#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 2.65 -0.08 0.55 0.00 -1.26 -5.05 121.76 118.57 3pch s ALA 302 Ca 0.00 1.03 0.04 0.00 0.00 0.00 0.00 51.96 53.03 3pch s ALA 302 Cb 0.00 -3.45 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 3pch s ALA 302 CO 0.00 -1.09 -0.21 -0.65 0.00 0.00 0.00 175.76 173.80 3pch s GLN 303 N -3.18 2.81 -1.09 0.00 -0.21 -1.26 -5.06 119.66 111.67 3pch s GLN 303 Ca 0.74 -0.84 -0.20 0.00 0.02 0.00 0.00 55.36 55.09 3pch s GLN 303 Cb -0.31 -2.30 0.09 0.00 1.00 0.00 0.00 33.01 31.49 3pch s GLN 303 CO 0.35 0.33 1.44 0.34 -2.12 0.00 0.00 175.29 175.63 3pch s ASP 304 N -0.02 6.68 -0.00 5.90 2.15 -1.26 -4.57 116.67 125.55 3pch s ASP 304 Ca -0.07 -2.00 0.02 0.00 0.43 0.00 0.00 52.55 50.93 3pch s ASP 304 Cb -0.15 -2.51 -0.02 0.00 -0.30 0.00 0.00 42.92 39.94 3pch s ASP 304 CO 0.05 -1.24 0.05 -0.46 -0.17 0.00 0.00 175.17 173.40 3pch n ASN 305 N 7.85 2.48 -4.68 -0.34 0.23 -1.26 -5.03 115.26 114.52 3pch n ASN 305 Ca 0.35 -0.25 -0.24 0.00 -0.53 0.00 0.00 54.58 53.91 3pch n ASN 305 Cb 0.48 1.04 -0.07 0.00 -2.08 0.00 0.00 39.78 39.15 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 -1.70 4.48 0.02 0.53 0.01 -1.26 -3.24 113.70 112.54 3pch s SER 306 Ca -0.00 -0.82 0.03 0.00 1.31 0.00 0.00 55.95 56.47 3pch s SER 306 Cb 0.01 -0.69 -0.01 0.00 0.21 0.00 0.00 66.02 65.54 3pch s SER 306 CO 0.07 -0.21 -0.09 -0.13 0.41 0.00 0.00 173.24 173.28 3pch s ARG 307 N -3.76 0.65 -0.05 12.44 1.81 0.17 -4.83 118.95 125.37 3pch s ARG 307 Ca 0.35 -0.53 0.05 0.00 -1.72 0.00 0.00 55.73 53.88 3pch s ARG 307 Cb -0.03 -0.58 -0.02 0.00 -0.45 0.00 0.00 34.95 33.87 3pch s ARG 307 CO 0.21 0.14 -0.19 -0.06 -0.68 0.00 0.00 175.30 174.72 3pch s PHE 308 N -0.69 2.56 0.23 -0.53 0.08 -1.26 -0.90 117.98 117.48 3pch s PHE 308 Ca -0.01 -0.36 -0.32 0.00 0.12 0.00 0.00 56.93 56.37 3pch s PHE 308 Cb -0.06 -1.60 -0.13 0.00 -0.57 0.00 0.00 43.02 40.65 3pch s PHE 308 CO 0.00 0.03 1.47 0.28 -0.10 0.00 0.00 175.22 176.91 3pch n VAL 309 N 2.53 0.76 -1.93 -0.44 0.31 0.15 -4.87 118.33 114.84 3pch n VAL 309 Ca -0.17 -0.19 -0.41 0.00 -0.01 0.00 0.00 64.34 63.56 3pch n VAL 309 Cb 0.52 -1.56 -0.01 0.00 -0.91 0.00 0.00 33.84 31.88 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 0.15 2.36 0.43 2.52 -1.09 -1.26 -4.64 121.20 119.66 3pch s ILE 310 Ca 0.70 0.34 -0.25 0.00 -2.23 0.00 0.00 60.65 59.21 3pch s ILE 310 Cb -0.63 -3.22 -0.08 0.00 -1.58 0.00 0.00 42.46 36.95 3pch s ILE 310 CO 0.47 0.07 1.30 -0.13 -1.23 0.00 0.00 174.94 175.42 3pch s ARG 311 N -1.56 3.84 -0.55 2.79 0.52 -1.26 -4.97 118.95 117.76 3pch s ARG 311 Ca 0.54 2.13 -0.20 0.00 -0.52 0.00 0.00 55.73 57.68 3pch s ARG 311 Cb -0.44 -2.66 0.07 0.00 0.52 0.00 0.00 34.95 32.45 3pch s ARG 311 CO 0.55 -0.59 0.70 0.34 0.02 0.00 0.00 175.30 176.33 3pch s ASP 312 N -0.83 6.22 0.00 0.23 -1.08 -1.26 -4.90 116.67 115.05 3pch s ASP 312 Ca 0.59 -1.02 0.28 0.00 -0.52 0.00 0.00 52.55 51.89 3pch s ASP 312 Cb -0.37 -2.32 1.67 0.00 -1.46 0.00 0.00 42.92 40.44 3pch s ASP 312 CO 0.47 -1.03 2.02 0.54 0.52 0.00 0.00 175.17 177.69 3pch n ARG 313 N 6.46 0.86 -0.00 4.34 1.74 -1.26 -2.22 116.66 126.58 3pch n ARG 313 Ca -0.06 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.11 3pch n ARG 313 Cb 0.45 -1.50 -0.13 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 -1.01 0.70 -0.08 0.55 3.02 -1.26 -4.36 115.26 112.81 3pch n ASN 314 Ca 0.21 -0.54 -0.18 0.00 -0.03 0.00 0.00 54.58 54.04 3pch n ASN 314 Cb 0.10 1.40 -0.12 0.00 -0.61 0.00 0.00 39.78 40.55 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 0.03 -4.24 3.10 2.91 -1.86 -3.43 115.95 112.45 3pch h TRP 315 Ca 0.00 -0.02 -0.51 0.00 1.13 0.00 0.00 58.89 59.49 3pch h TRP 315 Cb 0.66 -0.00 0.10 0.00 -0.51 0.00 0.00 29.16 29.40 3pch h TRP 315 CO 0.00 1.28 0.36 -1.01 -1.03 0.00 0.00 178.44 178.04 3pch s HIS 316 N -2.31 2.79 0.50 2.65 3.76 -1.04 -4.75 115.29 116.89 3pch s HIS 316 Ca -0.24 1.52 -0.22 0.00 -0.15 0.00 0.00 55.06 55.97 3pch s HIS 316 Cb 0.02 -3.05 -0.06 0.00 1.11 0.00 0.00 32.58 30.59 3pch s HIS 316 CO 0.65 -1.48 1.23 -1.25 -0.85 0.00 0.00 174.74 173.03 3pch s PRO 317 N -4.41 3.48 0.79 8.40 0.04 -1.26 -4.81 135.00 137.23 3pch s PRO 317 Ca 0.63 1.92 -0.11 0.00 0.04 0.00 0.00 61.00 63.48 3pch s PRO 317 Cb -0.18 -2.30 0.06 0.00 0.04 0.00 0.00 34.50 32.13 3pch s PRO 317 CO 0.45 -0.82 1.09 0.15 0.04 0.00 0.00 177.00 177.91 3pch s LYS 318 N -2.84 2.16 0.03 4.56 -0.14 -1.25 -4.99 119.74 117.28 3pch s LYS 318 Ca 0.68 0.69 -0.19 0.00 -1.36 0.00 0.00 55.97 55.79 3pch s LYS 318 Cb -0.32 -1.92 -0.18 0.00 -1.68 0.00 0.00 37.83 33.72 3pch s LYS 318 CO 0.38 -1.58 1.22 0.00 -0.76 0.00 0.00 175.35 174.61 3pch h ALA 319 N -1.06 0.18 -1.96 5.17 0.00 -1.95 -3.41 119.26 116.24 3pch h ALA 319 Ca -0.47 -0.49 -0.70 0.00 0.00 0.00 0.00 54.91 53.26 3pch h ALA 319 Cb 1.26 -0.01 -0.20 0.00 0.00 0.00 0.00 17.79 18.84 3pch h ALA 319 CO 0.59 0.32 0.07 -1.17 0.00 0.00 0.00 179.25 179.06 3pch s LEU 320 N -8.63 5.36 -0.51 0.00 2.96 -1.26 -4.75 118.68 111.85 3pch s LEU 320 Ca -0.13 -1.35 0.04 0.00 -0.22 0.00 0.00 54.13 52.47 3pch s LEU 320 Cb 0.05 -2.32 0.17 0.00 0.50 0.00 0.00 46.19 44.59 3pch s LEU 320 CO 0.81 -1.04 0.39 0.42 -1.32 0.00 0.00 176.35 175.60 3pch s THR 321 N 2.58 1.20 0.30 3.68 -4.23 -1.26 -5.03 115.64 112.87 3pch s THR 321 Ca 0.11 -3.17 0.15 0.00 -1.18 0.00 0.00 61.69 57.61 3pch s THR 321 Cb -0.24 -1.81 0.30 0.00 1.34 0.00 0.00 72.50 72.09 3pch s THR 321 CO 0.07 -1.15 1.30 -2.65 -0.54 0.00 0.00 174.62 171.65 3pch n PRO 322 N 2.59 -0.05 0.25 3.99 -0.01 -1.26 -0.63 135.00 139.88 3pch n PRO 322 Ca 0.26 1.15 0.13 0.00 -0.01 0.00 0.00 63.50 65.03 3pch n PRO 322 Cb 0.43 -2.03 0.79 0.00 -0.01 0.00 0.00 33.50 32.68 3pch n PRO 322 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 175.50 175.05 3pch h ASP 323 N 0.00 0.00 -3.22 2.55 3.32 -1.96 -3.17 116.42 113.95 3pch h ASP 323 Ca 0.67 0.00 -0.75 0.00 0.02 0.00 0.00 57.03 56.97 3pch h ASP 323 Cb 1.73 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 41.06 3pch h ASP 323 CO -0.65 0.00 0.42 -0.47 -1.72 0.00 0.00 179.24 176.82 3pch s TYR 324 N -4.82 3.49 0.33 4.55 5.04 0.20 -4.85 117.35 121.30 3pch s TYR 324 Ca -0.05 -1.75 0.11 0.00 -2.44 0.00 0.00 57.07 52.94 3pch s TYR 324 Cb 0.16 -4.02 1.02 0.00 0.35 0.00 0.00 41.96 39.47 3pch s TYR 324 CO 0.60 -1.20 1.59 0.87 -1.34 0.00 0.00 175.55 176.07 3pch h LYS 325 N 8.21 0.06 0.00 4.97 1.57 -1.77 -0.36 116.57 129.25 3pch h LYS 325 Ca 0.13 -0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.84 3pch h LYS 325 Cb 1.03 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 3pch h LYS 325 CO 0.90 0.04 -0.31 1.15 -0.57 0.00 0.00 179.45 180.66 3pch h THR 326 N 0.06 1.00 -0.05 -0.16 2.02 -1.91 -2.93 112.91 110.93 3pch h THR 326 Ca 0.71 -1.15 0.02 0.00 0.77 0.00 0.00 66.41 66.76 3pch h THR 326 Cb 1.66 1.66 -0.00 0.00 -1.74 0.00 0.00 68.15 69.73 3pch h THR 326 CO -0.80 0.30 0.04 0.77 0.37 0.00 0.00 175.52 176.21 3pch h SER 327 N 0.00 0.00 0.75 4.18 4.64 -1.34 -2.82 113.55 118.96 3pch h SER 327 Ca -0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 3pch h SER 327 Cb 0.63 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3pch h SER 327 CO 0.04 0.00 -0.47 0.40 -0.87 0.00 0.00 176.83 175.93 3pch h ILE 328 N 0.00 0.05 0.00 0.95 2.04 -1.66 -2.43 117.51 116.46 3pch h ILE 328 Ca 0.03 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.89 3pch h ILE 328 Cb 0.11 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.25 3pch h ILE 328 CO -0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 3pch n ALA 329 N -2.71 2.12 -1.45 1.87 0.00 -1.22 -3.82 120.51 115.30 3pch n ALA 329 Ca -0.14 -0.02 -0.08 0.00 0.00 0.00 0.00 53.44 53.19 3pch n ALA 329 Cb 0.48 -1.44 0.19 0.00 0.00 0.00 0.00 19.45 18.69 3pch n ALA 329 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3pch n ARG 330 N -2.03 1.94 -4.86 0.00 1.74 -1.02 -4.95 116.66 107.48 3pch n ARG 330 Ca 0.05 -3.21 -0.26 0.00 -0.77 0.00 0.00 57.85 53.67 3pch n ARG 330 Cb 0.35 -1.88 -0.16 0.00 -1.02 0.00 0.00 32.46 29.75 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 -2.41 2.14 0.81 0.55 1.04 -0.95 -4.94 113.70 109.95 3pch s SER 331 Ca 0.47 -0.34 -0.11 0.00 0.48 0.00 0.00 55.95 56.45 3pch s SER 331 Cb 0.42 -0.39 0.08 0.00 0.10 0.00 0.00 66.02 66.23 3pch s SER 331 CO 0.01 0.19 1.13 -2.84 0.98 0.00 0.00 173.24 172.71 3pch s PRO 332 N -0.23 1.80 -0.01 4.02 0.02 -1.26 -4.97 135.00 134.37 3pch s PRO 332 Ca 0.02 1.42 0.11 0.00 0.02 0.00 0.00 61.00 62.57 3pch s PRO 332 Cb -0.09 -1.83 -0.16 0.00 0.02 0.00 0.00 34.50 32.44 3pch s PRO 332 CO 0.01 -2.02 0.25 0.54 -0.33 0.00 0.00 177.00 175.44 3pch n ARG 333 N -3.59 0.53 -3.18 5.54 5.12 -1.26 -4.92 116.66 114.90 3pch n ARG 333 Ca 0.11 -0.09 -0.33 0.00 -1.93 0.00 0.00 57.85 55.61 3pch n ARG 333 Cb 0.52 -1.24 -0.06 0.00 -1.16 0.00 0.00 32.46 30.52 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 -2.70 3.99 0.54 5.56 -1.52 -1.26 -5.05 119.66 119.22 3pch s GLN 334 Ca -0.03 0.63 -0.20 0.00 -1.95 0.00 0.00 55.36 53.80 3pch s GLN 334 Cb 0.07 -2.50 -0.06 0.00 -0.22 0.00 0.00 33.01 30.31 3pch s GLN 334 CO 0.45 0.20 1.17 0.00 -0.25 0.00 0.00 175.29 176.85 3pch s ALA 335 N -1.92 2.72 0.48 6.09 0.00 -1.26 -4.98 121.76 122.89 3pch s ALA 335 Ca 0.52 0.92 -0.23 0.00 0.00 0.00 0.00 51.96 53.17 3pch s ALA 335 Cb -0.11 -3.40 -0.07 0.00 0.00 0.00 0.00 23.12 19.55 3pch s ALA 335 CO 0.18 -0.87 1.27 -0.51 0.00 0.00 0.00 175.76 175.83 3pch s LEU 336 N -3.69 3.98 -0.22 0.00 1.43 -1.26 -4.99 118.68 113.93 3pch s LEU 336 Ca 0.72 2.55 -0.18 0.00 -1.03 0.00 0.00 54.13 56.18 3pch s LEU 336 Cb -0.27 -4.20 -0.03 0.00 0.03 0.00 0.00 46.19 41.72 3pch s LEU 336 CO 0.31 -1.17 0.52 -0.69 0.23 0.00 0.00 176.35 175.55 3pch s VAL 337 N -1.40 5.09 0.27 -1.59 1.01 -1.26 -5.05 120.40 117.46 3pch s VAL 337 Ca 0.66 0.93 -0.29 0.00 0.00 0.00 0.00 61.98 63.28 3pch s VAL 337 Cb -0.35 -3.84 -0.09 0.00 0.00 0.00 0.00 36.38 32.10 3pch s VAL 337 CO 0.42 0.15 0.98 -0.44 0.00 0.00 0.00 175.10 176.21 3pch s SER 338 N 1.28 7.49 0.03 3.32 0.01 -1.26 -5.06 113.70 119.51 3pch s SER 338 Ca 0.23 2.01 0.02 0.00 1.31 0.00 0.00 55.95 59.53 3pch s SER 338 Cb -0.15 -2.61 -0.02 0.00 0.21 0.00 0.00 66.02 63.45 3pch s SER 338 CO 0.09 0.03 -0.07 0.27 0.41 0.00 0.00 173.24 173.97 3pch s ILE 339 N -1.25 0.53 0.60 1.44 -4.36 -1.26 -5.14 121.20 111.75 3pch s ILE 339 Ca 0.44 -0.84 -0.18 0.00 -0.26 0.00 0.00 60.65 59.80 3pch s ILE 339 Cb -0.26 -0.55 -0.03 0.00 1.25 0.00 0.00 42.46 42.86 3pch s ILE 339 CO 0.33 -0.23 1.16 -2.16 0.24 0.00 0.00 174.94 174.28 3pch s PRO 340 N -1.17 2.99 0.24 0.37 0.04 -1.26 -4.98 135.00 131.24 3pch s PRO 340 Ca -0.06 1.66 -0.30 0.00 0.04 0.00 0.00 61.00 62.34 3pch s PRO 340 Cb -0.08 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.42 3pch s PRO 340 CO 0.00 -1.15 1.17 -0.65 0.04 0.00 0.00 177.00 176.41 3pch s GLN 341 N -3.52 4.53 0.35 4.56 -0.21 -1.26 -5.00 119.66 119.12 3pch s GLN 341 Ca 0.73 1.90 0.05 0.00 0.02 0.00 0.00 55.36 58.06 3pch s GLN 341 Cb -0.26 -3.20 -0.03 0.00 1.00 0.00 0.00 33.01 30.52 3pch s GLN 341 CO 0.34 0.02 0.19 -1.54 -2.12 0.00 0.00 175.29 172.18 3pch s SER 342 N -0.37 2.08 0.43 5.90 1.04 -1.26 -5.01 113.70 116.51 3pch s SER 342 Ca 0.49 -1.68 0.14 0.00 0.48 0.00 0.00 55.95 55.38 3pch s SER 342 Cb -0.33 0.50 1.03 0.00 0.10 0.00 0.00 66.02 67.32 3pch s SER 342 CO 0.41 -0.97 1.96 -0.29 0.98 0.00 0.00 173.24 175.33 3pch h ILE 343 N 2.02 0.87 -0.67 -1.02 2.10 -1.95 -0.44 117.51 118.42 3pch h ILE 343 Ca -0.31 -0.14 0.06 0.00 1.08 0.00 0.00 64.86 65.55 3pch h ILE 343 Cb 1.25 0.41 -0.06 0.00 -1.09 0.00 0.00 36.82 37.34 3pch h ILE 343 CO 0.48 0.08 0.37 0.28 -1.08 0.00 0.00 178.15 178.28 3pch h SER 344 N 0.42 0.54 0.57 2.19 0.02 -1.96 -2.89 113.55 112.45 3pch h SER 344 Ca 0.30 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.29 3pch h SER 344 Cb 0.62 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.09 3pch h SER 344 CO -0.09 0.34 -1.26 -0.62 -1.14 0.00 0.00 176.83 174.07 3pch n GLU 345 N -4.80 0.52 -0.20 3.45 4.71 -0.32 -4.35 120.64 119.66 3pch n GLU 345 Ca 0.09 0.00 0.12 0.00 -0.01 0.00 0.00 57.16 57.36 3pch n GLU 345 Cb 0.18 -1.68 0.23 0.00 -1.01 0.00 0.00 31.44 29.16 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 -2.35 0.51 -4.65 2.62 -2.24 -0.36 -2.94 114.28 104.88 3pch n THR 346 Ca -0.00 -0.75 -0.29 0.00 -2.27 0.00 0.00 64.05 60.74 3pch n THR 346 Cb 0.52 0.95 -0.10 0.00 -2.10 0.00 0.00 70.33 69.60 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 -1.49 1.79 -0.07 4.28 -4.23 -1.10 -4.71 115.64 110.11 3pch s THR 347 Ca 0.39 -2.00 -0.31 0.00 -1.18 0.00 0.00 61.69 58.59 3pch s THR 347 Cb 0.23 -2.79 0.12 0.00 1.34 0.00 0.00 72.50 71.40 3pch s THR 347 CO 0.32 0.00 1.38 -0.83 -0.54 0.00 0.00 174.62 174.95 3pch s GLY 348 N -3.75 -0.37 0.51 3.99 0.00 -1.24 -1.41 107.32 105.05 3pch s GLY 348 Ca 0.28 0.59 -0.21 0.00 0.00 0.00 0.00 44.72 45.38 3pch s GLY 348 CO 0.14 2.69 1.14 2.56 0.00 0.00 0.00 173.10 179.63 3pch s PRO 349 N -2.08 3.53 -0.20 2.90 0.04 -1.26 -4.82 135.00 133.10 3pch s PRO 349 Ca 0.21 1.67 0.00 0.00 0.04 0.00 0.00 61.00 62.92 3pch s PRO 349 Cb 0.04 -2.17 0.02 0.00 0.04 0.00 0.00 34.50 32.44 3pch s PRO 349 CO -0.05 -0.72 -0.15 1.21 0.04 0.00 0.00 177.00 177.33 3pch s ASN 350 N -1.62 3.58 -0.09 6.66 3.84 -1.26 -4.86 114.94 121.20 3pch s ASN 350 Ca 0.69 -0.74 0.10 0.00 0.21 0.00 0.00 52.86 53.12 3pch s ASN 350 Cb -0.25 -1.54 0.44 0.00 -0.55 0.00 0.00 41.25 39.34 3pch s ASN 350 CO 0.30 -0.04 1.26 0.49 -2.79 0.00 0.00 177.10 176.32 3pch n PHE 351 N 4.62 0.97 -0.31 0.43 3.72 -1.26 -4.52 117.46 121.11 3pch n PHE 351 Ca -0.19 -0.37 0.11 0.00 -0.05 0.00 0.00 57.45 56.95 3pch n PHE 351 Cb 0.49 -0.21 0.34 0.00 -0.94 0.00 0.00 39.48 39.15 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 2.40 0.75 -0.32 4.37 0.02 -1.96 -0.72 113.55 118.09 3pch h SER 352 Ca 0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3pch h SER 352 Cb 1.07 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.52 3pch h SER 352 CO 0.18 0.35 0.00 1.41 -1.14 0.00 0.00 176.83 177.63 3pch n HIS 353 N -4.62 0.42 -2.33 3.45 8.25 -1.26 -4.88 115.22 114.26 3pch n HIS 353 Ca 0.19 -0.21 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 3pch n HIS 353 Cb 0.48 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.56 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 -1.23 4.40 -0.94 2.41 2.96 -0.28 -4.93 118.68 121.08 3pch s LEU 354 Ca 0.30 2.20 -0.23 0.00 -0.22 0.00 0.00 54.13 56.18 3pch s LEU 354 Cb 0.16 -3.59 0.06 0.00 0.50 0.00 0.00 46.19 43.31 3pch s LEU 354 CO 0.22 -0.48 1.35 -0.83 -1.32 0.00 0.00 176.35 175.28 3pch s GLY 355 N 0.67 1.29 0.15 7.98 0.00 -1.26 -5.00 107.32 111.15 3pch s GLY 355 Ca 0.58 -2.15 -0.27 0.00 0.00 0.00 0.00 44.72 42.88 3pch s GLY 355 CO 0.33 2.55 0.84 -1.36 0.00 0.00 0.00 173.10 175.46 3pch s PHE 356 N 4.73 3.87 0.69 1.90 0.08 -1.26 -5.05 117.98 122.94 3pch s PHE 356 Ca 0.41 1.69 -0.12 0.00 0.12 0.00 0.00 56.93 59.02 3pch s PHE 356 Cb -0.03 -2.87 0.01 0.00 -0.57 0.00 0.00 43.02 39.55 3pch s PHE 356 CO -0.04 0.40 1.07 0.20 -0.10 0.00 0.00 175.22 176.75 3pch s GLY 357 N -0.71 1.81 0.30 4.36 0.00 -1.26 -4.96 107.32 106.85 3pch s GLY 357 Ca 0.39 0.23 0.05 0.00 0.00 0.00 0.00 44.72 45.40 3pch s GLY 357 CO 0.27 0.55 1.78 0.00 0.00 0.00 0.00 173.10 175.71 3pch h ALA 358 N -0.51 1.64 -0.30 3.20 0.00 -2.02 -2.67 119.26 118.60 3pch h ALA 358 Ca -0.45 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.45 3pch h ALA 358 Cb 1.22 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 3pch h ALA 358 CO 0.55 -0.04 -0.02 0.72 0.00 0.00 0.00 179.25 180.47 3pch n HIS 359 N -4.77 0.99 -0.27 0.00 8.25 -1.26 -4.71 115.22 113.45 3pch n HIS 359 Ca 0.23 -1.21 0.20 0.00 -0.26 0.00 0.00 57.72 56.68 3pch n HIS 359 Cb 0.55 -0.39 0.50 0.00 1.12 0.00 0.00 29.99 31.77 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 1.34 0.43 -0.30 0.41 5.19 -1.75 0.21 116.42 121.94 3pch h ASP 360 Ca 0.11 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.57 3pch h ASP 360 Cb 1.54 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 41.03 3pch h ASP 360 CO 0.30 0.15 0.00 0.00 -3.12 0.00 0.00 179.24 176.57 3pch n HIS 361 N -4.54 0.38 -3.76 4.55 1.44 -1.16 -2.36 115.22 109.77 3pch n HIS 361 Ca 0.21 -0.21 -0.36 0.00 -2.01 0.00 0.00 57.72 55.36 3pch n HIS 361 Cb 0.74 -0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.74 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 -1.50 5.13 0.00 4.39 -1.08 0.06 -1.56 116.67 122.11 3pch s ASP 362 Ca 0.34 -2.70 0.08 0.00 -0.52 0.00 0.00 52.55 49.76 3pch s ASP 362 Cb 0.21 -1.82 0.37 0.00 -1.46 0.00 0.00 42.92 40.21 3pch s ASP 362 CO 0.29 -0.39 1.25 0.18 0.52 0.00 0.00 175.17 177.03 3pch n LEU 363 N 3.68 0.00 0.08 -1.34 4.32 0.28 -0.61 117.00 123.41 3pch n LEU 363 Ca 0.05 0.47 -0.05 0.00 -0.02 0.00 0.00 56.01 56.47 3pch n LEU 363 Cb 0.38 -0.47 -0.08 0.00 -1.62 0.00 0.00 43.42 41.63 3pch n LEU 363 CO 0.33 -0.34 0.23 -0.07 -1.22 0.00 0.00 177.39 176.32 3pch h LEU 364 N 0.00 0.00 0.00 2.23 4.07 -1.91 -3.38 115.31 116.32 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 0.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.88 3pch h LEU 364 CO 0.00 0.87 -0.39 0.18 -1.08 0.00 0.00 178.44 178.02 3pch n LEU 365 N -3.34 0.05 0.00 1.67 4.77 -0.60 -4.57 117.00 114.98 3pch n LEU 365 Ca 0.00 -0.34 0.14 0.00 -0.03 0.00 0.00 56.01 55.79 3pch n LEU 365 Cb 0.88 0.00 0.85 0.00 -2.33 0.00 0.00 43.42 42.82 3pch n LEU 365 CO 0.45 0.01 1.03 -0.46 -1.33 0.00 0.00 177.39 177.09 3pch n ASN 366 N -1.20 0.00 0.02 -1.43 0.23 0.22 -5.02 115.26 108.08 3pch n ASN 366 Ca 0.00 -0.86 0.00 0.00 -0.53 0.00 0.00 54.58 53.19 3pch n ASN 366 Cb 0.03 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.71 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 -1.02 -0.08 -0.32 -2.53 7.35 -1.26 -4.93 117.46 114.67 3pch n PHE 367 Ca 0.21 0.01 0.00 0.00 -0.76 0.00 0.00 57.45 56.92 3pch n PHE 367 Cb 0.11 0.05 0.00 0.00 0.35 0.00 0.00 39.48 39.99 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 3.31 0.00 3.89 7.13 0.00 -1.26 -4.40 105.19 113.86 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 1.08 0.00 0.00 0.00 173.32 174.40 3pch s LEU 372 N -2.72 4.38 0.73 0.99 1.02 -1.26 -4.83 118.68 116.99 3pch s LEU 372 Ca 0.00 0.43 -0.13 0.00 0.02 0.00 0.00 54.13 54.45 3pch s LEU 372 Cb 0.00 -2.39 0.04 0.00 0.02 0.00 0.00 46.19 43.86 3pch s LEU 372 CO 0.00 0.33 1.11 -2.16 0.02 0.00 0.00 176.35 175.65 3pch s PRO 373 N -1.52 2.41 -0.04 1.29 0.05 -1.26 -4.81 135.00 131.12 3pch s PRO 373 Ca 0.22 1.33 -0.16 0.00 0.05 0.00 0.00 61.00 62.45 3pch s PRO 373 Cb -0.12 -1.91 -0.05 0.00 0.05 0.00 0.00 34.50 32.47 3pch s PRO 373 CO 0.12 -1.54 0.42 0.42 0.05 0.00 0.00 177.00 176.47 3pch s ILE 374 N -2.57 5.08 0.00 0.56 1.01 -1.26 -5.00 121.20 119.01 3pch s ILE 374 Ca 0.65 0.86 0.00 0.00 0.00 0.00 0.00 60.65 62.16 3pch s ILE 374 Cb -0.20 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.53 3pch s ILE 374 CO 0.49 0.50 0.00 0.61 0.00 0.00 0.00 174.94 176.54 3pch n GLY 375 N 2.32 1.56 3.61 6.18 0.00 -1.26 -4.45 105.19 113.15 3pch n GLY 375 Ca -0.12 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 43.67 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 -1.41 3.71 0.00 1.61 2.02 -1.26 -4.91 118.70 118.46 3pch s GLU 376 Ca 0.00 1.15 -0.30 0.00 0.02 0.00 0.00 54.97 55.84 3pch s GLU 376 Cb 0.00 -3.98 -0.06 0.00 0.10 0.00 0.00 34.13 30.19 3pch s GLU 376 CO 0.00 -1.39 1.48 1.03 0.02 0.00 0.00 175.26 176.41 3pch s ARG 377 N 4.66 4.25 0.03 1.61 0.52 -1.26 -0.97 118.95 127.79 3pch s ARG 377 Ca 0.61 2.06 -0.07 0.00 -0.52 0.00 0.00 55.73 57.82 3pch s ARG 377 Cb -0.16 -3.64 -0.00 0.00 0.52 0.00 0.00 34.95 31.66 3pch s ARG 377 CO 0.29 -0.65 0.12 0.96 0.02 0.00 0.00 175.30 176.04 3pch s ILE 378 N 2.71 0.11 -0.18 1.52 -4.36 0.51 -2.24 121.20 119.27 3pch s ILE 378 Ca 0.67 -0.93 -0.07 0.00 -0.26 0.00 0.00 60.65 60.06 3pch s ILE 378 Cb -0.33 -0.73 -0.04 0.00 1.25 0.00 0.00 42.46 42.61 3pch s ILE 378 CO 0.28 -0.51 0.05 -0.63 0.24 0.00 0.00 174.94 174.37 3pch s ILE 379 N -2.17 4.70 -0.25 8.37 1.01 0.30 -0.23 121.20 132.93 3pch s ILE 379 Ca -0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 60.65 60.48 3pch s ILE 379 Cb -0.03 -3.11 0.03 0.00 0.01 0.00 0.00 42.46 39.36 3pch s ILE 379 CO -0.02 0.47 -0.06 -0.69 0.00 0.00 0.00 174.94 174.64 3pch s VAL 380 N 0.30 2.83 0.06 2.92 1.01 0.83 -0.40 120.40 127.95 3pch s VAL 380 Ca 0.03 -1.07 -0.03 0.00 0.00 0.00 0.00 61.98 60.91 3pch s VAL 380 Cb -0.12 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 3pch s VAL 380 CO 0.00 0.18 0.04 0.00 0.00 0.00 0.00 175.10 175.32 3pch s ALA 381 N 1.31 0.27 0.00 5.51 0.00 -0.42 0.49 121.76 128.92 3pch s ALA 381 Ca -0.00 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.95 3pch s ALA 381 Cb -0.17 0.33 0.00 0.00 0.00 0.00 0.00 23.12 23.28 3pch s ALA 381 CO -0.04 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.72 3pch n GLY 382 N 0.12 -0.84 3.12 0.00 0.00 -0.72 -0.31 105.19 106.56 3pch n GLY 382 Ca -0.15 -0.75 -0.19 0.00 0.00 0.00 0.00 46.02 44.94 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 -0.30 0.84 -0.22 1.61 3.52 -1.25 -1.12 118.95 122.02 3pch s ARG 383 Ca 0.00 -0.71 -0.06 0.00 -0.13 0.00 0.00 55.73 54.83 3pch s ARG 383 Cb 0.00 -0.82 -0.03 0.00 -1.56 0.00 0.00 34.95 32.55 3pch s ARG 383 CO 0.00 0.20 0.03 0.08 -0.81 0.00 0.00 175.30 174.80 3pch s VAL 384 N -0.85 4.12 0.17 7.11 1.01 0.48 -0.76 120.40 131.67 3pch s VAL 384 Ca 0.00 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 61.74 3pch s VAL 384 Cb -0.08 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 3pch s VAL 384 CO 0.01 0.39 0.02 0.68 0.00 0.00 0.00 175.10 176.21 3pch s VAL 385 N 1.27 0.51 0.55 2.92 -7.23 -0.30 -1.02 120.40 117.08 3pch s VAL 385 Ca 0.04 -1.96 0.06 0.00 -1.81 0.00 0.00 61.98 58.31 3pch s VAL 385 Cb -0.15 -2.14 0.06 0.00 0.56 0.00 0.00 36.38 34.72 3pch s VAL 385 CO 0.02 -0.43 0.76 1.51 -0.31 0.00 0.00 175.10 176.64 3pch s ASP 386 N -3.15 5.17 0.55 4.85 -4.77 0.14 0.51 116.67 119.96 3pch s ASP 386 Ca 0.25 -0.52 0.24 0.00 -3.30 0.00 0.00 52.55 49.23 3pch s ASP 386 Cb 0.07 -0.21 1.49 0.00 -1.09 0.00 0.00 42.92 43.18 3pch s ASP 386 CO 0.04 -1.23 2.09 1.56 0.70 0.00 0.00 175.17 178.33 3pch h GLN 387 N 0.18 0.00 -0.01 2.11 4.20 -1.21 0.59 115.11 120.98 3pch h GLN 387 Ca -0.36 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.35 3pch h GLN 387 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 3pch h GLN 387 CO 0.44 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 179.26 3pch n TYR 388 N -4.17 0.00 -1.05 2.96 4.01 -1.26 -4.88 117.16 112.77 3pch n TYR 388 Ca 0.03 -0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.76 3pch n TYR 388 Cb 0.34 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.36 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 1.01 0.40 3.77 2.72 0.00 0.20 -5.04 105.19 108.25 3pch n GLY 389 Ca 0.22 -1.08 -0.38 0.00 0.00 0.00 0.00 46.02 44.78 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 -2.10 4.22 0.69 1.61 2.20 -1.25 -4.79 119.74 120.31 3pch s LYS 390 Ca 0.00 0.53 -0.17 0.00 -0.36 0.00 0.00 55.97 55.97 3pch s LYS 390 Cb 0.00 -3.34 0.01 0.00 -1.51 0.00 0.00 37.83 32.98 3pch s LYS 390 CO 0.00 0.38 1.23 -2.30 -0.36 0.00 0.00 175.35 174.30 3pch n PRO 391 N 2.82 0.86 -3.91 4.03 -0.02 -1.26 -0.69 135.00 136.84 3pch n PRO 391 Ca -0.09 0.35 -0.32 0.00 -2.02 0.00 0.00 63.50 61.43 3pch n PRO 391 Cb 0.52 -2.47 -0.13 0.00 -0.02 0.00 0.00 33.50 31.40 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 -1.58 2.80 0.58 -1.45 1.01 -0.19 -4.80 120.40 116.76 3pch s VAL 392 Ca 0.80 -3.08 -0.14 0.00 0.00 0.00 0.00 61.98 59.56 3pch s VAL 392 Cb -0.36 -2.93 -0.05 0.00 0.00 0.00 0.00 36.38 33.04 3pch s VAL 392 CO 0.43 -0.78 1.01 -2.16 0.00 0.00 0.00 175.10 173.60 3pch s PRO 393 N -0.04 3.70 -1.57 2.72 0.04 -1.26 -4.17 135.00 134.42 3pch s PRO 393 Ca 0.16 0.87 -0.09 0.00 0.04 0.00 0.00 61.00 61.98 3pch s PRO 393 Cb -0.24 -2.10 0.08 0.00 0.04 0.00 0.00 34.50 32.28 3pch s PRO 393 CO -0.02 -0.49 0.54 0.09 0.04 0.00 0.00 177.00 177.17 3pch n ASN 394 N -2.25 -1.54 -4.63 6.66 5.03 -0.63 -4.94 115.26 112.96 3pch n ASN 394 Ca 0.06 -1.04 -0.29 0.00 0.87 0.00 0.00 54.58 54.18 3pch n ASN 394 Cb 0.54 -2.73 -0.09 0.00 -1.02 0.00 0.00 39.78 36.48 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 -3.69 3.66 -0.19 3.41 -1.32 -1.25 -4.57 115.64 111.69 3pch s THR 395 Ca 0.35 -1.19 -0.25 0.00 -1.21 0.00 0.00 61.69 59.39 3pch s THR 395 Cb -0.19 -2.75 -0.01 0.00 -1.51 0.00 0.00 72.50 68.04 3pch s THR 395 CO 0.92 0.08 0.81 -0.22 -2.21 0.00 0.00 174.62 174.00 3pch s LEU 396 N -2.36 4.15 -0.19 9.08 2.96 -1.26 -0.51 118.68 130.54 3pch s LEU 396 Ca 0.24 1.10 0.01 0.00 -0.22 0.00 0.00 54.13 55.26 3pch s LEU 396 Cb -0.11 -3.19 0.02 0.00 0.50 0.00 0.00 46.19 43.41 3pch s LEU 396 CO 0.16 -0.42 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.91 3pch s VAL 397 N 2.31 2.19 0.06 1.68 1.01 0.10 -1.32 120.40 126.43 3pch s VAL 397 Ca 0.36 -0.96 0.09 0.00 0.00 0.00 0.00 61.98 61.47 3pch s VAL 397 Cb -0.16 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 3pch s VAL 397 CO 0.11 0.48 -0.23 -1.61 0.00 0.00 0.00 175.10 173.84 3pch s GLU 398 N 1.29 1.85 0.03 2.72 2.02 -0.06 0.02 118.70 126.57 3pch s GLU 398 Ca 0.04 -1.10 -0.10 0.00 0.02 0.00 0.00 54.97 53.83 3pch s GLU 398 Cb -0.14 -2.05 0.01 0.00 0.10 0.00 0.00 34.13 32.05 3pch s GLU 398 CO -0.11 0.51 0.21 0.00 0.02 0.00 0.00 175.26 175.89 3pch s MET 399 N -1.45 0.66 -0.01 1.61 0.23 0.45 -0.34 119.30 120.46 3pch s MET 399 Ca 0.13 -0.52 -0.14 0.00 -1.03 0.00 0.00 55.69 54.13 3pch s MET 399 Cb -0.10 0.28 0.02 0.00 -1.53 0.00 0.00 34.83 33.50 3pch s MET 399 CO 0.04 -0.19 0.30 1.67 -2.03 0.00 0.00 175.02 174.81 3pch s TRP 400 N -2.21 -0.16 0.26 3.16 -2.14 -0.71 -1.10 118.94 116.03 3pch s TRP 400 Ca -0.08 0.23 -0.22 0.00 2.66 0.00 0.00 56.10 58.69 3pch s TRP 400 Cb -0.03 0.09 0.03 0.00 -3.10 0.00 0.00 33.47 30.46 3pch s TRP 400 CO -0.02 -0.39 0.78 1.14 -2.66 0.00 0.00 176.95 175.80 3pch s GLN 401 N -1.37 1.68 0.71 3.25 -2.07 -0.62 0.51 119.66 121.74 3pch s GLN 401 Ca -0.13 -0.94 -0.07 0.00 -1.82 0.00 0.00 55.36 52.40 3pch s GLN 401 Cb -0.05 0.56 0.06 0.00 -1.09 0.00 0.00 33.01 32.49 3pch s GLN 401 CO 0.04 -0.77 1.02 0.00 -1.32 0.00 0.00 175.29 174.26 3pch s ALA 402 N -3.69 3.14 0.81 2.60 0.00 -1.26 -4.63 121.76 118.72 3pch s ALA 402 Ca 0.12 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 51.12 3pch s ALA 402 Cb -0.05 -2.61 0.06 0.00 0.00 0.00 0.00 23.12 20.52 3pch s ALA 402 CO 0.06 -1.32 0.40 0.27 0.00 0.00 0.00 175.76 175.17 3pch n ASN 403 N -2.94 0.20 0.26 0.00 0.23 0.20 -4.48 115.26 108.73 3pch n ASN 403 Ca 0.08 -1.25 0.18 0.00 -0.53 0.00 0.00 54.58 53.06 3pch n ASN 403 Cb 0.60 -0.29 0.89 0.00 -2.08 0.00 0.00 39.78 38.91 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 -1.37 1.54 -0.02 -2.53 0.00 -1.78 -0.83 119.26 114.26 3pch h ALA 404 Ca -0.13 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3pch h ALA 404 Cb 0.40 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.20 3pch h ALA 404 CO 0.11 -0.29 -0.24 0.41 0.00 0.00 0.00 179.25 179.24 3pch n GLY 405 N -1.29 0.45 1.20 0.00 0.00 -1.26 -3.60 105.19 100.68 3pch n GLY 405 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 1.38 0.70 3.76 -0.02 0.00 -0.36 -4.81 105.19 105.83 3pch n GLY 406 Ca 0.12 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.44 4.32 -0.07 1.61 6.06 -1.26 -4.75 118.95 124.42 3pch s ARG 407 Ca 0.00 0.73 -0.04 0.00 -2.50 0.00 0.00 55.73 53.92 3pch s ARG 407 Cb 0.00 -3.35 -0.04 0.00 0.06 0.00 0.00 34.95 31.62 3pch s ARG 407 CO 0.00 0.34 0.13 0.71 -2.50 0.00 0.00 175.30 173.99 3pch s TYR 408 N -0.11 3.51 -1.19 5.12 2.02 -1.26 -0.62 117.35 124.82 3pch s TYR 408 Ca 0.31 0.41 -0.12 0.00 -0.37 0.00 0.00 57.07 57.30 3pch s TYR 408 Cb -0.18 -1.87 0.20 0.00 -0.40 0.00 0.00 41.96 39.71 3pch s TYR 408 CO 0.17 0.67 1.34 -2.13 -1.57 0.00 0.00 175.55 174.03 3pch n ARG 409 N 1.60 3.42 -3.67 -0.62 0.63 -1.26 -4.71 116.66 112.05 3pch n ARG 409 Ca -0.16 -4.03 -0.11 0.00 -0.92 0.00 0.00 57.85 52.62 3pch n ARG 409 Cb 0.54 -2.89 -0.09 0.00 0.45 0.00 0.00 32.46 30.47 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 0.69 -0.72 0.19 -0.14 2.46 -1.26 -5.06 115.29 111.45 3pch s HIS 410 Ca 0.39 1.61 -0.14 0.00 0.47 0.00 0.00 55.06 57.39 3pch s HIS 410 Cb -0.05 0.32 0.20 0.00 -0.13 0.00 0.00 32.58 32.92 3pch s HIS 410 CO -0.02 -0.36 1.26 1.63 -2.47 0.00 0.00 174.74 174.78 3pch n LYS 411 N 3.45 -0.19 0.00 2.88 5.02 -1.26 -1.15 118.16 126.91 3pch n LYS 411 Ca -0.17 1.25 0.08 0.00 -2.02 0.00 0.00 58.31 57.45 3pch n LYS 411 Cb 0.57 -1.85 0.38 0.00 -0.02 0.00 0.00 35.03 34.10 3pch n LYS 411 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3pch n ASN 412 N -5.19 0.00 -4.53 4.39 5.03 -1.26 -4.67 115.26 109.02 3pch n ASN 412 Ca 0.08 0.36 -0.43 0.00 0.87 0.00 0.00 54.58 55.46 3pch n ASN 412 Cb 0.33 -0.43 -0.04 0.00 -1.02 0.00 0.00 39.78 38.61 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 -2.87 6.37 -0.13 6.41 2.15 -0.30 -4.86 116.67 123.45 3pch s ASP 413 Ca 0.11 -0.24 0.18 0.00 0.43 0.00 0.00 52.55 53.02 3pch s ASP 413 Cb 0.11 -2.46 0.71 0.00 -0.30 0.00 0.00 42.92 40.99 3pch s ASP 413 CO 0.29 -1.25 1.62 0.54 -0.17 0.00 0.00 175.17 176.20 3pch n ARG 414 N 7.59 3.81 -2.08 4.34 5.12 -1.26 -4.92 116.66 129.27 3pch n ARG 414 Ca 0.03 -2.90 -0.39 0.00 -1.93 0.00 0.00 57.85 52.66 3pch n ARG 414 Cb 0.48 -1.92 -0.00 0.00 -1.16 0.00 0.00 32.46 29.86 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 -1.98 2.81 -0.86 -1.55 5.04 -1.26 -4.90 117.35 114.65 3pch s TYR 415 Ca 0.50 1.43 0.14 0.00 -2.44 0.00 0.00 57.07 56.71 3pch s TYR 415 Cb 0.33 -3.62 0.61 0.00 0.35 0.00 0.00 41.96 39.63 3pch s TYR 415 CO 0.23 -2.02 1.44 1.47 -1.34 0.00 0.00 175.55 175.33 3pch n LEU 416 N -0.04 0.16 -4.75 6.97 -0.00 -1.26 -4.72 117.00 113.37 3pch n LEU 416 Ca 0.05 0.55 -0.41 0.00 -0.00 0.00 0.00 56.01 56.19 3pch n LEU 416 Cb 0.44 -0.53 -0.03 0.00 -0.00 0.00 0.00 43.42 43.30 3pch n LEU 416 CO 0.54 -0.39 0.98 0.00 -0.00 0.00 0.00 177.39 178.52 3pch s ALA 417 N -3.09 3.52 0.75 1.47 0.00 -1.26 -4.97 121.76 118.17 3pch s ALA 417 Ca 0.05 1.14 -0.11 0.00 0.00 0.00 0.00 51.96 53.04 3pch s ALA 417 Cb 0.08 -3.48 0.04 0.00 0.00 0.00 0.00 23.12 19.76 3pch s ALA 417 CO 0.24 -0.55 1.08 -1.25 0.00 0.00 0.00 175.76 175.28 3pch s PRO 418 N -0.57 2.51 0.67 0.00 0.04 -1.26 -4.74 135.00 131.64 3pch s PRO 418 Ca 0.54 0.90 -0.12 0.00 0.04 0.00 0.00 61.00 62.36 3pch s PRO 418 Cb -0.37 -1.95 -0.00 0.00 0.04 0.00 0.00 34.50 32.22 3pch s PRO 418 CO 0.42 -1.38 1.06 -0.51 0.04 0.00 0.00 177.00 176.62 3pch s LEU 419 N -5.70 3.22 -0.27 -3.56 1.43 -1.26 -4.74 118.68 107.79 3pch s LEU 419 Ca 0.60 1.65 -0.06 0.00 -1.03 0.00 0.00 54.13 55.29 3pch s LEU 419 Cb -0.15 -4.50 0.00 0.00 0.03 0.00 0.00 46.19 41.57 3pch s LEU 419 CO 0.55 -1.35 0.04 -0.62 0.23 0.00 0.00 176.35 175.20 3pch s ASP 420 N -3.59 4.89 0.59 2.29 -1.08 -1.26 -4.99 116.67 113.52 3pch s ASP 420 Ca 0.59 -0.59 0.29 0.00 -0.52 0.00 0.00 52.55 52.32 3pch s ASP 420 Cb -0.14 -1.84 1.59 0.00 -1.46 0.00 0.00 42.92 41.08 3pch s ASP 420 CO 0.51 -0.13 2.01 1.55 0.52 0.00 0.00 175.17 179.63 3pch h PRO 421 N 8.19 0.00 -0.44 4.34 0.13 -1.97 -1.58 132.00 140.67 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 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 3pch h PRO 421 CO 0.60 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.46 3pch n ASN 422 N -3.70 4.50 -3.87 1.44 4.13 -1.26 -4.93 115.26 111.57 3pch n ASN 422 Ca 0.04 -2.77 -0.26 0.00 1.68 0.00 0.00 54.58 53.27 3pch n ASN 422 Cb 0.46 -0.56 -0.17 0.00 -1.54 0.00 0.00 39.78 37.97 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 -2.41 1.33 -0.14 3.10 5.36 -0.60 -4.22 117.98 120.40 3pch s PHE 423 Ca 0.46 -0.69 -0.09 0.00 -0.96 0.00 0.00 56.93 55.65 3pch s PHE 423 Cb 0.34 -1.15 -0.03 0.00 -0.34 0.00 0.00 43.02 41.84 3pch s PHE 423 CO 0.15 -0.50 -0.15 0.78 -1.46 0.00 0.00 175.22 174.04 3pch h GLY 424 N 8.20 0.00 0.00 13.12 0.00 -1.84 -3.43 103.07 119.13 3pch h GLY 424 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.07 3pch h GLY 424 CO 0.37 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.52 3pch n GLY 425 N 1.63 1.82 3.10 4.60 0.00 -1.26 -4.55 105.19 110.53 3pch n GLY 425 Ca -0.07 -0.07 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 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 1.17 0.07 1.61 1.01 -1.26 -1.58 120.40 119.42 3pch s VAL 426 Ca 0.00 -0.60 -0.11 0.00 0.00 0.00 0.00 61.98 61.27 3pch s VAL 426 Cb 0.00 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.39 3pch s VAL 426 CO 0.00 0.34 0.24 -0.83 0.00 0.00 0.00 175.10 174.85 3pch s GLY 427 N -0.07 -0.02 -0.09 4.51 0.00 -0.26 -4.74 107.32 106.66 3pch s GLY 427 Ca 0.00 -0.33 -0.10 0.00 0.00 0.00 0.00 44.72 44.29 3pch s GLY 427 CO 0.01 -0.53 0.28 1.09 0.00 0.00 0.00 173.10 173.95 3pch s ARG 428 N -3.25 0.39 -0.16 2.90 1.70 -1.00 -0.41 118.95 119.12 3pch s ARG 428 Ca 0.00 0.26 -0.16 0.00 -0.47 0.00 0.00 55.73 55.36 3pch s ARG 428 Cb 0.02 0.18 0.04 0.00 -0.57 0.00 0.00 34.95 34.62 3pch s ARG 428 CO -0.08 -0.06 0.45 0.00 -1.08 0.00 0.00 175.30 174.53 3pch s LEU 430 N 0.18 4.14 0.64 0.00 2.96 -1.26 -0.72 118.68 124.61 3pch s LEU 430 Ca -0.01 0.20 -0.18 0.00 -0.22 0.00 0.00 54.13 53.93 3pch s LEU 430 Cb -0.03 -2.17 -0.01 0.00 0.50 0.00 0.00 46.19 44.47 3pch s LEU 430 CO 0.01 0.06 1.23 0.42 -1.32 0.00 0.00 176.35 176.75 3pch s THR 431 N 0.98 2.42 0.41 3.68 -4.23 0.34 -4.86 115.64 114.39 3pch s THR 431 Ca 0.10 0.25 -0.05 0.00 -1.18 0.00 0.00 61.69 60.80 3pch s THR 431 Cb -0.13 -3.03 0.09 0.00 1.34 0.00 0.00 72.50 70.77 3pch s THR 431 CO 0.04 -0.07 0.56 -0.90 -0.54 0.00 0.00 174.62 173.71 3pch n ASP 432 N -1.92 0.24 -0.36 3.99 5.68 -0.12 -1.60 116.55 122.46 3pch n ASP 432 Ca 0.14 -1.33 0.26 0.00 -0.50 0.00 0.00 54.79 53.36 3pch n ASP 432 Cb 0.49 -0.41 0.52 0.00 -1.14 0.00 0.00 41.12 40.58 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 -0.63 0.44 -0.58 -1.12 0.02 -1.95 0.87 113.55 110.61 3pch h SER 433 Ca -0.18 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 3pch h SER 433 Cb 0.55 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.16 3pch h SER 433 CO 0.15 -0.03 0.00 0.47 -1.14 0.00 0.00 176.83 176.28 3pch n ASP 434 N -4.77 3.37 -0.10 3.07 8.00 -1.26 -4.57 116.55 120.29 3pch n ASP 434 Ca 0.30 -2.10 -0.01 0.00 0.71 0.00 0.00 54.79 53.69 3pch n ASP 434 Cb 1.02 -0.43 -0.01 0.00 -0.02 0.00 0.00 41.12 41.69 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 1.32 0.48 3.84 0.44 0.00 0.30 -4.74 105.19 106.82 3pch n GLY 435 Ca 0.20 -0.21 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3pch n GLY 435 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3pch s TYR 436 N -1.86 3.48 0.06 1.61 2.02 -1.26 -0.39 117.35 121.02 3pch s TYR 436 Ca 0.00 1.25 -0.02 0.00 -0.37 0.00 0.00 57.07 57.93 3pch s TYR 436 Cb 0.00 -2.54 -0.04 0.00 -0.40 0.00 0.00 41.96 38.98 3pch s TYR 436 CO 0.00 0.20 0.01 1.52 -1.57 0.00 0.00 175.55 175.71 3pch s TYR 437 N -1.79 0.50 -0.10 2.71 1.13 -0.28 -0.95 117.35 118.58 3pch s TYR 437 Ca 0.49 -1.02 -0.28 0.00 -1.41 0.00 0.00 57.07 54.85 3pch s TYR 437 Cb -0.13 -0.35 0.06 0.00 -1.10 0.00 0.00 41.96 40.44 3pch s TYR 437 CO 0.19 -0.42 0.64 -1.54 -2.51 0.00 0.00 175.55 171.92 3pch s SER 438 N -2.92 -0.63 0.05 -0.18 1.04 -1.26 -1.76 113.70 108.04 3pch s SER 438 Ca 0.08 0.82 0.02 0.00 0.48 0.00 0.00 55.95 57.35 3pch s SER 438 Cb 0.08 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.89 3pch s SER 438 CO -0.09 -0.50 -0.08 -0.36 0.98 0.00 0.00 173.24 173.19 3pch s PHE 439 N -0.82 0.73 -0.10 5.02 0.08 0.18 -4.89 117.98 118.18 3pch s PHE 439 Ca -0.09 -0.57 0.03 0.00 0.12 0.00 0.00 56.93 56.42 3pch s PHE 439 Cb -0.02 -0.43 0.01 0.00 -0.57 0.00 0.00 43.02 42.01 3pch s PHE 439 CO 0.07 -0.09 -0.19 0.50 -0.10 0.00 0.00 175.22 175.41 3pch s ARG 440 N -1.98 2.61 0.00 0.44 3.52 -0.60 -0.12 118.95 122.82 3pch s ARG 440 Ca -0.06 -0.72 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 3pch s ARG 440 Cb -0.07 -2.07 0.00 0.00 -1.56 0.00 0.00 34.95 31.24 3pch s ARG 440 CO -0.00 0.06 0.00 -2.37 -0.81 0.00 0.00 175.30 172.17 3pch n THR 441 N 3.84 0.00 -4.68 4.11 5.66 0.68 0.10 114.28 123.98 3pch n THR 441 Ca -0.20 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.50 3pch n THR 441 Cb 0.52 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.17 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 -2.92 2.66 0.15 1.09 -5.25 -1.26 -0.37 121.20 115.31 3pch s ILE 442 Ca 0.00 -1.25 -0.31 0.00 -0.99 0.00 0.00 60.65 58.10 3pch s ILE 442 Cb 0.00 -2.11 -0.09 0.00 2.95 0.00 0.00 42.46 43.21 3pch s ILE 442 CO 0.00 0.33 1.48 -0.75 -1.79 0.00 0.00 174.94 174.21 3pch s LYS 443 N -1.44 4.27 0.64 0.37 2.20 -0.14 -4.89 119.74 120.74 3pch s LYS 443 Ca 0.14 2.23 -0.14 0.00 -0.36 0.00 0.00 55.97 57.84 3pch s LYS 443 Cb -0.10 -3.19 -0.02 0.00 -1.51 0.00 0.00 37.83 33.01 3pch s LYS 443 CO 0.05 -0.52 1.06 -1.25 -0.36 0.00 0.00 175.35 174.34 3pch s PRO 444 N 0.98 3.12 0.17 4.03 0.04 -1.26 -4.30 135.00 137.78 3pch s PRO 444 Ca 0.67 1.15 0.03 0.00 0.04 0.00 0.00 61.00 62.88 3pch s PRO 444 Cb -0.41 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.09 3pch s PRO 444 CO 0.32 -0.97 0.31 0.20 0.04 0.00 0.00 177.00 176.90 3pch s GLY 445 N -3.07 1.61 1.14 0.56 0.00 -0.92 -4.68 107.32 101.95 3pch s GLY 445 Ca 0.62 -1.06 -0.14 0.00 0.00 0.00 0.00 44.72 44.14 3pch s GLY 445 CO 0.43 -1.06 1.05 -4.14 0.00 0.00 0.00 173.10 169.38 3pch s PRO 446 N -3.39 -0.70 -0.13 2.90 0.02 -1.26 -3.86 135.00 128.58 3pch s PRO 446 Ca 0.35 0.49 -0.29 0.00 0.02 0.00 0.00 61.00 61.57 3pch s PRO 446 Cb -0.11 -1.61 0.07 0.00 0.02 0.00 0.00 34.50 32.88 3pch s PRO 446 CO 0.29 -3.49 0.70 1.52 -0.33 0.00 0.00 177.00 175.69 3pch s TYR 447 N -2.72 -0.70 0.54 6.54 1.13 -1.10 -4.08 117.35 116.96 3pch s TYR 447 Ca 0.68 1.39 -0.18 0.00 -1.41 0.00 0.00 57.07 57.54 3pch s TYR 447 Cb -0.19 0.36 -0.06 0.00 -1.10 0.00 0.00 41.96 40.97 3pch s TYR 447 CO 0.60 -0.52 1.07 -1.25 -2.51 0.00 0.00 175.55 172.93 3pch s PRO 448 N -0.64 3.52 0.01 -3.49 0.04 -1.26 -0.56 135.00 132.61 3pch s PRO 448 Ca -0.07 1.37 -0.15 0.00 0.04 0.00 0.00 61.00 62.19 3pch s PRO 448 Cb -0.02 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.49 3pch s PRO 448 CO 0.07 -0.67 0.32 1.67 0.04 0.00 0.00 177.00 178.42 3pch s TRP 449 N -2.10 -0.16 -1.40 0.56 1.48 -0.95 -4.89 118.94 111.49 3pch s TRP 449 Ca 0.67 0.15 -0.15 0.00 -1.06 0.00 0.00 56.10 55.72 3pch s TRP 449 Cb -0.18 0.10 0.06 0.00 -1.16 0.00 0.00 33.47 32.29 3pch s TRP 449 CO 0.27 -0.45 2.06 0.54 -4.06 0.00 0.00 176.95 175.31 3pch n ARG 450 N 0.95 3.00 0.00 3.25 1.74 -1.26 -4.35 116.66 119.99 3pch n ARG 450 Ca -0.20 -2.87 0.00 0.00 -0.77 0.00 0.00 57.85 54.01 3pch n ARG 450 Cb 0.58 -3.32 0.00 0.00 -1.02 0.00 0.00 32.46 28.70 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 6.59 0.00 -4.27 0.55 5.15 -1.26 -5.03 115.26 116.99 3pch n ASN 451 Ca 0.50 0.00 -0.28 0.00 -0.60 0.00 0.00 54.58 54.20 3pch n ASN 451 Cb 0.41 0.00 0.17 0.00 -0.53 0.00 0.00 39.78 39.83 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 -0.26 1.78 0.55 8.20 0.00 -1.26 -4.96 107.32 111.36 3pch s GLY 452 Ca 0.00 -1.34 0.33 0.00 0.00 0.00 0.00 44.72 43.70 3pch s GLY 452 CO 0.00 -0.62 2.04 -2.55 0.00 0.00 0.00 173.10 171.96 3pch h PRO 453 N -1.36 0.00 -1.45 2.90 0.11 -1.97 -3.28 132.00 126.95 3pch h PRO 453 Ca -0.42 0.00 -0.42 0.00 0.11 0.00 0.00 66.00 65.27 3pch h PRO 453 Cb 1.24 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.95 3pch h PRO 453 CO 0.38 0.06 -1.18 -1.71 -0.21 0.00 0.00 178.00 175.34 3pch n ASN 454 N -3.22 1.30 -4.82 -2.05 5.15 -1.26 -5.08 115.26 105.27 3pch n ASN 454 Ca -0.00 -2.87 -0.38 0.00 -0.60 0.00 0.00 54.58 50.72 3pch n ASN 454 Cb 0.28 -0.57 -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 -2.84 6.94 -0.05 1.20 1.01 -1.24 -5.06 116.67 116.62 3pch s ASP 455 Ca 0.33 1.12 -0.02 0.00 0.71 0.00 0.00 52.55 54.69 3pch s ASP 455 Cb 0.41 -2.31 0.03 0.00 1.01 0.00 0.00 42.92 42.06 3pch s ASP 455 CO -0.02 0.29 0.04 0.26 0.21 0.00 0.00 175.17 175.96 3pch s TRP 456 N -1.11 0.23 0.30 4.23 0.52 -1.26 -2.23 118.94 119.61 3pch s TRP 456 Ca 0.27 0.13 -0.29 0.00 0.02 0.00 0.00 56.10 56.23 3pch s TRP 456 Cb -0.18 -0.56 -0.10 0.00 -1.15 0.00 0.00 33.47 31.48 3pch s TRP 456 CO 0.16 -0.22 1.19 1.03 0.02 0.00 0.00 176.95 179.14 3pch s ARG 457 N 2.06 4.51 0.81 4.98 1.81 0.28 -4.78 118.95 128.62 3pch s ARG 457 Ca 0.04 1.99 -0.12 0.00 -1.72 0.00 0.00 55.73 55.92 3pch s ARG 457 Cb -0.12 -3.14 0.09 0.00 -0.45 0.00 0.00 34.95 31.32 3pch s ARG 457 CO -0.04 0.02 1.15 -2.14 -0.68 0.00 0.00 175.30 173.61 3pch s PRO 458 N -1.52 1.74 0.32 3.54 0.02 -1.26 -2.70 135.00 135.14 3pch s PRO 458 Ca 0.47 1.50 -0.29 0.00 0.02 0.00 0.00 61.00 62.70 3pch s PRO 458 Cb -0.35 -1.81 -0.11 0.00 0.02 0.00 0.00 34.50 32.24 3pch s PRO 458 CO 0.46 -2.08 1.53 0.00 -0.33 0.00 0.00 177.00 176.58 3pch s ALA 459 N -2.51 3.67 0.07 -1.55 0.00 -1.26 -4.70 121.76 115.47 3pch s ALA 459 Ca 0.67 1.54 -0.23 0.00 0.00 0.00 0.00 51.96 53.94 3pch s ALA 459 Cb -0.23 -3.62 0.06 0.00 0.00 0.00 0.00 23.12 19.33 3pch s ALA 459 CO 0.53 -0.97 0.54 -3.38 0.00 0.00 0.00 175.76 172.48 3pch s HIS 460 N -0.42 -0.46 -0.10 0.00 -3.43 -1.26 -3.92 115.29 105.70 3pch s HIS 460 Ca 0.59 0.47 0.02 0.00 -0.80 0.00 0.00 55.06 55.34 3pch s HIS 460 Cb -0.47 0.39 -0.02 0.00 -1.43 0.00 0.00 32.58 31.06 3pch s HIS 460 CO 0.53 -0.69 -0.15 0.42 -2.00 0.00 0.00 174.74 172.85 3pch s ILE 461 N -2.69 2.91 0.11 -5.38 1.01 -0.53 -4.64 121.20 112.00 3pch s ILE 461 Ca -0.04 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 59.58 3pch s ILE 461 Cb -0.00 -2.18 -0.06 0.00 0.01 0.00 0.00 42.46 40.23 3pch s ILE 461 CO -0.04 0.55 0.95 -1.00 0.00 0.00 0.00 174.94 175.40 3pch s HIS 462 N -0.05 3.81 0.06 3.97 3.76 0.18 -0.79 115.29 126.23 3pch s HIS 462 Ca -0.03 1.78 0.08 0.00 -0.15 0.00 0.00 55.06 56.74 3pch s HIS 462 Cb -0.14 -3.03 -0.03 0.00 1.11 0.00 0.00 32.58 30.49 3pch s HIS 462 CO 0.04 0.22 -0.23 -0.06 -0.85 0.00 0.00 174.74 173.86 3pch s PHE 463 N -0.03 2.00 -0.06 1.40 0.40 0.95 -1.74 117.98 120.90 3pch s PHE 463 Ca 0.46 -0.39 0.01 0.00 -0.60 0.00 0.00 56.93 56.41 3pch s PHE 463 Cb -0.23 -1.17 0.02 0.00 0.51 0.00 0.00 43.02 42.15 3pch s PHE 463 CO 0.29 0.14 -0.05 0.20 0.70 0.00 0.00 175.22 176.50 3pch s GLY 464 N -1.37 0.54 -0.07 4.36 0.00 0.54 -0.88 107.32 110.45 3pch s GLY 464 Ca 0.09 -0.17 0.01 0.00 0.00 0.00 0.00 44.72 44.66 3pch s GLY 464 CO 0.03 0.50 -0.09 -0.42 0.00 0.00 0.00 173.10 173.12 3pch s ILE 465 N 1.07 0.93 -0.06 0.90 1.09 0.21 -0.88 121.20 124.45 3pch s ILE 465 Ca -0.08 -0.33 -0.08 0.00 -1.10 0.00 0.00 60.65 59.05 3pch s ILE 465 Cb -0.14 -0.89 -0.05 0.00 -1.06 0.00 0.00 42.46 40.32 3pch s ILE 465 CO -0.01 0.32 0.34 0.77 -0.10 0.00 0.00 174.94 176.26 3pch h SER 466 N 7.26 -0.25 -3.86 3.58 4.64 -1.49 -0.65 113.55 122.78 3pch h SER 466 Ca -0.32 0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.02 3pch h SER 466 Cb 1.17 0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.32 3pch h SER 466 CO 0.46 0.20 -0.01 0.61 -0.87 0.00 0.00 176.83 177.22 3pch n GLY 467 N 1.02 -2.11 0.20 -0.77 0.00 -1.26 -2.17 105.19 100.10 3pch n GLY 467 Ca -0.04 -1.44 0.15 0.00 0.00 0.00 0.00 46.02 44.68 3pch n GLY 467 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3pch h PRO 468 N 0.00 0.00 -3.22 1.61 0.14 -1.94 -3.46 132.00 125.13 3pch h PRO 468 Ca 0.00 0.00 -0.03 0.00 0.14 0.00 0.00 66.00 66.11 3pch h PRO 468 Cb 0.03 0.00 -0.04 0.00 0.14 0.00 0.00 31.00 31.14 3pch h PRO 468 CO 0.00 0.00 0.15 -1.54 0.14 0.00 0.00 178.00 176.75 3pch s SER 469 N -4.92 0.02 0.54 1.44 1.04 -1.26 -3.65 113.70 106.91 3pch s SER 469 Ca 0.03 -0.99 0.35 0.00 0.48 0.00 0.00 55.95 55.81 3pch s SER 469 Cb 0.09 0.76 1.55 0.00 0.10 0.00 0.00 66.02 68.52 3pch s SER 469 CO 0.46 -1.46 2.03 0.16 0.98 0.00 0.00 173.24 175.41 3pch h ILE 470 N 2.05 0.00 0.00 -1.02 3.07 -1.39 -1.81 117.51 118.40 3pch h ILE 470 Ca -0.27 -0.35 -0.13 0.00 1.55 0.00 0.00 64.86 65.66 3pch h ILE 470 Cb 1.25 1.30 -0.02 0.00 -0.27 0.00 0.00 36.82 39.08 3pch h ILE 470 CO 0.34 0.00 -0.61 0.00 -1.05 0.00 0.00 178.15 176.83 3pch h ALA 471 N 2.03 0.87 0.00 0.16 0.00 -1.78 -3.24 119.26 117.31 3pch h ALA 471 Ca 0.00 -0.56 -0.14 0.00 0.00 0.00 0.00 54.91 54.22 3pch h ALA 471 Cb 0.37 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3pch h ALA 471 CO 0.00 0.76 -1.13 1.79 0.00 0.00 0.00 179.25 180.68 3pch h THR 472 N 0.00 0.56 -1.64 0.00 1.35 -1.59 -3.48 112.91 108.12 3pch h THR 472 Ca -0.01 -1.98 -0.69 0.00 -0.55 0.00 0.00 66.41 63.19 3pch h THR 472 Cb 1.17 2.10 0.05 0.00 -1.73 0.00 0.00 68.15 69.74 3pch h THR 472 CO 0.08 0.32 0.45 1.17 -0.25 0.00 0.00 175.52 177.29 3pch n LYS 473 N -2.97 1.09 -3.89 4.72 3.00 -0.92 -4.74 118.16 114.45 3pch n LYS 473 Ca -0.06 0.39 -0.11 0.00 -0.00 0.00 0.00 58.31 58.54 3pch n LYS 473 Cb 0.79 -2.03 -0.12 0.00 0.00 0.00 0.00 35.03 33.67 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 0.60 1.80 -0.13 3.14 2.96 -0.25 -5.02 118.68 121.79 3pch s LEU 474 Ca 0.85 -0.13 0.02 0.00 -0.22 0.00 0.00 54.13 54.66 3pch s LEU 474 Cb -0.98 0.35 0.01 0.00 0.50 0.00 0.00 46.19 46.07 3pch s LEU 474 CO 0.48 -0.21 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.47 3pch s ILE 475 N -0.81 1.93 0.05 6.68 1.01 -1.26 -0.62 121.20 128.18 3pch s ILE 475 Ca -0.09 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.66 3pch s ILE 475 Cb -0.05 -1.71 -0.00 0.00 0.01 0.00 0.00 42.46 40.70 3pch s ILE 475 CO 0.00 0.53 0.04 1.07 0.00 0.00 0.00 174.94 176.58 3pch n THR 476 N 4.03 0.00 -4.04 2.92 5.66 -0.06 -5.00 114.28 117.79 3pch n THR 476 Ca -0.20 -0.35 -0.15 0.00 -3.05 0.00 0.00 64.05 60.31 3pch n THR 476 Cb 0.52 0.18 -0.15 0.00 -1.55 0.00 0.00 70.33 69.33 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 -2.19 0.29 -0.08 1.09 -0.21 -1.26 -0.04 119.66 117.26 3pch s GLN 477 Ca 0.06 -0.09 -0.13 0.00 0.02 0.00 0.00 55.36 55.22 3pch s GLN 477 Cb 0.00 -0.31 -0.05 0.00 1.00 0.00 0.00 33.01 33.65 3pch s GLN 477 CO 0.04 0.04 0.32 -1.17 -2.12 0.00 0.00 175.29 172.40 3pch s LEU 478 N 0.12 4.38 0.32 2.90 0.20 0.03 -4.82 118.68 121.81 3pch s LEU 478 Ca -0.01 0.72 0.10 0.00 0.69 0.00 0.00 54.13 55.62 3pch s LEU 478 Cb -0.04 -2.42 -0.05 0.00 -0.43 0.00 0.00 46.19 43.25 3pch s LEU 478 CO -0.00 0.26 -0.04 -0.31 -0.29 0.00 0.00 176.35 175.97 3pch s TYR 479 N -0.53 2.51 -0.11 5.38 2.02 0.65 -1.45 117.35 125.81 3pch s TYR 479 Ca 0.20 -0.39 -0.03 0.00 -0.37 0.00 0.00 57.07 56.47 3pch s TYR 479 Cb -0.14 -1.34 -0.03 0.00 -0.40 0.00 0.00 41.96 40.04 3pch s TYR 479 CO 0.08 0.55 0.01 -0.06 -1.57 0.00 0.00 175.55 174.57 3pch s PHE 480 N -2.50 3.18 0.13 2.71 0.40 -1.25 -0.17 117.98 120.48 3pch s PHE 480 Ca 0.33 0.12 -0.35 0.00 -0.60 0.00 0.00 56.93 56.44 3pch s PHE 480 Cb -0.02 -1.87 -0.16 0.00 0.51 0.00 0.00 43.02 41.48 3pch s PHE 480 CO 0.18 0.36 1.21 -1.91 0.70 0.00 0.00 175.22 175.77 3pch n GLU 481 N 2.57 1.08 -0.48 0.44 2.13 -0.54 -1.97 120.64 123.86 3pch n GLU 481 Ca -0.18 0.39 0.00 0.00 0.66 0.00 0.00 57.16 58.02 3pch n GLU 481 Cb 0.53 -1.93 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 2.18 1.52 3.62 8.31 0.00 -1.26 -4.99 105.19 114.59 3pch n GLY 482 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.74 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 3.53 0.10 1.61 -0.08 -0.83 -4.85 116.55 116.02 3pch n ASP 483 Ca 0.00 0.60 0.10 0.00 -1.51 0.00 0.00 54.79 53.98 3pch n ASP 483 Cb 0.00 -1.49 0.43 0.00 2.34 0.00 0.00 41.12 42.40 3pch n ASP 483 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3pch n PRO 484 N 7.92 0.13 0.15 -0.67 -0.04 -1.26 -2.36 135.00 138.87 3pch n PRO 484 Ca 0.26 0.43 0.03 0.00 -0.04 0.00 0.00 63.50 64.18 3pch n PRO 484 Cb 0.39 -1.78 0.15 0.00 -0.04 0.00 0.00 33.50 32.22 3pch n PRO 484 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3pch h LEU 485 N 0.00 0.00 -0.75 1.53 3.38 -1.95 -3.37 115.31 114.15 3pch h LEU 485 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 3pch h LEU 485 Cb 0.24 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 40.88 3pch h LEU 485 CO 0.00 0.51 -0.52 0.40 0.09 0.00 0.00 178.44 178.92 3pch h ILE 486 N 0.00 0.02 0.00 1.22 2.04 -1.84 -0.66 117.51 118.29 3pch h ILE 486 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3pch h ILE 486 Cb 1.21 0.02 0.00 0.00 -0.74 0.00 0.00 36.82 37.31 3pch h ILE 486 CO 0.07 0.00 0.00 -0.81 0.00 0.00 0.00 178.15 177.41 3pch n PRO 487 N -5.35 0.07 0.00 2.37 -0.05 -1.26 -2.39 135.00 128.40 3pch n PRO 487 Ca 0.02 0.36 0.11 0.00 -0.05 0.00 0.00 63.50 63.94 3pch n PRO 487 Cb 0.32 -1.65 0.00 0.00 -0.05 0.00 0.00 33.50 32.12 3pch n PRO 487 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 175.50 174.12 3pch n MET 488 N -1.80 1.11 -2.74 0.54 2.81 -0.28 -4.93 117.12 111.84 3pch n MET 488 Ca 0.02 -0.92 -0.42 0.00 -1.81 0.00 0.00 57.70 54.57 3pch n MET 488 Cb 0.16 -1.48 -0.03 0.00 -0.71 0.00 0.00 33.22 31.16 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 7.32 0.00 0.04 0.00 0.11 -1.89 0.16 132.00 137.73 3pch h PRO 490 Ca -0.26 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.61 3pch h PRO 490 Cb 1.11 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.22 3pch h PRO 490 CO 0.90 0.09 -1.03 0.82 -0.21 0.00 0.00 178.00 178.57 3pch h ILE 491 N 0.00 1.41 -0.30 4.15 2.04 -1.92 -2.23 117.51 120.67 3pch h ILE 491 Ca -0.00 -2.58 -0.06 0.00 1.00 0.00 0.00 64.86 63.23 3pch h ILE 491 Cb 0.19 2.55 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 3pch h ILE 491 CO 0.01 0.77 -0.03 0.58 0.00 0.00 0.00 178.15 179.48 3pch h VAL 492 N 0.20 1.27 0.00 1.67 2.07 -1.62 -2.65 116.25 117.19 3pch h VAL 492 Ca -0.10 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.40 3pch h VAL 492 Cb 1.69 1.33 0.00 0.00 -1.52 0.00 0.00 31.29 32.79 3pch h VAL 492 CO 0.18 0.33 0.00 0.29 0.02 0.00 0.00 177.57 178.39 3pch n LYS 493 N -4.53 0.15 0.28 1.57 5.02 0.49 -1.18 118.16 119.96 3pch n LYS 493 Ca -0.03 0.19 0.16 0.00 -2.02 0.00 0.00 58.31 56.61 3pch n LYS 493 Cb 0.29 -1.50 0.82 0.00 -0.02 0.00 0.00 35.03 34.61 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 -2.97 4.39 4.64 -1.02 -3.35 113.55 115.24 3pch h SER 494 Ca 0.00 0.00 -0.59 0.00 -0.47 0.00 0.00 61.79 60.73 3pch h SER 494 Cb 0.10 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.08 3pch h SER 494 CO 0.00 0.06 0.75 -0.63 -0.87 0.00 0.00 176.83 176.14 3pch s ILE 495 N -3.99 4.17 0.34 0.95 1.01 -0.33 -3.81 121.20 119.55 3pch s ILE 495 Ca -0.02 0.36 0.02 0.00 0.00 0.00 0.00 60.65 61.01 3pch s ILE 495 Cb 0.12 -4.67 0.27 0.00 0.01 0.00 0.00 42.46 38.19 3pch s ILE 495 CO 0.53 -1.35 1.98 0.00 0.00 0.00 0.00 174.94 176.10 3pch h ALA 496 N 9.53 1.56 -2.77 9.38 0.00 -1.86 -3.42 119.26 131.68 3pch h ALA 496 Ca -0.27 -0.04 -0.63 0.00 0.00 0.00 0.00 54.91 53.98 3pch h ALA 496 Cb 1.06 -0.26 -0.15 0.00 0.00 0.00 0.00 17.79 18.45 3pch h ALA 496 CO 1.16 0.37 -0.27 1.21 0.00 0.00 0.00 179.25 181.72 3pch s ASN 497 N -6.31 6.24 0.39 0.00 3.04 -1.26 -4.97 114.94 112.07 3pch s ASN 497 Ca -0.10 0.28 0.14 0.00 0.04 0.00 0.00 52.86 53.21 3pch s ASN 497 Cb 0.18 -2.20 0.97 0.00 -1.54 0.00 0.00 41.25 38.67 3pch s ASN 497 CO 0.78 -0.15 1.86 1.55 -3.04 0.00 0.00 177.10 178.10 3pch h PRO 498 N 8.07 0.51 -0.45 0.43 0.13 -2.00 0.33 132.00 139.01 3pch h PRO 498 Ca -0.33 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.72 3pch h PRO 498 Cb 1.17 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.16 3pch h PRO 498 CO 0.64 0.34 0.05 0.93 -0.23 0.00 0.00 178.00 179.73 3pch h GLU 499 N 0.52 0.70 -0.51 0.86 5.08 -1.97 -2.17 114.58 117.10 3pch h GLU 499 Ca 0.46 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.57 3pch h GLU 499 Cb 0.98 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 3pch h GLU 499 CO -0.20 0.68 -0.05 0.00 -1.00 0.00 0.00 179.01 178.44 3pch h ALA 500 N 1.39 0.94 -0.89 3.43 0.00 -0.71 -2.84 119.26 120.58 3pch h ALA 500 Ca 0.14 -0.31 0.03 0.00 0.00 0.00 0.00 54.91 54.77 3pch h ALA 500 Cb 0.34 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.89 3pch h ALA 500 CO 0.01 0.63 0.58 0.28 0.00 0.00 0.00 179.25 180.75 3pch h VAL 501 N 0.82 1.16 -0.56 0.00 2.07 -1.08 -2.12 116.25 116.54 3pch h VAL 501 Ca 0.14 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 67.30 3pch h VAL 501 Cb 0.57 -0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 30.25 3pch h VAL 501 CO 0.03 0.20 0.37 1.56 0.02 0.00 0.00 177.57 179.76 3pch h GLN 502 N 1.12 0.67 0.00 1.57 1.08 -1.16 -1.79 115.11 116.61 3pch h GLN 502 Ca 0.35 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.50 3pch h GLN 502 Cb -0.00 -0.15 -0.00 0.00 -0.05 0.00 0.00 27.48 27.28 3pch h GLN 502 CO -0.10 0.45 -0.05 1.96 -0.95 0.00 0.00 178.83 180.13 3pch h GLN 503 N 0.69 0.00 -0.01 1.46 4.20 -1.37 -2.68 115.11 117.40 3pch h GLN 503 Ca 0.22 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.93 3pch h GLN 503 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 3pch h GLN 503 CO -0.05 0.05 -0.19 1.28 -0.67 0.00 0.00 178.83 179.25 3pch n LEU 504 N -3.43 1.54 -4.61 1.46 4.77 -0.67 -4.87 117.00 111.19 3pch n LEU 504 Ca -0.02 -0.49 -0.41 0.00 -0.03 0.00 0.00 56.01 55.06 3pch n LEU 504 Cb 0.18 -0.05 -0.07 0.00 -2.33 0.00 0.00 43.42 41.15 3pch n LEU 504 CO 0.26 0.27 0.34 -0.63 -1.33 0.00 0.00 177.39 176.31 3pch s ILE 505 N -2.29 4.99 0.23 -0.08 1.01 -1.01 -0.25 121.20 123.79 3pch s ILE 505 Ca 0.28 0.89 -0.30 0.00 0.00 0.00 0.00 60.65 61.52 3pch s ILE 505 Cb 0.20 -3.94 -0.09 0.00 0.01 0.00 0.00 42.46 38.64 3pch s ILE 505 CO 0.45 -0.05 1.06 0.00 0.00 0.00 0.00 174.94 176.40 3pch s ALA 506 N 2.49 3.37 -0.10 9.38 0.00 0.76 -4.86 121.76 132.80 3pch s ALA 506 Ca 0.24 0.79 -0.06 0.00 0.00 0.00 0.00 51.96 52.94 3pch s ALA 506 Cb -0.15 -3.31 -0.04 0.00 0.00 0.00 0.00 23.12 19.62 3pch s ALA 506 CO 0.10 -0.09 0.12 0.15 0.00 0.00 0.00 175.76 176.05 3pch s LYS 507 N -0.94 3.36 0.38 0.00 -0.14 -0.97 -1.46 119.74 119.97 3pch s LYS 507 Ca 0.46 -0.20 -0.28 0.00 -1.36 0.00 0.00 55.97 54.58 3pch s LYS 507 Cb -0.29 -3.11 -0.11 0.00 -1.68 0.00 0.00 37.83 32.63 3pch s LYS 507 CO 0.36 0.75 1.49 -0.11 -0.76 0.00 0.00 175.35 177.09 3pch n LEU 508 N 1.86 4.82 -3.57 3.17 7.94 -1.26 -0.69 117.00 129.27 3pch n LEU 508 Ca -0.19 1.23 -0.29 0.00 -1.11 0.00 0.00 56.01 55.66 3pch n LEU 508 Cb 0.54 -1.63 -0.12 0.00 0.53 0.00 0.00 43.42 42.75 3pch n LEU 508 CO 0.32 0.18 -0.27 -0.62 -1.11 0.00 0.00 177.39 175.90 3pch s ASP 509 N -0.12 2.95 0.53 1.96 2.15 0.26 -4.81 116.67 119.58 3pch s ASP 509 Ca 0.53 -2.75 0.19 0.00 0.43 0.00 0.00 52.55 50.96 3pch s ASP 509 Cb -0.47 -0.74 1.36 0.00 -0.30 0.00 0.00 42.92 42.76 3pch s ASP 509 CO 0.64 -0.23 2.15 0.24 -0.17 0.00 0.00 175.17 177.80 3pch h MET 510 N 6.37 0.00 -0.09 4.34 2.86 -1.93 -2.19 114.93 124.30 3pch h MET 510 Ca 0.10 0.00 -0.04 0.00 -2.06 0.00 0.00 59.70 57.71 3pch h MET 510 Cb 0.92 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 3pch h MET 510 CO 0.41 0.03 -0.11 -0.91 1.06 0.00 0.00 176.91 177.38 3pch h ASN 511 N 0.00 0.12 0.02 1.22 2.35 -1.94 -2.75 115.58 114.60 3pch h ASN 511 Ca -0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3pch h ASN 511 Cb 0.05 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.39 3pch h ASN 511 CO 0.00 0.25 -0.38 -3.20 -1.65 0.00 0.00 177.43 172.46 3pch n ASN 512 N -4.34 1.97 -4.76 5.81 5.15 -0.83 -4.96 115.26 113.29 3pch n ASN 512 Ca -0.01 -1.48 -0.31 0.00 -0.60 0.00 0.00 54.58 52.18 3pch n ASN 512 Cb 0.22 0.36 0.10 0.00 -0.53 0.00 0.00 39.78 39.93 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 -2.41 2.12 -0.34 5.20 0.00 -1.04 -4.75 121.76 120.53 3pch s ALA 513 Ca 0.21 0.11 -0.07 0.00 0.00 0.00 0.00 51.96 52.21 3pch s ALA 513 Cb 0.19 -3.22 0.04 0.00 0.00 0.00 0.00 23.12 20.12 3pch s ALA 513 CO 0.53 -1.85 0.11 -0.80 0.00 0.00 0.00 175.76 173.75 3pch s ASN 514 N -3.50 5.34 0.31 0.00 0.01 0.72 -4.99 114.94 112.82 3pch s ASN 514 Ca 0.61 -1.15 -0.29 0.00 -0.71 0.00 0.00 52.86 51.33 3pch s ASN 514 Cb -0.17 -1.88 -0.13 0.00 0.41 0.00 0.00 41.25 39.49 3pch s ASN 514 CO 0.56 -0.34 1.26 -2.65 -1.51 0.00 0.00 177.10 174.43 3pch n PRO 515 N 4.82 1.97 -2.23 -0.60 -0.02 -1.26 -0.96 135.00 136.72 3pch n PRO 515 Ca -0.12 0.69 -0.19 0.00 -2.02 0.00 0.00 63.50 61.86 3pch n PRO 515 Cb 0.45 -2.25 -0.02 0.00 -0.02 0.00 0.00 33.50 31.65 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 0.87 -1.70 0.00 -0.52 2.81 -1.26 -4.73 117.12 112.59 3pch n MET 516 Ca 0.07 0.99 0.00 0.00 -1.81 0.00 0.00 57.70 56.95 3pch n MET 516 Cb 0.34 -5.58 0.00 0.00 -0.71 0.00 0.00 33.22 27.27 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 -1.82 0.00 -3.68 7.83 -0.08 -0.13 -5.16 116.55 113.51 3pch n ASP 517 Ca -0.22 0.00 -0.11 0.00 -1.51 0.00 0.00 54.79 52.94 3pch n ASP 517 Cb 0.67 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.07 3pch n ASP 517 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3pch s LEU 519 N -2.37 2.95 -0.02 0.00 1.43 -0.95 -0.20 118.68 119.52 3pch s LEU 519 Ca -0.01 -0.36 -0.09 0.00 -1.03 0.00 0.00 54.13 52.64 3pch s LEU 519 Cb 0.01 -1.95 0.01 0.00 0.03 0.00 0.00 46.19 44.29 3pch s LEU 519 CO -0.07 -1.93 0.19 0.00 0.23 0.00 0.00 176.35 174.77 3pch s ALA 520 N -3.19 -0.48 0.03 4.21 0.00 -1.26 -0.54 121.76 120.54 3pch s ALA 520 Ca 0.67 0.12 0.07 0.00 0.00 0.00 0.00 51.96 52.82 3pch s ALA 520 Cb -0.05 0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.06 3pch s ALA 520 CO 0.45 -0.20 -0.20 0.71 0.00 0.00 0.00 175.76 176.52 3pch s TYR 521 N -1.08 1.77 -0.17 0.00 1.51 0.46 0.92 117.35 120.76 3pch s TYR 521 Ca -0.12 -0.36 -0.02 0.00 -1.01 0.00 0.00 57.07 55.56 3pch s TYR 521 Cb -0.06 -1.08 -0.02 0.00 -0.11 0.00 0.00 41.96 40.69 3pch s TYR 521 CO 0.02 0.05 -0.07 0.50 -1.11 0.00 0.00 175.55 174.94 3pch s ARG 522 N -0.96 3.48 -0.29 -0.62 6.06 0.13 -1.30 118.95 125.46 3pch s ARG 522 Ca 0.07 -0.61 -0.02 0.00 -2.50 0.00 0.00 55.73 52.68 3pch s ARG 522 Cb -0.08 -2.84 0.09 0.00 0.06 0.00 0.00 34.95 32.18 3pch s ARG 522 CO 0.01 0.10 0.09 0.12 -2.50 0.00 0.00 175.30 173.12 3pch s PHE 523 N 0.69 1.43 0.10 5.12 5.36 0.58 -2.28 117.98 128.97 3pch s PHE 523 Ca -0.04 -1.47 -0.12 0.00 -0.96 0.00 0.00 56.93 54.34 3pch s PHE 523 Cb -0.15 -1.49 -0.06 0.00 -0.34 0.00 0.00 43.02 40.98 3pch s PHE 523 CO 0.02 -0.82 0.46 -0.51 -1.46 0.00 0.00 175.22 172.91 3pch s ASP 524 N 1.72 6.72 -0.08 6.13 1.01 -1.26 -3.96 116.67 126.95 3pch s ASP 524 Ca 0.07 0.91 0.05 0.00 0.71 0.00 0.00 52.55 54.29 3pch s ASP 524 Cb -0.17 -2.22 -0.01 0.00 1.01 0.00 0.00 42.92 41.53 3pch s ASP 524 CO -0.23 0.15 -0.23 -0.63 0.21 0.00 0.00 175.17 174.44 3pch s ILE 525 N -1.41 2.21 -0.21 0.77 1.01 0.06 -4.95 121.20 118.68 3pch s ILE 525 Ca 0.34 -0.99 -0.02 0.00 0.00 0.00 0.00 60.65 59.98 3pch s ILE 525 Cb -0.14 -1.83 0.00 0.00 0.01 0.00 0.00 42.46 40.50 3pch s ILE 525 CO 0.18 0.56 -0.09 -0.69 0.00 0.00 0.00 174.94 174.91 3pch s VAL 526 N 0.00 2.95 0.31 2.92 1.01 -1.25 -1.15 120.40 125.18 3pch s VAL 526 Ca -0.08 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.25 3pch s VAL 526 Cb -0.15 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.87 3pch s VAL 526 CO 0.05 0.43 0.48 -0.76 0.00 0.00 0.00 175.10 175.30 3pch s LEU 527 N 1.41 4.10 0.29 3.92 1.43 0.18 -4.90 118.68 125.11 3pch s LEU 527 Ca 0.05 0.24 -0.28 0.00 -1.03 0.00 0.00 54.13 53.11 3pch s LEU 527 Cb -0.14 -3.09 -0.14 0.00 0.03 0.00 0.00 46.19 42.85 3pch s LEU 527 CO -0.06 -0.25 1.00 0.54 0.23 0.00 0.00 176.35 177.81 3pch n ARG 528 N -1.65 1.33 -2.05 1.70 1.74 -1.26 -0.90 116.66 115.56 3pch n ARG 528 Ca -0.06 0.47 -0.41 0.00 -0.77 0.00 0.00 57.85 57.08 3pch n ARG 528 Cb 0.57 -1.84 -0.02 0.00 -1.02 0.00 0.00 32.46 30.15 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 -0.57 2.59 -0.19 -0.13 0.00 -1.26 -4.29 107.32 103.46 3pch s GLY 529 Ca 0.59 1.30 -0.06 0.00 0.00 0.00 0.00 44.72 46.55 3pch s GLY 529 CO 0.60 2.14 0.01 1.62 0.00 0.00 0.00 173.10 177.47 3pch s GLN 530 N -0.91 3.73 0.17 2.90 0.74 -1.26 -0.68 119.66 124.35 3pch s GLN 530 Ca 0.55 -0.47 0.03 0.00 0.05 0.00 0.00 55.36 55.52 3pch s GLN 530 Cb -0.41 -3.09 -0.05 0.00 1.10 0.00 0.00 33.01 30.56 3pch s GLN 530 CO 0.47 0.12 -0.05 -0.98 -0.55 0.00 0.00 175.29 174.30 3pch s ARG 531 N 0.73 1.12 0.54 1.67 1.70 -0.07 -4.97 118.95 119.66 3pch s ARG 531 Ca 0.01 -1.51 -0.16 0.00 -0.47 0.00 0.00 55.73 53.60 3pch s ARG 531 Cb -0.14 -0.48 -0.07 0.00 -0.57 0.00 0.00 34.95 33.69 3pch s ARG 531 CO 0.02 -0.03 1.00 -1.59 -1.08 0.00 0.00 175.30 173.62 3pch s LYS 532 N -3.83 3.86 0.58 3.89 -2.85 -1.26 -0.66 119.74 119.47 3pch s LYS 532 Ca 0.21 0.93 -0.16 0.00 -1.00 0.00 0.00 55.97 55.95 3pch s LYS 532 Cb 0.04 -2.12 -0.04 0.00 -2.06 0.00 0.00 37.83 33.65 3pch s LYS 532 CO 0.03 -0.35 1.04 0.95 0.10 0.00 0.00 175.35 177.12 3pch s THR 533 N -2.72 3.97 -0.21 3.79 -4.23 -1.20 -4.72 115.64 110.32 3pch s THR 533 Ca 0.58 0.93 -0.18 0.00 -1.18 0.00 0.00 61.69 61.84 3pch s THR 533 Cb -0.10 -3.46 0.06 0.00 1.34 0.00 0.00 72.50 70.34 3pch s THR 533 CO 0.35 -0.56 0.56 -1.38 -0.54 0.00 0.00 174.62 173.05 3pch s HIS 534 N -2.51 -0.65 -1.48 3.99 -3.43 -1.26 -4.92 115.29 105.03 3pch s HIS 534 Ca 0.62 1.54 -0.14 0.00 -0.80 0.00 0.00 55.06 56.28 3pch s HIS 534 Cb -0.15 0.25 0.11 0.00 -1.43 0.00 0.00 32.58 31.37 3pch s HIS 534 CO 0.36 -0.32 0.67 1.19 -2.00 0.00 0.00 174.74 174.64 3pch n PHE 535 N 3.06 -1.83 1.82 0.38 3.72 -1.26 -5.25 117.46 118.11 3pch n PHE 535 Ca -0.15 0.66 0.15 0.00 -0.05 0.00 0.00 57.45 58.06 3pch n PHE 535 Cb 0.56 -3.01 0.80 0.00 -0.94 0.00 0.00 39.48 36.89 3pch n PHE 535 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10