#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g6h s PHE 300 N 0.00 2.85 0.30 -0.14 0.40 -1.26 -4.88 117.98 115.25 2g6h s PHE 300 Ca 0.00 -0.80 -0.19 0.00 -0.60 0.00 0.00 56.93 55.34 2g6h s PHE 300 Cb 0.00 -4.18 -0.09 0.00 0.51 0.00 0.00 43.02 39.26 2g6h s PHE 300 CO 0.00 -1.49 0.80 -0.51 0.70 0.00 0.00 175.22 174.71 2g6h s LEU 301 N 3.37 4.18 0.03 -0.37 1.43 -1.11 -4.84 118.68 121.37 2g6h s LEU 301 Ca 0.19 1.47 0.08 0.00 -1.03 0.00 0.00 54.13 54.85 2g6h s LEU 301 Cb -0.19 -3.97 -0.03 0.00 0.03 0.00 0.00 46.19 42.04 2g6h s LEU 301 CO 0.07 -0.13 -0.24 -0.54 0.23 0.00 0.00 176.35 175.74 2g6h s LYS 302 N -2.52 1.94 -0.03 1.70 1.02 -1.26 0.22 119.74 120.81 2g6h s LYS 302 Ca 0.51 -1.03 0.05 0.00 0.02 0.00 0.00 55.97 55.52 2g6h s LYS 302 Cb -0.13 -2.05 -0.01 0.00 -0.52 0.00 0.00 37.83 35.12 2g6h s LYS 302 CO 0.19 0.53 -0.18 0.14 -0.92 0.00 0.00 175.35 175.11 2g6h s VAL 303 N -0.79 1.47 0.05 3.17 -7.23 0.50 -4.96 120.40 112.61 2g6h s VAL 303 Ca 0.12 -0.77 0.07 0.00 -1.81 0.00 0.00 61.98 59.59 2g6h s VAL 303 Cb -0.10 -1.24 -0.03 0.00 0.56 0.00 0.00 36.38 35.57 2g6h s VAL 303 CO 0.02 0.42 -0.18 -0.75 -0.31 0.00 0.00 175.10 174.30 2g6h s LYS 304 N -0.26 2.04 -0.34 4.82 2.20 -1.26 -1.13 119.74 125.80 2g6h s LYS 304 Ca 0.03 -1.01 -0.12 0.00 -0.36 0.00 0.00 55.97 54.51 2g6h s LYS 304 Cb -0.09 -2.18 -0.00 0.00 -1.51 0.00 0.00 37.83 34.05 2g6h s LYS 304 CO 0.00 0.53 0.22 1.21 -0.36 0.00 0.00 175.35 176.96 2g6h s ASN 305 N -1.52 5.88 0.00 1.43 3.84 -0.24 -1.53 114.94 122.80 2g6h s ASN 305 Ca 0.15 -0.58 0.17 0.00 0.21 0.00 0.00 52.86 52.82 2g6h s ASN 305 Cb -0.10 -2.09 0.80 0.00 -0.55 0.00 0.00 41.25 39.31 2g6h s ASN 305 CO 0.06 -0.27 1.54 0.79 -2.79 0.00 0.00 177.10 176.43 2g6h n TRP 306 N 5.06 0.00 -0.05 0.43 7.02 0.30 0.36 117.44 130.56 2g6h n TRP 306 Ca -0.13 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.32 2g6h n TRP 306 Cb 0.49 -0.41 -0.15 0.00 -2.42 0.00 0.00 31.31 28.82 2g6h n TRP 306 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 2g6h n GLU 307 N -1.41 0.67 0.00 -0.99 2.13 -1.26 -4.50 120.64 115.28 2g6h n GLU 307 Ca 0.06 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.89 2g6h n GLU 307 Cb 0.18 -1.58 0.00 0.00 0.27 0.00 0.00 31.44 30.31 2g6h n GLU 307 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2g6h n THR 308 N -2.68 0.00 -0.61 6.31 -2.24 -1.13 -4.99 114.28 108.94 2g6h n THR 308 Ca -0.22 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.07 2g6h n THR 308 Cb 0.97 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 70.23 2g6h n THR 308 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2g6h n ASP 309 N -0.11 -0.28 -4.75 3.42 8.00 0.16 -4.92 116.55 118.06 2g6h n ASP 309 Ca 0.01 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.10 2g6h n ASP 309 Cb 0.05 -2.12 -0.02 0.00 -0.02 0.00 0.00 41.12 39.01 2g6h n ASP 309 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2g6h s VAL 310 N -1.50 2.38 -0.09 2.53 1.01 -1.23 -4.74 120.40 118.77 2g6h s VAL 310 Ca 0.00 0.33 0.03 0.00 0.00 0.00 0.00 61.98 62.34 2g6h s VAL 310 Cb 0.00 -3.21 0.00 0.00 0.00 0.00 0.00 36.38 33.18 2g6h s VAL 310 CO 0.00 0.05 -0.20 -0.69 0.00 0.00 0.00 175.10 174.27 2g6h s VAL 311 N -0.11 1.74 0.11 2.92 1.01 -1.26 -1.08 120.40 123.72 2g6h s VAL 311 Ca 0.60 -0.83 0.09 0.00 0.00 0.00 0.00 61.98 61.84 2g6h s VAL 311 Cb -0.44 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.37 2g6h s VAL 311 CO 0.47 0.49 -0.21 -0.76 0.00 0.00 0.00 175.10 175.09 2g6h s LEU 312 N 0.45 2.55 -0.17 3.92 1.43 -0.29 -4.96 118.68 121.62 2g6h s LEU 312 Ca -0.17 -0.60 -0.04 0.00 -1.03 0.00 0.00 54.13 52.29 2g6h s LEU 312 Cb -0.17 -1.44 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 2g6h s LEU 312 CO 0.07 0.19 -0.03 -0.89 0.23 0.00 0.00 176.35 175.92 2g6h s THR 313 N -1.08 3.88 -0.31 5.49 2.01 -1.26 -0.37 115.64 124.01 2g6h s THR 313 Ca 0.16 -0.35 -0.10 0.00 0.31 0.00 0.00 61.69 61.70 2g6h s THR 313 Cb -0.10 -2.72 -0.02 0.00 0.01 0.00 0.00 72.50 69.67 2g6h s THR 313 CO 0.08 0.48 0.17 -0.62 -0.69 0.00 0.00 174.62 174.04 2g6h s ASP 314 N 0.53 5.69 -0.07 3.53 -1.08 0.58 -4.62 116.67 121.24 2g6h s ASP 314 Ca -0.03 -0.39 0.09 0.00 -0.52 0.00 0.00 52.55 51.70 2g6h s ASP 314 Cb -0.14 -2.04 -0.13 0.00 -1.46 0.00 0.00 42.92 39.15 2g6h s ASP 314 CO 0.03 -0.17 0.09 0.35 0.52 0.00 0.00 175.17 175.98 2g6h n THR 315 N 5.02 0.45 -0.26 1.71 -2.24 0.42 -2.75 114.28 116.63 2g6h n THR 315 Ca -0.14 -0.35 0.17 0.00 -2.27 0.00 0.00 64.05 61.47 2g6h n THR 315 Cb 0.50 -0.46 0.46 0.00 -2.10 0.00 0.00 70.33 68.74 2g6h n THR 315 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2g6h h LEU 316 N 0.00 0.50 -2.55 3.22 5.85 -1.37 0.51 115.31 121.47 2g6h h LEU 316 Ca -0.18 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.60 2g6h h LEU 316 Cb 1.25 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 42.23 2g6h h LEU 316 CO 0.01 0.21 0.11 1.12 -0.34 0.00 0.00 178.44 179.54 2g6h h HIS 317 N 0.50 0.00 0.00 1.25 2.07 -1.82 0.14 115.15 117.29 2g6h h HIS 317 Ca 0.48 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.00 2g6h h HIS 317 Cb 1.06 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.04 2g6h h HIS 317 CO -0.00 0.00 0.00 1.28 -3.07 0.00 0.00 177.93 176.14 2g6h n LEU 318 N -3.33 0.00 -1.09 6.12 4.77 0.17 -0.67 117.00 122.97 2g6h n LEU 318 Ca -0.02 0.45 0.10 0.00 -0.03 0.00 0.00 56.01 56.52 2g6h n LEU 318 Cb 0.19 -0.45 0.23 0.00 -2.33 0.00 0.00 43.42 41.06 2g6h n LEU 318 CO 0.22 -0.32 0.70 0.29 -1.33 0.00 0.00 177.39 176.94 2g6h n LYS 319 N -1.45 2.52 -1.82 3.23 5.02 0.49 -4.98 118.16 121.17 2g6h n LYS 319 Ca 0.02 -2.31 -0.40 0.00 -2.02 0.00 0.00 58.31 53.61 2g6h n LYS 319 Cb 0.09 -1.47 0.02 0.00 -0.02 0.00 0.00 35.03 33.65 2g6h n LYS 319 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2g6h s SER 320 N -1.20 5.82 0.00 4.39 0.15 0.16 -4.90 113.70 118.12 2g6h s SER 320 Ca 0.38 2.87 0.00 0.00 0.70 0.00 0.00 55.95 59.90 2g6h s SER 320 Cb 0.21 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.87 2g6h s SER 320 CO 0.28 -1.21 0.00 1.07 1.20 0.00 0.00 173.24 174.58 2g6h n THR 321 N -0.30 0.00 -2.15 6.45 5.66 -1.07 -5.06 114.28 117.81 2g6h n THR 321 Ca 0.06 0.00 -0.27 0.00 -3.05 0.00 0.00 64.05 60.78 2g6h n THR 321 Cb 0.42 -0.46 0.14 0.00 -1.55 0.00 0.00 70.33 68.88 2g6h n THR 321 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2g6h s LEU 322 N -4.69 2.79 0.34 1.09 1.43 -1.22 -5.09 118.68 113.33 2g6h s LEU 322 Ca 0.00 0.16 0.03 0.00 -1.03 0.00 0.00 54.13 53.29 2g6h s LEU 322 Cb 0.00 -2.42 -0.02 0.00 0.03 0.00 0.00 46.19 43.78 2g6h s LEU 322 CO 0.00 -2.25 0.52 -1.61 0.23 0.00 0.00 176.35 173.24 2g6h s GLU 323 N -5.56 3.32 -0.14 1.70 2.02 -1.26 -4.64 118.70 114.14 2g6h s GLU 323 Ca 0.69 -0.59 0.18 0.00 0.02 0.00 0.00 54.97 55.27 2g6h s GLU 323 Cb -0.06 -2.72 -0.26 0.00 0.10 0.00 0.00 34.13 31.19 2g6h s GLU 323 CO 0.49 0.11 0.18 0.25 0.02 0.00 0.00 175.26 176.31 2g6h n THR 324 N -1.74 0.94 0.00 3.63 -2.24 -1.26 -4.78 114.28 108.84 2g6h n THR 324 Ca -0.04 -0.72 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 2g6h n THR 324 Cb 0.57 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 2g6h n THR 324 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g6h n GLY 325 N 1.67 1.79 3.97 3.38 0.00 -1.26 -4.86 105.19 109.89 2g6h n GLY 325 Ca -0.23 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.57 2g6h n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g6h s THR 327 N -2.81 0.01 0.26 0.00 -4.23 0.62 -4.97 115.64 104.52 2g6h s THR 327 Ca 0.58 -1.39 0.35 0.00 -1.18 0.00 0.00 61.69 60.05 2g6h s THR 327 Cb -0.10 -2.10 0.36 0.00 1.34 0.00 0.00 72.50 72.00 2g6h s THR 327 CO 0.39 -0.06 2.08 -0.33 -0.54 0.00 0.00 174.62 176.15 2g6h h GLU 328 N 2.33 0.00 0.00 3.99 3.07 -2.05 -2.29 114.58 119.63 2g6h h GLU 328 Ca -0.28 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.58 2g6h h GLU 328 Cb 1.25 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.16 2g6h h GLU 328 CO 0.39 0.00 -1.86 0.72 -1.40 0.00 0.00 179.01 176.86 2g6h n HIS 329 N -2.80 0.00 -3.74 4.33 8.25 -1.26 -4.99 115.22 115.02 2g6h n HIS 329 Ca -0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.32 2g6h n HIS 329 Cb 0.11 -0.43 -0.11 0.00 1.12 0.00 0.00 29.99 30.69 2g6h n HIS 329 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 2g6h s ILE 330 N -3.42 -0.00 -0.20 1.59 2.07 -0.86 -5.13 121.20 115.24 2g6h s ILE 330 Ca -0.06 0.02 -0.07 0.00 -1.41 0.00 0.00 60.65 59.13 2g6h s ILE 330 Cb 0.14 -0.53 -0.04 0.00 0.13 0.00 0.00 42.46 42.17 2g6h s ILE 330 CO 0.88 0.01 0.05 0.00 -1.91 0.00 0.00 174.94 173.97 2g6h n MET 332 N 4.01 1.95 0.10 0.00 0.00 -1.26 -4.80 117.12 117.12 2g6h n MET 332 Ca -0.16 -3.04 0.19 0.00 0.00 0.00 0.00 57.70 54.69 2g6h n MET 332 Cb 0.52 -1.75 0.66 0.00 0.00 0.00 0.00 33.22 32.65 2g6h n MET 332 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 2g6h h GLY 333 N 1.03 0.00 -2.27 3.03 0.00 -1.93 -0.31 103.07 102.63 2g6h h GLY 333 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.44 2g6h h GLY 333 CO 0.23 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.63 2g6h n SER 334 N -3.38 3.56 -4.69 0.19 3.41 -1.26 -4.85 113.62 106.61 2g6h n SER 334 Ca 0.08 -1.98 -0.42 0.00 -0.26 0.00 0.00 58.87 56.29 2g6h n SER 334 Cb 0.76 -0.36 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 2g6h n SER 334 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2g6h s ILE 335 N -1.14 4.80 0.19 -1.33 -1.09 -0.13 -4.95 121.20 117.55 2g6h s ILE 335 Ca 0.40 1.99 -0.12 0.00 -2.23 0.00 0.00 60.65 60.69 2g6h s ILE 335 Cb 0.22 -4.29 0.11 0.00 -1.58 0.00 0.00 42.46 36.92 2g6h s ILE 335 CO 0.29 0.01 1.86 0.24 -1.23 0.00 0.00 174.94 176.11 2g6h h MET 336 N 7.11 0.85 -2.84 2.79 2.86 -1.91 -3.36 114.93 120.44 2g6h h MET 336 Ca -0.31 -0.05 -0.61 0.00 -2.06 0.00 0.00 59.70 56.67 2g6h h MET 336 Cb 1.15 -0.19 -0.40 0.00 0.06 0.00 0.00 31.60 32.21 2g6h h MET 336 CO 0.85 0.56 -0.73 -0.51 1.06 0.00 0.00 176.91 178.15 2g6h s LEU 337 N -10.15 3.47 0.03 1.22 1.43 -1.26 -5.15 118.68 108.27 2g6h s LEU 337 Ca -0.13 -3.47 -0.16 0.00 -1.03 0.00 0.00 54.13 49.34 2g6h s LEU 337 Cb 0.14 -1.18 -0.08 0.00 0.03 0.00 0.00 46.19 45.10 2g6h s LEU 337 CO 0.76 -0.13 1.24 -0.65 0.23 0.00 0.00 176.35 177.80 2g6h h PRO 338 N 5.61 -0.49 0.00 1.29 0.11 -1.90 -3.54 132.00 133.09 2g6h h PRO 338 Ca 0.17 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.31 2g6h h PRO 338 Cb 0.82 0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.05 2g6h h PRO 338 CO 0.58 -0.33 0.00 2.41 -0.21 0.00 0.00 178.00 180.45 2g6h n THR 350 N -3.63 0.00 -0.32 -1.15 -1.04 -1.26 -5.02 114.28 101.86 2g6h n THR 350 Ca -0.06 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.10 2g6h n THR 350 Cb 0.22 0.00 0.38 0.00 -1.82 0.00 0.00 70.33 69.11 2g6h n THR 350 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2g6h h LYS 351 N 0.00 0.64 -0.34 -2.82 1.57 -1.95 0.26 116.57 113.93 2g6h h LYS 351 Ca 0.00 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 2g6h h LYS 351 Cb 0.00 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 2g6h h LYS 351 CO 0.00 0.42 -0.21 -0.44 -0.57 0.00 0.00 179.45 178.65 2g6h h ASP 352 N 0.66 0.66 -0.17 0.86 3.45 -1.99 -2.42 116.42 117.46 2g6h h ASP 352 Ca 0.53 -0.22 -0.21 0.00 0.43 0.00 0.00 57.03 57.56 2g6h h ASP 352 Cb 0.97 -0.18 0.01 0.00 -0.56 0.00 0.00 39.33 39.56 2g6h h ASP 352 CO -0.30 0.87 -0.69 1.56 -1.57 0.00 0.00 179.24 179.11 2g6h h GLN 353 N 0.58 0.80 -0.00 3.56 4.20 -1.14 -3.38 115.11 119.73 2g6h h GLN 353 Ca 0.09 -0.59 -0.00 0.00 0.06 0.00 0.00 58.65 58.20 2g6h h GLN 353 Cb 0.68 0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.56 2g6h h GLN 353 CO 0.05 1.21 -0.00 1.25 -0.67 0.00 0.00 178.83 180.67 2g6h h LEU 354 N 0.57 0.00 -0.62 1.46 5.85 -0.44 -3.33 115.31 118.80 2g6h h LEU 354 Ca -0.03 -0.39 0.08 0.00 0.84 0.00 0.00 57.88 58.38 2g6h h LEU 354 Cb 1.31 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.27 2g6h h LEU 354 CO 0.14 0.39 0.29 0.15 -0.34 0.00 0.00 178.44 179.07 2g6h h PHE 355 N -0.39 0.52 -0.69 1.25 3.57 -1.61 -0.97 116.94 118.62 2g6h h PHE 355 Ca 0.00 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.56 2g6h h PHE 355 Cb 0.39 -0.14 -0.05 0.00 2.79 0.00 0.00 35.95 38.94 2g6h h PHE 355 CO 0.06 0.20 0.43 -1.00 -2.23 0.00 0.00 178.31 175.76 2g6h h PRO 356 N 0.52 0.80 -0.13 6.41 0.13 -1.76 0.21 132.00 138.18 2g6h h PRO 356 Ca 0.30 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 65.39 2g6h h PRO 356 Cb 0.29 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 31.23 2g6h h PRO 356 CO -0.24 0.53 0.04 -0.07 -0.23 0.00 0.00 178.00 178.03 2g6h h LEU 357 N 0.83 0.04 -0.71 1.56 3.38 -1.48 0.28 115.31 119.21 2g6h h LEU 357 Ca 0.28 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.28 2g6h h LEU 357 Cb 0.05 0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 2g6h h LEU 357 CO -0.12 0.05 0.47 0.00 0.09 0.00 0.00 178.44 178.93 2g6h h ALA 358 N 1.08 0.91 -0.04 1.53 0.00 -0.75 -0.95 119.26 121.05 2g6h h ALA 358 Ca 0.06 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.93 2g6h h ALA 358 Cb 0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2g6h h ALA 358 CO -0.06 0.32 0.00 -0.22 0.00 0.00 0.00 179.25 179.28 2g6h h LYS 359 N 0.96 0.02 -0.24 0.00 3.64 0.15 0.26 116.57 121.35 2g6h h LYS 359 Ca 0.26 -0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.70 2g6h h LYS 359 Cb -0.10 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 31.66 2g6h h LYS 359 CO -0.06 0.01 -0.12 1.49 -2.27 0.00 0.00 179.45 178.50 2g6h h GLU 360 N 0.02 -0.08 0.31 1.90 4.81 -0.10 -0.13 114.58 121.31 2g6h h GLU 360 Ca 0.02 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 2g6h h GLU 360 Cb 0.02 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 2g6h h GLU 360 CO -0.03 -0.06 -0.18 0.35 -0.73 0.00 0.00 179.01 178.37 2g6h h PHE 361 N -0.09 -0.46 -0.96 0.92 3.57 -0.79 -1.81 116.94 117.31 2g6h h PHE 361 Ca 0.13 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.70 2g6h h PHE 361 Cb 0.28 0.16 -0.07 0.00 2.79 0.00 0.00 35.95 39.12 2g6h h PHE 361 CO -0.30 -0.28 0.62 -0.07 -2.23 0.00 0.00 178.31 176.05 2g6h h LEU 362 N -0.46 0.94 -0.29 0.59 3.38 -0.27 0.36 115.31 119.56 2g6h h LEU 362 Ca -0.03 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2g6h h LEU 362 Cb 0.38 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2g6h h LEU 362 CO 0.04 0.58 0.14 0.44 0.09 0.00 0.00 178.44 179.73 2g6h h ASP 363 N 1.05 0.37 -0.50 -0.43 3.32 -0.77 0.25 116.42 119.71 2g6h h ASP 363 Ca 0.43 -0.12 -0.12 0.00 0.02 0.00 0.00 57.03 57.24 2g6h h ASP 363 Cb 0.28 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2g6h h ASP 363 CO -0.18 0.38 -0.15 0.06 -1.72 0.00 0.00 179.24 177.63 2g6h h GLN 364 N 0.34 1.00 0.40 3.56 3.07 -0.45 0.46 115.11 123.49 2g6h h GLN 364 Ca 0.10 -0.39 -0.01 0.00 0.09 0.00 0.00 58.65 58.44 2g6h h GLN 364 Cb 0.11 -0.05 -0.01 0.00 0.08 0.00 0.00 27.48 27.60 2g6h h GLN 364 CO -0.01 1.07 -0.31 -0.92 0.09 0.00 0.00 178.83 178.75 2g6h h TYR 365 N 0.88 -0.82 -0.29 0.06 3.20 0.11 0.51 116.97 120.62 2g6h h TYR 365 Ca 0.13 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 2g6h h TYR 365 Cb 0.72 0.31 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 2g6h h TYR 365 CO 0.05 -0.46 0.01 1.88 -1.64 0.00 0.00 178.16 178.00 2g6h h TYR 366 N -0.71 0.43 -0.68 -3.82 -1.99 -0.43 -1.24 116.97 108.54 2g6h h TYR 366 Ca -0.04 -0.03 -0.05 0.00 2.00 0.00 0.00 58.73 60.61 2g6h h TYR 366 Cb 0.61 -0.13 -0.03 0.00 2.00 0.00 0.00 36.73 39.18 2g6h h TYR 366 CO -0.14 0.43 0.21 1.03 -0.00 0.00 0.00 178.16 179.69 2g6h h SER 367 N 0.42 0.96 0.29 3.88 0.87 -0.54 0.18 113.55 119.60 2g6h h SER 367 Ca 0.09 -0.17 -0.06 0.00 -1.23 0.00 0.00 61.79 60.43 2g6h h SER 367 Cb 0.26 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.96 2g6h h SER 367 CO 0.01 0.89 -0.28 0.77 -0.53 0.00 0.00 176.83 177.69 2g6h h SER 368 N 1.00 0.00 -0.54 6.23 4.64 0.29 -2.29 113.55 122.87 2g6h h SER 368 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2g6h h SER 368 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2g6h h SER 368 CO -0.01 0.28 0.00 2.30 -0.87 0.00 0.00 176.83 178.53 2g6h n ILE 369 N -4.19 1.86 -2.70 0.95 -5.35 -0.89 -4.93 119.36 104.12 2g6h n ILE 369 Ca -0.02 -1.08 -0.22 0.00 -0.27 0.00 0.00 62.75 61.16 2g6h n ILE 369 Cb 0.33 -0.07 0.01 0.00 -1.74 0.00 0.00 39.64 38.18 2g6h n ILE 369 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2g6h n LYS 370 N 0.81 -3.24 -1.83 6.28 5.02 -0.86 -4.89 118.16 119.46 2g6h n LYS 370 Ca 0.23 0.97 -0.06 0.00 -2.02 0.00 0.00 58.31 57.43 2g6h n LYS 370 Cb 0.89 -5.72 0.07 0.00 -0.02 0.00 0.00 35.03 30.25 2g6h n LYS 370 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2g6h n ARG 371 N -3.50 1.99 -2.02 1.97 1.74 -0.00 -5.03 116.66 111.81 2g6h n ARG 371 Ca -0.18 -3.40 -0.42 0.00 -0.77 0.00 0.00 57.85 53.08 2g6h n ARG 371 Cb 0.66 -1.53 -0.03 0.00 -1.02 0.00 0.00 32.46 30.54 2g6h n ARG 371 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2g6h s PHE 372 N -2.91 2.49 -0.75 -1.55 5.36 -1.16 -2.32 117.98 117.14 2g6h s PHE 372 Ca 0.38 0.44 0.00 0.00 -0.96 0.00 0.00 56.93 56.80 2g6h s PHE 372 Cb 0.37 -3.88 0.00 0.00 -0.34 0.00 0.00 43.02 39.18 2g6h s PHE 372 CO -0.05 -3.47 0.00 0.41 -1.46 0.00 0.00 175.22 170.65 2g6h n GLY 373 N 3.91 0.89 3.95 13.12 0.00 -1.26 -5.01 105.19 120.79 2g6h n GLY 373 Ca 0.15 -0.72 -0.27 0.00 0.00 0.00 0.00 46.02 45.19 2g6h n GLY 373 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g6h s SER 374 N -2.91 3.96 0.10 1.61 1.04 -0.98 -4.85 113.70 111.67 2g6h s SER 374 Ca 0.00 0.13 -0.16 0.00 0.48 0.00 0.00 55.95 56.40 2g6h s SER 374 Cb 0.00 -0.44 -0.05 0.00 0.10 0.00 0.00 66.02 65.62 2g6h s SER 374 CO 0.00 -2.16 1.53 0.50 0.98 0.00 0.00 173.24 174.09 2g6h h LYS 375 N -1.02 0.60 -0.68 4.02 3.64 -1.96 0.06 116.57 121.22 2g6h h LYS 375 Ca -0.42 -0.21 0.13 0.00 -1.27 0.00 0.00 60.65 58.88 2g6h h LYS 375 Cb 1.27 -0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 32.95 2g6h h LYS 375 CO 0.45 0.75 0.22 0.00 -2.27 0.00 0.00 179.45 178.60 2g6h h ALA 376 N 0.83 0.90 0.91 5.00 0.00 -1.93 1.27 119.26 126.23 2g6h h ALA 376 Ca 0.09 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 2g6h h ALA 376 Cb 0.50 0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.42 2g6h h ALA 376 CO 0.02 -0.25 -0.44 1.25 0.00 0.00 0.00 179.25 179.84 2g6h h HIS 377 N 0.36 -1.13 -0.49 0.00 -0.00 -1.67 0.07 115.15 112.30 2g6h h HIS 377 Ca 0.37 -0.03 0.08 0.00 -0.00 0.00 0.00 60.37 60.79 2g6h h HIS 377 Cb 0.55 0.37 -0.06 0.00 -0.00 0.00 0.00 27.41 28.27 2g6h h HIS 377 CO -0.20 -0.70 0.13 0.52 -0.00 0.00 0.00 177.93 177.68 2g6h h MET 378 N -1.26 0.27 0.20 5.26 2.07 -0.22 0.26 114.93 121.53 2g6h h MET 378 Ca -0.12 -0.02 -0.00 0.00 -2.07 0.00 0.00 59.70 57.49 2g6h h MET 378 Cb 0.94 -0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 30.59 2g6h h MET 378 CO 0.20 0.18 -0.30 -0.44 1.07 0.00 0.00 176.91 177.62 2g6h h ASP 379 N 0.28 -0.86 -0.86 1.22 3.45 0.17 0.15 116.42 119.96 2g6h h ASP 379 Ca 0.24 0.08 0.18 0.00 0.43 0.00 0.00 57.03 57.96 2g6h h ASP 379 Cb 0.30 0.30 -0.11 0.00 -0.56 0.00 0.00 39.33 39.26 2g6h h ASP 379 CO -0.29 -0.37 0.41 -0.09 -1.57 0.00 0.00 179.24 177.34 2g6h h ARG 380 N -0.53 0.51 -0.37 3.56 9.65 -0.76 0.29 114.38 126.72 2g6h h ARG 380 Ca -0.02 -0.03 0.02 0.00 -1.10 0.00 0.00 59.98 58.85 2g6h h ARG 380 Cb 0.49 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.92 2g6h h ARG 380 CO -0.09 0.33 0.20 1.25 2.80 0.00 0.00 179.97 184.47 2g6h h LEU 381 N 0.52 0.31 -0.46 3.80 5.85 -0.48 -0.16 115.31 124.69 2g6h h LEU 381 Ca 0.50 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 59.19 2g6h h LEU 381 Cb 0.81 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.77 2g6h h LEU 381 CO -0.43 0.23 0.13 -0.08 -0.34 0.00 0.00 178.44 177.95 2g6h h GLU 382 N 0.41 0.72 0.09 1.25 4.57 0.19 -0.96 114.58 120.85 2g6h h GLU 382 Ca 0.15 -0.16 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 2g6h h GLU 382 Cb 0.04 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 2g6h h GLU 382 CO -0.09 0.70 -0.08 1.49 -1.18 0.00 0.00 179.01 179.85 2g6h h GLU 383 N 0.61 -0.17 -0.62 1.92 4.81 -0.14 0.16 114.58 121.14 2g6h h GLU 383 Ca 0.15 0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2g6h h GLU 383 Cb 0.28 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.67 2g6h h GLU 383 CO -0.00 -0.12 0.37 0.28 -0.73 0.00 0.00 179.01 178.81 2g6h h VAL 384 N -0.18 1.18 -0.20 0.32 2.07 -1.01 0.62 116.25 119.05 2g6h h VAL 384 Ca 0.00 -0.42 0.05 0.00 0.82 0.00 0.00 66.70 67.16 2g6h h VAL 384 Cb 0.17 0.34 -0.06 0.00 -1.52 0.00 0.00 31.29 30.21 2g6h h VAL 384 CO -0.01 0.19 -0.19 -1.13 0.02 0.00 0.00 177.57 176.45 2g6h h ASN 385 N 0.84 -0.61 -0.08 0.57 -0.73 -0.70 0.19 115.58 115.06 2g6h h ASN 385 Ca 0.22 0.11 0.00 0.00 1.87 0.00 0.00 56.30 58.51 2g6h h ASN 385 Cb -0.01 0.29 -0.00 0.00 0.27 0.00 0.00 38.32 38.87 2g6h h ASN 385 CO -0.04 -0.24 0.05 0.11 -0.37 0.00 0.00 177.43 176.95 2g6h h LYS 386 N -0.21 0.11 -0.94 6.67 1.57 -0.24 -1.75 116.57 121.79 2g6h h LYS 386 Ca 0.12 -0.01 0.12 0.00 -1.87 0.00 0.00 60.65 59.01 2g6h h LYS 386 Cb 0.39 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.60 2g6h h LYS 386 CO -0.32 0.09 0.60 1.49 -0.57 0.00 0.00 179.45 180.74 2g6h h GLU 387 N 0.10 0.87 0.31 3.15 4.81 -0.24 0.56 114.58 124.13 2g6h h GLU 387 Ca 0.03 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 59.19 2g6h h GLU 387 Cb 0.01 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.19 2g6h h GLU 387 CO -0.01 0.58 -0.15 0.82 -0.73 0.00 0.00 179.01 179.52 2g6h h ILE 388 N 0.90 0.65 -0.67 2.32 2.04 -0.33 0.91 117.51 123.33 2g6h h ILE 388 Ca 0.45 -0.66 0.18 0.00 1.00 0.00 0.00 64.86 65.83 2g6h h ILE 388 Cb 0.50 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 2g6h h ILE 388 CO -0.22 0.12 0.47 -0.08 0.00 0.00 0.00 178.15 178.45 2g6h h GLU 389 N -0.82 0.09 0.00 2.37 4.22 -0.94 1.07 114.58 120.57 2g6h h GLU 389 Ca -0.04 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.39 2g6h h GLU 389 Cb 0.52 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2g6h h GLU 389 CO 0.07 0.06 -0.03 1.03 -2.18 0.00 0.00 179.01 177.96 2g6h h SER 390 N 0.09 0.00 0.79 1.04 0.87 -0.69 -3.40 113.55 112.25 2g6h h SER 390 Ca 0.32 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.88 2g6h h SER 390 Cb 1.16 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.12 2g6h h SER 390 CO -0.03 0.10 -0.06 0.35 -0.53 0.00 0.00 176.83 176.65 2g6h n THR 391 N -2.54 0.00 -0.92 2.23 -2.24 0.31 -4.90 114.28 106.23 2g6h n THR 391 Ca -0.00 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2g6h n THR 391 Cb 0.02 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 67.86 2g6h n THR 391 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2g6h n SER 392 N -1.40 -1.48 -1.25 3.42 3.41 0.37 -4.90 113.62 111.78 2g6h n SER 392 Ca 0.09 0.00 -0.01 0.00 -0.26 0.00 0.00 58.87 58.69 2g6h n SER 392 Cb 0.31 -0.91 0.00 0.00 -0.26 0.00 0.00 64.21 63.36 2g6h n SER 392 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2g6h n THR 393 N -2.29 0.00 -3.88 6.66 5.66 -1.24 -4.70 114.28 114.49 2g6h n THR 393 Ca 0.00 -0.15 -0.09 0.00 -3.05 0.00 0.00 64.05 60.76 2g6h n THR 393 Cb 0.05 0.14 -0.01 0.00 -1.55 0.00 0.00 70.33 68.96 2g6h n THR 393 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2g6h s TYR 394 N -7.61 0.10 -0.02 1.09 -0.85 -1.26 -3.21 117.35 105.59 2g6h s TYR 394 Ca 0.02 -0.61 0.07 0.00 -0.52 0.00 0.00 57.07 56.04 2g6h s TYR 394 Cb -0.01 0.62 -0.02 0.00 0.38 0.00 0.00 41.96 42.94 2g6h s TYR 394 CO 0.02 -1.32 -0.23 -0.65 -1.52 0.00 0.00 175.55 171.85 2g6h s GLN 395 N -3.28 1.94 0.31 -3.49 -1.52 -1.26 -5.06 119.66 107.30 2g6h s GLN 395 Ca 0.16 -0.83 -0.19 0.00 -1.95 0.00 0.00 55.36 52.54 2g6h s GLN 395 Cb -0.04 -1.85 -0.09 0.00 -0.22 0.00 0.00 33.01 30.81 2g6h s GLN 395 CO 0.10 0.48 0.80 -0.51 -0.25 0.00 0.00 175.29 175.91 2g6h s LEU 396 N -0.50 4.18 0.95 2.90 1.43 -1.26 -5.05 118.68 121.33 2g6h s LEU 396 Ca 0.08 1.47 -0.12 0.00 -1.03 0.00 0.00 54.13 54.53 2g6h s LEU 396 Cb -0.09 -3.98 0.16 0.00 0.03 0.00 0.00 46.19 42.30 2g6h s LEU 396 CO -0.00 -0.13 1.11 -0.54 0.23 0.00 0.00 176.35 177.01 2g6h s LYS 397 N -2.55 0.79 0.14 1.70 -0.14 -1.26 -4.80 119.74 113.62 2g6h s LYS 397 Ca 0.51 0.43 -0.15 0.00 -1.36 0.00 0.00 55.97 55.41 2g6h s LYS 397 Cb -0.13 -1.79 0.00 0.00 -1.68 0.00 0.00 37.83 34.23 2g6h s LYS 397 CO 0.19 -2.47 1.65 -0.44 -0.76 0.00 0.00 175.35 173.52 2g6h h ASP 398 N -1.70 0.63 -0.88 2.83 3.32 -1.99 -1.65 116.42 116.98 2g6h h ASP 398 Ca -0.53 -0.21 0.11 0.00 0.02 0.00 0.00 57.03 56.43 2g6h h ASP 398 Cb 1.33 -0.17 -0.08 0.00 0.22 0.00 0.00 39.33 40.63 2g6h h ASP 398 CO 0.59 0.68 0.51 0.71 -1.72 0.00 0.00 179.24 180.02 2g6h h THR 399 N 0.56 0.87 -0.16 0.35 1.35 -2.00 -1.42 112.91 112.46 2g6h h THR 399 Ca 0.14 -0.28 -0.16 0.00 -0.55 0.00 0.00 66.41 65.56 2g6h h THR 399 Cb 0.28 -0.01 -0.01 0.00 -1.73 0.00 0.00 68.15 66.68 2g6h h THR 399 CO -0.00 0.15 -0.57 -0.33 -0.25 0.00 0.00 175.52 174.51 2g6h h GLU 400 N 0.82 0.51 0.06 4.72 5.08 -1.84 -2.09 114.58 121.84 2g6h h GLU 400 Ca 0.44 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2g6h h GLU 400 Cb 0.46 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2g6h h GLU 400 CO -0.28 0.94 -0.03 1.25 -1.00 0.00 0.00 179.01 179.89 2g6h h LEU 401 N 0.39 -0.07 -0.61 1.33 5.85 -0.48 0.80 115.31 122.51 2g6h h LEU 401 Ca 0.00 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.59 2g6h h LEU 401 Cb 1.12 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 2g6h h LEU 401 CO 0.11 0.10 0.40 0.40 -0.34 0.00 0.00 178.44 179.10 2g6h h ILE 402 N -0.24 1.14 -0.64 4.05 2.04 -1.29 -1.12 117.51 121.46 2g6h h ILE 402 Ca -0.01 -0.28 -0.08 0.00 1.00 0.00 0.00 64.86 65.49 2g6h h ILE 402 Cb 0.21 0.26 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 2g6h h ILE 402 CO 0.01 0.15 0.08 0.22 0.00 0.00 0.00 178.15 178.62 2g6h h TYR 403 N 0.81 1.14 -0.24 1.37 3.20 -1.28 -2.03 116.97 119.94 2g6h h TYR 403 Ca 0.23 -0.17 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 2g6h h TYR 403 Cb -0.07 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 37.88 2g6h h TYR 403 CO -0.04 0.97 0.12 0.78 -1.64 0.00 0.00 178.16 178.36 2g6h h GLY 404 N 0.98 0.37 0.90 1.82 0.00 -0.38 -1.12 103.07 105.64 2g6h h GLY 404 Ca 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 2g6h h GLY 404 CO 0.02 0.17 0.09 0.00 0.00 0.00 0.00 176.54 176.81 2g6h h ALA 405 N 1.00 0.26 -0.68 3.60 0.00 -1.16 0.46 119.26 122.73 2g6h h ALA 405 Ca 0.08 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2g6h h ALA 405 Cb 0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2g6h h ALA 405 CO -0.01 -0.16 0.43 0.87 0.00 0.00 0.00 179.25 180.37 2g6h h LYS 406 N 0.18 0.82 0.00 0.00 1.57 -1.29 -1.90 116.57 115.96 2g6h h LYS 406 Ca 0.07 -0.05 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 2g6h h LYS 406 Cb 0.15 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 2g6h h LYS 406 CO -0.01 0.54 -0.47 0.45 -0.57 0.00 0.00 179.45 179.39 2g6h h HIS 407 N 0.84 0.00 -0.61 -1.35 3.86 -1.02 0.45 115.15 117.32 2g6h h HIS 407 Ca 0.27 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.44 2g6h h HIS 407 Cb 0.00 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.45 2g6h h HIS 407 CO -0.04 0.47 0.23 0.00 0.86 0.00 0.00 177.93 179.45 2g6h h ALA 408 N 1.53 1.26 -0.09 2.45 0.00 -0.14 0.22 119.26 124.49 2g6h h ALA 408 Ca -0.00 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.63 2g6h h ALA 408 Cb 0.93 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2g6h h ALA 408 CO 0.06 0.54 -0.35 2.35 0.00 0.00 0.00 179.25 181.85 2g6h h TRP 409 N 0.88 0.53 -0.93 0.00 7.01 -1.05 -2.62 115.95 119.77 2g6h h TRP 409 Ca 0.21 -0.22 0.17 0.00 2.11 0.00 0.00 58.89 61.15 2g6h h TRP 409 Cb 0.19 -0.09 -0.08 0.00 -2.10 0.00 0.00 29.16 27.08 2g6h h TRP 409 CO 0.01 0.96 0.60 -0.09 -2.79 0.00 0.00 178.44 177.13 2g6h h ARG 410 N -0.05 0.64 -0.01 2.65 2.43 -0.20 -1.65 114.38 118.20 2g6h h ARG 410 Ca -0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 2g6h h ARG 410 Cb 0.99 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.39 2g6h h ARG 410 CO 0.07 0.43 -0.12 0.09 -1.51 0.00 0.00 179.97 178.93 2g6h n ASN 411 N -4.60 1.02 -4.56 -3.80 3.02 0.71 -4.80 115.26 102.25 2g6h n ASN 411 Ca 0.20 -1.05 -0.33 0.00 -0.03 0.00 0.00 54.58 53.36 2g6h n ASN 411 Cb 0.55 0.04 -0.04 0.00 -0.61 0.00 0.00 39.78 39.71 2g6h n ASN 411 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2g6h s ALA 412 N -2.28 2.04 0.46 5.41 0.00 -0.62 -4.71 121.76 122.05 2g6h s ALA 412 Ca 0.32 -1.46 0.36 0.00 0.00 0.00 0.00 51.96 51.18 2g6h s ALA 412 Cb 0.20 -4.48 1.98 0.00 0.00 0.00 0.00 23.12 20.82 2g6h s ALA 412 CO 0.44 -4.30 2.11 0.66 0.00 0.00 0.00 175.76 174.67 2g6h h SER 413 N 11.69 0.00 0.06 0.00 4.64 -1.87 -1.32 113.55 126.75 2g6h h SER 413 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 2g6h h SER 413 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 2g6h h SER 413 CO 1.26 0.00 -0.13 0.54 -0.87 0.00 0.00 176.83 177.63 2g6h n ARG 414 N -2.83 1.45 -3.38 4.77 1.74 -1.26 -0.44 116.66 116.72 2g6h n ARG 414 Ca -0.02 -0.96 -0.39 0.00 -0.77 0.00 0.00 57.85 55.71 2g6h n ARG 414 Cb 0.12 -1.48 -0.08 0.00 -1.02 0.00 0.00 32.46 29.99 2g6h n ARG 414 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2g6h n VAL 416 N 4.89 0.00 -1.03 0.00 3.14 -1.26 -4.01 118.33 120.07 2g6h n VAL 416 Ca -0.08 -0.03 -0.04 0.00 -2.96 0.00 0.00 64.34 61.24 2g6h n VAL 416 Cb 0.51 0.04 0.33 0.00 -1.06 0.00 0.00 33.84 33.65 2g6h n VAL 416 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2g6h n GLY 417 N 1.43 3.55 0.00 7.55 0.00 -1.26 -4.38 105.19 112.08 2g6h n GLY 417 Ca 0.09 -0.99 0.07 0.00 0.00 0.00 0.00 46.02 45.19 2g6h n GLY 417 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g6h n ARG 418 N -0.01 0.08 0.33 1.61 1.74 -1.26 -2.85 116.66 116.30 2g6h n ARG 418 Ca 0.39 0.21 0.22 0.00 -0.77 0.00 0.00 57.85 57.90 2g6h n ARG 418 Cb 1.36 -1.50 1.14 0.00 -1.02 0.00 0.00 32.46 32.44 2g6h n ARG 418 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 2g6h h ILE 419 N 0.00 0.00 -0.16 0.55 2.10 -1.88 0.18 117.51 118.30 2g6h h ILE 419 Ca 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 64.86 65.86 2g6h h ILE 419 Cb 0.20 1.07 0.00 0.00 -1.09 0.00 0.00 36.82 37.00 2g6h h ILE 419 CO 0.00 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 177.07 2g6h n GLN 420 N -3.07 1.90 -0.29 2.19 1.13 -1.13 -4.65 117.38 113.46 2g6h n GLN 420 Ca -0.02 -1.34 0.11 0.00 -1.94 0.00 0.00 57.00 53.81 2g6h n GLN 420 Cb 0.11 -1.44 0.27 0.00 0.11 0.00 0.00 30.24 29.29 2g6h n GLN 420 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 2g6h h TRP 421 N 2.83 0.50 0.00 1.08 5.08 -1.17 -1.21 115.95 123.06 2g6h h TRP 421 Ca 0.00 0.04 0.00 0.00 1.08 0.00 0.00 58.89 60.01 2g6h h TRP 421 Cb 0.62 -0.09 0.00 0.00 -3.00 0.00 0.00 29.16 26.69 2g6h h TRP 421 CO 0.10 -0.08 0.00 -1.13 -1.28 0.00 0.00 178.44 176.05 2g6h n SER 422 N -5.10 0.37 -0.94 0.11 3.41 -1.26 -3.10 113.62 107.11 2g6h n SER 422 Ca 0.20 0.58 0.07 0.00 -0.26 0.00 0.00 58.87 59.45 2g6h n SER 422 Cb 0.60 -0.66 0.21 0.00 -0.26 0.00 0.00 64.21 64.10 2g6h n SER 422 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2g6h n LYS 423 N -1.90 2.31 -1.85 4.33 5.02 -0.46 -4.95 118.16 120.66 2g6h n LYS 423 Ca 0.03 -1.70 -0.42 0.00 -2.02 0.00 0.00 58.31 54.20 2g6h n LYS 423 Cb 0.23 -1.47 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 2g6h n LYS 423 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2g6h s LEU 424 N -1.13 4.38 -0.24 -0.35 2.96 -1.18 -4.82 118.68 118.30 2g6h s LEU 424 Ca 0.31 2.59 -0.22 0.00 -0.22 0.00 0.00 54.13 56.59 2g6h s LEU 424 Cb 0.18 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.29 2g6h s LEU 424 CO 0.19 -0.92 0.72 -1.58 -1.32 0.00 0.00 176.35 173.43 2g6h s GLN 425 N 2.55 4.16 -0.25 1.98 2.00 -1.07 -5.00 119.66 124.03 2g6h s GLN 425 Ca 0.76 0.74 -0.09 0.00 -2.00 0.00 0.00 55.36 54.77 2g6h s GLN 425 Cb -0.42 -3.63 -0.04 0.00 0.80 0.00 0.00 33.01 29.71 2g6h s GLN 425 CO 0.34 -0.43 0.12 0.08 -0.50 0.00 0.00 175.29 174.89 2g6h s VAL 426 N 2.54 4.75 -0.33 1.34 1.01 -1.26 -1.93 120.40 126.53 2g6h s VAL 426 Ca 0.31 -0.02 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 2g6h s VAL 426 Cb -0.15 -3.23 -0.00 0.00 0.00 0.00 0.00 36.38 32.99 2g6h s VAL 426 CO 0.08 0.32 0.17 -0.36 0.00 0.00 0.00 175.10 175.32 2g6h s PHE 427 N 1.52 3.20 -0.66 5.22 0.08 0.56 -5.00 117.98 122.90 2g6h s PHE 427 Ca 0.06 -0.59 -0.26 0.00 0.12 0.00 0.00 56.93 56.27 2g6h s PHE 427 Cb -0.15 -2.39 0.04 0.00 -0.57 0.00 0.00 43.02 39.95 2g6h s PHE 427 CO 0.06 -0.48 1.12 0.34 -0.10 0.00 0.00 175.22 176.17 2g6h s ASP 428 N 1.62 6.24 -0.36 1.36 3.68 -1.26 -0.77 116.67 127.17 2g6h s ASP 428 Ca 0.04 -0.48 0.06 0.00 2.13 0.00 0.00 52.55 54.31 2g6h s ASP 428 Cb -0.17 -2.50 0.53 0.00 -1.45 0.00 0.00 42.92 39.33 2g6h s ASP 428 CO 0.07 -1.57 1.60 0.00 0.13 0.00 0.00 175.17 175.40 2g6h n ALA 429 N 8.45 4.88 0.39 3.66 0.00 -0.33 -4.64 120.51 132.92 2g6h n ALA 429 Ca 0.02 -3.19 0.13 0.00 0.00 0.00 0.00 53.44 50.40 2g6h n ALA 429 Cb 0.48 -0.96 0.52 0.00 0.00 0.00 0.00 19.45 19.49 2g6h n ALA 429 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g6h h ARG 430 N 1.20 0.00 -0.06 0.00 3.08 -1.77 -2.59 114.38 114.25 2g6h h ARG 430 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 2g6h h ARG 430 Cb 1.84 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.89 2g6h h ARG 430 CO 0.70 0.00 0.00 -0.40 -1.07 0.00 0.00 179.97 179.20 2g6h n ASP 431 N -2.44 1.15 -4.77 7.04 3.85 -1.26 -4.43 116.55 115.67 2g6h n ASP 431 Ca 0.02 -1.48 -0.35 0.00 -0.71 0.00 0.00 54.79 52.27 2g6h n ASP 431 Cb 0.27 -0.03 -0.00 0.00 -1.35 0.00 0.00 41.12 40.00 2g6h n ASP 431 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2g6h n THR 433 N -1.15 0.00 -4.25 0.00 -2.24 -1.26 -4.80 114.28 100.58 2g6h n THR 433 Ca 0.11 -0.04 -0.14 0.00 -2.27 0.00 0.00 64.05 61.71 2g6h n THR 433 Cb 0.50 0.64 -0.10 0.00 -2.10 0.00 0.00 70.33 69.27 2g6h n THR 433 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2g6h s THR 434 N -0.18 0.48 0.28 4.28 -4.23 -1.26 -4.61 115.64 110.39 2g6h s THR 434 Ca 0.00 -1.98 0.01 0.00 -1.18 0.00 0.00 61.69 58.54 2g6h s THR 434 Cb 0.00 -2.32 0.09 0.00 1.34 0.00 0.00 72.50 71.61 2g6h s THR 434 CO 0.00 -0.27 1.75 0.00 -0.54 0.00 0.00 174.62 175.56 2g6h h ALA 435 N 2.61 1.13 -0.54 3.99 0.00 -1.90 0.18 119.26 124.72 2g6h h ALA 435 Ca -0.37 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.19 2g6h h ALA 435 Cb 1.22 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2g6h h ALA 435 CO 0.60 0.55 0.15 0.45 0.00 0.00 0.00 179.25 181.00 2g6h h HIS 436 N 0.55 0.89 -0.70 0.00 -0.00 -1.96 0.21 115.15 114.14 2g6h h HIS 436 Ca 0.10 -0.10 0.04 0.00 -0.00 0.00 0.00 60.37 60.41 2g6h h HIS 436 Cb 0.55 -0.25 -0.05 0.00 -0.00 0.00 0.00 27.41 27.66 2g6h h HIS 436 CO 0.02 0.77 0.42 0.78 -0.00 0.00 0.00 177.93 179.93 2g6h h GLY 437 N 0.76 1.02 1.00 2.45 0.00 -1.78 -0.30 103.07 106.22 2g6h h GLY 437 Ca 0.17 -0.31 -0.04 0.00 0.00 0.00 0.00 47.33 47.15 2g6h h GLY 437 CO -0.00 0.24 0.21 -0.33 0.00 0.00 0.00 176.54 176.66 2g6h h MET 438 N 0.81 0.92 -0.57 4.80 0.00 -0.42 -1.28 114.93 119.19 2g6h h MET 438 Ca 0.29 -0.18 0.02 0.00 0.00 0.00 0.00 59.70 59.83 2g6h h MET 438 Cb 0.08 -0.14 -0.04 0.00 0.00 0.00 0.00 31.60 31.51 2g6h h MET 438 CO -0.14 0.80 0.36 0.35 0.00 0.00 0.00 176.91 178.28 2g6h h PHE 439 N 0.85 0.67 0.03 -0.22 3.04 0.25 0.35 116.94 121.91 2g6h h PHE 439 Ca 0.20 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 62.16 2g6h h PHE 439 Cb 0.25 -0.22 0.00 0.00 2.56 0.00 0.00 35.95 38.54 2g6h h PHE 439 CO 0.02 0.39 -0.02 -0.97 -2.02 0.00 0.00 178.31 175.71 2g6h h ASN 440 N 0.71 -0.04 -0.87 0.41 -1.24 -0.73 0.72 115.58 114.53 2g6h h ASN 440 Ca 0.23 -0.02 0.05 0.00 0.71 0.00 0.00 56.30 57.27 2g6h h ASN 440 Cb -0.00 0.01 -0.06 0.00 0.73 0.00 0.00 38.32 39.00 2g6h h ASN 440 CO -0.09 -0.01 0.54 1.88 -1.29 0.00 0.00 177.43 178.47 2g6h h TYR 441 N -0.07 1.01 -0.43 0.67 -1.99 -0.91 -1.38 116.97 113.88 2g6h h TYR 441 Ca -0.00 0.03 -0.13 0.00 2.00 0.00 0.00 58.73 60.62 2g6h h TYR 441 Cb 0.05 -0.33 -0.01 0.00 2.00 0.00 0.00 36.73 38.44 2g6h h TYR 441 CO -0.07 0.54 -0.26 0.82 -0.00 0.00 0.00 178.16 179.18 2g6h h ILE 442 N 1.01 1.27 -0.55 -2.88 2.04 -0.57 -1.17 117.51 116.67 2g6h h ILE 442 Ca 0.37 -1.42 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 2g6h h ILE 442 Cb 0.12 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 2g6h h ILE 442 CO -0.15 0.48 0.30 0.00 0.00 0.00 0.00 178.15 178.78 2g6h h ASN 444 N 0.75 1.08 0.11 0.00 2.35 -1.03 -1.64 115.58 117.19 2g6h h ASN 444 Ca 0.20 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 2g6h h ASN 444 Cb 0.05 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.15 2g6h h ASN 444 CO -0.03 0.87 -0.05 -0.74 -1.65 0.00 0.00 177.43 175.83 2g6h h HIS 445 N 1.20 -0.14 -0.90 1.19 2.76 -0.80 -0.73 115.15 117.73 2g6h h HIS 445 Ca 0.30 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.51 2g6h h HIS 445 Cb 0.04 0.05 -0.06 0.00 1.55 0.00 0.00 27.41 28.99 2g6h h HIS 445 CO 0.01 -0.05 0.57 0.28 -1.30 0.00 0.00 177.93 177.44 2g6h h VAL 446 N -0.18 1.11 -0.21 5.26 2.07 -0.85 0.14 116.25 123.58 2g6h h VAL 446 Ca -0.02 -0.37 -0.14 0.00 0.82 0.00 0.00 66.70 66.99 2g6h h VAL 446 Cb 0.14 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 29.84 2g6h h VAL 446 CO 0.02 0.20 -0.42 0.50 0.02 0.00 0.00 177.57 177.90 2g6h h LYS 447 N 1.09 0.66 -0.14 1.57 3.64 -1.18 -0.53 116.57 121.68 2g6h h LYS 447 Ca 0.37 -0.42 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2g6h h LYS 447 Cb 0.07 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 2g6h h LYS 447 CO -0.14 1.04 0.05 -0.92 -2.27 0.00 0.00 179.45 177.22 2g6h h TYR 448 N 0.36 0.22 -0.28 1.91 3.20 -0.82 -1.87 116.97 119.69 2g6h h TYR 448 Ca 0.01 -0.02 -0.14 0.00 3.14 0.00 0.00 58.73 61.72 2g6h h TYR 448 Cb 1.02 -0.07 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 2g6h h TYR 448 CO 0.09 0.31 -0.41 0.00 -1.64 0.00 0.00 178.16 176.50 2g6h h ALA 449 N 0.89 0.75 -0.37 1.82 0.00 -0.78 -3.23 119.26 118.33 2g6h h ALA 449 Ca 0.05 -0.45 -0.12 0.00 0.00 0.00 0.00 54.91 54.39 2g6h h ALA 449 Cb 0.18 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2g6h h ALA 449 CO -0.00 0.66 -0.22 1.15 0.00 0.00 0.00 179.25 180.84 2g6h h THR 450 N 0.56 1.28 -7.01 0.00 2.02 -1.06 0.08 112.91 108.79 2g6h h THR 450 Ca 0.04 -1.36 -0.60 0.00 0.77 0.00 0.00 66.41 65.26 2g6h h THR 450 Cb 0.95 1.35 -0.23 0.00 -1.74 0.00 0.00 68.15 68.48 2g6h h THR 450 CO 0.09 0.45 -0.93 -3.20 0.37 0.00 0.00 175.52 172.29 2g6h n ASN 451 N -4.24 -0.22 -1.91 4.18 5.15 -0.71 -0.44 115.26 117.08 2g6h n ASN 451 Ca -0.02 -1.21 -0.21 0.00 -0.60 0.00 0.00 54.58 52.54 2g6h n ASN 451 Cb 0.44 -1.88 -0.06 0.00 -0.53 0.00 0.00 39.78 37.75 2g6h n ASN 451 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2g6h n LYS 452 N -4.42 -1.55 0.00 1.20 5.02 -1.26 -2.27 118.16 114.88 2g6h n LYS 452 Ca -0.19 1.14 0.00 0.00 -2.02 0.00 0.00 58.31 57.24 2g6h n LYS 452 Cb 0.62 -5.64 0.00 0.00 -0.02 0.00 0.00 35.03 30.00 2g6h n LYS 452 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2g6h n GLY 453 N -0.63 2.62 3.19 0.72 0.00 0.42 -4.92 105.19 106.59 2g6h n GLY 453 Ca -0.22 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.36 2g6h n GLY 453 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2g6h n ASN 454 N 0.00 5.51 -4.68 1.61 4.05 -0.96 -0.36 115.26 120.43 2g6h n ASN 454 Ca 0.00 -3.12 -0.42 0.00 0.45 0.00 0.00 54.58 51.50 2g6h n ASN 454 Cb 0.00 -1.44 0.00 0.00 1.23 0.00 0.00 39.78 39.57 2g6h n ASN 454 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2g6h n LEU 455 N 3.61 3.46 -4.05 1.20 4.77 -1.24 -4.52 117.00 120.24 2g6h n LEU 455 Ca 0.32 1.14 -0.24 0.00 -0.03 0.00 0.00 56.01 57.20 2g6h n LEU 455 Cb 0.38 -1.45 -0.16 0.00 -2.33 0.00 0.00 43.42 39.86 2g6h n LEU 455 CO 0.66 -0.79 -0.47 -0.13 -1.33 0.00 0.00 177.39 175.33 2g6h s ARG 456 N -2.01 1.54 0.39 3.23 0.52 0.02 -5.01 118.95 117.62 2g6h s ARG 456 Ca 0.59 -0.44 -0.26 0.00 -0.52 0.00 0.00 55.73 55.10 2g6h s ARG 456 Cb -0.55 -1.32 -0.09 0.00 0.52 0.00 0.00 34.95 33.51 2g6h s ARG 456 CO 0.59 0.11 1.24 -1.54 0.02 0.00 0.00 175.30 175.72 2g6h s SER 457 N 0.39 6.50 0.17 0.23 1.04 -1.26 -4.41 113.70 116.36 2g6h s SER 457 Ca -0.09 2.52 -0.22 0.00 0.48 0.00 0.00 55.95 58.64 2g6h s SER 457 Cb -0.13 -2.63 0.06 0.00 0.10 0.00 0.00 66.02 63.42 2g6h s SER 457 CO 0.03 -0.71 0.60 0.00 0.98 0.00 0.00 173.24 174.13 2g6h s ALA 458 N -1.29 -1.48 -0.11 5.32 0.00 -0.63 -2.59 121.76 120.98 2g6h s ALA 458 Ca 0.55 0.33 -0.09 0.00 0.00 0.00 0.00 51.96 52.74 2g6h s ALA 458 Cb -0.35 0.87 0.03 0.00 0.00 0.00 0.00 23.12 23.67 2g6h s ALA 458 CO 0.45 -0.79 0.28 -1.50 0.00 0.00 0.00 175.76 174.20 2g6h s ILE 459 N -3.78 -0.00 -0.15 0.00 2.07 -0.81 -0.44 121.20 118.08 2g6h s ILE 459 Ca 0.03 0.02 -0.00 0.00 -1.41 0.00 0.00 60.65 59.28 2g6h s ILE 459 Cb -0.01 -0.41 -0.01 0.00 0.13 0.00 0.00 42.46 42.16 2g6h s ILE 459 CO -0.10 0.01 -0.13 -0.89 -1.91 0.00 0.00 174.94 171.91 2g6h s THR 460 N 0.30 2.89 -0.36 4.00 2.01 -0.69 -0.33 115.64 123.46 2g6h s THR 460 Ca -0.01 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.24 2g6h s THR 460 Cb -0.03 -2.23 0.07 0.00 0.01 0.00 0.00 72.50 70.32 2g6h s THR 460 CO -0.01 0.51 0.13 -0.63 -0.69 0.00 0.00 174.62 173.93 2g6h s ILE 461 N 0.72 3.51 0.95 1.82 1.01 0.05 -3.28 121.20 125.97 2g6h s ILE 461 Ca -0.06 -1.49 -0.15 0.00 0.00 0.00 0.00 60.65 58.95 2g6h s ILE 461 Cb -0.15 -3.14 0.17 0.00 0.01 0.00 0.00 42.46 39.35 2g6h s ILE 461 CO 0.02 -0.35 1.22 -0.36 0.00 0.00 0.00 174.94 175.46 2g6h s PHE 462 N 1.30 1.96 0.32 3.97 0.08 -0.84 -1.19 117.98 123.59 2g6h s PHE 462 Ca 0.01 0.57 -0.28 0.00 0.12 0.00 0.00 56.93 57.34 2g6h s PHE 462 Cb -0.21 -3.72 -0.13 0.00 -0.57 0.00 0.00 43.02 38.40 2g6h s PHE 462 CO -0.00 -2.56 1.26 -2.30 -0.10 0.00 0.00 175.22 171.52 2g6h n PRO 463 N -3.80 2.01 -1.22 0.24 -0.02 -1.25 -4.65 135.00 126.31 2g6h n PRO 463 Ca 0.11 0.71 -0.31 0.00 -2.02 0.00 0.00 63.50 61.99 2g6h n PRO 463 Cb 0.60 -2.27 0.10 0.00 -0.02 0.00 0.00 33.50 31.91 2g6h n PRO 463 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2g6h s GLN 464 N -1.68 2.13 0.49 -0.52 -2.07 -1.26 -4.56 119.66 112.20 2g6h s GLN 464 Ca 0.57 1.18 -0.22 0.00 -1.82 0.00 0.00 55.36 55.07 2g6h s GLN 464 Cb -0.60 -1.88 -0.06 0.00 -1.09 0.00 0.00 33.01 29.38 2g6h s GLN 464 CO 0.61 -1.74 1.23 0.50 -1.32 0.00 0.00 175.29 174.57 2g6h s ARG 465 N -4.89 3.52 0.00 9.60 3.52 0.22 -4.94 118.95 125.98 2g6h s ARG 465 Ca 0.62 1.92 0.00 0.00 -0.13 0.00 0.00 55.73 58.13 2g6h s ARG 465 Cb -0.18 -2.33 0.00 0.00 -1.56 0.00 0.00 34.95 30.88 2g6h s ARG 465 CO 0.56 -0.79 0.00 0.25 -0.81 0.00 0.00 175.30 174.52 2g6h n THR 466 N -0.72 0.00 0.59 4.11 -2.24 -1.26 -4.76 114.28 109.99 2g6h n THR 466 Ca 0.09 0.01 0.07 0.00 -2.27 0.00 0.00 64.05 61.94 2g6h n THR 466 Cb 0.47 -0.65 0.01 0.00 -2.10 0.00 0.00 70.33 68.06 2g6h n THR 466 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2g6h n ASP 467 N -1.31 1.55 0.00 3.42 5.75 -1.26 -4.97 116.55 119.73 2g6h n ASP 467 Ca 0.00 -1.28 0.00 0.00 -0.01 0.00 0.00 54.79 53.50 2g6h n ASP 467 Cb 0.00 0.39 0.00 0.00 -1.03 0.00 0.00 41.12 40.48 2g6h n ASP 467 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2g6h n GLY 468 N 0.99 1.81 0.64 6.12 0.00 -1.26 -4.79 105.19 108.70 2g6h n GLY 468 Ca 0.06 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.15 2g6h n GLY 468 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2g6h n LYS 469 N -2.00 1.58 -2.54 1.61 5.02 -1.26 -4.49 118.16 116.09 2g6h n LYS 469 Ca 0.00 -1.62 -0.15 0.00 -2.02 0.00 0.00 58.31 54.52 2g6h n LYS 469 Cb 0.00 -1.29 0.02 0.00 -0.02 0.00 0.00 35.03 33.74 2g6h n LYS 469 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2g6h n HIS 470 N 0.77 2.12 -3.37 2.13 8.25 -1.26 -4.35 115.22 119.51 2g6h n HIS 470 Ca 0.10 -2.70 -0.36 0.00 -0.26 0.00 0.00 57.72 54.50 2g6h n HIS 470 Cb 0.39 -0.25 -0.06 0.00 1.12 0.00 0.00 29.99 31.19 2g6h n HIS 470 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2g6h s ASP 471 N -3.44 6.87 -0.04 0.41 1.01 -1.26 -4.26 116.67 115.95 2g6h s ASP 471 Ca 0.37 1.09 -0.15 0.00 0.71 0.00 0.00 52.55 54.57 2g6h s ASP 471 Cb 0.41 -2.29 -0.05 0.00 1.01 0.00 0.00 42.92 41.99 2g6h s ASP 471 CO -0.05 0.18 0.39 -0.36 0.21 0.00 0.00 175.17 175.54 2g6h s PHE 472 N -1.33 3.66 -0.14 4.23 0.40 -1.26 -1.79 117.98 121.75 2g6h s PHE 472 Ca 0.34 0.91 -0.11 0.00 -0.60 0.00 0.00 56.93 57.47 2g6h s PHE 472 Cb -0.16 -2.32 0.04 0.00 0.51 0.00 0.00 43.02 41.09 2g6h s PHE 472 CO 0.18 0.52 0.35 1.03 0.70 0.00 0.00 175.22 178.00 2g6h s ARG 473 N -0.62 0.38 -0.29 0.44 1.81 0.38 -3.22 118.95 117.82 2g6h s ARG 473 Ca 0.23 0.55 -0.14 0.00 -1.72 0.00 0.00 55.73 54.65 2g6h s ARG 473 Cb -0.16 0.11 -0.03 0.00 -0.45 0.00 0.00 34.95 34.42 2g6h s ARG 473 CO 0.11 -0.09 0.31 0.08 -0.68 0.00 0.00 175.30 175.03 2g6h s VAL 474 N 0.58 5.22 0.27 3.52 1.01 -1.26 -0.90 120.40 128.84 2g6h s VAL 474 Ca -0.03 0.28 0.09 0.00 0.00 0.00 0.00 61.98 62.31 2g6h s VAL 474 Cb -0.05 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.63 2g6h s VAL 474 CO -0.04 0.12 1.60 -0.50 0.00 0.00 0.00 175.10 176.29 2g6h h TRP 475 N 8.32 0.06 -4.24 5.22 4.06 -1.66 -3.42 115.95 124.30 2g6h h TRP 475 Ca -0.32 -0.02 -0.53 0.00 2.06 0.00 0.00 58.89 60.08 2g6h h TRP 475 Cb 1.17 -0.01 0.19 0.00 -1.00 0.00 0.00 29.16 29.50 2g6h h TRP 475 CO 0.74 0.65 0.29 -0.80 -3.56 0.00 0.00 178.44 175.75 2g6h s ASN 476 N -6.86 3.28 0.03 -3.49 -0.87 -1.26 -4.91 114.94 100.86 2g6h s ASN 476 Ca -0.02 2.28 0.13 0.00 -1.57 0.00 0.00 52.86 53.68 2g6h s ASN 476 Cb 0.13 -2.58 -0.18 0.00 -0.02 0.00 0.00 41.25 38.59 2g6h s ASN 476 CO 0.77 -2.87 0.86 0.77 -2.57 0.00 0.00 177.10 174.06 2g6h h SER 477 N -1.36 0.00 -4.82 -1.22 4.64 -1.92 -3.35 113.55 105.51 2g6h h SER 477 Ca -0.45 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.69 2g6h h SER 477 Cb 1.28 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.15 2g6h h SER 477 CO 0.44 0.86 -0.70 -1.10 -0.87 0.00 0.00 176.83 175.45 2g6h s GLN 478 N -2.73 0.28 0.24 4.77 -0.21 -1.26 -0.99 119.66 119.76 2g6h s GLN 478 Ca -0.03 -0.54 -0.05 0.00 0.02 0.00 0.00 55.36 54.76 2g6h s GLN 478 Cb 0.08 0.08 0.35 0.00 1.00 0.00 0.00 33.01 34.53 2g6h s GLN 478 CO 0.82 -0.04 1.83 -0.07 -2.12 0.00 0.00 175.29 175.71 2g6h h LEU 479 N 4.82 0.76 -8.05 2.90 3.38 -1.45 -3.39 115.31 114.29 2g6h h LEU 479 Ca -0.31 0.03 -0.65 0.00 0.09 0.00 0.00 57.88 57.04 2g6h h LEU 479 Cb 1.21 -0.13 -0.35 0.00 0.09 0.00 0.00 40.66 41.48 2g6h h LEU 479 CO 0.42 0.47 -0.86 -0.63 0.09 0.00 0.00 178.44 177.94 2g6h s ILE 480 N -6.05 1.93 0.02 1.22 1.01 -1.26 -4.85 121.20 113.22 2g6h s ILE 480 Ca -0.12 -0.87 -0.23 0.00 0.00 0.00 0.00 60.65 59.43 2g6h s ILE 480 Cb 0.19 -1.74 0.05 0.00 0.01 0.00 0.00 42.46 40.97 2g6h s ILE 480 CO 0.79 0.52 0.53 -0.13 0.00 0.00 0.00 174.94 176.64 2g6h s ARG 481 N 1.21 1.00 0.14 2.79 0.52 -1.26 -4.80 118.95 118.55 2g6h s ARG 481 Ca 0.02 -0.15 -0.20 0.00 -0.52 0.00 0.00 55.73 54.88 2g6h s ARG 481 Cb -0.14 0.46 -0.07 0.00 0.52 0.00 0.00 34.95 35.72 2g6h s ARG 481 CO -0.09 -0.35 0.66 0.71 0.02 0.00 0.00 175.30 176.24 2g6h s TYR 482 N -2.12 3.78 0.72 -0.53 4.12 -1.26 -0.37 117.35 121.68 2g6h s TYR 482 Ca -0.07 1.37 -0.13 0.00 0.02 0.00 0.00 57.07 58.26 2g6h s TYR 482 Cb -0.01 -2.58 0.03 0.00 -1.52 0.00 0.00 41.96 37.88 2g6h s TYR 482 CO 0.01 0.50 1.11 0.00 0.02 0.00 0.00 175.55 177.18 2g6h s ALA 483 N -1.25 2.31 -0.07 3.71 0.00 0.37 -4.44 121.76 122.39 2g6h s ALA 483 Ca 0.35 0.44 0.00 0.00 0.00 0.00 0.00 51.96 52.75 2g6h s ALA 483 Cb -0.19 -3.31 0.02 0.00 0.00 0.00 0.00 23.12 19.64 2g6h s ALA 483 CO 0.21 -1.59 -0.05 0.20 0.00 0.00 0.00 175.76 174.53 2g6h s GLY 484 N -2.92 0.59 -0.05 0.00 0.00 -1.23 -1.28 107.32 102.43 2g6h s GLY 484 Ca 0.65 -0.23 0.05 0.00 0.00 0.00 0.00 44.72 45.19 2g6h s GLY 484 CO 0.49 0.65 -0.22 -0.19 0.00 0.00 0.00 173.10 173.84 2g6h s TYR 485 N 1.33 2.10 -0.46 1.90 1.51 0.14 -3.87 117.35 119.99 2g6h s TYR 485 Ca -0.04 -0.60 -0.25 0.00 -1.01 0.00 0.00 57.07 55.17 2g6h s TYR 485 Cb -0.14 -1.39 0.03 0.00 -0.11 0.00 0.00 41.96 40.35 2g6h s TYR 485 CO -0.03 -0.18 0.88 0.15 -1.11 0.00 0.00 175.55 175.26 2g6h s LYS 486 N -0.11 3.47 0.62 -0.62 1.02 -1.26 0.60 119.74 123.47 2g6h s LYS 486 Ca -0.03 0.04 -0.07 0.00 0.02 0.00 0.00 55.97 55.93 2g6h s LYS 486 Cb -0.12 -3.94 0.01 0.00 -0.52 0.00 0.00 37.83 33.26 2g6h s LYS 486 CO 0.03 -1.21 0.95 -0.65 -0.92 0.00 0.00 175.35 173.55 2g6h s GLN 487 N 3.61 2.87 0.27 1.68 -0.21 -0.90 -4.95 119.66 122.02 2g6h s GLN 487 Ca 0.34 0.07 -0.01 0.00 0.02 0.00 0.00 55.36 55.79 2g6h s GLN 487 Cb -0.11 -2.22 0.48 0.00 1.00 0.00 0.00 33.01 32.16 2g6h s GLN 487 CO 0.25 -0.80 1.85 -1.35 -2.12 0.00 0.00 175.29 173.12 2g6h h PRO 488 N -0.29 1.01 0.00 2.91 0.11 -1.97 0.20 132.00 133.98 2g6h h PRO 488 Ca -0.45 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2g6h h PRO 488 Cb 1.26 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.14 2g6h h PRO 488 CO 0.61 0.67 0.55 0.22 -0.21 0.00 0.00 178.00 179.84 2g6h h ASP 489 N 1.04 0.00 0.00 -2.05 -0.00 -2.02 -3.43 116.42 109.96 2g6h h ASP 489 Ca 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.49 2g6h h ASP 489 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.68 2g6h h ASP 489 CO -0.23 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.62 2g6h n GLY 490 N -1.31 2.90 3.42 -0.78 0.00 0.72 -5.01 105.19 105.13 2g6h n GLY 490 Ca -0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2g6h n GLY 490 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g6h s SER 491 N 0.50 -0.45 -0.06 1.61 1.04 -1.26 -4.70 113.70 110.37 2g6h s SER 491 Ca 0.00 0.63 0.05 0.00 0.48 0.00 0.00 55.95 57.11 2g6h s SER 491 Cb 0.00 -0.84 -0.00 0.00 0.10 0.00 0.00 66.02 65.27 2g6h s SER 491 CO 0.00 -4.97 -0.20 -0.89 0.98 0.00 0.00 173.24 168.16 2g6h s THR 492 N -2.62 1.72 -0.18 2.02 2.01 -1.26 -2.12 115.64 115.20 2g6h s THR 492 Ca 0.70 -0.86 -0.12 0.00 0.31 0.00 0.00 61.69 61.72 2g6h s THR 492 Cb -0.09 -1.48 -0.05 0.00 0.01 0.00 0.00 72.50 70.89 2g6h s THR 492 CO 0.56 0.49 0.21 -0.22 -0.69 0.00 0.00 174.62 174.96 2g6h s LEU 493 N 0.09 4.22 0.00 4.42 2.96 0.20 -4.94 118.68 125.64 2g6h s LEU 493 Ca -0.08 0.35 0.00 0.00 -0.22 0.00 0.00 54.13 54.19 2g6h s LEU 493 Cb -0.14 -2.22 0.00 0.00 0.50 0.00 0.00 46.19 44.33 2g6h s LEU 493 CO 0.04 0.14 0.00 0.61 -1.32 0.00 0.00 176.35 175.82 2g6h n GLY 494 N 3.48 0.27 3.51 7.98 0.00 -1.26 0.24 105.19 119.42 2g6h n GLY 494 Ca -0.14 -1.16 -0.43 0.00 0.00 0.00 0.00 46.02 44.29 2g6h n GLY 494 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2g6h s ASP 495 N -4.00 6.29 0.52 1.61 -1.08 -0.40 -4.76 116.67 114.84 2g6h s ASP 495 Ca 0.00 -0.43 0.18 0.00 -0.52 0.00 0.00 52.55 51.79 2g6h s ASP 495 Cb 0.00 -2.29 1.29 0.00 -1.46 0.00 0.00 42.92 40.45 2g6h s ASP 495 CO 0.00 -0.73 2.10 -0.65 0.52 0.00 0.00 175.17 176.41 2g6h h PRO 496 N 8.84 0.02 0.00 4.34 0.11 -1.81 -1.49 132.00 142.01 2g6h h PRO 496 Ca -0.26 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 2g6h h PRO 496 Cb 1.10 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2g6h h PRO 496 CO 0.87 0.02 -0.05 0.00 -0.21 0.00 0.00 178.00 178.62 2g6h h ALA 497 N 1.92 1.42 -0.27 -0.75 0.00 -1.93 -2.54 119.26 117.12 2g6h h ALA 497 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2g6h h ALA 497 Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2g6h h ALA 497 CO -0.00 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.40 2g6h n ASN 498 N -3.76 3.31 -0.14 0.00 3.02 -0.57 -4.67 115.26 112.46 2g6h n ASN 498 Ca -0.03 -2.55 -0.04 0.00 -0.03 0.00 0.00 54.58 51.94 2g6h n ASN 498 Cb 0.15 -0.38 0.03 0.00 -0.61 0.00 0.00 39.78 38.97 2g6h n ASN 498 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2g6h h VAL 499 N 1.69 0.61 0.67 2.41 2.07 -1.39 0.11 116.25 122.42 2g6h h VAL 499 Ca 0.00 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.47 2g6h h VAL 499 Cb 1.08 0.55 0.01 0.00 -1.52 0.00 0.00 31.29 31.40 2g6h h VAL 499 CO 0.11 0.01 -0.32 -0.61 0.02 0.00 0.00 177.57 176.78 2g6h h GLN 500 N 0.06 -0.87 -0.95 1.57 4.15 -1.82 -2.61 115.11 114.64 2g6h h GLN 500 Ca 0.22 0.06 0.09 0.00 0.77 0.00 0.00 58.65 59.79 2g6h h GLN 500 Cb 0.33 0.20 -0.07 0.00 0.21 0.00 0.00 27.48 28.14 2g6h h GLN 500 CO -0.41 -0.55 0.59 0.35 -1.93 0.00 0.00 178.83 176.89 2g6h h PHE 501 N -1.06 1.08 -0.27 3.99 3.57 -1.86 0.52 116.94 122.92 2g6h h PHE 501 Ca -0.09 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.52 2g6h h PHE 501 Cb 0.73 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2g6h h PHE 501 CO -0.01 0.48 0.26 1.15 -2.23 0.00 0.00 178.31 177.97 2g6h h THR 502 N 1.00 0.53 0.18 4.41 2.02 -0.66 -1.18 112.91 119.22 2g6h h THR 502 Ca 0.45 0.00 -0.33 0.00 0.77 0.00 0.00 66.41 67.30 2g6h h THR 502 Cb 0.34 0.80 0.01 0.00 -1.74 0.00 0.00 68.15 67.56 2g6h h THR 502 CO -0.23 0.00 -1.55 -0.33 0.37 0.00 0.00 175.52 173.78 2g6h h GLU 503 N 0.00 0.38 0.00 6.66 5.08 0.39 -3.19 114.58 123.91 2g6h h GLU 503 Ca 0.13 -0.66 -0.04 0.00 -1.00 0.00 0.00 59.36 57.79 2g6h h GLU 503 Cb 0.65 0.24 -0.01 0.00 0.50 0.00 0.00 28.75 30.13 2g6h h GLU 503 CO -0.00 1.29 -0.20 0.82 -1.00 0.00 0.00 179.01 179.92 2g6h h ILE 504 N 0.10 0.97 -0.13 3.13 2.04 -0.37 0.52 117.51 123.78 2g6h h ILE 504 Ca -0.27 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 64.83 2g6h h ILE 504 Cb 2.08 1.41 -0.00 0.00 -0.74 0.00 0.00 36.82 39.57 2g6h h ILE 504 CO 0.21 0.20 -0.07 0.00 0.00 0.00 0.00 178.15 178.48 2g6h h ILE 506 N -0.08 1.21 0.00 0.00 2.04 -1.38 0.35 117.51 119.64 2g6h h ILE 506 Ca 0.03 -0.61 0.00 0.00 1.00 0.00 0.00 64.86 65.27 2g6h h ILE 506 Cb 0.55 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.26 2g6h h ILE 506 CO 0.02 0.24 0.00 1.67 0.00 0.00 0.00 178.15 180.08 2g6h n GLN 507 N -4.56 0.02 -0.00 2.37 7.27 0.18 0.02 117.38 122.68 2g6h n GLN 507 Ca 0.02 0.15 0.02 0.00 0.07 0.00 0.00 57.00 57.26 2g6h n GLN 507 Cb 0.14 -1.50 -0.02 0.00 2.41 0.00 0.00 30.24 31.26 2g6h n GLN 507 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2g6h n GLN 508 N -1.16 5.09 0.00 3.69 1.13 0.10 -5.03 117.38 121.21 2g6h n GLN 508 Ca 0.00 -0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2g6h n GLN 508 Cb 0.00 -0.73 0.00 0.00 0.11 0.00 0.00 30.24 29.63 2g6h n GLN 508 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g6h n GLY 509 N 1.23 1.55 3.66 1.08 0.00 0.10 -5.01 105.19 107.80 2g6h n GLY 509 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.58 2g6h n GLY 509 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2g6h n TRP 510 N 0.00 2.03 -3.24 1.61 -0.00 -0.83 -4.90 117.44 112.11 2g6h n TRP 510 Ca 0.00 0.52 -0.45 0.00 -0.00 0.00 0.00 57.50 57.57 2g6h n TRP 510 Cb 0.00 -2.41 -0.01 0.00 -0.00 0.00 0.00 31.31 28.90 2g6h n TRP 510 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 2g6h s LYS 511 N -1.02 4.00 0.07 5.87 1.02 -1.26 -4.52 119.74 123.90 2g6h s LYS 511 Ca 0.63 -2.83 -0.30 0.00 0.02 0.00 0.00 55.97 53.49 2g6h s LYS 511 Cb -0.64 -4.63 -0.09 0.00 -0.52 0.00 0.00 37.83 31.94 2g6h s LYS 511 CO 0.55 -1.38 1.91 0.00 -0.92 0.00 0.00 175.35 175.51 2g6h s ALA 512 N -0.18 3.66 -2.00 5.17 0.00 -1.26 -4.84 121.76 122.30 2g6h s ALA 512 Ca 0.30 1.37 0.19 0.00 0.00 0.00 0.00 51.96 53.82 2g6h s ALA 512 Cb -0.08 -3.81 1.14 0.00 0.00 0.00 0.00 23.12 20.36 2g6h s ALA 512 CO -0.07 -1.43 1.54 -2.30 0.00 0.00 0.00 175.76 173.50 2g6h n PRO 513 N 6.78 0.63 -3.78 0.00 -0.02 -1.26 -4.90 135.00 132.44 2g6h n PRO 513 Ca 0.19 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.40 2g6h n PRO 513 Cb 0.40 -1.48 0.01 0.00 -0.02 0.00 0.00 33.50 32.41 2g6h n PRO 513 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2g6h n ARG 514 N -0.98 -1.28 -4.65 -0.52 1.74 -1.26 -4.99 116.66 104.72 2g6h n ARG 514 Ca 0.14 0.68 -0.30 0.00 -0.77 0.00 0.00 57.85 57.61 2g6h n ARG 514 Cb 0.07 -2.69 -0.08 0.00 -1.02 0.00 0.00 32.46 28.74 2g6h n ARG 514 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2g6h s GLY 515 N -3.11 2.86 0.13 -0.13 0.00 -1.26 -5.06 107.32 100.75 2g6h s GLY 515 Ca 0.11 -0.74 -0.04 0.00 0.00 0.00 0.00 44.72 44.05 2g6h s GLY 515 CO 0.90 -2.03 1.30 -0.09 0.00 0.00 0.00 173.10 173.18 2g6h h ARG 516 N 1.54 0.41 -2.08 2.90 2.43 -1.92 -3.39 114.38 114.26 2g6h h ARG 516 Ca -0.40 -0.45 -0.58 0.00 -0.81 0.00 0.00 59.98 57.75 2g6h h ARG 516 Cb 1.30 0.13 -0.40 0.00 -0.42 0.00 0.00 29.97 30.57 2g6h h ARG 516 CO 0.66 1.11 -0.88 1.19 -1.51 0.00 0.00 179.97 180.53 2g6h n PHE 517 N -3.74 1.41 -3.30 2.20 3.01 -1.26 -4.27 117.46 111.51 2g6h n PHE 517 Ca -0.07 -3.82 -0.41 0.00 1.01 0.00 0.00 57.45 54.16 2g6h n PHE 517 Cb 0.84 -0.44 -0.08 0.00 -0.01 0.00 0.00 39.48 39.78 2g6h n PHE 517 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2g6h s ASP 518 N -1.76 6.27 0.11 4.37 1.01 -1.26 -4.93 116.67 120.47 2g6h s ASP 518 Ca 0.37 -0.10 -0.31 0.00 0.71 0.00 0.00 52.55 53.22 2g6h s ASP 518 Cb 0.16 -2.24 -0.10 0.00 1.01 0.00 0.00 42.92 41.75 2g6h s ASP 518 CO -0.07 -0.43 1.86 -0.69 0.21 0.00 0.00 175.17 176.06 2g6h s VAL 519 N 2.26 2.60 0.91 -1.27 1.01 -1.26 -0.48 120.40 124.17 2g6h s VAL 519 Ca 0.16 0.02 -0.12 0.00 0.00 0.00 0.00 61.98 62.05 2g6h s VAL 519 Cb -0.16 -3.02 0.14 0.00 0.00 0.00 0.00 36.38 33.34 2g6h s VAL 519 CO 0.13 -0.00 1.09 -0.76 0.00 0.00 0.00 175.10 175.56 2g6h s LEU 520 N 3.08 2.18 0.20 3.92 1.43 0.50 -4.85 118.68 125.14 2g6h s LEU 520 Ca 0.83 1.49 -0.03 0.00 -1.03 0.00 0.00 54.13 55.39 2g6h s LEU 520 Cb -0.46 -3.87 -0.05 0.00 0.03 0.00 0.00 46.19 41.84 2g6h s LEU 520 CO 0.38 -2.74 0.42 -2.16 0.23 0.00 0.00 176.35 172.48 2g6h s PRO 521 N -4.91 3.58 0.24 1.29 0.04 -1.26 -4.75 135.00 129.23 2g6h s PRO 521 Ca 0.64 -0.18 -0.30 0.00 0.04 0.00 0.00 61.00 61.19 2g6h s PRO 521 Cb -0.18 -2.80 -0.09 0.00 0.04 0.00 0.00 34.50 31.47 2g6h s PRO 521 CO 0.57 0.38 0.95 -0.51 0.04 0.00 0.00 177.00 178.44 2g6h s LEU 522 N -3.16 4.64 -0.40 -3.56 1.43 -0.15 -4.86 118.68 112.62 2g6h s LEU 522 Ca 0.40 1.97 0.03 0.00 -1.03 0.00 0.00 54.13 55.51 2g6h s LEU 522 Cb -0.11 -3.62 0.11 0.00 0.03 0.00 0.00 46.19 42.60 2g6h s LEU 522 CO 0.28 0.13 0.15 -0.22 0.23 0.00 0.00 176.35 176.92 2g6h s LEU 523 N -1.22 3.78 -0.14 1.79 0.20 -1.25 -1.33 118.68 120.51 2g6h s LEU 523 Ca 0.41 -2.38 -0.07 0.00 0.69 0.00 0.00 54.13 52.79 2g6h s LEU 523 Cb -0.26 -1.38 -0.04 0.00 -0.43 0.00 0.00 46.19 44.08 2g6h s LEU 523 CO 0.33 -0.32 0.10 -0.76 -0.29 0.00 0.00 176.35 175.40 2g6h s LEU 524 N 0.61 4.10 -0.20 -0.68 1.43 -0.07 -1.67 118.68 122.20 2g6h s LEU 524 Ca 0.14 0.30 -0.01 0.00 -1.03 0.00 0.00 54.13 53.52 2g6h s LEU 524 Cb -0.22 -2.01 0.01 0.00 0.03 0.00 0.00 46.19 44.01 2g6h s LEU 524 CO -0.07 0.33 -0.12 -1.58 0.23 0.00 0.00 176.35 175.14 2g6h s GLN 525 N -0.54 3.16 -0.06 1.70 0.74 -0.08 -0.86 119.66 123.72 2g6h s GLN 525 Ca 0.11 -0.74 0.05 0.00 0.05 0.00 0.00 55.36 54.83 2g6h s GLN 525 Cb -0.12 -2.80 -0.02 0.00 1.10 0.00 0.00 33.01 31.17 2g6h s GLN 525 CO 0.02 -0.22 -0.19 0.00 -0.55 0.00 0.00 175.29 174.35 2g6h s ALA 526 N 1.38 2.43 -0.48 1.58 0.00 -1.26 -0.47 121.76 124.94 2g6h s ALA 526 Ca 0.05 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.00 2g6h s ALA 526 Cb -0.14 -0.84 0.00 0.00 0.00 0.00 0.00 23.12 22.14 2g6h s ALA 526 CO -0.08 0.48 0.00 -1.71 0.00 0.00 0.00 175.76 174.45 2g6h n ASN 527 N 2.65 -2.99 0.00 0.00 4.05 -1.24 -1.25 115.26 116.48 2g6h n ASN 527 Ca -0.17 0.11 0.00 0.00 0.45 0.00 0.00 54.58 54.97 2g6h n ASN 527 Cb 0.52 -2.34 0.00 0.00 1.23 0.00 0.00 39.78 39.19 2g6h n ASN 527 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2g6h n GLY 528 N 0.22 2.55 3.35 8.20 0.00 -0.74 -4.10 105.19 114.67 2g6h n GLY 528 Ca -0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2g6h n GLY 528 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2g6h n ASN 529 N 0.00 -2.63 -4.76 1.61 3.02 -0.38 -4.89 115.26 107.23 2g6h n ASN 529 Ca 0.00 -0.39 -0.34 0.00 -0.03 0.00 0.00 54.58 53.82 2g6h n ASN 529 Cb 0.00 -1.13 0.05 0.00 -0.61 0.00 0.00 39.78 38.10 2g6h n ASN 529 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2g6h s ASP 530 N -2.48 4.98 0.56 6.41 -0.00 -1.26 -4.36 116.67 120.52 2g6h s ASP 530 Ca 0.66 2.10 -0.15 0.00 -0.00 0.00 0.00 52.55 55.15 2g6h s ASP 530 Cb -0.20 -2.56 -0.06 0.00 -0.00 0.00 0.00 42.92 40.10 2g6h s ASP 530 CO 0.62 -1.72 1.02 -2.16 -0.00 0.00 0.00 175.17 172.93 2g6h s PRO 531 N -3.96 3.65 0.16 8.23 0.04 -1.26 -4.64 135.00 137.23 2g6h s PRO 531 Ca 0.69 1.02 0.09 0.00 0.04 0.00 0.00 61.00 62.83 2g6h s PRO 531 Cb -0.23 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 2g6h s PRO 531 CO 0.41 -0.52 -0.19 -1.21 0.04 0.00 0.00 177.00 175.53 2g6h s GLU 532 N -4.23 1.27 0.17 4.56 2.02 -0.04 -4.84 118.70 117.59 2g6h s GLU 532 Ca 0.60 -1.39 -0.05 0.00 0.02 0.00 0.00 54.97 54.15 2g6h s GLU 532 Cb -0.12 -1.36 -0.06 0.00 0.10 0.00 0.00 34.13 32.69 2g6h s GLU 532 CO 0.37 0.28 0.41 -0.51 0.02 0.00 0.00 175.26 175.83 2g6h s LEU 533 N -2.59 4.24 -0.19 1.80 1.43 -1.26 -0.89 118.68 121.22 2g6h s LEU 533 Ca 0.15 0.64 -0.13 0.00 -1.03 0.00 0.00 54.13 53.76 2g6h s LEU 533 Cb -0.06 -3.37 0.06 0.00 0.03 0.00 0.00 46.19 42.84 2g6h s LEU 533 CO 0.06 0.02 0.47 -0.36 0.23 0.00 0.00 176.35 176.78 2g6h s PHE 534 N -1.71 -0.65 -0.20 0.29 0.40 -0.44 -4.96 117.98 110.70 2g6h s PHE 534 Ca 0.42 1.41 -0.20 0.00 -0.60 0.00 0.00 56.93 57.96 2g6h s PHE 534 Cb -0.12 0.29 -0.03 0.00 0.51 0.00 0.00 43.02 43.68 2g6h s PHE 534 CO 0.25 -0.34 0.61 -1.14 0.70 0.00 0.00 175.22 175.30 2g6h s GLN 535 N 1.07 4.20 0.15 0.44 0.74 -1.26 -0.98 119.66 124.03 2g6h s GLN 535 Ca -0.07 0.58 -0.31 0.00 0.05 0.00 0.00 55.36 55.61 2g6h s GLN 535 Cb -0.06 -3.58 -0.09 0.00 1.10 0.00 0.00 33.01 30.38 2g6h s GLN 535 CO -0.10 -0.24 1.44 0.42 -0.55 0.00 0.00 175.29 176.27 2g6h s ILE 536 N 1.91 3.02 -0.15 -2.34 1.01 -1.26 -4.87 121.20 118.53 2g6h s ILE 536 Ca 0.28 0.75 -0.36 0.00 0.00 0.00 0.00 60.65 61.32 2g6h s ILE 536 Cb -0.16 -3.48 -0.12 0.00 0.01 0.00 0.00 42.46 38.71 2g6h s ILE 536 CO 0.10 0.07 1.87 -2.65 0.00 0.00 0.00 174.94 174.33 2g6h n PRO 537 N 3.70 1.91 -0.32 2.79 -0.02 -1.26 -4.79 135.00 137.01 2g6h n PRO 537 Ca 0.11 0.69 0.23 0.00 -2.02 0.00 0.00 63.50 62.52 2g6h n PRO 537 Cb 0.41 -2.53 0.52 0.00 -0.02 0.00 0.00 33.50 31.88 2g6h n PRO 537 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2g6h h PRO 538 N 8.97 0.36 0.00 0.52 0.11 -1.94 0.89 132.00 140.91 2g6h h PRO 538 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2g6h h PRO 538 Cb 1.28 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2g6h h PRO 538 CO 0.96 0.24 0.00 -0.85 -0.21 0.00 0.00 178.00 178.14 2g6h n GLU 539 N -4.61 0.09 0.00 1.05 0.00 -1.26 -1.24 120.64 114.67 2g6h n GLU 539 Ca 0.25 0.43 0.11 0.00 0.00 0.00 0.00 57.16 57.95 2g6h n GLU 539 Cb 0.89 -1.71 0.05 0.00 0.00 0.00 0.00 31.44 30.67 2g6h n GLU 539 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2g6h n LEU 540 N -1.89 0.75 -4.34 -1.84 4.77 0.31 -4.79 117.00 109.96 2g6h n LEU 540 Ca 0.01 -0.25 -0.45 0.00 -0.03 0.00 0.00 56.01 55.29 2g6h n LEU 540 Cb 0.13 -0.11 -0.05 0.00 -2.33 0.00 0.00 43.42 41.06 2g6h n LEU 540 CO 0.13 0.18 0.23 -0.69 -1.33 0.00 0.00 177.39 175.90 2g6h s VAL 541 N -3.02 5.07 0.01 4.08 1.01 -0.38 -4.77 120.40 122.40 2g6h s VAL 541 Ca 0.09 -1.25 -0.30 0.00 0.00 0.00 0.00 61.98 60.52 2g6h s VAL 541 Cb 0.16 -4.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2g6h s VAL 541 CO 0.79 -0.93 1.11 -0.22 0.00 0.00 0.00 175.10 175.86 2g6h s LEU 542 N 2.01 4.34 0.13 3.92 2.96 -1.26 -5.00 118.68 125.78 2g6h s LEU 542 Ca 0.06 1.82 0.07 0.00 -0.22 0.00 0.00 54.13 55.87 2g6h s LEU 542 Cb -0.27 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.81 2g6h s LEU 542 CO 0.05 -0.42 -0.17 -1.61 -1.32 0.00 0.00 176.35 172.88 2g6h s GLU 543 N 1.35 1.13 -0.17 1.98 2.02 -1.26 -1.12 118.70 122.63 2g6h s GLU 543 Ca 0.55 -1.29 0.00 0.00 0.02 0.00 0.00 54.97 54.26 2g6h s GLU 543 Cb -0.25 -1.14 0.03 0.00 0.10 0.00 0.00 34.13 32.87 2g6h s GLU 543 CO 0.26 0.23 -0.12 0.08 0.02 0.00 0.00 175.26 175.73 2g6h s VAL 544 N -1.94 1.58 0.05 2.63 1.01 0.90 -4.90 120.40 119.72 2g6h s VAL 544 Ca 0.11 -0.77 -0.31 0.00 0.00 0.00 0.00 61.98 61.01 2g6h s VAL 544 Cb -0.06 -1.56 -0.06 0.00 0.00 0.00 0.00 36.38 34.70 2g6h s VAL 544 CO 0.05 0.34 1.31 -2.16 0.00 0.00 0.00 175.10 174.63 2g6h s PRO 545 N 1.46 4.35 -0.33 2.72 0.04 -1.26 -1.99 135.00 139.99 2g6h s PRO 545 Ca 0.03 1.90 -0.22 0.00 0.04 0.00 0.00 61.00 62.74 2g6h s PRO 545 Cb -0.14 -3.40 0.00 0.00 0.04 0.00 0.00 34.50 31.00 2g6h s PRO 545 CO -0.10 -0.41 0.72 0.42 0.04 0.00 0.00 177.00 177.67 2g6h s ILE 546 N 1.55 4.83 0.17 0.56 -1.09 0.69 -4.82 121.20 123.09 2g6h s ILE 546 Ca 0.61 0.91 0.03 0.00 -2.23 0.00 0.00 60.65 59.98 2g6h s ILE 546 Cb -0.32 -4.11 -0.05 0.00 -1.58 0.00 0.00 42.46 36.41 2g6h s ILE 546 CO 0.28 -0.28 -0.05 0.00 -1.23 0.00 0.00 174.94 173.66 2g6h s ARG 547 N 2.86 1.13 0.02 2.79 3.03 -1.26 -4.21 118.95 123.31 2g6h s ARG 547 Ca 0.29 -1.52 0.00 0.00 2.03 0.00 0.00 55.73 56.53 2g6h s ARG 547 Cb -0.14 -0.50 -0.04 0.00 -1.03 0.00 0.00 34.95 33.24 2g6h s ARG 547 CO 0.14 -0.03 0.11 -1.58 -1.13 0.00 0.00 175.30 172.80 2g6h s HIS 548 N -3.46 3.32 -1.37 5.89 2.46 -1.26 -4.39 115.29 116.48 2g6h s HIS 548 Ca 0.21 0.20 0.00 0.00 0.47 0.00 0.00 55.06 55.94 2g6h s HIS 548 Cb 0.04 -1.72 0.00 0.00 -0.13 0.00 0.00 32.58 30.77 2g6h s HIS 548 CO 0.03 0.56 0.60 -0.35 -2.47 0.00 0.00 174.74 173.11 2g6h n PRO 549 N 0.91 0.88 0.00 2.88 -0.04 -1.26 -3.97 135.00 134.39 2g6h n PRO 549 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 2g6h n PRO 549 Cb 0.52 -1.28 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 2g6h n PRO 549 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2g6h n LYS 550 N -0.15 0.00 -3.27 0.54 5.02 -1.26 -5.04 118.16 114.00 2g6h n LYS 550 Ca 0.00 0.00 -0.46 0.00 -2.02 0.00 0.00 58.31 55.83 2g6h n LYS 550 Cb 0.14 -0.21 -0.03 0.00 -0.02 0.00 0.00 35.03 34.91 2g6h n LYS 550 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2g6h s PHE 551 N -1.00 3.54 0.57 2.13 2.99 -1.25 -4.88 117.98 120.07 2g6h s PHE 551 Ca 0.00 -1.71 0.27 0.00 0.00 0.00 0.00 56.93 55.49 2g6h s PHE 551 Cb 0.00 -3.87 1.53 0.00 0.00 0.00 0.00 43.02 40.68 2g6h s PHE 551 CO 0.00 -1.06 2.03 -0.44 -0.00 0.00 0.00 175.22 175.75 2g6h h ASP 552 N 8.22 0.00 1.05 1.36 3.32 -1.97 0.49 116.42 128.90 2g6h h ASP 552 Ca -0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2g6h h ASP 552 Cb 1.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.61 2g6h h ASP 552 CO 0.87 0.00 0.00 4.11 -1.72 0.00 0.00 179.24 182.50 2g6h h TRP 553 N 0.00 0.00 -0.32 4.55 5.08 -1.96 -3.23 115.95 120.07 2g6h h TRP 553 Ca 0.15 0.00 0.06 0.00 1.08 0.00 0.00 58.89 60.18 2g6h h TRP 553 Cb 0.74 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.84 2g6h h TRP 553 CO 0.00 0.00 -0.08 0.35 -1.28 0.00 0.00 178.44 177.43 2g6h h PHE 554 N 0.00 -0.17 -0.95 0.12 3.57 -0.39 -0.23 116.94 118.89 2g6h h PHE 554 Ca 0.00 0.03 0.22 0.00 3.53 0.00 0.00 57.97 61.75 2g6h h PHE 554 Cb 0.53 0.12 -0.08 0.00 2.79 0.00 0.00 35.95 39.31 2g6h h PHE 554 CO 0.00 -0.14 0.62 1.57 -2.23 0.00 0.00 178.31 178.14 2g6h h LYS 555 N 0.00 0.44 -0.36 1.11 2.10 -1.72 0.19 116.57 118.33 2g6h h LYS 555 Ca 0.15 -0.03 0.09 0.00 -2.00 0.00 0.00 60.65 58.86 2g6h h LYS 555 Cb 0.23 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.45 2g6h h LYS 555 CO -0.33 0.29 0.25 -0.44 -2.00 0.00 0.00 179.45 177.23 2g6h h ASP 556 N 0.45 0.08 -0.04 7.07 3.32 -1.21 -1.79 116.42 124.30 2g6h h ASP 556 Ca 0.51 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.58 2g6h h ASP 556 Cb 1.22 -0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.75 2g6h h ASP 556 CO -0.23 0.05 0.40 -0.07 -1.72 0.00 0.00 179.24 177.68 2g6h h LEU 557 N 0.09 0.00 -1.06 1.55 3.38 -0.61 -3.45 115.31 115.21 2g6h h LEU 557 Ca 0.17 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.95 2g6h h LEU 557 Cb 0.56 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.38 2g6h h LEU 557 CO -0.02 0.00 -0.34 0.61 0.09 0.00 0.00 178.44 178.79 2g6h n GLY 558 N -1.27 0.20 3.76 0.83 0.00 -0.67 -5.03 105.19 103.01 2g6h n GLY 558 Ca -0.01 -0.22 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 2g6h n GLY 558 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g6h s LEU 559 N -4.07 3.81 0.15 0.99 1.43 -1.26 -5.03 118.68 114.70 2g6h s LEU 559 Ca 0.24 0.10 -0.24 0.00 -1.03 0.00 0.00 54.13 53.21 2g6h s LEU 559 Cb -0.11 -2.22 0.07 0.00 0.03 0.00 0.00 46.19 43.96 2g6h s LEU 559 CO 0.35 0.27 0.67 -1.59 0.23 0.00 0.00 176.35 176.29 2g6h s LYS 560 N -1.72 1.28 0.15 1.70 -2.85 -1.26 -0.22 119.74 116.82 2g6h s LYS 560 Ca 0.22 -0.53 -0.10 0.00 -1.00 0.00 0.00 55.97 54.56 2g6h s LYS 560 Cb -0.12 0.55 0.00 0.00 -2.06 0.00 0.00 37.83 36.21 2g6h s LYS 560 CO 0.13 -0.57 0.30 -0.46 0.10 0.00 0.00 175.35 174.86 2g6h s TRP 561 N -3.66 0.23 0.36 1.78 -0.11 -0.84 -4.93 118.94 111.77 2g6h s TRP 561 Ca 0.03 -0.61 -0.14 0.00 1.22 0.00 0.00 56.10 56.61 2g6h s TRP 561 Cb -0.02 0.02 -0.08 0.00 -1.50 0.00 0.00 33.47 31.89 2g6h s TRP 561 CO -0.09 -0.70 0.76 1.52 -4.62 0.00 0.00 176.95 173.82 2g6h s TYR 562 N -3.92 3.40 -0.60 5.86 -0.85 -1.26 -0.07 117.35 119.90 2g6h s TYR 562 Ca 0.12 1.19 0.24 0.00 -0.52 0.00 0.00 57.07 58.11 2g6h s TYR 562 Cb 0.03 -2.53 0.38 0.00 0.38 0.00 0.00 41.96 40.22 2g6h s TYR 562 CO -0.04 0.01 1.38 0.78 -1.52 0.00 0.00 175.55 176.16 2g6h h GLY 563 N 1.90 0.00 -7.52 5.49 0.00 -1.47 -3.45 103.07 98.02 2g6h h GLY 563 Ca -0.48 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.14 2g6h h GLY 563 CO 0.65 0.00 -0.50 -2.27 0.00 0.00 0.00 176.54 174.41 2g6h s LEU 564 N -4.50 4.91 -0.31 3.11 2.96 -1.26 -4.52 118.68 119.07 2g6h s LEU 564 Ca 0.06 -1.34 -0.25 0.00 -0.22 0.00 0.00 54.13 52.38 2g6h s LEU 564 Cb 0.12 -1.97 0.01 0.00 0.50 0.00 0.00 46.19 44.85 2g6h s LEU 564 CO 0.71 -0.47 0.87 -2.16 -1.32 0.00 0.00 176.35 173.98 2g6h s PRO 565 N 1.44 3.99 -0.44 0.98 0.04 -1.26 -4.68 135.00 135.07 2g6h s PRO 565 Ca 0.02 0.73 0.03 0.00 0.04 0.00 0.00 61.00 61.82 2g6h s PRO 565 Cb -0.22 -3.73 0.16 0.00 0.04 0.00 0.00 34.50 30.76 2g6h s PRO 565 CO 0.03 -0.74 0.33 0.00 0.04 0.00 0.00 177.00 176.66 2g6h s ALA 566 N 3.15 1.69 -0.06 8.56 0.00 -1.26 -3.07 121.76 130.77 2g6h s ALA 566 Ca 0.36 -2.53 -0.35 0.00 0.00 0.00 0.00 51.96 49.44 2g6h s ALA 566 Cb -0.14 -1.69 -0.12 0.00 0.00 0.00 0.00 23.12 21.17 2g6h s ALA 566 CO 0.13 -2.02 1.82 0.28 0.00 0.00 0.00 175.76 175.97 2g6h n VAL 567 N 3.01 0.46 0.06 0.00 0.31 -0.86 -1.11 118.33 120.21 2g6h n VAL 567 Ca 0.23 -0.08 0.01 0.00 -0.01 0.00 0.00 64.34 64.49 2g6h n VAL 567 Cb 0.43 -1.77 0.00 0.00 -0.91 0.00 0.00 33.84 31.60 2g6h n VAL 567 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2g6h n SER 568 N 5.99 0.68 -1.36 4.52 3.41 -0.16 -1.95 113.62 124.74 2g6h n SER 568 Ca 0.22 -0.84 0.11 0.00 -0.26 0.00 0.00 58.87 58.10 2g6h n SER 568 Cb 0.28 0.42 0.32 0.00 -0.26 0.00 0.00 64.21 64.97 2g6h n SER 568 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2g6h n ASN 569 N -0.38 3.96 -4.93 4.04 2.04 -1.21 -4.47 115.26 114.32 2g6h n ASN 569 Ca 0.01 -2.05 -0.22 0.00 -0.44 0.00 0.00 54.58 51.87 2g6h n ASN 569 Cb 0.03 -0.49 0.05 0.00 -2.53 0.00 0.00 39.78 36.84 2g6h n ASN 569 CO 0.00 0.00 0.00 -0.04 -0.44 0.00 0.00 177.26 176.78 2g6h s MET 570 N -1.13 2.39 -0.12 -3.83 -1.94 -1.26 -4.34 119.30 109.07 2g6h s MET 570 Ca 0.49 -0.76 0.02 0.00 -1.71 0.00 0.00 55.69 53.73 2g6h s MET 570 Cb 0.26 -2.43 -0.00 0.00 2.01 0.00 0.00 34.83 34.67 2g6h s MET 570 CO 0.32 -0.87 -0.20 -1.17 -0.01 0.00 0.00 175.02 173.08 2g6h s LEU 571 N -4.87 2.27 -0.24 -0.03 0.20 0.16 -4.31 118.68 111.86 2g6h s LEU 571 Ca 0.59 -0.51 -0.11 0.00 0.69 0.00 0.00 54.13 54.79 2g6h s LEU 571 Cb -0.10 -1.48 -0.05 0.00 -0.43 0.00 0.00 46.19 44.14 2g6h s LEU 571 CO 0.40 0.14 0.20 -0.22 -0.29 0.00 0.00 176.35 176.58 2g6h s LEU 572 N 0.49 4.11 -0.20 -0.68 2.96 -0.28 0.12 118.68 125.19 2g6h s LEU 572 Ca -0.13 0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 53.89 2g6h s LEU 572 Cb -0.17 -2.17 -0.01 0.00 0.50 0.00 0.00 46.19 44.34 2g6h s LEU 572 CO 0.05 0.02 -0.05 -0.70 -1.32 0.00 0.00 176.35 174.36 2g6h s GLU 573 N 1.21 3.44 -0.07 1.98 2.12 -0.40 -0.37 118.70 126.61 2g6h s GLU 573 Ca 0.09 -0.61 -0.00 0.00 0.36 0.00 0.00 54.97 54.81 2g6h s GLU 573 Cb -0.14 -2.96 0.03 0.00 0.26 0.00 0.00 34.13 31.32 2g6h s GLU 573 CO 0.06 -0.07 -0.03 0.42 -0.54 0.00 0.00 175.26 175.10 2g6h s ILE 574 N 1.16 0.53 -1.58 -3.70 1.01 -0.50 -2.13 121.20 115.98 2g6h s ILE 574 Ca 0.02 -0.02 -0.11 0.00 0.00 0.00 0.00 60.65 60.54 2g6h s ILE 574 Cb -0.14 -0.62 0.09 0.00 0.01 0.00 0.00 42.46 41.80 2g6h s ILE 574 CO -0.01 0.26 0.62 0.61 0.00 0.00 0.00 174.94 176.42 2g6h n GLY 575 N 4.74 -0.35 3.50 6.18 0.00 -1.26 -0.19 105.19 117.81 2g6h n GLY 575 Ca -0.14 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2g6h n GLY 575 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g6h n GLY 576 N -1.69 3.05 3.75 -0.02 0.00 -1.26 -3.63 105.19 105.40 2g6h n GLY 576 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 2g6h n GLY 576 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g6h s LEU 577 N 0.00 4.60 -0.24 0.99 1.43 0.74 -5.03 118.68 121.18 2g6h s LEU 577 Ca 0.00 2.02 -0.05 0.00 -1.03 0.00 0.00 54.13 55.07 2g6h s LEU 577 Cb 0.00 -3.61 -0.01 0.00 0.03 0.00 0.00 46.19 42.60 2g6h s LEU 577 CO 0.00 0.05 0.01 -1.61 0.23 0.00 0.00 176.35 175.03 2g6h s GLU 578 N -1.09 3.43 -0.45 1.70 2.02 -1.26 -1.41 118.70 121.64 2g6h s GLU 578 Ca 0.43 -0.61 -0.09 0.00 0.02 0.00 0.00 54.97 54.73 2g6h s GLU 578 Cb -0.27 -3.16 0.10 0.00 0.10 0.00 0.00 34.13 30.90 2g6h s GLU 578 CO 0.34 -0.23 0.31 -0.06 0.02 0.00 0.00 175.26 175.64 2g6h s PHE 579 N 1.53 3.41 -0.95 1.61 0.40 0.50 0.70 117.98 125.17 2g6h s PHE 579 Ca 0.06 -1.79 0.27 0.00 -0.60 0.00 0.00 56.93 54.86 2g6h s PHE 579 Cb -0.15 -3.29 1.09 0.00 0.51 0.00 0.00 43.02 41.18 2g6h s PHE 579 CO -0.00 -0.94 1.84 -1.13 0.70 0.00 0.00 175.22 175.69 2g6h n SER 580 N 4.89 0.12 -3.76 1.36 3.41 -1.26 -1.13 113.62 117.25 2g6h n SER 580 Ca -0.08 0.51 -0.29 0.00 -0.26 0.00 0.00 58.87 58.75 2g6h n SER 580 Cb 0.41 -0.55 -0.15 0.00 -0.26 0.00 0.00 64.21 63.67 2g6h n SER 580 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g6h s ALA 581 N -3.02 1.48 -0.39 7.33 0.00 -1.20 -4.64 121.76 121.33 2g6h s ALA 581 Ca 0.12 -1.43 0.11 0.00 0.00 0.00 0.00 51.96 50.76 2g6h s ALA 581 Cb 0.17 -1.51 0.36 0.00 0.00 0.00 0.00 23.12 22.14 2g6h s ALA 581 CO 0.50 -1.51 0.91 0.00 0.00 0.00 0.00 175.76 175.66 2g6h n PRO 583 N 0.18 2.17 -4.05 0.00 -0.04 -1.21 -4.69 135.00 127.36 2g6h n PRO 583 Ca 0.16 0.76 -0.11 0.00 -0.04 0.00 0.00 63.50 64.27 2g6h n PRO 583 Cb 0.71 -2.37 -0.11 0.00 -0.04 0.00 0.00 33.50 31.69 2g6h n PRO 583 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2g6h s PHE 584 N -0.87 0.57 0.04 0.54 -0.12 -0.82 -1.70 117.98 115.63 2g6h s PHE 584 Ca 0.58 -0.58 -0.03 0.00 -0.05 0.00 0.00 56.93 56.85 2g6h s PHE 584 Cb -0.57 -0.36 -0.02 0.00 -0.63 0.00 0.00 43.02 41.43 2g6h s PHE 584 CO 0.60 -0.14 0.03 -1.54 -0.05 0.00 0.00 175.22 174.11 2g6h s SER 585 N -1.78 0.33 0.00 1.98 1.04 0.41 -2.03 113.70 113.64 2g6h s SER 585 Ca -0.08 -0.75 0.00 0.00 0.48 0.00 0.00 55.95 55.60 2g6h s SER 585 Cb -0.07 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.25 2g6h s SER 585 CO -0.01 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.28 2g6h n GLY 586 N 0.54 4.82 3.12 7.32 0.00 -1.18 -1.60 105.19 118.21 2g6h n GLY 586 Ca -0.17 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 2g6h n GLY 586 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2g6h s TRP 587 N 3.71 0.31 0.53 1.61 -2.14 -1.26 -4.47 118.94 117.23 2g6h s TRP 587 Ca 0.00 -0.72 -0.20 0.00 2.66 0.00 0.00 56.10 57.85 2g6h s TRP 587 Cb 0.00 -0.21 -0.06 0.00 -3.10 0.00 0.00 33.47 30.09 2g6h s TRP 587 CO 0.00 -0.40 1.10 0.71 -2.66 0.00 0.00 176.95 175.71 2g6h s TYR 588 N -3.25 2.76 -0.17 1.66 1.51 -1.26 -4.92 117.35 113.68 2g6h s TYR 588 Ca 0.01 1.55 -0.08 0.00 -1.01 0.00 0.00 57.07 57.54 2g6h s TYR 588 Cb 0.03 -3.22 -0.04 0.00 -0.11 0.00 0.00 41.96 38.61 2g6h s TYR 588 CO -0.08 -1.37 0.11 1.41 -1.11 0.00 0.00 175.55 174.51 2g6h s MET 589 N -3.30 3.91 0.23 -0.62 -2.45 -1.26 -1.07 119.30 114.75 2g6h s MET 589 Ca 0.71 -0.24 -0.15 0.00 -1.25 0.00 0.00 55.69 54.76 2g6h s MET 589 Cb -0.22 -3.28 0.29 0.00 1.25 0.00 0.00 34.83 32.87 2g6h s MET 589 CO 0.25 0.42 1.57 0.78 1.05 0.00 0.00 175.02 179.09 2g6h h GLY 590 N 6.24 0.29 0.66 2.11 0.00 -0.58 -1.54 103.07 110.26 2g6h h GLY 590 Ca -0.43 0.40 0.18 0.00 0.00 0.00 0.00 47.33 47.48 2g6h h GLY 590 CO 0.70 -0.27 0.49 -0.91 0.00 0.00 0.00 176.54 176.55 2g6h h THR 591 N -0.03 0.57 -0.77 4.70 1.35 -1.93 -1.70 112.91 115.10 2g6h h THR 591 Ca 0.36 0.00 0.08 0.00 -0.55 0.00 0.00 66.41 66.30 2g6h h THR 591 Cb 0.61 0.65 -0.07 0.00 -1.73 0.00 0.00 68.15 67.61 2g6h h THR 591 CO -0.89 0.00 0.43 -0.33 -0.25 0.00 0.00 175.52 174.47 2g6h h GLU 592 N 0.00 0.72 0.00 4.72 5.08 -1.68 0.10 114.58 123.52 2g6h h GLU 592 Ca 0.30 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.59 2g6h h GLU 592 Cb 1.28 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 2g6h h GLU 592 CO -0.00 0.48 -0.30 0.82 -1.00 0.00 0.00 179.01 179.00 2g6h h ILE 593 N 0.74 0.33 -0.86 3.13 2.04 -1.49 -1.26 117.51 120.13 2g6h h ILE 593 Ca 0.36 -1.30 -0.00 0.00 1.00 0.00 0.00 64.86 64.92 2g6h h ILE 593 Cb 0.30 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.01 2g6h h ILE 593 CO -0.23 0.11 0.54 1.23 0.00 0.00 0.00 178.15 179.80 2g6h h GLY 594 N -1.00 1.24 0.00 5.37 0.00 -1.42 0.28 103.07 107.55 2g6h h GLY 594 Ca -0.04 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.71 2g6h h GLY 594 CO -0.02 0.49 -0.79 -0.62 0.00 0.00 0.00 176.54 175.59 2g6h n VAL 595 N -4.44 1.46 0.04 4.60 0.31 0.31 -3.57 118.33 117.04 2g6h n VAL 595 Ca 0.09 0.13 -0.04 0.00 -0.01 0.00 0.00 64.34 64.51 2g6h n VAL 595 Cb 0.05 -2.27 -0.03 0.00 -0.91 0.00 0.00 33.84 30.68 2g6h n VAL 595 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 2g6h h ARG 596 N -1.00 -0.20 -0.52 5.55 2.47 -1.46 -2.28 114.38 116.94 2g6h h ARG 596 Ca -0.12 0.01 -0.07 0.00 -1.26 0.00 0.00 59.98 58.54 2g6h h ARG 596 Cb 0.79 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 29.14 2g6h h ARG 596 CO -0.08 -0.06 0.05 -0.44 0.56 0.00 0.00 179.97 180.00 2g6h h ASP 597 N -1.04 0.86 0.28 7.04 3.32 -0.93 -2.07 116.42 123.87 2g6h h ASP 597 Ca -0.02 -0.28 -0.34 0.00 0.02 0.00 0.00 57.03 56.41 2g6h h ASP 597 Cb 0.23 -0.23 0.01 0.00 0.22 0.00 0.00 39.33 39.57 2g6h h ASP 597 CO 0.03 0.92 -1.64 1.88 -1.72 0.00 0.00 179.24 178.71 2g6h h TYR 598 N 0.76 0.69 -0.00 4.55 0.99 -0.62 -2.29 116.97 121.04 2g6h h TYR 598 Ca 0.15 -0.51 0.00 0.00 2.00 0.00 0.00 58.73 60.38 2g6h h TYR 598 Cb 0.46 -0.03 0.00 0.00 1.00 0.00 0.00 36.73 38.16 2g6h h TYR 598 CO 0.03 1.58 -0.63 0.00 -0.00 0.00 0.00 178.16 179.14 2g6h n ASP 600 N -0.93 2.11 -0.03 0.00 9.92 -0.78 -4.63 116.55 122.21 2g6h n ASP 600 Ca 0.05 0.94 -0.04 0.00 -0.53 0.00 0.00 54.79 55.21 2g6h n ASP 600 Cb 0.29 -1.51 0.19 0.00 -0.64 0.00 0.00 41.12 39.46 2g6h n ASP 600 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 2g6h h ASN 601 N 1.20 0.60 -0.41 -2.24 -0.73 -1.93 -2.58 115.58 109.48 2g6h h ASN 601 Ca -0.50 -0.17 0.00 0.00 1.87 0.00 0.00 56.30 57.50 2g6h h ASN 601 Cb 1.32 -0.16 0.00 0.00 0.27 0.00 0.00 38.32 39.75 2g6h h ASN 601 CO 0.55 0.76 0.00 -1.54 -0.37 0.00 0.00 177.43 176.83 2g6h n SER 602 N -4.18 3.70 0.00 1.15 3.41 -1.26 -4.49 113.62 111.95 2g6h n SER 602 Ca 0.01 -2.44 0.00 0.00 -0.26 0.00 0.00 58.87 56.18 2g6h n SER 602 Cb 0.35 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 2g6h n SER 602 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2g6h n ARG 603 N 0.56 0.93 0.00 4.33 5.12 -1.02 -4.25 116.66 122.33 2g6h n ARG 603 Ca 0.18 0.00 0.10 0.00 -1.93 0.00 0.00 57.85 56.20 2g6h n ARG 603 Cb 0.75 0.00 0.51 0.00 -1.16 0.00 0.00 32.46 32.55 2g6h n ARG 603 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2g6h n TYR 604 N 0.00 0.00 -3.09 -1.55 4.02 -0.86 -4.60 117.16 111.08 2g6h n TYR 604 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.78 2g6h n TYR 604 Cb 0.00 -0.28 0.00 0.00 -0.02 0.00 0.00 39.34 39.04 2g6h n TYR 604 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2g6h n ASN 605 N -1.28 -1.88 -0.87 7.72 4.05 -0.97 -4.87 115.26 117.15 2g6h n ASN 605 Ca 0.10 -0.40 0.08 0.00 0.45 0.00 0.00 54.58 54.80 2g6h n ASN 605 Cb 0.16 -0.63 0.19 0.00 1.23 0.00 0.00 39.78 40.72 2g6h n ASN 605 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 2g6h n ILE 606 N -1.45 0.74 -0.05 -1.44 -5.35 -0.33 -4.71 119.36 106.78 2g6h n ILE 606 Ca -0.12 -0.87 -0.09 0.00 -0.27 0.00 0.00 62.75 61.39 2g6h n ILE 606 Cb 0.27 0.72 -0.03 0.00 -1.74 0.00 0.00 39.64 38.86 2g6h n ILE 606 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 2g6h h LEU 607 N 3.05 0.15 0.02 7.28 3.38 -1.87 -2.75 115.31 124.57 2g6h h LEU 607 Ca 0.00 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2g6h h LEU 607 Cb 0.80 -0.02 -0.05 0.00 0.09 0.00 0.00 40.66 41.48 2g6h h LEU 607 CO 0.00 0.12 -0.36 -0.33 0.09 0.00 0.00 178.44 177.96 2g6h h GLU 608 N 0.22 -0.51 -0.50 1.13 5.08 -1.99 0.18 114.58 118.20 2g6h h GLU 608 Ca 0.09 0.03 0.10 0.00 -1.00 0.00 0.00 59.36 58.58 2g6h h GLU 608 Cb 0.02 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.30 2g6h h GLU 608 CO -0.06 -0.34 -0.01 0.93 -1.00 0.00 0.00 179.01 178.53 2g6h h GLU 609 N -0.52 0.10 -0.70 2.33 5.08 -1.89 0.44 114.58 119.42 2g6h h GLU 609 Ca 0.05 -0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 2g6h h GLU 609 Cb 0.60 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 2g6h h GLU 609 CO -0.27 0.06 0.25 0.28 -1.00 0.00 0.00 179.01 178.33 2g6h h VAL 610 N 0.10 1.25 -0.44 3.13 2.07 -1.14 -1.07 116.25 120.15 2g6h h VAL 610 Ca 0.25 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 2g6h h VAL 610 Cb 0.38 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 2g6h h VAL 610 CO -0.43 0.32 0.22 0.00 0.02 0.00 0.00 177.57 177.71 2g6h h ALA 611 N 1.12 0.57 0.18 1.67 0.00 0.65 -1.70 119.26 121.74 2g6h h ALA 611 Ca 0.23 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2g6h h ALA 611 Cb 0.25 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2g6h h ALA 611 CO -0.01 0.11 -0.40 0.87 0.00 0.00 0.00 179.25 179.82 2g6h h LYS 612 N 0.57 -0.61 -0.98 0.00 1.57 0.32 -0.79 116.57 116.66 2g6h h LYS 612 Ca 0.15 0.04 0.26 0.00 -1.87 0.00 0.00 60.65 59.24 2g6h h LYS 612 Cb 0.09 0.14 -0.06 0.00 0.08 0.00 0.00 32.23 32.48 2g6h h LYS 612 CO -0.02 -0.41 0.67 0.87 -0.57 0.00 0.00 179.45 180.00 2g6h h LYS 613 N -0.63 0.18 -0.00 3.15 1.79 -1.09 1.55 116.57 121.52 2g6h h LYS 613 Ca -0.02 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2g6h h LYS 613 Cb 0.60 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.21 2g6h h LYS 613 CO -0.17 0.12 -0.05 -1.33 -1.08 0.00 0.00 179.45 176.94 2g6h n MET 614 N -4.39 0.23 -3.48 3.15 2.81 -0.65 -4.94 117.12 109.85 2g6h n MET 614 Ca 0.21 -0.03 -0.22 0.00 -1.81 0.00 0.00 57.70 55.86 2g6h n MET 614 Cb 0.93 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.98 2g6h n MET 614 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2g6h n ASP 615 N -1.36 -6.06 -4.83 7.83 2.03 0.53 -5.01 116.55 109.69 2g6h n ASP 615 Ca 0.10 -0.78 -0.28 0.00 0.52 0.00 0.00 54.79 54.35 2g6h n ASP 615 Cb 0.30 -4.04 -0.05 0.00 -0.72 0.00 0.00 41.12 36.60 2g6h n ASP 615 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2g6h s LEU 616 N -5.67 3.95 -0.86 -2.67 1.43 -1.08 -5.02 118.68 108.76 2g6h s LEU 616 Ca 0.36 0.00 -0.25 0.00 -1.03 0.00 0.00 54.13 53.22 2g6h s LEU 616 Cb -0.10 -2.58 -0.04 0.00 0.03 0.00 0.00 46.19 43.50 2g6h s LEU 616 CO 0.81 0.11 1.90 -0.62 0.23 0.00 0.00 176.35 178.79 2g6h s ASP 617 N -2.82 5.23 -0.07 2.29 3.68 -1.26 -4.78 116.67 118.94 2g6h s ASP 617 Ca 0.31 -0.56 0.06 0.00 2.13 0.00 0.00 52.55 54.50 2g6h s ASP 617 Cb -0.11 -2.56 0.29 0.00 -1.45 0.00 0.00 42.92 39.09 2g6h s ASP 617 CO 0.24 -2.62 1.02 0.23 0.13 0.00 0.00 175.17 174.17 2g6h n MET 618 N 8.91 2.23 0.02 4.34 2.81 -1.26 -4.12 117.12 130.06 2g6h n MET 618 Ca 0.36 -1.11 -0.19 0.00 -1.81 0.00 0.00 57.70 54.95 2g6h n MET 618 Cb 0.48 -1.64 -0.11 0.00 -0.71 0.00 0.00 33.22 31.24 2g6h n MET 618 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2g6h h ARG 619 N 1.50 0.52 -5.71 0.03 3.08 -2.04 -3.45 114.38 108.32 2g6h h ARG 619 Ca 0.00 -0.58 -0.68 0.00 0.07 0.00 0.00 59.98 58.79 2g6h h ARG 619 Cb 0.87 0.17 -0.32 0.00 0.08 0.00 0.00 29.97 30.77 2g6h h ARG 619 CO 0.14 1.21 -0.88 -1.59 -1.07 0.00 0.00 179.97 177.77 2g6h s LYS 620 N -3.20 2.74 0.49 0.04 -2.85 -1.26 -5.01 119.74 110.70 2g6h s LYS 620 Ca -0.12 -0.89 0.17 0.00 -1.00 0.00 0.00 55.97 54.14 2g6h s LYS 620 Cb 0.05 -2.20 1.19 0.00 -2.06 0.00 0.00 37.83 34.80 2g6h s LYS 620 CO 0.86 0.29 2.05 1.79 0.10 0.00 0.00 175.35 180.44 2g6h h THR 621 N 5.35 0.91 0.00 3.79 1.35 -1.91 -1.27 112.91 121.12 2g6h h THR 621 Ca -0.26 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.54 2g6h h THR 621 Cb 1.20 0.71 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 2g6h h THR 621 CO 0.47 0.03 0.00 -1.54 -0.25 0.00 0.00 175.52 174.23 2g6h n SER 622 N -4.47 0.00 0.00 5.36 3.41 -1.26 -1.06 113.62 115.61 2g6h n SER 622 Ca 0.05 0.13 0.13 0.00 -0.26 0.00 0.00 58.87 58.92 2g6h n SER 622 Cb 0.31 -0.28 0.49 0.00 -0.26 0.00 0.00 64.21 64.47 2g6h n SER 622 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2g6h n SER 623 N -1.28 0.19 -3.35 4.04 3.41 -0.48 -4.92 113.62 111.22 2g6h n SER 623 Ca 0.05 0.26 -0.24 0.00 -0.26 0.00 0.00 58.87 58.68 2g6h n SER 623 Cb 0.08 -0.26 0.04 0.00 -0.26 0.00 0.00 64.21 63.81 2g6h n SER 623 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2g6h n LEU 624 N -1.53 -2.70 -0.32 1.04 4.77 -0.22 -4.90 117.00 113.14 2g6h n LEU 624 Ca 0.06 -0.44 -0.04 0.00 -0.03 0.00 0.00 56.01 55.57 2g6h n LEU 624 Cb 0.34 -2.82 0.08 0.00 -2.33 0.00 0.00 43.42 38.70 2g6h n LEU 624 CO 0.30 0.37 1.17 4.11 -1.33 0.00 0.00 177.39 182.01 2g6h h TRP 625 N -1.78 1.19 -0.75 -1.77 5.08 -1.84 -1.34 115.95 114.74 2g6h h TRP 625 Ca -0.54 -0.02 0.05 0.00 1.08 0.00 0.00 58.89 59.46 2g6h h TRP 625 Cb 1.36 -0.38 -0.05 0.00 -3.00 0.00 0.00 29.16 27.08 2g6h h TRP 625 CO 0.55 0.81 0.45 0.87 -1.28 0.00 0.00 178.44 179.84 2g6h h LYS 626 N 1.21 0.81 -0.32 0.12 1.57 -1.90 -0.32 116.57 117.75 2g6h h LYS 626 Ca 0.31 -0.05 -0.06 0.00 -1.87 0.00 0.00 60.65 58.98 2g6h h LYS 626 Cb 0.01 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 2g6h h LYS 626 CO -0.05 0.54 -0.02 -0.44 -0.57 0.00 0.00 179.45 178.91 2g6h h ASP 627 N 0.84 0.56 -0.25 0.86 5.19 -1.80 -0.01 116.42 121.81 2g6h h ASP 627 Ca 0.32 -0.32 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2g6h h ASP 627 Cb 0.13 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.48 2g6h h ASP 627 CO -0.16 0.75 0.16 1.56 -3.12 0.00 0.00 179.24 178.44 2g6h h GLN 628 N 0.36 0.32 -0.13 3.56 4.20 -0.86 -1.86 115.11 120.70 2g6h h GLN 628 Ca 0.09 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 2g6h h GLN 628 Cb 0.47 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.18 2g6h h GLN 628 CO 0.02 0.21 0.07 0.00 -0.67 0.00 0.00 178.83 178.47 2g6h h ALA 629 N 1.09 0.17 -0.57 3.87 0.00 -1.02 -2.49 119.26 120.32 2g6h h ALA 629 Ca 0.09 -0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.05 2g6h h ALA 629 Cb -0.03 -0.05 -0.11 0.00 0.00 0.00 0.00 17.79 17.59 2g6h h ALA 629 CO -0.02 -0.29 -0.26 1.25 0.00 0.00 0.00 179.25 179.93 2g6h h LEU 630 N 0.11 -0.91 -0.29 0.00 5.85 -0.70 -0.14 115.31 119.24 2g6h h LEU 630 Ca 0.05 0.21 0.05 0.00 0.84 0.00 0.00 57.88 59.02 2g6h h LEU 630 Cb 0.08 0.49 -0.05 0.00 0.37 0.00 0.00 40.66 41.55 2g6h h LEU 630 CO -0.01 -0.27 -0.02 0.58 -0.34 0.00 0.00 178.44 178.38 2g6h h VAL 631 N -0.12 0.76 -0.29 1.05 2.07 -1.06 -1.94 116.25 116.73 2g6h h VAL 631 Ca 0.25 -0.02 0.01 0.00 0.82 0.00 0.00 66.70 67.76 2g6h h VAL 631 Cb 0.52 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2g6h h VAL 631 CO -0.64 0.01 0.18 -0.33 0.02 0.00 0.00 177.57 176.80 2g6h h GLU 632 N 0.06 0.35 0.23 1.57 4.39 -0.84 -1.23 114.58 119.10 2g6h h GLU 632 Ca 0.14 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.83 2g6h h GLU 632 Cb 0.19 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 2g6h h GLU 632 CO -0.25 0.23 -0.48 0.82 -1.16 0.00 0.00 179.01 178.17 2g6h h ILE 633 N 0.36 0.07 -0.06 3.13 2.04 -0.69 -0.71 117.51 121.65 2g6h h ILE 633 Ca 0.11 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.99 2g6h h ILE 633 Cb -0.01 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.13 2g6h h ILE 633 CO -0.04 0.00 0.12 0.78 0.00 0.00 0.00 178.15 179.01 2g6h h ASN 634 N -0.78 0.00 -0.24 1.72 2.35 -1.21 0.31 115.58 117.72 2g6h h ASN 634 Ca -0.01 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.55 2g6h h ASN 634 Cb 0.76 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.13 2g6h h ASN 634 CO -0.21 0.00 -0.61 0.40 -1.65 0.00 0.00 177.43 175.37 2g6h h ILE 635 N 0.00 1.28 -0.13 2.81 2.04 0.08 -3.12 117.51 120.46 2g6h h ILE 635 Ca 0.03 -1.79 -0.11 0.00 1.00 0.00 0.00 64.86 63.99 2g6h h ILE 635 Cb 0.28 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.10 2g6h h ILE 635 CO -0.00 0.58 -0.38 0.00 0.00 0.00 0.00 178.15 178.34 2g6h h ALA 636 N 0.63 1.10 0.12 1.87 0.00 0.69 -1.41 119.26 122.26 2g6h h ALA 636 Ca -0.01 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2g6h h ALA 636 Cb 1.22 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2g6h h ALA 636 CO 0.13 0.58 -0.06 0.28 0.00 0.00 0.00 179.25 180.19 2g6h h VAL 637 N 0.25 1.05 -0.69 0.00 2.07 -1.34 -1.13 116.25 116.45 2g6h h VAL 637 Ca 0.03 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.81 2g6h h VAL 637 Cb 0.79 1.49 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 2g6h h VAL 637 CO 0.06 0.17 0.33 -0.07 0.02 0.00 0.00 177.57 178.08 2g6h h LEU 638 N -0.50 0.89 -0.25 2.57 3.38 -1.53 -1.71 115.31 118.16 2g6h h LEU 638 Ca -0.02 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 2g6h h LEU 638 Cb 0.40 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 2g6h h LEU 638 CO 0.03 0.75 0.02 0.22 0.09 0.00 0.00 178.44 179.55 2g6h h TYR 639 N 0.98 0.46 0.76 1.13 3.20 -1.21 -1.82 116.97 120.47 2g6h h TYR 639 Ca 0.24 -0.07 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 2g6h h TYR 639 Cb 0.10 -0.12 0.01 0.00 1.54 0.00 0.00 36.73 38.25 2g6h h TYR 639 CO 0.01 0.57 -0.37 0.77 -1.64 0.00 0.00 178.16 177.50 2g6h h SER 640 N 0.21 -0.89 -0.75 -2.11 0.02 -0.91 0.10 113.55 109.22 2g6h h SER 640 Ca 0.07 0.03 0.17 0.00 -0.84 0.00 0.00 61.79 61.23 2g6h h SER 640 Cb 0.37 0.23 -0.12 0.00 0.14 0.00 0.00 62.40 63.02 2g6h h SER 640 CO 0.01 -0.63 0.10 -0.26 -1.14 0.00 0.00 176.83 174.92 2g6h h PHE 641 N -1.03 0.13 -0.45 3.45 -1.00 -1.38 0.12 116.94 116.78 2g6h h PHE 641 Ca -0.10 0.05 -0.03 0.00 2.81 0.00 0.00 57.97 60.70 2g6h h PHE 641 Cb 0.79 0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.39 2g6h h PHE 641 CO 0.04 -0.17 0.18 1.96 -1.61 0.00 0.00 178.31 178.70 2g6h h GLN 642 N 0.18 0.67 0.00 1.51 4.20 -1.27 0.22 115.11 120.62 2g6h h GLN 642 Ca 0.43 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 59.00 2g6h h GLN 642 Cb 0.76 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.43 2g6h h GLN 642 CO -0.60 0.61 -0.05 0.77 -0.67 0.00 0.00 178.83 178.90 2g6h h SER 643 N 0.58 0.00 -0.67 1.46 0.02 0.12 -0.93 113.55 114.14 2g6h h SER 643 Ca 0.15 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2g6h h SER 643 Cb 0.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.74 2g6h h SER 643 CO -0.01 0.05 0.00 0.47 -1.14 0.00 0.00 176.83 176.20 2g6h n ASP 644 N -4.42 3.86 -3.90 3.07 9.92 -0.10 -4.95 116.55 120.03 2g6h n ASP 644 Ca -0.03 -2.10 -0.28 0.00 -0.53 0.00 0.00 54.79 51.85 2g6h n ASP 644 Cb 0.13 -0.48 0.02 0.00 -0.64 0.00 0.00 41.12 40.15 2g6h n ASP 644 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2g6h n LYS 645 N 1.40 -5.05 -4.25 -1.24 4.01 -0.35 -4.97 118.16 107.71 2g6h n LYS 645 Ca 0.23 0.57 -0.34 0.00 -0.51 0.00 0.00 58.31 58.26 2g6h n LYS 645 Cb 0.64 -5.32 -0.11 0.00 -0.51 0.00 0.00 35.03 29.73 2g6h n LYS 645 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 2g6h s VAL 646 N -3.43 4.18 0.31 -0.18 1.01 -0.02 -4.27 120.40 118.00 2g6h s VAL 646 Ca 0.48 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.91 2g6h s VAL 646 Cb -0.24 -2.86 -0.12 0.00 0.00 0.00 0.00 36.38 33.16 2g6h s VAL 646 CO 0.84 0.48 1.41 0.41 0.00 0.00 0.00 175.10 178.23 2g6h n THR 647 N 3.60 1.52 -3.51 3.92 -1.04 0.51 -4.29 114.28 115.00 2g6h n THR 647 Ca -0.17 -0.38 -0.13 0.00 -2.04 0.00 0.00 64.05 61.33 2g6h n THR 647 Cb 0.52 -1.67 -0.04 0.00 -1.82 0.00 0.00 70.33 67.32 2g6h n THR 647 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 2g6h s ILE 648 N -0.60 0.00 -0.02 12.58 2.07 -1.26 -4.51 121.20 129.45 2g6h s ILE 648 Ca 0.60 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 59.87 2g6h s ILE 648 Cb -0.57 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.02 2g6h s ILE 648 CO 0.56 0.00 -0.08 0.54 -1.91 0.00 0.00 174.94 174.05 2g6h s VAL 649 N -2.15 0.71 0.50 4.00 0.11 -0.24 -4.98 120.40 118.35 2g6h s VAL 649 Ca -0.03 -0.34 -0.17 0.00 -2.93 0.00 0.00 61.98 58.51 2g6h s VAL 649 Cb -0.01 -0.62 -0.08 0.00 -1.53 0.00 0.00 36.38 34.15 2g6h s VAL 649 CO -0.01 0.22 0.97 1.51 -3.33 0.00 0.00 175.10 174.45 2g6h s ASP 650 N 0.06 6.64 0.57 3.54 -4.77 -1.26 0.20 116.67 121.66 2g6h s ASP 650 Ca -0.01 1.55 0.27 0.00 -3.30 0.00 0.00 52.55 51.06 2g6h s ASP 650 Cb -0.06 -2.50 1.66 0.00 -1.09 0.00 0.00 42.92 40.92 2g6h s ASP 650 CO 0.00 -0.55 2.18 1.12 0.70 0.00 0.00 175.17 178.62 2g6h h HIS 651 N 1.03 0.00 0.07 2.11 2.07 -1.97 -0.36 115.15 118.10 2g6h h HIS 651 Ca -0.47 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2g6h h HIS 651 Cb 1.18 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.16 2g6h h HIS 651 CO 0.63 0.00 -0.03 0.45 -3.07 0.00 0.00 177.93 175.91 2g6h h HIS 652 N 0.00 -0.09 -0.65 6.12 3.86 -1.96 -1.91 115.15 120.51 2g6h h HIS 652 Ca 0.03 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.20 2g6h h HIS 652 Cb 0.17 0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.65 2g6h h HIS 652 CO 0.00 0.40 0.23 1.03 0.86 0.00 0.00 177.93 180.45 2g6h h SER 653 N -0.63 0.92 -0.36 2.45 0.87 -1.85 -1.85 113.55 113.11 2g6h h SER 653 Ca -0.01 -0.19 -0.01 0.00 -1.23 0.00 0.00 61.79 60.35 2g6h h SER 653 Cb 0.53 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 2g6h h SER 653 CO 0.02 0.87 0.19 0.00 -0.53 0.00 0.00 176.83 177.37 2g6h h ALA 654 N 1.09 0.47 -0.35 6.23 0.00 -1.13 -1.25 119.26 124.33 2g6h h ALA 654 Ca 0.21 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 2g6h h ALA 654 Cb 0.25 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2g6h h ALA 654 CO -0.01 0.01 -0.24 1.79 0.00 0.00 0.00 179.25 180.80 2g6h h THR 655 N 0.45 1.27 -0.63 0.00 1.35 -1.22 -1.06 112.91 113.08 2g6h h THR 655 Ca 0.13 -1.34 -0.00 0.00 -0.55 0.00 0.00 66.41 64.65 2g6h h THR 655 Cb 0.09 1.26 -0.03 0.00 -1.73 0.00 0.00 68.15 67.75 2g6h h THR 655 CO -0.02 0.44 0.38 -0.08 -0.25 0.00 0.00 175.52 176.00 2g6h h GLU 656 N 0.60 0.85 -0.81 4.72 4.81 -1.15 -1.66 114.58 121.94 2g6h h GLU 656 Ca 0.08 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 2g6h h GLU 656 Cb 0.73 -0.18 -0.04 0.00 0.63 0.00 0.00 28.75 29.89 2g6h h GLU 656 CO 0.06 0.60 0.46 0.77 -0.73 0.00 0.00 179.01 180.17 2g6h h SER 657 N 0.85 1.00 -0.69 1.04 0.02 -0.76 -2.51 113.55 112.50 2g6h h SER 657 Ca 0.23 -0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 61.03 2g6h h SER 657 Cb -0.03 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 2g6h h SER 657 CO -0.04 0.80 0.23 0.15 -1.14 0.00 0.00 176.83 176.83 2g6h h PHE 658 N 1.12 1.11 -0.32 3.45 3.57 -0.59 0.30 116.94 125.59 2g6h h PHE 658 Ca 0.29 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2g6h h PHE 658 Cb 0.01 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 38.41 2g6h h PHE 658 CO 0.00 0.88 0.20 0.82 -2.23 0.00 0.00 178.31 177.98 2g6h h ILE 659 N 1.05 1.09 -0.45 1.41 1.08 -1.01 0.27 117.51 120.95 2g6h h ILE 659 Ca 0.23 -0.20 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 2g6h h ILE 659 Cb 0.27 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 2g6h h ILE 659 CO -0.01 0.09 0.30 0.50 -0.69 0.00 0.00 178.15 178.34 2g6h h LYS 660 N 0.42 0.60 -0.92 2.37 3.64 -1.14 -1.39 116.57 120.14 2g6h h LYS 660 Ca 0.12 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2g6h h LYS 660 Cb -0.02 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 31.62 2g6h h LYS 660 CO -0.02 0.40 0.53 1.25 -2.27 0.00 0.00 179.45 179.34 2g6h h HIS 661 N 0.61 1.24 -0.33 1.91 2.76 -0.44 -0.42 115.15 120.48 2g6h h HIS 661 Ca 0.17 -0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2g6h h HIS 661 Cb -0.07 -0.40 -0.02 0.00 1.55 0.00 0.00 27.41 28.48 2g6h h HIS 661 CO -0.04 0.84 0.20 0.52 -1.30 0.00 0.00 177.93 178.14 2g6h h MET 662 N 1.28 0.44 -0.03 5.26 2.86 0.11 0.15 114.93 124.99 2g6h h MET 662 Ca 0.33 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.94 2g6h h MET 662 Cb -0.02 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 2g6h h MET 662 CO -0.06 0.32 -0.03 0.93 1.06 0.00 0.00 176.91 179.14 2g6h h GLU 663 N 0.43 -0.04 -0.29 1.72 5.08 -0.76 0.25 114.58 120.96 2g6h h GLU 663 Ca 0.12 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.53 2g6h h GLU 663 Cb -0.01 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.21 2g6h h GLU 663 CO -0.02 -0.03 0.02 -0.91 -1.00 0.00 0.00 179.01 177.07 2g6h h ASN 664 N -0.04 -0.06 -0.77 1.42 2.35 -0.83 -1.72 115.58 115.93 2g6h h ASN 664 Ca 0.02 0.06 0.03 0.00 -0.55 0.00 0.00 56.30 55.86 2g6h h ASN 664 Cb 0.07 0.10 -0.05 0.00 0.05 0.00 0.00 38.32 38.49 2g6h h ASN 664 CO -0.05 0.00 0.49 -0.33 -1.65 0.00 0.00 177.43 175.89 2g6h h GLU 665 N 0.12 0.94 -0.45 0.81 4.39 -0.29 0.15 114.58 120.25 2g6h h GLU 665 Ca 0.14 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.76 2g6h h GLU 665 Cb 0.17 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2g6h h GLU 665 CO -0.21 0.62 0.21 1.88 -1.16 0.00 0.00 179.01 180.35 2g6h h TYR 666 N 0.97 0.65 0.01 4.33 -1.99 0.13 0.13 116.97 121.20 2g6h h TYR 666 Ca 0.30 -0.03 -0.20 0.00 2.00 0.00 0.00 58.73 60.79 2g6h h TYR 666 Cb -0.01 -0.20 -0.01 0.00 2.00 0.00 0.00 36.73 38.51 2g6h h TYR 666 CO -0.03 0.53 -0.91 0.07 -0.00 0.00 0.00 178.16 177.82 2g6h h ARG 667 N 0.58 0.21 0.00 4.88 0.11 -1.01 0.11 114.38 119.26 2g6h h ARG 667 Ca 0.15 -0.24 0.00 0.00 0.10 0.00 0.00 59.98 59.99 2g6h h ARG 667 Cb 0.13 0.07 0.00 0.00 1.11 0.00 0.00 29.97 31.28 2g6h h ARG 667 CO -0.02 0.98 -0.97 0.00 0.10 0.00 0.00 179.97 180.06 2g6h n ARG 669 N -2.14 1.65 -0.81 0.00 0.63 0.40 -5.03 116.66 111.35 2g6h n ARG 669 Ca 0.02 -0.02 0.00 0.00 -0.92 0.00 0.00 57.85 56.92 2g6h n ARG 669 Cb 0.46 -0.22 0.00 0.00 0.45 0.00 0.00 32.46 33.15 2g6h n ARG 669 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2g6h n GLY 670 N 0.24 0.51 0.00 5.14 0.00 0.38 -4.47 105.19 106.99 2g6h n GLY 670 Ca 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2g6h n GLY 670 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g6h n GLY 671 N -2.81 0.81 3.09 -0.02 0.00 -1.13 -0.43 105.19 104.70 2g6h n GLY 671 Ca 0.00 -1.49 0.01 0.00 0.00 0.00 0.00 46.02 44.54 2g6h n GLY 671 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g6h s PRO 673 N 2.78 4.17 -0.12 0.00 0.04 -1.26 -4.66 135.00 135.95 2g6h s PRO 673 Ca 0.16 2.49 -0.09 0.00 0.04 0.00 0.00 61.00 63.59 2g6h s PRO 673 Cb -0.13 -3.10 0.04 0.00 0.04 0.00 0.00 34.50 31.34 2g6h s PRO 673 CO -0.23 -0.66 0.30 0.00 0.04 0.00 0.00 177.00 176.45 2g6h s ALA 674 N 0.91 -0.73 -0.51 8.56 0.00 -0.07 -4.19 121.76 125.73 2g6h s ALA 674 Ca 0.70 0.94 -0.15 0.00 0.00 0.00 0.00 51.96 53.46 2g6h s ALA 674 Cb -0.47 -0.56 0.11 0.00 0.00 0.00 0.00 23.12 22.20 2g6h s ALA 674 CO 0.35 -0.16 0.44 0.34 0.00 0.00 0.00 175.76 176.73 2g6h s ASP 675 N 0.51 6.09 0.25 0.00 3.68 0.42 -3.22 116.67 124.40 2g6h s ASP 675 Ca -0.03 -1.68 -0.03 0.00 2.13 0.00 0.00 52.55 52.94 2g6h s ASP 675 Cb -0.04 -2.17 0.49 0.00 -1.45 0.00 0.00 42.92 39.75 2g6h s ASP 675 CO -0.03 -0.77 1.74 -0.25 0.13 0.00 0.00 175.17 175.99 2g6h h TRP 676 N 8.78 0.62 -0.60 -5.34 7.01 -1.90 -0.13 115.95 124.38 2g6h h TRP 676 Ca -0.28 0.04 0.12 0.00 2.11 0.00 0.00 58.89 60.87 2g6h h TRP 676 Cb 1.10 -0.15 -0.04 0.00 -2.10 0.00 0.00 29.16 27.97 2g6h h TRP 676 CO 0.69 0.11 0.41 0.28 -2.79 0.00 0.00 178.44 177.14 2g6h h VAL 677 N 0.52 0.85 0.01 2.65 2.07 -1.93 -2.16 116.25 118.25 2g6h h VAL 677 Ca 0.43 -0.11 -0.34 0.00 0.82 0.00 0.00 66.70 67.51 2g6h h VAL 677 Cb 0.64 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 2g6h h VAL 677 CO -0.38 0.06 -2.07 0.79 0.02 0.00 0.00 177.57 175.98 2g6h n TRP 678 N -4.46 0.50 -0.12 1.57 7.02 -0.64 -4.49 117.44 116.83 2g6h n TRP 678 Ca 0.10 0.17 -0.12 0.00 -1.02 0.00 0.00 57.50 56.64 2g6h n TRP 678 Cb 0.44 -1.09 -0.02 0.00 -2.42 0.00 0.00 31.31 28.21 2g6h n TRP 678 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 2g6h h ILE 679 N 0.00 1.28 -2.82 -0.99 1.08 -0.66 -3.42 117.51 111.98 2g6h h ILE 679 Ca -0.43 -1.35 -0.54 0.00 -0.39 0.00 0.00 64.86 62.15 2g6h h ILE 679 Cb 2.12 1.36 0.00 0.00 -3.07 0.00 0.00 36.82 37.23 2g6h h ILE 679 CO 0.05 0.45 0.91 -0.69 -0.69 0.00 0.00 178.15 178.17 2g6h s VAL 680 N -4.57 3.58 0.81 1.67 1.01 -0.85 -4.94 120.40 117.10 2g6h s VAL 680 Ca -0.12 0.93 -0.14 0.00 0.00 0.00 0.00 61.98 62.65 2g6h s VAL 680 Cb 0.10 -3.60 0.05 0.00 0.00 0.00 0.00 36.38 32.93 2g6h s VAL 680 CO 0.84 -0.02 0.99 -2.65 0.00 0.00 0.00 175.10 174.26 2g6h n PRO 681 N 5.71 0.16 0.00 2.72 -0.02 -1.26 -4.90 135.00 137.41 2g6h n PRO 681 Ca 0.14 0.12 0.10 0.00 -2.02 0.00 0.00 63.50 61.84 2g6h n PRO 681 Cb 0.43 -2.26 0.58 0.00 -0.02 0.00 0.00 33.50 32.22 2g6h n PRO 681 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2g6h n PRO 682 N -2.62 0.59 -4.03 0.52 -0.04 -1.26 -4.36 135.00 123.80 2g6h n PRO 682 Ca 0.12 0.01 -0.08 0.00 -0.04 0.00 0.00 63.50 63.51 2g6h n PRO 682 Cb 0.51 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.36 2g6h n PRO 682 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g6h s MET 683 N -2.05 0.53 -1.23 0.54 0.23 -1.26 -4.89 119.30 111.17 2g6h s MET 683 Ca 0.29 -0.98 -0.11 0.00 -1.03 0.00 0.00 55.69 53.86 2g6h s MET 683 Cb 0.13 0.19 0.09 0.00 -1.53 0.00 0.00 34.83 33.71 2g6h s MET 683 CO 0.23 -0.10 0.45 0.43 -2.03 0.00 0.00 175.02 174.00 2g6h n SER 684 N 0.62 -3.09 -0.22 -1.18 7.64 -1.26 -4.88 113.62 111.25 2g6h n SER 684 Ca -0.18 -0.42 -0.06 0.00 1.01 0.00 0.00 58.87 59.22 2g6h n SER 684 Cb 0.59 -2.59 -0.05 0.00 -1.01 0.00 0.00 64.21 61.15 2g6h n SER 684 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2g6h n GLY 685 N -1.07 -2.65 0.00 0.23 0.00 -1.26 -1.75 105.19 98.69 2g6h n GLY 685 Ca 0.01 0.87 0.07 0.00 0.00 0.00 0.00 46.02 46.97 2g6h n GLY 685 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2g6h n SER 686 N -4.21 0.00 -0.94 1.61 3.41 -1.26 -1.67 113.62 110.56 2g6h n SER 686 Ca 0.01 0.29 0.10 0.00 -0.26 0.00 0.00 58.87 59.02 2g6h n SER 686 Cb 0.14 -0.40 0.27 0.00 -0.26 0.00 0.00 64.21 63.96 2g6h n SER 686 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2g6h n ILE 687 N -1.40 0.51 -4.05 -1.33 -5.35 -0.72 -4.81 119.36 102.22 2g6h n ILE 687 Ca 0.05 -0.63 -0.31 0.00 -0.27 0.00 0.00 62.75 61.59 2g6h n ILE 687 Cb 0.15 0.59 -0.06 0.00 -1.74 0.00 0.00 39.64 38.57 2g6h n ILE 687 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2g6h s THR 688 N -1.49 4.67 0.41 7.28 -4.23 -0.67 -5.03 115.64 116.57 2g6h s THR 688 Ca 0.36 -0.64 0.14 0.00 -1.18 0.00 0.00 61.69 60.37 2g6h s THR 688 Cb 0.20 -3.23 0.14 0.00 1.34 0.00 0.00 72.50 70.95 2g6h s THR 688 CO 0.28 0.18 1.91 1.55 -0.54 0.00 0.00 174.62 178.00 2g6h h PRO 689 N 3.47 0.00 0.00 3.99 0.13 -1.87 -3.11 132.00 134.60 2g6h h PRO 689 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 2g6h h PRO 689 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 2g6h h PRO 689 CO 0.66 0.27 -0.07 -0.39 -0.23 0.00 0.00 178.00 178.25 2g6h h VAL 690 N 0.00 0.62 -0.70 1.56 -1.51 -1.88 -2.31 116.25 112.02 2g6h h VAL 690 Ca -0.00 -0.28 0.02 0.00 -1.23 0.00 0.00 66.70 65.21 2g6h h VAL 690 Cb 0.48 1.17 -0.04 0.00 -2.13 0.00 0.00 31.29 30.78 2g6h h VAL 690 CO 0.04 0.06 0.46 0.15 -1.23 0.00 0.00 177.57 177.05 2g6h h PHE 691 N 0.00 0.85 -0.19 5.19 3.57 -1.73 -1.98 116.94 122.64 2g6h h PHE 691 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 2g6h h PHE 691 Cb 0.17 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 38.62 2g6h h PHE 691 CO 0.00 0.51 0.00 0.72 -2.23 0.00 0.00 178.31 177.31 2g6h n HIS 692 N -4.44 0.24 -3.57 0.41 8.25 -0.87 -4.85 115.22 110.38 2g6h n HIS 692 Ca 0.08 -0.12 -0.39 0.00 -0.26 0.00 0.00 57.72 57.03 2g6h n HIS 692 Cb 0.08 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.08 2g6h n HIS 692 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2g6h s GLN 693 N -1.76 3.57 0.33 -0.41 2.00 -0.75 -0.54 119.66 122.10 2g6h s GLN 693 Ca 0.33 -0.58 -0.29 0.00 -2.00 0.00 0.00 55.36 52.82 2g6h s GLN 693 Cb 0.18 -3.72 -0.10 0.00 0.80 0.00 0.00 33.01 30.17 2g6h s GLN 693 CO 0.27 -0.37 1.29 -1.21 -0.50 0.00 0.00 175.29 174.76 2g6h s GLU 694 N 1.71 4.36 0.06 1.67 2.02 -0.58 -4.99 118.70 122.94 2g6h s GLU 694 Ca 0.06 2.18 0.03 0.00 0.02 0.00 0.00 54.97 57.26 2g6h s GLU 694 Cb -0.17 -3.06 -0.03 0.00 0.10 0.00 0.00 34.13 30.97 2g6h s GLU 694 CO 0.10 -0.17 -0.10 -1.64 0.02 0.00 0.00 175.26 173.46 2g6h s MET 695 N -1.80 0.65 -0.14 1.61 -1.94 -1.26 -4.64 119.30 111.78 2g6h s MET 695 Ca 0.49 -0.85 0.00 0.00 -1.71 0.00 0.00 55.69 53.62 2g6h s MET 695 Cb -0.39 -0.49 -0.01 0.00 2.01 0.00 0.00 34.83 35.95 2g6h s MET 695 CO 0.52 0.10 -0.14 -0.51 -0.01 0.00 0.00 175.02 174.98 2g6h s LEU 696 N -1.69 2.60 -0.16 -0.03 1.43 -1.26 -4.90 118.68 114.67 2g6h s LEU 696 Ca -0.06 -0.40 -0.06 0.00 -1.03 0.00 0.00 54.13 52.58 2g6h s LEU 696 Cb -0.09 -1.59 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 2g6h s LEU 696 CO 0.01 0.12 0.04 0.21 0.23 0.00 0.00 176.35 176.96 2g6h s ASN 697 N 0.59 5.45 0.09 2.29 3.04 -1.20 -0.89 114.94 124.32 2g6h s ASN 697 Ca -0.08 0.07 -0.26 0.00 0.04 0.00 0.00 52.86 52.63 2g6h s ASN 697 Cb -0.16 -1.87 0.07 0.00 -1.54 0.00 0.00 41.25 37.75 2g6h s ASN 697 CO 0.03 0.21 0.64 -0.72 -3.04 0.00 0.00 177.10 174.22 2g6h s TYR 698 N 0.15 -0.57 -0.33 0.43 -0.85 -1.26 -4.95 117.35 109.97 2g6h s TYR 698 Ca 0.03 0.56 -0.12 0.00 -0.52 0.00 0.00 57.07 57.02 2g6h s TYR 698 Cb -0.13 0.52 -0.02 0.00 0.38 0.00 0.00 41.96 42.71 2g6h s TYR 698 CO 0.01 -0.77 0.23 1.03 -1.52 0.00 0.00 175.55 174.53 2g6h s ARG 699 N -2.97 3.56 0.09 -3.49 0.52 -1.26 -4.81 118.95 110.60 2g6h s ARG 699 Ca -0.02 -0.60 0.05 0.00 -0.52 0.00 0.00 55.73 54.64 2g6h s ARG 699 Cb -0.01 -3.77 -0.04 0.00 0.52 0.00 0.00 34.95 31.65 2g6h s ARG 699 CO -0.06 -0.40 -0.03 -0.51 0.02 0.00 0.00 175.30 174.32 2g6h s LEU 700 N 1.72 3.33 0.14 2.53 1.43 -1.26 -2.61 118.68 123.96 2g6h s LEU 700 Ca 0.06 -0.23 0.10 0.00 -1.03 0.00 0.00 54.13 53.03 2g6h s LEU 700 Cb -0.17 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 2g6h s LEU 700 CO 0.10 0.18 -0.21 0.28 0.23 0.00 0.00 176.35 176.93 2g6h s THR 701 N -1.27 2.60 0.68 5.49 -1.32 -1.26 -4.26 115.64 116.30 2g6h s THR 701 Ca 0.24 -1.68 -0.17 0.00 -1.21 0.00 0.00 61.69 58.87 2g6h s THR 701 Cb -0.11 -2.20 -0.02 0.00 -1.51 0.00 0.00 72.50 68.66 2g6h s THR 701 CO 0.16 0.05 0.90 -2.65 -2.21 0.00 0.00 174.62 170.88 2g6h n PRO 702 N 0.70 0.61 -3.90 7.08 -0.02 -1.26 -5.02 135.00 133.18 2g6h n PRO 702 Ca -0.16 0.26 -0.09 0.00 -2.02 0.00 0.00 63.50 61.49 2g6h n PRO 702 Cb 0.53 -2.15 -0.05 0.00 -0.02 0.00 0.00 33.50 31.82 2g6h n PRO 702 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2g6h s SER 703 N -1.48 -0.15 -0.14 2.55 1.04 -0.90 -4.00 113.70 110.62 2g6h s SER 703 Ca 0.73 -0.75 -0.04 0.00 0.48 0.00 0.00 55.95 56.38 2g6h s SER 703 Cb -0.37 0.59 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 2g6h s SER 703 CO 0.50 -1.12 -0.01 -0.36 0.98 0.00 0.00 173.24 173.23 2g6h s PHE 704 N -3.96 3.10 0.21 5.02 0.40 -1.26 -1.28 117.98 120.21 2g6h s PHE 704 Ca 0.17 -0.10 0.08 0.00 -0.60 0.00 0.00 56.93 56.48 2g6h s PHE 704 Cb -0.01 -1.93 -0.05 0.00 0.51 0.00 0.00 43.02 41.54 2g6h s PHE 704 CO 0.04 0.14 -0.15 -1.21 0.70 0.00 0.00 175.22 174.74 2g6h s GLU 705 N 0.02 1.37 0.64 0.44 0.41 0.12 -4.93 118.70 116.77 2g6h s GLU 705 Ca 0.02 -1.61 -0.10 0.00 -0.41 0.00 0.00 54.97 52.87 2g6h s GLU 705 Cb -0.13 -1.20 -0.01 0.00 -1.78 0.00 0.00 34.13 31.01 2g6h s GLU 705 CO 0.02 0.20 1.01 0.71 -0.49 0.00 0.00 175.26 176.72 2g6h s TYR 706 N -2.92 3.42 -0.01 1.61 1.51 -1.26 -0.67 117.35 119.04 2g6h s TYR 706 Ca 0.23 1.02 -0.22 0.00 -1.01 0.00 0.00 57.07 57.09 2g6h s TYR 706 Cb -0.01 -2.83 0.05 0.00 -0.11 0.00 0.00 41.96 39.05 2g6h s TYR 706 CO 0.08 -0.88 0.48 1.14 -1.11 0.00 0.00 175.55 175.26 2g6h s GLN 707 N -5.18 0.88 0.41 -0.62 -2.07 -1.26 -4.72 119.66 107.10 2g6h s GLN 707 Ca 0.55 -0.05 -0.24 0.00 -1.82 0.00 0.00 55.36 53.80 2g6h s GLN 707 Cb -0.11 0.40 -0.11 0.00 -1.09 0.00 0.00 33.01 32.11 2g6h s GLN 707 CO 0.50 -0.27 1.02 -2.30 -1.32 0.00 0.00 175.29 172.92 2g6h n PRO 708 N 0.96 1.37 -1.88 9.60 -0.02 -1.26 -4.87 135.00 138.89 2g6h n PRO 708 Ca -0.20 0.49 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 2g6h n PRO 708 Cb 0.57 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.98 2g6h n PRO 708 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2g6h s ASP 709 N -0.72 6.56 0.31 2.55 1.01 -1.26 -4.87 116.67 120.24 2g6h s ASP 709 Ca 0.63 2.59 0.06 0.00 0.71 0.00 0.00 52.55 56.53 2g6h s ASP 709 Cb -0.56 -2.57 0.83 0.00 1.01 0.00 0.00 42.92 41.62 2g6h s ASP 709 CO 0.57 -0.89 1.64 1.55 0.21 0.00 0.00 175.17 178.24 2g6h h PRO 710 N 7.88 0.19 0.00 8.23 0.13 -1.92 -0.28 132.00 146.23 2g6h h PRO 710 Ca -0.43 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2g6h h PRO 710 Cb 1.20 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.29 2g6h h PRO 710 CO 0.93 0.13 0.00 -2.67 -0.23 0.00 0.00 178.00 176.16 2g6h n TRP 711 N -5.22 0.00 -0.70 1.56 2.14 -1.26 -0.34 117.44 113.62 2g6h n TRP 711 Ca 0.25 0.00 0.07 0.00 2.07 0.00 0.00 57.50 59.89 2g6h n TRP 711 Cb 0.79 0.00 0.16 0.00 -0.81 0.00 0.00 31.31 31.45 2g6h n TRP 711 CO 0.00 0.00 0.00 0.09 2.07 0.00 0.00 177.69 179.85 2g6h n ASN 712 N -0.92 2.93 0.00 -0.67 3.02 -0.12 -4.63 115.26 114.88 2g6h n ASN 712 Ca 0.02 -2.68 0.00 0.00 -0.03 0.00 0.00 54.58 51.89 2g6h n ASN 712 Cb 0.01 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 2g6h n ASN 712 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2g6h n THR 713 N -0.60 0.00 -1.86 3.41 -1.04 0.54 -5.00 114.28 109.73 2g6h n THR 713 Ca 0.14 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.74 2g6h n THR 713 Cb 0.62 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 69.11 2g6h n THR 713 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 2g6h s HIS 714 N -0.61 2.88 -0.85 -1.42 5.04 -0.01 -4.97 115.29 115.36 2g6h s HIS 714 Ca 0.00 0.79 -0.03 0.00 -1.54 0.00 0.00 55.06 54.27 2g6h s HIS 714 Cb 0.00 -3.99 0.21 0.00 0.04 0.00 0.00 32.58 28.84 2g6h s HIS 714 CO 0.00 -3.38 0.73 0.14 -2.34 0.00 0.00 174.74 169.89 2g6h s VAL 715 N 0.25 4.43 -0.59 0.89 -7.23 -1.26 -5.01 120.40 111.88 2g6h s VAL 715 Ca 0.64 -3.55 0.00 0.00 -1.81 0.00 0.00 61.98 57.26 2g6h s VAL 715 Cb -0.46 -3.76 0.00 0.00 0.56 0.00 0.00 36.38 32.72 2g6h s VAL 715 CO 0.43 -1.05 0.15 0.79 -0.31 0.00 0.00 175.10 175.11