#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hn8 h ALA 296 N 0.00 -0.63 0.00 4.61 0.00 -2.04 -3.09 119.26 118.12 3hn8 h ALA 296 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3hn8 h ALA 296 Cb 0.00 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3hn8 h ALA 296 CO 0.00 -0.60 0.00 -2.30 0.00 0.00 0.00 179.25 176.35 3hn8 n PRO 297 N -5.20 0.36 -3.19 0.00 -0.02 -1.26 -4.58 135.00 121.12 3hn8 n PRO 297 Ca -0.08 0.00 -0.45 0.00 -2.02 0.00 0.00 63.50 60.95 3hn8 n PRO 297 Cb 0.26 -1.02 -0.05 0.00 -0.02 0.00 0.00 33.50 32.66 3hn8 n PRO 297 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hn8 s GLY 299 N 3.21 2.61 0.12 0.00 0.00 -1.24 -4.90 107.32 107.12 3hn8 s GLY 299 Ca 0.10 0.89 -0.10 0.00 0.00 0.00 0.00 44.72 45.61 3hn8 s GLY 299 CO 0.07 1.26 0.26 1.09 0.00 0.00 0.00 173.10 175.79 3hn8 s ARG 300 N -3.44 0.99 0.03 2.90 1.70 -0.88 -0.78 118.95 119.47 3hn8 s ARG 300 Ca 0.74 -0.99 0.02 0.00 -0.47 0.00 0.00 55.73 55.04 3hn8 s ARG 300 Cb -0.27 0.38 -0.02 0.00 -0.57 0.00 0.00 34.95 34.47 3hn8 s ARG 300 CO 0.33 -0.35 -0.08 -1.50 -1.08 0.00 0.00 175.30 172.62 3hn8 s ILE 301 N -3.89 0.56 0.17 4.99 2.07 -0.55 -0.19 121.20 124.37 3hn8 s ILE 301 Ca 0.09 -0.79 0.10 0.00 -1.41 0.00 0.00 60.65 58.64 3hn8 s ILE 301 Cb 0.04 -0.57 -0.04 0.00 0.13 0.00 0.00 42.46 42.02 3hn8 s ILE 301 CO -0.07 -0.18 -0.21 -0.94 -1.91 0.00 0.00 174.94 171.63 3hn8 s SER 302 N -1.05 3.03 0.16 4.50 1.04 0.49 -1.91 113.70 119.95 3hn8 s SER 302 Ca -0.05 -0.85 -0.16 0.00 0.48 0.00 0.00 55.95 55.37 3hn8 s SER 302 Cb -0.07 -0.20 0.06 0.00 0.10 0.00 0.00 66.02 65.90 3hn8 s SER 302 CO 0.00 0.05 0.77 2.22 0.98 0.00 0.00 173.24 177.26 3hn8 n PHE 303 N 0.34 -1.26 -3.78 5.02 1.16 -0.94 -1.09 117.46 116.91 3hn8 n PHE 303 Ca -0.13 -1.01 -0.12 0.00 -1.87 0.00 0.00 57.45 54.31 3hn8 n PHE 303 Cb 0.56 0.50 -0.09 0.00 -1.61 0.00 0.00 39.48 38.84 3hn8 n PHE 303 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3hn8 s ALA 304 N -1.79 -0.66 -0.16 1.98 0.00 -0.47 -2.04 121.76 118.62 3hn8 s ALA 304 Ca 0.17 0.16 -0.15 0.00 0.00 0.00 0.00 51.96 52.14 3hn8 s ALA 304 Cb -0.02 0.13 0.04 0.00 0.00 0.00 0.00 23.12 23.27 3hn8 s ALA 304 CO 0.05 -0.28 0.42 -0.48 0.00 0.00 0.00 175.76 175.47 3hn8 s LEU 305 N -1.50 0.38 0.11 0.00 2.34 -1.26 -0.42 118.68 118.33 3hn8 s LEU 305 Ca -0.12 0.85 0.03 0.00 0.06 0.00 0.00 54.13 54.95 3hn8 s LEU 305 Cb -0.05 1.45 -0.04 0.00 -0.56 0.00 0.00 46.19 46.99 3hn8 s LEU 305 CO 0.02 -0.15 -0.09 0.00 -1.06 0.00 0.00 176.35 175.08 3hn8 s ARG 306 N 0.23 0.87 -0.31 1.48 3.03 -1.05 -4.07 118.95 119.13 3hn8 s ARG 306 Ca -0.00 -1.26 0.03 0.00 2.03 0.00 0.00 55.73 56.52 3hn8 s ARG 306 Cb -0.03 -0.42 0.09 0.00 -1.03 0.00 0.00 34.95 33.56 3hn8 s ARG 306 CO 0.01 0.04 0.03 -0.47 -1.13 0.00 0.00 175.30 173.78 3hn8 s TYR 307 N -3.00 3.15 -0.45 5.89 6.14 -1.26 -1.12 117.35 126.71 3hn8 s TYR 307 Ca 0.09 -2.54 -0.28 0.00 0.64 0.00 0.00 57.07 54.98 3hn8 s TYR 307 Cb 0.01 -2.43 -0.01 0.00 0.42 0.00 0.00 41.96 39.95 3hn8 s TYR 307 CO -0.02 -0.91 1.71 -0.51 0.64 0.00 0.00 175.55 176.47 3hn8 s LEU 308 N 1.12 3.45 0.00 6.97 1.43 -0.59 -4.92 118.68 126.14 3hn8 s LEU 308 Ca 0.07 0.84 -0.20 0.00 -1.03 0.00 0.00 54.13 53.81 3hn8 s LEU 308 Cb -0.19 -3.19 0.30 0.00 0.03 0.00 0.00 46.19 43.14 3hn8 s LEU 308 CO -0.11 -1.86 1.05 -1.22 0.23 0.00 0.00 176.35 174.45 3hn8 n TYR 309 N 10.69 -3.87 -0.47 0.29 4.02 -1.26 -2.01 117.16 124.55 3hn8 n TYR 309 Ca 0.20 -0.96 0.00 0.00 -0.01 0.00 0.00 57.90 57.14 3hn8 n TYR 309 Cb 0.49 -1.11 0.00 0.00 -0.02 0.00 0.00 39.34 38.70 3hn8 n TYR 309 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3hn8 n GLY 310 N -4.59 0.55 0.00 2.72 0.00 -1.26 -4.19 105.19 98.42 3hn8 n GLY 310 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3hn8 n GLY 310 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hn8 n SER 311 N 0.00 0.00 -2.85 1.61 3.41 -1.24 -5.06 113.62 109.48 3hn8 n SER 311 Ca 0.00 -1.00 -0.22 0.00 -0.26 0.00 0.00 58.87 57.39 3hn8 n SER 311 Cb 0.00 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 63.97 3hn8 n SER 311 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3hn8 n ASP 312 N 0.00 -3.33 -3.51 4.04 9.92 -1.13 -4.93 116.55 117.62 3hn8 n ASP 312 Ca 0.00 -0.28 -0.15 0.00 -0.53 0.00 0.00 54.79 53.83 3hn8 n ASP 312 Cb 0.44 -1.01 -0.12 0.00 -0.64 0.00 0.00 41.12 39.79 3hn8 n ASP 312 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 3hn8 s GLN 313 N -2.35 0.22 -0.30 -1.24 -0.21 -0.85 -2.98 119.66 111.95 3hn8 s GLN 313 Ca 0.17 0.44 -0.26 0.00 0.02 0.00 0.00 55.36 55.72 3hn8 s GLN 313 Cb -0.02 -0.71 0.01 0.00 1.00 0.00 0.00 33.01 33.29 3hn8 s GLN 313 CO 0.56 -0.55 0.90 -1.17 -2.12 0.00 0.00 175.29 172.91 3hn8 s LEU 314 N 2.41 4.04 -0.08 2.90 0.20 0.49 -1.54 118.68 127.10 3hn8 s LEU 314 Ca 0.07 0.85 -0.03 0.00 0.69 0.00 0.00 54.13 55.70 3hn8 s LEU 314 Cb -0.15 -3.26 -0.04 0.00 -0.43 0.00 0.00 46.19 42.32 3hn8 s LEU 314 CO -0.12 -0.70 0.06 -0.69 -0.29 0.00 0.00 176.35 174.61 3hn8 s VAL 315 N 3.19 4.78 -0.10 1.68 1.01 -0.28 -0.30 120.40 130.38 3hn8 s VAL 315 Ca 0.37 -0.14 -0.03 0.00 0.00 0.00 0.00 61.98 62.18 3hn8 s VAL 315 Cb -0.14 -3.08 0.04 0.00 0.00 0.00 0.00 36.38 33.21 3hn8 s VAL 315 CO 0.13 0.55 0.04 -0.69 0.00 0.00 0.00 175.10 175.13 3hn8 s VAL 316 N -1.00 0.15 -0.33 2.92 1.01 0.30 -2.53 120.40 120.92 3hn8 s VAL 316 Ca 0.16 0.04 -0.13 0.00 0.00 0.00 0.00 61.98 62.06 3hn8 s VAL 316 Cb -0.12 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 35.73 3hn8 s VAL 316 CO 0.06 0.04 0.23 -0.13 0.00 0.00 0.00 175.10 175.29 3hn8 s ARG 317 N 2.05 3.54 -0.31 2.72 0.52 0.44 -0.72 118.95 127.18 3hn8 s ARG 317 Ca 0.03 -0.61 -0.26 0.00 -0.52 0.00 0.00 55.73 54.37 3hn8 s ARG 317 Cb -0.14 -3.78 0.01 0.00 0.52 0.00 0.00 34.95 31.56 3hn8 s ARG 317 CO -0.06 -0.41 0.92 0.42 0.02 0.00 0.00 175.30 176.19 3hn8 s ILE 318 N 1.72 4.66 0.00 1.52 1.01 0.03 -1.37 121.20 128.78 3hn8 s ILE 318 Ca 0.06 1.45 0.00 0.00 0.00 0.00 0.00 60.65 62.17 3hn8 s ILE 318 Cb -0.17 -4.27 0.00 0.00 0.01 0.00 0.00 42.46 38.03 3hn8 s ILE 318 CO 0.10 -0.35 0.00 0.18 0.00 0.00 0.00 174.94 174.87 3hn8 n LEU 319 N 6.50 1.73 -3.62 2.97 4.77 -0.25 -1.21 117.00 127.90 3hn8 n LEU 319 Ca 0.08 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.92 3hn8 n LEU 319 Cb 0.48 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.51 3hn8 n LEU 319 CO 0.54 0.00 0.22 0.00 -1.33 0.00 0.00 177.39 176.82 3hn8 s GLN 320 N 0.00 0.98 0.33 3.23 -2.07 -1.12 -0.11 119.66 120.90 3hn8 s GLN 320 Ca 0.00 -0.30 0.08 0.00 -1.82 0.00 0.00 55.36 53.31 3hn8 s GLN 320 Cb 0.00 0.44 -0.03 0.00 -1.09 0.00 0.00 33.01 32.33 3hn8 s GLN 320 CO 0.00 -0.35 0.25 0.00 -1.32 0.00 0.00 175.29 173.87 3hn8 s ALA 321 N -2.48 3.73 0.01 2.60 0.00 -0.64 -0.38 121.76 124.61 3hn8 s ALA 321 Ca -0.05 -1.68 -0.00 0.00 0.00 0.00 0.00 51.96 50.23 3hn8 s ALA 321 Cb -0.01 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 3hn8 s ALA 321 CO -0.02 0.04 -0.02 -0.51 0.00 0.00 0.00 175.76 175.24 3hn8 s LEU 322 N -3.94 2.17 -1.43 0.00 1.43 0.73 -3.83 118.68 113.81 3hn8 s LEU 322 Ca 0.39 -0.37 -0.10 0.00 -1.03 0.00 0.00 54.13 53.02 3hn8 s LEU 322 Cb -0.05 0.08 0.07 0.00 0.03 0.00 0.00 46.19 46.32 3hn8 s LEU 322 CO 0.25 -0.23 0.69 0.47 0.23 0.00 0.00 176.35 177.76 3hn8 n ASP 323 N 1.96 -4.56 -4.73 2.29 10.43 -1.11 -2.07 116.55 118.75 3hn8 n ASP 323 Ca -0.21 -0.51 -0.37 0.00 2.57 0.00 0.00 54.79 56.27 3hn8 n ASP 323 Cb 0.56 -3.70 0.07 0.00 1.84 0.00 0.00 41.12 39.89 3hn8 n ASP 323 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 3hn8 s LEU 324 N -6.81 3.57 0.29 0.64 1.43 0.35 -3.71 118.68 114.44 3hn8 s LEU 324 Ca 0.48 2.63 -0.29 0.00 -1.03 0.00 0.00 54.13 55.92 3hn8 s LEU 324 Cb -0.24 -4.62 -0.10 0.00 0.03 0.00 0.00 46.19 41.26 3hn8 s LEU 324 CO 0.59 -2.02 1.17 -2.84 0.23 0.00 0.00 176.35 173.48 3hn8 s PRO 325 N -3.38 4.54 0.38 1.29 0.02 -1.26 -4.83 135.00 131.76 3hn8 s PRO 325 Ca 0.83 1.94 -0.25 0.00 0.02 0.00 0.00 61.00 63.54 3hn8 s PRO 325 Cb -0.38 -3.15 -0.09 0.00 0.02 0.00 0.00 34.50 30.90 3hn8 s PRO 325 CO 0.40 0.07 1.03 0.00 -0.33 0.00 0.00 177.00 178.17 3hn8 s ALA 326 N -1.09 3.13 0.00 -1.55 0.00 -1.26 -4.71 121.76 116.27 3hn8 s ALA 326 Ca 0.46 0.67 0.00 0.00 0.00 0.00 0.00 51.96 53.09 3hn8 s ALA 326 Cb -0.34 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.52 3hn8 s ALA 326 CO 0.45 -0.12 0.00 1.63 0.00 0.00 0.00 175.76 177.71 3hn8 n LYS 327 N 0.10 3.17 -3.44 0.00 4.76 -0.06 -4.94 118.16 117.75 3hn8 n LYS 327 Ca 0.04 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.17 3hn8 n LYS 327 Cb 0.50 -0.43 -0.05 0.00 -1.84 0.00 0.00 35.03 33.21 3hn8 n LYS 327 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3hn8 s ASP 328 N -0.59 6.58 0.31 4.39 -0.00 -0.49 -4.96 116.67 121.90 3hn8 s ASP 328 Ca 0.00 0.84 0.22 0.00 -0.00 0.00 0.00 52.55 53.62 3hn8 s ASP 328 Cb 0.00 -2.20 1.14 0.00 -0.00 0.00 0.00 42.92 41.86 3hn8 s ASP 328 CO 0.00 -0.07 1.68 -1.20 -0.00 0.00 0.00 175.17 175.57 3hn8 n SER 329 N -0.22 0.59 -0.07 0.27 7.64 -1.26 -1.83 113.62 118.74 3hn8 n SER 329 Ca -0.00 0.74 0.14 0.00 1.01 0.00 0.00 58.87 60.76 3hn8 n SER 329 Cb 0.52 -0.83 0.79 0.00 -1.01 0.00 0.00 64.21 63.68 3hn8 n SER 329 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3hn8 n ASN 330 N -2.26 0.21 0.00 6.43 0.23 -1.26 -4.88 115.26 113.73 3hn8 n ASN 330 Ca -0.01 -1.18 0.00 0.00 -0.53 0.00 0.00 54.58 52.86 3hn8 n ASN 330 Cb 0.08 -0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.77 3hn8 n ASN 330 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hn8 n GLY 331 N 0.97 0.56 0.00 4.83 0.00 -0.76 -5.03 105.19 105.76 3hn8 n GLY 331 Ca 0.21 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.78 3hn8 n GLY 331 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hn8 n PHE 332 N -2.78 0.00 -3.61 1.61 3.72 -1.25 -4.75 117.46 110.39 3hn8 n PHE 332 Ca 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.27 3hn8 n PHE 332 Cb 0.00 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.48 3hn8 n PHE 332 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 3hn8 s SER 333 N 0.69 -0.37 -0.91 4.37 0.01 -1.25 -0.88 113.70 115.36 3hn8 s SER 333 Ca 0.00 0.08 -0.01 0.00 1.31 0.00 0.00 55.95 57.33 3hn8 s SER 333 Cb 0.00 0.47 0.27 0.00 0.21 0.00 0.00 66.02 66.96 3hn8 s SER 333 CO 0.00 -0.71 1.06 0.47 0.41 0.00 0.00 173.24 174.48 3hn8 n ASP 334 N 0.40 5.03 -4.77 2.44 10.43 -1.26 -1.48 116.55 127.33 3hn8 n ASP 334 Ca -0.18 -3.32 -0.38 0.00 2.57 0.00 0.00 54.79 53.48 3hn8 n ASP 334 Cb 0.60 -1.05 -0.03 0.00 1.84 0.00 0.00 41.12 42.48 3hn8 n ASP 334 CO 0.00 0.00 0.00 -2.16 -1.07 0.00 0.00 177.20 173.97 3hn8 s PRO 335 N -2.21 4.20 0.10 -0.24 0.04 -0.80 -0.02 135.00 136.06 3hn8 s PRO 335 Ca 0.33 1.74 -0.13 0.00 0.04 0.00 0.00 61.00 62.98 3hn8 s PRO 335 Cb 0.03 -2.73 0.02 0.00 0.04 0.00 0.00 34.50 31.86 3hn8 s PRO 335 CO -0.00 -0.17 0.31 1.52 0.04 0.00 0.00 177.00 178.70 3hn8 s TYR 336 N -1.44 -0.06 -0.12 0.56 -0.85 0.04 -2.09 117.35 113.40 3hn8 s TYR 336 Ca 0.55 -0.27 -0.00 0.00 -0.52 0.00 0.00 57.07 56.83 3hn8 s TYR 336 Cb -0.28 0.12 0.02 0.00 0.38 0.00 0.00 41.96 42.19 3hn8 s TYR 336 CO 0.36 -0.61 -0.10 0.54 -1.52 0.00 0.00 175.55 174.22 3hn8 s VAL 337 N -3.62 1.18 0.40 -3.49 0.11 -1.26 -0.65 120.40 113.07 3hn8 s VAL 337 Ca 0.02 -0.39 -0.24 0.00 -2.93 0.00 0.00 61.98 58.44 3hn8 s VAL 337 Cb 0.03 -1.16 -0.09 0.00 -1.53 0.00 0.00 36.38 33.63 3hn8 s VAL 337 CO -0.10 0.39 1.04 -0.54 -3.33 0.00 0.00 175.10 172.56 3hn8 s LYS 338 N 1.58 4.17 -0.07 1.54 1.02 0.48 -2.85 119.74 125.62 3hn8 s LYS 338 Ca 0.04 1.48 0.01 0.00 0.02 0.00 0.00 55.97 57.52 3hn8 s LYS 338 Cb -0.13 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.68 3hn8 s LYS 338 CO -0.08 -0.13 -0.09 0.42 -0.92 0.00 0.00 175.35 174.55 3hn8 s ILE 339 N -1.69 0.93 0.24 2.17 1.01 -0.51 -0.58 121.20 122.76 3hn8 s ILE 339 Ca 0.58 -0.33 0.10 0.00 0.00 0.00 0.00 60.65 60.99 3hn8 s ILE 339 Cb -0.21 -0.89 -0.05 0.00 0.01 0.00 0.00 42.46 41.33 3hn8 s ILE 339 CO 0.26 0.32 -0.17 -0.31 0.00 0.00 0.00 174.94 175.04 3hn8 s TYR 340 N 0.90 1.99 -0.45 3.97 1.51 -0.03 -2.36 117.35 122.89 3hn8 s TYR 340 Ca -0.11 -0.46 0.02 0.00 -1.01 0.00 0.00 57.07 55.52 3hn8 s TYR 340 Cb -0.15 -0.89 0.14 0.00 -0.11 0.00 0.00 41.96 40.95 3hn8 s TYR 340 CO 0.01 0.53 0.25 -1.17 -1.11 0.00 0.00 175.55 174.07 3hn8 s LEU 341 N -3.41 2.67 0.83 -1.29 0.20 -1.25 -1.34 118.68 115.09 3hn8 s LEU 341 Ca 0.26 -2.68 -0.13 0.00 0.69 0.00 0.00 54.13 52.27 3hn8 s LEU 341 Cb -0.03 -1.01 0.06 0.00 -0.43 0.00 0.00 46.19 44.77 3hn8 s LEU 341 CO 0.11 -0.26 0.93 0.18 -0.29 0.00 0.00 176.35 177.02 3hn8 n LEU 342 N 3.47 2.83 0.00 -0.68 4.77 0.63 -2.31 117.00 125.71 3hn8 n LEU 342 Ca 0.10 0.53 0.11 0.00 -0.03 0.00 0.00 56.01 56.72 3hn8 n LEU 342 Cb 0.35 -1.40 0.64 0.00 -2.33 0.00 0.00 43.42 40.68 3hn8 n LEU 342 CO 0.23 -2.35 0.88 -2.65 -1.33 0.00 0.00 177.39 172.18 3hn8 n PRO 343 N -2.59 0.92 -1.58 3.23 -0.02 -1.26 -3.54 135.00 130.17 3hn8 n PRO 343 Ca 0.12 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.17 3hn8 n PRO 343 Cb 0.51 -1.36 -0.03 0.00 -0.02 0.00 0.00 33.50 32.59 3hn8 n PRO 343 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3hn8 n ASP 344 N -0.86 3.03 0.08 2.55 -0.08 -0.98 -4.84 116.55 115.45 3hn8 n ASP 344 Ca 0.16 0.11 -0.14 0.00 -1.51 0.00 0.00 54.79 53.42 3hn8 n ASP 344 Cb 0.07 -1.54 -0.14 0.00 2.34 0.00 0.00 41.12 41.86 3hn8 n ASP 344 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3hn8 h ARG 345 N 15.53 0.20 0.13 -0.67 3.08 -1.97 -3.35 114.38 127.33 3hn8 h ARG 345 Ca -0.37 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.33 3hn8 h ARG 345 Cb 1.25 0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.43 3hn8 h ARG 345 CO 0.99 1.13 -0.06 0.87 -1.07 0.00 0.00 179.97 181.83 3hn8 h LYS 346 N 0.05 -0.16 -2.22 0.04 1.57 -1.97 -3.45 116.57 110.43 3hn8 h LYS 346 Ca -0.13 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 3hn8 h LYS 346 Cb 1.94 0.04 0.00 0.00 0.08 0.00 0.00 32.23 34.29 3hn8 h LYS 346 CO 0.18 -0.11 0.42 1.17 -0.57 0.00 0.00 179.45 180.54 3hn8 n LYS 347 N -4.01 0.00 -5.05 3.15 4.81 -1.26 -4.86 118.16 110.94 3hn8 n LYS 347 Ca -0.02 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.11 3hn8 n LYS 347 Cb 0.07 -0.44 -0.15 0.00 0.02 0.00 0.00 35.03 34.52 3hn8 n LYS 347 CO 0.00 0.00 0.00 -1.59 1.17 0.00 0.00 177.40 176.98 3hn8 s LYS 348 N 2.14 1.96 0.25 1.64 -2.85 -1.25 -3.92 119.74 117.71 3hn8 s LYS 348 Ca 0.00 -1.02 0.07 0.00 -1.00 0.00 0.00 55.97 54.02 3hn8 s LYS 348 Cb 0.00 -2.03 -0.04 0.00 -2.06 0.00 0.00 37.83 33.71 3hn8 s LYS 348 CO 0.00 0.54 0.20 -0.06 0.10 0.00 0.00 175.35 176.13 3hn8 s PHE 349 N -0.73 3.12 -0.00 1.78 0.08 -0.99 -4.92 117.98 116.31 3hn8 s PHE 349 Ca 0.11 -0.11 0.03 0.00 0.12 0.00 0.00 56.93 57.09 3hn8 s PHE 349 Cb -0.10 -1.41 -0.01 0.00 -0.57 0.00 0.00 43.02 40.93 3hn8 s PHE 349 CO 0.01 0.52 -0.10 -0.65 -0.10 0.00 0.00 175.22 174.90 3hn8 s GLN 350 N -3.83 0.78 0.72 0.44 -0.21 -1.26 -1.43 119.66 114.87 3hn8 s GLN 350 Ca 0.33 -0.39 -0.12 0.00 0.02 0.00 0.00 55.36 55.20 3hn8 s GLN 350 Cb -0.08 -0.75 0.02 0.00 1.00 0.00 0.00 33.01 33.20 3hn8 s GLN 350 CO 0.25 0.20 1.11 0.95 -2.12 0.00 0.00 175.29 175.68 3hn8 s THR 351 N -0.32 3.30 1.02 -0.19 -4.23 -1.13 -4.99 115.64 109.10 3hn8 s THR 351 Ca 0.03 0.42 -0.11 0.00 -1.18 0.00 0.00 61.69 60.85 3hn8 s THR 351 Cb -0.04 -3.42 0.19 0.00 1.34 0.00 0.00 72.50 70.57 3hn8 s THR 351 CO -0.00 -0.55 1.00 0.29 -0.54 0.00 0.00 174.62 174.82 3hn8 n LYS 352 N -3.05 -1.22 -3.43 3.99 5.02 -1.26 -4.63 118.16 113.58 3hn8 n LYS 352 Ca 0.07 -0.31 -0.43 0.00 -2.02 0.00 0.00 58.31 55.62 3hn8 n LYS 352 Cb 0.58 -2.24 -0.03 0.00 -0.02 0.00 0.00 35.03 33.31 3hn8 n LYS 352 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hn8 s VAL 353 N -2.52 5.27 -0.06 -0.18 1.01 -1.26 -4.55 120.40 118.10 3hn8 s VAL 353 Ca 0.66 -3.01 -0.30 0.00 0.00 0.00 0.00 61.98 59.34 3hn8 s VAL 353 Cb -0.23 -4.24 -0.07 0.00 0.00 0.00 0.00 36.38 31.84 3hn8 s VAL 353 CO 0.62 -1.06 1.85 -1.00 0.00 0.00 0.00 175.10 175.51 3hn8 s HIS 354 N -0.48 1.59 0.25 5.22 3.76 -0.89 -4.88 115.29 119.86 3hn8 s HIS 354 Ca 0.23 -0.01 -0.05 0.00 -0.15 0.00 0.00 55.06 55.08 3hn8 s HIS 354 Cb -0.11 -4.07 -0.05 0.00 1.11 0.00 0.00 32.58 29.45 3hn8 s HIS 354 CO -0.08 -4.52 0.51 -0.98 -0.85 0.00 0.00 174.74 168.81 3hn8 s ARG 355 N 4.58 3.64 -0.50 1.40 3.03 -1.26 -1.90 118.95 127.93 3hn8 s ARG 355 Ca 0.83 -0.02 -0.30 0.00 2.03 0.00 0.00 55.73 58.27 3hn8 s ARG 355 Cb -0.36 -2.70 0.05 0.00 -1.03 0.00 0.00 34.95 30.90 3hn8 s ARG 355 CO 0.35 0.29 0.63 1.63 -1.13 0.00 0.00 175.30 177.07 3hn8 n LYS 356 N -0.64 -1.77 -3.62 3.89 5.02 -1.11 -4.93 118.16 114.99 3hn8 n LYS 356 Ca -0.02 1.22 -0.08 0.00 -2.02 0.00 0.00 58.31 57.42 3hn8 n LYS 356 Cb 0.53 -1.94 -0.06 0.00 -0.02 0.00 0.00 35.03 33.54 3hn8 n LYS 356 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3hn8 s THR 357 N -1.70 0.00 -2.12 -0.18 -1.32 -0.55 -4.92 115.64 104.85 3hn8 s THR 357 Ca 0.30 0.00 0.20 0.00 -1.21 0.00 0.00 61.69 60.98 3hn8 s THR 357 Cb -0.03 -1.00 0.36 0.00 -1.51 0.00 0.00 72.50 70.32 3hn8 s THR 357 CO 0.84 0.00 1.31 0.18 -2.21 0.00 0.00 174.62 174.74 3hn8 n LEU 358 N 1.44 3.20 -3.15 9.08 4.77 -1.26 -3.91 117.00 127.16 3hn8 n LEU 358 Ca -0.10 -1.50 -0.17 0.00 -0.03 0.00 0.00 56.01 54.21 3hn8 n LEU 358 Cb 0.57 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.43 3hn8 n LEU 358 CO 0.07 0.69 -0.18 0.59 -1.33 0.00 0.00 177.39 177.23 3hn8 n ASN 359 N 1.25 0.54 -4.62 -1.43 3.02 -1.26 -0.49 115.26 112.27 3hn8 n ASN 359 Ca 0.17 -3.07 -0.35 0.00 -0.03 0.00 0.00 54.58 51.29 3hn8 n ASN 359 Cb 0.54 -0.39 0.09 0.00 -0.61 0.00 0.00 39.78 39.42 3hn8 n ASN 359 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3hn8 n PRO 360 N 0.29 0.44 -3.87 3.52 -0.04 -1.25 -4.70 135.00 129.38 3hn8 n PRO 360 Ca 0.23 0.21 -0.30 0.00 -0.04 0.00 0.00 63.50 63.60 3hn8 n PRO 360 Cb 0.66 -2.25 -0.14 0.00 -0.04 0.00 0.00 33.50 31.73 3hn8 n PRO 360 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3hn8 s ILE 361 N -1.88 2.01 -0.03 0.52 1.01 -1.26 -1.62 121.20 119.95 3hn8 s ILE 361 Ca 0.73 -2.73 -0.23 0.00 0.00 0.00 0.00 60.65 58.42 3hn8 s ILE 361 Cb -0.33 -2.42 -0.17 0.00 0.01 0.00 0.00 42.46 39.55 3hn8 s ILE 361 CO 0.51 -0.78 1.06 -0.26 0.00 0.00 0.00 174.94 175.46 3hn8 h PHE 362 N 6.92 -0.22 -3.48 3.97 -1.00 -0.73 -3.48 116.94 118.93 3hn8 h PHE 362 Ca -0.06 -0.01 -0.34 0.00 2.81 0.00 0.00 57.97 60.38 3hn8 h PHE 362 Cb 0.94 0.07 -0.01 0.00 3.61 0.00 0.00 35.95 40.56 3hn8 h PHE 362 CO 0.48 0.20 -0.44 0.09 -1.61 0.00 0.00 178.31 177.03 3hn8 n ASN 363 N -4.97 -4.97 -4.80 2.17 3.02 -0.35 -4.98 115.26 100.39 3hn8 n ASN 363 Ca -0.08 0.06 -0.29 0.00 -0.03 0.00 0.00 54.58 54.24 3hn8 n ASN 363 Cb 0.26 -4.16 -0.06 0.00 -0.61 0.00 0.00 39.78 35.21 3hn8 n ASN 363 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hn8 s GLU 364 N -5.08 2.95 0.12 3.52 2.02 -1.08 -4.96 118.70 116.19 3hn8 s GLU 364 Ca 0.02 -0.74 0.08 0.00 0.02 0.00 0.00 54.97 54.35 3hn8 s GLU 364 Cb -0.01 -2.73 -0.04 0.00 0.10 0.00 0.00 34.13 31.46 3hn8 s GLU 364 CO 0.02 0.54 -0.20 0.99 0.02 0.00 0.00 175.26 176.63 3hn8 s THR 365 N -1.54 1.75 -0.06 3.63 2.01 -1.26 -0.79 115.64 119.37 3hn8 s THR 365 Ca 0.30 -1.68 -0.04 0.00 0.31 0.00 0.00 61.69 60.58 3hn8 s THR 365 Cb -0.11 -1.66 0.02 0.00 0.01 0.00 0.00 72.50 70.76 3hn8 s THR 365 CO 0.23 -0.16 0.14 -0.36 -0.69 0.00 0.00 174.62 173.79 3hn8 s PHE 366 N -1.49 -0.16 -0.08 4.92 0.40 0.10 -4.97 117.98 116.70 3hn8 s PHE 366 Ca 0.10 0.40 -0.00 0.00 -0.60 0.00 0.00 56.93 56.82 3hn8 s PHE 366 Cb -0.08 0.03 -0.03 0.00 0.51 0.00 0.00 43.02 43.44 3hn8 s PHE 366 CO 0.05 -0.09 -0.04 -0.65 0.70 0.00 0.00 175.22 175.19 3hn8 s GLN 367 N 0.29 2.87 -0.02 0.44 -0.21 -1.26 -0.54 119.66 121.22 3hn8 s GLN 367 Ca -0.02 -0.49 0.05 0.00 0.02 0.00 0.00 55.36 54.92 3hn8 s GLN 367 Cb -0.03 -2.68 -0.01 0.00 1.00 0.00 0.00 33.01 31.29 3hn8 s GLN 367 CO -0.01 0.67 -0.15 -0.06 -2.12 0.00 0.00 175.29 173.62 3hn8 s PHE 368 N -0.81 1.42 -0.59 0.91 0.40 0.58 -4.97 117.98 114.92 3hn8 s PHE 368 Ca 0.12 -0.30 -0.19 0.00 -0.60 0.00 0.00 56.93 55.97 3hn8 s PHE 368 Cb -0.11 -0.93 0.11 0.00 0.51 0.00 0.00 43.02 42.59 3hn8 s PHE 368 CO 0.02 -0.05 0.69 0.45 0.70 0.00 0.00 175.22 177.02 3hn8 s SER 369 N -0.26 6.19 -0.05 1.36 0.15 -1.26 -0.38 113.70 119.46 3hn8 s SER 369 Ca 0.04 -1.49 0.01 0.00 0.70 0.00 0.00 55.95 55.20 3hn8 s SER 369 Cb -0.07 -2.29 0.02 0.00 -1.71 0.00 0.00 66.02 61.97 3hn8 s SER 369 CO -0.00 -1.09 -0.03 -0.69 1.20 0.00 0.00 173.24 172.63 3hn8 s VAL 370 N 2.56 0.49 0.55 4.45 1.01 -1.16 -5.00 120.40 123.31 3hn8 s VAL 370 Ca 0.11 -0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.81 3hn8 s VAL 370 Cb -0.24 -0.55 -0.05 0.00 0.00 0.00 0.00 36.38 35.54 3hn8 s VAL 370 CO 0.06 0.23 1.27 -2.84 0.00 0.00 0.00 175.10 173.81 3hn8 s PRO 371 N 1.11 3.17 0.36 2.72 0.02 -1.26 -4.19 135.00 136.93 3hn8 s PRO 371 Ca -0.08 2.01 0.07 0.00 0.02 0.00 0.00 61.00 63.02 3hn8 s PRO 371 Cb -0.14 -2.16 0.77 0.00 0.02 0.00 0.00 34.50 33.00 3hn8 s PRO 371 CO -0.01 -1.10 1.91 1.25 -0.33 0.00 0.00 177.00 178.72 3hn8 h LEU 372 N 1.34 0.67 -2.44 -5.54 5.85 -1.99 -0.48 115.31 112.72 3hn8 h LEU 372 Ca -0.50 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.25 3hn8 h LEU 372 Cb 1.29 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 42.20 3hn8 h LEU 372 CO 0.57 0.39 0.05 0.00 -0.34 0.00 0.00 178.44 179.11 3hn8 h ALA 373 N 1.59 1.56 0.00 1.25 0.00 -2.06 -2.77 119.26 118.84 3hn8 h ALA 373 Ca 0.39 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 3hn8 h ALA 373 Cb 0.51 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 3hn8 h ALA 373 CO -0.16 -0.08 -1.43 0.39 0.00 0.00 0.00 179.25 177.97 3hn8 n GLU 374 N -3.78 0.63 -0.28 0.00 1.02 -0.19 -4.43 120.64 113.60 3hn8 n GLU 374 Ca -0.02 -0.01 0.17 0.00 -0.02 0.00 0.00 57.16 57.28 3hn8 n GLU 374 Cb 0.14 -1.70 0.45 0.00 -0.02 0.00 0.00 31.44 30.32 3hn8 n GLU 374 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3hn8 h LEU 375 N 0.00 0.53 -0.15 -4.62 3.38 -1.43 -0.92 115.31 112.11 3hn8 h LEU 375 Ca -0.01 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3hn8 h LEU 375 Cb 1.02 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 3hn8 h LEU 375 CO 0.00 0.20 0.00 0.00 0.09 0.00 0.00 178.44 178.74 3hn8 h ALA 376 N 1.62 0.20 0.00 1.53 0.00 -1.78 -3.02 119.26 117.80 3hn8 h ALA 376 Ca 0.51 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3hn8 h ALA 376 Cb 1.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3hn8 h ALA 376 CO -0.24 -0.11 0.00 1.04 0.00 0.00 0.00 179.25 179.94 3hn8 n GLN 377 N -4.76 0.84 -3.92 0.00 6.02 -0.35 -4.82 117.38 110.38 3hn8 n GLN 377 Ca -0.05 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 56.84 3hn8 n GLN 377 Cb 0.21 -1.08 -0.10 0.00 1.02 0.00 0.00 30.24 30.29 3hn8 n GLN 377 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3hn8 s ARG 378 N 0.21 0.47 -0.00 -1.09 6.06 -1.14 -4.75 118.95 118.71 3hn8 s ARG 378 Ca 0.00 -0.58 0.01 0.00 -2.50 0.00 0.00 55.73 52.66 3hn8 s ARG 378 Cb 0.00 0.18 -0.00 0.00 0.06 0.00 0.00 34.95 35.19 3hn8 s ARG 378 CO 0.00 -0.11 -0.02 0.15 -2.50 0.00 0.00 175.30 172.82 3hn8 s LYS 379 N -1.81 0.19 0.35 5.12 3.01 -1.23 -4.38 119.74 120.99 3hn8 s LYS 379 Ca -0.12 -0.07 -0.10 0.00 -1.01 0.00 0.00 55.97 54.67 3hn8 s LYS 379 Cb -0.06 -0.20 -0.07 0.00 -1.01 0.00 0.00 37.83 36.50 3hn8 s LYS 379 CO -0.01 0.04 0.70 -0.51 0.51 0.00 0.00 175.35 176.08 3hn8 s LEU 380 N 0.01 3.95 -0.23 3.17 1.43 -1.15 -0.27 118.68 125.59 3hn8 s LEU 380 Ca 0.00 1.07 -0.03 0.00 -1.03 0.00 0.00 54.13 54.14 3hn8 s LEU 380 Cb -0.02 -3.91 0.12 0.00 0.03 0.00 0.00 46.19 42.42 3hn8 s LEU 380 CO -0.00 -0.30 0.34 -2.28 0.23 0.00 0.00 176.35 174.35 3hn8 s HIS 381 N -2.19 -0.70 -0.17 0.29 2.46 -0.45 -1.45 115.29 113.09 3hn8 s HIS 381 Ca 0.50 0.72 -0.11 0.00 0.47 0.00 0.00 55.06 56.64 3hn8 s HIS 381 Cb -0.10 -0.06 -0.05 0.00 -0.13 0.00 0.00 32.58 32.24 3hn8 s HIS 381 CO 0.27 -0.68 0.21 -0.06 -2.47 0.00 0.00 174.74 172.01 3hn8 s PHE 382 N 2.50 3.47 -0.32 3.88 2.99 -0.36 -0.85 117.98 129.28 3hn8 s PHE 382 Ca 0.11 0.49 -0.04 0.00 0.00 0.00 0.00 56.93 57.49 3hn8 s PHE 382 Cb -0.15 -2.21 0.05 0.00 0.00 0.00 0.00 43.02 40.70 3hn8 s PHE 382 CO -0.15 0.34 0.05 -1.12 -0.00 0.00 0.00 175.22 174.34 3hn8 s SER 383 N 0.18 5.10 -0.13 1.36 0.01 0.25 -1.18 113.70 119.29 3hn8 s SER 383 Ca 0.13 -1.22 -0.22 0.00 1.31 0.00 0.00 55.95 55.95 3hn8 s SER 383 Cb -0.12 -1.79 -0.03 0.00 0.21 0.00 0.00 66.02 64.29 3hn8 s SER 383 CO 0.02 -0.30 0.67 -0.69 0.41 0.00 0.00 173.24 173.35 3hn8 s VAL 384 N 1.32 5.03 0.06 3.43 1.01 0.99 -0.39 120.40 131.85 3hn8 s VAL 384 Ca -0.03 1.33 0.06 0.00 0.00 0.00 0.00 61.98 63.34 3hn8 s VAL 384 Cb -0.20 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 32.16 3hn8 s VAL 384 CO 0.01 0.18 -0.17 -0.31 0.00 0.00 0.00 175.10 174.81 3hn8 s TYR 385 N 1.35 1.47 -0.13 5.22 1.51 0.18 0.23 117.35 127.17 3hn8 s TYR 385 Ca 0.33 -0.40 -0.20 0.00 -1.01 0.00 0.00 57.07 55.79 3hn8 s TYR 385 Cb -0.17 -0.85 -0.03 0.00 -0.11 0.00 0.00 41.96 40.80 3hn8 s TYR 385 CO 0.14 0.09 0.59 0.34 -1.11 0.00 0.00 175.55 175.60 3hn8 s ASP 386 N -1.46 6.76 0.29 2.29 -1.08 0.28 -0.78 116.67 122.97 3hn8 s ASP 386 Ca 0.03 0.91 -0.28 0.00 -0.52 0.00 0.00 52.55 52.69 3hn8 s ASP 386 Cb -0.09 -2.34 -0.09 0.00 -1.46 0.00 0.00 42.92 38.94 3hn8 s ASP 386 CO 0.02 -0.13 0.98 0.12 0.52 0.00 0.00 175.17 176.68 3hn8 s PHE 387 N 1.14 3.77 -0.00 -5.34 5.36 0.97 -1.79 117.98 122.09 3hn8 s PHE 387 Ca 0.30 1.82 0.00 0.00 -0.96 0.00 0.00 56.93 58.09 3hn8 s PHE 387 Cb -0.16 -3.03 -0.00 0.00 -0.34 0.00 0.00 43.02 39.49 3hn8 s PHE 387 CO 0.12 0.13 -0.01 -0.51 -1.46 0.00 0.00 175.22 173.49 3hn8 s ASP 388 N -1.30 0.15 -0.13 6.13 -0.00 -1.26 -4.53 116.67 115.73 3hn8 s ASP 388 Ca 0.46 -0.03 -0.10 0.00 -0.00 0.00 0.00 52.55 52.88 3hn8 s ASP 388 Cb -0.24 -0.02 -0.08 0.00 -0.00 0.00 0.00 42.92 42.58 3hn8 s ASP 388 CO 0.31 0.01 0.13 -0.09 -0.00 0.00 0.00 175.17 175.53 3hn8 h ARG 389 N 6.11 0.00 -0.32 8.23 9.65 -1.97 -3.40 114.38 132.68 3hn8 h ARG 389 Ca -0.25 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.63 3hn8 h ARG 389 Cb 1.21 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.79 3hn8 h ARG 389 CO 0.51 0.30 0.00 1.19 2.80 0.00 0.00 179.97 184.76 3hn8 n PHE 390 N -4.67 0.42 -3.75 2.20 3.72 -1.26 -4.93 117.46 109.19 3hn8 n PHE 390 Ca -0.07 -0.21 -0.11 0.00 -0.05 0.00 0.00 57.45 57.02 3hn8 n PHE 390 Cb 0.23 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.70 3hn8 n PHE 390 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3hn8 s SER 391 N -1.39 -0.10 0.14 4.37 0.15 -1.26 -5.12 113.70 110.48 3hn8 s SER 391 Ca 0.34 -0.32 -0.35 0.00 0.70 0.00 0.00 55.95 56.32 3hn8 s SER 391 Cb 0.19 0.38 -0.15 0.00 -1.71 0.00 0.00 66.02 64.73 3hn8 s SER 391 CO 0.27 -0.70 1.37 -1.14 1.20 0.00 0.00 173.24 174.24 3hn8 n ARG 392 N 0.23 1.49 -1.69 5.44 0.63 -1.26 -4.49 116.66 117.02 3hn8 n ARG 392 Ca -0.17 0.53 -0.44 0.00 -0.92 0.00 0.00 57.85 56.85 3hn8 n ARG 392 Cb 0.61 -2.18 -0.03 0.00 0.45 0.00 0.00 32.46 31.31 3hn8 n ARG 392 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 3hn8 n HIS 393 N 2.48 2.37 -3.03 -0.14 8.25 -1.26 -4.86 115.22 119.04 3hn8 n HIS 393 Ca 0.17 0.30 -0.40 0.00 -0.26 0.00 0.00 57.72 57.52 3hn8 n HIS 393 Cb 0.24 -2.54 -0.05 0.00 1.12 0.00 0.00 29.99 28.76 3hn8 n HIS 393 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3hn8 s ASP 394 N 0.65 6.84 0.05 0.41 -0.00 -0.74 -4.90 116.67 118.98 3hn8 s ASP 394 Ca 0.72 1.02 -0.31 0.00 -0.00 0.00 0.00 52.55 53.99 3hn8 s ASP 394 Cb -0.62 -2.40 -0.06 0.00 -0.00 0.00 0.00 42.92 39.84 3hn8 s ASP 394 CO 0.43 -0.28 1.34 -0.22 -0.00 0.00 0.00 175.17 176.45 3hn8 s LEU 395 N 1.73 4.34 -0.16 1.23 2.96 -1.26 0.10 118.68 127.62 3hn8 s LEU 395 Ca 0.34 2.14 -0.13 0.00 -0.22 0.00 0.00 54.13 56.26 3hn8 s LEU 395 Cb -0.16 -3.57 -0.23 0.00 0.50 0.00 0.00 46.19 42.72 3hn8 s LEU 395 CO 0.13 -0.64 0.28 -0.38 -1.32 0.00 0.00 176.35 174.43 3hn8 n ILE 396 N 4.27 1.67 -0.23 6.68 5.41 0.14 -4.85 119.36 132.44 3hn8 n ILE 396 Ca 0.12 -0.38 0.00 0.00 1.00 0.00 0.00 62.75 63.49 3hn8 n ILE 396 Cb 0.44 -1.87 0.00 0.00 -0.71 0.00 0.00 39.64 37.50 3hn8 n ILE 396 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3hn8 n GLY 397 N 1.74 -1.77 3.08 7.39 0.00 -0.88 -4.52 105.19 110.23 3hn8 n GLY 397 Ca -0.33 -1.12 -0.11 0.00 0.00 0.00 0.00 46.02 44.46 3hn8 n GLY 397 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hn8 s GLN 398 N -1.92 0.59 -0.01 1.61 -0.21 -0.97 -0.01 119.66 118.75 3hn8 s GLN 398 Ca 0.00 -0.96 0.02 0.00 0.02 0.00 0.00 55.36 54.44 3hn8 s GLN 398 Cb 0.00 -0.14 -0.00 0.00 1.00 0.00 0.00 33.01 33.87 3hn8 s GLN 398 CO 0.00 -0.01 -0.05 0.14 -2.12 0.00 0.00 175.29 173.25 3hn8 s VAL 399 N -2.37 0.44 -0.16 1.09 -7.23 -0.32 -0.15 120.40 111.71 3hn8 s VAL 399 Ca -0.02 -0.23 -0.03 0.00 -1.81 0.00 0.00 61.98 59.88 3hn8 s VAL 399 Cb -0.03 -0.38 -0.03 0.00 0.56 0.00 0.00 36.38 36.51 3hn8 s VAL 399 CO -0.03 0.13 -0.05 -0.69 -0.31 0.00 0.00 175.10 174.15 3hn8 s VAL 400 N -0.09 3.80 -0.39 1.32 1.01 -1.26 -1.22 120.40 123.56 3hn8 s VAL 400 Ca 0.02 -0.39 -0.15 0.00 0.00 0.00 0.00 61.98 61.46 3hn8 s VAL 400 Cb -0.03 -2.66 0.01 0.00 0.00 0.00 0.00 36.38 33.70 3hn8 s VAL 400 CO -0.00 0.49 0.30 -0.76 0.00 0.00 0.00 175.10 175.13 3hn8 s LEU 401 N 0.40 4.92 0.00 3.92 1.43 -0.53 -5.01 118.68 123.81 3hn8 s LEU 401 Ca -0.05 -0.74 -0.10 0.00 -1.03 0.00 0.00 54.13 52.22 3hn8 s LEU 401 Cb -0.14 -2.18 0.15 0.00 0.03 0.00 0.00 46.19 44.04 3hn8 s LEU 401 CO 0.03 -0.40 0.47 -0.67 0.23 0.00 0.00 176.35 176.01 3hn8 n ASP 402 N 5.20 -1.87 -0.95 2.29 -0.08 -1.26 -2.91 116.55 116.96 3hn8 n ASP 402 Ca -0.11 -0.70 -0.13 0.00 -1.51 0.00 0.00 54.79 52.34 3hn8 n ASP 402 Cb 0.48 -0.46 -0.03 0.00 2.34 0.00 0.00 41.12 43.45 3hn8 n ASP 402 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 3hn8 n ASN 403 N -3.96 0.15 -0.04 1.67 6.94 -1.26 -4.76 115.26 114.00 3hn8 n ASN 403 Ca 0.07 0.14 -0.06 0.00 -0.02 0.00 0.00 54.58 54.71 3hn8 n ASN 403 Cb 0.27 -0.20 0.14 0.00 -2.36 0.00 0.00 39.78 37.63 3hn8 n ASN 403 CO 0.00 0.00 0.00 -0.07 -1.03 0.00 0.00 177.26 176.16 3hn8 h LEU 404 N 2.07 0.64 -0.24 -4.53 3.38 -1.76 -3.28 115.31 111.58 3hn8 h LEU 404 Ca -0.02 -0.22 0.06 0.00 0.09 0.00 0.00 57.88 57.78 3hn8 h LEU 404 Cb 0.31 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 40.81 3hn8 h LEU 404 CO 0.25 0.86 -0.39 0.25 0.09 0.00 0.00 178.44 179.50 3hn8 h LEU 405 N 0.56 -1.25 -1.09 1.67 7.12 -1.86 -2.23 115.31 118.23 3hn8 h LEU 405 Ca 0.08 0.18 -0.02 0.00 0.13 0.00 0.00 57.88 58.25 3hn8 h LEU 405 Cb 0.70 0.53 -0.03 0.00 -0.53 0.00 0.00 40.66 41.33 3hn8 h LEU 405 CO 0.05 -0.38 0.32 -0.33 -0.13 0.00 0.00 178.44 177.97 3hn8 h GLU 406 N -0.40 0.96 -0.64 1.25 5.08 -1.94 -1.01 114.58 117.88 3hn8 h GLU 406 Ca 0.11 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3hn8 h GLU 406 Cb 0.59 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.63 3hn8 h GLU 406 CO -0.45 0.74 0.29 -0.07 -1.00 0.00 0.00 179.01 178.52 3hn8 h LEU 407 N 0.95 0.85 -0.04 1.33 4.07 -1.53 -3.19 115.31 117.75 3hn8 h LEU 407 Ca 0.23 -0.15 -0.21 0.00 0.08 0.00 0.00 57.88 57.84 3hn8 h LEU 407 Cb 0.10 -0.22 0.01 0.00 1.08 0.00 0.00 40.66 41.64 3hn8 h LEU 407 CO -0.03 0.76 -0.78 0.00 -1.08 0.00 0.00 178.44 177.31 3hn8 h ALA 408 N 1.12 0.15 -0.17 1.53 0.00 -1.04 -3.34 119.26 117.51 3hn8 h ALA 408 Ca 0.22 -0.61 0.05 0.00 0.00 0.00 0.00 54.91 54.56 3hn8 h ALA 408 Cb 0.15 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3hn8 h ALA 408 CO -0.02 0.53 0.38 1.49 0.00 0.00 0.00 179.25 181.63 3hn8 h GLU 409 N 0.21 0.00 0.00 0.00 4.81 -1.18 -3.42 114.58 115.00 3hn8 h GLU 409 Ca -0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 3hn8 h GLU 409 Cb 1.44 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.82 3hn8 h GLU 409 CO 0.16 0.00 0.00 1.04 -0.73 0.00 0.00 179.01 179.48 3hn8 n GLN 410 N -3.24 0.00 -1.22 1.92 6.02 -1.25 -4.99 117.38 114.62 3hn8 n GLN 410 Ca 0.02 0.00 -0.03 0.00 -0.01 0.00 0.00 57.00 56.98 3hn8 n GLN 410 Cb 0.48 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.75 3hn8 n GLN 410 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 3hn8 n PRO 411 N -0.23 0.91 -0.84 -1.09 -0.04 -1.26 -4.79 135.00 127.66 3hn8 n PRO 411 Ca 0.00 -0.40 0.05 0.00 -0.04 0.00 0.00 63.50 63.10 3hn8 n PRO 411 Cb 0.00 -0.04 0.17 0.00 -0.04 0.00 0.00 33.50 33.59 3hn8 n PRO 411 CO 0.00 0.00 0.00 -0.35 -0.04 0.00 0.00 175.50 175.11 3hn8 n PRO 412 N -1.17 1.34 -0.08 0.54 -0.05 -1.26 -4.69 135.00 129.62 3hn8 n PRO 412 Ca 0.02 -3.08 0.02 0.00 -0.05 0.00 0.00 63.50 60.41 3hn8 n PRO 412 Cb 0.08 -1.32 0.03 0.00 -0.05 0.00 0.00 33.50 32.23 3hn8 n PRO 412 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 175.50 175.20 3hn8 n ASP 413 N -0.78 1.24 -3.05 3.54 9.92 -1.26 -5.02 116.55 121.14 3hn8 n ASP 413 Ca 0.17 -1.91 0.03 0.00 -0.53 0.00 0.00 54.79 52.55 3hn8 n ASP 413 Cb 0.79 -0.10 -0.00 0.00 -0.64 0.00 0.00 41.12 41.17 3hn8 n ASP 413 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 3hn8 s ARG 414 N -0.92 0.43 0.48 -1.24 0.52 -1.26 -5.15 118.95 111.81 3hn8 s ARG 414 Ca 0.06 0.03 -0.23 0.00 -0.52 0.00 0.00 55.73 55.06 3hn8 s ARG 414 Cb 0.05 0.09 -0.08 0.00 0.52 0.00 0.00 34.95 35.54 3hn8 s ARG 414 CO 0.01 -0.68 1.26 -2.30 0.02 0.00 0.00 175.30 173.60 3hn8 n PRO 415 N 4.50 1.72 -4.35 3.54 -0.02 -1.26 -4.81 135.00 134.31 3hn8 n PRO 415 Ca 0.08 0.62 -0.33 0.00 -2.02 0.00 0.00 63.50 61.85 3hn8 n PRO 415 Cb 0.59 -2.41 -0.09 0.00 -0.02 0.00 0.00 33.50 31.56 3hn8 n PRO 415 CO 0.00 0.00 0.00 -0.48 1.98 0.00 0.00 175.50 177.00 3hn8 s LEU 416 N -2.26 3.41 0.08 2.45 2.34 -0.86 -4.95 118.68 118.89 3hn8 s LEU 416 Ca 0.66 -0.03 0.06 0.00 0.06 0.00 0.00 54.13 54.88 3hn8 s LEU 416 Cb -0.47 -1.93 -0.04 0.00 -0.56 0.00 0.00 46.19 43.20 3hn8 s LEU 416 CO 0.54 0.29 -0.11 0.26 -1.06 0.00 0.00 176.35 176.28 3hn8 s TRP 417 N -1.03 2.74 0.01 3.48 0.52 -1.26 -2.21 118.94 121.19 3hn8 s TRP 417 Ca 0.18 -0.15 0.02 0.00 0.02 0.00 0.00 56.10 56.17 3hn8 s TRP 417 Cb -0.11 -1.46 -0.01 0.00 -1.15 0.00 0.00 33.47 30.73 3hn8 s TRP 417 CO 0.08 0.40 -0.07 1.03 0.02 0.00 0.00 176.95 178.41 3hn8 s ARG 418 N -1.99 0.50 0.18 4.98 1.81 -0.80 -5.01 118.95 118.62 3hn8 s ARG 418 Ca 0.20 -0.43 -0.30 0.00 -1.72 0.00 0.00 55.73 53.48 3hn8 s ARG 418 Cb -0.11 -0.41 -0.08 0.00 -0.45 0.00 0.00 34.95 33.91 3hn8 s ARG 418 CO 0.12 0.10 1.10 -0.51 -0.68 0.00 0.00 175.30 175.43 3hn8 s ASP 419 N -0.71 7.26 -0.28 0.23 1.01 -1.26 -1.48 116.67 121.44 3hn8 s ASP 419 Ca -0.02 2.09 -0.29 0.00 0.71 0.00 0.00 52.55 55.04 3hn8 s ASP 419 Cb -0.05 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.27 3hn8 s ASP 419 CO 0.00 -0.23 1.41 -0.63 0.21 0.00 0.00 175.17 175.94 3hn8 s ILE 420 N -0.22 3.98 -0.74 0.77 1.01 0.04 -4.80 121.20 121.24 3hn8 s ILE 420 Ca 0.49 1.09 -0.26 0.00 0.00 0.00 0.00 60.65 61.98 3hn8 s ILE 420 Cb -0.29 -4.02 -0.01 0.00 0.01 0.00 0.00 42.46 38.15 3hn8 s ILE 420 CO 0.35 -0.44 1.71 -0.76 0.00 0.00 0.00 174.94 175.80 3hn8 s LEU 421 N 4.74 3.26 0.34 2.97 1.43 0.79 -4.67 118.68 127.54 3hn8 s LEU 421 Ca 0.62 -0.22 -0.28 0.00 -1.03 0.00 0.00 54.13 53.22 3hn8 s LEU 421 Cb -0.19 -2.55 -0.10 0.00 0.03 0.00 0.00 46.19 43.39 3hn8 s LEU 421 CO 0.26 -2.25 1.26 -1.61 0.23 0.00 0.00 176.35 174.23 3hn8 s GLU 422 N 6.55 4.30 0.00 1.70 2.02 -1.26 -2.28 118.70 129.72 3hn8 s GLU 422 Ca 0.59 2.09 0.00 0.00 0.02 0.00 0.00 54.97 57.67 3hn8 s GLU 422 Cb -0.09 -2.99 0.00 0.00 0.10 0.00 0.00 34.13 31.15 3hn8 s GLU 422 CO 0.12 -0.19 0.00 0.41 0.02 0.00 0.00 175.26 175.62 3hn8 n GLY 423 N 0.81 3.68 3.55 -1.39 0.00 -1.26 -4.75 105.19 105.84 3hn8 n GLY 423 Ca 0.01 -0.16 -0.52 0.00 0.00 0.00 0.00 46.02 45.35 3hn8 n GLY 423 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hn8 n GLY 424 N -0.52 -0.02 2.67 -0.02 0.00 -1.26 -4.95 105.19 101.09 3hn8 n GLY 424 Ca 0.00 0.62 -0.22 0.00 0.00 0.00 0.00 46.02 46.42 3hn8 n GLY 424 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3hn8 s SER 425 N 0.08 2.38 0.77 1.61 0.15 -1.26 -4.75 113.70 112.69 3hn8 s SER 425 Ca 0.80 -0.91 -0.00 0.00 0.70 0.00 0.00 55.95 56.54 3hn8 s SER 425 Cb -0.98 0.15 0.01 0.00 -1.71 0.00 0.00 66.02 63.48 3hn8 s SER 425 CO 0.52 -0.40 0.04 -0.62 1.20 0.00 0.00 173.24 173.98 3hn8 n GLU 426 N 5.29 0.19 -0.27 5.44 1.02 -1.26 -4.87 120.64 126.18 3hn8 n GLU 426 Ca -0.04 -0.09 0.29 0.00 -0.02 0.00 0.00 57.16 57.30 3hn8 n GLU 426 Cb 0.45 -0.04 0.66 0.00 -0.02 0.00 0.00 31.44 32.49 3hn8 n GLU 426 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3hn8 h LYS 427 N 0.00 0.12 -4.53 3.49 3.64 -2.05 -3.29 116.57 113.96 3hn8 h LYS 427 Ca -0.01 -0.01 -0.71 0.00 -1.27 0.00 0.00 60.65 58.65 3hn8 h LYS 427 Cb 0.04 -0.03 -0.27 0.00 -0.41 0.00 0.00 32.23 31.56 3hn8 h LYS 427 CO 0.01 0.08 -0.51 0.00 -2.27 0.00 0.00 179.45 176.77 3hn8 s ALA 428 N -5.13 3.23 0.12 5.00 0.00 -1.26 -5.08 121.76 118.65 3hn8 s ALA 428 Ca -0.06 -1.98 -0.20 0.00 0.00 0.00 0.00 51.96 49.72 3hn8 s ALA 428 Cb 0.23 -2.56 -0.07 0.00 0.00 0.00 0.00 23.12 20.72 3hn8 s ALA 428 CO 0.79 -1.53 0.62 0.34 0.00 0.00 0.00 175.76 175.98 3hn8 s ASP 429 N 1.84 7.09 0.16 0.00 2.15 -1.24 -4.89 116.67 121.78 3hn8 s ASP 429 Ca 0.02 1.32 0.00 0.00 0.43 0.00 0.00 52.55 54.32 3hn8 s ASP 429 Cb -0.21 -2.38 -0.00 0.00 -0.30 0.00 0.00 42.92 40.02 3hn8 s ASP 429 CO 0.03 0.21 1.38 -0.07 -0.17 0.00 0.00 175.17 176.55 3hn8 h LEU 430 N 4.24 0.36 0.00 -1.34 3.38 -1.81 -3.35 115.31 116.79 3hn8 h LEU 430 Ca -0.49 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.21 3hn8 h LEU 430 Cb 1.21 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3hn8 h LEU 430 CO 0.64 1.06 0.00 0.61 0.09 0.00 0.00 178.44 180.84 3hn8 n GLY 431 N 0.80 3.04 3.64 0.83 0.00 -1.23 -1.41 105.19 110.87 3hn8 n GLY 431 Ca -0.04 -1.95 -0.32 0.00 0.00 0.00 0.00 46.02 43.71 3hn8 n GLY 431 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hn8 s GLU 432 N -2.29 2.58 -0.09 1.61 8.01 -0.31 -1.00 118.70 127.22 3hn8 s GLU 432 Ca 0.00 -0.74 0.03 0.00 0.01 0.00 0.00 54.97 54.27 3hn8 s GLU 432 Cb 0.00 -2.54 0.01 0.00 -4.31 0.00 0.00 34.13 27.28 3hn8 s GLU 432 CO 0.00 0.59 -0.19 -1.17 0.01 0.00 0.00 175.26 174.50 3hn8 s LEU 433 N -1.74 1.90 -0.15 1.80 2.96 -0.62 -0.37 118.68 122.48 3hn8 s LEU 433 Ca 0.20 -0.45 -0.05 0.00 -0.22 0.00 0.00 54.13 53.61 3hn8 s LEU 433 Cb -0.11 -1.17 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 3hn8 s LEU 433 CO 0.11 0.11 0.02 0.21 -1.32 0.00 0.00 176.35 175.48 3hn8 s ASN 434 N 0.48 5.32 0.01 3.68 2.47 0.13 -1.86 114.94 125.16 3hn8 s ASN 434 Ca -0.17 0.05 -0.26 0.00 0.42 0.00 0.00 52.86 52.90 3hn8 s ASN 434 Cb -0.17 -1.80 0.06 0.00 -1.45 0.00 0.00 41.25 37.89 3hn8 s ASN 434 CO 0.07 0.23 0.59 0.72 -3.72 0.00 0.00 177.10 174.99 3hn8 s PHE 435 N 0.02 -0.53 0.25 0.43 -0.12 -1.16 -0.80 117.98 116.07 3hn8 s PHE 435 Ca 0.04 0.76 -0.02 0.00 -0.05 0.00 0.00 56.93 57.66 3hn8 s PHE 435 Cb -0.13 0.38 0.05 0.00 -0.63 0.00 0.00 43.02 42.70 3hn8 s PHE 435 CO 0.02 -0.63 0.34 -1.13 -0.05 0.00 0.00 175.22 173.76 3hn8 n SER 436 N 0.63 0.28 -3.16 1.98 3.41 -0.92 -2.64 113.62 113.19 3hn8 n SER 436 Ca -0.19 -1.28 0.05 0.00 -0.26 0.00 0.00 58.87 57.19 3hn8 n SER 436 Cb 0.59 -0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 64.29 3hn8 n SER 436 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3hn8 s LEU 437 N 0.00 -0.78 -0.05 1.04 2.96 -0.95 -4.54 118.68 116.36 3hn8 s LEU 437 Ca 0.21 0.51 -0.02 0.00 -0.22 0.00 0.00 54.13 54.62 3hn8 s LEU 437 Cb -0.01 1.66 0.03 0.00 0.50 0.00 0.00 46.19 48.37 3hn8 s LEU 437 CO 0.14 -0.15 0.03 0.00 -1.32 0.00 0.00 176.35 175.06 3hn8 s TYR 439 N 1.98 3.09 -0.58 0.00 5.04 -1.19 -0.72 117.35 124.98 3hn8 s TYR 439 Ca 0.03 -1.61 -0.23 0.00 -2.44 0.00 0.00 57.07 52.83 3hn8 s TYR 439 Cb -0.12 -2.06 0.05 0.00 0.35 0.00 0.00 41.96 40.18 3hn8 s TYR 439 CO -0.04 -0.74 0.89 -0.51 -1.34 0.00 0.00 175.55 173.81 3hn8 s LEU 440 N 1.31 4.36 0.26 6.97 2.01 0.42 -4.07 118.68 129.94 3hn8 s LEU 440 Ca -0.01 -0.66 0.00 0.00 0.01 0.00 0.00 54.13 53.47 3hn8 s LEU 440 Cb -0.17 -2.63 0.33 0.00 0.01 0.00 0.00 46.19 43.73 3hn8 s LEU 440 CO -0.04 -1.23 1.69 -0.65 1.01 0.00 0.00 176.35 177.13 3hn8 h PRO 441 N 9.33 0.59 0.00 1.29 0.11 -1.89 0.63 132.00 142.06 3hn8 h PRO 441 Ca -0.27 -0.22 -0.00 0.00 0.11 0.00 0.00 66.00 65.61 3hn8 h PRO 441 Cb 1.08 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 3hn8 h PRO 441 CO 1.09 0.78 -0.02 1.79 -0.21 0.00 0.00 178.00 181.43 3hn8 h THR 442 N 0.52 0.43 0.00 -1.15 1.35 -1.97 -3.21 112.91 108.87 3hn8 h THR 442 Ca 0.07 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.82 3hn8 h THR 442 Cb 0.69 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 3hn8 h THR 442 CO 0.05 0.02 -0.00 0.00 -0.25 0.00 0.00 175.52 175.34 3hn8 n ALA 443 N -2.26 1.35 -1.06 6.62 0.00 -0.98 -5.02 120.51 119.16 3hn8 n ALA 443 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.39 3hn8 n ALA 443 Cb 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 3hn8 n ALA 443 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hn8 n GLY 444 N 0.68 0.50 3.65 0.00 0.00 0.22 -4.91 105.19 105.32 3hn8 n GLY 444 Ca 0.00 -0.19 -0.43 0.00 0.00 0.00 0.00 46.02 45.40 3hn8 n GLY 444 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hn8 s LEU 445 N -0.48 4.05 -0.19 0.99 1.43 -1.12 -0.37 118.68 122.99 3hn8 s LEU 445 Ca 0.00 1.14 -0.05 0.00 -1.03 0.00 0.00 54.13 54.19 3hn8 s LEU 445 Cb 0.00 -3.42 -0.03 0.00 0.03 0.00 0.00 46.19 42.78 3hn8 s LEU 445 CO 0.00 -0.69 -0.00 -0.22 0.23 0.00 0.00 176.35 175.67 3hn8 s LEU 446 N 3.23 3.29 -0.13 1.79 0.20 -0.41 -0.43 118.68 126.22 3hn8 s LEU 446 Ca 0.41 -0.17 0.01 0.00 0.69 0.00 0.00 54.13 55.07 3hn8 s LEU 446 Cb -0.14 -1.83 0.02 0.00 -0.43 0.00 0.00 46.19 43.81 3hn8 s LEU 446 CO 0.10 0.09 -0.14 -0.89 -0.29 0.00 0.00 176.35 175.21 3hn8 s THR 447 N 0.85 1.50 -0.10 3.68 2.01 0.10 -0.78 115.64 122.90 3hn8 s THR 447 Ca 0.01 -0.61 -0.01 0.00 0.31 0.00 0.00 61.69 61.39 3hn8 s THR 447 Cb -0.14 -1.40 -0.00 0.00 0.01 0.00 0.00 72.50 70.96 3hn8 s THR 447 CO 0.02 0.44 -0.03 0.58 -0.69 0.00 0.00 174.62 174.95 3hn8 h VAL 448 N 6.03 0.00 -4.48 3.82 2.07 -0.53 -2.09 116.25 121.06 3hn8 h VAL 448 Ca -0.35 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.20 3hn8 h VAL 448 Cb 1.15 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 3hn8 h VAL 448 CO 0.50 0.00 -0.48 0.41 0.02 0.00 0.00 177.57 178.02 3hn8 n THR 449 N -4.69 -8.40 -2.28 2.57 -1.04 -1.25 -2.89 114.28 96.31 3hn8 n THR 449 Ca -0.01 0.88 -0.43 0.00 -2.04 0.00 0.00 64.05 62.46 3hn8 n THR 449 Cb 0.04 -6.11 -0.02 0.00 -1.82 0.00 0.00 70.33 62.41 3hn8 n THR 449 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 3hn8 s ILE 450 N -1.65 4.00 -0.15 12.58 -1.09 -0.11 -2.17 121.20 132.60 3hn8 s ILE 450 Ca 0.09 1.24 -0.11 0.00 -2.23 0.00 0.00 60.65 59.65 3hn8 s ILE 450 Cb -0.03 -3.80 -0.04 0.00 -1.58 0.00 0.00 42.46 37.01 3hn8 s ILE 450 CO 0.52 -0.09 -0.19 -0.38 -1.23 0.00 0.00 174.94 173.57 3hn8 n ILE 451 N 5.26 1.44 -3.83 2.92 5.41 0.02 -0.20 119.36 130.38 3hn8 n ILE 451 Ca 0.15 0.19 -0.04 0.00 1.00 0.00 0.00 62.75 64.04 3hn8 n ILE 451 Cb 0.44 -2.36 0.01 0.00 -0.71 0.00 0.00 39.64 37.01 3hn8 n ILE 451 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 3hn8 s LYS 452 N -2.36 1.41 0.02 0.38 -2.85 -0.98 -0.11 119.74 115.25 3hn8 s LYS 452 Ca -0.18 -0.86 -0.03 0.00 -1.00 0.00 0.00 55.97 53.90 3hn8 s LYS 452 Cb 0.03 0.42 -0.01 0.00 -2.06 0.00 0.00 37.83 36.21 3hn8 s LYS 452 CO 0.27 -0.66 0.04 0.00 0.10 0.00 0.00 175.35 175.11 3hn8 s ALA 453 N -2.63 -0.05 0.02 0.59 0.00 -0.66 0.19 121.76 119.23 3hn8 s ALA 453 Ca 0.17 -0.44 0.04 0.00 0.00 0.00 0.00 51.96 51.74 3hn8 s ALA 453 Cb -0.03 0.15 -0.02 0.00 0.00 0.00 0.00 23.12 23.23 3hn8 s ALA 453 CO 0.05 -0.20 -0.13 0.45 0.00 0.00 0.00 175.76 175.93 3hn8 s SER 454 N -1.53 1.58 -1.29 0.00 0.15 0.50 -3.42 113.70 109.69 3hn8 s SER 454 Ca -0.14 -0.37 -0.09 0.00 0.70 0.00 0.00 55.95 56.05 3hn8 s SER 454 Cb -0.08 -0.13 0.06 0.00 -1.71 0.00 0.00 66.02 64.17 3hn8 s SER 454 CO -0.01 0.08 0.48 -3.20 1.20 0.00 0.00 173.24 171.79 3hn8 n ASN 455 N 2.22 -3.92 -4.34 5.45 5.15 -1.23 -1.17 115.26 117.44 3hn8 n ASN 455 Ca -0.17 -0.35 -0.33 0.00 -0.60 0.00 0.00 54.58 53.13 3hn8 n ASN 455 Cb 0.55 -3.24 0.12 0.00 -0.53 0.00 0.00 39.78 36.68 3hn8 n ASN 455 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3hn8 n LEU 456 N -3.71 -1.30 -4.74 1.20 4.32 -0.80 -3.49 117.00 108.48 3hn8 n LEU 456 Ca -0.03 0.23 -0.40 0.00 -0.02 0.00 0.00 56.01 55.79 3hn8 n LEU 456 Cb 0.55 -1.10 -0.05 0.00 -1.62 0.00 0.00 43.42 41.20 3hn8 n LEU 456 CO 0.49 -3.80 0.41 -0.75 -1.22 0.00 0.00 177.39 172.52 3hn8 s LYS 457 N -3.38 4.44 0.21 3.23 2.20 -0.50 -4.80 119.74 121.13 3hn8 s LYS 457 Ca 0.54 0.93 -0.31 0.00 -0.36 0.00 0.00 55.97 56.78 3hn8 s LYS 457 Cb -0.18 -3.39 -0.10 0.00 -1.51 0.00 0.00 37.83 32.65 3hn8 s LYS 457 CO 0.69 0.22 1.47 0.00 -0.36 0.00 0.00 175.35 177.36 3hn8 s ALA 458 N 0.25 3.67 0.00 3.13 0.00 -1.26 -4.73 121.76 122.81 3hn8 s ALA 458 Ca 0.37 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.64 3hn8 s ALA 458 Cb -0.19 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.36 3hn8 s ALA 458 CO 0.20 -0.73 0.00 -1.33 0.00 0.00 0.00 175.76 173.90 3hn8 n MET 459 N 3.02 2.75 -4.02 0.00 0.00 0.49 -4.97 117.12 114.39 3hn8 n MET 459 Ca 0.09 0.00 -0.26 0.00 0.00 0.00 0.00 57.70 57.54 3hn8 n MET 459 Cb 0.40 -0.71 -0.04 0.00 0.00 0.00 0.00 33.22 32.87 3hn8 n MET 459 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 3hn8 s ASP 460 N -1.27 5.91 0.39 7.83 1.11 0.36 -5.00 116.67 126.01 3hn8 s ASP 460 Ca 0.00 0.00 0.13 0.00 0.18 0.00 0.00 52.55 52.87 3hn8 s ASP 460 Cb 0.00 -1.66 0.81 0.00 1.07 0.00 0.00 42.92 43.14 3hn8 s ASP 460 CO 0.00 0.05 1.88 -0.07 1.18 0.00 0.00 175.17 178.20 3hn8 h LEU 461 N 2.17 0.00 -1.23 1.23 3.38 -1.97 -2.91 115.31 115.99 3hn8 h LEU 461 Ca -0.48 0.00 0.15 0.00 0.09 0.00 0.00 57.88 57.63 3hn8 h LEU 461 Cb 1.20 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.88 3hn8 h LEU 461 CO 0.65 0.32 0.59 0.71 0.09 0.00 0.00 178.44 180.80 3hn8 h THR 462 N 0.00 0.83 0.00 0.22 1.35 -2.03 -3.45 112.91 109.83 3hn8 h THR 462 Ca -0.00 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.60 3hn8 h THR 462 Cb 0.56 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 67.01 3hn8 h THR 462 CO 0.04 0.13 0.00 0.61 -0.25 0.00 0.00 175.52 176.06 3hn8 n GLY 463 N -1.41 0.58 0.00 5.82 0.00 -1.10 -5.12 105.19 103.96 3hn8 n GLY 463 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3hn8 n GLY 463 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3hn8 n PHE 464 N 0.00 0.00 -3.71 1.61 3.01 -1.26 -4.82 117.46 112.30 3hn8 n PHE 464 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.32 3hn8 n PHE 464 Cb 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.39 3hn8 n PHE 464 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 3hn8 s SER 465 N 1.00 -0.29 -0.92 4.37 0.01 -1.21 -0.38 113.70 116.27 3hn8 s SER 465 Ca 0.00 0.22 -0.02 0.00 1.31 0.00 0.00 55.95 57.46 3hn8 s SER 465 Cb 0.00 0.36 0.26 0.00 0.21 0.00 0.00 66.02 66.85 3hn8 s SER 465 CO 0.00 -0.49 1.02 0.47 0.41 0.00 0.00 173.24 174.65 3hn8 n ASP 466 N 1.16 4.91 -4.78 2.44 9.92 -1.26 -1.28 116.55 127.66 3hn8 n ASP 466 Ca -0.21 -3.27 -0.37 0.00 -0.53 0.00 0.00 54.79 50.41 3hn8 n ASP 466 Cb 0.56 -1.07 -0.04 0.00 -0.64 0.00 0.00 41.12 39.93 3hn8 n ASP 466 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 3hn8 s PRO 467 N -2.02 4.21 0.23 -0.24 0.02 -0.87 -0.38 135.00 135.95 3hn8 s PRO 467 Ca 0.32 1.55 -0.01 0.00 0.02 0.00 0.00 61.00 62.87 3hn8 s PRO 467 Cb 0.01 -2.61 -0.03 0.00 0.02 0.00 0.00 34.50 31.88 3hn8 s PRO 467 CO -0.03 -0.11 0.19 1.52 -0.33 0.00 0.00 177.00 178.24 3hn8 s TYR 468 N -1.60 1.17 -0.11 6.54 -0.85 0.25 -2.78 117.35 119.97 3hn8 s TYR 468 Ca 0.56 -1.36 0.02 0.00 -0.52 0.00 0.00 57.07 55.77 3hn8 s TYR 468 Cb -0.23 -0.50 0.01 0.00 0.38 0.00 0.00 41.96 41.62 3hn8 s TYR 468 CO 0.29 -0.72 -0.16 0.08 -1.52 0.00 0.00 175.55 173.52 3hn8 s VAL 469 N -4.01 1.59 -0.42 -3.49 1.01 -1.26 -0.47 120.40 113.35 3hn8 s VAL 469 Ca 0.38 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.56 3hn8 s VAL 469 Cb 0.05 -1.44 0.07 0.00 0.00 0.00 0.00 36.38 35.06 3hn8 s VAL 469 CO 0.14 0.46 0.26 -0.75 0.00 0.00 0.00 175.10 175.21 3hn8 s LYS 470 N 0.95 2.65 -0.11 2.72 2.20 -0.42 -1.78 119.74 125.95 3hn8 s LYS 470 Ca -0.07 -1.40 -0.16 0.00 -0.36 0.00 0.00 55.97 53.98 3hn8 s LYS 470 Cb -0.15 -3.79 -0.05 0.00 -1.51 0.00 0.00 37.83 32.33 3hn8 s LYS 470 CO -0.01 -0.93 0.40 0.00 -0.36 0.00 0.00 175.35 174.45 3hn8 s ALA 471 N 1.45 3.57 -0.03 3.13 0.00 -0.26 -1.49 121.76 128.13 3hn8 s ALA 471 Ca 0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 51.96 51.70 3hn8 s ALA 471 Cb -0.23 -2.49 0.03 0.00 0.00 0.00 0.00 23.12 20.43 3hn8 s ALA 471 CO 0.03 0.15 0.03 -1.54 0.00 0.00 0.00 175.76 174.42 3hn8 s SER 472 N 0.16 0.44 0.21 0.00 1.04 -0.98 -0.31 113.70 114.27 3hn8 s SER 472 Ca 0.22 0.02 -0.30 0.00 0.48 0.00 0.00 55.95 56.37 3hn8 s SER 472 Cb -0.15 -0.14 -0.09 0.00 0.10 0.00 0.00 66.02 65.74 3hn8 s SER 472 CO 0.09 -0.15 1.34 -0.22 0.98 0.00 0.00 173.24 175.28 3hn8 s LEU 473 N 1.30 4.41 -0.06 2.42 2.96 0.17 -1.11 118.68 128.77 3hn8 s LEU 473 Ca -0.06 2.46 0.02 0.00 -0.22 0.00 0.00 54.13 56.33 3hn8 s LEU 473 Cb -0.13 -3.61 0.02 0.00 0.50 0.00 0.00 46.19 42.96 3hn8 s LEU 473 CO -0.03 -0.56 -0.09 -0.63 -1.32 0.00 0.00 176.35 173.71 3hn8 s ILE 474 N 0.07 0.95 -0.07 6.68 1.01 0.43 -0.74 121.20 129.52 3hn8 s ILE 474 Ca 0.57 -0.35 -0.02 0.00 0.00 0.00 0.00 60.65 60.85 3hn8 s ILE 474 Cb -0.38 -0.90 0.04 0.00 0.01 0.00 0.00 42.46 41.23 3hn8 s ILE 474 CO 0.39 0.32 0.06 -0.55 0.00 0.00 0.00 174.94 175.16 3hn8 s SER 475 N 0.87 1.48 -1.21 3.58 0.15 -0.83 0.40 113.70 118.14 3hn8 s SER 475 Ca -0.11 -0.10 -0.08 0.00 0.70 0.00 0.00 55.95 56.36 3hn8 s SER 475 Cb -0.15 -0.22 -0.02 0.00 -1.71 0.00 0.00 66.02 63.92 3hn8 s SER 475 CO 0.01 -0.26 0.75 -0.62 1.20 0.00 0.00 173.24 174.33 3hn8 n GLU 476 N 5.26 -3.15 0.00 5.44 1.02 -1.26 -2.38 120.64 125.57 3hn8 n GLU 476 Ca -0.05 0.60 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 3hn8 n GLU 476 Cb 0.50 -4.91 0.00 0.00 -0.02 0.00 0.00 31.44 27.01 3hn8 n GLU 476 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hn8 n GLY 477 N -1.57 2.52 3.77 0.62 0.00 -1.26 -4.97 105.19 104.29 3hn8 n GLY 477 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 3hn8 n GLY 477 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3hn8 s ARG 478 N 0.00 4.28 -0.26 1.61 3.52 -1.00 -4.71 118.95 122.38 3hn8 s ARG 478 Ca 0.00 0.67 -0.25 0.00 -0.13 0.00 0.00 55.73 56.03 3hn8 s ARG 478 Cb 0.00 -3.33 -0.00 0.00 -1.56 0.00 0.00 34.95 30.05 3hn8 s ARG 478 CO 0.00 0.39 0.84 0.50 -0.81 0.00 0.00 175.30 176.22 3hn8 s ARG 479 N -0.24 4.14 -0.22 5.12 3.00 -1.26 -1.96 118.95 127.53 3hn8 s ARG 479 Ca 0.30 0.89 0.08 0.00 -1.00 0.00 0.00 55.73 56.00 3hn8 s ARG 479 Cb -0.18 -3.66 -0.19 0.00 0.00 0.00 0.00 34.95 30.92 3hn8 s ARG 479 CO 0.16 -0.57 -0.09 1.28 0.00 0.00 0.00 175.30 176.08 3hn8 n LEU 480 N 6.09 1.68 -3.64 -0.88 4.77 0.09 -5.02 117.00 120.09 3hn8 n LEU 480 Ca 0.06 -0.07 -0.05 0.00 -0.03 0.00 0.00 56.01 55.92 3hn8 n LEU 480 Cb 0.48 -0.27 -0.07 0.00 -2.33 0.00 0.00 43.42 41.23 3hn8 n LEU 480 CO 0.48 0.71 0.51 -0.54 -1.33 0.00 0.00 177.39 177.23 3hn8 s LYS 481 N -2.47 0.54 0.37 3.23 -0.14 -1.24 -4.97 119.74 115.06 3hn8 s LYS 481 Ca -0.22 0.96 0.07 0.00 -1.36 0.00 0.00 55.97 55.42 3hn8 s LYS 481 Cb 0.07 0.13 -0.02 0.00 -1.68 0.00 0.00 37.83 36.33 3hn8 s LYS 481 CO 0.65 -0.12 0.40 -1.59 -0.76 0.00 0.00 175.35 173.93 3hn8 s LYS 482 N 1.54 2.80 -0.29 1.68 -2.85 -1.26 0.46 119.74 121.81 3hn8 s LYS 482 Ca -0.09 -1.27 -0.15 0.00 -1.00 0.00 0.00 55.97 53.46 3hn8 s LYS 482 Cb -0.04 -2.59 0.11 0.00 -2.06 0.00 0.00 37.83 33.25 3hn8 s LYS 482 CO -0.18 -0.03 0.75 0.50 0.10 0.00 0.00 175.35 176.49 3hn8 s ARG 483 N -4.13 0.60 0.36 1.78 6.06 0.58 -4.95 118.95 119.25 3hn8 s ARG 483 Ca 0.46 1.14 0.07 0.00 -2.50 0.00 0.00 55.73 54.90 3hn8 s ARG 483 Cb -0.07 0.30 -0.02 0.00 0.06 0.00 0.00 34.95 35.22 3hn8 s ARG 483 CO 0.29 -0.14 0.40 0.15 -2.50 0.00 0.00 175.30 173.49 3hn8 s LYS 484 N 1.89 2.81 0.27 5.12 1.02 -1.26 -1.10 119.74 128.48 3hn8 s LYS 484 Ca -0.09 -1.25 0.02 0.00 0.02 0.00 0.00 55.97 54.67 3hn8 s LYS 484 Cb -0.06 -2.59 0.02 0.00 -0.52 0.00 0.00 37.83 34.67 3hn8 s LYS 484 CO -0.19 -0.02 0.13 0.25 -0.92 0.00 0.00 175.35 174.61 3hn8 n THR 485 N -1.55 0.00 -0.53 2.17 -2.24 -0.74 -4.97 114.28 106.43 3hn8 n THR 485 Ca 0.01 -1.12 -0.29 0.00 -2.27 0.00 0.00 64.05 60.38 3hn8 n THR 485 Cb 0.60 -0.10 0.23 0.00 -2.10 0.00 0.00 70.33 68.96 3hn8 n THR 485 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3hn8 n SER 486 N -1.67 -1.18 -2.14 3.42 2.88 -1.26 -4.66 113.62 109.02 3hn8 n SER 486 Ca -0.04 -0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.21 3hn8 n SER 486 Cb 0.31 -1.32 0.06 0.00 -0.75 0.00 0.00 64.21 62.52 3hn8 n SER 486 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 3hn8 n ILE 487 N -4.79 3.12 -1.07 2.46 2.08 -1.26 -4.36 119.36 115.54 3hn8 n ILE 487 Ca 0.05 -3.43 -0.42 0.00 0.56 0.00 0.00 62.75 59.52 3hn8 n ILE 487 Cb 0.53 -1.09 -0.06 0.00 -0.75 0.00 0.00 39.64 38.27 3hn8 n ILE 487 CO 0.00 0.00 0.00 0.29 0.56 0.00 0.00 176.55 177.40 3hn8 n LYS 488 N -0.85 0.00 -4.04 0.38 4.76 -1.12 -4.56 118.16 112.73 3hn8 n LYS 488 Ca 0.54 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 55.66 3hn8 n LYS 488 Cb 0.83 -0.92 -0.06 0.00 -1.84 0.00 0.00 35.03 33.04 3hn8 n LYS 488 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 3hn8 s LYS 489 N 1.81 3.11 -1.25 1.97 -2.85 -1.26 -2.04 119.74 119.22 3hn8 s LYS 489 Ca 0.64 -0.51 -0.03 0.00 -1.00 0.00 0.00 55.97 55.07 3hn8 s LYS 489 Cb -0.92 -2.87 0.00 0.00 -2.06 0.00 0.00 37.83 31.98 3hn8 s LYS 489 CO 0.50 0.63 1.06 0.09 0.10 0.00 0.00 175.35 177.73 3hn8 n ASN 490 N 0.87 -3.42 -4.09 0.03 3.02 -1.00 -4.94 115.26 105.73 3hn8 n ASN 490 Ca -0.11 -0.60 -0.10 0.00 -0.03 0.00 0.00 54.58 53.75 3hn8 n ASN 490 Cb 0.52 -5.10 -0.09 0.00 -0.61 0.00 0.00 39.78 34.50 3hn8 n ASN 490 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3hn8 s THR 491 N -3.35 0.08 0.00 3.41 -1.32 -0.40 -4.85 115.64 109.21 3hn8 s THR 491 Ca 0.19 -1.73 0.00 0.00 -1.21 0.00 0.00 61.69 58.94 3hn8 s THR 491 Cb -0.08 -2.03 0.00 0.00 -1.51 0.00 0.00 72.50 68.88 3hn8 s THR 491 CO 0.73 -0.35 0.13 0.18 -2.21 0.00 0.00 174.62 173.10 3hn8 n LEU 492 N -0.16 0.26 -3.42 9.08 4.77 -1.26 -3.32 117.00 122.94 3hn8 n LEU 492 Ca -0.05 -0.41 -0.26 0.00 -0.03 0.00 0.00 56.01 55.25 3hn8 n LEU 492 Cb 0.64 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.64 3hn8 n LEU 492 CO 0.28 0.06 -0.10 0.59 -1.33 0.00 0.00 177.39 176.90 3hn8 n ASN 493 N -0.31 2.06 -4.81 -1.43 4.13 -1.26 -1.90 115.26 111.74 3hn8 n ASN 493 Ca 0.00 -3.06 -0.33 0.00 1.68 0.00 0.00 54.58 52.88 3hn8 n ASN 493 Cb 0.05 -0.66 0.00 0.00 -1.54 0.00 0.00 39.78 37.63 3hn8 n ASN 493 CO 0.00 0.00 0.00 -2.84 0.28 0.00 0.00 177.26 174.70 3hn8 s PRO 494 N -1.63 3.43 -0.08 3.52 0.02 -1.22 -4.82 135.00 134.21 3hn8 s PRO 494 Ca 0.35 1.16 0.02 0.00 0.02 0.00 0.00 61.00 62.55 3hn8 s PRO 494 Cb 0.11 -2.05 0.02 0.00 0.02 0.00 0.00 34.50 32.60 3hn8 s PRO 494 CO -0.09 -0.72 -0.12 0.99 -0.33 0.00 0.00 177.00 176.74 3hn8 s THR 495 N -2.48 1.15 -0.04 0.99 2.01 -1.26 -1.65 115.64 114.36 3hn8 s THR 495 Ca 0.63 -0.46 -0.08 0.00 0.31 0.00 0.00 61.69 62.08 3hn8 s THR 495 Cb -0.15 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 71.26 3hn8 s THR 495 CO 0.36 0.37 -0.17 -1.22 -0.69 0.00 0.00 174.62 173.27 3hn8 n TYR 496 N 4.06 0.00 -2.44 4.92 4.02 0.84 -4.98 117.16 123.59 3hn8 n TYR 496 Ca -0.21 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.52 3hn8 n TYR 496 Cb 0.51 -0.25 -0.01 0.00 -0.02 0.00 0.00 39.34 39.57 3hn8 n TYR 496 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3hn8 n ASN 497 N -3.94 -4.79 -4.67 7.72 3.02 0.72 -4.96 115.26 108.36 3hn8 n ASN 497 Ca -0.08 0.10 -0.35 0.00 -0.03 0.00 0.00 54.58 54.22 3hn8 n ASN 497 Cb 0.27 -4.02 -0.09 0.00 -0.61 0.00 0.00 39.78 35.33 3hn8 n ASN 497 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3hn8 s GLU 498 N -5.05 3.65 -0.15 3.52 2.02 -0.97 -4.93 118.70 116.79 3hn8 s GLU 498 Ca 0.01 -0.34 -0.17 0.00 0.02 0.00 0.00 54.97 54.48 3hn8 s GLU 498 Cb -0.00 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 31.09 3hn8 s GLU 498 CO 0.01 0.44 0.45 0.00 0.02 0.00 0.00 175.26 176.18 3hn8 s ALA 499 N -0.12 3.51 -0.14 5.21 0.00 -1.26 -0.94 121.76 128.02 3hn8 s ALA 499 Ca 0.07 -0.30 -0.03 0.00 0.00 0.00 0.00 51.96 51.69 3hn8 s ALA 499 Cb -0.12 -2.63 -0.03 0.00 0.00 0.00 0.00 23.12 20.33 3hn8 s ALA 499 CO 0.01 -0.09 -0.02 -0.51 0.00 0.00 0.00 175.76 175.15 3hn8 s LEU 500 N 0.84 3.37 0.03 0.00 1.43 -1.26 -4.81 118.68 118.28 3hn8 s LEU 500 Ca 0.23 -0.04 0.07 0.00 -1.03 0.00 0.00 54.13 53.36 3hn8 s LEU 500 Cb -0.15 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 3hn8 s LEU 500 CO 0.09 0.23 -0.20 -0.69 0.23 0.00 0.00 176.35 176.00 3hn8 s VAL 501 N 0.01 1.63 -0.01 -1.59 1.01 -1.26 0.19 120.40 120.37 3hn8 s VAL 501 Ca 0.01 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.90 3hn8 s VAL 501 Cb -0.13 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.85 3hn8 s VAL 501 CO 0.02 0.26 -0.03 -0.36 0.00 0.00 0.00 175.10 175.00 3hn8 s PHE 502 N -0.72 0.35 -0.30 5.22 0.40 0.04 -5.00 117.98 117.97 3hn8 s PHE 502 Ca 0.07 -0.05 -0.27 0.00 -0.60 0.00 0.00 56.93 56.08 3hn8 s PHE 502 Cb -0.09 -0.30 0.01 0.00 0.51 0.00 0.00 43.02 43.16 3hn8 s PHE 502 CO 0.01 -0.05 0.97 -0.51 0.70 0.00 0.00 175.22 176.34 3hn8 s ASP 503 N 0.30 6.86 -0.07 1.36 1.01 -1.26 -1.28 116.67 123.60 3hn8 s ASP 503 Ca -0.03 0.96 -0.03 0.00 0.71 0.00 0.00 52.55 54.16 3hn8 s ASP 503 Cb -0.06 -2.49 0.04 0.00 1.01 0.00 0.00 42.92 41.42 3hn8 s ASP 503 CO -0.01 -0.76 0.11 -0.69 0.21 0.00 0.00 175.17 174.03 3hn8 s VAL 504 N 3.35 -0.18 0.67 -1.27 1.01 0.51 -4.99 120.40 119.49 3hn8 s VAL 504 Ca 0.41 0.37 -0.17 0.00 0.00 0.00 0.00 61.98 62.59 3hn8 s VAL 504 Cb -0.13 -0.23 0.00 0.00 0.00 0.00 0.00 36.38 36.02 3hn8 s VAL 504 CO 0.13 0.15 1.27 0.00 0.00 0.00 0.00 175.10 176.64 3hn8 s ALA 505 N 2.23 2.30 0.39 5.51 0.00 -1.26 -4.38 121.76 126.54 3hn8 s ALA 505 Ca 0.04 1.12 0.12 0.00 0.00 0.00 0.00 51.96 53.24 3hn8 s ALA 505 Cb -0.12 -3.53 0.79 0.00 0.00 0.00 0.00 23.12 20.26 3hn8 s ALA 505 CO -0.04 -1.67 1.88 -1.35 0.00 0.00 0.00 175.76 174.58 3hn8 h PRO 506 N 0.31 0.07 -0.08 0.00 0.11 -1.94 -1.79 132.00 128.68 3hn8 h PRO 506 Ca -0.50 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3hn8 h PRO 506 Cb 1.32 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.43 3hn8 h PRO 506 CO 0.52 0.34 0.00 -0.85 -0.21 0.00 0.00 178.00 177.80 3hn8 n GLU 507 N -4.19 0.88 0.00 1.05 0.00 -1.26 -3.82 120.64 113.30 3hn8 n GLU 507 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.14 3hn8 n GLU 507 Cb 0.34 -1.04 0.00 0.00 0.00 0.00 0.00 31.44 30.74 3hn8 n GLU 507 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 3hn8 n SER 508 N -0.45 1.29 -0.10 -1.84 7.64 -0.73 -4.84 113.62 114.58 3hn8 n SER 508 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.80 3hn8 n SER 508 Cb 0.02 0.20 -0.02 0.00 -1.01 0.00 0.00 64.21 63.39 3hn8 n SER 508 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 3hn8 h VAL 509 N 0.00 0.21 -1.52 0.44 -1.51 -1.50 0.39 116.25 112.76 3hn8 h VAL 509 Ca 0.00 0.00 0.45 0.00 -1.23 0.00 0.00 66.70 65.92 3hn8 h VAL 509 Cb 0.13 0.21 -0.09 0.00 -2.13 0.00 0.00 31.29 29.41 3hn8 h VAL 509 CO 0.00 0.00 1.06 -0.33 -1.23 0.00 0.00 177.57 177.07 3hn8 h GLU 510 N -0.29 0.05 -0.01 5.19 5.08 -1.88 0.21 114.58 122.93 3hn8 h GLU 510 Ca 0.16 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3hn8 h GLU 510 Cb 0.55 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.79 3hn8 h GLU 510 CO -0.52 0.03 -0.42 -1.71 -1.00 0.00 0.00 179.01 175.39 3hn8 n ASN 511 N -4.28 1.85 -5.02 1.42 5.15 0.04 -4.72 115.26 109.71 3hn8 n ASN 511 Ca 0.36 -1.42 -0.21 0.00 -0.60 0.00 0.00 54.58 52.71 3hn8 n ASN 511 Cb 1.57 0.48 0.05 0.00 -0.53 0.00 0.00 39.78 41.35 3hn8 n ASN 511 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3hn8 s VAL 512 N -2.23 2.05 -0.01 3.44 0.11 0.74 -4.28 120.40 120.24 3hn8 s VAL 512 Ca 0.16 -1.08 -0.25 0.00 -2.93 0.00 0.00 61.98 57.88 3hn8 s VAL 512 Cb 0.16 -2.13 0.08 0.00 -1.53 0.00 0.00 36.38 32.96 3hn8 s VAL 512 CO 0.50 0.00 1.15 0.61 -3.33 0.00 0.00 175.10 174.03 3hn8 n GLY 513 N -2.18 0.28 3.11 6.54 0.00 0.16 -4.32 105.19 108.78 3hn8 n GLY 513 Ca 0.13 -1.04 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 3hn8 n GLY 513 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3hn8 s LEU 514 N 0.00 1.31 -0.40 0.99 2.34 -0.15 0.16 118.68 122.93 3hn8 s LEU 514 Ca 0.27 0.15 -0.09 0.00 0.06 0.00 0.00 54.13 54.52 3hn8 s LEU 514 Cb -0.01 0.74 0.07 0.00 -0.56 0.00 0.00 46.19 46.43 3hn8 s LEU 514 CO -0.00 -0.22 0.23 -0.55 -1.06 0.00 0.00 176.35 174.75 3hn8 s SER 515 N -0.58 5.60 0.13 1.48 0.15 -0.27 -2.03 113.70 118.18 3hn8 s SER 515 Ca -0.07 -1.39 -0.17 0.00 0.70 0.00 0.00 55.95 55.02 3hn8 s SER 515 Cb -0.04 -1.97 -0.07 0.00 -1.71 0.00 0.00 66.02 62.22 3hn8 s SER 515 CO 0.01 -0.49 0.59 -0.63 1.20 0.00 0.00 173.24 173.92 3hn8 s ILE 516 N 1.44 4.76 -0.14 6.45 -1.09 -0.60 -2.33 121.20 129.68 3hn8 s ILE 516 Ca 0.02 1.07 -0.05 0.00 -2.23 0.00 0.00 60.65 59.46 3hn8 s ILE 516 Cb -0.22 -3.83 0.07 0.00 -1.58 0.00 0.00 42.46 36.90 3hn8 s ILE 516 CO 0.03 0.37 0.29 0.00 -1.23 0.00 0.00 174.94 174.41 3hn8 s ALA 517 N -1.32 -0.68 0.06 9.38 0.00 -0.56 -0.47 121.76 128.18 3hn8 s ALA 517 Ca 0.35 1.07 -0.30 0.00 0.00 0.00 0.00 51.96 53.07 3hn8 s ALA 517 Cb -0.17 -1.02 -0.05 0.00 0.00 0.00 0.00 23.12 21.88 3hn8 s ALA 517 CO 0.19 -0.58 1.12 0.08 0.00 0.00 0.00 175.76 176.57 3hn8 s VAL 518 N 2.25 4.24 -0.04 0.00 1.01 -0.35 -1.31 120.40 126.21 3hn8 s VAL 518 Ca -0.01 1.66 0.03 0.00 0.00 0.00 0.00 61.98 63.66 3hn8 s VAL 518 Cb -0.12 -4.06 0.00 0.00 0.00 0.00 0.00 36.38 32.20 3hn8 s VAL 518 CO -0.09 0.16 -0.12 -0.69 0.00 0.00 0.00 175.10 174.35 3hn8 s VAL 519 N 0.81 1.08 -0.16 2.92 1.01 0.38 -1.16 120.40 125.28 3hn8 s VAL 519 Ca 0.55 -0.51 -0.29 0.00 0.00 0.00 0.00 61.98 61.73 3hn8 s VAL 519 Cb -0.27 -0.95 -0.00 0.00 0.00 0.00 0.00 36.38 35.15 3hn8 s VAL 519 CO 0.30 0.33 1.03 -0.62 0.00 0.00 0.00 175.10 176.14 3hn8 s ASP 520 N 0.24 7.17 0.75 3.32 3.68 -0.30 -0.59 116.67 130.95 3hn8 s ASP 520 Ca -0.06 1.47 -0.12 0.00 2.13 0.00 0.00 52.55 55.97 3hn8 s ASP 520 Cb -0.11 -2.55 0.05 0.00 -1.45 0.00 0.00 42.92 38.86 3hn8 s ASP 520 CO 0.02 -0.56 1.11 -0.47 0.13 0.00 0.00 175.17 175.40 3hn8 s TYR 521 N 2.59 2.46 0.00 -5.34 5.04 0.49 -1.87 117.35 120.71 3hn8 s TYR 521 Ca 0.47 1.58 0.00 0.00 -2.44 0.00 0.00 57.07 56.68 3hn8 s TYR 521 Cb -0.17 -3.14 0.00 0.00 0.35 0.00 0.00 41.96 39.00 3hn8 s TYR 521 CO 0.12 -1.92 0.00 -0.25 -1.34 0.00 0.00 175.55 172.17 3hn8 n ASP 522 N -3.20 0.00 0.00 4.32 10.43 -1.26 -4.49 116.55 122.35 3hn8 n ASP 522 Ca 0.10 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.46 3hn8 n ASP 522 Cb 0.52 0.11 0.00 0.00 1.84 0.00 0.00 41.12 43.60 3hn8 n ASP 522 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3hn8 n ILE 524 N -0.24 0.00 -1.87 0.00 -0.00 -1.26 -0.74 119.36 115.25 3hn8 n ILE 524 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 62.75 62.72 3hn8 n ILE 524 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 39.64 39.61 3hn8 n ILE 524 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 3hn8 n GLY 525 N 0.00 0.59 1.28 7.39 0.00 -1.26 -4.99 105.19 108.21 3hn8 n GLY 525 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 3hn8 n GLY 525 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3hn8 n HIS 526 N 0.00 1.42 -1.78 1.61 8.25 0.09 -5.03 115.22 119.77 3hn8 n HIS 526 Ca -0.11 -1.28 -0.41 0.00 -0.26 0.00 0.00 57.72 55.65 3hn8 n HIS 526 Cb 0.52 -0.49 -0.01 0.00 1.12 0.00 0.00 29.99 31.12 3hn8 n HIS 526 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 3hn8 s ASN 527 N -1.97 6.36 -0.14 0.41 0.01 -1.26 -4.63 114.94 113.72 3hn8 s ASN 527 Ca 0.46 2.98 -0.01 0.00 -0.71 0.00 0.00 52.86 55.59 3hn8 s ASN 527 Cb 0.39 -2.65 -0.02 0.00 0.41 0.00 0.00 41.25 39.39 3hn8 s ASN 527 CO 0.06 -0.90 -0.10 -1.83 -1.51 0.00 0.00 177.10 172.82 3hn8 s GLU 528 N -1.01 3.46 0.32 -0.60 -1.05 -0.78 -4.97 118.70 114.07 3hn8 s GLU 528 Ca 0.60 -0.64 -0.29 0.00 -0.15 0.00 0.00 54.97 54.50 3hn8 s GLU 528 Cb -0.47 -2.71 -0.10 0.00 -0.44 0.00 0.00 34.13 30.40 3hn8 s GLU 528 CO 0.53 0.23 1.23 0.08 0.95 0.00 0.00 175.26 178.28 3hn8 s VAL 529 N 0.34 2.99 -0.19 1.83 1.01 -1.26 -1.14 120.40 123.97 3hn8 s VAL 529 Ca -0.09 0.99 -0.17 0.00 0.00 0.00 0.00 61.98 62.72 3hn8 s VAL 529 Cb -0.15 -3.63 -0.13 0.00 0.00 0.00 0.00 36.38 32.47 3hn8 s VAL 529 CO 0.05 0.23 -0.00 -0.38 0.00 0.00 0.00 175.10 175.00 3hn8 n ILE 530 N 0.89 1.50 -3.79 2.22 5.41 -0.31 -4.80 119.36 120.47 3hn8 n ILE 530 Ca -0.00 0.02 -0.06 0.00 1.00 0.00 0.00 62.75 63.71 3hn8 n ILE 530 Cb 0.43 -2.15 -0.02 0.00 -0.71 0.00 0.00 39.64 37.20 3hn8 n ILE 530 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 3hn8 s GLY 531 N -4.75 -0.18 0.17 7.39 0.00 -1.03 -4.90 107.32 104.02 3hn8 s GLY 531 Ca -0.26 -0.06 0.00 0.00 0.00 0.00 0.00 44.72 44.41 3hn8 s GLY 531 CO 0.46 -0.03 0.04 0.14 0.00 0.00 0.00 173.10 173.71 3hn8 s VAL 532 N -3.62 0.40 -0.23 1.40 1.01 -0.68 -1.21 120.40 117.47 3hn8 s VAL 532 Ca 0.11 -1.96 -0.23 0.00 0.00 0.00 0.00 61.98 59.90 3hn8 s VAL 532 Cb -0.04 -2.17 0.06 0.00 0.00 0.00 0.00 36.38 34.24 3hn8 s VAL 532 CO 0.04 -0.39 0.66 0.00 0.00 0.00 0.00 175.10 175.41 3hn8 s ARG 534 N 0.23 3.52 -0.27 0.00 3.00 -1.26 -1.56 118.95 122.61 3hn8 s ARG 534 Ca -0.01 -0.32 -0.13 0.00 0.00 0.00 0.00 55.73 55.26 3hn8 s ARG 534 Cb -0.04 -2.76 0.09 0.00 0.00 0.00 0.00 34.95 32.23 3hn8 s ARG 534 CO 0.02 0.30 0.64 0.54 0.00 0.00 0.00 175.30 176.80 3hn8 s VAL 535 N -2.04 -0.28 0.00 3.52 0.11 -0.86 -4.63 120.40 116.22 3hn8 s VAL 535 Ca 0.39 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.46 3hn8 s VAL 535 Cb -0.10 -0.95 0.00 0.00 -1.53 0.00 0.00 36.38 33.79 3hn8 s VAL 535 CO 0.31 0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.70 3hn8 n GLY 536 N 4.65 1.11 3.58 6.54 0.00 -1.18 -0.98 105.19 118.91 3hn8 n GLY 536 Ca -0.18 -2.04 -0.29 0.00 0.00 0.00 0.00 46.02 43.51 3hn8 n GLY 536 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hn8 s PRO 537 N -1.06 -0.76 -1.75 1.61 0.02 -1.26 -3.29 135.00 128.50 3hn8 s PRO 537 Ca 0.00 0.30 0.00 0.00 0.02 0.00 0.00 61.00 61.32 3hn8 s PRO 537 Cb 0.00 -1.62 0.00 0.00 0.02 0.00 0.00 34.50 32.90 3hn8 s PRO 537 CO 0.00 -3.48 0.00 -1.91 -0.33 0.00 0.00 177.00 171.28 3hn8 n GLU 538 N -4.67 -1.72 -4.21 5.54 4.07 -1.26 -4.92 120.64 113.48 3hn8 n GLU 538 Ca 0.08 0.99 -0.34 0.00 -0.06 0.00 0.00 57.16 57.83 3hn8 n GLU 538 Cb 0.58 -5.63 -0.10 0.00 -0.06 0.00 0.00 31.44 26.22 3hn8 n GLU 538 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3hn8 s ALA 539 N -2.98 3.25 0.07 4.31 0.00 -1.21 -5.04 121.76 120.16 3hn8 s ALA 539 Ca 0.00 -0.78 -0.21 0.00 0.00 0.00 0.00 51.96 50.97 3hn8 s ALA 539 Cb 0.00 -1.71 -0.09 0.00 0.00 0.00 0.00 23.12 21.32 3hn8 s ALA 539 CO 0.00 0.28 1.34 0.00 0.00 0.00 0.00 175.76 177.38 3hn8 h ALA 540 N 6.38 -0.78 -2.31 0.00 0.00 -1.92 -3.41 119.26 117.21 3hn8 h ALA 540 Ca -0.38 -0.05 -0.55 0.00 0.00 0.00 0.00 54.91 53.93 3hn8 h ALA 540 Cb 1.18 0.79 -0.02 0.00 0.00 0.00 0.00 17.79 19.74 3hn8 h ALA 540 CO 0.65 -0.88 0.69 0.34 0.00 0.00 0.00 179.25 180.04 3hn8 s ASP 541 N -3.90 7.07 0.24 0.00 -1.08 -1.26 -4.93 116.67 112.81 3hn8 s ASP 541 Ca -0.10 1.80 -0.07 0.00 -0.52 0.00 0.00 52.55 53.65 3hn8 s ASP 541 Cb 0.04 -2.56 0.42 0.00 -1.46 0.00 0.00 42.92 39.36 3hn8 s ASP 541 CO 0.38 -0.57 1.64 -0.65 0.52 0.00 0.00 175.17 176.49 3hn8 h PRO 542 N 7.41 0.10 -0.63 4.34 0.11 -1.94 0.41 132.00 141.79 3hn8 h PRO 542 Ca -0.34 -0.01 0.15 0.00 0.11 0.00 0.00 66.00 65.91 3hn8 h PRO 542 Cb 1.16 -0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 3hn8 h PRO 542 CO 0.88 0.07 0.44 1.25 -0.21 0.00 0.00 178.00 180.42 3hn8 h HIS 543 N 0.10 0.25 -0.33 0.65 -0.00 -1.95 0.28 115.15 114.15 3hn8 h HIS 543 Ca 0.40 0.01 -0.05 0.00 -0.00 0.00 0.00 60.37 60.73 3hn8 h HIS 543 Cb 0.70 -0.08 -0.01 0.00 -0.00 0.00 0.00 27.41 28.02 3hn8 h HIS 543 CO -0.42 0.10 0.02 0.78 -0.00 0.00 0.00 177.93 178.40 3hn8 h GLY 544 N 0.22 0.62 1.06 5.26 0.00 -0.45 -2.95 103.07 106.82 3hn8 h GLY 544 Ca 0.30 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.19 3hn8 h GLY 544 CO -0.06 0.41 -0.80 0.07 0.00 0.00 0.00 176.54 176.16 3hn8 h ARG 545 N 0.39 0.00 0.00 4.80 0.11 -0.98 -3.12 114.38 115.57 3hn8 h ARG 545 Ca 0.10 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.08 3hn8 h ARG 545 Cb 0.42 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.49 3hn8 h ARG 545 CO 0.01 0.00 -0.45 1.05 0.10 0.00 0.00 179.97 180.69 3hn8 h GLU 546 N 0.00 0.00 -0.22 0.08 4.11 -0.52 0.82 114.58 118.85 3hn8 h GLU 546 Ca 0.00 0.00 -0.20 0.00 0.07 0.00 0.00 59.36 59.23 3hn8 h GLU 546 Cb 0.85 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.11 3hn8 h GLU 546 CO 0.00 0.45 -0.64 1.25 0.07 0.00 0.00 179.01 180.14 3hn8 h HIS 547 N 0.00 1.07 0.00 2.06 2.76 -1.55 -1.05 115.15 118.44 3hn8 h HIS 547 Ca -0.00 -0.43 -0.15 0.00 -2.20 0.00 0.00 60.37 57.59 3hn8 h HIS 547 Cb 0.81 -0.18 -0.02 0.00 1.55 0.00 0.00 27.41 29.56 3hn8 h HIS 547 CO 0.00 1.26 -0.72 2.35 -1.30 0.00 0.00 177.93 179.51 3hn8 h TRP 548 N 0.58 0.00 -0.60 5.26 7.01 -1.57 -2.41 115.95 124.21 3hn8 h TRP 548 Ca -0.02 0.00 -0.08 0.00 2.11 0.00 0.00 58.89 60.91 3hn8 h TRP 548 Cb 1.26 0.00 -0.02 0.00 -2.10 0.00 0.00 29.16 28.30 3hn8 h TRP 548 CO 0.08 0.72 0.08 0.00 -2.79 0.00 0.00 178.44 176.53 3hn8 h ALA 549 N 1.28 0.80 -0.01 2.65 0.00 -0.62 -2.66 119.26 120.70 3hn8 h ALA 549 Ca -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3hn8 h ALA 549 Cb 1.31 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3hn8 h ALA 549 CO 0.09 0.57 -0.16 -0.85 0.00 0.00 0.00 179.25 178.90 3hn8 n GLU 550 N -4.28 1.05 -0.01 0.00 0.28 -0.42 -3.57 120.64 113.69 3hn8 n GLU 550 Ca 0.03 -0.58 -0.13 0.00 -0.16 0.00 0.00 57.16 56.32 3hn8 n GLU 550 Cb 0.29 -1.49 -0.10 0.00 1.43 0.00 0.00 31.44 31.57 3hn8 n GLU 550 CO 0.00 0.00 0.00 1.98 -0.16 0.00 0.00 177.13 178.95 3hn8 h MET 551 N 1.41 -0.02 -7.34 3.44 4.05 -1.08 -3.33 114.93 112.07 3hn8 h MET 551 Ca 0.00 0.00 -0.48 0.00 -0.28 0.00 0.00 59.70 58.94 3hn8 h MET 551 Cb 0.48 0.00 0.14 0.00 -0.80 0.00 0.00 31.60 31.42 3hn8 h MET 551 CO 0.00 0.52 0.26 -0.51 0.23 0.00 0.00 176.91 177.41 3hn8 s LEU 552 N -9.11 2.32 0.00 3.39 2.01 -1.14 -3.37 118.68 112.79 3hn8 s LEU 552 Ca -0.16 1.50 0.00 0.00 0.01 0.00 0.00 54.13 55.48 3hn8 s LEU 552 Cb 0.01 -3.95 0.00 0.00 0.01 0.00 0.00 46.19 42.26 3hn8 s LEU 552 CO 0.66 -2.57 0.00 0.00 1.01 0.00 0.00 176.35 175.45 3hn8 n ALA 553 N -3.84 0.00 -3.19 4.21 0.00 -1.26 -4.77 120.51 111.66 3hn8 n ALA 553 Ca 0.07 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.32 3hn8 n ALA 553 Cb 0.55 -0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 3hn8 n ALA 553 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3hn8 n ASN 554 N 0.00 0.71 0.00 0.00 4.13 -1.22 -5.07 115.26 113.81 3hn8 n ASN 554 Ca 0.00 -2.94 0.00 0.00 1.68 0.00 0.00 54.58 53.32 3hn8 n ASN 554 Cb 0.00 -0.62 0.00 0.00 -1.54 0.00 0.00 39.78 37.62 3hn8 n ASN 554 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 3hn8 n PRO 555 N 0.53 0.00 -0.55 3.52 -0.02 -1.26 -1.45 135.00 135.77 3hn8 n PRO 555 Ca 0.24 0.30 -0.07 0.00 -2.02 0.00 0.00 63.50 61.95 3hn8 n PRO 555 Cb 0.63 -0.64 0.12 0.00 -0.02 0.00 0.00 33.50 33.59 3hn8 n PRO 555 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hn8 n ARG 556 N -0.74 2.03 -4.24 -0.52 1.74 -1.26 -3.14 116.66 110.53 3hn8 n ARG 556 Ca 0.00 -1.50 -0.34 0.00 -0.77 0.00 0.00 57.85 55.24 3hn8 n ARG 556 Cb 0.00 -1.67 -0.14 0.00 -1.02 0.00 0.00 32.46 29.63 3hn8 n ARG 556 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3hn8 s LYS 557 N -1.70 3.45 0.10 5.56 2.20 -0.53 -5.00 119.74 123.82 3hn8 s LYS 557 Ca 0.28 -0.61 -0.31 0.00 -0.36 0.00 0.00 55.97 54.96 3hn8 s LYS 557 Cb 0.23 -2.90 -0.07 0.00 -1.51 0.00 0.00 37.83 33.58 3hn8 s LYS 557 CO 0.06 0.01 1.31 -1.25 -0.36 0.00 0.00 175.35 175.12 3hn8 s PRO 558 N 0.94 4.37 -0.26 4.03 0.04 -1.26 -4.54 135.00 138.32 3hn8 s PRO 558 Ca -0.01 1.96 -0.06 0.00 0.04 0.00 0.00 61.00 62.93 3hn8 s PRO 558 Cb -0.15 -3.28 -0.01 0.00 0.04 0.00 0.00 34.50 31.10 3hn8 s PRO 558 CO 0.01 -0.36 0.04 0.14 0.04 0.00 0.00 177.00 176.87 3hn8 s VAL 559 N 1.02 3.94 0.22 -0.36 -7.23 -0.74 -4.81 120.40 112.45 3hn8 s VAL 559 Ca 0.62 -0.43 -0.19 0.00 -1.81 0.00 0.00 61.98 60.16 3hn8 s VAL 559 Cb -0.34 -2.90 -0.08 0.00 0.56 0.00 0.00 36.38 33.62 3hn8 s VAL 559 CO 0.30 0.27 0.72 -0.70 -0.31 0.00 0.00 175.10 175.38 3hn8 s GLU 560 N 1.54 4.24 -0.20 4.82 2.12 -1.26 -2.24 118.70 127.72 3hn8 s GLU 560 Ca 0.05 0.85 -0.27 0.00 0.36 0.00 0.00 54.97 55.96 3hn8 s GLU 560 Cb -0.16 -2.88 0.09 0.00 0.26 0.00 0.00 34.13 31.44 3hn8 s GLU 560 CO 0.01 0.40 0.84 -1.01 -0.54 0.00 0.00 175.26 174.96 3hn8 s HIS 561 N -1.52 -0.60 0.24 5.30 3.76 -1.08 -4.99 115.29 116.40 3hn8 s HIS 561 Ca 0.43 1.30 -0.13 0.00 -0.15 0.00 0.00 55.06 56.51 3hn8 s HIS 561 Cb -0.17 0.36 -0.08 0.00 1.11 0.00 0.00 32.58 33.81 3hn8 s HIS 561 CO 0.21 -0.39 0.62 -1.58 -0.85 0.00 0.00 174.74 172.75 3hn8 s TRP 562 N -0.33 3.46 0.03 1.40 0.52 -1.26 -2.98 118.94 119.78 3hn8 s TRP 562 Ca -0.02 1.05 0.02 0.00 0.02 0.00 0.00 56.10 57.17 3hn8 s TRP 562 Cb -0.03 -2.39 -0.02 0.00 -1.15 0.00 0.00 33.47 29.88 3hn8 s TRP 562 CO 0.02 0.25 -0.07 -1.01 0.02 0.00 0.00 176.95 176.15 3hn8 s HIS 563 N -1.78 0.64 -0.13 -1.98 3.76 -0.78 -4.99 115.29 110.03 3hn8 s HIS 563 Ca 0.47 -0.38 -0.27 0.00 -0.15 0.00 0.00 55.06 54.73 3hn8 s HIS 563 Cb -0.12 -0.39 -0.02 0.00 1.11 0.00 0.00 32.58 33.17 3hn8 s HIS 563 CO 0.20 -0.06 0.89 -1.14 -0.85 0.00 0.00 174.74 173.78 3hn8 s GLN 564 N -1.17 4.37 0.17 1.40 2.00 -1.26 -1.58 119.66 123.59 3hn8 s GLN 564 Ca -0.06 1.17 -0.30 0.00 -2.00 0.00 0.00 55.36 54.16 3hn8 s GLN 564 Cb -0.08 -3.55 -0.08 0.00 0.80 0.00 0.00 33.01 30.11 3hn8 s GLN 564 CO 0.00 -0.28 1.23 -0.51 -0.50 0.00 0.00 175.29 175.23 3hn8 s LEU 565 N 1.94 4.43 0.14 3.68 1.43 -0.17 -4.68 118.68 125.45 3hn8 s LEU 565 Ca 0.43 2.25 0.06 0.00 -1.03 0.00 0.00 54.13 55.84 3hn8 s LEU 565 Cb -0.17 -3.60 -0.04 0.00 0.03 0.00 0.00 46.19 42.40 3hn8 s LEU 565 CO 0.16 -0.43 -0.14 -0.69 0.23 0.00 0.00 176.35 175.48 3hn8 s VAL 566 N 0.16 1.44 0.28 -1.59 1.01 0.10 -4.53 120.40 117.27 3hn8 s VAL 566 Ca 0.55 -1.85 -0.30 0.00 0.00 0.00 0.00 61.98 60.38 3hn8 s VAL 566 Cb -0.33 -1.68 -0.13 0.00 0.00 0.00 0.00 36.38 34.24 3hn8 s VAL 566 CO 0.36 -0.46 1.34 -0.62 0.00 0.00 0.00 175.10 175.71 3hn8 n GLU 567 N 0.30 2.01 -0.15 2.72 -0.58 -1.26 -1.69 120.64 121.99 3hn8 n GLU 567 Ca -0.14 0.71 0.14 0.00 -0.42 0.00 0.00 57.16 57.46 3hn8 n GLU 567 Cb 0.58 -2.32 0.50 0.00 -0.57 0.00 0.00 31.44 29.63 3hn8 n GLU 567 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 3hn8 h GLU 568 N 3.48 0.41 -1.95 3.49 4.57 -1.94 -3.05 114.58 119.59 3hn8 h GLU 568 Ca -0.45 -0.02 -0.40 0.00 -1.18 0.00 0.00 59.36 57.30 3hn8 h GLU 568 Cb 1.28 -0.09 -0.15 0.00 -0.16 0.00 0.00 28.75 29.63 3hn8 h GLU 568 CO 0.70 0.27 0.22 1.63 -1.18 0.00 0.00 179.01 180.65 3hn8 n LYS 569 N -4.48 2.22 0.00 1.92 4.76 -1.26 -3.40 118.16 117.92 3hn8 n LYS 569 Ca 0.13 -1.93 0.00 0.00 -2.87 0.00 0.00 58.31 53.65 3hn8 n LYS 569 Cb 0.49 -2.03 0.00 0.00 -1.84 0.00 0.00 35.03 31.65 3hn8 n LYS 569 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 3hn8 n THR 570 N 1.17 0.12 -4.34 -0.18 -2.24 -1.15 -5.07 114.28 102.59 3hn8 n THR 570 Ca 0.45 -0.15 -0.21 0.00 -2.27 0.00 0.00 64.05 61.86 3hn8 n THR 570 Cb 0.63 1.21 -0.08 0.00 -2.10 0.00 0.00 70.33 69.99 3hn8 n THR 570 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hn8 s LEU 571 N -0.12 1.83 -0.30 3.22 2.01 -1.22 -5.07 118.68 119.03 3hn8 s LEU 571 Ca 0.00 -1.77 -0.06 0.00 0.01 0.00 0.00 54.13 52.31 3hn8 s LEU 571 Cb 0.00 0.42 0.19 0.00 0.01 0.00 0.00 46.19 46.81 3hn8 s LEU 571 CO 0.00 -1.06 0.87 -0.94 1.01 0.00 0.00 176.35 176.24 3hn8 s SER 572 N -3.44 -0.86 0.00 2.29 1.04 -1.26 -5.06 113.70 106.41 3hn8 s SER 572 Ca 0.37 0.31 0.31 0.00 0.48 0.00 0.00 55.95 57.42 3hn8 s SER 572 Cb 0.02 1.63 1.79 0.00 0.10 0.00 0.00 66.02 69.56 3hn8 s SER 572 CO 0.25 -0.16 2.16 -1.20 0.98 0.00 0.00 173.24 175.28