0.00 56.93 56.83 3pch s PHE 480 Cb 0.01 -2.09 -0.17 0.00 -0.57 0.00 0.00 43.02 40.20 3pch s PHE 480 CO 0.17 -0.03 1.46 -1.91 -0.10 0.00 0.00 175.22 174.81 3pch n GLU 481 N 3.90 0.82 -0.08 0.44 2.13 -0.29 -1.31 120.64 126.26 3pch n GLU 481 Ca -0.17 0.30 0.00 0.00 0.66 0.00 0.00 57.16 57.95 3pch n GLU 481 Cb 0.52 -1.92 0.00 0.00 0.27 0.00 0.00 31.44 30.31 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 3.09 1.93 3.67 8.31 0.00 -1.26 -4.96 105.19 115.96 3pch n GLY 482 Ca 0.23 0.00 -0.45 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 3.89 0.25 1.61 -0.08 -0.43 -4.87 116.55 116.92 3pch n ASP 483 Ca 0.00 0.93 0.17 0.00 -1.51 0.00 0.00 54.79 54.38 3pch n ASP 483 Cb 0.00 -1.46 0.74 0.00 2.34 0.00 0.00 41.12 42.74 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 10.07 0.00 0.00 -0.67 0.13 -1.95 -2.84 132.00 136.74 3pch h PRO 484 Ca -0.49 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.56 3pch h PRO 484 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 3pch h PRO 484 CO 0.94 0.00 -0.38 -0.07 -0.23 0.00 0.00 178.00 178.26 3pch h LEU 485 N 0.00 0.00 -0.49 1.56 3.38 -1.95 -3.38 115.31 114.44 3pch h LEU 485 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 3pch h LEU 485 Cb 0.34 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.01 3pch h LEU 485 CO 0.00 0.38 -0.50 0.40 0.09 0.00 0.00 178.44 178.81 3pch h ILE 486 N 0.00 0.00 0.00 1.22 2.04 -1.88 -0.19 117.51 118.71 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 1.09 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.17 3pch h ILE 486 CO 0.05 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.39 3pch n PRO 487 N -5.05 0.12 0.00 2.37 -0.04 -1.26 -1.95 135.00 129.19 3pch n PRO 487 Ca -0.02 0.55 0.11 0.00 -0.04 0.00 0.00 63.50 64.10 3pch n PRO 487 Cb 0.29 -1.83 0.02 0.00 -0.04 0.00 0.00 33.50 31.94 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 -2.07 0.92 -2.95 0.54 2.81 -0.12 -4.93 117.12 111.32 3pch n MET 488 Ca -0.00 -0.74 -0.41 0.00 -1.81 0.00 0.00 57.70 54.74 3pch n MET 488 Cb 0.07 -1.48 -0.05 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 7.67 0.01 -0.33 0.00 0.11 -1.91 0.34 132.00 137.89 3pch h PRO 490 Ca -0.25 -0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.75 3pch h PRO 490 Cb 1.11 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3pch h PRO 490 CO 0.84 0.09 -0.22 0.82 -0.21 0.00 0.00 178.00 179.32 3pch h ILE 491 N 0.01 1.29 -0.10 4.15 2.04 -1.92 -1.83 117.51 121.16 3pch h ILE 491 Ca 0.00 -1.36 -0.00 0.00 1.00 0.00 0.00 64.86 64.50 3pch h ILE 491 Cb 0.14 1.45 -0.00 0.00 -0.74 0.00 0.00 36.82 37.66 3pch h ILE 491 CO 0.01 0.44 0.05 0.58 0.00 0.00 0.00 178.15 179.23 3pch h VAL 492 N 0.50 1.11 0.00 1.67 2.07 -1.49 -2.42 116.25 117.69 3pch h VAL 492 Ca 0.07 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.28 3pch h VAL 492 Cb 0.77 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 3pch h VAL 492 CO 0.06 0.09 0.00 0.29 0.02 0.00 0.00 177.57 178.03 3pch n LYS 493 N -4.95 0.00 0.30 1.57 5.02 0.11 -1.32 118.16 118.89 3pch n LYS 493 Ca -0.05 0.44 0.18 0.00 -2.02 0.00 0.00 58.31 56.86 3pch n LYS 493 Cb 0.09 -1.50 0.96 0.00 -0.02 0.00 0.00 35.03 34.55 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 -3.50 4.39 4.64 -0.80 -3.37 113.55 114.91 3pch h SER 494 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 3pch h SER 494 Cb 0.03 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.03 3pch h SER 494 CO 0.00 0.03 0.56 -0.63 -0.87 0.00 0.00 176.83 175.92 3pch s ILE 495 N -4.11 4.61 0.12 0.95 1.01 -0.44 -3.86 121.20 119.49 3pch s ILE 495 Ca -0.03 1.12 -0.16 0.00 0.00 0.00 0.00 60.65 61.58 3pch s ILE 495 Cb 0.12 -4.31 -0.02 0.00 0.01 0.00 0.00 42.46 38.26 3pch s ILE 495 CO 0.50 -0.53 1.60 0.00 0.00 0.00 0.00 174.94 176.51 3pch h ALA 496 N 8.49 0.50 -2.25 9.38 0.00 -1.85 -3.44 119.26 130.09 3pch h ALA 496 Ca -0.23 -0.21 -0.59 0.00 0.00 0.00 0.00 54.91 53.88 3pch h ALA 496 Cb 1.08 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.65 3pch h ALA 496 CO 0.97 0.21 0.54 1.21 0.00 0.00 0.00 179.25 182.17 3pch s ASN 497 N -6.04 6.92 0.43 0.00 3.04 -1.26 -4.96 114.94 113.07 3pch s ASN 497 Ca -0.13 1.14 0.14 0.00 0.04 0.00 0.00 52.86 54.05 3pch s ASN 497 Cb 0.10 -2.46 1.03 0.00 -1.54 0.00 0.00 41.25 38.37 3pch s ASN 497 CO 0.77 -0.53 1.97 1.55 -3.04 0.00 0.00 177.10 177.82 3pch h PRO 498 N 7.56 0.40 -0.25 0.43 0.13 -2.00 -0.16 132.00 138.12 3pch h PRO 498 Ca -0.23 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 64.81 3pch h PRO 498 Cb 1.09 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.12 3pch h PRO 498 CO 0.89 0.27 -0.13 0.93 -0.23 0.00 0.00 178.00 179.73 3pch h GLU 499 N 0.41 0.41 -0.07 0.86 5.08 -1.98 -2.75 114.58 116.55 3pch h GLU 499 Ca 0.29 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.37 3pch h GLU 499 Cb 0.58 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3pch h GLU 499 CO -0.08 0.55 -0.69 0.00 -1.00 0.00 0.00 179.01 177.78 3pch h ALA 500 N 1.48 0.68 -0.65 3.43 0.00 -1.38 -3.00 119.26 119.83 3pch h ALA 500 Ca 0.07 -0.59 0.00 0.00 0.00 0.00 0.00 54.91 54.39 3pch h ALA 500 Cb 0.46 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3pch h ALA 500 CO 0.03 0.77 0.41 0.28 0.00 0.00 0.00 179.25 180.73 3pch h VAL 501 N 0.23 1.18 -0.73 0.00 2.07 -1.23 -1.77 116.25 116.00 3pch h VAL 501 Ca -0.02 -0.37 0.14 0.00 0.82 0.00 0.00 66.70 67.26 3pch h VAL 501 Cb 1.25 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 31.23 3pch h VAL 501 CO 0.11 0.18 0.49 1.56 0.02 0.00 0.00 177.57 179.93 3pch h GLN 502 N 0.88 0.40 0.00 1.57 1.08 -1.35 -0.01 115.11 117.69 3pch h GLN 502 Ca 0.24 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.41 3pch h GLN 502 Cb -0.06 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.28 3pch h GLN 502 CO -0.05 0.27 0.00 1.96 -0.95 0.00 0.00 178.83 180.06 3pch h GLN 503 N 0.42 0.00 -0.32 1.46 4.20 -1.32 -2.40 115.11 117.15 3pch h GLN 503 Ca 0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.06 3pch h GLN 503 Cb 0.79 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.57 3pch h GLN 503 CO -0.11 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.33 3pch n LEU 504 N -2.96 3.06 -4.54 1.46 4.77 -0.02 -4.89 117.00 113.88 3pch n LEU 504 Ca -0.02 -1.29 -0.42 0.00 -0.03 0.00 0.00 56.01 54.26 3pch n LEU 504 Cb 0.14 -0.20 -0.08 0.00 -2.33 0.00 0.00 43.42 40.94 3pch n LEU 504 CO 0.21 0.65 0.17 -0.63 -1.33 0.00 0.00 177.39 176.45 3pch s ILE 505 N -1.59 5.05 0.10 -0.08 1.01 -0.91 -0.51 121.20 124.28 3pch s ILE 505 Ca 0.37 0.12 -0.30 0.00 0.00 0.00 0.00 60.65 60.84 3pch s ILE 505 Cb 0.22 -3.96 -0.06 0.00 0.01 0.00 0.00 42.46 38.66 3pch s ILE 505 CO 0.30 -0.25 1.15 0.00 0.00 0.00 0.00 174.94 176.15 3pch s ALA 506 N 2.28 3.37 -0.03 9.38 0.00 0.41 -4.83 121.76 132.34 3pch s ALA 506 Ca 0.16 0.83 -0.11 0.00 0.00 0.00 0.00 51.96 52.84 3pch s ALA 506 Cb -0.16 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 3pch s ALA 506 CO 0.13 -0.35 0.30 0.15 0.00 0.00 0.00 175.76 176.00 3pch s LYS 507 N 0.52 3.70 0.28 0.00 -0.14 -0.66 -1.14 119.74 122.31 3pch s LYS 507 Ca 0.55 0.15 -0.30 0.00 -1.36 0.00 0.00 55.97 55.00 3pch s LYS 507 Cb -0.29 -3.17 -0.12 0.00 -1.68 0.00 0.00 37.83 32.57 3pch s LYS 507 CO 0.31 0.70 1.54 -0.11 -0.76 0.00 0.00 175.35 177.04 3pch n LEU 508 N 1.68 4.04 -3.65 3.17 7.94 -1.26 -0.87 117.00 128.04 3pch n LEU 508 Ca -0.15 1.15 -0.28 0.00 -1.11 0.00 0.00 56.01 55.62 3pch n LEU 508 Cb 0.53 -1.55 -0.12 0.00 0.53 0.00 0.00 43.42 42.81 3pch n LEU 508 CO 0.36 -0.02 -0.21 -0.62 -1.11 0.00 0.00 177.39 175.79 3pch s ASP 509 N 0.41 3.26 0.48 1.96 2.15 0.19 -4.82 116.67 120.30 3pch s ASP 509 Ca 0.65 -3.08 0.16 0.00 0.43 0.00 0.00 52.55 50.71 3pch s ASP 509 Cb -0.53 -0.99 1.15 0.00 -0.30 0.00 0.00 42.92 42.25 3pch s ASP 509 CO 0.49 -0.19 2.07 0.24 -0.17 0.00 0.00 175.17 177.62 3pch h MET 510 N 6.04 0.00 0.00 4.34 2.86 -1.93 -2.01 114.93 124.23 3pch h MET 510 Ca 0.12 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.76 3pch h MET 510 Cb 0.88 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.54 3pch h MET 510 CO 0.50 0.10 -0.01 -0.91 1.06 0.00 0.00 176.91 177.65 3pch h ASN 511 N 0.00 0.00 -0.01 1.22 2.35 -1.95 -2.59 115.58 114.61 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 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 3pch h ASN 511 CO 0.01 0.01 -0.72 -3.20 -1.65 0.00 0.00 177.43 171.88 3pch n ASN 512 N -4.53 1.45 -4.78 5.81 5.15 -0.77 -4.97 115.26 112.62 3pch n ASN 512 Ca -0.03 -1.23 -0.32 0.00 -0.60 0.00 0.00 54.58 52.40 3pch n ASN 512 Cb 0.10 0.75 0.05 0.00 -0.53 0.00 0.00 39.78 40.14 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 -2.67 2.49 -0.42 5.20 0.00 -0.98 -4.76 121.76 120.62 3pch s ALA 513 Ca 0.12 0.43 -0.11 0.00 0.00 0.00 0.00 51.96 52.40 3pch s ALA 513 Cb 0.16 -3.28 0.06 0.00 0.00 0.00 0.00 23.12 20.06 3pch s ALA 513 CO 0.70 -1.29 0.28 -0.80 0.00 0.00 0.00 175.76 174.65 3pch s ASN 514 N -2.86 5.81 0.22 0.00 0.01 0.42 -5.00 114.94 113.55 3pch s ASN 514 Ca 0.65 -1.32 -0.31 0.00 -0.71 0.00 0.00 52.86 51.17 3pch s ASN 514 Cb -0.19 -2.05 -0.15 0.00 0.41 0.00 0.00 41.25 39.27 3pch s ASN 514 CO 0.45 -0.53 1.09 -2.65 -1.51 0.00 0.00 177.10 173.95 3pch n PRO 515 N 5.02 1.25 -1.41 -0.60 -0.02 -1.26 -0.49 135.00 137.48 3pch n PRO 515 Ca -0.11 0.44 -0.14 0.00 -2.02 0.00 0.00 63.50 61.67 3pch n PRO 515 Cb 0.44 -1.88 -0.06 0.00 -0.02 0.00 0.00 33.50 31.98 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 1.32 -1.63 0.00 -0.52 2.81 -1.26 -4.71 117.12 113.13 3pch n MET 516 Ca 0.13 0.99 0.00 0.00 -1.81 0.00 0.00 57.70 57.01 3pch n MET 516 Cb 0.28 -5.42 0.00 0.00 -0.71 0.00 0.00 33.22 27.37 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 -1.25 0.00 -3.84 7.83 2.03 0.35 -5.14 116.55 116.53 3pch n ASP 517 Ca -0.14 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.06 3pch n ASP 517 Cb 0.63 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.94 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 -1.96 2.73 -0.02 0.00 1.43 -0.98 -0.43 118.68 119.45 3pch s LEU 519 Ca -0.07 0.29 -0.09 0.00 -1.03 0.00 0.00 54.13 53.24 3pch s LEU 519 Cb -0.02 -2.56 0.01 0.00 0.03 0.00 0.00 46.19 43.65 3pch s LEU 519 CO -0.03 -2.27 0.20 0.00 0.23 0.00 0.00 176.35 174.48 3pch s ALA 520 N -3.62 -0.49 0.03 4.21 0.00 -1.26 -0.76 121.76 119.87 3pch s ALA 520 Ca 0.68 0.14 0.05 0.00 0.00 0.00 0.00 51.96 52.84 3pch s ALA 520 Cb -0.06 -0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 3pch s ALA 520 CO 0.50 -0.20 -0.16 0.71 0.00 0.00 0.00 175.76 176.61 3pch s TYR 521 N -1.04 1.37 -0.16 0.00 2.02 -0.17 0.53 117.35 119.90 3pch s TYR 521 Ca -0.11 -0.33 -0.02 0.00 -0.37 0.00 0.00 57.07 56.23 3pch s TYR 521 Cb -0.06 -0.83 -0.02 0.00 -0.40 0.00 0.00 41.96 40.66 3pch s TYR 521 CO 0.02 0.03 -0.07 0.50 -1.57 0.00 0.00 175.55 174.46 3pch s ARG 522 N -0.96 3.49 -0.27 -0.62 6.06 -0.05 -1.50 118.95 125.10 3pch s ARG 522 Ca 0.04 -0.61 -0.02 0.00 -2.50 0.00 0.00 55.73 52.64 3pch s ARG 522 Cb -0.08 -2.84 0.12 0.00 0.06 0.00 0.00 34.95 32.21 3pch s ARG 522 CO 0.01 0.11 0.24 0.12 -2.50 0.00 0.00 175.30 173.27 3pch s PHE 523 N 0.67 -0.21 0.16 5.12 5.36 0.93 -1.65 117.98 128.35 3pch s PHE 523 Ca -0.04 -0.30 -0.11 0.00 -0.96 0.00 0.00 56.93 55.52 3pch s PHE 523 Cb -0.15 -0.57 -0.07 0.00 -0.34 0.00 0.00 43.02 41.90 3pch s PHE 523 CO 0.02 -0.84 0.50 -0.51 -1.46 0.00 0.00 175.22 172.93 3pch s ASP 524 N 2.28 6.68 -0.05 6.13 1.01 -1.26 -4.04 116.67 127.42 3pch s ASP 524 Ca 0.09 0.91 0.04 0.00 0.71 0.00 0.00 52.55 54.30 3pch s ASP 524 Cb -0.15 -2.22 -0.00 0.00 1.01 0.00 0.00 42.92 41.56 3pch s ASP 524 CO -0.30 0.06 -0.18 -0.63 0.21 0.00 0.00 175.17 174.33 3pch s ILE 525 N -1.59 1.47 -0.19 0.77 1.01 0.51 -4.95 121.20 118.24 3pch s ILE 525 Ca 0.40 -0.74 -0.01 0.00 0.00 0.00 0.00 60.65 60.30 3pch s ILE 525 Cb -0.13 -1.27 0.00 0.00 0.01 0.00 0.00 42.46 41.07 3pch s ILE 525 CO 0.20 0.42 -0.12 -0.69 0.00 0.00 0.00 174.94 174.75 3pch s VAL 526 N 0.06 2.75 0.36 2.92 1.01 -1.24 -0.26 120.40 126.00 3pch s VAL 526 Ca -0.05 -0.71 0.07 0.00 0.00 0.00 0.00 61.98 61.30 3pch s VAL 526 Cb -0.12 -2.21 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 3pch s VAL 526 CO 0.02 0.48 0.40 -0.76 0.00 0.00 0.00 175.10 175.25 3pch s LEU 527 N 1.30 3.71 0.20 3.92 1.43 0.15 -4.92 118.68 124.47 3pch s LEU 527 Ca 0.04 -0.41 -0.32 0.00 -1.03 0.00 0.00 54.13 52.41 3pch s LEU 527 Cb -0.14 -2.44 -0.15 0.00 0.03 0.00 0.00 46.19 43.49 3pch s LEU 527 CO -0.07 -0.47 1.19 0.54 0.23 0.00 0.00 176.35 177.77 3pch n ARG 528 N -1.55 1.38 -1.96 1.70 1.74 -1.26 -0.92 116.66 115.79 3pch n ARG 528 Ca 0.01 0.49 -0.41 0.00 -0.77 0.00 0.00 57.85 57.17 3pch n ARG 528 Cb 0.59 -2.01 -0.02 0.00 -1.02 0.00 0.00 32.46 30.01 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 -0.02 2.59 -0.18 -0.13 0.00 -1.26 -4.25 107.32 104.07 3pch s GLY 529 Ca 0.70 1.40 -0.03 0.00 0.00 0.00 0.00 44.72 46.79 3pch s GLY 529 CO 0.53 2.22 -0.06 1.62 0.00 0.00 0.00 173.10 177.41 3pch s GLN 530 N -1.10 3.46 0.14 2.90 0.74 -1.26 -1.02 119.66 123.52 3pch s GLN 530 Ca 0.56 -0.61 0.02 0.00 0.05 0.00 0.00 55.36 55.38 3pch s GLN 530 Cb -0.43 -2.89 -0.04 0.00 1.10 0.00 0.00 33.01 30.75 3pch s GLN 530 CO 0.50 0.03 -0.05 -0.98 -0.55 0.00 0.00 175.29 174.24 3pch s ARG 531 N 0.89 0.98 0.42 1.67 1.70 -0.20 -4.98 118.95 119.43 3pch s ARG 531 Ca -0.01 -1.43 -0.22 0.00 -0.47 0.00 0.00 55.73 53.60 3pch s ARG 531 Cb -0.15 -0.33 -0.10 0.00 -0.57 0.00 0.00 34.95 33.79 3pch s ARG 531 CO 0.01 -0.03 0.97 -1.59 -1.08 0.00 0.00 175.30 173.58 3pch s LYS 532 N -3.84 4.24 0.78 3.89 -2.85 -1.26 -0.37 119.74 120.33 3pch s LYS 532 Ca 0.17 1.22 -0.12 0.00 -1.00 0.00 0.00 55.97 56.24 3pch s LYS 532 Cb 0.05 -2.31 0.06 0.00 -2.06 0.00 0.00 37.83 33.57 3pch s LYS 532 CO -0.01 -0.03 1.12 0.95 0.10 0.00 0.00 175.35 177.48 3pch s THR 533 N -2.01 2.96 -0.21 3.79 -4.23 -1.18 -4.72 115.64 110.04 3pch s THR 533 Ca 0.60 0.35 -0.21 0.00 -1.18 0.00 0.00 61.69 61.25 3pch s THR 533 Cb -0.13 -2.75 0.06 0.00 1.34 0.00 0.00 72.50 71.02 3pch s THR 533 CO 0.17 -0.37 0.60 -1.38 -0.54 0.00 0.00 174.62 173.09 3pch s HIS 534 N -2.67 -0.64 -1.80 3.99 -3.43 -1.26 -4.96 115.29 104.52 3pch s HIS 534 Ca 0.64 1.53 -0.21 0.00 -0.80 0.00 0.00 55.06 56.22 3pch s HIS 534 Cb -0.20 0.23 0.20 0.00 -1.43 0.00 0.00 32.58 31.38 3pch s HIS 534 CO 0.53 -0.34 0.69 1.19 -2.00 0.00 0.00 174.74 174.80 3pch n PHE 535 N 2.57 -1.45 1.35 0.38 3.72 -1.26 -5.24 117.46 117.54 3pch n PHE 535 Ca -0.14 0.74 0.13 0.00 -0.05 0.00 0.00 57.45 58.13 3pch n PHE 535 Cb 0.56 -2.40 0.40 0.00 -0.94 0.00 0.00 39.48 37.10 3pch n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10