#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hp6 s LYS 298 N 0.00 3.37 -0.22 0.00 2.47 -1.26 -5.08 119.74 119.03 3hp6 s LYS 298 Ca 0.00 -0.63 -0.01 0.00 -1.56 0.00 0.00 55.97 53.77 3hp6 s LYS 298 Cb 0.00 -3.04 0.06 0.00 -1.46 0.00 0.00 37.83 33.39 3hp6 s LYS 298 CO 0.00 -0.21 0.00 1.41 0.16 0.00 0.00 175.35 176.71 3hp6 s MET 299 N 1.48 1.06 0.31 4.03 -2.45 -1.26 -5.13 119.30 117.35 3hp6 s MET 299 Ca 0.06 -0.70 -0.28 0.00 -1.25 0.00 0.00 55.69 53.52 3hp6 s MET 299 Cb -0.14 -2.31 -0.09 0.00 1.25 0.00 0.00 34.83 33.53 3hp6 s MET 299 CO -0.03 -0.64 1.08 0.00 1.05 0.00 0.00 175.02 176.48 3hp6 s ALA 300 N 1.65 3.30 0.16 4.11 0.00 -1.26 -5.06 121.76 124.66 3hp6 s ALA 300 Ca -0.02 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 52.60 3hp6 s ALA 300 Cb -0.18 -3.30 0.03 0.00 0.00 0.00 0.00 23.12 19.67 3hp6 s ALA 300 CO -0.08 -0.16 0.45 -0.59 0.00 0.00 0.00 175.76 175.38 3hp6 s PHE 301 N -1.31 -0.15 -0.32 0.00 -0.12 -1.26 -4.68 117.98 110.14 3hp6 s PHE 301 Ca 0.48 -0.18 -0.17 0.00 -0.05 0.00 0.00 56.93 57.01 3hp6 s PHE 301 Cb -0.29 0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.39 3hp6 s PHE 301 CO 0.37 -0.80 0.48 0.99 -0.05 0.00 0.00 175.22 176.21 3hp6 s THR 302 N -3.84 5.07 -1.06 -4.49 2.01 0.11 -4.99 115.64 108.45 3hp6 s THR 302 Ca 0.06 0.48 -0.20 0.00 0.31 0.00 0.00 61.69 62.35 3hp6 s THR 302 Cb 0.01 -3.88 0.10 0.00 0.01 0.00 0.00 72.50 68.74 3hp6 s THR 302 CO -0.08 -0.07 1.39 -0.22 -0.69 0.00 0.00 174.62 174.95 3hp6 s LEU 303 N 2.29 4.27 0.38 4.42 0.20 -1.26 -0.65 118.68 128.33 3hp6 s LEU 303 Ca 0.18 -2.01 -0.24 0.00 0.69 0.00 0.00 54.13 52.76 3hp6 s LEU 303 Cb -0.16 -2.49 -0.10 0.00 -0.43 0.00 0.00 46.19 43.01 3hp6 s LEU 303 CO 0.12 -1.21 0.96 0.00 -0.29 0.00 0.00 176.35 175.93 3hp6 s ALA 304 N 3.66 3.11 -0.24 5.97 0.00 -0.46 -4.97 121.76 128.83 3hp6 s ALA 304 Ca 0.42 0.50 0.22 0.00 0.00 0.00 0.00 51.96 53.10 3hp6 s ALA 304 Cb -0.01 -3.18 -0.28 0.00 0.00 0.00 0.00 23.12 19.64 3hp6 s ALA 304 CO -0.06 0.09 0.62 -0.25 0.00 0.00 0.00 175.76 176.16 3hp6 n ASP 305 N -0.05 0.26 -3.74 0.00 8.00 -1.26 -4.51 116.55 115.25 3hp6 n ASP 305 Ca 0.05 -0.17 -0.13 0.00 0.71 0.00 0.00 54.79 55.25 3hp6 n ASP 305 Cb 0.52 1.67 -0.08 0.00 -0.02 0.00 0.00 41.12 43.21 3hp6 n ASP 305 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hp6 s ARG 306 N -3.40 0.77 0.17 -1.24 1.70 -1.26 -5.02 118.95 110.67 3hp6 s ARG 306 Ca -0.04 -0.32 -0.30 0.00 -0.47 0.00 0.00 55.73 54.60 3hp6 s ARG 306 Cb 0.14 0.34 -0.08 0.00 -0.57 0.00 0.00 34.95 34.79 3hp6 s ARG 306 CO 0.89 -0.24 1.15 0.08 -1.08 0.00 0.00 175.30 176.10 3hp6 s VAL 307 N -1.95 3.75 0.25 4.99 1.01 -1.26 -5.05 120.40 122.13 3hp6 s VAL 307 Ca -0.09 1.48 0.11 0.00 0.00 0.00 0.00 61.98 63.47 3hp6 s VAL 307 Cb -0.03 -3.94 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 3hp6 s VAL 307 CO 0.01 0.24 -0.19 0.42 0.00 0.00 0.00 175.10 175.57 3hp6 s THR 308 N -0.08 2.26 0.30 3.92 -4.23 -1.26 -5.06 115.64 111.49 3hp6 s THR 308 Ca 0.51 -2.30 0.02 0.00 -1.18 0.00 0.00 61.69 58.75 3hp6 s THR 308 Cb -0.31 -2.20 0.29 0.00 1.34 0.00 0.00 72.50 71.63 3hp6 s THR 308 CO 0.35 -0.41 1.87 -0.08 -0.54 0.00 0.00 174.62 175.81 3hp6 h GLU 309 N 2.49 0.94 0.00 3.99 4.57 -1.98 -1.90 114.58 122.69 3hp6 h GLU 309 Ca -0.40 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 3hp6 h GLU 309 Cb 1.24 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 29.62 3hp6 h GLU 309 CO 0.59 0.62 0.00 1.05 -1.18 0.00 0.00 179.01 180.09 3hp6 h GLU 310 N 0.97 0.00 0.00 1.92 4.11 -2.01 -0.51 114.58 119.06 3hp6 h GLU 310 Ca 0.45 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.88 3hp6 h GLU 310 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3hp6 h GLU 310 CO -0.21 0.00 0.00 -1.33 0.07 0.00 0.00 179.01 177.54 3hp6 n MET 311 N -2.91 0.15 -1.75 1.06 2.81 -0.71 -3.79 117.12 111.98 3hp6 n MET 311 Ca -0.01 0.30 -0.29 0.00 -1.81 0.00 0.00 57.70 55.90 3hp6 n MET 311 Cb 0.20 -1.75 0.04 0.00 -0.71 0.00 0.00 33.22 31.00 3hp6 n MET 311 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3hp6 n LEU 312 N -2.02 6.13 -4.73 4.03 4.77 -0.20 -5.03 117.00 119.95 3hp6 n LEU 312 Ca 0.04 -4.58 -0.31 0.00 -0.03 0.00 0.00 56.01 51.13 3hp6 n LEU 312 Cb 0.27 -0.62 0.12 0.00 -2.33 0.00 0.00 43.42 40.86 3hp6 n LEU 312 CO 0.21 1.84 0.68 0.00 -1.33 0.00 0.00 177.39 178.80 3hp6 s ALA 313 N -3.70 1.87 -2.10 -1.18 0.00 -1.25 -4.95 121.76 110.46 3hp6 s ALA 313 Ca 0.57 0.26 0.24 0.00 0.00 0.00 0.00 51.96 53.02 3hp6 s ALA 313 Cb 0.45 -3.29 1.30 0.00 0.00 0.00 0.00 23.12 21.58 3hp6 s ALA 313 CO -0.00 -2.15 1.85 -0.40 0.00 0.00 0.00 175.76 175.06 3hp6 n ASP 314 N -3.78 0.41 -3.71 0.00 3.85 -1.26 -4.62 116.55 107.45 3hp6 n ASP 314 Ca 0.09 -1.34 -0.17 0.00 -0.71 0.00 0.00 54.79 52.66 3hp6 n ASP 314 Cb 0.53 -0.02 -0.17 0.00 -1.35 0.00 0.00 41.12 40.12 3hp6 n ASP 314 CO 0.00 0.00 0.00 -0.75 -1.01 0.00 0.00 177.20 175.44 3hp6 s LYS 315 N -1.97 -0.03 0.06 0.11 2.47 -1.26 -0.64 119.74 118.48 3hp6 s LYS 315 Ca 0.36 0.35 -0.17 0.00 -1.56 0.00 0.00 55.97 54.95 3hp6 s LYS 315 Cb 0.17 -0.36 0.03 0.00 -1.46 0.00 0.00 37.83 36.21 3hp6 s LYS 315 CO 0.28 -0.26 0.39 0.00 0.16 0.00 0.00 175.35 175.92 3hp6 s ALA 316 N 1.77 -0.93 -0.10 3.13 0.00 -0.39 -4.49 121.76 120.75 3hp6 s ALA 316 Ca -0.01 0.19 -0.18 0.00 0.00 0.00 0.00 51.96 51.96 3hp6 s ALA 316 Cb -0.12 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.36 3hp6 s ALA 316 CO -0.04 -0.48 0.49 0.00 0.00 0.00 0.00 175.76 175.73 3hp6 s ALA 317 N -2.73 3.48 -0.06 0.00 0.00 0.43 -0.18 121.76 122.71 3hp6 s ALA 317 Ca -0.04 -0.17 0.03 0.00 0.00 0.00 0.00 51.96 51.79 3hp6 s ALA 317 Cb -0.00 -2.65 0.01 0.00 0.00 0.00 0.00 23.12 20.48 3hp6 s ALA 317 CO -0.04 0.04 -0.15 -1.17 0.00 0.00 0.00 175.76 174.44 3hp6 s LEU 318 N 0.47 1.79 -0.17 0.00 2.96 -0.20 -1.05 118.68 122.47 3hp6 s LEU 318 Ca 0.27 -0.34 0.01 0.00 -0.22 0.00 0.00 54.13 53.84 3hp6 s LEU 318 Cb -0.15 -0.93 0.02 0.00 0.50 0.00 0.00 46.19 45.63 3hp6 s LEU 318 CO 0.11 0.09 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.34 3hp6 s VAL 319 N 0.41 2.01 -0.43 1.68 1.01 -0.35 -4.46 120.40 120.28 3hp6 s VAL 319 Ca -0.11 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 60.98 3hp6 s VAL 319 Cb -0.14 -1.82 0.12 0.00 0.00 0.00 0.00 36.38 34.53 3hp6 s VAL 319 CO 0.04 0.53 0.17 -0.69 0.00 0.00 0.00 175.10 175.15 3hp6 s VAL 320 N 1.28 2.62 -0.20 2.92 1.01 -1.26 -1.42 120.40 125.35 3hp6 s VAL 320 Ca 0.04 -2.66 -0.26 0.00 0.00 0.00 0.00 61.98 59.11 3hp6 s VAL 320 Cb -0.13 -2.86 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 3hp6 s VAL 320 CO -0.12 -0.69 0.87 -0.70 0.00 0.00 0.00 175.10 174.46 3hp6 s GLU 321 N 0.49 4.25 -0.22 2.72 2.56 -0.84 -4.64 118.70 123.02 3hp6 s GLU 321 Ca 0.13 1.06 0.02 0.00 0.00 0.00 0.00 54.97 56.18 3hp6 s GLU 321 Cb -0.22 -3.61 0.04 0.00 2.00 0.00 0.00 34.13 32.35 3hp6 s GLU 321 CO -0.05 -0.45 -0.14 0.08 -0.56 0.00 0.00 175.26 174.14 3hp6 s VAL 322 N 2.57 2.05 0.01 3.70 1.01 -1.26 -1.52 120.40 126.97 3hp6 s VAL 322 Ca 0.38 -1.29 0.10 0.00 0.00 0.00 0.00 61.98 61.17 3hp6 s VAL 322 Cb -0.16 -2.04 -0.23 0.00 0.00 0.00 0.00 36.38 33.95 3hp6 s VAL 322 CO 0.10 0.21 0.86 0.58 0.00 0.00 0.00 175.10 176.84 3hp6 h VAL 323 N 6.41 1.13 -2.54 2.92 2.07 -1.96 -3.45 116.25 120.83 3hp6 h VAL 323 Ca -0.30 -2.93 -0.53 0.00 0.82 0.00 0.00 66.70 63.76 3hp6 h VAL 323 Cb 1.08 2.57 0.05 0.00 -1.52 0.00 0.00 31.29 33.47 3hp6 h VAL 323 CO 0.53 0.66 1.08 -0.62 0.02 0.00 0.00 177.57 179.23 3hp6 n GLU 324 N -3.16 2.78 -0.14 1.57 1.02 -1.26 -4.89 120.64 116.56 3hp6 n GLU 324 Ca -0.12 1.01 -0.03 0.00 -0.02 0.00 0.00 57.16 58.00 3hp6 n GLU 324 Cb 1.02 -2.89 0.05 0.00 -0.02 0.00 0.00 31.44 29.60 3hp6 n GLU 324 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3hp6 h GLU 325 N 7.94 0.13 -5.74 3.49 5.08 -2.03 -3.32 114.58 120.13 3hp6 h GLU 325 Ca -0.45 -0.01 -0.61 0.00 -1.00 0.00 0.00 59.36 57.29 3hp6 h GLU 325 Cb 1.22 -0.03 -0.12 0.00 0.50 0.00 0.00 28.75 30.32 3hp6 h GLU 325 CO 0.95 0.08 0.34 1.21 -1.00 0.00 0.00 179.01 180.60 3hp6 s ASN 326 N -5.26 6.53 0.00 1.42 3.84 -1.26 -4.93 114.94 115.28 3hp6 s ASN 326 Ca -0.13 0.32 0.27 0.00 0.21 0.00 0.00 52.86 53.53 3hp6 s ASN 326 Cb 0.15 -2.39 1.00 0.00 -0.55 0.00 0.00 41.25 39.47 3hp6 s ASN 326 CO 0.72 -0.71 1.72 0.00 -2.79 0.00 0.00 177.10 176.03 3hp6 n TYR 327 N 6.37 0.01 -2.06 0.43 0.18 -1.25 -4.69 117.16 116.15 3hp6 n TYR 327 Ca 0.02 -0.01 -0.42 0.00 1.88 0.00 0.00 57.90 59.37 3hp6 n TYR 327 Cb 0.48 0.00 -0.03 0.00 -0.38 0.00 0.00 39.34 39.42 3hp6 n TYR 327 CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 3hp6 s HIS 328 N -1.99 2.32 -1.36 -3.48 3.76 -1.26 -2.57 115.29 110.71 3hp6 s HIS 328 Ca 0.37 0.40 -0.08 0.00 -0.15 0.00 0.00 55.06 55.60 3hp6 s HIS 328 Cb 0.21 -3.85 0.06 0.00 1.11 0.00 0.00 32.58 30.11 3hp6 s HIS 328 CO 0.33 -3.42 0.54 -3.47 -0.85 0.00 0.00 174.74 167.87 3hp6 n ASP 329 N 6.37 -4.39 -4.93 1.40 2.03 -1.26 -4.96 116.55 110.81 3hp6 n ASP 329 Ca 0.16 -0.38 -0.26 0.00 0.52 0.00 0.00 54.79 54.83 3hp6 n ASP 329 Cb 0.43 -3.60 -0.03 0.00 -0.72 0.00 0.00 41.12 37.20 3hp6 n ASP 329 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hp6 s ALA 330 N -3.01 3.81 0.44 -1.67 0.00 -1.06 -5.06 121.76 115.20 3hp6 s ALA 330 Ca 0.38 -0.87 -0.24 0.00 0.00 0.00 0.00 51.96 51.24 3hp6 s ALA 330 Cb -0.20 -2.00 -0.08 0.00 0.00 0.00 0.00 23.12 20.84 3hp6 s ALA 330 CO 0.47 0.33 1.23 -2.14 0.00 0.00 0.00 175.76 175.65 3hp6 s PRO 331 N -3.56 3.81 -0.22 0.00 0.02 -1.26 -4.97 135.00 128.81 3hp6 s PRO 331 Ca 0.39 1.95 -0.18 0.00 0.02 0.00 0.00 61.00 63.17 3hp6 s PRO 331 Cb -0.11 -2.55 -0.03 0.00 0.02 0.00 0.00 34.50 31.84 3hp6 s PRO 331 CO 0.30 -0.56 0.53 0.42 -0.33 0.00 0.00 177.00 177.36 3hp6 s ILE 332 N -1.41 5.08 -0.77 2.83 1.01 -1.26 -4.41 121.20 122.27 3hp6 s ILE 332 Ca 0.61 0.94 0.22 0.00 0.00 0.00 0.00 60.65 62.43 3hp6 s ILE 332 Cb -0.33 -3.84 -0.17 0.00 0.01 0.00 0.00 42.46 38.13 3hp6 s ILE 332 CO 0.41 0.13 0.98 1.33 0.00 0.00 0.00 174.94 177.79 3hp6 n VAL 333 N 4.80 0.06 0.00 2.92 0.24 -0.57 -4.79 118.33 120.98 3hp6 n VAL 333 Ca -0.04 -0.13 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 3hp6 n VAL 333 Cb 0.50 0.52 0.00 0.00 -1.47 0.00 0.00 33.84 33.39 3hp6 n VAL 333 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hp6 n GLY 334 N 1.43 1.35 3.04 7.63 0.00 -1.26 -4.76 105.19 112.61 3hp6 n GLY 334 Ca 0.03 -0.57 -0.22 0.00 0.00 0.00 0.00 46.02 45.25 3hp6 n GLY 334 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hp6 s ILE 335 N -2.00 1.00 0.04 -0.61 1.01 -0.73 -2.00 121.20 117.91 3hp6 s ILE 335 Ca 0.00 -0.47 0.08 0.00 0.00 0.00 0.00 60.65 60.26 3hp6 s ILE 335 Cb 0.00 -0.88 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 3hp6 s ILE 335 CO 0.00 0.30 -0.22 0.00 0.00 0.00 0.00 174.94 175.03 3hp6 s ALA 336 N 0.23 1.85 -0.05 9.38 0.00 -0.51 -0.48 121.76 132.18 3hp6 s ALA 336 Ca -0.05 -1.09 0.02 0.00 0.00 0.00 0.00 51.96 50.84 3hp6 s ALA 336 Cb -0.10 -0.38 0.02 0.00 0.00 0.00 0.00 23.12 22.66 3hp6 s ALA 336 CO 0.01 0.42 -0.08 0.08 0.00 0.00 0.00 175.76 176.19 3hp6 s VAL 337 N -0.78 0.83 -0.12 0.00 1.01 0.05 -1.21 120.40 120.19 3hp6 s VAL 337 Ca 0.08 -0.30 0.01 0.00 0.00 0.00 0.00 61.98 61.78 3hp6 s VAL 337 Cb -0.09 -0.79 0.02 0.00 0.00 0.00 0.00 36.38 35.51 3hp6 s VAL 337 CO 0.02 0.29 -0.14 -0.69 0.00 0.00 0.00 175.10 174.57 3hp6 s VAL 338 N 0.80 1.45 0.00 2.92 1.01 -0.22 -0.19 120.40 126.17 3hp6 s VAL 338 Ca -0.13 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3hp6 s VAL 338 Cb -0.15 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 34.88 3hp6 s VAL 338 CO 0.02 0.43 0.00 -0.46 0.00 0.00 0.00 175.10 175.09 3hp6 n ASN 339 N 4.39 0.00 0.30 3.32 0.23 -0.59 -0.43 115.26 122.48 3hp6 n ASN 339 Ca -0.18 -0.29 0.15 0.00 -0.53 0.00 0.00 54.58 53.73 3hp6 n ASN 339 Cb 0.51 0.00 0.92 0.00 -2.08 0.00 0.00 39.78 39.13 3hp6 n ASN 339 CO 0.00 0.00 0.00 1.05 -0.93 0.00 0.00 177.26 177.38 3hp6 h GLU 340 N 0.00 0.00 0.00 -3.83 4.11 -1.93 -3.03 114.58 109.90 3hp6 h GLU 340 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3hp6 h GLU 340 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hp6 h GLU 340 CO 0.00 0.01 -1.07 0.72 0.07 0.00 0.00 179.01 178.74 3hp6 n HIS 341 N -3.79 0.20 -1.57 2.06 8.25 -1.26 -5.06 115.22 114.05 3hp6 n HIS 341 Ca -0.03 0.06 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 3hp6 n HIS 341 Cb 0.09 -0.37 0.00 0.00 1.12 0.00 0.00 29.99 30.83 3hp6 n HIS 341 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hp6 n GLY 342 N 1.38 0.26 3.06 -1.41 0.00 -1.15 -5.10 105.19 102.24 3hp6 n GLY 342 Ca 0.02 -1.61 -0.26 0.00 0.00 0.00 0.00 46.02 44.17 3hp6 n GLY 342 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hp6 s ARG 343 N -2.00 1.99 -0.03 1.61 0.52 -1.26 -1.55 118.95 118.24 3hp6 s ARG 343 Ca 0.00 -0.51 0.01 0.00 -0.52 0.00 0.00 55.73 54.71 3hp6 s ARG 343 Cb 0.00 -1.60 0.01 0.00 0.52 0.00 0.00 34.95 33.88 3hp6 s ARG 343 CO 0.00 0.06 -0.05 -0.06 0.02 0.00 0.00 175.30 175.27 3hp6 s PHE 344 N 0.61 0.67 -0.14 -0.53 0.40 0.74 0.08 117.98 119.81 3hp6 s PHE 344 Ca -0.15 -0.16 -0.03 0.00 -0.60 0.00 0.00 56.93 55.99 3hp6 s PHE 344 Cb -0.16 -0.55 -0.03 0.00 0.51 0.00 0.00 43.02 42.79 3hp6 s PHE 344 CO 0.05 -0.12 -0.03 0.12 0.70 0.00 0.00 175.22 175.93 3hp6 s PHE 345 N 0.55 3.05 -0.03 0.36 5.36 0.18 -0.77 117.98 126.68 3hp6 s PHE 345 Ca -0.07 -0.15 0.06 0.00 -0.96 0.00 0.00 56.93 55.80 3hp6 s PHE 345 Cb -0.11 -1.91 -0.01 0.00 -0.34 0.00 0.00 43.02 40.65 3hp6 s PHE 345 CO 0.00 0.10 -0.21 -0.51 -1.46 0.00 0.00 175.22 173.15 3hp6 s LEU 346 N 0.02 2.00 0.22 6.12 1.43 0.36 -1.35 118.68 127.48 3hp6 s LEU 346 Ca 0.01 -0.40 -0.30 0.00 -1.03 0.00 0.00 54.13 52.41 3hp6 s LEU 346 Cb -0.13 -1.12 -0.09 0.00 0.03 0.00 0.00 46.19 44.89 3hp6 s LEU 346 CO 0.02 0.22 1.16 -0.13 0.23 0.00 0.00 176.35 177.86 3hp6 s ARG 347 N -0.24 4.54 0.22 1.70 0.52 -1.26 -1.77 118.95 122.66 3hp6 s ARG 347 Ca 0.01 1.85 -0.07 0.00 -0.52 0.00 0.00 55.73 57.01 3hp6 s ARG 347 Cb -0.11 -3.22 0.19 0.00 0.52 0.00 0.00 34.95 32.33 3hp6 s ARG 347 CO 0.01 0.02 1.78 -1.35 0.02 0.00 0.00 175.30 175.79 3hp6 h PRO 348 N 4.67 1.16 -0.72 3.54 0.11 -1.87 -0.99 132.00 137.91 3hp6 h PRO 348 Ca -0.45 -0.21 0.16 0.00 0.11 0.00 0.00 66.00 65.60 3hp6 h PRO 348 Cb 1.21 -0.19 -0.12 0.00 0.11 0.00 0.00 31.00 32.01 3hp6 h PRO 348 CO 0.71 0.95 0.02 0.93 -0.21 0.00 0.00 178.00 180.40 3hp6 h GLU 349 N 1.13 0.11 0.39 1.05 3.07 -1.92 -1.71 114.58 116.70 3hp6 h GLU 349 Ca 0.26 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.36 59.09 3hp6 h GLU 349 Cb 0.23 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.12 3hp6 h GLU 349 CO -0.02 0.08 -0.19 1.15 -1.40 0.00 0.00 179.01 178.63 3hp6 h THR 350 N 0.12 0.00 -0.94 1.13 2.02 -1.77 -3.16 112.91 110.31 3hp6 h THR 350 Ca 0.39 -0.56 0.00 0.00 0.77 0.00 0.00 66.41 67.01 3hp6 h THR 350 Cb 0.67 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 3hp6 h THR 350 CO -0.62 0.00 0.60 0.00 0.37 0.00 0.00 175.52 175.87 3hp6 h ALA 351 N -1.20 1.19 -0.00 6.16 0.00 -1.14 -2.29 119.26 121.98 3hp6 h ALA 351 Ca -0.05 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.77 3hp6 h ALA 351 Cb 0.41 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3hp6 h ALA 351 CO 0.09 0.62 -0.16 1.28 0.00 0.00 0.00 179.25 181.08 3hp6 n LEU 352 N -4.40 0.17 -0.08 0.00 4.77 -0.65 -2.60 117.00 114.20 3hp6 n LEU 352 Ca 0.11 0.33 0.11 0.00 -0.03 0.00 0.00 56.01 56.53 3hp6 n LEU 352 Cb 0.03 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 40.71 3hp6 n LEU 352 CO 0.37 0.04 0.14 0.00 -1.33 0.00 0.00 177.39 176.62 3hp6 n ALA 353 N -1.49 4.26 -2.61 -1.18 0.00 -0.99 -4.90 120.51 113.60 3hp6 n ALA 353 Ca 0.07 -0.54 -0.42 0.00 0.00 0.00 0.00 53.44 52.55 3hp6 n ALA 353 Cb 0.34 -0.87 -0.05 0.00 0.00 0.00 0.00 19.45 18.87 3hp6 n ALA 353 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3hp6 s ASP 354 N -2.91 6.65 0.43 0.00 2.15 -0.90 -4.95 116.67 117.14 3hp6 s ASP 354 Ca 0.11 0.62 0.12 0.00 0.43 0.00 0.00 52.55 53.83 3hp6 s ASP 354 Cb 0.17 -2.41 0.98 0.00 -0.30 0.00 0.00 42.92 41.36 3hp6 s ASP 354 CO 0.78 -0.66 2.00 -0.65 -0.17 0.00 0.00 175.17 176.47 3hp6 h PRO 355 N 8.20 0.43 -0.33 4.34 0.11 -1.91 -2.09 132.00 140.76 3hp6 h PRO 355 Ca -0.24 -0.03 -0.15 0.00 0.11 0.00 0.00 66.00 65.69 3hp6 h PRO 355 Cb 1.09 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 3hp6 h PRO 355 CO 0.90 0.29 -0.38 1.96 -0.21 0.00 0.00 178.00 180.55 3hp6 h GLN 356 N 0.45 0.80 -0.20 1.05 7.50 -1.93 -1.82 115.11 120.96 3hp6 h GLN 356 Ca 0.24 -0.41 -0.13 0.00 0.50 0.00 0.00 58.65 58.85 3hp6 h GLN 356 Cb 0.37 0.01 0.00 0.00 0.05 0.00 0.00 27.48 27.91 3hp6 h GLN 356 CO -0.06 1.04 -0.39 0.35 -1.50 0.00 0.00 178.83 178.27 3hp6 h PHE 357 N 0.66 0.77 -0.80 2.96 3.57 -1.69 -1.65 116.94 120.76 3hp6 h PHE 357 Ca 0.06 -0.28 -0.04 0.00 3.53 0.00 0.00 57.97 61.24 3hp6 h PHE 357 Cb 0.94 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.50 3hp6 h PHE 357 CO 0.05 1.03 0.36 0.28 -2.23 0.00 0.00 178.31 177.80 3hp6 h VAL 358 N 0.30 1.26 -0.55 1.41 2.07 -1.40 0.14 116.25 119.47 3hp6 h VAL 358 Ca 0.01 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.75 3hp6 h VAL 358 Cb 0.98 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 3hp6 h VAL 358 CO 0.09 0.32 0.29 0.00 0.02 0.00 0.00 177.57 178.28 3hp6 h ALA 359 N 1.19 0.71 -0.36 1.67 0.00 -1.31 -1.40 119.26 119.75 3hp6 h ALA 359 Ca 0.27 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hp6 h ALA 359 Cb 0.16 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3hp6 h ALA 359 CO -0.03 0.24 0.19 2.35 0.00 0.00 0.00 179.25 182.00 3hp6 h TRP 360 N 0.74 0.50 -0.47 0.00 7.01 -0.70 -1.73 115.95 121.30 3hp6 h TRP 360 Ca 0.19 -0.02 0.08 0.00 2.11 0.00 0.00 58.89 61.26 3hp6 h TRP 360 Cb 0.08 -0.16 -0.07 0.00 -2.10 0.00 0.00 29.16 26.91 3hp6 h TRP 360 CO -0.01 0.41 0.05 -0.07 -2.79 0.00 0.00 178.44 176.03 3hp6 h LEU 361 N 0.45 -0.09 0.00 0.65 3.38 -0.49 -2.50 115.31 116.71 3hp6 h LEU 361 Ca 0.13 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3hp6 h LEU 361 Cb 0.08 0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3hp6 h LEU 361 CO -0.02 -0.02 0.00 0.61 0.09 0.00 0.00 178.44 179.11 3hp6 n GLY 362 N -1.29 -1.13 3.60 0.83 0.00 -0.55 -4.48 105.19 102.17 3hp6 n GLY 362 Ca 0.05 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.57 3hp6 n GLY 362 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hp6 s ASP 363 N -2.82 6.47 0.37 1.61 -1.08 -0.67 -4.89 116.67 115.66 3hp6 s ASP 363 Ca 0.14 0.41 0.28 0.00 -0.52 0.00 0.00 52.55 52.86 3hp6 s ASP 363 Cb 0.14 -2.32 1.13 0.00 -1.46 0.00 0.00 42.92 40.41 3hp6 s ASP 363 CO 0.36 -0.45 1.82 1.05 0.52 0.00 0.00 175.17 178.47 3hp6 h GLU 364 N 8.18 0.00 0.00 4.34 4.11 -1.87 -2.45 114.58 126.89 3hp6 h GLU 364 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.16 3hp6 h GLU 364 Cb 1.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.37 3hp6 h GLU 364 CO 0.79 0.00 -0.17 0.25 0.07 0.00 0.00 179.01 179.95 3hp6 n THR 365 N -2.57 0.43 -3.16 -1.06 -2.24 -1.26 -4.31 114.28 100.11 3hp6 n THR 365 Ca 0.02 -0.23 -0.43 0.00 -2.27 0.00 0.00 64.05 61.13 3hp6 n THR 365 Cb 0.26 -0.43 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 3hp6 n THR 365 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3hp6 s LYS 366 N -3.10 3.15 0.03 -0.78 -0.14 -0.92 -4.90 119.74 113.08 3hp6 s LYS 366 Ca 0.10 -0.76 -0.23 0.00 -1.36 0.00 0.00 55.97 53.71 3hp6 s LYS 366 Cb 0.14 -4.05 -0.05 0.00 -1.68 0.00 0.00 37.83 32.18 3hp6 s LYS 366 CO 0.62 -1.14 0.70 0.15 -0.76 0.00 0.00 175.35 174.92 3hp6 s LYS 367 N 2.63 4.43 -0.04 1.68 -0.14 0.19 -4.55 119.74 123.94 3hp6 s LYS 367 Ca 0.16 0.95 0.06 0.00 -1.36 0.00 0.00 55.97 55.78 3hp6 s LYS 367 Cb -0.18 -3.35 -0.01 0.00 -1.68 0.00 0.00 37.83 32.61 3hp6 s LYS 367 CO 0.14 0.32 -0.23 0.15 -0.76 0.00 0.00 175.35 174.96 3hp6 s LYS 368 N -0.12 2.17 -0.15 1.68 3.01 -0.05 -1.26 119.74 125.02 3hp6 s LYS 368 Ca 0.36 -0.83 -0.05 0.00 -1.01 0.00 0.00 55.97 54.44 3hp6 s LYS 368 Cb -0.20 -1.93 -0.04 0.00 -1.01 0.00 0.00 37.83 34.66 3hp6 s LYS 368 CO 0.21 0.40 0.03 -1.12 0.51 0.00 0.00 175.35 175.38 3hp6 s SER 369 N -0.27 5.43 0.26 2.83 0.01 0.75 -0.89 113.70 121.82 3hp6 s SER 369 Ca 0.01 0.09 0.03 0.00 1.31 0.00 0.00 55.95 57.39 3hp6 s SER 369 Cb -0.12 -1.81 -0.04 0.00 0.21 0.00 0.00 66.02 64.27 3hp6 s SER 369 CO 0.02 0.25 0.20 -0.04 0.41 0.00 0.00 173.24 174.07 3hp6 s MET 370 N -0.10 1.45 -0.18 12.44 -1.94 0.23 -1.03 119.30 130.17 3hp6 s MET 370 Ca 0.05 -1.80 0.01 0.00 -1.71 0.00 0.00 55.69 52.24 3hp6 s MET 370 Cb -0.12 0.29 0.03 0.00 2.01 0.00 0.00 34.83 37.04 3hp6 s MET 370 CO 0.02 -0.51 -0.13 0.12 -0.01 0.00 0.00 175.02 174.51 3hp6 s PHE 371 N -3.84 2.39 -0.77 -0.03 5.36 -1.26 -0.36 117.98 119.46 3hp6 s PHE 371 Ca 0.40 -1.48 -0.03 0.00 -0.96 0.00 0.00 56.93 54.86 3hp6 s PHE 371 Cb 0.05 -1.66 -0.03 0.00 -0.34 0.00 0.00 43.02 41.04 3hp6 s PHE 371 CO 0.19 -0.73 0.70 -3.47 -1.46 0.00 0.00 175.22 170.45 3hp6 n ASP 372 N 4.70 -6.42 0.23 6.13 2.03 -1.26 -4.90 116.55 117.06 3hp6 n ASP 372 Ca -0.16 -0.35 0.08 0.00 0.52 0.00 0.00 54.79 54.87 3hp6 n ASP 372 Cb 0.48 -4.59 0.56 0.00 -0.72 0.00 0.00 41.12 36.85 3hp6 n ASP 372 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3hp6 h SER 373 N -0.32 0.00 -0.57 1.67 4.64 -1.94 -2.88 113.55 114.15 3hp6 h SER 373 Ca -0.28 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.03 3hp6 h SER 373 Cb 1.14 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.21 3hp6 h SER 373 CO 0.32 0.20 0.32 0.50 -0.87 0.00 0.00 176.83 177.30 3hp6 h LYS 374 N 0.00 0.79 -0.43 4.77 3.64 -1.92 0.30 116.57 123.72 3hp6 h LYS 374 Ca -0.00 -0.09 0.07 0.00 -1.27 0.00 0.00 60.65 59.36 3hp6 h LYS 374 Cb 0.40 -0.16 -0.06 0.00 -0.41 0.00 0.00 32.23 32.00 3hp6 h LYS 374 CO 0.03 0.60 0.05 -0.09 -2.27 0.00 0.00 179.45 177.77 3hp6 h ARG 375 N 0.77 0.17 -0.15 1.90 2.43 -1.89 -0.64 114.38 116.97 3hp6 h ARG 375 Ca 0.20 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 3hp6 h ARG 375 Cb 0.03 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 3hp6 h ARG 375 CO -0.03 0.11 -0.01 0.00 -1.51 0.00 0.00 179.97 178.53 3hp6 h ALA 376 N 1.35 0.20 -0.75 2.80 0.00 -1.35 -1.96 119.26 119.55 3hp6 h ALA 376 Ca 0.21 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3hp6 h ALA 376 Cb 0.28 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3hp6 h ALA 376 CO -0.30 -0.08 0.48 0.00 0.00 0.00 0.00 179.25 179.34 3hp6 h ALA 377 N 0.75 0.95 -0.13 0.00 0.00 -0.25 -0.56 119.26 120.02 3hp6 h ALA 377 Ca 0.04 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 3hp6 h ALA 377 Cb 0.40 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3hp6 h ALA 377 CO 0.01 0.38 -0.07 0.28 0.00 0.00 0.00 179.25 179.85 3hp6 h VAL 378 N 1.01 1.32 -0.84 0.00 2.07 -1.15 0.63 116.25 119.29 3hp6 h VAL 378 Ca 0.27 -1.12 0.04 0.00 0.82 0.00 0.00 66.70 66.71 3hp6 h VAL 378 Cb -0.09 1.78 -0.05 0.00 -1.52 0.00 0.00 31.29 31.41 3hp6 h VAL 378 CO -0.06 0.33 0.54 0.00 0.02 0.00 0.00 177.57 178.40 3hp6 h ALA 379 N 0.65 1.12 -0.61 1.67 0.00 -1.27 -1.24 119.26 119.58 3hp6 h ALA 379 Ca 0.03 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 3hp6 h ALA 379 Cb 0.55 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 3hp6 h ALA 379 CO 0.02 0.35 0.23 -0.07 0.00 0.00 0.00 179.25 179.78 3hp6 h LEU 380 N 1.03 0.85 -0.95 0.00 3.38 -1.06 -2.77 115.31 115.79 3hp6 h LEU 380 Ca 0.34 -0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.22 3hp6 h LEU 380 Cb 0.04 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.50 3hp6 h LEU 380 CO -0.13 0.80 0.60 0.11 0.09 0.00 0.00 178.44 179.91 3hp6 h LYS 381 N 0.85 1.00 0.00 1.13 1.57 -0.04 0.36 116.57 121.43 3hp6 h LYS 381 Ca 0.20 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.90 3hp6 h LYS 381 Cb 0.23 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 3hp6 h LYS 381 CO -0.01 0.66 -0.12 -1.49 -0.57 0.00 0.00 179.45 177.92 3hp6 h TRP 382 N 1.03 0.00 -0.17 -1.35 4.06 -1.09 -1.66 115.95 116.77 3hp6 h TRP 382 Ca 0.44 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.39 3hp6 h TRP 382 Cb 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.46 3hp6 h TRP 382 CO -0.02 0.12 0.00 1.63 -3.56 0.00 0.00 178.44 176.61 3hp6 n LYS 383 N -3.91 1.81 -1.54 0.49 4.76 -0.36 -4.96 118.16 114.46 3hp6 n LYS 383 Ca -0.02 -1.22 -0.03 0.00 -2.87 0.00 0.00 58.31 54.17 3hp6 n LYS 383 Cb 0.21 -1.42 -0.01 0.00 -1.84 0.00 0.00 35.03 31.98 3hp6 n LYS 383 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hp6 n GLY 384 N 1.18 0.45 3.21 0.72 0.00 -0.62 -5.05 105.19 105.07 3hp6 n GLY 384 Ca 0.17 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 3hp6 n GLY 384 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hp6 s ILE 385 N -2.14 2.06 0.01 -0.61 1.01 -0.03 -4.98 121.20 116.51 3hp6 s ILE 385 Ca 0.00 -1.01 -0.26 0.00 0.00 0.00 0.00 60.65 59.38 3hp6 s ILE 385 Cb 0.00 -1.79 -0.04 0.00 0.01 0.00 0.00 42.46 40.64 3hp6 s ILE 385 CO 0.00 0.56 0.80 -0.70 0.00 0.00 0.00 174.94 175.60 3hp6 s GLU 386 N 0.47 4.51 0.15 2.79 2.12 -1.26 -3.05 118.70 124.43 3hp6 s GLU 386 Ca -0.16 1.11 0.06 0.00 0.36 0.00 0.00 54.97 56.35 3hp6 s GLU 386 Cb -0.17 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.77 3hp6 s GLU 386 CO 0.06 0.14 0.02 -1.17 -0.54 0.00 0.00 175.26 173.77 3hp6 s LEU 387 N 0.44 3.42 -2.11 2.70 2.96 -1.26 -2.76 118.68 122.07 3hp6 s LEU 387 Ca 0.42 -0.30 0.00 0.00 -0.22 0.00 0.00 54.13 54.02 3hp6 s LEU 387 Cb -0.20 -2.09 0.00 0.00 0.50 0.00 0.00 46.19 44.40 3hp6 s LEU 387 CO 0.23 0.11 0.00 0.61 -1.32 0.00 0.00 176.35 175.98 3hp6 n GLY 389 N 0.02 1.81 3.63 7.98 0.00 -1.26 -4.96 105.19 112.42 3hp6 n GLY 389 Ca -0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.49 3hp6 n GLY 389 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hp6 s VAL 390 N -2.71 4.00 -0.61 1.61 1.01 -1.26 -0.87 120.40 121.56 3hp6 s VAL 390 Ca 0.00 1.14 0.11 0.00 0.00 0.00 0.00 61.98 63.23 3hp6 s VAL 390 Cb 0.00 -3.97 -0.11 0.00 0.00 0.00 0.00 36.38 32.30 3hp6 s VAL 390 CO 0.00 -0.36 0.51 -1.54 0.00 0.00 0.00 175.10 173.71 3hp6 n SER 391 N 7.74 0.64 -3.68 3.32 3.41 -0.07 -4.89 113.62 120.08 3hp6 n SER 391 Ca 0.16 -0.82 -0.10 0.00 -0.26 0.00 0.00 58.87 57.85 3hp6 n SER 391 Cb 0.46 0.93 -0.10 0.00 -0.26 0.00 0.00 64.21 65.24 3hp6 n SER 391 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3hp6 s PHE 392 N -2.00 -0.70 -0.27 7.33 5.36 -1.19 -5.02 117.98 121.48 3hp6 s PHE 392 Ca 0.05 1.46 0.03 0.00 -0.96 0.00 0.00 56.93 57.51 3hp6 s PHE 392 Cb 0.09 0.34 0.06 0.00 -0.34 0.00 0.00 43.02 43.18 3hp6 s PHE 392 CO 0.44 -0.38 -0.08 0.34 -1.46 0.00 0.00 175.22 174.08 3hp6 s ASP 393 N 1.48 4.37 0.35 6.13 -1.08 -1.26 -0.60 116.67 126.07 3hp6 s ASP 393 Ca -0.09 -1.45 0.06 0.00 -0.52 0.00 0.00 52.55 50.55 3hp6 s ASP 393 Cb -0.08 -1.48 0.66 0.00 -1.46 0.00 0.00 42.92 40.56 3hp6 s ASP 393 CO -0.14 -0.22 1.89 0.25 0.52 0.00 0.00 175.17 177.47 3hp6 h LEU 394 N 7.79 0.42 -0.40 -1.34 5.85 -1.07 -0.84 115.31 125.71 3hp6 h LEU 394 Ca -0.17 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 3hp6 h LEU 394 Cb 1.04 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 3hp6 h LEU 394 CO 0.46 0.50 0.20 0.25 -0.34 0.00 0.00 178.44 179.51 3hp6 h LEU 395 N 0.43 0.52 -0.40 2.25 5.85 -1.91 -0.20 115.31 121.85 3hp6 h LEU 395 Ca 0.09 -0.12 -0.17 0.00 0.84 0.00 0.00 57.88 58.52 3hp6 h LEU 395 Cb 0.33 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 3hp6 h LEU 395 CO 0.01 0.50 -0.52 -0.07 -0.34 0.00 0.00 178.44 178.02 3hp6 h LEU 396 N 0.51 0.85 -0.38 2.25 3.38 -1.82 -1.37 115.31 118.73 3hp6 h LEU 396 Ca 0.14 -0.44 0.04 0.00 0.09 0.00 0.00 57.88 57.71 3hp6 h LEU 396 Cb 0.11 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 3hp6 h LEU 396 CO -0.02 1.21 0.16 0.00 0.09 0.00 0.00 178.44 179.87 3hp6 h ALA 397 N 0.81 0.45 -0.51 1.53 0.00 -1.01 -1.68 119.26 118.87 3hp6 h ALA 397 Ca 0.02 0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3hp6 h ALA 397 Cb 1.10 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3hp6 h ALA 397 CO 0.11 -0.23 -0.10 0.00 0.00 0.00 0.00 179.25 179.03 3hp6 h ALA 398 N 1.23 0.86 -0.93 0.00 0.00 -0.94 -2.13 119.26 117.34 3hp6 h ALA 398 Ca 0.17 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.75 3hp6 h ALA 398 Cb 0.12 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 3hp6 h ALA 398 CO -0.15 0.65 0.62 -0.92 0.00 0.00 0.00 179.25 179.44 3hp6 h TYR 399 N 0.84 1.17 -0.24 0.00 3.20 -1.02 -2.19 116.97 118.73 3hp6 h TYR 399 Ca 0.14 0.03 -0.18 0.00 3.14 0.00 0.00 58.73 61.85 3hp6 h TYR 399 Cb 0.64 -0.39 -0.00 0.00 1.54 0.00 0.00 36.73 38.51 3hp6 h TYR 399 CO 0.04 0.73 -0.57 -0.07 -1.64 0.00 0.00 178.16 176.65 3hp6 h LEU 400 N 1.25 0.84 -0.66 2.82 3.38 -1.07 -2.52 115.31 119.36 3hp6 h LEU 400 Ca 0.34 -0.46 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 3hp6 h LEU 400 Cb -0.13 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.35 3hp6 h LEU 400 CO -0.08 1.23 0.28 -0.07 0.09 0.00 0.00 178.44 179.89 3hp6 h LEU 401 N 0.57 0.90 -6.00 1.67 3.38 -1.05 -3.42 115.31 111.35 3hp6 h LEU 401 Ca 0.01 -0.16 0.11 0.00 0.09 0.00 0.00 57.88 57.93 3hp6 h LEU 401 Cb 1.16 -0.23 -0.20 0.00 0.09 0.00 0.00 40.66 41.47 3hp6 h LEU 401 CO 0.12 0.81 -0.21 -0.62 0.09 0.00 0.00 178.44 178.63 3hp6 s ASP 402 N -6.14 -1.14 0.58 -0.43 2.15 -0.85 -5.01 116.67 105.83 3hp6 s ASP 402 Ca -0.13 0.27 0.28 0.00 0.43 0.00 0.00 52.55 53.40 3hp6 s ASP 402 Cb 0.14 1.78 1.67 0.00 -0.30 0.00 0.00 42.92 46.21 3hp6 s ASP 402 CO 0.80 -0.21 2.15 -0.65 -0.17 0.00 0.00 175.17 177.10 3hp6 h PRO 403 N 7.80 0.00 0.00 4.34 0.11 -1.68 -2.65 132.00 139.92 3hp6 h PRO 403 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 3hp6 h PRO 403 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3hp6 h PRO 403 CO 0.07 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.86 3hp6 h ALA 404 N 1.86 1.00 0.00 -0.75 0.00 -1.93 -2.47 119.26 116.96 3hp6 h ALA 404 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3hp6 h ALA 404 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3hp6 h ALA 404 CO -0.00 0.00 0.00 1.96 0.00 0.00 0.00 179.25 181.21 3hp6 h GLN 405 N 0.00 0.00 -6.23 0.00 1.08 -1.86 -3.47 115.11 104.64 3hp6 h GLN 405 Ca 0.00 0.00 -0.46 0.00 -1.45 0.00 0.00 58.65 56.74 3hp6 h GLN 405 Cb 0.53 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.95 3hp6 h GLN 405 CO 0.00 0.00 -0.77 0.41 -0.95 0.00 0.00 178.83 177.52 3hp6 n GLY 406 N -0.02 -0.46 3.69 3.46 0.00 -0.93 -4.87 105.19 106.06 3hp6 n GLY 406 Ca 0.01 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3hp6 n GLY 406 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3hp6 n VAL 407 N -4.64 0.33 -0.82 1.61 0.31 -1.26 -4.84 118.33 109.03 3hp6 n VAL 407 Ca -0.03 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 3hp6 n VAL 407 Cb 0.56 -2.12 0.00 0.00 -0.91 0.00 0.00 33.84 31.37 3hp6 n VAL 407 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3hp6 n ASP 408 N 5.50 0.21 -3.95 4.52 5.75 -1.26 -4.95 116.55 122.38 3hp6 n ASP 408 Ca 0.18 -1.03 -0.09 0.00 -0.01 0.00 0.00 54.79 53.83 3hp6 n ASP 408 Cb 0.37 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.39 3hp6 n ASP 408 CO 0.00 0.00 0.00 1.51 -0.11 0.00 0.00 177.20 178.60 3hp6 s ASP 409 N -0.03 0.13 0.29 -1.12 3.84 -1.26 -5.05 116.67 113.45 3hp6 s ASP 409 Ca 0.00 -0.83 0.03 0.00 -0.00 0.00 0.00 52.55 51.75 3hp6 s ASP 409 Cb 0.00 0.37 0.68 0.00 -1.38 0.00 0.00 42.92 42.59 3hp6 s ASP 409 CO 0.00 -0.80 1.75 0.58 -0.00 0.00 0.00 175.17 176.70 3hp6 h VAL 410 N 2.69 0.63 -0.71 2.11 2.07 -1.97 -2.11 116.25 118.96 3hp6 h VAL 410 Ca -0.33 -0.21 0.02 0.00 0.82 0.00 0.00 66.70 67.01 3hp6 h VAL 410 Cb 1.21 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 3hp6 h VAL 410 CO 0.53 0.11 0.45 0.00 0.02 0.00 0.00 177.57 178.69 3hp6 h ALA 411 N 1.64 0.92 -0.51 1.67 0.00 -1.87 0.07 119.26 121.18 3hp6 h ALA 411 Ca 0.54 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.35 3hp6 h ALA 411 Cb 0.90 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 3hp6 h ALA 411 CO -0.42 0.26 0.02 0.00 0.00 0.00 0.00 179.25 179.10 3hp6 h ALA 412 N 1.29 1.06 -0.20 0.00 0.00 -1.78 -1.18 119.26 118.45 3hp6 h ALA 412 Ca 0.28 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3hp6 h ALA 412 Cb -0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3hp6 h ALA 412 CO -0.09 0.59 -0.06 0.00 0.00 0.00 0.00 179.25 179.69 3hp6 h ALA 413 N 1.22 0.28 -0.88 0.00 0.00 -1.17 -3.11 119.26 115.60 3hp6 h ALA 413 Ca 0.15 -0.26 0.14 0.00 0.00 0.00 0.00 54.91 54.95 3hp6 h ALA 413 Cb 0.46 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.11 3hp6 h ALA 413 CO 0.02 0.07 0.57 0.00 0.00 0.00 0.00 179.25 179.90 3hp6 h ALA 414 N 0.73 1.86 0.00 0.00 0.00 -0.71 -1.39 119.26 119.76 3hp6 h ALA 414 Ca 0.05 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3hp6 h ALA 414 Cb 0.51 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3hp6 h ALA 414 CO 0.02 -0.10 -0.17 0.87 0.00 0.00 0.00 179.25 179.87 3hp6 h LYS 415 N 0.66 0.00 0.00 0.00 1.79 -1.15 -0.65 116.57 117.22 3hp6 h LYS 415 Ca 0.44 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.91 3hp6 h LYS 415 Cb 0.74 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.39 3hp6 h LYS 415 CO -0.20 0.17 -0.02 0.52 -1.08 0.00 0.00 179.45 178.85 3hp6 h MET 416 N 0.00 0.00 0.00 3.15 2.86 -1.28 -2.72 114.93 116.94 3hp6 h MET 416 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3hp6 h MET 416 Cb 0.36 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.02 3hp6 h MET 416 CO 0.02 0.02 -0.01 1.63 1.06 0.00 0.00 176.91 179.63 3hp6 n LYS 417 N -3.64 1.27 -3.48 1.72 4.76 -0.78 -4.99 118.16 113.02 3hp6 n LYS 417 Ca -0.03 -2.52 -0.25 0.00 -2.87 0.00 0.00 58.31 52.63 3hp6 n LYS 417 Cb 0.10 -1.47 0.03 0.00 -1.84 0.00 0.00 35.03 31.85 3hp6 n LYS 417 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3hp6 n GLN 418 N -1.39 -5.11 -3.40 1.97 3.00 -0.95 -4.97 117.38 106.52 3hp6 n GLN 418 Ca 0.15 0.68 -0.39 0.00 -0.01 0.00 0.00 57.00 57.44 3hp6 n GLN 418 Cb 0.64 -5.54 -0.09 0.00 0.00 0.00 0.00 30.24 25.25 3hp6 n GLN 418 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.06 176.59 3hp6 s TYR 419 N -3.17 3.29 0.00 1.08 5.04 -0.32 -4.96 117.35 118.31 3hp6 s TYR 419 Ca 0.49 0.47 0.00 0.00 -2.44 0.00 0.00 57.07 55.58 3hp6 s TYR 419 Cb -0.24 -2.54 0.00 0.00 0.35 0.00 0.00 41.96 39.53 3hp6 s TYR 419 CO 0.60 -0.14 0.66 -0.85 -1.34 0.00 0.00 175.55 174.48 3hp6 n GLU 420 N 4.99 0.33 -0.18 4.97 0.28 -1.26 -3.99 120.64 125.78 3hp6 n GLU 420 Ca -0.09 -0.83 -0.02 0.00 -0.16 0.00 0.00 57.16 56.07 3hp6 n GLU 420 Cb 0.51 -1.00 0.01 0.00 1.43 0.00 0.00 31.44 32.39 3hp6 n GLU 420 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3hp6 n ALA 421 N -0.17 3.01 -3.64 -1.84 0.00 -1.26 -4.73 120.51 111.88 3hp6 n ALA 421 Ca 0.00 -0.18 -0.11 0.00 0.00 0.00 0.00 53.44 53.15 3hp6 n ALA 421 Cb 0.08 -1.03 -0.11 0.00 0.00 0.00 0.00 19.45 18.40 3hp6 n ALA 421 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3hp6 s VAL 422 N -0.22 -0.02 0.42 0.00 0.11 -1.26 -4.88 120.40 114.55 3hp6 s VAL 422 Ca 0.04 0.08 -0.22 0.00 -2.93 0.00 0.00 61.98 58.95 3hp6 s VAL 422 Cb 0.03 -0.62 -0.11 0.00 -1.53 0.00 0.00 36.38 34.16 3hp6 s VAL 422 CO 0.01 0.03 0.96 -0.13 -3.33 0.00 0.00 175.10 172.64 3hp6 s ARG 423 N 1.25 4.24 0.42 1.54 0.52 -1.26 -4.79 118.95 120.87 3hp6 s ARG 423 Ca -0.08 1.18 -0.26 0.00 -0.52 0.00 0.00 55.73 56.04 3hp6 s ARG 423 Cb -0.08 -2.27 -0.09 0.00 0.52 0.00 0.00 34.95 33.04 3hp6 s ARG 423 CO -0.11 -0.02 1.44 -2.14 0.02 0.00 0.00 175.30 174.49 3hp6 s PRO 424 N -3.02 3.86 0.28 3.54 0.02 -1.26 -4.52 135.00 133.90 3hp6 s PRO 424 Ca 0.61 2.46 0.03 0.00 0.02 0.00 0.00 61.00 64.12 3hp6 s PRO 424 Cb -0.11 -2.78 0.65 0.00 0.02 0.00 0.00 34.50 32.28 3hp6 s PRO 424 CO 0.15 -0.70 1.76 -0.44 -0.33 0.00 0.00 177.00 177.44 3hp6 h ASP 425 N 2.59 0.62 0.20 2.53 3.32 -1.97 -1.29 116.42 122.42 3hp6 h ASP 425 Ca -0.51 0.10 -0.06 0.00 0.02 0.00 0.00 57.03 56.59 3hp6 h ASP 425 Cb 1.25 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.80 3hp6 h ASP 425 CO 0.62 0.21 -0.24 -0.08 -1.72 0.00 0.00 179.24 178.04 3hp6 h GLU 426 N 0.65 0.08 -0.22 3.56 4.81 -1.91 0.94 114.58 122.49 3hp6 h GLU 426 Ca 0.53 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.59 3hp6 h GLU 426 Cb 0.82 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 3hp6 h GLU 426 CO -0.39 0.32 -0.49 0.00 -0.73 0.00 0.00 179.01 177.71 3hp6 h ALA 427 N 1.69 0.74 0.11 2.92 0.00 -1.58 0.14 119.26 123.27 3hp6 h ALA 427 Ca 0.01 -0.48 -0.15 0.00 0.00 0.00 0.00 54.91 54.29 3hp6 h ALA 427 Cb 0.47 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.18 3hp6 h ALA 427 CO 0.03 0.67 -0.68 0.28 0.00 0.00 0.00 179.25 179.56 3hp6 h VAL 428 N 0.47 1.54 0.00 0.00 2.07 -1.20 -3.38 116.25 115.75 3hp6 h VAL 428 Ca 0.02 -2.49 -0.04 0.00 0.82 0.00 0.00 66.70 65.02 3hp6 h VAL 428 Cb 1.02 3.21 -0.01 0.00 -1.52 0.00 0.00 31.29 33.99 3hp6 h VAL 428 CO 0.09 0.69 -1.01 1.88 0.02 0.00 0.00 177.57 179.24 3hp6 h TYR 429 N -0.51 0.00 0.00 1.57 -1.99 -0.90 -3.43 116.97 111.71 3hp6 h TYR 429 Ca -0.12 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.61 3hp6 h TYR 429 Cb 1.51 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.24 3hp6 h TYR 429 CO 0.21 0.14 0.00 0.41 -0.00 0.00 0.00 178.16 178.92 3hp6 n GLY 430 N 1.22 -1.07 3.91 3.88 0.00 0.50 -0.91 105.19 112.73 3hp6 n GLY 430 Ca -0.02 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.17 3hp6 n GLY 430 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hp6 s LYS 431 N -3.45 3.54 6.33 1.61 -2.85 -1.26 -4.17 119.74 119.49 3hp6 s LYS 431 Ca 0.00 -0.26 0.00 0.00 -1.00 0.00 0.00 55.97 54.71 3hp6 s LYS 431 Cb 0.00 -2.89 0.00 0.00 -2.06 0.00 0.00 37.83 32.88 3hp6 s LYS 431 CO 0.00 0.48 0.00 0.41 0.10 0.00 0.00 175.35 176.34 3hp6 n GLY 432 N -0.13 3.82 0.06 0.59 0.00 -1.26 -1.92 105.19 106.36 3hp6 n GLY 432 Ca -0.04 0.14 0.10 0.00 0.00 0.00 0.00 46.02 46.23 3hp6 n GLY 432 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hp6 n ALA 433 N 12.08 1.82 1.40 4.61 0.00 -1.26 -2.00 120.51 137.17 3hp6 n ALA 433 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 3hp6 n ALA 433 Cb 0.00 -1.35 0.50 0.00 0.00 0.00 0.00 19.45 18.60 3hp6 n ALA 433 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3hp6 n LYS 434 N -1.88 1.12 -1.68 0.00 5.02 -0.81 -4.94 118.16 115.00 3hp6 n LYS 434 Ca 0.04 -0.60 -0.50 0.00 -2.02 0.00 0.00 58.31 55.23 3hp6 n LYS 434 Cb 0.25 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 33.72 3hp6 n LYS 434 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3hp6 n ARG 435 N -0.42 1.90 -3.63 1.97 0.63 -0.84 -4.61 116.66 111.66 3hp6 n ARG 435 Ca 0.16 0.69 -0.11 0.00 -0.92 0.00 0.00 57.85 57.67 3hp6 n ARG 435 Cb 0.33 -2.48 -0.07 0.00 0.45 0.00 0.00 32.46 30.69 3hp6 n ARG 435 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3hp6 s ALA 436 N 2.89 -1.89 0.03 5.13 0.00 -0.09 -5.02 121.76 122.81 3hp6 s ALA 436 Ca 0.90 1.98 -0.30 0.00 0.00 0.00 0.00 51.96 54.53 3hp6 s ALA 436 Cb -0.78 -1.32 -0.06 0.00 0.00 0.00 0.00 23.12 20.96 3hp6 s ALA 436 CO 0.50 -0.29 1.39 0.08 0.00 0.00 0.00 175.76 177.44 3hp6 s VAL 437 N 0.38 3.63 0.90 0.00 1.01 -1.26 -4.49 120.40 120.57 3hp6 s VAL 437 Ca 0.01 1.07 -0.15 0.00 0.00 0.00 0.00 61.98 62.91 3hp6 s VAL 437 Cb -0.05 -3.69 0.21 0.00 0.00 0.00 0.00 36.38 32.86 3hp6 s VAL 437 CO -0.04 0.02 1.01 -0.81 0.00 0.00 0.00 175.10 175.29 3hp6 n PRO 438 N 4.96 -1.81 -1.77 2.72 -0.04 -1.26 -5.00 135.00 132.80 3hp6 n PRO 438 Ca 0.12 -1.59 -0.41 0.00 -0.04 0.00 0.00 63.50 61.59 3hp6 n PRO 438 Cb 0.43 -1.23 -0.00 0.00 -0.04 0.00 0.00 33.50 32.67 3hp6 n PRO 438 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 3hp6 n ASP 439 N -4.07 3.82 -0.32 3.54 2.03 -1.26 -4.65 116.55 115.64 3hp6 n ASP 439 Ca 0.13 1.22 0.17 0.00 0.52 0.00 0.00 54.79 56.83 3hp6 n ASP 439 Cb 0.48 -1.62 0.34 0.00 -0.72 0.00 0.00 41.12 39.60 3hp6 n ASP 439 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 3hp6 h GLU 440 N 3.24 0.09 -0.65 -0.67 4.81 -1.98 0.74 114.58 120.16 3hp6 h GLU 440 Ca -0.50 -0.01 0.06 0.00 -0.13 0.00 0.00 59.36 58.78 3hp6 h GLU 440 Cb 1.24 -0.02 -0.06 0.00 0.63 0.00 0.00 28.75 30.54 3hp6 h GLU 440 CO 0.66 0.06 0.35 -1.35 -0.73 0.00 0.00 179.01 178.00 3hp6 h PRO 441 N 0.10 0.62 -0.27 0.92 0.11 -1.99 0.21 132.00 131.69 3hp6 h PRO 441 Ca 0.62 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 66.59 3hp6 h PRO 441 Cb 1.34 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3hp6 h PRO 441 CO -0.78 0.41 -0.21 0.28 -0.21 0.00 0.00 178.00 177.50 3hp6 h VAL 442 N 0.64 1.30 -0.36 3.15 2.07 -1.25 -2.33 116.25 119.47 3hp6 h VAL 442 Ca 0.29 -1.35 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 3hp6 h VAL 442 Cb 0.20 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.53 3hp6 h VAL 442 CO -0.19 0.43 0.21 0.25 0.02 0.00 0.00 177.57 178.28 3hp6 h LEU 443 N 0.35 0.44 -0.48 2.57 5.85 -1.16 -1.98 115.31 120.91 3hp6 h LEU 443 Ca 0.05 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3hp6 h LEU 443 Cb 0.75 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3hp6 h LEU 443 CO 0.05 0.39 0.31 0.00 -0.34 0.00 0.00 178.44 178.85 3hp6 h ALA 444 N 1.07 0.61 -0.44 1.25 0.00 -0.96 -0.87 119.26 119.93 3hp6 h ALA 444 Ca 0.13 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3hp6 h ALA 444 Cb 0.04 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3hp6 h ALA 444 CO -0.02 0.07 0.26 1.49 0.00 0.00 0.00 179.25 181.05 3hp6 h GLU 445 N 0.65 0.59 -0.63 0.00 4.81 -1.36 -1.87 114.58 116.78 3hp6 h GLU 445 Ca 0.17 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 3hp6 h GLU 445 Cb -0.05 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 3hp6 h GLU 445 CO -0.04 0.45 0.38 1.25 -0.73 0.00 0.00 179.01 180.32 3hp6 h HIS 446 N 0.58 0.82 -0.43 0.92 2.76 -0.91 0.52 115.15 119.42 3hp6 h HIS 446 Ca 0.16 -0.00 -0.13 0.00 -2.20 0.00 0.00 60.37 58.19 3hp6 h HIS 446 Cb 0.01 -0.27 -0.01 0.00 1.55 0.00 0.00 27.41 28.68 3hp6 h HIS 446 CO -0.03 0.56 -0.26 -0.07 -1.30 0.00 0.00 177.93 176.83 3hp6 h LEU 447 N 0.85 0.93 -0.50 0.26 3.38 -1.07 -0.79 115.31 118.38 3hp6 h LEU 447 Ca 0.22 -0.37 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 3hp6 h LEU 447 Cb -0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 3hp6 h LEU 447 CO -0.04 1.13 -0.07 0.58 0.09 0.00 0.00 178.44 180.13 3hp6 h VAL 448 N 0.77 1.27 -0.61 1.22 2.07 -1.04 -0.71 116.25 119.22 3hp6 h VAL 448 Ca 0.09 -1.20 -0.05 0.00 0.82 0.00 0.00 66.70 66.37 3hp6 h VAL 448 Cb 0.82 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.58 3hp6 h VAL 448 CO 0.07 0.42 0.18 0.03 0.02 0.00 0.00 177.57 178.29 3hp6 h ARG 449 N 0.80 0.93 -0.19 1.57 3.08 -0.73 0.32 114.38 120.17 3hp6 h ARG 449 Ca 0.13 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.99 3hp6 h ARG 449 Cb 0.62 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3hp6 h ARG 449 CO 0.04 0.81 0.09 0.87 -1.07 0.00 0.00 179.97 180.71 3hp6 h LYS 450 N 0.90 0.27 -0.86 0.04 1.57 -0.86 -1.45 116.57 116.19 3hp6 h LYS 450 Ca 0.20 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 3hp6 h LYS 450 Cb 0.27 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 3hp6 h LYS 450 CO -0.01 0.30 0.43 0.00 -0.57 0.00 0.00 179.45 179.61 3hp6 h ALA 451 N 0.96 1.10 -0.59 3.86 0.00 -0.51 -1.85 119.26 122.22 3hp6 h ALA 451 Ca 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 3hp6 h ALA 451 Cb 0.12 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 3hp6 h ALA 451 CO -0.01 0.65 0.30 0.00 0.00 0.00 0.00 179.25 180.18 3hp6 h ALA 452 N 1.23 0.76 -0.29 0.00 0.00 -0.27 -1.54 119.26 119.16 3hp6 h ALA 452 Ca 0.30 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3hp6 h ALA 452 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3hp6 h ALA 452 CO -0.04 0.31 0.18 0.00 0.00 0.00 0.00 179.25 179.69 3hp6 h ALA 453 N 1.13 0.37 -0.98 0.00 0.00 -0.89 -0.73 119.26 118.16 3hp6 h ALA 453 Ca 0.20 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3hp6 h ALA 453 Cb 0.10 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 17.72 3hp6 h ALA 453 CO -0.03 -0.13 0.65 0.82 0.00 0.00 0.00 179.25 180.56 3hp6 h ILE 454 N 0.37 1.25 -0.58 0.00 2.04 -1.14 0.13 117.51 119.58 3hp6 h ILE 454 Ca 0.10 -0.47 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 3hp6 h ILE 454 Cb 0.01 -0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 35.88 3hp6 h ILE 454 CO -0.02 0.25 0.34 -0.25 0.00 0.00 0.00 178.15 178.47 3hp6 h TRP 455 N 1.33 0.77 0.00 1.37 2.91 -0.77 -2.55 115.95 119.02 3hp6 h TRP 455 Ca 0.36 -0.01 -0.11 0.00 1.13 0.00 0.00 58.89 60.26 3hp6 h TRP 455 Cb -0.15 -0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 28.23 3hp6 h TRP 455 CO -0.00 0.54 -0.54 0.93 -1.03 0.00 0.00 178.44 178.34 3hp6 h GLU 456 N 0.78 0.00 0.00 2.65 4.39 -0.54 -3.36 114.58 118.50 3hp6 h GLU 456 Ca 0.21 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.91 3hp6 h GLU 456 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 3hp6 h GLU 456 CO -0.04 0.54 -1.05 1.28 -1.16 0.00 0.00 179.01 178.59 3hp6 n LEU 457 N -3.30 0.62 0.08 1.33 4.77 0.38 -4.41 117.00 116.47 3hp6 n LEU 457 Ca 0.01 0.08 -0.13 0.00 -0.03 0.00 0.00 56.01 55.95 3hp6 n LEU 457 Cb 0.72 -0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.66 3hp6 n LEU 457 CO 0.41 -0.02 0.64 -0.08 -1.33 0.00 0.00 177.39 177.01 3hp6 h GLU 458 N 0.00 -0.50 0.02 3.23 4.81 -1.61 -1.78 114.58 118.76 3hp6 h GLU 458 Ca 0.00 0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3hp6 h GLU 458 Cb 0.80 0.11 0.00 0.00 0.63 0.00 0.00 28.75 30.30 3hp6 h GLU 458 CO 0.00 -0.33 -0.01 0.00 -0.73 0.00 0.00 179.01 177.94 3hp6 h ARG 459 N -0.52 -0.02 -0.93 1.92 3.08 -1.85 0.23 114.38 116.29 3hp6 h ARG 459 Ca 0.05 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.15 3hp6 h ARG 459 Cb 0.58 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.58 3hp6 h ARG 459 CO -0.25 0.02 0.61 -1.35 -1.07 0.00 0.00 179.97 177.93 3hp6 h PRO 460 N -0.06 1.08 -0.24 0.04 0.11 -1.77 0.10 132.00 131.27 3hp6 h PRO 460 Ca -0.00 -0.07 -0.05 0.00 0.11 0.00 0.00 66.00 65.99 3hp6 h PRO 460 Cb 0.05 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 3hp6 h PRO 460 CO 0.00 0.72 -0.06 0.74 -0.21 0.00 0.00 178.00 179.19 3hp6 h PHE 461 N 1.12 0.52 -0.81 0.65 -1.00 -1.05 -2.41 116.94 113.96 3hp6 h PHE 461 Ca 0.39 -0.11 -0.03 0.00 2.81 0.00 0.00 57.97 61.02 3hp6 h PHE 461 Cb 0.11 -0.13 -0.04 0.00 3.61 0.00 0.00 35.95 39.51 3hp6 h PHE 461 CO -0.00 0.69 0.37 -0.07 -1.61 0.00 0.00 178.31 177.69 3hp6 h LEU 462 N 0.19 1.07 -0.58 1.54 3.38 -0.71 -1.13 115.31 119.07 3hp6 h LEU 462 Ca 0.06 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 57.90 3hp6 h LEU 462 Cb 0.53 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3hp6 h LEU 462 CO 0.02 0.91 0.38 0.44 0.09 0.00 0.00 178.44 180.29 3hp6 h ASP 463 N 1.16 0.65 -0.00 -0.43 3.32 -0.72 0.23 116.42 120.62 3hp6 h ASP 463 Ca 0.28 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 57.12 3hp6 h ASP 463 Cb 0.14 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3hp6 h ASP 463 CO -0.03 0.47 -0.68 -0.08 -1.72 0.00 0.00 179.24 177.20 3hp6 h GLU 464 N 0.77 0.63 -0.40 3.56 4.81 -1.19 -2.23 114.58 120.54 3hp6 h GLU 464 Ca 0.22 -0.47 -0.00 0.00 -0.13 0.00 0.00 59.36 58.97 3hp6 h GLU 464 Cb -0.07 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 3hp6 h GLU 464 CO -0.06 1.09 0.24 -0.07 -0.73 0.00 0.00 179.01 179.48 3hp6 h LEU 465 N 0.45 0.48 -0.76 1.64 3.38 -1.01 -0.36 115.31 119.14 3hp6 h LEU 465 Ca -0.02 -0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.91 3hp6 h LEU 465 Cb 1.27 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.85 3hp6 h LEU 465 CO 0.13 0.39 0.49 -0.09 0.09 0.00 0.00 178.44 179.45 3hp6 h ARG 466 N 0.52 0.95 -1.01 1.13 2.43 -0.88 0.63 114.38 118.15 3hp6 h ARG 466 Ca 0.14 -0.06 0.01 0.00 -0.81 0.00 0.00 59.98 59.27 3hp6 h ARG 466 Cb 0.00 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 29.29 3hp6 h ARG 466 CO -0.03 0.63 0.67 -0.09 -1.51 0.00 0.00 179.97 179.64 3hp6 h ARG 467 N 0.98 1.32 0.00 0.20 2.43 -0.96 -1.93 114.38 116.43 3hp6 h ARG 467 Ca 0.29 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 3hp6 h ARG 467 Cb -0.05 -0.30 0.00 0.00 -0.42 0.00 0.00 29.97 29.21 3hp6 h ARG 467 CO -0.09 0.87 0.00 0.09 -1.51 0.00 0.00 179.97 179.34 3hp6 n ASN 468 N -4.39 0.00 -2.74 -3.80 3.02 -0.18 -4.89 115.26 102.28 3hp6 n ASN 468 Ca 0.12 -1.18 -0.20 0.00 -0.03 0.00 0.00 54.58 53.29 3hp6 n ASN 468 Cb 0.02 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.22 3hp6 n ASN 468 CO 0.00 0.00 0.00 1.21 -2.62 0.00 0.00 177.26 175.85 3hp6 n GLU 469 N -0.91 -4.50 -0.04 3.52 2.13 -0.72 -4.91 120.64 115.20 3hp6 n GLU 469 Ca 0.20 0.82 0.02 0.00 0.66 0.00 0.00 57.16 58.85 3hp6 n GLU 469 Cb 0.09 -5.49 0.04 0.00 0.27 0.00 0.00 31.44 26.36 3hp6 n GLU 469 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3hp6 n GLN 470 N -3.72 1.84 -0.06 5.31 6.02 0.12 -4.72 117.38 122.18 3hp6 n GLN 470 Ca -0.10 -1.38 -0.07 0.00 -0.01 0.00 0.00 57.00 55.44 3hp6 n GLN 470 Cb 0.61 -1.09 0.11 0.00 1.02 0.00 0.00 30.24 30.89 3hp6 n GLN 470 CO 0.00 0.00 0.00 0.38 -1.01 0.00 0.00 177.06 176.43 3hp6 h ASP 471 N 0.75 0.71 0.68 1.08 2.03 -1.84 -2.08 116.42 117.76 3hp6 h ASP 471 Ca 0.00 -0.26 -0.15 0.00 -0.73 0.00 0.00 57.03 55.89 3hp6 h ASP 471 Cb 0.45 -0.19 -0.02 0.00 -0.83 0.00 0.00 39.33 38.73 3hp6 h ASP 471 CO 0.00 0.94 -0.72 0.03 -1.03 0.00 0.00 179.24 178.46 3hp6 h ARG 472 N 0.60 0.03 -0.72 4.15 3.08 -1.92 -1.70 114.38 117.90 3hp6 h ARG 472 Ca 0.08 -0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.15 3hp6 h ARG 472 Cb 0.75 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.76 3hp6 h ARG 472 CO 0.06 0.73 0.44 1.25 -1.07 0.00 0.00 179.97 181.38 3hp6 h LEU 473 N 0.02 0.69 0.33 3.04 5.85 -1.75 -0.03 115.31 123.46 3hp6 h LEU 473 Ca -0.01 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.71 3hp6 h LEU 473 Cb 1.27 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 42.17 3hp6 h LEU 473 CO 0.10 0.47 -0.16 0.25 -0.34 0.00 0.00 178.44 178.75 3hp6 h LEU 474 N 0.83 -0.37 0.00 2.25 5.85 -1.28 -0.93 115.31 121.66 3hp6 h LEU 474 Ca 0.30 -0.17 -0.21 0.00 0.84 0.00 0.00 57.88 58.65 3hp6 h LEU 474 Cb 0.09 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 3hp6 h LEU 474 CO -0.14 0.08 -1.03 0.58 -0.34 0.00 0.00 178.44 177.58 3hp6 h VAL 475 N -0.94 1.63 0.00 1.05 2.07 -1.26 -0.41 116.25 118.38 3hp6 h VAL 475 Ca -0.04 -3.33 0.00 0.00 0.82 0.00 0.00 66.70 64.14 3hp6 h VAL 475 Cb 0.51 2.80 0.00 0.00 -1.52 0.00 0.00 31.29 33.09 3hp6 h VAL 475 CO 0.07 0.93 -1.13 -0.62 0.02 0.00 0.00 177.57 176.84 3hp6 n GLU 476 N -3.32 1.04 0.01 1.57 1.02 -0.04 -4.40 120.64 116.52 3hp6 n GLU 476 Ca -0.01 -0.05 -0.00 0.00 -0.02 0.00 0.00 57.16 57.08 3hp6 n GLU 476 Cb 0.94 -1.35 -0.00 0.00 -0.02 0.00 0.00 31.44 31.01 3hp6 n GLU 476 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 3hp6 n LEU 477 N -1.63 0.15 -0.13 -4.62 0.00 -1.14 -4.74 117.00 104.88 3hp6 n LEU 477 Ca 0.01 0.02 -0.09 0.00 0.00 0.00 0.00 56.01 55.95 3hp6 n LEU 477 Cb 0.33 -0.05 -0.01 0.00 0.00 0.00 0.00 43.42 43.69 3hp6 n LEU 477 CO 0.36 -0.53 0.92 -0.33 0.00 0.00 0.00 177.39 177.80 3hp6 h GLU 478 N -0.00 0.60 -0.23 1.96 4.39 -1.13 -1.98 114.58 118.19 3hp6 h GLU 478 Ca 0.00 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.56 3hp6 h GLU 478 Cb 0.00 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.55 3hp6 h GLU 478 CO 0.00 0.57 0.03 1.96 -1.16 0.00 0.00 179.01 180.41 3hp6 h GLN 479 N 0.50 0.39 -0.72 2.33 4.20 -1.32 -0.75 115.11 119.74 3hp6 h GLN 479 Ca 0.13 -0.11 0.01 0.00 0.06 0.00 0.00 58.65 58.75 3hp6 h GLN 479 Cb 0.20 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 3hp6 h GLN 479 CO -0.01 0.53 0.47 -1.35 -0.67 0.00 0.00 178.83 177.80 3hp6 h PRO 480 N 0.18 0.92 -0.86 1.46 0.11 -1.76 -2.56 132.00 129.49 3hp6 h PRO 480 Ca 0.07 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 66.10 3hp6 h PRO 480 Cb 0.34 -0.21 -0.04 0.00 0.11 0.00 0.00 31.00 31.20 3hp6 h PRO 480 CO 0.01 0.61 0.44 1.25 -0.21 0.00 0.00 178.00 180.09 3hp6 h LEU 481 N 0.95 1.11 -0.94 2.35 5.85 -0.96 -2.75 115.31 120.92 3hp6 h LEU 481 Ca 0.27 -0.12 0.14 0.00 0.84 0.00 0.00 57.88 59.01 3hp6 h LEU 481 Cb -0.07 -0.28 -0.09 0.00 0.37 0.00 0.00 40.66 40.58 3hp6 h LEU 481 CO -0.06 0.92 0.56 -1.28 -0.34 0.00 0.00 178.44 178.23 3hp6 h SER 482 N 1.22 0.77 -0.36 1.25 0.87 -0.71 0.59 113.55 117.18 3hp6 h SER 482 Ca 0.30 0.07 -0.05 0.00 -1.23 0.00 0.00 61.79 60.88 3hp6 h SER 482 Cb 0.09 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 3hp6 h SER 482 CO -0.04 0.37 0.03 0.28 -0.53 0.00 0.00 176.83 176.93 3hp6 h SER 483 N 0.83 0.59 -0.33 6.23 0.02 -1.48 -1.55 113.55 117.85 3hp6 h SER 483 Ca 0.49 -0.29 0.02 0.00 -0.84 0.00 0.00 61.79 61.18 3hp6 h SER 483 Cb 0.60 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.95 3hp6 h SER 483 CO -0.31 0.73 0.18 0.40 -1.14 0.00 0.00 176.83 176.69 3hp6 h ILE 484 N 0.44 1.00 -0.72 3.27 2.04 -1.25 -2.67 117.51 119.62 3hp6 h ILE 484 Ca 0.10 -0.12 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 3hp6 h ILE 484 Cb 0.41 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 3hp6 h ILE 484 CO 0.01 0.07 0.40 -0.07 0.00 0.00 0.00 178.15 178.56 3hp6 h LEU 485 N 0.36 0.89 -1.27 1.44 3.38 -0.86 -2.15 115.31 117.12 3hp6 h LEU 485 Ca 0.14 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 3hp6 h LEU 485 Cb 0.03 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3hp6 h LEU 485 CO -0.08 0.72 0.40 0.00 0.09 0.00 0.00 178.44 179.57 3hp6 h ALA 486 N 1.43 1.45 -0.20 1.53 0.00 -1.02 0.67 119.26 123.11 3hp6 h ALA 486 Ca 0.26 -0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 3hp6 h ALA 486 Cb 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3hp6 h ALA 486 CO -0.04 0.48 -0.58 0.93 0.00 0.00 0.00 179.25 180.04 3hp6 h GLU 487 N 0.92 0.74 -0.23 0.00 5.08 -1.19 -1.91 114.58 117.99 3hp6 h GLU 487 Ca 0.24 -0.53 -0.01 0.00 -1.00 0.00 0.00 59.36 58.06 3hp6 h GLU 487 Cb -0.04 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 3hp6 h GLU 487 CO -0.05 1.15 0.11 0.52 -1.00 0.00 0.00 179.01 179.75 3hp6 h MET 488 N 0.46 0.33 -0.26 2.33 2.86 -0.81 -1.60 114.93 118.24 3hp6 h MET 488 Ca -0.02 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 3hp6 h MET 488 Cb 1.20 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.79 3hp6 h MET 488 CO 0.12 0.34 0.17 0.93 1.06 0.00 0.00 176.91 179.53 3hp6 h GLU 489 N 0.24 0.35 -0.56 1.72 5.08 -0.89 -2.20 114.58 118.30 3hp6 h GLU 489 Ca 0.08 -0.02 -0.09 0.00 -1.00 0.00 0.00 59.36 58.32 3hp6 h GLU 489 Cb 0.12 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 3hp6 h GLU 489 CO -0.01 0.25 -0.02 0.35 -1.00 0.00 0.00 179.01 178.58 3hp6 h PHE 490 N 0.34 1.10 -0.49 4.33 3.57 -1.27 -2.91 116.94 121.61 3hp6 h PHE 490 Ca 0.09 -0.20 -0.01 0.00 3.53 0.00 0.00 57.97 61.39 3hp6 h PHE 490 Cb -0.02 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.41 3hp6 h PHE 490 CO -0.05 1.00 0.27 0.00 -2.23 0.00 0.00 178.31 177.29 3hp6 h ALA 491 N 0.96 0.63 -0.56 2.41 0.00 -1.28 -3.49 119.26 117.93 3hp6 h ALA 491 Ca 0.16 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 55.04 3hp6 h ALA 491 Cb 0.57 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3hp6 h ALA 491 CO 0.03 0.15 -0.08 0.41 0.00 0.00 0.00 179.25 179.76 3hp6 n GLY 492 N -1.02 -2.17 3.08 0.00 0.00 -0.83 -4.92 105.19 99.32 3hp6 n GLY 492 Ca 0.02 -1.46 -0.25 0.00 0.00 0.00 0.00 46.02 44.33 3hp6 n GLY 492 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hp6 s VAL 493 N -1.08 1.27 0.06 1.61 1.01 -0.64 -4.94 120.40 117.68 3hp6 s VAL 493 Ca 0.00 -0.60 -0.24 0.00 0.00 0.00 0.00 61.98 61.15 3hp6 s VAL 493 Cb 0.00 -1.11 -0.06 0.00 0.00 0.00 0.00 36.38 35.21 3hp6 s VAL 493 CO 0.00 0.38 0.72 -0.75 0.00 0.00 0.00 175.10 175.44 3hp6 s LYS 494 N 0.30 4.45 -0.01 2.72 2.20 -1.25 -0.28 119.74 127.87 3hp6 s LYS 494 Ca -0.08 0.98 0.08 0.00 -0.36 0.00 0.00 55.97 56.59 3hp6 s LYS 494 Cb -0.13 -3.33 -0.02 0.00 -1.51 0.00 0.00 37.83 32.84 3hp6 s LYS 494 CO 0.03 0.38 -0.25 0.08 -0.36 0.00 0.00 175.35 175.23 3hp6 s VAL 495 N -0.35 1.98 -0.98 4.02 1.01 0.33 -1.82 120.40 124.59 3hp6 s VAL 495 Ca 0.36 -1.11 -0.22 0.00 0.00 0.00 0.00 61.98 61.01 3hp6 s VAL 495 Cb -0.20 -1.65 0.07 0.00 0.00 0.00 0.00 36.38 34.60 3hp6 s VAL 495 CO 0.22 0.52 1.36 -0.62 0.00 0.00 0.00 175.10 176.58 3hp6 s ASP 496 N -0.68 6.52 0.28 3.32 -1.08 0.37 -4.85 116.67 120.55 3hp6 s ASP 496 Ca 0.10 -1.56 0.03 0.00 -0.52 0.00 0.00 52.55 50.59 3hp6 s ASP 496 Cb -0.10 -2.52 0.41 0.00 -1.46 0.00 0.00 42.92 39.25 3hp6 s ASP 496 CO -0.01 -1.41 1.72 0.71 0.52 0.00 0.00 175.17 176.71 3hp6 h THR 497 N 6.52 1.27 -0.54 1.71 1.35 -1.92 -2.39 112.91 118.91 3hp6 h THR 497 Ca 0.17 -1.28 0.04 0.00 -0.55 0.00 0.00 66.41 64.78 3hp6 h THR 497 Cb 1.02 1.37 -0.04 0.00 -1.73 0.00 0.00 68.15 68.76 3hp6 h THR 497 CO 1.34 0.40 0.31 0.11 -0.25 0.00 0.00 175.52 177.43 3hp6 h LYS 498 N 0.41 0.58 -0.35 4.72 1.57 -1.99 0.14 116.57 121.66 3hp6 h LYS 498 Ca 0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3hp6 h LYS 498 Cb 0.68 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 3hp6 h LYS 498 CO 0.05 0.38 0.17 -0.09 -0.57 0.00 0.00 179.45 179.40 3hp6 h ARG 499 N 0.60 0.50 -0.84 3.15 2.43 -1.91 -1.03 114.38 117.28 3hp6 h ARG 499 Ca 0.23 -0.07 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 3hp6 h ARG 499 Cb 0.08 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 29.49 3hp6 h ARG 499 CO -0.13 0.45 0.55 -0.07 -1.51 0.00 0.00 179.97 179.26 3hp6 h LEU 500 N 0.43 0.93 -1.12 3.80 3.38 -1.10 -0.63 115.31 121.00 3hp6 h LEU 500 Ca 0.12 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 3hp6 h LEU 500 Cb 0.11 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.62 3hp6 h LEU 500 CO -0.02 0.65 -0.05 -0.33 0.09 0.00 0.00 178.44 178.78 3hp6 h GLU 501 N 1.09 0.55 0.18 1.13 5.08 -0.40 -0.47 114.58 121.74 3hp6 h GLU 501 Ca 0.33 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3hp6 h GLU 501 Cb -0.05 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.14 3hp6 h GLU 501 CO -0.10 0.62 -0.09 0.37 -1.00 0.00 0.00 179.01 178.82 3hp6 h GLN 502 N 0.52 -0.23 -0.79 2.33 5.75 -0.64 -1.66 115.11 120.40 3hp6 h GLN 502 Ca 0.10 0.02 0.16 0.00 -0.15 0.00 0.00 58.65 58.78 3hp6 h GLN 502 Cb 0.42 0.05 -0.10 0.00 1.07 0.00 0.00 27.48 28.92 3hp6 h GLN 502 CO 0.02 0.10 0.32 0.52 -2.65 0.00 0.00 178.83 177.14 3hp6 h MET 503 N -0.58 0.43 -0.44 1.69 2.86 -0.99 -2.11 114.93 115.80 3hp6 h MET 503 Ca -0.02 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.61 3hp6 h MET 503 Cb 0.43 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 3hp6 h MET 503 CO 0.04 0.28 0.27 0.78 1.06 0.00 0.00 176.91 179.34 3hp6 h GLY 504 N 0.44 0.61 0.77 8.32 0.00 -0.91 0.52 103.07 112.83 3hp6 h GLY 504 Ca 0.45 -0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 3hp6 h GLY 504 CO -0.43 0.18 -0.27 1.70 0.00 0.00 0.00 176.54 177.72 3hp6 h LYS 505 N 0.54 -0.58 -0.64 4.80 1.63 -0.71 -1.70 116.57 119.90 3hp6 h LYS 505 Ca 0.17 0.04 0.05 0.00 -0.85 0.00 0.00 60.65 60.06 3hp6 h LYS 505 Cb -0.00 0.13 -0.05 0.00 -0.60 0.00 0.00 32.23 31.71 3hp6 h LYS 505 CO -0.07 -0.39 0.36 0.93 -3.45 0.00 0.00 179.45 176.83 3hp6 h GLU 506 N -0.60 0.66 -0.20 1.90 5.08 -1.27 -2.60 114.58 117.54 3hp6 h GLU 506 Ca -0.02 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3hp6 h GLU 506 Cb 0.53 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 3hp6 h GLU 506 CO -0.01 0.44 0.13 1.25 -1.00 0.00 0.00 179.01 179.81 3hp6 h LEU 507 N 0.68 0.23 -1.56 1.33 5.85 -0.77 -0.37 115.31 120.69 3hp6 h LEU 507 Ca 0.28 -0.01 0.12 0.00 0.84 0.00 0.00 57.88 59.10 3hp6 h LEU 507 Cb 0.14 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.07 3hp6 h LEU 507 CO -0.16 0.17 0.46 0.00 -0.34 0.00 0.00 178.44 178.57 3hp6 h ALA 508 N 1.06 2.00 -0.19 1.25 0.00 -1.06 0.55 119.26 122.87 3hp6 h ALA 508 Ca 0.07 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 3hp6 h ALA 508 Cb -0.02 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.68 3hp6 h ALA 508 CO -0.02 -0.16 -0.66 0.93 0.00 0.00 0.00 179.25 179.35 3hp6 h GLU 509 N 0.47 0.79 -0.19 0.00 5.08 -0.97 -1.77 114.58 117.99 3hp6 h GLU 509 Ca 0.33 -0.59 -0.04 0.00 -1.00 0.00 0.00 59.36 58.06 3hp6 h GLU 509 Cb 0.63 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3hp6 h GLU 509 CO -0.10 1.21 -0.04 1.96 -1.00 0.00 0.00 179.01 181.03 3hp6 h GLN 510 N 0.53 0.37 -0.45 2.33 4.20 -0.03 -2.66 115.11 119.40 3hp6 h GLN 510 Ca -0.03 -0.14 0.09 0.00 0.06 0.00 0.00 58.65 58.64 3hp6 h GLN 510 Cb 1.28 -0.02 -0.09 0.00 0.30 0.00 0.00 27.48 28.94 3hp6 h GLN 510 CO 0.14 0.62 -0.23 -0.07 -0.67 0.00 0.00 178.83 178.62 3hp6 h LEU 511 N 0.09 -0.79 -1.02 1.46 4.07 -0.00 0.42 115.31 119.54 3hp6 h LEU 511 Ca 0.05 0.17 0.06 0.00 0.08 0.00 0.00 57.88 58.24 3hp6 h LEU 511 Cb 0.48 0.42 -0.06 0.00 1.08 0.00 0.00 40.66 42.57 3hp6 h LEU 511 CO 0.02 -0.25 0.65 1.23 -1.08 0.00 0.00 178.44 179.00 3hp6 h GLY 512 N -0.14 1.50 0.74 0.83 0.00 -1.28 -0.07 103.07 104.64 3hp6 h GLY 512 Ca 0.21 -0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 3hp6 h GLY 512 CO -0.53 0.37 -0.12 -0.84 0.00 0.00 0.00 176.54 175.41 3hp6 h THR 513 N 1.20 0.79 -0.71 4.70 2.02 -0.98 -2.83 112.91 117.10 3hp6 h THR 513 Ca 0.42 -0.51 -0.06 0.00 0.77 0.00 0.00 66.41 67.03 3hp6 h THR 513 Cb 0.12 1.07 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 3hp6 h THR 513 CO -0.16 0.11 0.19 0.58 0.37 0.00 0.00 175.52 176.61 3hp6 h VAL 514 N -0.62 1.26 -0.10 3.16 2.07 -0.76 -2.28 116.25 118.98 3hp6 h VAL 514 Ca -0.04 -0.95 0.04 0.00 0.82 0.00 0.00 66.70 66.58 3hp6 h VAL 514 Cb 0.44 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 3hp6 h VAL 514 CO 0.06 0.37 -0.20 -0.08 0.02 0.00 0.00 177.57 177.73 3hp6 h GLU 515 N 1.06 -0.27 -0.38 1.57 4.81 -1.07 0.15 114.58 120.45 3hp6 h GLU 515 Ca 0.22 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.40 3hp6 h GLU 515 Cb 0.35 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 3hp6 h GLU 515 CO -0.00 -0.18 -0.07 1.96 -0.73 0.00 0.00 179.01 179.99 3hp6 h GLN 516 N -0.28 0.64 -0.30 1.92 1.08 -1.33 -1.48 115.11 115.37 3hp6 h GLN 516 Ca 0.09 -0.18 -0.09 0.00 -1.45 0.00 0.00 58.65 57.02 3hp6 h GLN 516 Cb 0.40 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.75 3hp6 h GLN 516 CO -0.26 0.71 -0.18 -0.09 -0.95 0.00 0.00 178.83 178.06 3hp6 h ARG 517 N 0.59 0.53 -0.20 1.46 9.65 -1.06 -1.09 114.38 124.26 3hp6 h ARG 517 Ca 0.11 -0.18 -0.05 0.00 -1.10 0.00 0.00 59.98 58.76 3hp6 h ARG 517 Cb 0.48 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 29.01 3hp6 h ARG 517 CO 0.03 0.69 -0.08 0.82 2.80 0.00 0.00 179.97 184.23 3hp6 h ILE 518 N 0.48 1.30 -0.40 1.20 2.04 -0.54 -1.47 117.51 120.13 3hp6 h ILE 518 Ca 0.08 -1.11 -0.00 0.00 1.00 0.00 0.00 64.86 64.83 3hp6 h ILE 518 Cb 0.59 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.25 3hp6 h ILE 518 CO 0.04 0.34 0.24 1.88 0.00 0.00 0.00 178.15 180.65 3hp6 h TYR 519 N 0.12 0.51 -0.15 1.37 0.05 -1.08 0.22 116.97 118.00 3hp6 h TYR 519 Ca 0.05 0.01 -0.14 0.00 0.05 0.00 0.00 58.73 58.69 3hp6 h TYR 519 Cb 0.55 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.13 3hp6 h TYR 519 CO 0.06 0.34 -0.47 1.49 -1.05 0.00 0.00 178.16 178.53 3hp6 h GLU 520 N 0.54 0.59 0.00 4.88 4.81 -1.11 0.18 114.58 124.46 3hp6 h GLU 520 Ca 0.14 -0.43 -0.06 0.00 -0.13 0.00 0.00 59.36 58.89 3hp6 h GLU 520 Cb -0.03 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 3hp6 h GLU 520 CO -0.03 1.05 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.97 3hp6 h LEU 521 N 0.24 0.00 0.00 1.64 3.38 -1.03 -3.16 115.31 116.37 3hp6 h LEU 521 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3hp6 h LEU 521 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3hp6 h LEU 521 CO 0.10 0.26 -0.87 0.00 0.09 0.00 0.00 178.44 178.02 3hp6 n ALA 522 N -2.21 3.25 -2.58 1.53 0.00 0.05 -4.98 120.51 115.57 3hp6 n ALA 522 Ca 0.01 -0.35 -0.21 0.00 0.00 0.00 0.00 53.44 52.89 3hp6 n ALA 522 Cb 0.51 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.92 3hp6 n ALA 522 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hp6 n GLY 523 N 1.36 -0.51 3.50 0.00 0.00 0.55 -4.96 105.19 105.14 3hp6 n GLY 523 Ca 0.02 0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 3hp6 n GLY 523 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hp6 s GLN 524 N -5.23 0.91 -0.12 1.61 0.74 -0.81 -5.04 119.66 111.72 3hp6 s GLN 524 Ca 0.08 -0.19 -0.06 0.00 0.05 0.00 0.00 55.36 55.25 3hp6 s GLN 524 Cb -0.04 0.42 -0.04 0.00 1.10 0.00 0.00 33.01 34.45 3hp6 s GLN 524 CO 0.10 -0.37 0.11 -1.21 -0.55 0.00 0.00 175.29 173.38 3hp6 s GLU 525 N -2.66 3.40 0.30 1.67 2.02 -1.26 -4.42 118.70 117.75 3hp6 s GLU 525 Ca 0.01 -0.19 -0.13 0.00 0.02 0.00 0.00 54.97 54.67 3hp6 s GLU 525 Cb -0.01 -3.12 0.01 0.00 0.10 0.00 0.00 34.13 31.11 3hp6 s GLU 525 CO -0.06 0.73 0.59 -0.59 0.02 0.00 0.00 175.26 175.96 3hp6 s PHE 526 N -0.91 0.32 -0.60 1.61 -0.71 -1.26 -5.11 117.98 111.32 3hp6 s PHE 526 Ca 0.14 -0.74 -0.24 0.00 -1.04 0.00 0.00 56.93 55.04 3hp6 s PHE 526 Cb -0.12 0.39 0.05 0.00 -1.21 0.00 0.00 43.02 42.12 3hp6 s PHE 526 CO 0.03 -1.19 1.01 1.21 -1.34 0.00 0.00 175.22 174.94 3hp6 s ASN 527 N -3.05 6.29 0.45 1.98 2.47 -1.26 -4.88 114.94 116.94 3hp6 s ASN 527 Ca 0.20 -0.49 0.18 0.00 0.42 0.00 0.00 52.86 53.17 3hp6 s ASN 527 Cb -0.03 -2.46 1.07 0.00 -1.45 0.00 0.00 41.25 38.38 3hp6 s ASN 527 CO 0.11 -1.37 1.98 0.40 -3.72 0.00 0.00 177.10 174.50 3hp6 h ILE 528 N 6.02 1.00 0.00 -5.21 2.04 -1.99 -1.24 117.51 118.14 3hp6 h ILE 528 Ca -0.27 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 64.86 3hp6 h ILE 528 Cb 1.07 1.41 0.00 0.00 -0.74 0.00 0.00 36.82 38.56 3hp6 h ILE 528 CO 1.14 0.20 0.00 0.59 0.00 0.00 0.00 178.15 180.08 3hp6 n ASN 529 N -4.09 0.00 -4.31 1.72 5.03 -1.26 -4.50 115.26 107.85 3hp6 n ASN 529 Ca -0.02 -1.03 -0.42 0.00 0.87 0.00 0.00 54.58 53.98 3hp6 n ASN 529 Cb 0.28 0.00 -0.09 0.00 -1.02 0.00 0.00 39.78 38.95 3hp6 n ASN 529 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 3hp6 s SER 530 N -1.84 5.85 0.37 6.41 0.15 -0.47 -4.95 113.70 119.23 3hp6 s SER 530 Ca 0.34 -1.49 0.11 0.00 0.70 0.00 0.00 55.95 55.61 3hp6 s SER 530 Cb 0.16 -2.07 0.88 0.00 -1.71 0.00 0.00 66.02 63.27 3hp6 s SER 530 CO 0.26 -0.61 1.88 -0.65 1.20 0.00 0.00 173.24 175.32 3hp6 h PRO 531 N 8.56 0.61 -0.20 5.44 0.11 -1.85 0.10 132.00 144.77 3hp6 h PRO 531 Ca -0.25 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.80 3hp6 h PRO 531 Cb 1.09 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 3hp6 h PRO 531 CO 0.82 0.40 0.03 -0.22 -0.21 0.00 0.00 178.00 178.83 3hp6 h LYS 532 N 0.62 0.33 -0.38 1.05 3.64 -1.92 0.13 116.57 120.05 3hp6 h LYS 532 Ca 0.43 -0.09 -0.09 0.00 -1.27 0.00 0.00 60.65 59.64 3hp6 h LYS 532 Cb 0.77 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.53 3hp6 h LYS 532 CO -0.19 0.49 -0.13 1.96 -2.27 0.00 0.00 179.45 179.31 3hp6 h GLN 533 N 0.12 0.67 -0.59 1.90 4.20 -1.73 -2.66 115.11 117.03 3hp6 h GLN 533 Ca 0.06 -0.22 -0.06 0.00 0.06 0.00 0.00 58.65 58.49 3hp6 h GLN 533 Cb 0.32 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 3hp6 h GLN 533 CO 0.00 0.78 0.14 1.25 -0.67 0.00 0.00 178.83 180.33 3hp6 h LEU 534 N 0.61 0.86 -0.04 1.46 5.85 -0.62 -2.76 115.31 120.68 3hp6 h LEU 534 Ca 0.10 -0.17 0.03 0.00 0.84 0.00 0.00 57.88 58.69 3hp6 h LEU 534 Cb 0.58 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 3hp6 h LEU 534 CO 0.04 0.85 -0.14 1.23 -0.34 0.00 0.00 178.44 180.07 3hp6 h GLY 535 N 1.01 -0.14 0.26 3.75 0.00 -0.40 -0.70 103.07 106.84 3hp6 h GLY 535 Ca 0.19 0.17 0.08 0.00 0.00 0.00 0.00 47.33 47.77 3hp6 h GLY 535 CO 0.00 -0.14 -0.03 -2.08 0.00 0.00 0.00 176.54 174.29 3hp6 h VAL 536 N -0.21 0.64 -0.10 4.60 2.07 -1.43 0.33 116.25 122.14 3hp6 h VAL 536 Ca 0.06 -0.03 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 3hp6 h VAL 536 Cb 0.30 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 3hp6 h VAL 536 CO -0.17 0.01 0.06 0.40 0.02 0.00 0.00 177.57 177.90 3hp6 h ILE 537 N 0.08 1.07 -0.14 4.57 1.08 -1.24 0.23 117.51 123.15 3hp6 h ILE 537 Ca 0.21 -0.19 -0.07 0.00 -0.39 0.00 0.00 64.86 64.43 3hp6 h ILE 537 Cb 0.31 1.01 -0.00 0.00 -3.07 0.00 0.00 36.82 35.07 3hp6 h ILE 537 CO -0.38 0.06 -0.19 -0.07 -0.69 0.00 0.00 178.15 176.89 3hp6 h LEU 538 N 0.09 0.41 0.00 1.44 3.38 -0.88 -0.39 115.31 119.35 3hp6 h LEU 538 Ca 0.04 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.50 3hp6 h LEU 538 Cb 0.05 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3hp6 h LEU 538 CO -0.01 0.84 -0.99 0.49 0.09 0.00 0.00 178.44 178.86 3hp6 n PHE 539 N -4.51 0.00 -0.02 1.13 3.72 0.11 -1.37 117.46 116.52 3hp6 n PHE 539 Ca -0.06 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.28 3hp6 n PHE 539 Cb 0.39 -0.07 -0.02 0.00 -0.94 0.00 0.00 39.48 38.85 3hp6 n PHE 539 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 3hp6 n GLU 540 N -1.53 0.16 0.03 -1.08 1.02 -0.08 -4.23 120.64 114.93 3hp6 n GLU 540 Ca 0.02 0.07 -0.13 0.00 -0.02 0.00 0.00 57.16 57.10 3hp6 n GLU 540 Cb 0.31 -0.77 -0.09 0.00 -0.02 0.00 0.00 31.44 30.87 3hp6 n GLU 540 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 3hp6 h LYS 541 N -0.28 -0.12 -0.00 3.49 3.64 -1.16 -3.30 116.57 118.84 3hp6 h LYS 541 Ca -0.12 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.27 3hp6 h LYS 541 Cb 0.82 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 3hp6 h LYS 541 CO -0.07 0.33 -0.21 1.28 -2.27 0.00 0.00 179.45 178.51 3hp6 n LEU 542 N -4.92 0.51 -2.32 5.20 4.77 -0.16 -4.94 117.00 115.15 3hp6 n LEU 542 Ca -0.08 0.03 -0.19 0.00 -0.03 0.00 0.00 56.01 55.73 3hp6 n LEU 542 Cb 0.26 -0.23 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 3hp6 n LEU 542 CO 0.31 0.10 -0.24 0.00 -1.33 0.00 0.00 177.39 176.23 3hp6 n GLN 543 N -1.11 -1.75 -2.13 3.23 1.13 -1.14 -4.95 117.38 110.68 3hp6 n GLN 543 Ca 0.11 0.96 -0.36 0.00 -1.94 0.00 0.00 57.00 55.77 3hp6 n GLN 543 Cb 0.31 -5.59 0.01 0.00 0.11 0.00 0.00 30.24 25.09 3hp6 n GLN 543 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3hp6 s LEU 544 N -5.82 3.78 0.36 1.08 1.02 -0.47 -4.94 118.68 113.69 3hp6 s LEU 544 Ca 0.00 2.34 -0.28 0.00 0.02 0.00 0.00 54.13 56.20 3hp6 s LEU 544 Cb 0.00 -4.49 -0.11 0.00 0.02 0.00 0.00 46.19 41.61 3hp6 s LEU 544 CO 0.00 -1.32 1.48 -2.84 0.02 0.00 0.00 176.35 173.69 3hp6 s PRO 545 N -3.14 4.14 -0.61 1.29 0.02 -1.26 -4.60 135.00 130.84 3hp6 s PRO 545 Ca 0.72 2.53 -0.26 0.00 0.02 0.00 0.00 61.00 64.02 3hp6 s PRO 545 Cb -0.29 -2.99 0.04 0.00 0.02 0.00 0.00 34.50 31.28 3hp6 s PRO 545 CO 0.33 -0.51 1.09 0.08 -0.33 0.00 0.00 177.00 177.66 3hp6 s VAL 546 N -0.96 4.13 -0.01 3.83 1.01 -1.26 -4.90 120.40 122.23 3hp6 s VAL 546 Ca 0.54 0.41 0.03 0.00 0.00 0.00 0.00 61.98 62.96 3hp6 s VAL 546 Cb -0.46 -4.69 -0.25 0.00 0.00 0.00 0.00 36.38 30.98 3hp6 s VAL 546 CO 0.60 -1.38 0.78 -0.07 0.00 0.00 0.00 175.10 175.03 3hp6 h LEU 547 N 11.73 0.20 -7.62 3.92 3.38 -1.92 -3.47 115.31 121.53 3hp6 h LEU 547 Ca -0.26 -0.33 -0.20 0.00 0.09 0.00 0.00 57.88 57.18 3hp6 h LEU 547 Cb 1.06 -0.07 -0.27 0.00 0.09 0.00 0.00 40.66 41.48 3hp6 h LEU 547 CO 1.17 1.28 -0.58 -0.75 0.09 0.00 0.00 178.44 179.65 3hp6 s LYS 548 N -2.61 0.15 -0.03 1.13 2.20 -1.26 -5.10 119.74 114.22 3hp6 s LYS 548 Ca -0.08 0.13 0.07 0.00 -0.36 0.00 0.00 55.97 55.73 3hp6 s LYS 548 Cb 0.08 0.07 -0.02 0.00 -1.51 0.00 0.00 37.83 36.45 3hp6 s LYS 548 CO 0.83 -0.02 -0.24 0.15 -0.36 0.00 0.00 175.35 175.70 3hp6 s LYS 549 N -0.02 2.08 0.54 4.03 -0.14 -1.26 -1.75 119.74 123.22 3hp6 s LYS 549 Ca -0.01 -0.87 0.07 0.00 -1.36 0.00 0.00 55.97 53.80 3hp6 s LYS 549 Cb -0.01 -1.95 0.04 0.00 -1.68 0.00 0.00 37.83 34.23 3hp6 s LYS 549 CO 0.00 0.49 0.50 0.95 -0.76 0.00 0.00 175.35 176.53 3hp6 s THR 550 N -0.47 1.91 0.62 2.17 -4.23 0.65 -4.94 115.64 111.34 3hp6 s THR 550 Ca 0.06 -1.35 0.32 0.00 -1.18 0.00 0.00 61.69 59.55 3hp6 s THR 550 Cb -0.10 -2.25 0.37 0.00 1.34 0.00 0.00 72.50 71.85 3hp6 s THR 550 CO 0.00 0.00 2.14 0.07 -0.54 0.00 0.00 174.62 176.29 3hp6 h LYS 551 N 0.64 0.00 0.00 3.99 2.10 -2.01 -2.61 116.57 118.68 3hp6 h LYS 551 Ca -0.36 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.29 3hp6 h LYS 551 Cb 1.29 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.62 3hp6 h LYS 551 CO 0.53 0.00 -1.55 0.25 -2.00 0.00 0.00 179.45 176.68 3hp6 n THR 552 N -3.54 0.00 -0.33 0.07 -2.24 -1.26 -5.10 114.28 101.88 3hp6 n THR 552 Ca -0.00 -0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.50 3hp6 n THR 552 Cb 0.26 0.44 0.00 0.00 -2.10 0.00 0.00 70.33 68.94 3hp6 n THR 552 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hp6 n GLY 553 N 1.37 0.19 3.74 3.38 0.00 -0.98 -5.12 105.19 107.77 3hp6 n GLY 553 Ca -0.00 -1.27 -0.41 0.00 0.00 0.00 0.00 46.02 44.34 3hp6 n GLY 553 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hp6 s TYR 554 N -3.82 3.36 0.23 1.61 4.12 -1.26 -0.25 117.35 121.33 3hp6 s TYR 554 Ca 0.00 1.41 -0.25 0.00 0.02 0.00 0.00 57.07 58.25 3hp6 s TYR 554 Cb 0.00 -3.49 -0.09 0.00 -1.52 0.00 0.00 41.96 36.87 3hp6 s TYR 554 CO 0.00 -1.37 0.83 0.45 0.02 0.00 0.00 175.55 175.48 3hp6 s SER 555 N -0.04 7.33 -0.16 2.29 0.15 -0.72 -4.87 113.70 117.68 3hp6 s SER 555 Ca 0.52 1.68 0.14 0.00 0.70 0.00 0.00 55.95 58.99 3hp6 s SER 555 Cb -0.34 -2.51 0.42 0.00 -1.71 0.00 0.00 66.02 61.88 3hp6 s SER 555 CO 0.40 0.09 1.21 0.35 1.20 0.00 0.00 173.24 176.48 3hp6 n THR 556 N 1.09 1.72 -1.06 6.45 -2.24 -1.26 -4.83 114.28 114.16 3hp6 n THR 556 Ca -0.02 -2.76 -0.32 0.00 -2.27 0.00 0.00 64.05 58.67 3hp6 n THR 556 Cb 0.49 0.03 0.13 0.00 -2.10 0.00 0.00 70.33 68.88 3hp6 n THR 556 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3hp6 s SER 557 N -2.97 3.60 0.34 3.42 1.04 -1.26 -4.65 113.70 113.22 3hp6 s SER 557 Ca 0.37 2.23 0.10 0.00 0.48 0.00 0.00 55.95 59.13 3hp6 s SER 557 Cb 0.37 -2.57 0.85 0.00 0.10 0.00 0.00 66.02 64.77 3hp6 s SER 557 CO -0.09 -2.65 1.80 0.00 0.98 0.00 0.00 173.24 173.27 3hp6 h ALA 558 N -1.14 1.84 -0.45 5.32 0.00 -1.98 -0.23 119.26 122.61 3hp6 h ALA 558 Ca -0.45 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.45 3hp6 h ALA 558 Cb 1.28 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.99 3hp6 h ALA 558 CO 0.46 -0.20 0.01 -0.44 0.00 0.00 0.00 179.25 179.09 3hp6 h ASP 559 N 0.66 0.77 -0.26 0.00 3.32 -1.97 -0.35 116.42 118.59 3hp6 h ASP 559 Ca 0.55 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 3hp6 h ASP 559 Cb 1.00 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 3hp6 h ASP 559 CO -0.32 0.88 0.11 0.58 -1.72 0.00 0.00 179.24 178.77 3hp6 h VAL 560 N 0.64 1.16 -0.62 -1.35 2.07 -1.67 -2.75 116.25 113.72 3hp6 h VAL 560 Ca 0.13 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 3hp6 h VAL 560 Cb 0.48 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 3hp6 h VAL 560 CO 0.02 0.17 0.35 -0.07 0.02 0.00 0.00 177.57 178.06 3hp6 h LEU 561 N 0.28 0.76 -0.64 2.57 4.07 -0.91 -1.43 115.31 120.00 3hp6 h LEU 561 Ca 0.09 -0.05 0.01 0.00 0.08 0.00 0.00 57.88 58.01 3hp6 h LEU 561 Cb 0.16 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 41.67 3hp6 h LEU 561 CO -0.01 0.60 0.42 -0.08 -1.08 0.00 0.00 178.44 178.29 3hp6 h GLU 562 N 0.86 0.81 0.00 1.13 4.81 -0.99 -2.42 114.58 118.79 3hp6 h GLU 562 Ca 0.22 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.40 3hp6 h GLU 562 Cb 0.01 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.20 3hp6 h GLU 562 CO -0.04 0.54 0.00 0.87 -0.73 0.00 0.00 179.01 179.65 3hp6 h LYS 563 N 0.84 0.00 -0.00 1.92 1.57 -1.00 -2.74 116.57 117.16 3hp6 h LYS 563 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3hp6 h LYS 563 Cb -0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.25 3hp6 h LYS 563 CO -0.07 0.00 -0.43 1.28 -0.57 0.00 0.00 179.45 179.67 3hp6 n LEU 564 N -2.35 0.85 0.24 2.94 4.77 -0.64 -4.42 117.00 118.39 3hp6 n LEU 564 Ca 0.03 -0.19 0.12 0.00 -0.03 0.00 0.00 56.01 55.94 3hp6 n LEU 564 Cb 0.31 -0.16 0.73 0.00 -2.33 0.00 0.00 43.42 41.96 3hp6 n LEU 564 CO 0.24 0.18 1.10 0.00 -1.33 0.00 0.00 177.39 177.58 3hp6 h ALA 565 N 3.35 1.92 0.00 -1.18 0.00 -1.25 -0.48 119.26 121.62 3hp6 h ALA 565 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hp6 h ALA 565 Cb 0.52 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3hp6 h ALA 565 CO 0.00 -0.10 0.00 -2.30 0.00 0.00 0.00 179.25 176.85 3hp6 n PRO 566 N -4.29 0.18 -0.04 0.00 -0.02 -1.26 -3.59 135.00 125.99 3hp6 n PRO 566 Ca -0.01 0.43 -0.16 0.00 -2.02 0.00 0.00 63.50 61.74 3hp6 n PRO 566 Cb 0.16 -1.86 -0.14 0.00 -0.02 0.00 0.00 33.50 31.64 3hp6 n PRO 566 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3hp6 n TYR 567 N -2.21 0.85 -3.64 6.00 4.02 -0.19 -4.99 117.16 117.00 3hp6 n TYR 567 Ca 0.02 0.23 -0.10 0.00 -0.01 0.00 0.00 57.90 58.03 3hp6 n TYR 567 Cb 0.21 -1.13 -0.07 0.00 -0.02 0.00 0.00 39.34 38.34 3hp6 n TYR 567 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 3hp6 s HIS 568 N -2.56 -0.78 -1.61 -0.72 2.46 -1.20 -5.04 115.29 105.84 3hp6 s HIS 568 Ca -0.17 1.78 0.27 0.00 0.47 0.00 0.00 55.06 57.41 3hp6 s HIS 568 Cb 0.07 0.38 1.46 0.00 -0.13 0.00 0.00 32.58 34.37 3hp6 s HIS 568 CO 0.77 -0.38 1.95 -0.85 -2.47 0.00 0.00 174.74 173.76 3hp6 n GLU 569 N 3.09 0.54 -0.15 2.88 0.28 -1.26 -3.51 120.64 122.50 3hp6 n GLU 569 Ca -0.16 0.02 -0.03 0.00 -0.16 0.00 0.00 57.16 56.83 3hp6 n GLU 569 Cb 0.56 -1.50 0.17 0.00 1.43 0.00 0.00 31.44 32.10 3hp6 n GLU 569 CO 0.00 0.00 0.00 0.97 -0.16 0.00 0.00 177.13 177.94 3hp6 h ILE 570 N 0.00 1.23 -0.10 3.84 2.10 -1.94 -3.13 117.51 119.50 3hp6 h ILE 570 Ca 0.00 -0.84 -0.02 0.00 1.08 0.00 0.00 64.86 65.09 3hp6 h ILE 570 Cb 0.17 0.64 -0.01 0.00 -1.09 0.00 0.00 36.82 36.54 3hp6 h ILE 570 CO 0.00 0.31 -0.02 -0.37 -1.08 0.00 0.00 178.15 177.00 3hp6 h VAL 571 N 0.85 1.08 -0.10 2.19 -1.51 -1.91 -0.22 116.25 116.62 3hp6 h VAL 571 Ca 0.19 -0.32 -0.17 0.00 -1.23 0.00 0.00 66.70 65.17 3hp6 h VAL 571 Cb 0.30 1.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.48 3hp6 h VAL 571 CO -0.00 0.10 -0.65 -0.33 -1.23 0.00 0.00 177.57 175.46 3hp6 h GLU 572 N 0.14 0.40 -0.34 5.19 5.08 -1.79 -1.79 114.58 121.47 3hp6 h GLU 572 Ca 0.03 -0.29 -0.12 0.00 -1.00 0.00 0.00 59.36 57.98 3hp6 h GLU 572 Cb 0.13 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3hp6 h GLU 572 CO 0.00 0.91 -0.27 -0.91 -1.00 0.00 0.00 179.01 177.74 3hp6 h ASN 573 N 0.29 0.73 -0.40 1.42 2.35 -1.18 -2.20 115.58 116.59 3hp6 h ASN 573 Ca -0.01 -0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 55.43 3hp6 h ASN 573 Cb 1.19 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 39.35 3hp6 h ASN 573 CO 0.11 0.96 0.15 0.40 -1.65 0.00 0.00 177.43 177.40 3hp6 h ILE 574 N 0.61 1.20 -0.68 2.81 2.04 -1.02 -0.51 117.51 121.96 3hp6 h ILE 574 Ca 0.08 -0.64 0.05 0.00 1.00 0.00 0.00 64.86 65.34 3hp6 h ILE 574 Cb 0.78 0.88 -0.05 0.00 -0.74 0.00 0.00 36.82 37.69 3hp6 h ILE 574 CO 0.06 0.23 0.40 -0.07 0.00 0.00 0.00 178.15 178.77 3hp6 h LEU 575 N 0.49 0.62 -0.15 1.44 3.38 -1.25 -0.81 115.31 119.04 3hp6 h LEU 575 Ca 0.13 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 3hp6 h LEU 575 Cb 0.21 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3hp6 h LEU 575 CO -0.01 0.42 0.08 -0.74 0.09 0.00 0.00 178.44 178.28 3hp6 h HIS 576 N 0.76 0.20 -0.91 1.13 2.76 -1.16 -2.08 115.15 115.85 3hp6 h HIS 576 Ca 0.29 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.49 3hp6 h HIS 576 Cb 0.12 -0.06 -0.05 0.00 1.55 0.00 0.00 27.41 28.96 3hp6 h HIS 576 CO -0.06 0.20 0.60 -0.92 -1.30 0.00 0.00 177.93 176.45 3hp6 h TYR 577 N 0.14 1.11 -0.24 5.26 3.20 -0.83 -1.63 116.97 123.98 3hp6 h TYR 577 Ca 0.05 0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.84 3hp6 h TYR 577 Cb 0.07 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 37.95 3hp6 h TYR 577 CO -0.04 0.65 -0.31 0.00 -1.64 0.00 0.00 178.16 176.82 3hp6 h ARG 578 N 1.16 0.49 -0.24 1.82 3.08 -0.91 0.16 114.38 119.93 3hp6 h ARG 578 Ca 0.36 -0.21 -0.09 0.00 0.07 0.00 0.00 59.98 60.11 3hp6 h ARG 578 Cb -0.00 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 3hp6 h ARG 578 CO -0.10 0.74 -0.20 1.96 -1.07 0.00 0.00 179.97 181.30 3hp6 h GLN 579 N 0.42 0.57 -0.39 0.04 4.20 -0.95 -2.12 115.11 116.89 3hp6 h GLN 579 Ca 0.05 -0.28 -0.03 0.00 0.06 0.00 0.00 58.65 58.45 3hp6 h GLN 579 Cb 0.75 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.52 3hp6 h GLN 579 CO 0.06 0.87 0.13 -0.07 -0.67 0.00 0.00 178.83 179.15 3hp6 h LEU 580 N 0.27 0.55 -0.80 1.46 3.38 -1.22 -2.71 115.31 116.24 3hp6 h LEU 580 Ca 0.04 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.85 3hp6 h LEU 580 Cb 0.74 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 3hp6 h LEU 580 CO 0.05 0.60 0.52 1.23 0.09 0.00 0.00 178.44 180.92 3hp6 h GLY 581 N 0.48 1.15 0.95 0.83 0.00 -0.69 -2.04 103.07 103.75 3hp6 h GLY 581 Ca 0.13 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 3hp6 h GLY 581 CO -0.01 0.35 -0.11 1.70 0.00 0.00 0.00 176.54 178.47 3hp6 h LYS 582 N 1.02 -0.30 -0.99 4.80 1.63 -1.28 -0.84 116.57 120.61 3hp6 h LYS 582 Ca 0.31 0.02 0.12 0.00 -0.85 0.00 0.00 60.65 60.26 3hp6 h LYS 582 Cb -0.02 0.07 -0.08 0.00 -0.60 0.00 0.00 32.23 31.59 3hp6 h LYS 582 CO -0.10 -0.15 0.63 -0.07 -3.45 0.00 0.00 179.45 176.30 3hp6 h LEU 583 N -0.36 0.90 0.28 5.20 3.38 -1.32 -1.13 115.31 122.26 3hp6 h LEU 583 Ca -0.03 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3hp6 h LEU 583 Cb 0.28 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.90 3hp6 h LEU 583 CO 0.05 0.47 -0.14 -0.61 0.09 0.00 0.00 178.44 178.31 3hp6 h GLN 584 N 0.96 -0.36 -0.11 1.13 5.75 -1.04 -1.17 115.11 120.27 3hp6 h GLN 584 Ca 0.49 0.02 -0.19 0.00 -0.15 0.00 0.00 58.65 58.83 3hp6 h GLN 584 Cb 0.52 0.08 0.01 0.00 1.07 0.00 0.00 27.48 29.16 3hp6 h GLN 584 CO -0.26 -0.02 -0.68 0.66 -2.65 0.00 0.00 178.83 175.88 3hp6 h SER 585 N -0.86 0.79 0.00 -0.69 4.64 -1.11 -0.20 113.55 116.13 3hp6 h SER 585 Ca -0.04 -0.65 -0.06 0.00 -0.47 0.00 0.00 61.79 60.57 3hp6 h SER 585 Cb 0.52 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 3hp6 h SER 585 CO 0.06 1.32 -0.52 0.74 -0.87 0.00 0.00 176.83 177.57 3hp6 h THR 586 N 0.32 0.46 -0.00 2.95 2.02 -1.36 -1.83 112.91 115.46 3hp6 h THR 586 Ca -0.05 -1.46 0.00 0.00 0.77 0.00 0.00 66.41 65.66 3hp6 h THR 586 Cb 1.33 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.72 3hp6 h THR 586 CO 0.14 0.15 -0.71 -1.22 0.37 0.00 0.00 175.52 174.25 3hp6 n TYR 587 N -4.61 0.00 -0.01 3.16 4.02 -0.89 -3.05 117.16 115.79 3hp6 n TYR 587 Ca -0.12 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.75 3hp6 n TYR 587 Cb 0.34 -0.08 -0.01 0.00 -0.02 0.00 0.00 39.34 39.58 3hp6 n TYR 587 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 3hp6 n ILE 588 N -1.17 0.38 -0.14 -0.72 2.08 -0.49 -4.43 119.36 114.86 3hp6 n ILE 588 Ca 0.06 0.29 -0.07 0.00 0.56 0.00 0.00 62.75 63.59 3hp6 n ILE 588 Cb 0.36 -1.52 0.01 0.00 -0.75 0.00 0.00 39.64 37.74 3hp6 n ILE 588 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 3hp6 h GLU 589 N -0.17 0.53 -0.15 0.38 5.08 -1.15 -1.40 114.58 117.70 3hp6 h GLU 589 Ca 0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3hp6 h GLU 589 Cb 0.17 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 3hp6 h GLU 589 CO 0.00 0.35 0.09 0.78 -1.00 0.00 0.00 179.01 179.23 3hp6 h GLY 590 N 0.54 0.21 1.10 -3.84 0.00 -1.24 -2.22 103.07 97.63 3hp6 h GLY 590 Ca 0.17 -0.08 -0.10 0.00 0.00 0.00 0.00 47.33 47.31 3hp6 h GLY 590 CO -0.06 0.08 -0.03 -2.00 0.00 0.00 0.00 176.54 174.53 3hp6 h LEU 591 N 0.19 1.05 -0.98 3.11 5.85 -1.55 -3.00 115.31 119.97 3hp6 h LEU 591 Ca 0.05 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.42 3hp6 h LEU 591 Cb -0.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.74 3hp6 h LEU 591 CO -0.01 1.11 -0.18 -0.07 -0.34 0.00 0.00 178.44 178.96 3hp6 h LEU 592 N 0.96 0.00 -1.11 2.25 3.38 -1.18 -2.01 115.31 117.60 3hp6 h LEU 592 Ca 0.16 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.04 3hp6 h LEU 592 Cb 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 3hp6 h LEU 592 CO 0.04 0.18 -0.40 0.11 0.09 0.00 0.00 178.44 178.46 3hp6 h LYS 593 N 0.00 0.09 0.00 1.13 1.57 -1.25 -3.31 116.57 114.80 3hp6 h LYS 593 Ca -0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 3hp6 h LYS 593 Cb 0.78 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 3hp6 h LYS 593 CO 0.02 0.48 -0.90 1.33 -0.57 0.00 0.00 179.45 179.81 3hp6 n VAL 594 N -4.05 0.00 -1.76 0.50 0.24 -1.08 -4.97 118.33 107.20 3hp6 n VAL 594 Ca -0.02 -0.21 -0.41 0.00 -2.04 0.00 0.00 64.34 61.66 3hp6 n VAL 594 Cb 0.44 0.80 -0.01 0.00 -1.47 0.00 0.00 33.84 33.60 3hp6 n VAL 594 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3hp6 s VAL 595 N -2.47 2.02 -0.49 3.34 0.11 -0.78 -4.73 120.40 117.41 3hp6 s VAL 595 Ca 0.03 0.02 -0.28 0.00 -2.93 0.00 0.00 61.98 58.81 3hp6 s VAL 595 Cb 0.10 -3.01 0.02 0.00 -1.53 0.00 0.00 36.38 31.96 3hp6 s VAL 595 CO 0.57 0.00 1.33 -0.13 -3.33 0.00 0.00 175.10 173.54 3hp6 s ARG 596 N -0.74 3.52 0.50 1.54 0.52 0.15 -4.95 118.95 119.50 3hp6 s ARG 596 Ca 0.62 0.64 0.28 0.00 -0.52 0.00 0.00 55.73 56.75 3hp6 s ARG 596 Cb -0.48 -4.03 1.25 0.00 0.52 0.00 0.00 34.95 32.21 3hp6 s ARG 596 CO 0.50 -1.65 1.96 -1.35 0.02 0.00 0.00 175.30 174.79 3hp6 h PRO 597 N 10.36 0.00 -0.04 3.54 0.11 -1.92 0.88 132.00 144.93 3hp6 h PRO 597 Ca -0.26 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 65.68 3hp6 h PRO 597 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3hp6 h PRO 597 CO 1.13 0.13 -0.73 0.00 -0.21 0.00 0.00 178.00 178.32 3hp6 h ALA 598 N 1.87 0.68 0.00 -0.75 0.00 -1.98 -3.34 119.26 115.74 3hp6 h ALA 598 Ca -0.00 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 54.28 3hp6 h ALA 598 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.25 3hp6 h ALA 598 CO 0.02 0.81 -1.67 0.25 0.00 0.00 0.00 179.25 178.66 3hp6 n THR 599 N -3.77 0.00 -1.40 0.00 -2.24 -0.96 -4.99 114.28 100.91 3hp6 n THR 599 Ca -0.03 -0.36 -0.14 0.00 -2.27 0.00 0.00 64.05 61.25 3hp6 n THR 599 Cb 0.71 0.23 -0.06 0.00 -2.10 0.00 0.00 70.33 69.10 3hp6 n THR 599 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3hp6 n LYS 600 N -2.02 -0.97 -3.63 -0.78 4.76 0.30 -4.86 118.16 110.96 3hp6 n LYS 600 Ca -0.02 0.98 -0.33 0.00 -2.87 0.00 0.00 58.31 56.07 3hp6 n LYS 600 Cb 0.44 -5.07 -0.05 0.00 -1.84 0.00 0.00 35.03 28.51 3hp6 n LYS 600 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 3hp6 s LYS 601 N -3.16 3.67 -0.08 1.97 1.02 -1.22 -0.51 119.74 121.43 3hp6 s LYS 601 Ca 0.00 0.02 -0.01 0.00 0.02 0.00 0.00 55.97 56.01 3hp6 s LYS 601 Cb 0.00 -2.91 -0.03 0.00 -0.52 0.00 0.00 37.83 34.37 3hp6 s LYS 601 CO 0.00 0.51 -0.03 0.14 -0.92 0.00 0.00 175.35 175.05 3hp6 s VAL 602 N -1.54 4.01 -0.41 3.17 -7.23 0.61 -0.67 120.40 118.33 3hp6 s VAL 602 Ca 0.37 -0.36 0.03 0.00 -1.81 0.00 0.00 61.98 60.22 3hp6 s VAL 602 Cb -0.13 -2.67 0.11 0.00 0.56 0.00 0.00 36.38 34.26 3hp6 s VAL 602 CO 0.21 0.59 0.15 -1.00 -0.31 0.00 0.00 175.10 174.74 3hp6 s HIS 603 N -0.74 3.14 0.91 2.82 0.09 -1.26 -1.63 115.29 118.62 3hp6 s HIS 603 Ca 0.11 -2.86 -0.12 0.00 -0.00 0.00 0.00 55.06 52.20 3hp6 s HIS 603 Cb -0.11 -2.64 0.14 0.00 -0.00 0.00 0.00 32.58 29.96 3hp6 s HIS 603 CO 0.02 -0.85 1.10 -0.08 -0.00 0.00 0.00 174.74 174.93 3hp6 s THR 604 N 0.51 2.43 -0.18 1.30 -1.32 -1.26 -4.57 115.64 112.55 3hp6 s THR 604 Ca 0.14 0.14 0.01 0.00 -1.21 0.00 0.00 61.69 60.77 3hp6 s THR 604 Cb -0.22 -2.73 0.02 0.00 -1.51 0.00 0.00 72.50 68.06 3hp6 s THR 604 CO -0.06 -0.18 -0.18 -0.63 -2.21 0.00 0.00 174.62 171.35 3hp6 s ILE 605 N -3.06 1.97 -0.42 5.08 1.01 -0.97 -4.69 121.20 120.13 3hp6 s ILE 605 Ca 0.64 -0.93 -0.29 0.00 0.00 0.00 0.00 60.65 60.07 3hp6 s ILE 605 Cb -0.17 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.51 3hp6 s ILE 605 CO 0.56 0.48 1.12 -0.36 0.00 0.00 0.00 174.94 176.74 3hp6 s PHE 606 N 1.32 2.94 -0.47 3.97 0.08 -1.26 -2.11 117.98 122.44 3hp6 s PHE 606 Ca 0.04 0.90 -0.28 0.00 0.12 0.00 0.00 56.93 57.70 3hp6 s PHE 606 Cb -0.13 -4.16 0.03 0.00 -0.57 0.00 0.00 43.02 38.18 3hp6 s PHE 606 CO -0.12 -1.09 1.09 1.21 -0.10 0.00 0.00 175.22 176.21 3hp6 s ASN 607 N 2.17 6.60 0.00 1.36 3.84 0.56 -4.87 114.94 124.60 3hp6 s ASN 607 Ca 0.47 0.38 0.26 0.00 0.21 0.00 0.00 52.86 54.18 3hp6 s ASN 607 Cb -0.09 -2.53 0.64 0.00 -0.55 0.00 0.00 41.25 38.73 3hp6 s ASN 607 CO 0.26 -1.20 1.50 1.67 -2.79 0.00 0.00 177.10 176.53 3hp6 n GLN 608 N 7.68 0.32 -2.44 0.43 7.27 -1.26 -1.87 117.38 127.51 3hp6 n GLN 608 Ca 0.11 -0.18 -0.15 0.00 0.07 0.00 0.00 57.00 56.85 3hp6 n GLN 608 Cb 0.49 -1.50 0.03 0.00 2.41 0.00 0.00 30.24 31.67 3hp6 n GLN 608 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3hp6 n ALA 609 N -1.18 4.02 0.00 1.69 0.00 -1.26 -4.86 120.51 118.92 3hp6 n ALA 609 Ca 0.08 -3.44 0.00 0.00 0.00 0.00 0.00 53.44 50.08 3hp6 n ALA 609 Cb 0.34 -0.62 0.00 0.00 0.00 0.00 0.00 19.45 19.17 3hp6 n ALA 609 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3hp6 n LEU 610 N -0.56 0.02 -4.79 0.00 0.00 -1.26 -4.86 117.00 105.54 3hp6 n LEU 610 Ca 0.27 0.00 -0.33 0.00 0.00 0.00 0.00 56.01 55.94 3hp6 n LEU 610 Cb 0.85 0.00 -0.00 0.00 0.00 0.00 0.00 43.42 44.27 3hp6 n LEU 610 CO 0.26 -0.09 0.73 0.42 0.00 0.00 0.00 177.39 178.71 3hp6 s THR 611 N -2.00 3.68 -0.97 1.96 -4.23 -1.26 -4.93 115.64 107.90 3hp6 s THR 611 Ca 0.00 0.90 0.29 0.00 -1.18 0.00 0.00 61.69 61.70 3hp6 s THR 611 Cb 0.00 -3.37 0.25 0.00 1.34 0.00 0.00 72.50 70.71 3hp6 s THR 611 CO 0.00 -0.36 1.91 0.00 -0.54 0.00 0.00 174.62 175.63 3hp6 n GLN 612 N -1.62 0.03 0.00 3.99 1.13 -1.26 -3.53 117.38 116.12 3hp6 n GLN 612 Ca 0.09 0.03 0.04 0.00 -1.94 0.00 0.00 57.00 55.22 3hp6 n GLN 612 Cb 0.52 -1.54 -0.02 0.00 0.11 0.00 0.00 30.24 29.32 3hp6 n GLN 612 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 3hp6 n THR 613 N -1.59 0.00 -0.25 5.09 -2.24 -1.26 -4.80 114.28 109.23 3hp6 n THR 613 Ca 0.07 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 3hp6 n THR 613 Cb 0.35 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 3hp6 n THR 613 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hp6 n GLY 614 N 0.97 0.66 3.70 3.38 0.00 -1.23 -3.96 105.19 108.71 3hp6 n GLY 614 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 3hp6 n GLY 614 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hp6 s ARG 615 N -0.75 1.36 0.59 1.61 0.52 -1.26 -4.82 118.95 116.20 3hp6 s ARG 615 Ca 0.00 1.34 -0.09 0.00 -0.52 0.00 0.00 55.73 56.46 3hp6 s ARG 615 Cb 0.00 -1.78 -0.03 0.00 0.52 0.00 0.00 34.95 33.65 3hp6 s ARG 615 CO 0.00 -2.32 0.97 -0.51 0.02 0.00 0.00 175.30 173.46 3hp6 s LEU 616 N -6.38 3.31 0.36 2.53 1.43 -1.26 -4.17 118.68 114.49 3hp6 s LEU 616 Ca 0.65 1.26 0.07 0.00 -1.03 0.00 0.00 54.13 55.07 3hp6 s LEU 616 Cb -0.21 -4.26 -0.07 0.00 0.03 0.00 0.00 46.19 41.69 3hp6 s LEU 616 CO 0.58 -0.84 -0.02 -0.94 0.23 0.00 0.00 176.35 175.36 3hp6 s SER 617 N -4.18 3.40 -0.02 2.29 1.04 -0.78 -4.95 113.70 110.50 3hp6 s SER 617 Ca 0.53 -1.30 0.00 0.00 0.48 0.00 0.00 55.95 55.67 3hp6 s SER 617 Cb -0.11 -0.29 0.02 0.00 0.10 0.00 0.00 66.02 65.74 3hp6 s SER 617 CO 0.51 -0.39 0.01 -0.55 0.98 0.00 0.00 173.24 173.80 3hp6 s SER 618 N -3.60 0.25 0.04 7.02 0.15 -1.26 -0.32 113.70 115.98 3hp6 s SER 618 Ca 0.34 -0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.99 3hp6 s SER 618 Cb 0.07 -0.14 -0.03 0.00 -1.71 0.00 0.00 66.02 64.21 3hp6 s SER 618 CO 0.16 -0.09 -0.04 0.42 1.20 0.00 0.00 173.24 174.88 3hp6 s THR 619 N 0.89 0.29 -1.15 6.45 -4.23 -0.90 -4.01 115.64 112.97 3hp6 s THR 619 Ca -0.08 -1.24 -0.25 0.00 -1.18 0.00 0.00 61.69 58.93 3hp6 s THR 619 Cb -0.12 -0.75 0.01 0.00 1.34 0.00 0.00 72.50 72.99 3hp6 s THR 619 CO -0.02 -0.62 0.75 1.21 -0.54 0.00 0.00 174.62 175.40 3hp6 n GLU 620 N 1.09 -0.86 -3.35 3.99 2.13 -1.26 -2.29 120.64 120.10 3hp6 n GLU 620 Ca -0.20 0.34 -0.28 0.00 0.66 0.00 0.00 57.16 57.67 3hp6 n GLU 620 Cb 0.57 -3.49 -0.03 0.00 0.27 0.00 0.00 31.44 28.76 3hp6 n GLU 620 CO 0.00 0.00 0.00 -1.25 -0.41 0.00 0.00 177.13 175.47 3hp6 s PRO 621 N -6.45 3.60 -0.25 5.31 0.04 -1.26 -4.45 135.00 131.53 3hp6 s PRO 621 Ca 0.47 -0.06 -0.29 0.00 0.04 0.00 0.00 61.00 61.15 3hp6 s PRO 621 Cb -0.20 -2.65 -0.01 0.00 0.04 0.00 0.00 34.50 31.67 3hp6 s PRO 621 CO 0.90 0.20 1.43 1.21 0.04 0.00 0.00 177.00 180.78 3hp6 s ASN 622 N -3.32 6.59 -0.12 6.66 3.84 -1.26 -4.62 114.94 122.71 3hp6 s ASN 622 Ca 0.43 1.44 0.16 0.00 0.21 0.00 0.00 52.86 55.11 3hp6 s ASN 622 Cb -0.11 -2.54 0.62 0.00 -0.55 0.00 0.00 41.25 38.68 3hp6 s ASN 622 CO 0.31 -1.11 1.53 0.18 -2.79 0.00 0.00 177.10 175.23 3hp6 n LEU 623 N 7.81 4.36 -0.81 3.21 4.77 -1.26 -4.26 117.00 130.82 3hp6 n LEU 623 Ca 0.16 -2.55 0.08 0.00 -0.03 0.00 0.00 56.01 53.67 3hp6 n LEU 623 Cb 0.46 -0.52 0.16 0.00 -2.33 0.00 0.00 43.42 41.19 3hp6 n LEU 623 CO 0.63 0.75 0.62 0.00 -1.33 0.00 0.00 177.39 178.06 3hp6 n GLN 624 N 0.61 2.20 -1.19 3.23 6.02 -1.26 -4.45 117.38 122.54 3hp6 n GLN 624 Ca 0.23 -1.97 0.05 0.00 -0.01 0.00 0.00 57.00 55.30 3hp6 n GLN 624 Cb 0.84 -1.36 0.08 0.00 1.02 0.00 0.00 30.24 30.83 3hp6 n GLN 624 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 3hp6 n ASN 625 N 0.94 1.24 -4.73 1.08 6.94 -1.26 -5.01 115.26 114.46 3hp6 n ASN 625 Ca 0.14 -2.65 -0.42 0.00 -0.02 0.00 0.00 54.58 51.63 3hp6 n ASN 625 Cb 0.46 -0.38 -0.03 0.00 -2.36 0.00 0.00 39.78 37.48 3hp6 n ASN 625 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3hp6 s ILE 626 N -1.10 2.72 0.58 1.53 -1.09 -1.26 -4.93 121.20 117.66 3hp6 s ILE 626 Ca 0.35 0.56 -0.20 0.00 -2.23 0.00 0.00 60.65 59.13 3hp6 s ILE 626 Cb 0.38 -3.36 -0.03 0.00 -1.58 0.00 0.00 42.46 37.87 3hp6 s ILE 626 CO -0.13 0.07 1.30 -2.84 -1.23 0.00 0.00 174.94 172.10 3hp6 s PRO 627 N 0.36 2.94 0.00 2.79 0.02 -1.26 -4.91 135.00 134.93 3hp6 s PRO 627 Ca 0.64 2.08 0.00 0.00 0.02 0.00 0.00 61.00 63.73 3hp6 s PRO 627 Cb -0.42 -2.06 0.00 0.00 0.02 0.00 0.00 34.50 32.04 3hp6 s PRO 627 CO 0.37 -1.30 0.00 1.51 -0.33 0.00 0.00 177.00 177.25 3hp6 n ILE 628 N -1.40 0.00 0.14 2.83 3.06 -1.26 -4.10 119.36 118.63 3hp6 n ILE 628 Ca 0.13 0.00 -0.01 0.00 -2.50 0.00 0.00 62.75 60.37 3hp6 n ILE 628 Cb 0.47 0.00 0.20 0.00 0.54 0.00 0.00 39.64 40.85 3hp6 n ILE 628 CO 0.00 0.00 0.00 0.03 -2.50 0.00 0.00 176.55 174.08 3hp6 h ARG 629 N 0.00 0.04 -6.25 9.51 3.08 -1.97 -3.43 114.38 115.36 3hp6 h ARG 629 Ca 0.00 -0.02 -0.69 0.00 0.07 0.00 0.00 59.98 59.34 3hp6 h ARG 629 Cb 0.00 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 29.78 3hp6 h ARG 629 CO 0.00 0.59 -0.82 -0.51 -1.07 0.00 0.00 179.97 178.16 3hp6 s LEU 630 N -7.77 2.42 0.34 3.04 1.43 -1.26 -5.05 118.68 111.83 3hp6 s LEU 630 Ca -0.02 -0.34 0.03 0.00 -1.03 0.00 0.00 54.13 52.77 3hp6 s LEU 630 Cb 0.13 -1.47 0.65 0.00 0.03 0.00 0.00 46.19 45.53 3hp6 s LEU 630 CO 0.76 0.30 1.98 -0.08 0.23 0.00 0.00 176.35 179.54 3hp6 h GLU 631 N 5.65 0.84 0.14 1.70 4.57 -1.99 -1.09 114.58 124.39 3hp6 h GLU 631 Ca -0.41 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 3hp6 h GLU 631 Cb 1.15 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 29.54 3hp6 h GLU 631 CO 0.49 0.55 -0.13 0.93 -1.18 0.00 0.00 179.01 179.68 3hp6 h GLU 632 N 0.86 -0.28 -0.08 1.92 5.08 -1.97 -3.09 114.58 117.03 3hp6 h GLU 632 Ca 0.29 0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.53 3hp6 h GLU 632 Cb 0.07 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 3hp6 h GLU 632 CO -0.08 -0.19 -0.54 0.78 -1.00 0.00 0.00 179.01 177.98 3hp6 h GLY 633 N -0.29 0.25 1.58 -3.84 0.00 -1.87 -3.01 103.07 95.89 3hp6 h GLY 633 Ca -0.00 -0.28 0.06 0.00 0.00 0.00 0.00 47.33 47.11 3hp6 h GLY 633 CO -0.02 0.25 0.16 -0.09 0.00 0.00 0.00 176.54 176.84 3hp6 h ARG 634 N 0.17 0.00 0.00 4.80 2.43 -1.13 -2.12 114.38 118.53 3hp6 h ARG 634 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3hp6 h ARG 634 Cb 1.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 3hp6 h ARG 634 CO 0.08 0.00 0.00 0.87 -1.51 0.00 0.00 179.97 179.41 3hp6 h LYS 635 N 0.00 0.00 -0.55 0.20 1.57 -1.46 -0.84 116.57 115.49 3hp6 h LYS 635 Ca 0.09 0.00 0.16 0.00 -1.87 0.00 0.00 60.65 59.03 3hp6 h LYS 635 Cb 0.41 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 3hp6 h LYS 635 CO -0.00 0.00 0.49 0.82 -0.57 0.00 0.00 179.45 180.19 3hp6 h ILE 636 N 0.00 0.47 0.00 1.86 1.08 -1.58 -1.00 117.51 118.34 3hp6 h ILE 636 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 3hp6 h ILE 636 Cb 0.23 0.63 0.00 0.00 -3.07 0.00 0.00 36.82 34.61 3hp6 h ILE 636 CO 0.00 0.00 0.00 0.54 -0.69 0.00 0.00 178.15 178.00 3hp6 n ARG 637 N -3.95 0.15 0.25 2.37 1.74 -0.32 -1.73 116.66 115.16 3hp6 n ARG 637 Ca 0.11 0.30 0.16 0.00 -0.77 0.00 0.00 57.85 57.65 3hp6 n ARG 637 Cb 0.71 -1.74 0.57 0.00 -1.02 0.00 0.00 32.46 30.97 3hp6 n ARG 637 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 3hp6 h GLN 638 N 0.00 0.00 -0.00 5.56 4.20 -1.37 -2.13 115.11 121.36 3hp6 h GLN 638 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3hp6 h GLN 638 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 3hp6 h GLN 638 CO 0.00 0.00 -0.06 0.00 -0.67 0.00 0.00 178.83 178.10 3hp6 n ALA 639 N -2.04 2.69 -2.81 3.87 0.00 -0.71 -4.68 120.51 116.83 3hp6 n ALA 639 Ca 0.02 -0.27 -0.43 0.00 0.00 0.00 0.00 53.44 52.76 3hp6 n ALA 639 Cb 0.34 -1.36 -0.09 0.00 0.00 0.00 0.00 19.45 18.33 3hp6 n ALA 639 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3hp6 s PHE 640 N -2.28 3.26 0.14 0.00 0.08 -1.06 -0.48 117.98 117.65 3hp6 s PHE 640 Ca 0.35 -0.93 0.08 0.00 0.12 0.00 0.00 56.93 56.55 3hp6 s PHE 640 Cb 0.21 -2.85 -0.04 0.00 -0.57 0.00 0.00 43.02 39.77 3hp6 s PHE 640 CO 0.42 -0.72 -0.18 0.14 -0.10 0.00 0.00 175.22 174.79 3hp6 s VAL 641 N 1.60 1.68 0.49 -0.44 -7.23 -0.76 -1.15 120.40 114.60 3hp6 s VAL 641 Ca 0.04 -1.81 -0.21 0.00 -1.81 0.00 0.00 61.98 58.18 3hp6 s VAL 641 Cb -0.22 -1.72 -0.09 0.00 0.56 0.00 0.00 36.38 34.91 3hp6 s VAL 641 CO 0.07 -0.30 0.82 -2.65 -0.31 0.00 0.00 175.10 172.73 3hp6 n PRO 642 N 0.48 0.94 0.08 4.82 -0.02 -1.26 -3.86 135.00 136.17 3hp6 n PRO 642 Ca -0.15 0.35 0.12 0.00 -2.02 0.00 0.00 63.50 61.80 3hp6 n PRO 642 Cb 0.56 -1.90 0.24 0.00 -0.02 0.00 0.00 33.50 32.39 3hp6 n PRO 642 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3hp6 n SER 643 N 0.40 0.75 -4.30 2.55 3.41 -1.26 -4.81 113.62 110.35 3hp6 n SER 643 Ca 0.11 0.27 -0.17 0.00 -0.26 0.00 0.00 58.87 58.83 3hp6 n SER 643 Cb 0.42 -0.16 -0.10 0.00 -0.26 0.00 0.00 64.21 64.11 3hp6 n SER 643 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3hp6 s GLU 644 N -3.15 1.21 0.53 4.33 0.41 -1.26 -5.07 118.70 115.71 3hp6 s GLU 644 Ca 0.08 -1.51 -0.22 0.00 -0.41 0.00 0.00 54.97 52.90 3hp6 s GLU 644 Cb 0.13 -0.94 -0.06 0.00 -1.78 0.00 0.00 34.13 31.49 3hp6 s GLU 644 CO 0.68 0.15 1.29 0.43 -0.49 0.00 0.00 175.26 177.32 3hp6 n SER 645 N -0.24 2.41 -0.36 -0.19 7.64 -1.26 -3.00 113.62 118.62 3hp6 n SER 645 Ca -0.09 0.98 -0.05 0.00 1.01 0.00 0.00 58.87 60.72 3hp6 n SER 645 Cb 0.60 -1.54 -0.02 0.00 -1.01 0.00 0.00 64.21 62.24 3hp6 n SER 645 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3hp6 n ASP 646 N -0.77 -4.92 -4.91 6.43 8.00 -1.26 -4.98 116.55 114.13 3hp6 n ASP 646 Ca 0.10 0.12 -0.28 0.00 0.71 0.00 0.00 54.79 55.44 3hp6 n ASP 646 Cb 0.44 -2.83 -0.03 0.00 -0.02 0.00 0.00 41.12 38.68 3hp6 n ASP 646 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3hp6 s TRP 647 N -1.72 3.48 0.12 1.24 0.52 -1.16 -1.18 118.94 120.23 3hp6 s TRP 647 Ca 0.00 0.55 0.09 0.00 0.02 0.00 0.00 56.10 56.76 3hp6 s TRP 647 Cb 0.00 -2.03 -0.04 0.00 -1.15 0.00 0.00 33.47 30.25 3hp6 s TRP 647 CO 0.00 0.24 -0.21 -0.51 0.02 0.00 0.00 176.95 176.49 3hp6 s LEU 648 N -3.46 2.33 0.08 2.99 1.43 0.95 -4.74 118.68 118.26 3hp6 s LEU 648 Ca 0.42 -0.73 -0.24 0.00 -1.03 0.00 0.00 54.13 52.55 3hp6 s LEU 648 Cb -0.11 -0.91 -0.06 0.00 0.03 0.00 0.00 46.19 45.14 3hp6 s LEU 648 CO 0.29 0.05 0.75 -0.63 0.23 0.00 0.00 176.35 177.05 3hp6 s ILE 649 N -1.32 4.63 -0.10 -0.59 -1.09 -0.41 -1.85 121.20 120.47 3hp6 s ILE 649 Ca 0.09 1.61 0.03 0.00 -2.23 0.00 0.00 60.65 60.15 3hp6 s ILE 649 Cb -0.09 -4.10 0.00 0.00 -1.58 0.00 0.00 42.46 36.69 3hp6 s ILE 649 CO 0.05 0.42 -0.21 0.12 -1.23 0.00 0.00 174.94 174.09 3hp6 s PHE 650 N -0.44 2.39 -0.06 3.97 5.36 -0.04 -2.02 117.98 127.14 3hp6 s PHE 650 Ca 0.37 -1.02 0.04 0.00 -0.96 0.00 0.00 56.93 55.35 3hp6 s PHE 650 Cb -0.21 -1.62 0.00 0.00 -0.34 0.00 0.00 43.02 40.85 3hp6 s PHE 650 CO 0.23 -0.44 -0.17 0.00 -1.46 0.00 0.00 175.22 173.39 3hp6 s ALA 651 N 0.51 1.54 -0.01 11.12 0.00 0.88 0.58 121.76 136.37 3hp6 s ALA 651 Ca -0.15 -0.64 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3hp6 s ALA 651 Cb -0.17 -0.57 0.00 0.00 0.00 0.00 0.00 23.12 22.38 3hp6 s ALA 651 CO 0.06 0.23 -0.06 0.00 0.00 0.00 0.00 175.76 175.98 3hp6 s ALA 652 N 0.28 0.57 -0.02 0.00 0.00 -0.64 -0.12 121.76 121.83 3hp6 s ALA 652 Ca -0.10 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.65 3hp6 s ALA 652 Cb -0.14 -0.20 0.01 0.00 0.00 0.00 0.00 23.12 22.79 3hp6 s ALA 652 CO 0.04 0.10 -0.01 0.16 0.00 0.00 0.00 175.76 176.05 3hp6 s ASP 653 N 0.11 0.34 0.24 0.00 -4.77 0.11 -0.49 116.67 112.21 3hp6 s ASP 653 Ca -0.01 -0.03 -0.30 0.00 -3.30 0.00 0.00 52.55 48.91 3hp6 s ASP 653 Cb -0.05 -0.13 -0.10 0.00 -1.09 0.00 0.00 42.92 41.54 3hp6 s ASP 653 CO -0.00 -0.05 1.43 -0.31 0.70 0.00 0.00 175.17 176.94 3hp6 s TYR 654 N 0.56 3.05 -0.26 2.11 1.51 -0.03 -1.04 117.35 123.26 3hp6 s TYR 654 Ca -0.05 1.04 -0.23 0.00 -1.01 0.00 0.00 57.07 56.81 3hp6 s TYR 654 Cb -0.08 -3.80 -0.01 0.00 -0.11 0.00 0.00 41.96 37.97 3hp6 s TYR 654 CO -0.01 -2.59 0.78 0.45 -1.11 0.00 0.00 175.55 173.06 3hp6 s SER 655 N 0.39 6.74 -1.60 2.29 0.15 0.11 -4.38 113.70 117.40 3hp6 s SER 655 Ca 0.59 0.87 -0.16 0.00 0.70 0.00 0.00 55.95 57.96 3hp6 s SER 655 Cb -0.41 -2.41 0.12 0.00 -1.71 0.00 0.00 66.02 61.61 3hp6 s SER 655 CO 0.42 -0.51 0.86 0.00 1.20 0.00 0.00 173.24 175.21 3hp6 n GLN 656 N 6.00 -4.28 -0.32 5.44 6.02 -1.26 -4.60 117.38 124.38 3hp6 n GLN 656 Ca 0.04 0.49 0.06 0.00 -0.01 0.00 0.00 57.00 57.58 3hp6 n GLN 656 Cb 0.48 -5.30 0.22 0.00 1.02 0.00 0.00 30.24 26.66 3hp6 n GLN 656 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 3hp6 h ILE 657 N -1.73 0.86 -0.67 5.09 2.10 -1.93 -2.39 117.51 118.84 3hp6 h ILE 657 Ca -0.57 -0.28 -0.06 0.00 1.08 0.00 0.00 64.86 65.02 3hp6 h ILE 657 Cb 1.37 -0.04 -0.03 0.00 -1.09 0.00 0.00 36.82 37.03 3hp6 h ILE 657 CO 0.71 0.15 0.18 -0.33 -1.08 0.00 0.00 178.15 177.78 3hp6 h GLU 658 N 0.82 1.04 -0.11 2.19 5.08 -1.90 0.23 114.58 121.94 3hp6 h GLU 658 Ca 0.46 -0.23 -0.13 0.00 -1.00 0.00 0.00 59.36 58.46 3hp6 h GLU 658 Cb 0.52 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3hp6 h GLU 658 CO -0.29 0.91 -0.50 -0.07 -1.00 0.00 0.00 179.01 178.06 3hp6 h LEU 659 N 1.00 0.31 -0.52 1.33 3.38 -1.84 0.97 115.31 119.93 3hp6 h LEU 659 Ca 0.21 -0.15 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 3hp6 h LEU 659 Cb 0.33 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3hp6 h LEU 659 CO -0.00 0.76 -0.00 0.03 0.09 0.00 0.00 178.44 179.32 3hp6 h ARG 660 N 0.23 0.93 -0.67 1.13 3.08 -1.12 -0.44 114.38 117.51 3hp6 h ARG 660 Ca 0.01 -0.30 -0.05 0.00 0.07 0.00 0.00 59.98 59.71 3hp6 h ARG 660 Cb 0.97 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.91 3hp6 h ARG 660 CO 0.08 0.95 0.20 0.28 -1.07 0.00 0.00 179.97 180.41 3hp6 h VAL 661 N 0.80 1.25 -0.78 2.04 2.07 -0.78 -1.83 116.25 119.01 3hp6 h VAL 661 Ca 0.15 -0.86 -0.04 0.00 0.82 0.00 0.00 66.70 66.77 3hp6 h VAL 661 Cb 0.53 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 3hp6 h VAL 661 CO 0.03 0.33 0.32 0.25 0.02 0.00 0.00 177.57 178.52 3hp6 h LEU 662 N 0.99 1.07 -0.07 2.57 5.85 -0.56 -1.28 115.31 123.88 3hp6 h LEU 662 Ca 0.22 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.78 3hp6 h LEU 662 Cb 0.29 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 3hp6 h LEU 662 CO -0.01 0.94 0.01 0.00 -0.34 0.00 0.00 178.44 179.04 3hp6 h ALA 663 N 1.17 0.07 0.11 1.25 0.00 -0.57 0.25 119.26 121.54 3hp6 h ALA 663 Ca 0.26 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.20 3hp6 h ALA 663 Cb 0.20 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3hp6 h ALA 663 CO -0.02 -0.46 -0.20 1.25 0.00 0.00 0.00 179.25 179.81 3hp6 h HIS 664 N 0.04 -0.53 -0.34 0.00 -0.00 -1.14 -0.93 115.15 112.25 3hp6 h HIS 664 Ca 0.03 0.01 -0.17 0.00 -0.00 0.00 0.00 60.37 60.24 3hp6 h HIS 664 Cb 0.03 0.22 -0.00 0.00 -0.00 0.00 0.00 27.41 27.66 3hp6 h HIS 664 CO -0.11 -0.29 -0.45 0.82 -0.00 0.00 0.00 177.93 177.90 3hp6 h ILE 665 N -0.38 1.27 0.00 6.26 2.04 -1.14 -3.27 117.51 122.29 3hp6 h ILE 665 Ca 0.02 -1.63 -0.14 0.00 1.00 0.00 0.00 64.86 64.12 3hp6 h ILE 665 Cb 0.40 1.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.96 3hp6 h ILE 665 CO -0.11 0.54 -0.65 0.00 0.00 0.00 0.00 178.15 177.93 3hp6 h ALA 666 N 0.73 0.60 -5.95 1.87 0.00 -0.97 -3.48 119.26 112.06 3hp6 h ALA 666 Ca 0.04 -0.59 -0.41 0.00 0.00 0.00 0.00 54.91 53.95 3hp6 h ALA 666 Cb 1.05 -0.10 0.09 0.00 0.00 0.00 0.00 17.79 18.83 3hp6 h ALA 666 CO 0.11 0.82 -0.73 0.39 0.00 0.00 0.00 179.25 179.83 3hp6 n GLU 667 N -3.30 -6.91 -2.63 0.00 1.02 -0.35 -4.77 120.64 103.71 3hp6 n GLU 667 Ca 0.01 0.76 -0.43 0.00 -0.02 0.00 0.00 57.16 57.48 3hp6 n GLU 667 Cb 0.78 -5.73 -0.02 0.00 -0.02 0.00 0.00 31.44 26.46 3hp6 n GLU 667 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 3hp6 s ASP 668 N -3.58 7.08 0.12 1.62 -1.08 -1.24 -4.89 116.67 114.70 3hp6 s ASP 668 Ca 0.46 1.43 -0.27 0.00 -0.52 0.00 0.00 52.55 53.65 3hp6 s ASP 668 Cb -0.21 -2.54 -0.06 0.00 -1.46 0.00 0.00 42.92 38.64 3hp6 s ASP 668 CO 0.76 -0.68 1.63 0.44 0.52 0.00 0.00 175.17 177.84 3hp6 h ASP 669 N 7.55 -0.80 -0.16 -0.34 3.32 -1.93 -0.24 116.42 123.82 3hp6 h ASP 669 Ca -0.20 0.10 0.02 0.00 0.02 0.00 0.00 57.03 56.97 3hp6 h ASP 669 Cb 1.07 0.32 -0.02 0.00 0.22 0.00 0.00 39.33 40.92 3hp6 h ASP 669 CO 0.98 -0.35 0.05 0.78 -1.72 0.00 0.00 179.24 178.98 3hp6 h ASN 670 N -0.44 0.05 -0.43 6.45 2.35 -1.92 -1.04 115.58 120.59 3hp6 h ASN 670 Ca 0.05 0.02 0.01 0.00 -0.55 0.00 0.00 56.30 55.83 3hp6 h ASN 670 Cb 0.51 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.87 3hp6 h ASN 670 CO -0.21 0.05 0.28 0.25 -1.65 0.00 0.00 177.43 176.15 3hp6 h LEU 671 N 0.12 0.47 -0.78 1.61 5.85 -1.84 -2.58 115.31 118.16 3hp6 h LEU 671 Ca 0.07 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 3hp6 h LEU 671 Cb 0.04 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 3hp6 h LEU 671 CO -0.07 0.34 0.44 0.24 -0.34 0.00 0.00 178.44 179.05 3hp6 h MET 672 N 0.56 1.08 -0.43 1.25 2.86 -0.77 -2.83 114.93 116.66 3hp6 h MET 672 Ca 0.16 -0.12 0.04 0.00 -2.06 0.00 0.00 59.70 57.72 3hp6 h MET 672 Cb -0.05 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.36 3hp6 h MET 672 CO -0.04 0.79 0.20 1.49 1.06 0.00 0.00 176.91 180.41 3hp6 h GLU 673 N 1.08 0.40 -0.59 1.72 4.57 -1.04 -2.21 114.58 118.51 3hp6 h GLU 673 Ca 0.28 -0.02 0.12 0.00 -1.18 0.00 0.00 59.36 58.55 3hp6 h GLU 673 Cb 0.02 -0.09 -0.11 0.00 -0.16 0.00 0.00 28.75 28.41 3hp6 h GLU 673 CO -0.05 0.27 -0.10 0.00 -1.18 0.00 0.00 179.01 177.95 3hp6 h ALA 674 N 1.23 0.45 0.02 2.92 0.00 -1.21 -2.03 119.26 120.65 3hp6 h ALA 674 Ca 0.19 0.22 -0.22 0.00 0.00 0.00 0.00 54.91 55.10 3hp6 h ALA 674 Cb 0.11 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3hp6 h ALA 674 CO -0.14 -0.42 -0.96 0.74 0.00 0.00 0.00 179.25 178.47 3hp6 h PHE 675 N 0.03 0.37 -0.50 0.00 -1.00 -1.45 -0.09 116.94 114.31 3hp6 h PHE 675 Ca 0.29 -0.22 -0.03 0.00 2.81 0.00 0.00 57.97 60.82 3hp6 h PHE 675 Cb 0.46 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.96 3hp6 h PHE 675 CO -0.45 1.06 0.16 0.00 -1.61 0.00 0.00 178.31 177.48 3hp6 h ARG 676 N 0.12 0.73 -0.38 1.51 3.08 -1.16 -2.59 114.38 115.70 3hp6 h ARG 676 Ca -0.06 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 59.87 3hp6 h ARG 676 Cb 1.61 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.54 3hp6 h ARG 676 CO 0.15 0.63 0.00 0.54 -1.07 0.00 0.00 179.97 180.22 3hp6 n ARG 677 N -4.32 2.06 -3.04 0.04 1.74 -0.79 -4.94 116.66 107.41 3hp6 n ARG 677 Ca 0.04 -1.63 -0.22 0.00 -0.77 0.00 0.00 57.85 55.27 3hp6 n ARG 677 Cb 0.18 -1.40 0.02 0.00 -1.02 0.00 0.00 32.46 30.24 3hp6 n ARG 677 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3hp6 n ASP 678 N 0.83 -5.24 -4.84 0.55 -0.08 -0.98 -4.98 116.55 101.82 3hp6 n ASP 678 Ca 0.17 -0.26 -0.32 0.00 -1.51 0.00 0.00 54.79 52.87 3hp6 n ASP 678 Cb 0.41 -4.27 0.01 0.00 2.34 0.00 0.00 41.12 39.61 3hp6 n ASP 678 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 3hp6 s LEU 679 N -6.51 3.35 -0.36 -2.67 1.43 -0.07 -5.01 118.68 108.84 3hp6 s LEU 679 Ca 0.29 1.58 -0.26 0.00 -1.03 0.00 0.00 54.13 54.71 3hp6 s LEU 679 Cb -0.14 -4.50 0.01 0.00 0.03 0.00 0.00 46.19 41.60 3hp6 s LEU 679 CO 0.36 -1.00 0.95 -0.62 0.23 0.00 0.00 176.35 176.27 3hp6 s ASP 680 N -3.56 6.72 0.33 2.29 -1.08 -1.26 -4.70 116.67 115.41 3hp6 s ASP 680 Ca 0.58 0.66 0.09 0.00 -0.52 0.00 0.00 52.55 53.37 3hp6 s ASP 680 Cb -0.12 -2.48 0.59 0.00 -1.46 0.00 0.00 42.92 39.44 3hp6 s ASP 680 CO 0.46 -0.86 1.77 -0.29 0.52 0.00 0.00 175.17 176.76 3hp6 h ILE 681 N 5.81 1.29 -0.34 4.11 6.09 -1.95 -1.93 117.51 130.58 3hp6 h ILE 681 Ca -0.23 -1.38 -0.15 0.00 -1.37 0.00 0.00 64.86 61.73 3hp6 h ILE 681 Cb 1.08 1.66 -0.00 0.00 0.47 0.00 0.00 36.82 40.02 3hp6 h ILE 681 CO 0.99 0.41 -0.37 0.45 -3.07 0.00 0.00 178.15 176.55 3hp6 h HIS 682 N 0.12 1.03 -0.57 2.19 3.86 -1.92 -1.79 115.15 118.07 3hp6 h HIS 682 Ca 0.01 -0.32 -0.04 0.00 -1.16 0.00 0.00 60.37 58.87 3hp6 h HIS 682 Cb 0.72 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.95 3hp6 h HIS 682 CO 0.01 1.12 0.22 1.15 0.86 0.00 0.00 177.93 181.29 3hp6 h THR 683 N 0.65 1.23 -0.30 2.45 2.02 -1.83 -1.82 112.91 115.30 3hp6 h THR 683 Ca 0.05 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.51 3hp6 h THR 683 Cb 0.96 0.63 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 3hp6 h THR 683 CO 0.09 0.28 0.18 0.50 0.37 0.00 0.00 175.52 176.94 3hp6 h LYS 684 N 0.79 0.42 -0.44 6.66 1.63 -1.31 -0.96 116.57 123.35 3hp6 h LYS 684 Ca 0.19 -0.04 -0.01 0.00 -0.85 0.00 0.00 60.65 59.93 3hp6 h LYS 684 Cb 0.22 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.74 3hp6 h LYS 684 CO -0.01 0.33 0.22 1.15 -3.45 0.00 0.00 179.45 177.69 3hp6 h THR 685 N 0.38 1.17 -0.50 1.00 2.02 -1.27 -1.16 112.91 114.56 3hp6 h THR 685 Ca 0.11 -0.48 0.10 0.00 0.77 0.00 0.00 66.41 66.91 3hp6 h THR 685 Cb 0.03 0.68 -0.09 0.00 -1.74 0.00 0.00 68.15 67.03 3hp6 h THR 685 CO -0.02 0.19 -0.09 0.00 0.37 0.00 0.00 175.52 175.96 3hp6 h ALA 686 N 1.07 0.37 -0.59 6.16 0.00 -1.09 0.10 119.26 125.28 3hp6 h ALA 686 Ca 0.15 0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.26 3hp6 h ALA 686 Cb 0.10 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 3hp6 h ALA 686 CO -0.02 -0.43 0.39 0.52 0.00 0.00 0.00 179.25 179.71 3hp6 h MET 687 N 0.03 0.76 -0.05 0.00 2.07 -0.52 -0.87 114.93 116.35 3hp6 h MET 687 Ca 0.25 -0.05 -0.21 0.00 -2.07 0.00 0.00 59.70 57.62 3hp6 h MET 687 Cb 0.38 -0.17 0.01 0.00 -1.87 0.00 0.00 31.60 29.95 3hp6 h MET 687 CO -0.50 0.50 -0.80 -0.44 1.07 0.00 0.00 176.91 176.75 3hp6 h ASP 688 N 0.78 0.79 0.91 1.22 3.45 0.03 -2.44 116.42 121.16 3hp6 h ASP 688 Ca 0.22 -0.70 -0.19 0.00 0.43 0.00 0.00 57.03 56.78 3hp6 h ASP 688 Cb -0.06 -0.24 -0.03 0.00 -0.56 0.00 0.00 39.33 38.44 3hp6 h ASP 688 CO -0.05 1.38 -1.16 0.16 -1.57 0.00 0.00 179.24 178.00 3hp6 h ILE 689 N 0.27 0.97 -0.02 0.35 3.07 -0.68 -3.21 117.51 118.25 3hp6 h ILE 689 Ca -0.09 -2.56 0.00 0.00 1.55 0.00 0.00 64.86 63.76 3hp6 h ILE 689 Cb 1.46 2.42 0.00 0.00 -0.27 0.00 0.00 36.82 40.42 3hp6 h ILE 689 CO 0.16 0.55 -0.06 0.49 -1.05 0.00 0.00 178.15 178.24 3hp6 n PHE 690 N -3.12 0.00 -4.10 0.16 3.72 -0.35 -4.73 117.46 109.04 3hp6 n PHE 690 Ca -0.06 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.05 3hp6 n PHE 690 Cb 0.89 -0.02 -0.05 0.00 -0.94 0.00 0.00 39.48 39.36 3hp6 n PHE 690 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3hp6 n GLN 691 N 0.31 -2.10 -4.46 -1.08 6.02 -0.97 -4.98 117.38 110.12 3hp6 n GLN 691 Ca 0.16 0.26 -0.22 0.00 -0.01 0.00 0.00 57.00 57.19 3hp6 n GLN 691 Cb 0.41 -4.03 -0.11 0.00 1.02 0.00 0.00 30.24 27.54 3hp6 n GLN 691 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 3hp6 s VAL 692 N -4.11 1.48 0.91 5.09 -7.23 -0.96 -5.05 120.40 110.53 3hp6 s VAL 692 Ca 0.04 -2.05 -0.12 0.00 -1.81 0.00 0.00 61.98 58.03 3hp6 s VAL 692 Cb -0.02 -2.65 0.14 0.00 0.56 0.00 0.00 36.38 34.41 3hp6 s VAL 692 CO 0.94 -0.14 1.13 -0.94 -0.31 0.00 0.00 175.10 175.78 3hp6 s SER 693 N -3.49 3.46 0.14 4.85 1.04 -1.26 -4.66 113.70 113.78 3hp6 s SER 693 Ca 0.33 0.99 -0.15 0.00 0.48 0.00 0.00 55.95 57.61 3hp6 s SER 693 Cb 0.07 -1.58 0.01 0.00 0.10 0.00 0.00 66.02 64.61 3hp6 s SER 693 CO 0.14 -2.58 1.67 -0.08 0.98 0.00 0.00 173.24 173.36 3hp6 h GLU 694 N -1.52 0.68 0.00 4.02 4.81 -1.96 -2.97 114.58 117.64 3hp6 h GLU 694 Ca -0.51 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 58.58 3hp6 h GLU 694 Cb 1.33 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.61 3hp6 h GLU 694 CO 0.61 0.65 -0.03 -0.44 -0.73 0.00 0.00 179.01 179.08 3hp6 h ASP 695 N 0.58 0.00 1.59 1.04 3.32 -2.01 -2.61 116.42 118.33 3hp6 h ASP 695 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3hp6 h ASP 695 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.80 3hp6 h ASP 695 CO -0.01 0.03 0.00 -0.33 -1.72 0.00 0.00 179.24 177.21 3hp6 h GLU 696 N 0.00 0.00 -6.24 3.56 5.08 -1.91 -3.44 114.58 111.62 3hp6 h GLU 696 Ca -0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 3hp6 h GLU 696 Cb 0.35 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 3hp6 h GLU 696 CO 0.00 0.00 1.22 0.08 -1.00 0.00 0.00 179.01 179.31 3hp6 s VAL 697 N -3.25 3.39 0.50 3.13 1.01 -0.98 -5.01 120.40 119.18 3hp6 s VAL 697 Ca 0.07 0.45 -0.11 0.00 0.00 0.00 0.00 61.98 62.39 3hp6 s VAL 697 Cb 0.08 -3.38 -0.06 0.00 0.00 0.00 0.00 36.38 33.03 3hp6 s VAL 697 CO 0.61 -0.14 0.89 0.42 0.00 0.00 0.00 175.10 176.88 3hp6 s THR 698 N 5.47 4.72 0.48 3.92 -4.23 -1.26 -4.92 115.64 119.82 3hp6 s THR 698 Ca 0.81 0.76 0.22 0.00 -1.18 0.00 0.00 61.69 62.30 3hp6 s THR 698 Cb -0.32 -3.79 0.40 0.00 1.34 0.00 0.00 72.50 70.14 3hp6 s THR 698 CO 0.33 -0.77 1.92 -0.65 -0.54 0.00 0.00 174.62 174.91 3hp6 h PRO 699 N 0.62 0.21 -0.57 3.99 0.11 -2.00 0.65 132.00 135.01 3hp6 h PRO 699 Ca -0.46 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.52 3hp6 h PRO 699 Cb 1.19 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 3hp6 h PRO 699 CO 0.62 0.14 -0.08 -0.97 -0.21 0.00 0.00 178.00 177.51 3hp6 h ASN 700 N 0.22 1.06 0.22 -2.05 -1.24 -2.00 -2.60 115.58 109.19 3hp6 h ASN 700 Ca 0.37 -0.34 -0.10 0.00 0.71 0.00 0.00 56.30 56.95 3hp6 h ASN 700 Cb 1.14 -0.29 -0.01 0.00 0.73 0.00 0.00 38.32 39.89 3hp6 h ASN 700 CO -0.08 1.14 -0.37 0.24 -1.29 0.00 0.00 177.43 177.08 3hp6 h MET 701 N 0.95 0.22 -0.32 6.67 2.86 -1.30 -1.73 114.93 122.27 3hp6 h MET 701 Ca 0.15 -0.09 -0.06 0.00 -2.06 0.00 0.00 59.70 57.64 3hp6 h MET 701 Cb 0.65 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 3hp6 h MET 701 CO 0.04 0.57 -0.04 -0.09 1.06 0.00 0.00 176.91 178.45 3hp6 h ARG 702 N 0.19 0.59 -0.57 1.72 2.43 -1.12 -1.71 114.38 115.90 3hp6 h ARG 702 Ca 0.02 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 58.98 3hp6 h ARG 702 Cb 0.75 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.23 3hp6 h ARG 702 CO 0.06 0.75 0.33 0.00 -1.51 0.00 0.00 179.97 179.60 3hp6 h ARG 703 N 0.38 0.79 -0.86 0.20 3.08 -1.14 0.23 114.38 117.05 3hp6 h ARG 703 Ca 0.09 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 3hp6 h ARG 703 Cb 0.51 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.36 3hp6 h ARG 703 CO 0.02 0.58 0.51 1.96 -1.07 0.00 0.00 179.97 181.97 3hp6 h GLN 704 N 0.77 1.18 -0.23 0.04 4.20 -1.34 -2.04 115.11 117.69 3hp6 h GLN 704 Ca 0.20 -0.11 -0.12 0.00 0.06 0.00 0.00 58.65 58.67 3hp6 h GLN 704 Cb 0.01 -0.24 -0.01 0.00 0.30 0.00 0.00 27.48 27.54 3hp6 h GLN 704 CO -0.04 0.84 -0.38 0.00 -0.67 0.00 0.00 178.83 178.58 3hp6 h ALA 705 N 1.36 0.91 -0.75 3.87 0.00 -0.68 -1.53 119.26 122.44 3hp6 h ALA 705 Ca 0.31 -0.42 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 3hp6 h ALA 705 Cb -0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3hp6 h ALA 705 CO -0.06 0.63 0.25 -0.22 0.00 0.00 0.00 179.25 179.86 3hp6 h LYS 706 N 0.44 1.15 -0.46 0.00 3.64 -0.19 0.17 116.57 121.33 3hp6 h LYS 706 Ca 0.04 -0.23 -0.09 0.00 -1.27 0.00 0.00 60.65 59.09 3hp6 h LYS 706 Cb 0.86 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.49 3hp6 h LYS 706 CO 0.07 0.96 -0.10 0.00 -2.27 0.00 0.00 179.45 178.12 3hp6 h ALA 707 N 1.16 0.96 0.02 5.00 0.00 -1.17 -0.86 119.26 124.37 3hp6 h ALA 707 Ca 0.25 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3hp6 h ALA 707 Cb 0.28 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3hp6 h ALA 707 CO -0.01 0.61 -0.01 0.28 0.00 0.00 0.00 179.25 180.12 3hp6 h VAL 708 N 0.75 1.05 -1.01 0.00 2.07 -0.95 -1.62 116.25 116.54 3hp6 h VAL 708 Ca 0.13 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.46 3hp6 h VAL 708 Cb 0.59 1.19 -0.05 0.00 -1.52 0.00 0.00 31.29 31.50 3hp6 h VAL 708 CO 0.04 0.05 0.66 0.78 0.02 0.00 0.00 177.57 179.12 3hp6 h ASN 709 N -0.12 1.12 -0.41 0.57 2.35 -0.34 -0.87 115.58 117.88 3hp6 h ASN 709 Ca -0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 3hp6 h ASN 709 Cb 0.11 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.21 3hp6 h ASN 709 CO 0.00 0.79 0.00 -1.22 -1.65 0.00 0.00 177.43 175.35 3hp6 n TYR 710 N -4.42 0.55 -0.05 1.19 4.01 -0.36 -4.42 117.16 113.67 3hp6 n TYR 710 Ca 0.13 -0.27 -0.10 0.00 -0.16 0.00 0.00 57.90 57.49 3hp6 n TYR 710 Cb 0.06 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.05 3hp6 n TYR 710 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hp6 n GLY 711 N 1.30 -0.16 0.06 2.72 0.00 -0.62 -4.73 105.19 103.76 3hp6 n GLY 711 Ca 0.17 -0.05 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 3hp6 n GLY 711 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hp6 h ILE 712 N -0.30 1.04 -0.07 -0.61 2.04 -1.40 -1.42 117.51 116.78 3hp6 h ILE 712 Ca -0.25 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.41 3hp6 h ILE 712 Cb 1.25 1.19 -0.00 0.00 -0.74 0.00 0.00 36.82 38.51 3hp6 h ILE 712 CO -0.14 0.06 0.06 1.62 0.00 0.00 0.00 178.15 179.76 3hp6 h VAL 713 N -0.14 0.68 -0.68 1.67 3.04 -1.82 0.37 116.25 119.37 3hp6 h VAL 713 Ca -0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3hp6 h VAL 713 Cb 0.12 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 30.35 3hp6 h VAL 713 CO 0.01 0.00 0.00 -1.22 -1.01 0.00 0.00 177.57 175.35 3hp6 n TYR 714 N -4.09 1.02 -0.10 3.17 4.01 -0.99 -4.74 117.16 115.44 3hp6 n TYR 714 Ca -0.01 -0.49 0.00 0.00 -0.16 0.00 0.00 57.90 57.24 3hp6 n TYR 714 Cb 0.17 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 3hp6 n TYR 714 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hp6 n GLY 715 N 1.52 0.94 3.68 2.72 0.00 0.12 -4.79 105.19 109.37 3hp6 n GLY 715 Ca 0.24 -0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.79 3hp6 n GLY 715 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3hp6 n ILE 716 N -2.10 3.02 -2.71 -0.61 3.06 -0.57 -5.00 119.36 114.44 3hp6 n ILE 716 Ca 0.00 -0.50 -0.21 0.00 -2.50 0.00 0.00 62.75 59.54 3hp6 n ILE 716 Cb 0.00 -1.43 0.05 0.00 0.54 0.00 0.00 39.64 38.80 3hp6 n ILE 716 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3hp6 s SER 717 N -0.79 5.14 0.21 9.51 1.04 -1.26 -4.82 113.70 122.73 3hp6 s SER 717 Ca 0.66 -0.21 -0.07 0.00 0.48 0.00 0.00 55.95 56.81 3hp6 s SER 717 Cb -0.48 -0.58 0.14 0.00 0.10 0.00 0.00 66.02 65.20 3hp6 s SER 717 CO 0.54 -1.24 1.70 -2.24 0.98 0.00 0.00 173.24 172.98 3hp6 h ASP 718 N 0.05 1.02 0.01 7.02 -0.00 -1.93 -1.02 116.42 121.58 3hp6 h ASP 718 Ca -0.40 -0.25 0.03 0.00 -0.00 0.00 0.00 57.03 56.42 3hp6 h ASP 718 Cb 1.29 -0.27 -0.04 0.00 -0.00 0.00 0.00 39.33 40.30 3hp6 h ASP 718 CO 0.48 1.02 -0.25 0.22 -0.00 0.00 0.00 179.24 180.71 3hp6 h TYR 719 N 0.99 -0.67 -0.32 4.15 3.20 -1.95 0.18 116.97 122.56 3hp6 h TYR 719 Ca 0.19 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.11 3hp6 h TYR 719 Cb 0.45 0.30 -0.03 0.00 1.54 0.00 0.00 36.73 38.99 3hp6 h TYR 719 CO 0.03 -0.34 0.16 0.78 -1.64 0.00 0.00 178.16 177.15 3hp6 h GLY 720 N -0.40 0.43 1.05 1.82 0.00 -1.88 0.80 103.07 104.89 3hp6 h GLY 720 Ca 0.06 -0.12 0.01 0.00 0.00 0.00 0.00 47.33 47.28 3hp6 h GLY 720 CO -0.21 0.09 0.62 -2.00 0.00 0.00 0.00 176.54 175.04 3hp6 h LEU 721 N 0.34 1.11 -0.32 3.11 5.85 -1.05 0.27 115.31 124.61 3hp6 h LEU 721 Ca 0.13 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.75 3hp6 h LEU 721 Cb 0.04 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 3hp6 h LEU 721 CO -0.09 0.82 -0.05 0.00 -0.34 0.00 0.00 178.44 178.78 3hp6 h ALA 722 N 1.38 0.44 -0.38 1.25 0.00 0.08 -2.41 119.26 119.63 3hp6 h ALA 722 Ca 0.35 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 3hp6 h ALA 722 Cb -0.13 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3hp6 h ALA 722 CO -0.07 0.25 -0.11 1.96 0.00 0.00 0.00 179.25 181.27 3hp6 h GLN 723 N 0.39 0.75 -0.13 0.00 1.08 -0.62 -0.72 115.11 115.86 3hp6 h GLN 723 Ca 0.09 -0.30 -0.11 0.00 -1.45 0.00 0.00 58.65 56.88 3hp6 h GLN 723 Cb 0.53 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 3hp6 h GLN 723 CO 0.03 0.90 -0.41 -0.91 -0.95 0.00 0.00 178.83 177.49 3hp6 h ASN 724 N 0.55 0.31 -0.02 1.46 2.35 -0.93 -3.07 115.58 116.23 3hp6 h ASN 724 Ca 0.09 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 3hp6 h ASN 724 Cb 0.64 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.92 3hp6 h ASN 724 CO 0.04 0.69 -0.12 0.18 -1.65 0.00 0.00 177.43 176.57 3hp6 n LEU 725 N -4.03 2.44 -3.71 1.61 4.77 -0.91 -5.00 117.00 112.18 3hp6 n LEU 725 Ca -0.01 -0.93 -0.25 0.00 -0.03 0.00 0.00 56.01 54.79 3hp6 n LEU 725 Cb 0.49 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.60 3hp6 n LEU 725 CO 0.42 0.43 -0.10 -3.20 -1.33 0.00 0.00 177.39 173.61 3hp6 n ASN 726 N 0.79 -2.70 -4.41 -1.43 5.15 -0.35 -5.01 115.26 107.30 3hp6 n ASN 726 Ca 0.11 -0.91 -0.22 0.00 -0.60 0.00 0.00 54.58 52.95 3hp6 n ASN 726 Cb 0.48 -3.73 -0.10 0.00 -0.53 0.00 0.00 39.78 35.90 3hp6 n ASN 726 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 3hp6 s ILE 727 N -3.65 1.08 0.38 -1.44 -4.36 -0.75 -5.05 121.20 107.41 3hp6 s ILE 727 Ca 0.19 -2.00 -0.27 0.00 -0.26 0.00 0.00 60.65 58.30 3hp6 s ILE 727 Cb -0.06 -2.71 -0.09 0.00 1.25 0.00 0.00 42.46 40.85 3hp6 s ILE 727 CO 0.84 0.00 1.31 -0.94 0.24 0.00 0.00 174.94 176.39 3hp6 s SER 728 N -3.51 6.49 0.19 4.36 1.04 -1.26 -4.63 113.70 116.38 3hp6 s SER 728 Ca 0.34 2.69 -0.11 0.00 0.48 0.00 0.00 55.95 59.35 3hp6 s SER 728 Cb 0.08 -2.64 0.12 0.00 0.10 0.00 0.00 66.02 63.67 3hp6 s SER 728 CO 0.15 -0.73 1.81 -0.09 0.98 0.00 0.00 173.24 175.36 3hp6 h ARG 729 N 2.95 0.93 -0.71 4.02 2.43 -1.91 -0.85 114.38 121.24 3hp6 h ARG 729 Ca -0.49 -0.10 0.09 0.00 -0.81 0.00 0.00 59.98 58.66 3hp6 h ARG 729 Cb 1.24 -0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 30.53 3hp6 h ARG 729 CO 0.64 0.69 0.36 -0.22 -1.51 0.00 0.00 179.97 179.93 3hp6 h LYS 730 N 0.92 0.60 -0.27 0.20 3.64 -1.94 -0.28 116.57 119.44 3hp6 h LYS 730 Ca 0.24 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.42 3hp6 h LYS 730 Cb 0.02 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 3hp6 h LYS 730 CO -0.04 0.39 -0.48 0.93 -2.27 0.00 0.00 179.45 177.98 3hp6 h GLU 731 N 0.61 0.73 -0.23 1.90 5.08 -1.87 -2.30 114.58 118.50 3hp6 h GLU 731 Ca 0.34 -0.43 0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3hp6 h GLU 731 Cb 0.34 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 3hp6 h GLU 731 CO -0.26 1.05 -0.00 0.00 -1.00 0.00 0.00 179.01 178.80 3hp6 h ALA 732 N 0.88 0.20 -0.71 3.43 0.00 -0.51 0.07 119.26 122.62 3hp6 h ALA 732 Ca 0.03 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.05 3hp6 h ALA 732 Cb 1.05 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 3hp6 h ALA 732 CO 0.10 -0.43 0.47 0.00 0.00 0.00 0.00 179.25 179.39 3hp6 h ALA 733 N 1.20 1.65 -0.48 0.00 0.00 -0.99 -1.47 119.26 119.15 3hp6 h ALA 733 Ca 0.11 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 3hp6 h ALA 733 Cb 0.14 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 3hp6 h ALA 733 CO -0.19 0.26 -0.22 0.93 0.00 0.00 0.00 179.25 180.04 3hp6 h GLU 734 N 0.80 1.00 -0.40 0.00 5.08 -0.86 -2.05 114.58 118.15 3hp6 h GLU 734 Ca 0.29 -0.43 0.06 0.00 -1.00 0.00 0.00 59.36 58.28 3hp6 h GLU 734 Cb 0.15 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.32 3hp6 h GLU 734 CO -0.09 1.11 0.11 0.74 -1.00 0.00 0.00 179.01 179.88 3hp6 h PHE 735 N 0.86 0.19 -0.45 4.33 0.04 -0.30 -1.01 116.94 120.60 3hp6 h PHE 735 Ca 0.11 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.88 3hp6 h PHE 735 Cb 0.80 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.90 3hp6 h PHE 735 CO 0.05 0.06 0.22 0.82 -0.60 0.00 0.00 178.31 178.85 3hp6 h ILE 736 N 0.25 1.19 -0.15 -0.55 2.04 -1.16 -0.11 117.51 119.02 3hp6 h ILE 736 Ca 0.19 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.54 3hp6 h ILE 736 Cb 0.20 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3hp6 h ILE 736 CO -0.22 0.21 0.02 -0.33 0.00 0.00 0.00 178.15 177.83 3hp6 h GLU 737 N 0.59 0.08 -0.45 2.37 5.08 -1.20 -2.75 114.58 118.31 3hp6 h GLU 737 Ca 0.16 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.46 3hp6 h GLU 737 Cb 0.13 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3hp6 h GLU 737 CO -0.02 0.06 0.08 0.00 -1.00 0.00 0.00 179.01 178.12 3hp6 h ARG 738 N 0.09 0.70 -0.03 2.33 3.08 -0.92 -1.72 114.38 117.90 3hp6 h ARG 738 Ca 0.07 -0.14 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3hp6 h ARG 738 Cb 0.06 -0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.01 3hp6 h ARG 738 CO -0.10 0.66 0.02 -0.92 -1.07 0.00 0.00 179.97 178.57 3hp6 h TYR 739 N 0.67 0.04 -0.15 3.04 3.20 -0.92 -0.84 116.97 122.02 3hp6 h TYR 739 Ca 0.15 0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.93 3hp6 h TYR 739 Cb 0.30 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.55 3hp6 h TYR 739 CO 0.01 0.05 -0.31 0.74 -1.64 0.00 0.00 178.16 177.02 3hp6 h PHE 740 N 0.02 0.32 -0.01 -3.82 0.04 -1.19 0.48 116.94 112.79 3hp6 h PHE 740 Ca 0.01 -0.07 -0.18 0.00 2.80 0.00 0.00 57.97 60.53 3hp6 h PHE 740 Cb 0.02 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.08 3hp6 h PHE 740 CO -0.07 0.57 -0.81 0.93 -0.60 0.00 0.00 178.31 178.32 3hp6 h GLU 741 N 0.25 0.14 -0.01 1.51 4.39 -1.26 -1.90 114.58 117.70 3hp6 h GLU 741 Ca 0.03 -0.15 -0.21 0.00 0.34 0.00 0.00 59.36 59.38 3hp6 h GLU 741 Cb 0.68 0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 29.36 3hp6 h GLU 741 CO 0.05 0.88 -0.88 1.03 -1.16 0.00 0.00 179.01 178.93 3hp6 h SER 742 N 0.08 0.40 -2.12 1.42 0.87 -0.35 -3.38 113.55 110.47 3hp6 h SER 742 Ca -0.03 -0.32 -0.58 0.00 -1.23 0.00 0.00 61.79 59.63 3hp6 h SER 742 Cb 1.42 -0.12 -0.41 0.00 -0.44 0.00 0.00 62.40 62.85 3hp6 h SER 742 CO 0.12 1.10 -0.80 0.49 -0.53 0.00 0.00 176.83 177.21 3hp6 n PHE 743 N -3.72 2.03 0.26 2.24 3.72 0.16 -4.74 117.46 117.40 3hp6 n PHE 743 Ca -0.05 -3.92 0.13 0.00 -0.05 0.00 0.00 57.45 53.56 3hp6 n PHE 743 Cb 0.80 -0.47 0.66 0.00 -0.94 0.00 0.00 39.48 39.54 3hp6 n PHE 743 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3hp6 h PRO 744 N 4.12 0.00 0.00 -1.08 0.13 -1.54 -1.62 132.00 132.01 3hp6 h PRO 744 Ca 0.15 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.26 3hp6 h PRO 744 Cb 0.75 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.88 3hp6 h PRO 744 CO 0.68 0.14 -0.09 0.78 -0.23 0.00 0.00 178.00 179.29 3hp6 h GLY 745 N 1.30 0.00 1.11 1.56 0.00 -1.88 -2.49 103.07 102.67 3hp6 h GLY 745 Ca -0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 3hp6 h GLY 745 CO 0.02 0.00 -0.91 -2.08 0.00 0.00 0.00 176.54 173.56 3hp6 h VAL 746 N 0.00 1.31 -1.00 4.60 2.07 -1.59 -1.67 116.25 119.97 3hp6 h VAL 746 Ca -0.00 -2.17 0.04 0.00 0.82 0.00 0.00 66.70 65.39 3hp6 h VAL 746 Cb 0.17 2.38 -0.06 0.00 -1.52 0.00 0.00 31.29 32.26 3hp6 h VAL 746 CO 0.01 0.67 0.65 0.50 0.02 0.00 0.00 177.57 179.42 3hp6 h LYS 747 N 0.30 1.20 -0.03 1.57 1.63 -1.50 -2.10 116.57 117.66 3hp6 h LYS 747 Ca -0.11 -0.07 -0.19 0.00 -0.85 0.00 0.00 60.65 59.43 3hp6 h LYS 747 Cb 1.58 -0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 32.93 3hp6 h LYS 747 CO 0.18 0.80 -0.80 0.00 -3.45 0.00 0.00 179.45 176.18 3hp6 h ARG 748 N 1.24 0.26 -0.24 1.90 3.08 -1.43 -2.55 114.38 116.64 3hp6 h ARG 748 Ca 0.41 -0.25 0.02 0.00 0.07 0.00 0.00 59.98 60.23 3hp6 h ARG 748 Cb 0.05 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 3hp6 h ARG 748 CO -0.14 0.93 0.10 -0.92 -1.07 0.00 0.00 179.97 178.87 3hp6 h TYR 749 N 0.16 0.19 -0.47 3.04 3.20 -0.97 0.29 116.97 122.42 3hp6 h TYR 749 Ca -0.04 0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.87 3hp6 h TYR 749 Cb 1.39 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.58 3hp6 h TYR 749 CO 0.03 0.10 0.27 0.52 -1.64 0.00 0.00 178.16 177.44 3hp6 h MET 750 N 0.22 0.52 -0.32 1.82 2.86 -1.32 0.39 114.93 119.11 3hp6 h MET 750 Ca 0.10 -0.03 -0.05 0.00 -2.06 0.00 0.00 59.70 57.66 3hp6 h MET 750 Cb 0.05 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 3hp6 h MET 750 CO -0.08 0.35 0.02 0.93 1.06 0.00 0.00 176.91 179.19 3hp6 h GLU 751 N 0.54 0.55 -0.18 1.72 5.08 -1.30 -2.92 114.58 118.07 3hp6 h GLU 751 Ca 0.19 -0.16 -0.17 0.00 -1.00 0.00 0.00 59.36 58.22 3hp6 h GLU 751 Cb 0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3hp6 h GLU 751 CO -0.10 0.67 -0.57 -0.91 -1.00 0.00 0.00 179.01 177.11 3hp6 h ASN 752 N 0.37 0.64 0.37 1.42 2.35 0.07 -2.05 115.58 118.74 3hp6 h ASN 752 Ca 0.09 -0.35 -0.16 0.00 -0.55 0.00 0.00 56.30 55.33 3hp6 h ASN 752 Cb 0.40 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 3hp6 h ASN 752 CO 0.01 1.07 -0.67 -0.29 -1.65 0.00 0.00 177.43 175.90 3hp6 h ILE 753 N 0.44 1.40 -0.33 2.81 6.09 -0.30 -0.25 117.51 127.37 3hp6 h ILE 753 Ca 0.00 -2.11 -0.17 0.00 -1.37 0.00 0.00 64.86 61.21 3hp6 h ILE 753 Cb 1.12 2.09 -0.00 0.00 0.47 0.00 0.00 36.82 40.50 3hp6 h ILE 753 CO 0.11 0.63 -0.47 0.58 -3.07 0.00 0.00 178.15 175.92 3hp6 h VAL 754 N 0.19 1.27 -0.15 2.19 2.07 -1.47 -1.43 116.25 118.92 3hp6 h VAL 754 Ca -0.02 -1.65 -0.00 0.00 0.82 0.00 0.00 66.70 65.85 3hp6 h VAL 754 Cb 1.21 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 3hp6 h VAL 754 CO 0.11 0.55 0.09 -0.61 0.02 0.00 0.00 177.57 177.72 3hp6 h GLN 755 N 0.70 0.20 -0.34 1.57 4.15 -1.24 -1.33 115.11 118.83 3hp6 h GLN 755 Ca 0.03 -0.02 0.05 0.00 0.77 0.00 0.00 58.65 59.49 3hp6 h GLN 755 Cb 1.08 -0.04 -0.05 0.00 0.21 0.00 0.00 27.48 28.68 3hp6 h GLN 755 CO 0.11 0.18 0.05 1.49 -1.93 0.00 0.00 178.83 178.73 3hp6 h GLU 756 N 0.17 0.16 -0.95 1.69 4.81 -0.98 -0.27 114.58 119.21 3hp6 h GLU 756 Ca 0.05 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.36 3hp6 h GLU 756 Cb 0.03 -0.04 -0.07 0.00 0.63 0.00 0.00 28.75 29.30 3hp6 h GLU 756 CO -0.01 0.10 0.60 0.00 -0.73 0.00 0.00 179.01 178.97 3hp6 h ALA 757 N 1.26 1.35 -0.44 2.92 0.00 -1.17 0.27 119.26 123.46 3hp6 h ALA 757 Ca 0.16 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 3hp6 h ALA 757 Cb 0.19 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3hp6 h ALA 757 CO -0.23 0.32 0.04 0.87 0.00 0.00 0.00 179.25 180.26 3hp6 h LYS 758 N 1.05 0.76 -0.22 0.00 1.57 -0.48 0.25 116.57 119.49 3hp6 h LYS 758 Ca 0.43 -0.22 -0.14 0.00 -1.87 0.00 0.00 60.65 58.85 3hp6 h LYS 758 Cb 0.26 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3hp6 h LYS 758 CO -0.20 0.80 -0.41 1.96 -0.57 0.00 0.00 179.45 181.03 3hp6 h GLN 759 N 0.61 0.66 0.02 3.15 4.20 -0.64 -3.37 115.11 119.74 3hp6 h GLN 759 Ca 0.13 -0.42 -0.32 0.00 0.06 0.00 0.00 58.65 58.10 3hp6 h GLN 759 Cb 0.43 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.21 3hp6 h GLN 759 CO 0.01 1.04 -1.93 1.63 -0.67 0.00 0.00 178.83 178.92 3hp6 n LYS 760 N -4.21 0.66 -0.17 1.46 5.02 0.92 -5.00 118.16 116.84 3hp6 n LYS 760 Ca -0.05 0.23 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 3hp6 n LYS 760 Cb 0.54 -1.71 0.00 0.00 -0.02 0.00 0.00 35.03 33.84 3hp6 n LYS 760 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hp6 n GLY 761 N 1.70 0.72 3.53 0.72 0.00 0.89 -5.04 105.19 107.71 3hp6 n GLY 761 Ca -0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.68 3hp6 n GLY 761 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hp6 s TYR 762 N -2.20 -0.43 0.31 1.61 -0.85 -1.24 -1.44 117.35 113.11 3hp6 s TYR 762 Ca 0.00 0.18 0.11 0.00 -0.52 0.00 0.00 57.07 56.83 3hp6 s TYR 762 Cb 0.00 0.59 -0.06 0.00 0.38 0.00 0.00 41.96 42.87 3hp6 s TYR 762 CO 0.00 -0.88 -0.14 0.14 -1.52 0.00 0.00 175.55 173.15 3hp6 s VAL 763 N -3.67 2.42 0.13 -3.49 -7.23 -0.17 -4.20 120.40 104.20 3hp6 s VAL 763 Ca 0.04 -2.28 0.04 0.00 -1.81 0.00 0.00 61.98 57.97 3hp6 s VAL 763 Cb -0.02 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.39 3hp6 s VAL 763 CO -0.08 -0.31 -0.10 0.42 -0.31 0.00 0.00 175.10 174.72 3hp6 s THR 764 N -2.54 1.09 0.51 5.32 -4.23 -1.26 -1.22 115.64 113.31 3hp6 s THR 764 Ca 0.31 -1.98 0.06 0.00 -1.18 0.00 0.00 61.69 58.90 3hp6 s THR 764 Cb -0.02 -1.76 0.02 0.00 1.34 0.00 0.00 72.50 72.09 3hp6 s THR 764 CO 0.16 -0.73 0.35 0.42 -0.54 0.00 0.00 174.62 174.29 3hp6 s THR 765 N -3.20 1.81 0.25 3.99 -4.23 -0.05 -4.59 115.64 109.62 3hp6 s THR 765 Ca 0.14 -1.53 -0.03 0.00 -1.18 0.00 0.00 61.69 59.10 3hp6 s THR 765 Cb 0.02 -2.34 0.23 0.00 1.34 0.00 0.00 72.50 71.75 3hp6 s THR 765 CO -0.00 0.00 1.77 -0.07 -0.54 0.00 0.00 174.62 175.78 3hp6 h LEU 766 N 0.89 0.53 -3.71 4.79 3.38 -1.89 -1.13 115.31 118.17 3hp6 h LEU 766 Ca -0.38 0.08 -0.27 0.00 0.09 0.00 0.00 57.88 57.39 3hp6 h LEU 766 Cb 1.29 -0.01 -0.16 0.00 0.09 0.00 0.00 40.66 41.88 3hp6 h LEU 766 CO 0.60 0.25 0.35 0.18 0.09 0.00 0.00 178.44 179.90 3hp6 n LEU 767 N -4.86 6.12 -0.22 1.67 4.77 -1.26 -4.93 117.00 118.29 3hp6 n LEU 767 Ca 0.15 -3.20 -0.03 0.00 -0.03 0.00 0.00 56.01 52.90 3hp6 n LEU 767 Cb 0.38 -0.76 -0.01 0.00 -2.33 0.00 0.00 43.42 40.70 3hp6 n LEU 767 CO 0.22 0.84 -0.03 1.41 -1.33 0.00 0.00 177.39 178.51 3hp6 n HIS 768 N -0.32 0.00 -2.09 -1.77 8.25 -0.43 -4.72 115.22 114.14 3hp6 n HIS 768 Ca 0.43 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.52 3hp6 n HIS 768 Cb 1.42 -0.88 0.01 0.00 1.12 0.00 0.00 29.99 31.66 3hp6 n HIS 768 CO 0.00 0.00 0.00 0.50 0.64 0.00 0.00 176.34 177.48 3hp6 s ARG 769 N -1.84 3.48 0.11 -0.41 3.52 -1.26 -4.74 118.95 117.80 3hp6 s ARG 769 Ca 0.00 1.92 0.10 0.00 -0.13 0.00 0.00 55.73 57.62 3hp6 s ARG 769 Cb 0.00 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 31.05 3hp6 s ARG 769 CO 0.00 -0.82 -0.26 0.50 -0.81 0.00 0.00 175.30 173.91 3hp6 s ARG 770 N -2.84 1.44 -0.06 5.12 3.52 -1.26 -0.87 118.95 124.00 3hp6 s ARG 770 Ca 0.68 -1.26 -0.01 0.00 -0.13 0.00 0.00 55.73 55.01 3hp6 s ARG 770 Cb -0.32 -1.83 0.03 0.00 -1.56 0.00 0.00 34.95 31.26 3hp6 s ARG 770 CO 0.38 0.44 -0.01 0.50 -0.81 0.00 0.00 175.30 175.81 3hp6 s ARG 771 N -1.83 0.58 0.17 5.12 3.52 -0.36 -4.72 118.95 121.43 3hp6 s ARG 771 Ca 0.12 0.06 -0.24 0.00 -0.13 0.00 0.00 55.73 55.54 3hp6 s ARG 771 Cb -0.10 -0.84 -0.08 0.00 -1.56 0.00 0.00 34.95 32.37 3hp6 s ARG 771 CO 0.05 -0.22 0.76 0.71 -0.81 0.00 0.00 175.30 175.78 3hp6 s TYR 772 N 1.57 3.88 -0.50 5.12 1.51 -1.26 -1.00 117.35 126.67 3hp6 s TYR 772 Ca -0.01 1.59 0.07 0.00 -1.01 0.00 0.00 57.07 57.71 3hp6 s TYR 772 Cb -0.13 -2.74 0.27 0.00 -0.11 0.00 0.00 41.96 39.25 3hp6 s TYR 772 CO -0.03 0.50 0.67 1.28 -1.11 0.00 0.00 175.55 176.85 3hp6 n LEU 773 N 1.50 1.97 0.29 -1.29 4.77 -0.52 -4.95 117.00 118.77 3hp6 n LEU 773 Ca -0.06 -5.09 0.16 0.00 -0.03 0.00 0.00 56.01 50.99 3hp6 n LEU 773 Cb 0.49 0.05 0.93 0.00 -2.33 0.00 0.00 43.42 42.56 3hp6 n LEU 773 CO 0.45 2.11 1.13 1.55 -1.33 0.00 0.00 177.39 181.31 3hp6 h PRO 774 N 3.87 0.00 0.00 3.23 0.13 -1.96 -1.71 132.00 135.56 3hp6 h PRO 774 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3hp6 h PRO 774 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3hp6 h PRO 774 CO 0.64 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.16 3hp6 n ASP 775 N -3.81 0.04 0.21 1.44 10.43 -1.26 -4.32 116.55 119.28 3hp6 n ASP 775 Ca -0.03 0.51 0.08 0.00 2.57 0.00 0.00 54.79 57.92 3hp6 n ASP 775 Cb 0.10 -0.52 0.47 0.00 1.84 0.00 0.00 41.12 43.01 3hp6 n ASP 775 CO 0.00 0.00 0.00 -0.29 -1.07 0.00 0.00 177.20 175.84 3hp6 h ILE 776 N 0.00 0.83 -0.48 0.53 2.10 -1.62 -3.25 117.51 115.62 3hp6 h ILE 776 Ca 0.00 -1.12 0.00 0.00 1.08 0.00 0.00 64.86 64.82 3hp6 h ILE 776 Cb 0.18 1.68 0.00 0.00 -1.09 0.00 0.00 36.82 37.59 3hp6 h ILE 776 CO 0.00 0.27 0.00 1.07 -1.08 0.00 0.00 178.15 178.41 3hp6 n THR 777 N -3.67 2.35 -2.69 2.19 5.66 -1.26 -4.80 114.28 112.05 3hp6 n THR 777 Ca -0.01 -1.49 -0.33 0.00 -3.05 0.00 0.00 64.05 59.16 3hp6 n THR 777 Cb 0.39 -0.15 -0.05 0.00 -1.55 0.00 0.00 70.33 68.97 3hp6 n THR 777 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 3hp6 s SER 778 N -1.18 6.67 0.51 1.09 0.01 -1.23 -4.97 113.70 114.61 3hp6 s SER 778 Ca 0.49 1.80 0.30 0.00 1.31 0.00 0.00 55.95 59.85 3hp6 s SER 778 Cb 0.36 -2.55 1.07 0.00 0.21 0.00 0.00 66.02 65.11 3hp6 s SER 778 CO 0.15 -0.55 1.87 0.08 0.41 0.00 0.00 173.24 175.21 3hp6 h ARG 779 N 1.76 0.00 -6.26 12.44 -0.00 -1.94 -3.42 114.38 116.96 3hp6 h ARG 779 Ca -0.49 0.00 -0.53 0.00 -0.00 0.00 0.00 59.98 58.96 3hp6 h ARG 779 Cb 1.20 0.00 -0.06 0.00 -0.00 0.00 0.00 29.97 31.11 3hp6 h ARG 779 CO 0.60 0.00 1.17 1.21 -0.00 0.00 0.00 179.97 182.96 3hp6 s ASN 780 N -5.77 5.87 0.29 0.08 3.84 -1.26 -4.90 114.94 113.09 3hp6 s ASN 780 Ca 0.03 0.15 0.04 0.00 0.21 0.00 0.00 52.86 53.29 3hp6 s ASN 780 Cb 0.08 -2.54 0.76 0.00 -0.55 0.00 0.00 41.25 38.99 3hp6 s ASN 780 CO 0.57 -1.95 1.65 0.15 -2.79 0.00 0.00 177.10 174.74 3hp6 h PHE 781 N 12.05 0.42 -0.00 0.43 3.57 -1.99 -1.09 116.94 130.33 3hp6 h PHE 781 Ca -0.27 0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.28 3hp6 h PHE 781 Cb 1.11 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.80 3hp6 h PHE 781 CO 1.06 -0.21 -0.00 -0.91 -2.23 0.00 0.00 178.31 176.02 3hp6 h ASN 782 N 0.22 0.01 -0.01 0.41 4.21 -1.96 -0.21 115.58 118.25 3hp6 h ASN 782 Ca 0.57 -0.52 -0.00 0.00 1.21 0.00 0.00 56.30 57.57 3hp6 h ASN 782 Cb 1.18 -0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 38.38 3hp6 h ASN 782 CO -0.65 0.53 0.01 0.58 -1.29 0.00 0.00 177.43 176.60 3hp6 h VAL 783 N -0.50 1.10 -0.41 2.81 2.07 -1.81 -0.64 116.25 118.87 3hp6 h VAL 783 Ca 0.00 -0.29 0.05 0.00 0.82 0.00 0.00 66.70 67.27 3hp6 h VAL 783 Cb 0.52 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 3hp6 h VAL 783 CO 0.00 0.08 0.15 -0.09 0.02 0.00 0.00 177.57 177.73 3hp6 h ARG 784 N -0.11 0.31 -0.32 1.57 2.43 -1.32 -2.21 114.38 114.75 3hp6 h ARG 784 Ca 0.00 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.16 3hp6 h ARG 784 Cb 0.12 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 3hp6 h ARG 784 CO -0.00 0.21 0.20 0.77 -1.51 0.00 0.00 179.97 179.63 3hp6 h SER 785 N 0.32 0.33 -0.42 -3.80 0.02 -0.86 0.15 113.55 109.29 3hp6 h SER 785 Ca 0.19 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 3hp6 h SER 785 Cb 0.16 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 3hp6 h SER 785 CO -0.18 0.24 0.27 -0.26 -1.14 0.00 0.00 176.83 175.76 3hp6 h PHE 786 N 0.40 0.54 -0.82 3.45 0.04 -0.99 -1.67 116.94 117.89 3hp6 h PHE 786 Ca 0.12 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.89 3hp6 h PHE 786 Cb -0.02 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 37.91 3hp6 h PHE 786 CO -0.07 0.35 0.49 0.00 -0.60 0.00 0.00 178.31 178.48 3hp6 h ALA 787 N 1.14 1.32 -0.76 2.45 0.00 -1.05 -1.41 119.26 120.96 3hp6 h ALA 787 Ca 0.15 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3hp6 h ALA 787 Cb -0.05 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.38 3hp6 h ALA 787 CO -0.03 0.58 0.31 0.93 0.00 0.00 0.00 179.25 181.03 3hp6 h GLU 788 N 1.12 1.13 -0.14 0.00 5.08 -0.18 -0.46 114.58 121.13 3hp6 h GLU 788 Ca 0.29 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.32 3hp6 h GLU 788 Cb -0.04 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 3hp6 h GLU 788 CO -0.05 0.92 -0.49 0.00 -1.00 0.00 0.00 179.01 178.39 3hp6 h ARG 789 N 1.09 0.37 -0.86 2.33 3.08 -0.94 -1.91 114.38 117.54 3hp6 h ARG 789 Ca 0.25 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 60.10 3hp6 h ARG 789 Cb 0.21 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.23 3hp6 h ARG 789 CO -0.02 0.78 0.54 0.52 -1.07 0.00 0.00 179.97 180.72 3hp6 h MET 790 N 0.29 1.15 -0.79 0.04 2.86 -0.92 -1.69 114.93 115.86 3hp6 h MET 790 Ca 0.01 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.59 3hp6 h MET 790 Cb 0.97 -0.25 -0.04 0.00 0.06 0.00 0.00 31.60 32.34 3hp6 h MET 790 CO 0.08 0.79 0.52 0.00 1.06 0.00 0.00 176.91 179.36 3hp6 h ALA 791 N 1.30 1.49 -0.18 6.32 0.00 -0.38 -0.37 119.26 127.44 3hp6 h ALA 791 Ca 0.31 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 55.01 3hp6 h ALA 791 Cb -0.09 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 3hp6 h ALA 791 CO -0.06 0.44 -0.59 0.52 0.00 0.00 0.00 179.25 179.56 3hp6 h MET 792 N 1.01 0.59 0.09 0.00 2.07 -0.93 -3.38 114.93 114.39 3hp6 h MET 792 Ca 0.31 -0.40 -0.34 0.00 -2.07 0.00 0.00 59.70 57.20 3hp6 h MET 792 Cb -0.02 0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 29.75 3hp6 h MET 792 CO -0.08 1.01 -1.83 -1.71 1.07 0.00 0.00 176.91 175.37 3hp6 n ASN 793 N -3.94 2.06 -0.32 1.22 2.85 -0.68 -4.42 115.26 112.04 3hp6 n ASN 793 Ca -0.04 0.26 0.01 0.00 -0.11 0.00 0.00 54.58 54.70 3hp6 n ASN 793 Cb 0.63 -0.89 0.14 0.00 1.24 0.00 0.00 39.78 40.91 3hp6 n ASN 793 CO 0.00 0.00 0.00 0.74 -2.11 0.00 0.00 177.26 175.89 3hp6 h THR 794 N -0.19 1.06 -0.16 -0.44 2.02 -1.24 -0.24 112.91 113.72 3hp6 h THR 794 Ca -0.41 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 66.40 3hp6 h THR 794 Cb 1.86 -0.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 3hp6 h THR 794 CO 0.01 0.18 -0.03 -0.65 0.37 0.00 0.00 175.52 175.41 3hp6 h PRO 795 N 1.01 0.23 0.04 6.66 0.11 -1.77 0.17 132.00 138.44 3hp6 h PRO 795 Ca 0.38 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.45 3hp6 h PRO 795 Cb 0.15 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.22 3hp6 h PRO 795 CO -0.17 0.27 -0.02 0.82 -0.21 0.00 0.00 178.00 178.70 3hp6 h ILE 796 N 0.22 0.85 -0.79 4.15 1.08 -1.49 -1.90 117.51 119.63 3hp6 h ILE 796 Ca 0.05 -1.54 -0.03 0.00 -0.39 0.00 0.00 64.86 62.95 3hp6 h ILE 796 Cb 0.20 1.57 -0.04 0.00 -3.07 0.00 0.00 36.82 35.48 3hp6 h ILE 796 CO 0.01 0.28 0.37 -0.61 -0.69 0.00 0.00 178.15 177.50 3hp6 h GLN 797 N -0.98 1.14 -0.43 2.37 4.15 -1.08 -1.84 115.11 118.44 3hp6 h GLN 797 Ca -0.01 -0.17 -0.14 0.00 0.77 0.00 0.00 58.65 59.11 3hp6 h GLN 797 Cb 0.49 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 27.96 3hp6 h GLN 797 CO 0.01 0.88 -0.29 0.78 -1.93 0.00 0.00 178.83 178.28 3hp6 h GLY 798 N 1.16 1.02 1.24 2.39 0.00 -0.78 -1.65 103.07 106.45 3hp6 h GLY 798 Ca 0.27 -0.96 -0.09 0.00 0.00 0.00 0.00 47.33 46.55 3hp6 h GLY 798 CO -0.03 0.87 -0.06 1.76 0.00 0.00 0.00 176.54 179.08 3hp6 h SER 799 N 0.79 0.89 -0.68 0.19 0.02 -1.16 -1.32 113.55 112.27 3hp6 h SER 799 Ca 0.09 -0.26 -0.04 0.00 -0.84 0.00 0.00 61.79 60.74 3hp6 h SER 799 Cb 0.87 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 3hp6 h SER 799 CO 0.08 0.98 0.29 0.00 -1.14 0.00 0.00 176.83 177.03 3hp6 h ALA 800 N 1.11 1.18 -0.53 3.77 0.00 -1.19 -2.13 119.26 121.47 3hp6 h ALA 800 Ca 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3hp6 h ALA 800 Cb 0.57 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3hp6 h ALA 800 CO 0.03 0.60 0.34 0.00 0.00 0.00 0.00 179.25 180.22 3hp6 h ALA 801 N 1.30 0.68 -0.53 0.00 0.00 -0.89 -2.75 119.26 117.06 3hp6 h ALA 801 Ca 0.24 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.15 3hp6 h ALA 801 Cb 0.18 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 3hp6 h ALA 801 CO -0.02 0.14 0.26 -0.44 0.00 0.00 0.00 179.25 179.18 3hp6 h ASP 802 N 0.72 0.35 -0.17 0.00 3.45 -0.88 -2.04 116.42 117.84 3hp6 h ASP 802 Ca 0.19 0.04 -0.02 0.00 0.43 0.00 0.00 57.03 57.67 3hp6 h ASP 802 Cb -0.05 -0.02 -0.01 0.00 -0.56 0.00 0.00 39.33 38.69 3hp6 h ASP 802 CO -0.04 0.24 0.03 0.40 -1.57 0.00 0.00 179.24 178.29 3hp6 h ILE 803 N 0.49 1.22 -0.18 0.35 2.04 -1.24 -1.83 117.51 118.36 3hp6 h ILE 803 Ca 0.24 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.30 3hp6 h ILE 803 Cb 0.18 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3hp6 h ILE 803 CO -0.19 0.22 -0.22 -0.29 0.00 0.00 0.00 178.15 177.67 3hp6 h ILE 804 N 0.08 1.24 -0.32 -0.67 2.10 -1.44 -0.81 117.51 117.68 3hp6 h ILE 804 Ca 0.05 -1.10 -0.03 0.00 1.08 0.00 0.00 64.86 64.87 3hp6 h ILE 804 Cb 0.31 1.35 -0.01 0.00 -1.09 0.00 0.00 36.82 37.37 3hp6 h ILE 804 CO 0.00 0.34 0.09 0.11 -1.08 0.00 0.00 178.15 177.62 3hp6 h LYS 805 N 0.29 0.50 -0.49 2.19 1.57 -1.12 -0.84 116.57 118.66 3hp6 h LYS 805 Ca 0.05 -0.11 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 3hp6 h LYS 805 Cb 0.56 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.78 3hp6 h LYS 805 CO 0.04 0.55 0.22 -0.22 -0.57 0.00 0.00 179.45 179.46 3hp6 h LYS 806 N 0.35 0.72 -0.77 3.15 3.64 -1.14 -2.34 116.57 120.18 3hp6 h LYS 806 Ca 0.10 -0.12 0.15 0.00 -1.27 0.00 0.00 60.65 59.51 3hp6 h LYS 806 Cb 0.26 -0.12 -0.10 0.00 -0.41 0.00 0.00 32.23 31.86 3hp6 h LYS 806 CO -0.00 0.63 0.31 0.00 -2.27 0.00 0.00 179.45 178.11 3hp6 h ALA 807 N 1.06 1.10 -0.75 5.00 0.00 -0.75 -1.08 119.26 123.84 3hp6 h ALA 807 Ca 0.17 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.16 3hp6 h ALA 807 Cb 0.16 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3hp6 h ALA 807 CO -0.02 -0.22 0.33 0.52 0.00 0.00 0.00 179.25 179.86 3hp6 h MET 808 N 0.44 1.10 0.25 0.00 2.86 -0.66 -0.19 114.93 118.73 3hp6 h MET 808 Ca 0.43 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.88 3hp6 h MET 808 Cb 0.68 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 32.15 3hp6 h MET 808 CO -0.42 0.88 -0.12 0.82 1.06 0.00 0.00 176.91 179.13 3hp6 h ILE 809 N 1.07 0.78 -0.70 -1.22 2.04 -0.84 -0.74 117.51 117.89 3hp6 h ILE 809 Ca 0.25 -0.16 0.04 0.00 1.00 0.00 0.00 64.86 66.00 3hp6 h ILE 809 Cb 0.17 0.87 -0.05 0.00 -0.74 0.00 0.00 36.82 37.07 3hp6 h ILE 809 CO -0.03 0.04 0.43 0.44 0.00 0.00 0.00 178.15 179.03 3hp6 h ASP 810 N -0.42 0.69 -0.15 1.72 3.32 -1.12 -2.14 116.42 118.32 3hp6 h ASP 810 Ca -0.03 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 3hp6 h ASP 810 Cb 0.32 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 3hp6 h ASP 810 CO 0.06 0.47 0.06 0.25 -1.72 0.00 0.00 179.24 178.35 3hp6 h LEU 811 N 0.83 0.20 -0.73 1.55 5.85 -0.92 -2.52 115.31 119.57 3hp6 h LEU 811 Ca 0.29 -0.16 0.11 0.00 0.84 0.00 0.00 57.88 58.96 3hp6 h LEU 811 Cb 0.07 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 40.97 3hp6 h LEU 811 CO -0.13 0.31 0.34 -1.13 -0.34 0.00 0.00 178.44 177.49 3hp6 h ASN 812 N 0.08 0.41 -0.28 1.25 -0.73 -0.86 -1.28 115.58 114.16 3hp6 h ASN 812 Ca 0.05 0.08 0.06 0.00 1.87 0.00 0.00 56.30 58.35 3hp6 h ASN 812 Cb 0.17 0.02 -0.06 0.00 0.27 0.00 0.00 38.32 38.72 3hp6 h ASN 812 CO -0.00 0.21 -0.09 0.00 -0.37 0.00 0.00 177.43 177.18 3hp6 h ALA 813 N 1.47 0.17 0.01 1.57 0.00 -1.15 -2.34 119.26 118.99 3hp6 h ALA 813 Ca 0.37 0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.39 3hp6 h ALA 813 Cb 0.46 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.49 3hp6 h ALA 813 CO -0.31 -0.48 -0.01 0.00 0.00 0.00 0.00 179.25 178.45 3hp6 h ARG 814 N -0.02 -0.01 -0.71 0.00 2.47 -0.95 0.12 114.38 115.27 3hp6 h ARG 814 Ca 0.14 0.00 0.14 0.00 -1.26 0.00 0.00 59.98 59.00 3hp6 h ARG 814 Cb 0.23 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 28.42 3hp6 h ARG 814 CO -0.31 0.54 -0.20 -0.07 0.56 0.00 0.00 179.97 180.50 3hp6 h LEU 815 N -0.58 -0.74 -0.79 3.04 3.38 -1.27 0.35 115.31 118.70 3hp6 h LEU 815 Ca -0.00 0.22 -0.06 0.00 0.09 0.00 0.00 57.88 58.13 3hp6 h LEU 815 Cb 0.56 0.47 -0.03 0.00 0.09 0.00 0.00 40.66 41.75 3hp6 h LEU 815 CO 0.00 -0.25 0.20 0.50 0.09 0.00 0.00 178.44 178.99 3hp6 h LYS 816 N -0.02 1.11 -0.36 1.13 3.64 -1.42 -1.25 116.57 119.40 3hp6 h LYS 816 Ca 0.33 -0.25 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 3hp6 h LYS 816 Cb 0.53 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 3hp6 h LYS 816 CO -0.74 0.96 0.16 1.49 -2.27 0.00 0.00 179.45 179.05 3hp6 h GLU 817 N 1.07 0.33 -0.66 1.90 4.81 0.21 -2.17 114.58 120.05 3hp6 h GLU 817 Ca 0.23 -0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 3hp6 h GLU 817 Cb 0.33 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 3hp6 h GLU 817 CO -0.00 0.22 0.03 0.39 -0.73 0.00 0.00 179.01 178.91 3hp6 n GLU 818 N -4.96 4.21 -2.32 1.92 1.02 0.93 -4.93 120.64 116.51 3hp6 n GLU 818 Ca 0.01 -2.67 -0.11 0.00 -0.02 0.00 0.00 57.16 54.37 3hp6 n GLU 818 Cb 0.10 -2.15 -0.01 0.00 -0.02 0.00 0.00 31.44 29.36 3hp6 n GLU 818 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 3hp6 n ARG 819 N 0.46 -2.20 -1.91 3.49 1.85 -0.65 -4.92 116.66 112.78 3hp6 n ARG 819 Ca 0.25 0.53 -0.33 0.00 -1.00 0.00 0.00 57.85 57.30 3hp6 n ARG 819 Cb 1.08 -5.08 0.03 0.00 -1.05 0.00 0.00 32.46 27.44 3hp6 n ARG 819 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3hp6 s LEU 820 N -5.30 3.45 0.03 2.89 1.02 -0.57 -4.96 118.68 115.24 3hp6 s LEU 820 Ca 0.00 1.92 0.28 0.00 0.02 0.00 0.00 54.13 56.34 3hp6 s LEU 820 Cb 0.00 -4.54 0.98 0.00 0.02 0.00 0.00 46.19 42.65 3hp6 s LEU 820 CO 0.00 -1.40 1.77 0.00 0.02 0.00 0.00 176.35 176.74 3hp6 n GLN 821 N -2.20 0.04 -1.74 1.70 6.02 -1.26 -4.75 117.38 115.19 3hp6 n GLN 821 Ca 0.10 0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.69 3hp6 n GLN 821 Cb 0.52 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 30.23 3hp6 n GLN 821 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hp6 n ALA 822 N -1.55 2.33 -2.18 -1.58 0.00 -1.26 -4.87 120.51 111.40 3hp6 n ALA 822 Ca 0.06 0.38 -0.08 0.00 0.00 0.00 0.00 53.44 53.80 3hp6 n ALA 822 Cb 0.35 -2.43 -0.09 0.00 0.00 0.00 0.00 19.45 17.28 3hp6 n ALA 822 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 3hp6 s HIS 823 N -0.08 0.50 0.35 0.00 -3.43 -0.92 -4.91 115.29 106.79 3hp6 s HIS 823 Ca 0.64 -1.00 -0.26 0.00 -0.80 0.00 0.00 55.06 53.63 3hp6 s HIS 823 Cb -0.52 -0.34 -0.09 0.00 -1.43 0.00 0.00 32.58 30.20 3hp6 s HIS 823 CO 0.50 -0.43 1.08 -0.51 -2.00 0.00 0.00 174.74 173.38 3hp6 s LEU 824 N -2.93 4.32 -0.14 5.38 1.43 -1.26 -1.83 118.68 123.65 3hp6 s LEU 824 Ca 0.09 2.17 0.01 0.00 -1.03 0.00 0.00 54.13 55.36 3hp6 s LEU 824 Cb 0.07 -3.94 -0.09 0.00 0.03 0.00 0.00 46.19 42.27 3hp6 s LEU 824 CO -0.09 -0.37 -0.13 0.18 0.23 0.00 0.00 176.35 176.18 3hp6 n LEU 825 N 0.46 2.89 -3.72 1.79 4.77 0.51 -4.61 117.00 119.09 3hp6 n LEU 825 Ca 0.02 -0.06 -0.14 0.00 -0.03 0.00 0.00 56.01 55.80 3hp6 n LEU 825 Cb 0.47 -0.48 -0.08 0.00 -2.33 0.00 0.00 43.42 41.00 3hp6 n LEU 825 CO 0.49 0.71 0.10 -0.76 -1.33 0.00 0.00 177.39 176.60 3hp6 s LEU 826 N -5.86 0.56 -0.03 2.23 1.43 -0.98 -4.79 118.68 111.24 3hp6 s LEU 826 Ca -0.19 0.23 0.06 0.00 -1.03 0.00 0.00 54.13 53.20 3hp6 s LEU 826 Cb 0.05 1.50 -0.01 0.00 0.03 0.00 0.00 46.19 47.76 3hp6 s LEU 826 CO 0.31 -0.47 -0.22 -1.58 0.23 0.00 0.00 176.35 174.63 3hp6 s GLN 827 N -1.25 2.00 -0.50 1.70 -0.44 -1.26 -0.78 119.66 119.14 3hp6 s GLN 827 Ca -0.13 -0.78 0.08 0.00 -2.50 0.00 0.00 55.36 52.03 3hp6 s GLN 827 Cb -0.04 -1.81 0.35 0.00 -1.64 0.00 0.00 33.01 29.87 3hp6 s GLN 827 CO 0.05 0.39 0.87 0.28 0.50 0.00 0.00 175.29 177.39 3hp6 n VAL 828 N 2.79 1.85 0.00 1.34 0.31 -0.33 -4.83 118.33 119.47 3hp6 n VAL 828 Ca -0.17 -5.17 0.00 0.00 -0.01 0.00 0.00 64.34 58.99 3hp6 n VAL 828 Cb 0.52 -0.95 0.00 0.00 -0.91 0.00 0.00 33.84 32.50 3hp6 n VAL 828 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 3hp6 n HIS 829 N -0.06 0.00 -1.89 3.52 -0.00 -1.26 -3.32 115.22 112.21 3hp6 n HIS 829 Ca 0.29 0.00 0.04 0.00 -0.00 0.00 0.00 57.72 58.04 3hp6 n HIS 829 Cb 0.50 0.00 0.05 0.00 -0.00 0.00 0.00 29.99 30.55 3hp6 n HIS 829 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 3hp6 n ASP 830 N 1.72 0.87 -3.91 0.41 5.68 -1.26 -4.74 116.55 115.31 3hp6 n ASP 830 Ca 0.00 -2.41 -0.11 0.00 -0.50 0.00 0.00 54.79 51.77 3hp6 n ASP 830 Cb 0.00 -0.30 -0.12 0.00 -1.14 0.00 0.00 41.12 39.56 3hp6 n ASP 830 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 3hp6 s GLU 831 N -0.91 0.19 -0.10 0.11 2.02 -1.21 -0.85 118.70 117.96 3hp6 s GLU 831 Ca 0.18 -0.28 0.03 0.00 0.02 0.00 0.00 54.97 54.92 3hp6 s GLU 831 Cb 0.18 0.07 -0.01 0.00 0.10 0.00 0.00 34.13 34.48 3hp6 s GLU 831 CO -0.04 -0.03 -0.20 -0.51 0.02 0.00 0.00 175.26 174.50 3hp6 s LEU 832 N -0.75 2.33 -0.15 1.80 1.43 0.36 -1.18 118.68 122.51 3hp6 s LEU 832 Ca -0.08 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.55 3hp6 s LEU 832 Cb -0.05 -1.48 -0.02 0.00 0.03 0.00 0.00 46.19 44.67 3hp6 s LEU 832 CO -0.00 0.19 -0.09 -0.63 0.23 0.00 0.00 176.35 176.04 3hp6 s ILE 833 N 0.18 3.32 0.34 -0.59 -1.09 0.04 -1.63 121.20 121.79 3hp6 s ILE 833 Ca -0.12 -0.56 0.08 0.00 -2.23 0.00 0.00 60.65 57.82 3hp6 s ILE 833 Cb -0.16 -2.43 -0.07 0.00 -1.58 0.00 0.00 42.46 38.22 3hp6 s ILE 833 CO 0.06 0.50 -0.04 -0.76 -1.23 0.00 0.00 174.94 173.47 3hp6 s LEU 834 N 0.52 2.65 0.07 2.97 1.02 0.20 -0.36 118.68 125.75 3hp6 s LEU 834 Ca -0.06 -1.26 0.05 0.00 0.02 0.00 0.00 54.13 52.87 3hp6 s LEU 834 Cb -0.15 -0.82 -0.03 0.00 0.02 0.00 0.00 46.19 45.21 3hp6 s LEU 834 CO 0.03 -0.34 -0.14 -1.83 0.02 0.00 0.00 176.35 174.09 3hp6 s GLU 835 N -3.69 0.81 0.05 1.70 -1.05 -0.76 -0.86 118.70 114.89 3hp6 s GLU 835 Ca 0.33 -0.96 -0.27 0.00 -0.15 0.00 0.00 54.97 53.92 3hp6 s GLU 835 Cb 0.05 -0.78 0.07 0.00 -0.44 0.00 0.00 34.13 33.03 3hp6 s GLU 835 CO 0.16 0.17 0.65 0.00 0.95 0.00 0.00 175.26 177.18 3hp6 s ALA 836 N -1.35 -1.69 0.46 -0.84 0.00 -0.77 -2.17 121.76 115.40 3hp6 s ALA 836 Ca -0.02 0.92 -0.23 0.00 0.00 0.00 0.00 51.96 52.63 3hp6 s ALA 836 Cb -0.10 0.43 -0.09 0.00 0.00 0.00 0.00 23.12 23.36 3hp6 s ALA 836 CO 0.02 -0.57 0.96 -2.30 0.00 0.00 0.00 175.76 173.88 3hp6 n PRO 837 N 0.27 1.21 0.11 0.00 -0.02 -1.26 -0.03 135.00 135.28 3hp6 n PRO 837 Ca -0.18 0.44 0.10 0.00 -2.02 0.00 0.00 63.50 61.84 3hp6 n PRO 837 Cb 0.61 -2.04 0.59 0.00 -0.02 0.00 0.00 33.50 32.64 3hp6 n PRO 837 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3hp6 h LYS 838 N 1.27 0.16 0.00 -0.52 2.10 -1.46 -1.28 116.57 116.83 3hp6 h LYS 838 Ca -0.45 -0.01 -0.03 0.00 -2.00 0.00 0.00 60.65 58.16 3hp6 h LYS 838 Cb 1.35 -0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 32.64 3hp6 h LYS 838 CO 0.55 0.10 -0.13 0.93 -2.00 0.00 0.00 179.45 178.90 3hp6 h GLU 839 N 0.16 0.00 -0.00 0.07 3.07 -1.90 -2.54 114.58 113.44 3hp6 h GLU 839 Ca 0.11 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.97 3hp6 h GLU 839 Cb 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 3hp6 h GLU 839 CO -0.02 0.13 -0.01 0.39 -1.40 0.00 0.00 179.01 178.10 3hp6 n GLU 840 N -3.56 0.55 0.11 2.33 1.02 -0.48 -4.22 120.64 116.39 3hp6 n GLU 840 Ca -0.01 -0.02 -0.02 0.00 -0.02 0.00 0.00 57.16 57.08 3hp6 n GLU 840 Cb 0.27 -1.50 0.21 0.00 -0.02 0.00 0.00 31.44 30.40 3hp6 n GLU 840 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 3hp6 h MET 841 N 0.06 0.16 0.00 3.49 4.05 -1.57 -2.15 114.93 118.97 3hp6 h MET 841 Ca 0.00 -0.09 -0.08 0.00 -0.28 0.00 0.00 59.70 59.25 3hp6 h MET 841 Cb 0.24 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.04 3hp6 h MET 841 CO 0.00 0.62 -0.38 1.49 0.23 0.00 0.00 176.91 178.86 3hp6 h GLU 842 N 0.13 0.00 0.14 0.39 4.57 -1.82 -2.16 114.58 115.83 3hp6 h GLU 842 Ca 0.01 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 3hp6 h GLU 842 Cb 0.91 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.50 3hp6 h GLU 842 CO 0.07 0.38 -0.07 0.00 -1.18 0.00 0.00 179.01 178.22 3hp6 h ARG 843 N 0.00 -0.18 -1.00 1.92 3.08 -1.76 -3.31 114.38 113.13 3hp6 h ARG 843 Ca -0.00 0.01 0.20 0.00 0.07 0.00 0.00 59.98 60.25 3hp6 h ARG 843 Cb 0.76 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 30.74 3hp6 h ARG 843 CO 0.05 0.19 0.61 -0.07 -1.07 0.00 0.00 179.97 179.68 3hp6 h LEU 844 N -0.96 0.78 -2.31 3.04 3.38 -1.40 0.16 115.31 117.99 3hp6 h LEU 844 Ca -0.02 0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.09 3hp6 h LEU 844 Cb 0.45 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3hp6 h LEU 844 CO 0.03 0.26 0.17 0.00 0.09 0.00 0.00 178.44 178.99 3hp6 n ARG 846 N -3.64 1.14 -0.07 0.00 1.74 0.37 -4.66 116.66 111.54 3hp6 n ARG 846 Ca 0.00 0.03 -0.10 0.00 -0.77 0.00 0.00 57.85 57.01 3hp6 n ARG 846 Cb 0.28 -1.41 -0.08 0.00 -1.02 0.00 0.00 32.46 30.24 3hp6 n ARG 846 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3hp6 h LEU 847 N 0.00 0.00 -0.13 0.55 5.85 -0.63 -3.27 115.31 117.68 3hp6 h LEU 847 Ca -0.44 -0.50 0.05 0.00 0.84 0.00 0.00 57.88 57.84 3hp6 h LEU 847 Cb 1.89 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.86 3hp6 h LEU 847 CO -0.01 0.92 -0.29 0.58 -0.34 0.00 0.00 178.44 179.30 3hp6 h VAL 848 N -1.00 0.33 -0.50 1.05 2.07 -1.39 -1.00 116.25 115.80 3hp6 h VAL 848 Ca -0.06 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 3hp6 h VAL 848 Cb 0.71 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3hp6 h VAL 848 CO -0.04 0.00 0.29 -0.65 0.02 0.00 0.00 177.57 177.19 3hp6 h PRO 849 N -0.36 0.68 0.09 1.57 0.11 -1.75 -1.75 132.00 130.58 3hp6 h PRO 849 Ca 0.10 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 66.15 3hp6 h PRO 849 Cb 0.52 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.48 3hp6 h PRO 849 CO -0.34 0.49 -0.04 1.49 -0.21 0.00 0.00 178.00 179.39 3hp6 h GLU 850 N 0.69 -0.11 -0.17 1.05 4.81 -1.49 -0.72 114.58 118.64 3hp6 h GLU 850 Ca 0.18 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.46 3hp6 h GLU 850 Cb -0.00 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.35 3hp6 h GLU 850 CO -0.03 0.33 -0.14 0.28 -0.73 0.00 0.00 179.01 178.71 3hp6 h VAL 851 N -0.60 0.60 -0.53 0.32 2.07 -1.13 -1.70 116.25 115.28 3hp6 h VAL 851 Ca -0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.61 3hp6 h VAL 851 Cb 0.49 0.60 -0.09 0.00 -1.52 0.00 0.00 31.29 30.77 3hp6 h VAL 851 CO 0.02 0.00 -0.01 -0.03 0.02 0.00 0.00 177.57 177.57 3hp6 h MET 852 N -0.16 0.11 0.00 1.57 4.05 -1.34 -2.49 114.93 116.66 3hp6 h MET 852 Ca 0.11 -0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.48 3hp6 h MET 852 Cb 0.32 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 3hp6 h MET 852 CO -0.26 0.07 -0.18 0.93 0.23 0.00 0.00 176.91 177.70 3hp6 h GLU 853 N 0.11 0.00 -0.53 0.39 5.08 -0.70 -3.20 114.58 115.73 3hp6 h GLU 853 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3hp6 h GLU 853 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3hp6 h GLU 853 CO -0.46 0.18 0.00 1.04 -1.00 0.00 0.00 179.01 178.77 3hp6 n GLN 854 N -3.20 2.95 -0.21 2.33 6.02 -0.68 -4.56 117.38 120.04 3hp6 n GLN 854 Ca 0.02 -2.44 -0.02 0.00 -0.01 0.00 0.00 57.00 54.55 3hp6 n GLN 854 Cb 0.52 -1.50 0.09 0.00 1.02 0.00 0.00 30.24 30.37 3hp6 n GLN 854 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3hp6 h ALA 855 N 3.12 0.82 -2.37 -1.58 0.00 -1.45 -3.43 119.26 114.37 3hp6 h ALA 855 Ca 0.00 0.03 -0.30 0.00 0.00 0.00 0.00 54.91 54.64 3hp6 h ALA 855 Cb 0.97 -0.08 -0.15 0.00 0.00 0.00 0.00 17.79 18.53 3hp6 h ALA 855 CO 0.05 -0.02 -0.63 0.14 0.00 0.00 0.00 179.25 178.78 3hp6 s VAL 856 N -6.10 0.45 -0.23 0.00 -7.23 -1.26 -4.89 120.40 101.13 3hp6 s VAL 856 Ca -0.13 -1.99 -0.02 0.00 -1.81 0.00 0.00 61.98 58.04 3hp6 s VAL 856 Cb 0.16 -2.42 0.02 0.00 0.56 0.00 0.00 36.38 34.69 3hp6 s VAL 856 CO 0.75 -0.17 -0.08 -0.89 -0.31 0.00 0.00 175.10 174.40 3hp6 s THR 857 N -3.82 2.86 0.42 5.32 2.01 -1.26 -4.97 115.64 116.20 3hp6 s THR 857 Ca 0.33 -0.88 0.07 0.00 0.31 0.00 0.00 61.69 61.52 3hp6 s THR 857 Cb 0.07 -2.38 -0.04 0.00 0.01 0.00 0.00 72.50 70.16 3hp6 s THR 857 CO 0.10 0.31 0.22 -0.76 -0.69 0.00 0.00 174.62 173.79 3hp6 s LEU 858 N 1.36 3.13 0.00 4.42 1.43 -1.26 -5.01 118.68 122.75 3hp6 s LEU 858 Ca 0.02 -1.04 0.10 0.00 -1.03 0.00 0.00 54.13 52.19 3hp6 s LEU 858 Cb -0.15 -1.52 0.62 0.00 0.03 0.00 0.00 46.19 45.16 3hp6 s LEU 858 CO -0.06 -0.59 1.11 0.54 0.23 0.00 0.00 176.35 177.58 3hp6 n ARG 859 N -1.32 0.61 -3.96 1.70 1.74 -1.26 -4.68 116.66 109.50 3hp6 n ARG 859 Ca -0.01 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 56.99 3hp6 n ARG 859 Cb 0.64 -1.26 -0.09 0.00 -1.02 0.00 0.00 32.46 30.73 3hp6 n ARG 859 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3hp6 s VAL 860 N -2.00 0.18 0.57 1.55 -7.23 -1.26 -4.92 120.40 107.29 3hp6 s VAL 860 Ca 0.16 -1.47 -0.15 0.00 -1.81 0.00 0.00 61.98 58.70 3hp6 s VAL 860 Cb 0.07 -1.42 -0.05 0.00 0.56 0.00 0.00 36.38 35.53 3hp6 s VAL 860 CO 0.12 -0.81 1.02 -2.16 -0.31 0.00 0.00 175.10 172.96 3hp6 s PRO 861 N -3.89 3.60 -0.09 4.82 0.04 -1.26 -5.05 135.00 133.16 3hp6 s PRO 861 Ca 0.06 1.04 -0.11 0.00 0.04 0.00 0.00 61.00 62.03 3hp6 s PRO 861 Cb 0.06 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.48 3hp6 s PRO 861 CO -0.11 -0.57 0.26 -0.51 0.04 0.00 0.00 177.00 176.11 3hp6 s LEU 862 N -4.44 4.38 -0.06 -3.56 1.43 -1.26 -4.96 118.68 110.21 3hp6 s LEU 862 Ca 0.60 0.63 0.04 0.00 -1.03 0.00 0.00 54.13 54.38 3hp6 s LEU 862 Cb -0.13 -2.30 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 3hp6 s LEU 862 CO 0.37 0.31 -0.19 -0.75 0.23 0.00 0.00 176.35 176.32 3hp6 s LYS 863 N -0.68 2.58 -0.08 1.70 2.20 -1.26 -4.83 119.74 119.38 3hp6 s LYS 863 Ca 0.18 -0.79 0.02 0.00 -0.36 0.00 0.00 55.97 55.02 3hp6 s LYS 863 Cb -0.14 -2.31 0.01 0.00 -1.51 0.00 0.00 37.83 33.89 3hp6 s LYS 863 CO 0.07 0.49 -0.12 0.08 -0.36 0.00 0.00 175.35 175.51 3hp6 s VAL 864 N -0.41 1.21 0.05 4.02 1.01 -1.26 0.05 120.40 125.07 3hp6 s VAL 864 Ca 0.04 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.53 3hp6 s VAL 864 Cb -0.12 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 3hp6 s VAL 864 CO 0.02 0.38 0.16 -1.81 0.00 0.00 0.00 175.10 173.85 3hp6 s ASP 865 N 0.87 6.09 -0.03 3.32 1.01 -0.20 -4.90 116.67 122.84 3hp6 s ASP 865 Ca -0.10 0.20 -0.12 0.00 0.71 0.00 0.00 52.55 53.23 3hp6 s ASP 865 Cb -0.15 -1.82 0.02 0.00 1.01 0.00 0.00 42.92 41.98 3hp6 s ASP 865 CO 0.01 0.19 0.27 -0.72 0.21 0.00 0.00 175.17 175.14 3hp6 s TYR 866 N -1.43 -0.16 0.02 4.23 1.13 -1.26 0.08 117.35 119.97 3hp6 s TYR 866 Ca 0.31 0.29 -0.25 0.00 -1.41 0.00 0.00 57.07 56.01 3hp6 s TYR 866 Cb -0.13 0.07 0.06 0.00 -1.10 0.00 0.00 41.96 40.86 3hp6 s TYR 866 CO 0.24 -0.32 0.57 -1.01 -2.51 0.00 0.00 175.55 172.52 3hp6 s HIS 867 N -1.05 -0.51 0.15 -3.49 3.76 0.83 -4.99 115.29 109.99 3hp6 s HIS 867 Ca -0.11 0.67 0.00 0.00 -0.15 0.00 0.00 55.06 55.47 3hp6 s HIS 867 Cb -0.05 0.38 -0.04 0.00 1.11 0.00 0.00 32.58 33.97 3hp6 s HIS 867 CO 0.03 -0.64 0.03 1.52 -0.85 0.00 0.00 174.74 174.83 3hp6 s TYR 868 N -2.11 1.01 0.00 1.40 1.13 -1.26 -0.09 117.35 117.44 3hp6 s TYR 868 Ca -0.07 -1.14 0.00 0.00 -1.41 0.00 0.00 57.07 54.45 3hp6 s TYR 868 Cb -0.01 -0.58 0.00 0.00 -1.10 0.00 0.00 41.96 40.28 3hp6 s TYR 868 CO 0.01 -0.39 0.00 0.41 -2.51 0.00 0.00 175.55 173.08 3hp6 n GLY 869 N -0.16 -0.89 0.03 5.49 0.00 -0.86 -4.36 105.19 104.45 3hp6 n GLY 869 Ca -0.06 -1.10 0.14 0.00 0.00 0.00 0.00 46.02 45.01 3hp6 n GLY 869 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hp6 n SER 870 N 0.00 0.15 -4.17 1.61 3.41 -1.26 -1.29 113.62 112.07 3hp6 n SER 870 Ca 0.00 -0.15 -0.11 0.00 -0.26 0.00 0.00 58.87 58.35 3hp6 n SER 870 Cb 0.00 -0.24 -0.10 0.00 -0.26 0.00 0.00 64.21 63.61 3hp6 n SER 870 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 3hp6 s THR 871 N -2.64 0.05 0.17 6.66 -4.23 -1.26 -4.35 115.64 110.04 3hp6 s THR 871 Ca 0.25 -1.94 -0.14 0.00 -1.18 0.00 0.00 61.69 58.68 3hp6 s THR 871 Cb 0.20 -2.27 0.07 0.00 1.34 0.00 0.00 72.50 71.83 3hp6 s THR 871 CO 0.49 -0.22 1.82 -0.25 -0.54 0.00 0.00 174.62 175.91 3hp6 h TRP 872 N 2.73 0.58 -0.78 3.99 7.01 -1.09 -1.50 115.95 126.89 3hp6 h TRP 872 Ca -0.35 0.02 0.17 0.00 2.11 0.00 0.00 58.89 60.84 3hp6 h TRP 872 Cb 1.23 -0.19 -0.14 0.00 -2.10 0.00 0.00 29.16 27.95 3hp6 h TRP 872 CO 0.39 0.34 -0.08 -0.92 -2.79 0.00 0.00 178.44 175.39 3hp6 h TYR 873 N 0.62 -0.20 0.00 2.65 3.20 -1.66 0.12 116.97 121.70 3hp6 h TYR 873 Ca 0.20 0.06 0.00 0.00 3.14 0.00 0.00 58.73 62.14 3hp6 h TYR 873 Cb 0.00 0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.48 3hp6 h TYR 873 CO -0.06 -0.30 0.00 -0.44 -1.64 0.00 0.00 178.16 175.72 3hp6 h ASP 874 N 0.05 0.00 0.00 -2.11 5.19 -1.60 -3.36 116.42 114.59 3hp6 h ASP 874 Ca 0.41 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 56.28 3hp6 h ASP 874 Cb 0.70 0.00 0.02 0.00 0.18 0.00 0.00 39.33 40.23 3hp6 h ASP 874 CO -0.74 0.00 3.15 0.00 -3.12 0.00 0.00 179.24 178.53 3hp6 n ALA 875 N -1.95 6.58 -1.21 3.45 0.00 0.03 -4.43 120.51 122.98 3hp6 n ALA 875 Ca 0.02 -2.91 0.00 0.00 0.00 0.00 0.00 53.44 50.55 3hp6 n ALA 875 Cb 0.33 -3.18 0.00 0.00 0.00 0.00 0.00 19.45 16.61 3hp6 n ALA 875 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86