#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 3.42 -0.03 -0.14 0.40 -1.26 -4.88 117.98 115.49 2g6h s PHE 300 Ca 0.00 1.40 0.00 0.00 -0.60 0.00 0.00 56.93 57.73 2g6h s PHE 300 Cb 0.00 -2.72 0.03 0.00 0.51 0.00 0.00 43.02 40.84 2g6h s PHE 300 CO 0.00 -0.23 0.01 -0.51 0.70 0.00 0.00 175.22 175.19 2g6h s LEU 301 N -3.76 1.04 -0.00 -0.37 1.43 -1.06 -4.97 118.68 110.99 2g6h s LEU 301 Ca 0.58 -0.00 0.01 0.00 -1.03 0.00 0.00 54.13 53.68 2g6h s LEU 301 Cb -0.10 -0.19 -0.04 0.00 0.03 0.00 0.00 46.19 45.90 2g6h s LEU 301 CO 0.26 -0.12 0.03 -0.54 0.23 0.00 0.00 176.35 176.21 2g6h s LYS 302 N 1.16 2.88 -0.02 1.70 1.02 -1.26 0.98 119.74 126.21 2g6h s LYS 302 Ca -0.08 -0.57 0.07 0.00 0.02 0.00 0.00 55.97 55.41 2g6h s LYS 302 Cb -0.13 -2.74 -0.02 0.00 -0.52 0.00 0.00 37.83 34.43 2g6h s LYS 302 CO -0.02 0.63 -0.22 0.14 -0.92 0.00 0.00 175.35 174.96 2g6h s VAL 303 N -1.13 1.73 0.07 3.17 -7.23 -0.07 -4.95 120.40 111.99 2g6h s VAL 303 Ca 0.21 -0.93 0.08 0.00 -1.81 0.00 0.00 61.98 59.52 2g6h s VAL 303 Cb -0.12 -1.44 -0.03 0.00 0.56 0.00 0.00 36.38 35.35 2g6h s VAL 303 CO 0.11 0.49 -0.20 -0.75 -0.31 0.00 0.00 175.10 174.45 2g6h s LYS 304 N -0.47 1.91 -0.41 4.82 2.20 -1.26 -0.58 119.74 125.96 2g6h s LYS 304 Ca 0.07 -1.08 -0.12 0.00 -0.36 0.00 0.00 55.97 54.48 2g6h s LYS 304 Cb -0.09 -2.12 0.04 0.00 -1.51 0.00 0.00 37.83 34.15 2g6h s LYS 304 CO -0.00 0.51 0.27 1.21 -0.36 0.00 0.00 175.35 176.98 2g6h s ASN 305 N -1.63 5.87 0.00 1.43 3.84 -0.44 -1.91 114.94 122.10 2g6h s ASN 305 Ca 0.15 -1.11 0.12 0.00 0.21 0.00 0.00 52.86 52.23 2g6h s ASN 305 Cb -0.10 -2.07 0.72 0.00 -0.55 0.00 0.00 41.25 39.24 2g6h s ASN 305 CO 0.06 -0.47 1.21 0.79 -2.79 0.00 0.00 177.10 175.90 2g6h n TRP 306 N 5.05 0.00 -0.09 0.43 7.02 -0.29 0.33 117.44 129.90 2g6h n TRP 306 Ca -0.11 0.00 -0.07 0.00 -1.02 0.00 0.00 57.50 56.29 2g6h n TRP 306 Cb 0.45 -0.07 -0.16 0.00 -2.42 0.00 0.00 31.31 29.12 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 -1.07 0.74 0.00 -0.99 2.13 -1.26 -4.56 120.64 115.63 2g6h n GLU 307 Ca 0.09 -0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.87 2g6h n GLU 307 Cb 0.06 -1.51 0.00 0.00 0.27 0.00 0.00 31.44 30.26 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 -2.67 0.00 -0.70 6.31 -2.24 -1.01 -5.00 114.28 108.97 2g6h n THR 308 Ca -0.29 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 2g6h n THR 308 Cb 1.07 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 70.31 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 -0.14 -2.08 -4.71 3.42 10.43 0.15 -4.93 116.55 118.69 2g6h n ASP 309 Ca 0.00 0.00 -0.42 0.00 2.57 0.00 0.00 54.79 56.94 2g6h n ASP 309 Cb 0.00 -2.66 -0.03 0.00 1.84 0.00 0.00 41.12 40.27 2g6h n ASP 309 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2g6h s VAL 310 N -1.17 2.97 -0.05 2.53 1.01 -1.24 -4.75 120.40 119.70 2g6h s VAL 310 Ca 0.00 0.68 0.04 0.00 0.00 0.00 0.00 61.98 62.70 2g6h s VAL 310 Cb 0.00 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.92 2g6h s VAL 310 CO 0.00 0.05 -0.14 -0.69 0.00 0.00 0.00 175.10 174.32 2g6h s VAL 311 N 1.23 3.07 0.12 2.92 1.01 -1.26 -1.33 120.40 126.16 2g6h s VAL 311 Ca 0.68 -0.73 0.08 0.00 0.00 0.00 0.00 61.98 62.01 2g6h s VAL 311 Cb -0.40 -2.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.74 2g6h s VAL 311 CO 0.31 0.59 -0.20 -0.76 0.00 0.00 0.00 175.10 175.03 2g6h s LEU 312 N -0.75 2.33 -0.13 3.92 1.43 0.26 -4.96 118.68 120.77 2g6h s LEU 312 Ca 0.12 -0.72 -0.00 0.00 -1.03 0.00 0.00 54.13 52.49 2g6h s LEU 312 Cb -0.11 -0.88 -0.01 0.00 0.03 0.00 0.00 46.19 45.22 2g6h s LEU 312 CO 0.01 0.04 -0.13 -0.89 0.23 0.00 0.00 176.35 175.61 2g6h s THR 313 N -1.34 3.06 -0.22 5.49 2.01 -1.26 -0.89 115.64 122.49 2g6h s THR 313 Ca 0.08 -0.66 -0.06 0.00 0.31 0.00 0.00 61.69 61.36 2g6h s THR 313 Cb -0.09 -2.29 -0.03 0.00 0.01 0.00 0.00 72.50 70.10 2g6h s THR 313 CO 0.05 0.52 0.04 -0.62 -0.69 0.00 0.00 174.62 173.92 2g6h s ASP 314 N 0.38 5.07 -0.01 3.53 -1.08 0.28 -4.65 116.67 120.19 2g6h s ASP 314 Ca -0.10 -0.17 0.02 0.00 -0.52 0.00 0.00 52.55 51.78 2g6h s ASP 314 Cb -0.16 -1.89 -0.04 0.00 -1.46 0.00 0.00 42.92 39.38 2g6h s ASP 314 CO 0.05 0.03 0.04 0.35 0.52 0.00 0.00 175.17 176.17 2g6h n THR 315 N 4.46 0.05 -0.12 1.71 -2.24 0.34 -2.56 114.28 115.92 2g6h n THR 315 Ca -0.17 -0.07 0.14 0.00 -2.27 0.00 0.00 64.05 61.69 2g6h n THR 315 Cb 0.52 0.06 0.52 0.00 -2.10 0.00 0.00 70.33 69.33 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 0.35 -2.45 3.22 5.85 -1.53 -0.88 115.31 119.86 2g6h h LEU 316 Ca -0.02 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.73 2g6h h LEU 316 Cb 0.40 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 2g6h h LEU 316 CO 0.00 0.19 0.17 1.12 -0.34 0.00 0.00 178.44 179.58 2g6h h HIS 317 N 0.38 0.00 -0.12 1.25 2.07 -1.83 -0.35 115.15 116.55 2g6h h HIS 317 Ca 0.32 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.82 2g6h h HIS 317 Cb 0.74 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.71 2g6h h HIS 317 CO -0.00 0.00 -0.05 -0.07 -3.07 0.00 0.00 177.93 174.74 2g6h h LEU 318 N 0.00 0.15 -0.32 6.12 3.38 -1.50 -0.59 115.31 122.55 2g6h h LEU 318 Ca 0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2g6h h LEU 318 Cb 0.36 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.07 2g6h h LEU 318 CO -0.00 0.23 0.00 0.29 0.09 0.00 0.00 178.44 179.05 2g6h n LYS 319 N -4.39 1.21 -2.45 1.13 4.76 -0.14 -4.83 118.16 113.46 2g6h n LYS 319 Ca -0.01 -0.32 -0.42 0.00 -2.87 0.00 0.00 58.31 54.69 2g6h n LYS 319 Cb 0.18 -1.39 -0.03 0.00 -1.84 0.00 0.00 35.03 31.95 2g6h n LYS 319 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2g6h s SER 320 N -1.75 7.08 -0.15 4.39 0.15 -0.23 -4.92 113.70 118.27 2g6h s SER 320 Ca 0.35 1.92 -0.07 0.00 0.70 0.00 0.00 55.95 58.86 2g6h s SER 320 Cb 0.17 -2.57 -0.07 0.00 -1.71 0.00 0.00 66.02 61.85 2g6h s SER 320 CO 0.28 -0.51 -0.18 0.35 1.20 0.00 0.00 173.24 174.38 2g6h n THR 321 N 4.20 0.80 -0.68 6.45 -2.24 -1.24 -5.04 114.28 116.53 2g6h n THR 321 Ca 0.10 -0.21 -0.31 0.00 -2.27 0.00 0.00 64.05 61.35 2g6h n THR 321 Cb 0.46 -1.64 0.17 0.00 -2.10 0.00 0.00 70.33 67.22 2g6h n THR 321 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2g6h n LEU 322 N -3.60 1.71 -4.93 3.22 4.77 -1.25 -5.02 117.00 111.90 2g6h n LEU 322 Ca -0.29 0.32 -0.25 0.00 -0.03 0.00 0.00 56.01 55.76 2g6h n LEU 322 Cb 0.71 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 2g6h n LEU 322 CO 0.03 -2.70 0.35 -1.61 -1.33 0.00 0.00 177.39 172.12 2g6h s GLU 323 N -4.31 3.30 -0.19 3.23 2.02 -1.26 -4.65 118.70 116.84 2g6h s GLU 323 Ca 0.64 -0.16 0.16 0.00 0.02 0.00 0.00 54.97 55.63 2g6h s GLU 323 Cb -0.22 -2.48 -0.22 0.00 0.10 0.00 0.00 34.13 31.30 2g6h s GLU 323 CO 0.62 -0.21 0.05 0.25 0.02 0.00 0.00 175.26 175.98 2g6h n THR 324 N -2.14 1.28 0.00 3.63 -2.24 -1.26 -4.81 114.28 108.73 2g6h n THR 324 Ca 0.00 -0.77 0.00 0.00 -2.27 0.00 0.00 64.05 61.01 2g6h n THR 324 Cb 0.56 -0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 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 1.89 1.89 3.95 3.38 0.00 -1.26 -4.89 105.19 110.14 2g6h n GLY 325 Ca -0.31 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.48 2g6h n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g6h n THR 327 N -2.02 0.00 0.49 0.00 -2.24 -0.12 -4.98 114.28 105.41 2g6h n THR 327 Ca 0.00 -2.21 0.13 0.00 -2.27 0.00 0.00 64.05 59.69 2g6h n THR 327 Cb 0.57 1.01 0.46 0.00 -2.10 0.00 0.00 70.33 70.27 2g6h n THR 327 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2g6h n GLU 328 N -0.67 0.23 -0.01 -0.78 4.71 -1.26 -3.16 120.64 119.71 2g6h n GLU 328 Ca 0.03 0.34 0.09 0.00 -0.01 0.00 0.00 57.16 57.61 2g6h n GLU 328 Cb 0.56 -1.85 -0.13 0.00 -1.01 0.00 0.00 31.44 29.00 2g6h n GLU 328 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 2g6h n HIS 329 N -2.27 0.00 -3.72 -0.32 8.25 -1.26 -5.00 115.22 110.90 2g6h n HIS 329 Ca 0.04 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.37 2g6h n HIS 329 Cb 0.32 -0.32 -0.10 0.00 1.12 0.00 0.00 29.99 31.02 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 -3.12 -0.00 -0.21 1.59 2.07 -1.19 -5.14 121.20 115.19 2g6h s ILE 330 Ca -0.03 0.02 -0.09 0.00 -1.41 0.00 0.00 60.65 59.13 2g6h s ILE 330 Cb 0.12 -0.61 -0.04 0.00 0.13 0.00 0.00 42.46 42.06 2g6h s ILE 330 CO 0.75 0.01 0.10 0.00 -1.91 0.00 0.00 174.94 173.89 2g6h n MET 332 N 3.92 2.34 -0.17 0.00 0.00 -1.26 -4.78 117.12 117.17 2g6h n MET 332 Ca -0.16 -3.01 0.29 0.00 0.00 0.00 0.00 57.70 54.82 2g6h n MET 332 Cb 0.52 -1.84 0.72 0.00 0.00 0.00 0.00 33.22 32.62 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 1.34 0.00 -2.30 3.03 0.00 -1.94 -0.69 103.07 102.52 2g6h h GLY 333 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.47 2g6h h GLY 333 CO 0.34 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.74 2g6h n SER 334 N -4.09 3.87 -4.70 0.19 3.41 -1.26 -4.84 113.62 106.21 2g6h n SER 334 Ca 0.19 -2.19 -0.41 0.00 -0.26 0.00 0.00 58.87 56.19 2g6h n SER 334 Cb 1.01 -0.44 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 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 -1.36 4.92 0.11 -1.33 -1.09 -0.27 -4.97 121.20 117.21 2g6h s ILE 335 Ca 0.42 1.75 -0.26 0.00 -2.23 0.00 0.00 60.65 60.32 2g6h s ILE 335 Cb 0.24 -4.18 -0.08 0.00 -1.58 0.00 0.00 42.46 36.86 2g6h s ILE 335 CO 0.24 0.14 1.65 -0.03 -1.23 0.00 0.00 174.94 175.70 2g6h h MET 336 N 6.96 -0.40 -2.90 2.79 4.05 -1.92 -3.37 114.93 120.15 2g6h h MET 336 Ca -0.37 0.03 -0.61 0.00 -0.28 0.00 0.00 59.70 58.47 2g6h h MET 336 Cb 1.18 0.09 -0.40 0.00 -0.80 0.00 0.00 31.60 31.67 2g6h h MET 336 CO 0.79 -0.26 -0.74 -0.51 0.23 0.00 0.00 176.91 176.41 2g6h s LEU 337 N -10.30 2.96 0.50 3.39 1.43 -1.26 -5.16 118.68 110.23 2g6h s LEU 337 Ca -0.15 -2.99 0.18 0.00 -1.03 0.00 0.00 54.13 50.14 2g6h s LEU 337 Cb 0.08 -1.07 1.26 0.00 0.03 0.00 0.00 46.19 46.49 2g6h s LEU 337 CO 0.66 -0.21 2.10 -0.65 0.23 0.00 0.00 176.35 178.48 2g6h h PRO 338 N 6.23 0.00 -6.02 1.29 0.11 -1.91 -3.54 132.00 128.17 2g6h h PRO 338 Ca 0.07 0.00 -0.79 0.00 0.11 0.00 0.00 66.00 65.39 2g6h h PRO 338 Cb 0.89 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.98 2g6h h PRO 338 CO 0.52 0.08 1.08 1.55 -0.21 0.00 0.00 178.00 181.01 2g6h n VAL 348 N -4.30 0.06 -1.74 3.15 3.14 -1.26 -4.93 118.33 112.44 2g6h n VAL 348 Ca -0.03 -0.03 -0.30 0.00 -2.96 0.00 0.00 64.34 61.02 2g6h n VAL 348 Cb 0.16 -0.71 0.06 0.00 -1.06 0.00 0.00 33.84 32.28 2g6h n VAL 348 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 2g6h s ARG 349 N 4.75 2.65 0.08 1.45 0.52 -1.26 -5.08 118.95 122.06 2g6h s ARG 349 Ca 1.11 0.58 0.04 0.00 -0.52 0.00 0.00 55.73 56.94 2g6h s ARG 349 Cb -1.38 -1.99 -0.04 0.00 0.52 0.00 0.00 34.95 32.06 2g6h s ARG 349 CO 0.69 -1.21 0.04 0.99 0.02 0.00 0.00 175.30 175.83 2g6h s THR 350 N -3.25 4.26 0.28 0.02 2.01 -1.26 -4.98 115.64 112.72 2g6h s THR 350 Ca 0.59 -0.87 0.02 0.00 0.31 0.00 0.00 61.69 61.74 2g6h s THR 350 Cb -0.12 -3.03 0.27 0.00 0.01 0.00 0.00 72.50 69.62 2g6h s THR 350 CO 0.53 0.14 1.72 0.11 -0.69 0.00 0.00 174.62 176.43 2g6h h LYS 351 N 3.42 0.46 -0.44 4.92 1.57 -1.94 0.47 116.57 125.03 2g6h h LYS 351 Ca -0.47 -0.03 0.09 0.00 -1.87 0.00 0.00 60.65 58.37 2g6h h LYS 351 Cb 1.16 -0.10 -0.09 0.00 0.08 0.00 0.00 32.23 33.28 2g6h h LYS 351 CO 0.62 0.31 -0.23 0.22 -0.57 0.00 0.00 179.45 179.80 2g6h h ASP 352 N 0.47 -0.78 1.03 0.86 3.58 -1.97 -2.23 116.42 117.38 2g6h h ASP 352 Ca 0.53 0.17 0.00 0.00 0.42 0.00 0.00 57.03 58.15 2g6h h ASP 352 Cb 0.92 0.41 0.00 0.00 1.72 0.00 0.00 39.33 42.38 2g6h h ASP 352 CO -0.47 -0.25 -0.56 0.06 -2.88 0.00 0.00 179.24 175.14 2g6h h GLN 353 N -0.14 0.00 0.23 0.28 3.07 -1.33 -3.41 115.11 113.81 2g6h h GLN 353 Ca 0.21 0.00 -0.01 0.00 0.09 0.00 0.00 58.65 58.94 2g6h h GLN 353 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.03 2g6h h GLN 353 CO -0.52 0.00 -0.11 1.25 0.09 0.00 0.00 178.83 179.54 2g6h h LEU 354 N 0.00 -0.26 -0.72 0.06 5.85 0.45 -3.30 115.31 117.40 2g6h h LEU 354 Ca 0.00 -0.26 0.11 0.00 0.84 0.00 0.00 57.88 58.58 2g6h h LEU 354 Cb 0.80 0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.81 2g6h h LEU 354 CO 0.00 0.25 0.32 0.15 -0.34 0.00 0.00 178.44 178.82 2g6h h PHE 355 N -0.90 0.56 -0.79 1.25 3.57 -1.76 0.38 116.94 119.25 2g6h h PHE 355 Ca -0.03 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.56 2g6h h PHE 355 Cb 0.50 -0.14 -0.06 0.00 2.79 0.00 0.00 35.95 39.04 2g6h h PHE 355 CO 0.06 0.15 0.48 -1.00 -2.23 0.00 0.00 178.31 175.77 2g6h h PRO 356 N 0.52 0.85 -0.75 6.41 0.13 -1.81 0.51 132.00 137.86 2g6h h PRO 356 Ca 0.37 -0.05 -0.06 0.00 -0.87 0.00 0.00 66.00 65.40 2g6h h PRO 356 Cb 0.48 -0.19 -0.03 0.00 0.13 0.00 0.00 31.00 31.38 2g6h h PRO 356 CO -0.33 0.56 0.25 -0.07 -0.23 0.00 0.00 178.00 178.19 2g6h h LEU 357 N 0.88 1.08 -0.32 1.56 3.38 -1.35 -1.24 115.31 119.30 2g6h h LEU 357 Ca 0.35 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2g6h h LEU 357 Cb 0.17 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2g6h h LEU 357 CO -0.17 0.99 0.08 0.00 0.09 0.00 0.00 178.44 179.43 2g6h h ALA 358 N 1.13 0.42 -0.53 1.53 0.00 0.38 -2.33 119.26 119.86 2g6h h ALA 358 Ca 0.25 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2g6h h ALA 358 Cb 0.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2g6h h ALA 358 CO -0.01 0.08 0.27 -0.22 0.00 0.00 0.00 179.25 179.37 2g6h h LYS 359 N 0.36 0.76 -0.52 0.00 3.64 0.28 0.61 116.57 121.70 2g6h h LYS 359 Ca 0.10 -0.10 0.04 0.00 -1.27 0.00 0.00 60.65 59.42 2g6h h LYS 359 Cb 0.28 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 2g6h h LYS 359 CO 0.00 0.61 0.28 0.93 -2.27 0.00 0.00 179.45 179.00 2g6h h GLU 360 N 0.71 0.53 0.43 1.90 5.08 -1.16 0.27 114.58 122.34 2g6h h GLU 360 Ca 0.19 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2g6h h GLU 360 Cb 0.09 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2g6h h GLU 360 CO -0.03 0.35 -0.20 0.35 -1.00 0.00 0.00 179.01 178.48 2g6h h PHE 361 N 0.55 -0.53 -0.67 4.33 3.57 -0.98 -1.32 116.94 121.90 2g6h h PHE 361 Ca 0.22 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.77 2g6h h PHE 361 Cb 0.09 0.18 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 2g6h h PHE 361 CO -0.09 -0.27 0.44 -0.07 -2.23 0.00 0.00 178.31 176.09 2g6h h LEU 362 N -0.68 0.60 -0.48 0.59 3.38 -0.61 0.21 115.31 118.32 2g6h h LEU 362 Ca -0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2g6h h LEU 362 Cb 0.50 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.10 2g6h h LEU 362 CO 0.10 0.39 0.18 0.44 0.09 0.00 0.00 178.44 179.64 2g6h h ASP 363 N 0.68 0.67 -0.46 -0.43 3.45 -0.24 0.80 116.42 120.90 2g6h h ASP 363 Ca 0.29 -0.18 -0.08 0.00 0.43 0.00 0.00 57.03 57.49 2g6h h ASP 363 Cb 0.25 -0.17 -0.02 0.00 -0.56 0.00 0.00 39.33 38.83 2g6h h ASP 363 CO -0.09 0.67 -0.02 1.56 -1.57 0.00 0.00 179.24 179.79 2g6h h GLN 364 N 0.64 0.82 0.12 3.56 4.20 -0.01 -1.69 115.11 122.74 2g6h h GLN 364 Ca 0.16 -0.27 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 2g6h h GLN 364 Cb 0.21 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.92 2g6h h GLN 364 CO -0.01 0.88 -0.06 -0.92 -0.67 0.00 0.00 178.83 178.05 2g6h h TYR 365 N 0.66 -0.15 -0.19 2.96 3.20 -0.38 -0.75 116.97 122.32 2g6h h TYR 365 Ca 0.13 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 2g6h h TYR 365 Cb 0.52 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.83 2g6h h TYR 365 CO 0.04 -0.08 -0.12 1.88 -1.64 0.00 0.00 178.16 178.24 2g6h h TYR 366 N -0.18 0.32 -0.46 -3.82 -1.99 -0.79 -1.93 116.97 108.13 2g6h h TYR 366 Ca -0.02 -0.04 -0.06 0.00 2.00 0.00 0.00 58.73 60.61 2g6h h TYR 366 Cb 0.14 -0.09 -0.02 0.00 2.00 0.00 0.00 36.73 38.76 2g6h h TYR 366 CO -0.07 0.42 0.04 0.77 -0.00 0.00 0.00 178.16 179.33 2g6h h SER 367 N 0.29 0.75 -0.33 3.88 0.02 -1.07 -0.24 113.55 116.86 2g6h h SER 367 Ca 0.06 -0.28 0.03 0.00 -0.84 0.00 0.00 61.79 60.75 2g6h h SER 367 Cb 0.39 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 2g6h h SER 367 CO 0.02 0.85 0.22 0.77 -1.14 0.00 0.00 176.83 177.55 2g6h h SER 368 N 0.63 0.28 -0.59 3.07 4.64 -0.37 -0.76 113.55 120.46 2g6h h SER 368 Ca 0.13 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 2g6h h SER 368 Cb 0.44 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 2g6h h SER 368 CO 0.02 0.20 0.00 2.30 -0.87 0.00 0.00 176.83 178.47 2g6h n ILE 369 N -4.49 0.89 -3.51 0.95 -5.35 -0.94 -4.96 119.36 101.95 2g6h n ILE 369 Ca 0.03 -0.81 -0.20 0.00 -0.27 0.00 0.00 62.75 61.49 2g6h n ILE 369 Cb 0.15 0.35 0.08 0.00 -1.74 0.00 0.00 39.64 38.49 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 1.19 -7.03 -1.34 6.28 4.76 -0.29 -4.91 118.16 116.81 2g6h n LYS 370 Ca 0.20 0.83 0.04 0.00 -2.87 0.00 0.00 58.31 56.51 2g6h n LYS 370 Cb 0.53 -5.85 0.02 0.00 -1.84 0.00 0.00 35.03 27.90 2g6h n LYS 370 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2g6h n ARG 371 N -4.46 0.05 -1.97 1.97 5.12 -0.14 -5.03 116.66 112.20 2g6h n ARG 371 Ca -0.18 -1.91 -0.42 0.00 -1.93 0.00 0.00 57.85 53.41 2g6h n ARG 371 Cb 0.63 -0.12 -0.03 0.00 -1.16 0.00 0.00 32.46 31.79 2g6h n ARG 371 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2g6h s PHE 372 N -0.10 3.03 0.00 -1.55 5.36 -1.16 -1.91 117.98 121.64 2g6h s PHE 372 Ca 0.30 0.84 0.00 0.00 -0.96 0.00 0.00 56.93 57.10 2g6h s PHE 372 Cb 0.34 -3.87 0.00 0.00 -0.34 0.00 0.00 43.02 39.15 2g6h s PHE 372 CO -0.15 -3.03 0.00 0.41 -1.46 0.00 0.00 175.22 170.99 2g6h n GLY 373 N 2.93 1.41 3.54 13.12 0.00 -1.26 -5.01 105.19 119.92 2g6h n GLY 373 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.16 0.97 0.19 1.61 1.04 -0.80 -4.78 113.70 108.77 2g6h s SER 374 Ca 0.00 0.94 -0.03 0.00 0.48 0.00 0.00 55.95 57.34 2g6h s SER 374 Cb 0.00 -1.41 0.12 0.00 0.10 0.00 0.00 66.02 64.84 2g6h s SER 374 CO 0.00 -4.13 1.51 0.50 0.98 0.00 0.00 173.24 172.10 2g6h h LYS 375 N -2.58 0.56 -0.77 4.02 3.64 -1.95 -1.90 116.57 117.59 2g6h h LYS 375 Ca -0.50 -0.34 -0.02 0.00 -1.27 0.00 0.00 60.65 58.52 2g6h h LYS 375 Cb 1.32 0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 33.14 2g6h h LYS 375 CO 0.42 0.95 0.42 0.00 -2.27 0.00 0.00 179.45 178.97 2g6h h ALA 376 N 0.98 1.28 0.31 5.00 0.00 -1.91 0.18 119.26 125.10 2g6h h ALA 376 Ca 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2g6h h ALA 376 Cb 1.07 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2g6h h ALA 376 CO 0.10 0.58 -0.15 1.25 0.00 0.00 0.00 179.25 181.03 2g6h h HIS 377 N 1.08 -0.39 -0.60 0.00 -0.00 -1.75 -2.05 115.15 111.44 2g6h h HIS 377 Ca 0.27 -0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.68 2g6h h HIS 377 Cb 0.03 0.13 -0.05 0.00 -0.00 0.00 0.00 27.41 27.52 2g6h h HIS 377 CO 0.01 -0.07 0.35 0.52 -0.00 0.00 0.00 177.93 178.73 2g6h h MET 378 N -0.72 0.64 -0.63 5.26 2.07 -1.10 -1.50 114.93 118.94 2g6h h MET 378 Ca -0.04 -0.04 -0.05 0.00 -2.07 0.00 0.00 59.70 57.50 2g6h h MET 378 Cb 0.49 -0.15 -0.03 0.00 -1.87 0.00 0.00 31.60 30.05 2g6h h MET 378 CO 0.07 0.43 0.21 -0.44 1.07 0.00 0.00 176.91 178.25 2g6h h ASP 379 N 0.66 0.88 -0.38 1.22 3.32 -0.66 -1.18 116.42 120.29 2g6h h ASP 379 Ca 0.26 -0.14 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 2g6h h ASP 379 Cb 0.10 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.41 2g6h h ASP 379 CO -0.14 0.82 0.16 -0.09 -1.72 0.00 0.00 179.24 178.27 2g6h h ARG 380 N 0.93 0.56 -0.53 3.56 9.65 -0.76 0.22 114.38 128.00 2g6h h ARG 380 Ca 0.21 -0.09 0.02 0.00 -1.10 0.00 0.00 59.98 59.01 2g6h h ARG 380 Cb 0.25 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.70 2g6h h ARG 380 CO -0.01 0.52 0.33 -0.07 2.80 0.00 0.00 179.97 183.54 2g6h h LEU 381 N 0.47 0.55 -0.08 3.80 3.38 -0.95 0.05 115.31 122.53 2g6h h LEU 381 Ca 0.13 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2g6h h LEU 381 Cb 0.16 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.78 2g6h h LEU 381 CO -0.01 0.39 0.05 -0.08 0.09 0.00 0.00 178.44 178.88 2g6h h GLU 382 N 0.66 0.10 -0.25 1.13 4.57 -0.89 -0.19 114.58 119.72 2g6h h GLU 382 Ca 0.21 -0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.41 2g6h h GLU 382 Cb -0.02 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 2g6h h GLU 382 CO -0.08 0.11 0.06 1.49 -1.18 0.00 0.00 179.01 179.41 2g6h h GLU 383 N 0.07 0.15 -0.41 1.92 4.81 -0.20 -0.70 114.58 120.22 2g6h h GLU 383 Ca 0.03 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.22 2g6h h GLU 383 Cb 0.03 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2g6h h GLU 383 CO -0.01 0.10 0.14 0.28 -0.73 0.00 0.00 179.01 178.80 2g6h h VAL 384 N 0.16 1.21 -0.19 0.32 2.07 -0.88 -0.61 116.25 118.32 2g6h h VAL 384 Ca 0.12 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 67.00 2g6h h VAL 384 Cb 0.11 0.88 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 2g6h h VAL 384 CO -0.15 0.24 -0.16 -1.13 0.02 0.00 0.00 177.57 176.40 2g6h h ASN 385 N 0.53 -0.51 -0.15 0.57 -0.00 -0.71 0.32 115.58 115.61 2g6h h ASN 385 Ca 0.13 0.10 0.00 0.00 -0.00 0.00 0.00 56.30 56.54 2g6h h ASN 385 Cb 0.24 0.25 -0.01 0.00 -0.00 0.00 0.00 38.32 38.81 2g6h h ASN 385 CO -0.01 -0.20 0.10 0.11 -0.00 0.00 0.00 177.43 177.43 2g6h h LYS 386 N -0.17 0.20 -0.60 6.67 1.57 -0.94 -1.27 116.57 122.02 2g6h h LYS 386 Ca 0.12 -0.02 0.03 0.00 -1.87 0.00 0.00 60.65 58.91 2g6h h LYS 386 Cb 0.35 -0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 2g6h h LYS 386 CO -0.29 0.15 0.36 1.49 -0.57 0.00 0.00 179.45 180.60 2g6h h GLU 387 N 0.19 0.69 0.09 3.15 4.81 -0.62 0.46 114.58 123.35 2g6h h GLU 387 Ca 0.06 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2g6h h GLU 387 Cb 0.00 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.22 2g6h h GLU 387 CO -0.01 0.46 -0.04 0.82 -0.73 0.00 0.00 179.01 179.51 2g6h h ILE 388 N 0.72 0.94 -0.40 2.32 2.04 -0.12 1.05 117.51 124.04 2g6h h ILE 388 Ca 0.24 -0.08 -0.03 0.00 1.00 0.00 0.00 64.86 66.00 2g6h h ILE 388 Cb 0.03 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.08 2g6h h ILE 388 CO -0.11 0.02 0.13 -0.08 0.00 0.00 0.00 178.15 178.12 2g6h h GLU 389 N -0.16 0.58 0.03 2.37 4.81 -0.87 2.32 114.58 123.65 2g6h h GLU 389 Ca -0.01 -0.08 -0.27 0.00 -0.13 0.00 0.00 59.36 58.87 2g6h h GLU 389 Cb 0.13 -0.10 0.02 0.00 0.63 0.00 0.00 28.75 29.42 2g6h h GLU 389 CO 0.02 0.50 -1.06 1.03 -0.73 0.00 0.00 179.01 178.77 2g6h h SER 390 N 0.57 0.87 0.00 1.04 0.87 0.48 -3.39 113.55 113.99 2g6h h SER 390 Ca 0.14 -0.76 0.00 0.00 -1.23 0.00 0.00 61.79 59.93 2g6h h SER 390 Cb 0.16 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.85 2g6h h SER 390 CO -0.01 1.53 0.00 0.35 -0.53 0.00 0.00 176.83 178.17 2g6h n THR 391 N -3.88 0.17 -0.86 2.23 -2.24 0.36 -5.00 114.28 105.06 2g6h n THR 391 Ca -0.12 -0.51 0.00 0.00 -2.27 0.00 0.00 64.05 61.15 2g6h n THR 391 Cb 0.89 1.03 0.00 0.00 -2.10 0.00 0.00 70.33 70.16 2g6h n THR 391 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2g6h n SER 392 N -0.08 -0.84 -0.54 3.42 7.64 0.78 -4.90 113.62 119.10 2g6h n SER 392 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2g6h n SER 392 Cb 0.09 -1.02 0.00 0.00 -1.01 0.00 0.00 64.21 62.26 2g6h n SER 392 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2g6h n THR 393 N -2.13 0.00 -3.49 0.44 5.66 -1.24 -4.64 114.28 108.88 2g6h n THR 393 Ca 0.00 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.91 2g6h n THR 393 Cb 0.04 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.80 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 -4.81 -0.39 -0.12 1.09 -0.85 -1.26 -2.67 117.35 108.34 2g6h s TYR 394 Ca 0.00 0.23 -0.03 0.00 -0.52 0.00 0.00 57.07 56.75 2g6h s TYR 394 Cb 0.00 0.55 -0.03 0.00 0.38 0.00 0.00 41.96 42.86 2g6h s TYR 394 CO 0.00 -0.64 0.00 -0.65 -1.52 0.00 0.00 175.55 172.74 2g6h s GLN 395 N -3.31 3.30 0.38 -3.49 -1.52 -1.26 -5.04 119.66 108.71 2g6h s GLN 395 Ca 0.04 -0.42 -0.21 0.00 -1.95 0.00 0.00 55.36 52.82 2g6h s GLN 395 Cb -0.01 -2.89 -0.10 0.00 -0.22 0.00 0.00 33.01 29.79 2g6h s GLN 395 CO -0.10 0.53 0.90 -0.51 -0.25 0.00 0.00 175.29 175.87 2g6h s LEU 396 N -0.41 4.07 0.72 2.90 1.43 -1.26 -5.05 118.68 121.08 2g6h s LEU 396 Ca 0.08 1.64 -0.11 0.00 -1.03 0.00 0.00 54.13 54.70 2g6h s LEU 396 Cb -0.12 -4.30 0.02 0.00 0.03 0.00 0.00 46.19 41.83 2g6h s LEU 396 CO 0.02 -0.25 1.07 -0.54 0.23 0.00 0.00 176.35 176.88 2g6h s LYS 397 N -2.83 2.72 0.23 1.70 -0.14 -1.26 -4.84 119.74 115.30 2g6h s LYS 397 Ca 0.57 0.80 -0.07 0.00 -1.36 0.00 0.00 55.97 55.91 2g6h s LYS 397 Cb -0.12 -1.98 0.29 0.00 -1.68 0.00 0.00 37.83 34.34 2g6h s LYS 397 CO 0.16 -1.22 1.83 -0.44 -0.76 0.00 0.00 175.35 174.93 2g6h h ASP 398 N -0.80 0.71 -0.72 2.83 5.19 -1.99 -1.56 116.42 120.07 2g6h h ASP 398 Ca -0.45 0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 55.97 2g6h h ASP 398 Cb 1.23 -0.12 -0.03 0.00 0.18 0.00 0.00 39.33 40.58 2g6h h ASP 398 CO 0.58 0.45 0.40 0.71 -3.12 0.00 0.00 179.24 178.27 2g6h h THR 399 N 0.84 1.22 -0.44 0.35 1.35 -2.00 -2.07 112.91 112.16 2g6h h THR 399 Ca 0.34 -0.55 -0.10 0.00 -0.55 0.00 0.00 66.41 65.55 2g6h h THR 399 Cb 0.17 0.26 -0.02 0.00 -1.73 0.00 0.00 68.15 66.84 2g6h h THR 399 CO -0.17 0.24 -0.12 -0.33 -0.25 0.00 0.00 175.52 174.89 2g6h h GLU 400 N 1.00 0.81 -0.36 4.72 5.08 -1.78 -2.03 114.58 122.01 2g6h h GLU 400 Ca 0.26 -0.27 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 2g6h h GLU 400 Cb 0.03 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 2g6h h GLU 400 CO -0.04 0.89 0.10 1.25 -1.00 0.00 0.00 179.01 180.21 2g6h h LEU 401 N 0.73 0.54 -0.23 1.33 5.85 -0.94 0.31 115.31 122.89 2g6h h LEU 401 Ca 0.12 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 2g6h h LEU 401 Cb 0.61 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 2g6h h LEU 401 CO 0.04 0.61 0.10 0.40 -0.34 0.00 0.00 178.44 179.25 2g6h h ILE 402 N 0.44 1.16 -0.60 4.05 2.04 -1.30 0.01 117.51 123.31 2g6h h ILE 402 Ca 0.12 -0.48 -0.00 0.00 1.00 0.00 0.00 64.86 65.50 2g6h h ILE 402 Cb 0.27 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 2g6h h ILE 402 CO -0.00 0.16 0.37 0.22 0.00 0.00 0.00 178.15 178.90 2g6h h TYR 403 N 0.22 0.78 0.14 1.37 3.20 -1.23 -1.36 116.97 120.10 2g6h h TYR 403 Ca 0.08 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.95 2g6h h TYR 403 Cb 0.16 -0.26 -0.00 0.00 1.54 0.00 0.00 36.73 38.17 2g6h h TYR 403 CO -0.01 0.52 -0.10 0.78 -1.64 0.00 0.00 178.16 177.71 2g6h h GLY 404 N 0.81 -0.23 0.99 1.82 0.00 0.06 -1.35 103.07 105.17 2g6h h GLY 404 Ca 0.22 0.11 -0.00 0.00 0.00 0.00 0.00 47.33 47.65 2g6h h GLY 404 CO -0.04 -0.10 0.31 0.00 0.00 0.00 0.00 176.54 176.71 2g6h h ALA 405 N 0.61 0.65 -0.85 3.60 0.00 -0.84 -1.19 119.26 121.25 2g6h h ALA 405 Ca -0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2g6h h ALA 405 Cb 0.21 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 2g6h h ALA 405 CO 0.00 0.13 0.47 0.87 0.00 0.00 0.00 179.25 180.73 2g6h h LYS 406 N 0.69 1.18 0.00 0.00 1.57 -1.15 -2.60 116.57 116.26 2g6h h LYS 406 Ca 0.18 -0.13 -0.11 0.00 -1.87 0.00 0.00 60.65 58.72 2g6h h LYS 406 Cb -0.02 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.04 2g6h h LYS 406 CO -0.04 0.86 -0.52 0.45 -0.57 0.00 0.00 179.45 179.63 2g6h h HIS 407 N 1.19 0.00 -0.58 -1.35 3.86 -0.69 -0.37 115.15 117.21 2g6h h HIS 407 Ca 0.30 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.45 2g6h h HIS 407 Cb 0.02 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 2g6h h HIS 407 CO 0.01 0.52 0.11 0.00 0.86 0.00 0.00 177.93 179.43 2g6h h ALA 408 N 1.48 1.10 -0.23 2.45 0.00 -0.90 0.29 119.26 123.45 2g6h h ALA 408 Ca -0.01 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 2g6h h ALA 408 Cb 1.16 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 2g6h h ALA 408 CO 0.07 0.59 -0.25 2.35 0.00 0.00 0.00 179.25 182.01 2g6h h TRP 409 N 0.87 0.69 -0.45 0.00 7.01 -1.16 -2.17 115.95 120.74 2g6h h TRP 409 Ca 0.18 -0.21 0.04 0.00 2.11 0.00 0.00 58.89 61.01 2g6h h TRP 409 Cb 0.36 -0.14 -0.02 0.00 -2.10 0.00 0.00 29.16 27.25 2g6h h TRP 409 CO 0.02 0.92 0.30 -0.09 -2.79 0.00 0.00 178.44 176.80 2g6h h ARG 410 N 0.27 0.45 -0.01 2.65 2.43 -0.48 -1.83 114.38 117.86 2g6h h ARG 410 Ca 0.03 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 2g6h h ARG 410 Cb 0.82 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 2g6h h ARG 410 CO 0.06 0.30 -0.09 0.09 -1.51 0.00 0.00 179.97 178.82 2g6h n ASN 411 N -4.48 1.25 -4.55 -3.80 3.02 0.95 -4.83 115.26 102.82 2g6h n ASN 411 Ca 0.05 -1.24 -0.37 0.00 -0.03 0.00 0.00 54.58 52.99 2g6h n ASN 411 Cb 0.17 0.04 -0.03 0.00 -0.61 0.00 0.00 39.78 39.35 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 -2.19 2.25 0.54 5.41 0.00 -0.69 -4.72 121.76 122.36 2g6h s ALA 412 Ca 0.33 -1.17 0.21 0.00 0.00 0.00 0.00 51.96 51.33 2g6h s ALA 412 Cb 0.20 -4.37 1.41 0.00 0.00 0.00 0.00 23.12 20.36 2g6h s ALA 412 CO 0.40 -3.93 2.12 0.66 0.00 0.00 0.00 175.76 175.01 2g6h h SER 413 N 12.52 0.00 0.66 0.00 4.64 -1.88 -2.05 113.55 127.43 2g6h h SER 413 Ca -0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 2g6h h SER 413 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2g6h h SER 413 CO 1.25 0.00 -0.05 0.54 -0.87 0.00 0.00 176.83 177.70 2g6h n ARG 414 N -4.34 0.32 -3.23 4.77 1.74 -1.26 -0.86 116.66 113.79 2g6h n ARG 414 Ca 0.00 -0.04 -0.40 0.00 -0.77 0.00 0.00 57.85 56.64 2g6h n ARG 414 Cb 0.23 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.10 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 5.05 0.00 -0.39 0.00 3.14 -1.26 -3.91 118.33 120.96 2g6h n VAL 416 Ca -0.04 -0.03 0.08 0.00 -2.96 0.00 0.00 64.34 61.39 2g6h n VAL 416 Cb 0.50 0.07 0.32 0.00 -1.06 0.00 0.00 33.84 33.67 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 1.44 2.46 0.00 7.55 0.00 -1.26 -4.44 105.19 110.94 2g6h n GLY 417 Ca 0.08 -0.76 0.04 0.00 0.00 0.00 0.00 46.02 45.38 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 0.91 0.04 0.33 1.61 1.74 -1.25 -2.44 116.66 117.59 2g6h n ARG 418 Ca 0.23 0.32 0.22 0.00 -0.77 0.00 0.00 57.85 57.85 2g6h n ARG 418 Cb 0.85 -1.50 1.16 0.00 -1.02 0.00 0.00 32.46 31.95 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 0.04 -0.05 0.55 2.10 -1.90 -1.14 117.51 117.11 2g6h h ILE 419 Ca 0.00 -0.05 0.00 0.00 1.08 0.00 0.00 64.86 65.89 2g6h h ILE 419 Cb 0.11 1.05 0.00 0.00 -1.09 0.00 0.00 36.82 36.89 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 -3.14 1.80 -0.35 2.19 1.13 -1.02 -4.65 117.38 113.34 2g6h n GLN 420 Ca -0.03 -1.17 0.23 0.00 -1.94 0.00 0.00 57.00 54.09 2g6h n GLN 420 Cb 0.09 -1.46 0.47 0.00 0.11 0.00 0.00 30.24 29.45 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 2.74 0.86 0.00 1.08 5.08 -1.42 -1.11 115.95 123.18 2g6h h TRP 421 Ca 0.00 0.03 0.00 0.00 1.08 0.00 0.00 58.89 60.00 2g6h h TRP 421 Cb 0.59 -0.24 0.00 0.00 -3.00 0.00 0.00 29.16 26.51 2g6h h TRP 421 CO 0.03 -0.04 0.00 0.66 -1.28 0.00 0.00 178.44 177.81 2g6h h SER 422 N 0.41 0.00 -0.47 0.11 4.64 -1.84 -3.17 113.55 113.22 2g6h h SER 422 Ca 0.68 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 62.00 2g6h h SER 422 Cb 1.57 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.66 2g6h h SER 422 CO -0.47 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 175.78 2g6h n LYS 423 N -2.44 2.46 -1.70 4.77 5.02 -0.42 -4.96 118.16 120.88 2g6h n LYS 423 Ca 0.03 -1.85 -0.42 0.00 -2.02 0.00 0.00 58.31 54.04 2g6h n LYS 423 Cb 0.33 -1.52 -0.03 0.00 -0.02 0.00 0.00 35.03 33.79 2g6h n LYS 423 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2g6h n LEU 424 N 0.84 4.03 -4.66 -0.35 7.94 -1.20 -4.79 117.00 118.81 2g6h n LEU 424 Ca 0.17 1.02 -0.40 0.00 -1.11 0.00 0.00 56.01 55.69 2g6h n LEU 424 Cb 0.52 -1.56 -0.05 0.00 0.53 0.00 0.00 43.42 42.85 2g6h n LEU 424 CO 0.14 0.18 0.44 -1.58 -1.11 0.00 0.00 177.39 175.46 2g6h s GLN 425 N 1.93 4.21 -0.25 1.96 2.00 -0.90 -4.99 119.66 123.62 2g6h s GLN 425 Ca 0.78 0.71 -0.07 0.00 -2.00 0.00 0.00 55.36 54.78 2g6h s GLN 425 Cb -0.49 -3.59 -0.03 0.00 0.80 0.00 0.00 33.01 29.70 2g6h s GLN 425 CO 0.35 -0.30 0.06 0.08 -0.50 0.00 0.00 175.29 174.98 2g6h s VAL 426 N 2.10 4.25 -0.25 1.34 1.01 -1.26 -1.58 120.40 126.01 2g6h s VAL 426 Ca 0.31 -0.20 -0.11 0.00 0.00 0.00 0.00 61.98 61.98 2g6h s VAL 426 Cb -0.16 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.18 2g6h s VAL 426 CO 0.10 0.34 0.16 -0.36 0.00 0.00 0.00 175.10 175.34 2g6h s PHE 427 N 1.61 3.28 -0.63 5.22 0.08 1.00 -4.98 117.98 123.55 2g6h s PHE 427 Ca 0.06 0.17 -0.21 0.00 0.12 0.00 0.00 56.93 57.07 2g6h s PHE 427 Cb -0.15 -2.30 0.08 0.00 -0.57 0.00 0.00 43.02 40.08 2g6h s PHE 427 CO 0.03 -0.02 0.85 0.34 -0.10 0.00 0.00 175.22 176.33 2g6h s ASP 428 N 1.28 6.18 -0.40 1.36 3.68 -1.26 -1.08 116.67 126.42 2g6h s ASP 428 Ca 0.07 -1.17 0.05 0.00 2.13 0.00 0.00 52.55 53.63 2g6h s ASP 428 Cb -0.14 -2.37 0.60 0.00 -1.45 0.00 0.00 42.92 39.56 2g6h s ASP 428 CO 0.06 -1.30 1.75 0.00 0.13 0.00 0.00 175.17 175.82 2g6h n ALA 429 N 7.11 5.20 0.43 3.66 0.00 0.25 -4.65 120.51 132.51 2g6h n ALA 429 Ca -0.06 -3.04 0.09 0.00 0.00 0.00 0.00 53.44 50.43 2g6h n ALA 429 Cb 0.44 -1.20 0.39 0.00 0.00 0.00 0.00 19.45 19.09 2g6h n ALA 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2g6h n ARG 430 N -1.12 0.09 -0.03 0.00 1.74 -1.06 -2.12 116.66 114.15 2g6h n ARG 430 Ca 0.51 0.35 0.13 0.00 -0.77 0.00 0.00 57.85 58.06 2g6h n ARG 430 Cb 1.38 -1.69 0.43 0.00 -1.02 0.00 0.00 32.46 31.57 2g6h n ARG 430 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2g6h n ASP 431 N -1.86 1.77 -4.76 0.55 5.68 -1.26 -4.45 116.55 112.21 2g6h n ASP 431 Ca 0.03 -1.63 -0.40 0.00 -0.50 0.00 0.00 54.79 52.28 2g6h n ASP 431 Cb 0.19 -0.04 -0.03 0.00 -1.14 0.00 0.00 41.12 40.10 2g6h n ASP 431 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2g6h n THR 433 N 0.98 0.00 -4.29 0.00 -2.24 -1.26 -4.75 114.28 102.72 2g6h n THR 433 Ca -0.00 -0.10 -0.15 0.00 -2.27 0.00 0.00 64.05 61.52 2g6h n THR 433 Cb 0.43 0.54 -0.10 0.00 -2.10 0.00 0.00 70.33 69.09 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 -1.03 0.70 0.31 4.28 -4.23 -1.26 -4.54 115.64 109.87 2g6h s THR 434 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 2g6h s THR 434 Cb 0.00 -2.35 0.17 0.00 1.34 0.00 0.00 72.50 71.66 2g6h s THR 434 CO 0.00 -0.27 1.87 0.00 -0.54 0.00 0.00 174.62 175.67 2g6h h ALA 435 N 2.54 1.32 -0.55 3.99 0.00 -1.89 0.15 119.26 124.81 2g6h h ALA 435 Ca -0.38 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.26 2g6h h ALA 435 Cb 1.22 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 2g6h h ALA 435 CO 0.62 0.48 -0.00 0.45 0.00 0.00 0.00 179.25 180.80 2g6h h HIS 436 N 0.68 1.02 -0.51 0.00 3.86 -1.96 0.22 115.15 118.45 2g6h h HIS 436 Ca 0.15 -0.16 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2g6h h HIS 436 Cb 0.26 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 2g6h h HIS 436 CO 0.01 0.91 0.21 0.78 0.86 0.00 0.00 177.93 180.71 2g6h h GLY 437 N 1.00 0.82 1.00 2.45 0.00 -1.69 -1.39 103.07 105.25 2g6h h GLY 437 Ca 0.16 -0.44 0.00 0.00 0.00 0.00 0.00 47.33 47.05 2g6h h GLY 437 CO 0.03 0.42 0.38 -0.33 0.00 0.00 0.00 176.54 177.04 2g6h h MET 438 N 0.69 0.79 -0.70 4.80 0.00 -0.45 -1.15 114.93 118.91 2g6h h MET 438 Ca 0.17 -0.05 0.05 0.00 0.00 0.00 0.00 59.70 59.86 2g6h h MET 438 Cb 0.19 -0.17 -0.05 0.00 0.00 0.00 0.00 31.60 31.56 2g6h h MET 438 CO -0.02 0.53 0.42 0.35 0.00 0.00 0.00 176.91 178.20 2g6h h PHE 439 N 0.80 0.78 -0.40 -0.22 3.04 -0.16 -0.66 116.94 120.13 2g6h h PHE 439 Ca 0.22 0.02 -0.03 0.00 3.98 0.00 0.00 57.97 62.16 2g6h h PHE 439 Cb -0.07 -0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.17 2g6h h PHE 439 CO -0.03 0.41 0.12 -0.97 -2.02 0.00 0.00 178.31 175.82 2g6h h ASN 440 N 0.80 0.59 -0.82 0.41 -1.24 -0.63 -0.37 115.58 114.31 2g6h h ASN 440 Ca 0.30 -0.21 -0.03 0.00 0.71 0.00 0.00 56.30 57.06 2g6h h ASN 440 Cb 0.11 -0.15 -0.04 0.00 0.73 0.00 0.00 38.32 38.96 2g6h h ASN 440 CO -0.15 0.64 0.39 1.88 -1.29 0.00 0.00 177.43 178.91 2g6h h TYR 441 N 0.50 1.19 -0.60 0.67 -1.99 -0.82 -2.46 116.97 113.46 2g6h h TYR 441 Ca 0.13 -0.06 -0.10 0.00 2.00 0.00 0.00 58.73 60.70 2g6h h TYR 441 Cb 0.27 -0.37 -0.02 0.00 2.00 0.00 0.00 36.73 38.61 2g6h h TYR 441 CO 0.01 0.87 -0.01 0.82 -0.00 0.00 0.00 178.16 179.85 2g6h h ILE 442 N 1.18 1.27 -0.61 -2.88 2.04 -0.85 -1.33 117.51 116.32 2g6h h ILE 442 Ca 0.28 -1.17 -0.02 0.00 1.00 0.00 0.00 64.86 64.96 2g6h h ILE 442 Cb 0.13 0.81 -0.03 0.00 -0.74 0.00 0.00 36.82 36.99 2g6h h ILE 442 CO -0.03 0.42 0.31 0.00 0.00 0.00 0.00 178.15 178.84 2g6h h ASN 444 N 0.84 0.76 -0.20 0.00 2.35 -1.15 -1.24 115.58 116.93 2g6h h ASN 444 Ca 0.21 -0.14 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2g6h h ASN 444 Cb 0.10 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2g6h h ASN 444 CO -0.03 0.76 0.04 -0.74 -1.65 0.00 0.00 177.43 175.82 2g6h h HIS 445 N 0.77 0.35 -0.74 1.19 -0.00 -0.89 -0.28 115.15 115.55 2g6h h HIS 445 Ca 0.17 -0.04 -0.05 0.00 -0.00 0.00 0.00 60.37 60.45 2g6h h HIS 445 Cb 0.32 -0.10 -0.03 0.00 -0.00 0.00 0.00 27.41 27.60 2g6h h HIS 445 CO 0.02 0.45 0.29 0.28 -0.00 0.00 0.00 177.93 178.97 2g6h h VAL 446 N 0.14 1.25 -0.19 5.26 2.07 -1.01 0.14 116.25 123.91 2g6h h VAL 446 Ca 0.06 -0.81 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 2g6h h VAL 446 Cb 0.28 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.45 2g6h h VAL 446 CO 0.00 0.33 -0.05 0.50 0.02 0.00 0.00 177.57 178.37 2g6h h LYS 447 N 1.07 0.37 -0.52 1.57 3.64 -1.10 0.17 116.57 121.77 2g6h h LYS 447 Ca 0.24 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 2g6h h LYS 447 Cb 0.23 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 2g6h h LYS 447 CO -0.02 0.64 0.29 -0.92 -2.27 0.00 0.00 179.45 177.17 2g6h h TYR 448 N 0.09 0.71 -0.26 1.91 3.20 -0.87 -1.78 116.97 119.96 2g6h h TYR 448 Ca 0.05 -0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.73 2g6h h TYR 448 Cb 0.50 -0.23 -0.00 0.00 1.54 0.00 0.00 36.73 38.54 2g6h h TYR 448 CO 0.05 0.52 -0.53 0.00 -1.64 0.00 0.00 178.16 176.56 2g6h h ALA 449 N 1.13 0.58 -0.22 1.82 0.00 -0.68 -3.23 119.26 118.66 2g6h h ALA 449 Ca 0.18 -0.51 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 2g6h h ALA 449 Cb 0.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2g6h h ALA 449 CO -0.03 0.68 -0.02 1.15 0.00 0.00 0.00 179.25 181.03 2g6h h THR 450 N 0.58 1.27 -6.65 0.00 2.02 -0.86 -0.27 112.91 109.00 2g6h h THR 450 Ca 0.02 -0.96 -0.53 0.00 0.77 0.00 0.00 66.41 65.71 2g6h h THR 450 Cb 1.11 1.46 -0.11 0.00 -1.74 0.00 0.00 68.15 68.88 2g6h h THR 450 CO 0.11 0.30 -0.90 -3.20 0.37 0.00 0.00 175.52 172.20 2g6h n ASN 451 N -4.64 -0.43 -2.31 4.18 5.15 -0.68 -0.91 115.26 115.62 2g6h n ASN 451 Ca -0.04 -1.06 -0.12 0.00 -0.60 0.00 0.00 54.58 52.75 2g6h n ASN 451 Cb 0.26 -2.72 -0.01 0.00 -0.53 0.00 0.00 39.78 36.78 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 -4.43 -2.11 0.00 1.20 5.02 -1.26 -1.76 118.16 114.82 2g6h n LYS 452 Ca -0.27 0.62 0.00 0.00 -2.02 0.00 0.00 58.31 56.64 2g6h n LYS 452 Cb 0.66 -5.17 0.00 0.00 -0.02 0.00 0.00 35.03 30.50 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 -0.74 2.65 3.32 0.72 0.00 -0.09 -4.94 105.19 106.11 2g6h n GLY 453 Ca -0.14 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.43 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 5.55 -4.71 1.61 4.05 -0.72 -0.69 115.26 120.34 2g6h n ASN 454 Ca 0.00 -3.07 -0.42 0.00 0.45 0.00 0.00 54.58 51.54 2g6h n ASN 454 Cb 0.00 -1.41 -0.00 0.00 1.23 0.00 0.00 39.78 39.60 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 3.15 3.85 -4.10 1.20 4.32 -1.24 -4.48 117.00 119.71 2g6h n LEU 455 Ca 0.27 1.19 -0.27 0.00 -0.02 0.00 0.00 56.01 57.19 2g6h n LEU 455 Cb 0.39 -1.51 -0.17 0.00 -1.62 0.00 0.00 43.42 40.51 2g6h n LEU 455 CO 0.54 -0.40 -0.50 -0.13 -1.22 0.00 0.00 177.39 175.67 2g6h s ARG 456 N -1.98 2.07 0.33 3.23 0.52 -0.11 -5.01 118.95 117.99 2g6h s ARG 456 Ca 0.56 -0.58 -0.29 0.00 -0.52 0.00 0.00 55.73 54.91 2g6h s ARG 456 Cb -0.54 -1.67 -0.10 0.00 0.52 0.00 0.00 34.95 33.16 2g6h s ARG 456 CO 0.62 0.11 1.26 -1.54 0.02 0.00 0.00 175.30 175.77 2g6h s SER 457 N 0.45 6.85 0.17 0.23 1.04 -1.26 -4.46 113.70 116.72 2g6h s SER 457 Ca -0.13 2.59 -0.19 0.00 0.48 0.00 0.00 55.95 58.69 2g6h s SER 457 Cb -0.15 -2.64 0.04 0.00 0.10 0.00 0.00 66.02 63.37 2g6h s SER 457 CO 0.05 -0.47 0.52 0.00 0.98 0.00 0.00 173.24 174.32 2g6h s ALA 458 N -1.16 -1.17 -0.11 5.32 0.00 -0.63 -2.13 121.76 121.89 2g6h s ALA 458 Ca 0.48 0.07 -0.10 0.00 0.00 0.00 0.00 51.96 52.41 2g6h s ALA 458 Cb -0.38 0.82 0.03 0.00 0.00 0.00 0.00 23.12 23.59 2g6h s ALA 458 CO 0.50 -0.76 0.30 -1.50 0.00 0.00 0.00 175.76 174.30 2g6h s ILE 459 N -3.81 0.00 -0.12 0.00 2.07 -0.61 -0.42 121.20 118.31 2g6h s ILE 459 Ca 0.05 -0.03 0.02 0.00 -1.41 0.00 0.00 60.65 59.27 2g6h s ILE 459 Cb -0.00 -0.43 -0.01 0.00 0.13 0.00 0.00 42.46 42.15 2g6h s ILE 459 CO -0.08 -0.02 -0.18 -0.89 -1.91 0.00 0.00 174.94 171.86 2g6h s THR 460 N 0.07 2.64 -0.27 4.00 2.01 -0.36 -0.00 115.64 123.74 2g6h s THR 460 Ca -0.01 -0.81 -0.00 0.00 0.31 0.00 0.00 61.69 61.18 2g6h s THR 460 Cb -0.02 -2.07 0.04 0.00 0.01 0.00 0.00 72.50 70.46 2g6h s THR 460 CO 0.01 0.54 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.78 2g6h s ILE 461 N 0.36 2.70 0.64 1.82 1.01 -0.24 -3.23 121.20 124.26 2g6h s ILE 461 Ca -0.14 -1.29 -0.07 0.00 0.00 0.00 0.00 60.65 59.15 2g6h s ILE 461 Cb -0.17 -2.47 0.03 0.00 0.01 0.00 0.00 42.46 39.86 2g6h s ILE 461 CO 0.07 0.06 0.96 -0.36 0.00 0.00 0.00 174.94 175.66 2g6h s PHE 462 N 1.24 3.13 0.25 3.97 0.08 -0.86 -0.58 117.98 125.22 2g6h s PHE 462 Ca -0.04 0.60 -0.29 0.00 0.12 0.00 0.00 56.93 57.33 2g6h s PHE 462 Cb -0.18 -2.93 -0.15 0.00 -0.57 0.00 0.00 43.02 39.18 2g6h s PHE 462 CO -0.04 -1.07 0.90 -2.30 -0.10 0.00 0.00 175.22 172.61 2g6h n PRO 463 N -2.74 0.95 -1.18 0.24 -0.02 -1.25 -4.74 135.00 126.26 2g6h n PRO 463 Ca 0.06 0.33 -0.30 0.00 -2.02 0.00 0.00 63.50 61.57 2g6h n PRO 463 Cb 0.59 -1.62 0.13 0.00 -0.02 0.00 0.00 33.50 32.58 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 -1.25 1.37 0.46 -0.52 -2.07 -1.26 -4.60 119.66 111.78 2g6h s GLN 464 Ca 0.62 0.90 -0.23 0.00 -1.82 0.00 0.00 55.36 54.83 2g6h s GLN 464 Cb -0.79 -1.82 -0.07 0.00 -1.09 0.00 0.00 33.01 29.24 2g6h s GLN 464 CO 0.58 -2.19 1.21 0.50 -1.32 0.00 0.00 175.29 174.07 2g6h s ARG 465 N -4.91 3.74 0.00 9.60 3.52 0.97 -4.92 118.95 126.95 2g6h s ARG 465 Ca 0.63 1.89 0.00 0.00 -0.13 0.00 0.00 55.73 58.13 2g6h s ARG 465 Cb -0.18 -2.47 0.00 0.00 -1.56 0.00 0.00 34.95 30.74 2g6h s ARG 465 CO 0.57 -0.60 0.00 0.25 -0.81 0.00 0.00 175.30 174.71 2g6h n THR 466 N -0.40 0.00 1.08 4.11 -2.24 -1.26 -4.76 114.28 110.82 2g6h n THR 466 Ca 0.07 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.97 2g6h n THR 466 Cb 0.47 -0.20 0.22 0.00 -2.10 0.00 0.00 70.33 68.73 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 -0.18 2.62 0.00 3.42 3.85 -1.26 -4.83 116.55 120.17 2g6h n ASP 467 Ca 0.00 -1.87 0.00 0.00 -0.71 0.00 0.00 54.79 52.21 2g6h n ASP 467 Cb 0.00 -0.02 0.00 0.00 -1.35 0.00 0.00 41.12 39.75 2g6h n ASP 467 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2g6h n GLY 468 N 1.31 1.07 0.36 6.12 0.00 -1.26 -4.83 105.19 107.96 2g6h n GLY 468 Ca 0.16 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.25 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 1.72 -1.20 1.61 5.02 -1.26 -4.52 118.16 117.52 2g6h n LYS 469 Ca 0.00 -0.81 -0.01 0.00 -2.02 0.00 0.00 58.31 55.47 2g6h n LYS 469 Cb 0.00 -1.24 0.13 0.00 -0.02 0.00 0.00 35.03 33.89 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 -0.08 0.63 -1.84 2.13 8.25 -1.26 -4.32 115.22 118.73 2g6h n HIS 470 Ca 0.06 -1.50 -0.39 0.00 -0.26 0.00 0.00 57.72 55.63 2g6h n HIS 470 Cb 0.32 -0.25 0.02 0.00 1.12 0.00 0.00 29.99 31.20 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 -3.12 5.82 -0.18 0.41 -0.00 -1.26 -2.59 116.67 115.76 2g6h s ASP 471 Ca 0.39 2.84 -0.09 0.00 -0.00 0.00 0.00 52.55 55.69 2g6h s ASP 471 Cb 0.38 -2.65 -0.05 0.00 -0.00 0.00 0.00 42.92 40.60 2g6h s ASP 471 CO -0.06 -1.20 0.14 -0.36 -0.00 0.00 0.00 175.17 173.68 2g6h s PHE 472 N -1.24 3.46 -0.01 4.23 0.40 -1.26 0.25 117.98 123.82 2g6h s PHE 472 Ca 0.62 0.39 -0.07 0.00 -0.60 0.00 0.00 56.93 57.28 2g6h s PHE 472 Cb -0.42 -2.10 0.01 0.00 0.51 0.00 0.00 43.02 41.01 2g6h s PHE 472 CO 0.53 0.41 0.14 1.03 0.70 0.00 0.00 175.22 178.04 2g6h s ARG 473 N -0.03 0.40 -0.29 0.44 1.81 0.17 -3.28 118.95 118.17 2g6h s ARG 473 Ca 0.10 -0.23 -0.08 0.00 -1.72 0.00 0.00 55.73 53.80 2g6h s ARG 473 Cb -0.11 0.17 -0.01 0.00 -0.45 0.00 0.00 34.95 34.55 2g6h s ARG 473 CO -0.00 -0.09 0.12 0.08 -0.68 0.00 0.00 175.30 174.73 2g6h s VAL 474 N -0.97 4.40 0.09 3.52 1.01 -1.26 -1.36 120.40 125.83 2g6h s VAL 474 Ca -0.11 -0.40 0.19 0.00 0.00 0.00 0.00 61.98 61.66 2g6h s VAL 474 Cb -0.06 -3.20 0.14 0.00 0.00 0.00 0.00 36.38 33.27 2g6h s VAL 474 CO 0.01 0.15 1.69 -0.50 0.00 0.00 0.00 175.10 176.45 2g6h h TRP 475 N 8.30 0.00 -4.19 5.22 4.06 -1.56 -3.43 115.95 124.36 2g6h h TRP 475 Ca -0.34 0.00 -0.52 0.00 2.06 0.00 0.00 58.89 60.09 2g6h h TRP 475 Cb 1.15 0.00 0.14 0.00 -1.00 0.00 0.00 29.16 29.45 2g6h h TRP 475 CO 0.64 0.37 0.38 -0.80 -3.56 0.00 0.00 178.44 175.47 2g6h s ASN 476 N -6.38 4.53 0.05 -3.49 -0.87 -1.26 -4.93 114.94 102.59 2g6h s ASN 476 Ca 0.01 2.20 0.13 0.00 -1.57 0.00 0.00 52.86 53.63 2g6h s ASN 476 Cb 0.10 -2.57 -0.17 0.00 -0.02 0.00 0.00 41.25 38.59 2g6h s ASN 476 CO 0.69 -2.03 0.93 0.77 -2.57 0.00 0.00 177.10 174.89 2g6h h SER 477 N -0.20 0.00 -4.71 -1.22 4.64 -1.90 -3.36 113.55 106.80 2g6h h SER 477 Ca -0.47 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 60.63 2g6h h SER 477 Cb 1.27 0.00 -0.22 0.00 -0.31 0.00 0.00 62.40 63.14 2g6h h SER 477 CO 0.51 0.84 -0.72 -1.10 -0.87 0.00 0.00 176.83 175.49 2g6h s GLN 478 N -2.75 0.35 0.37 4.77 -0.21 -1.26 -0.68 119.66 120.25 2g6h s GLN 478 Ca -0.02 -0.56 0.05 0.00 0.02 0.00 0.00 55.36 54.85 2g6h s GLN 478 Cb 0.09 -0.05 0.73 0.00 1.00 0.00 0.00 33.01 34.77 2g6h s GLN 478 CO 0.81 -0.01 1.99 -0.07 -2.12 0.00 0.00 175.29 175.90 2g6h h LEU 479 N 4.85 0.65 -8.07 2.90 3.38 -1.49 -3.39 115.31 114.15 2g6h h LEU 479 Ca -0.32 -0.01 -0.59 0.00 0.09 0.00 0.00 57.88 57.05 2g6h h LEU 479 Cb 1.21 -0.15 -0.34 0.00 0.09 0.00 0.00 40.66 41.47 2g6h h LEU 479 CO 0.43 0.45 -0.84 -0.63 0.09 0.00 0.00 178.44 177.93 2g6h s ILE 480 N -5.66 1.56 -0.01 1.22 1.01 -1.26 -4.87 121.20 113.19 2g6h s ILE 480 Ca -0.10 -0.70 -0.28 0.00 0.00 0.00 0.00 60.65 59.57 2g6h s ILE 480 Cb 0.18 -1.41 0.10 0.00 0.01 0.00 0.00 42.46 41.34 2g6h s ILE 480 CO 0.76 0.45 0.83 -0.13 0.00 0.00 0.00 174.94 176.85 2g6h s ARG 481 N 0.81 0.89 -0.00 2.79 0.52 -1.26 -4.81 118.95 117.89 2g6h s ARG 481 Ca -0.10 -0.19 -0.14 0.00 -0.52 0.00 0.00 55.73 54.78 2g6h s ARG 481 Cb -0.16 0.41 -0.06 0.00 0.52 0.00 0.00 34.95 35.67 2g6h s ARG 481 CO 0.01 -0.36 0.39 0.71 0.02 0.00 0.00 175.30 176.06 2g6h s TYR 482 N -2.67 3.71 0.73 -0.53 4.12 -1.26 -0.92 117.35 120.53 2g6h s TYR 482 Ca 0.01 0.94 -0.15 0.00 0.02 0.00 0.00 57.07 57.90 2g6h s TYR 482 Cb -0.01 -2.25 0.04 0.00 -1.52 0.00 0.00 41.96 38.22 2g6h s TYR 482 CO -0.06 0.64 1.20 0.00 0.02 0.00 0.00 175.55 177.36 2g6h s ALA 483 N -1.10 2.12 -0.05 3.71 0.00 -0.12 -4.37 121.76 121.95 2g6h s ALA 483 Ca 0.24 0.86 0.02 0.00 0.00 0.00 0.00 51.96 53.08 2g6h s ALA 483 Cb -0.16 -3.46 0.01 0.00 0.00 0.00 0.00 23.12 19.51 2g6h s ALA 483 CO 0.13 -1.88 -0.12 0.20 0.00 0.00 0.00 175.76 174.10 2g6h s GLY 484 N -2.08 0.73 -0.10 0.00 0.00 -1.23 -1.40 107.32 103.24 2g6h s GLY 484 Ca 0.74 -0.40 0.01 0.00 0.00 0.00 0.00 44.72 45.06 2g6h s GLY 484 CO 0.46 0.04 -0.10 -0.19 0.00 0.00 0.00 173.10 173.30 2g6h s TYR 485 N 0.50 1.59 -0.10 1.90 1.51 0.26 -4.07 117.35 118.94 2g6h s TYR 485 Ca -0.10 -0.74 -0.30 0.00 -1.01 0.00 0.00 57.07 54.92 2g6h s TYR 485 Cb -0.14 -1.23 -0.01 0.00 -0.11 0.00 0.00 41.96 40.47 2g6h s TYR 485 CO 0.03 -0.45 1.02 0.21 -1.11 0.00 0.00 175.55 175.25 2g6h s LYS 486 N 1.27 4.42 0.26 -0.62 2.47 -1.26 0.13 119.74 126.41 2g6h s LYS 486 Ca -0.03 1.41 -0.05 0.00 -1.56 0.00 0.00 55.97 55.74 2g6h s LYS 486 Cb -0.14 -3.54 -0.05 0.00 -1.46 0.00 0.00 37.83 32.63 2g6h s LYS 486 CO -0.04 -0.32 0.53 -0.65 0.16 0.00 0.00 175.35 175.03 2g6h s GLN 487 N 2.02 3.65 0.63 4.03 -1.52 0.00 -4.95 119.66 123.51 2g6h s GLN 487 Ca 0.49 0.02 0.36 0.00 -1.95 0.00 0.00 55.36 54.28 2g6h s GLN 487 Cb -0.19 -2.67 2.07 0.00 -0.22 0.00 0.00 33.01 32.00 2g6h s GLN 487 CO 0.18 0.26 2.29 -1.00 -0.25 0.00 0.00 175.29 176.77 2g6h h PRO 488 N 1.90 0.00 -0.08 2.91 0.13 -1.96 -0.16 132.00 134.75 2g6h h PRO 488 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2g6h h PRO 488 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2g6h h PRO 488 CO 0.67 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.04 2g6h n ASP 489 N -3.49 0.42 0.00 1.44 3.85 -1.26 -4.88 116.55 112.64 2g6h n ASP 489 Ca -0.03 -1.97 0.00 0.00 -0.71 0.00 0.00 54.79 52.08 2g6h n ASP 489 Cb 0.10 -0.05 0.00 0.00 -1.35 0.00 0.00 41.12 39.82 2g6h n ASP 489 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2g6h n GLY 490 N 0.64 2.01 3.92 6.12 0.00 -0.07 -5.04 105.19 112.77 2g6h n GLY 490 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 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 -3.17 4.53 -0.07 1.61 1.04 -1.26 -4.81 113.70 111.58 2g6h s SER 491 Ca 0.00 0.49 0.04 0.00 0.48 0.00 0.00 55.95 56.96 2g6h s SER 491 Cb 0.00 -1.02 -0.00 0.00 0.10 0.00 0.00 66.02 65.10 2g6h s SER 491 CO 0.00 -1.82 -0.20 -0.89 0.98 0.00 0.00 173.24 171.31 2g6h s THR 492 N -3.40 1.72 -0.21 2.02 2.01 -1.26 -0.82 115.64 115.70 2g6h s THR 492 Ca 0.62 -0.86 -0.09 0.00 0.31 0.00 0.00 61.69 61.67 2g6h s THR 492 Cb -0.10 -1.49 -0.05 0.00 0.01 0.00 0.00 72.50 70.88 2g6h s THR 492 CO 0.47 0.49 0.12 -0.22 -0.69 0.00 0.00 174.62 174.78 2g6h s LEU 493 N 0.15 4.07 0.00 4.42 2.96 0.12 -4.92 118.68 125.49 2g6h s LEU 493 Ca -0.09 0.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 2g6h s LEU 493 Cb -0.14 -2.06 0.00 0.00 0.50 0.00 0.00 46.19 44.48 2g6h s LEU 493 CO 0.05 0.14 0.00 0.61 -1.32 0.00 0.00 176.35 175.83 2g6h n GLY 494 N 3.79 -0.38 3.55 7.98 0.00 -1.26 0.92 105.19 119.78 2g6h n GLY 494 Ca -0.16 -1.46 -0.43 0.00 0.00 0.00 0.00 46.02 43.97 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 6.43 0.56 1.61 -1.08 -0.49 -4.82 116.67 114.88 2g6h s ASP 495 Ca 0.00 -0.01 0.25 0.00 -0.52 0.00 0.00 52.55 52.27 2g6h s ASP 495 Cb 0.00 -2.36 1.57 0.00 -1.46 0.00 0.00 42.92 40.67 2g6h s ASP 495 CO 0.00 -0.79 2.15 -0.65 0.52 0.00 0.00 175.17 176.40 2g6h h PRO 496 N 8.76 0.00 0.00 4.34 0.11 -1.81 -1.69 132.00 141.71 2g6h h PRO 496 Ca -0.25 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 2g6h h PRO 496 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2g6h h PRO 496 CO 0.91 0.00 -0.04 0.00 -0.21 0.00 0.00 178.00 178.67 2g6h h ALA 497 N 1.90 1.10 -0.26 -0.75 0.00 -1.93 -3.04 119.26 116.28 2g6h h ALA 497 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2g6h h ALA 497 Cb 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2g6h h ALA 497 CO -0.00 0.04 0.00 0.09 0.00 0.00 0.00 179.25 179.38 2g6h n ASN 498 N -3.27 3.40 0.03 0.00 3.02 -0.64 -4.71 115.26 113.09 2g6h n ASN 498 Ca -0.02 -2.67 -0.10 0.00 -0.03 0.00 0.00 54.58 51.77 2g6h n ASN 498 Cb 0.19 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 38.90 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 1.66 0.70 -0.13 2.41 2.07 -1.62 0.99 116.25 122.33 2g6h h VAL 499 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2g6h h VAL 499 Cb 1.15 0.70 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 2g6h h VAL 499 CO 0.13 0.00 0.03 -0.61 0.02 0.00 0.00 177.57 177.14 2g6h h GLN 500 N -0.17 0.09 -0.86 1.57 4.15 -1.85 -0.57 115.11 117.47 2g6h h GLN 500 Ca 0.06 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.45 2g6h h GLN 500 Cb 0.25 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 27.88 2g6h h GLN 500 CO -0.15 0.06 0.45 0.35 -1.93 0.00 0.00 178.83 177.61 2g6h h PHE 501 N 0.09 1.19 -0.67 3.99 3.57 -1.86 -1.95 116.94 121.31 2g6h h PHE 501 Ca 0.06 -0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.53 2g6h h PHE 501 Cb 0.04 -0.38 -0.04 0.00 2.79 0.00 0.00 35.95 38.37 2g6h h PHE 501 CO -0.12 0.84 0.43 1.15 -2.23 0.00 0.00 178.31 178.38 2g6h h THR 502 N 1.21 1.14 -0.93 4.41 2.02 -0.26 -1.13 112.91 119.37 2g6h h THR 502 Ca 0.30 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2g6h h THR 502 Cb 0.05 0.19 -0.04 0.00 -1.74 0.00 0.00 68.15 66.61 2g6h h THR 502 CO -0.05 0.16 0.55 -0.33 0.37 0.00 0.00 175.52 176.22 2g6h h GLU 503 N 0.87 1.27 -0.58 6.66 5.08 -0.40 -1.18 114.58 126.30 2g6h h GLU 503 Ca 0.25 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 2g6h h GLU 503 Cb -0.06 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 28.90 2g6h h GLU 503 CO -0.07 0.90 0.21 0.82 -1.00 0.00 0.00 179.01 179.87 2g6h h ILE 504 N 1.29 1.23 -0.52 3.13 2.04 -0.72 0.31 117.51 124.27 2g6h h ILE 504 Ca 0.33 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.44 2g6h h ILE 504 Cb -0.04 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2g6h h ILE 504 CO -0.06 0.29 0.30 0.00 0.00 0.00 0.00 178.15 178.67 2g6h h ILE 506 N 0.70 1.24 0.00 0.00 2.04 -1.01 -0.05 117.51 120.43 2g6h h ILE 506 Ca 0.19 -0.83 -0.05 0.00 1.00 0.00 0.00 64.86 65.17 2g6h h ILE 506 Cb 0.02 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2g6h h ILE 506 CO -0.03 0.32 -0.23 -0.61 0.00 0.00 0.00 178.15 177.60 2g6h h GLN 507 N 0.90 0.00 0.00 2.37 4.15 -0.29 -1.18 115.11 121.05 2g6h h GLN 507 Ca 0.20 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.62 2g6h h GLN 507 Cb 0.28 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.97 2g6h h GLN 507 CO -0.01 0.23 -0.00 1.04 -1.93 0.00 0.00 178.83 178.16 2g6h n GLN 508 N -4.24 0.01 0.00 1.69 1.13 0.40 -4.88 117.38 111.50 2g6h n GLN 508 Ca -0.02 0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.05 2g6h n GLN 508 Cb 0.29 -1.52 0.00 0.00 0.11 0.00 0.00 30.24 29.12 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 1.49 0.78 3.73 1.08 0.00 -0.45 -4.96 105.19 106.86 2g6h n GLY 509 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2g6h n GLY 509 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2g6h s TRP 510 N -1.50 3.16 -0.72 1.61 -0.00 -0.11 -4.95 118.94 116.43 2g6h s TRP 510 Ca 0.00 1.02 -0.18 0.00 -0.00 0.00 0.00 56.10 56.94 2g6h s TRP 510 Cb 0.00 -3.73 0.13 0.00 -0.00 0.00 0.00 33.47 29.87 2g6h s TRP 510 CO 0.00 -2.44 0.83 0.15 -0.00 0.00 0.00 176.95 175.49 2g6h s LYS 511 N 0.29 3.28 0.10 5.86 -0.14 -1.26 -4.38 119.74 123.49 2g6h s LYS 511 Ca 0.61 -1.62 -0.31 0.00 -1.36 0.00 0.00 55.97 53.29 2g6h s LYS 511 Cb -0.39 -4.45 -0.08 0.00 -1.68 0.00 0.00 37.83 31.23 2g6h s LYS 511 CO 0.37 -1.56 1.39 0.00 -0.76 0.00 0.00 175.35 174.78 2g6h s ALA 512 N 2.27 3.58 -0.44 5.17 0.00 -1.26 -4.90 121.76 126.18 2g6h s ALA 512 Ca 0.18 1.09 0.26 0.00 0.00 0.00 0.00 51.96 53.49 2g6h s ALA 512 Cb -0.17 -3.54 0.91 0.00 0.00 0.00 0.00 23.12 20.32 2g6h s ALA 512 CO -0.00 -0.64 1.77 -1.00 0.00 0.00 0.00 175.76 175.88 2g6h h PRO 513 N 6.93 0.00 -6.04 0.00 0.13 -1.99 -3.47 132.00 127.56 2g6h h PRO 513 Ca -0.42 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.32 2g6h h PRO 513 Cb 1.21 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.42 2g6h h PRO 513 CO 0.87 0.00 -0.87 0.54 -0.23 0.00 0.00 178.00 178.30 2g6h n ARG 514 N -2.54 -3.14 -3.15 0.86 1.74 -1.26 -5.04 116.66 104.14 2g6h n ARG 514 Ca 0.03 0.60 -0.17 0.00 -0.77 0.00 0.00 57.85 57.54 2g6h n ARG 514 Cb 0.35 -4.91 -0.01 0.00 -1.02 0.00 0.00 32.46 26.86 2g6h n ARG 514 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2g6h n GLY 515 N -1.57 3.16 0.05 -0.13 0.00 -1.26 -5.04 105.19 100.41 2g6h n GLY 515 Ca -0.19 -2.27 0.13 0.00 0.00 0.00 0.00 46.02 43.69 2g6h n GLY 515 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2g6h n ARG 516 N -1.12 0.17 -3.14 1.61 0.63 -1.26 -4.30 116.66 109.24 2g6h n ARG 516 Ca -0.05 0.09 -0.18 0.00 -0.92 0.00 0.00 57.85 56.80 2g6h n ARG 516 Cb 0.39 -1.65 -0.02 0.00 0.45 0.00 0.00 32.46 31.62 2g6h n ARG 516 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2g6h n PHE 517 N -1.92 -0.21 -3.20 -0.14 3.01 -1.26 -4.32 117.46 109.42 2g6h n PHE 517 Ca 0.05 -3.61 -0.40 0.00 1.01 0.00 0.00 57.45 54.51 2g6h n PHE 517 Cb 0.40 -0.19 -0.06 0.00 -0.01 0.00 0.00 39.48 39.61 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 -2.18 6.59 0.04 4.37 1.01 -1.26 -4.95 116.67 120.29 2g6h s ASP 518 Ca 0.38 0.72 -0.30 0.00 0.71 0.00 0.00 52.55 54.05 2g6h s ASP 518 Cb 0.32 -2.31 -0.07 0.00 1.01 0.00 0.00 42.92 41.88 2g6h s ASP 518 CO -0.08 -0.22 1.49 -0.69 0.21 0.00 0.00 175.17 175.87 2g6h s VAL 519 N 1.79 3.42 0.72 -1.27 1.01 -1.26 -0.94 120.40 123.87 2g6h s VAL 519 Ca 0.25 0.86 -0.13 0.00 0.00 0.00 0.00 61.98 62.96 2g6h s VAL 519 Cb -0.16 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.71 2g6h s VAL 519 CO 0.10 0.01 1.12 -0.76 0.00 0.00 0.00 175.10 175.56 2g6h s LEU 520 N 2.34 3.23 0.66 3.92 1.43 -0.10 -4.87 118.68 125.29 2g6h s LEU 520 Ca 0.67 2.01 -0.07 0.00 -1.03 0.00 0.00 54.13 55.71 2g6h s LEU 520 Cb -0.35 -4.55 0.03 0.00 0.03 0.00 0.00 46.19 41.35 2g6h s LEU 520 CO 0.29 -1.94 0.98 -2.16 0.23 0.00 0.00 176.35 173.75 2g6h s PRO 521 N -4.35 2.62 0.08 1.29 0.04 -1.26 -4.76 135.00 128.66 2g6h s PRO 521 Ca 0.66 -0.02 -0.23 0.00 0.04 0.00 0.00 61.00 61.46 2g6h s PRO 521 Cb -0.21 -2.19 -0.07 0.00 0.04 0.00 0.00 34.50 32.08 2g6h s PRO 521 CO 0.47 -0.97 0.68 -0.51 0.04 0.00 0.00 177.00 176.71 2g6h s LEU 522 N -5.16 4.51 -0.34 -3.56 1.43 0.20 -4.89 118.68 110.87 2g6h s LEU 522 Ca 0.57 1.40 0.02 0.00 -1.03 0.00 0.00 54.13 55.09 2g6h s LEU 522 Cb -0.11 -3.09 0.09 0.00 0.03 0.00 0.00 46.19 43.11 2g6h s LEU 522 CO 0.46 0.17 0.06 -0.22 0.23 0.00 0.00 176.35 177.04 2g6h s LEU 523 N -0.72 4.62 -0.11 1.79 2.96 -1.26 -0.86 118.68 125.10 2g6h s LEU 523 Ca 0.33 -1.95 -0.01 0.00 -0.22 0.00 0.00 54.13 52.28 2g6h s LEU 523 Cb -0.21 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.79 2g6h s LEU 523 CO 0.22 -0.38 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.03 2g6h s LEU 524 N 1.01 3.06 -0.23 -0.68 1.43 0.36 -1.41 118.68 122.23 2g6h s LEU 524 Ca 0.06 -0.14 -0.02 0.00 -1.03 0.00 0.00 54.13 52.99 2g6h s LEU 524 Cb -0.20 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.33 2g6h s LEU 524 CO -0.06 0.24 -0.07 -1.58 0.23 0.00 0.00 176.35 175.12 2g6h s GLN 525 N -0.11 3.10 -0.08 1.70 0.74 -0.46 -0.19 119.66 124.36 2g6h s GLN 525 Ca 0.01 -0.80 0.01 0.00 0.05 0.00 0.00 55.36 54.63 2g6h s GLN 525 Cb -0.13 -2.95 -0.02 0.00 1.10 0.00 0.00 33.01 31.00 2g6h s GLN 525 CO 0.03 -0.29 -0.11 0.00 -0.55 0.00 0.00 175.29 174.37 2g6h s ALA 526 N 1.40 2.76 -1.50 1.58 0.00 -1.26 -0.66 121.76 124.08 2g6h s ALA 526 Ca 0.03 -0.92 -0.13 0.00 0.00 0.00 0.00 51.96 50.94 2g6h s ALA 526 Cb -0.15 -1.14 0.10 0.00 0.00 0.00 0.00 23.12 21.92 2g6h s ALA 526 CO -0.05 0.46 0.75 -1.71 0.00 0.00 0.00 175.76 175.21 2g6h n ASN 527 N 2.69 -4.14 0.00 0.00 4.05 -1.20 -1.16 115.26 115.49 2g6h n ASN 527 Ca -0.18 -0.68 0.00 0.00 0.45 0.00 0.00 54.58 54.17 2g6h n ASN 527 Cb 0.53 -3.36 0.00 0.00 1.23 0.00 0.00 39.78 38.17 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 -1.43 0.48 3.90 8.20 0.00 0.14 -4.51 105.19 111.97 2g6h n GLY 528 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2g6h n GLY 528 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2g6h s ASN 529 N -2.30 4.28 0.44 1.61 0.01 -0.31 -4.87 114.94 113.80 2g6h s ASN 529 Ca 0.00 0.71 -0.24 0.00 -0.71 0.00 0.00 52.86 52.62 2g6h s ASN 529 Cb 0.00 -1.15 -0.08 0.00 0.41 0.00 0.00 41.25 40.44 2g6h s ASN 529 CO 0.00 -2.04 1.26 -1.81 -1.51 0.00 0.00 177.10 172.99 2g6h s ASP 530 N -4.61 6.13 0.59 -1.22 1.01 -1.26 -4.44 116.67 112.88 2g6h s ASP 530 Ca 0.64 2.54 -0.19 0.00 0.71 0.00 0.00 52.55 56.25 2g6h s ASP 530 Cb -0.10 -2.63 -0.04 0.00 1.01 0.00 0.00 42.92 41.17 2g6h s ASP 530 CO 0.50 -0.96 1.18 -2.16 0.21 0.00 0.00 175.17 173.94 2g6h s PRO 531 N -2.47 3.03 0.05 8.23 0.04 -1.26 -4.72 135.00 137.90 2g6h s PRO 531 Ca 0.61 1.75 0.08 0.00 0.04 0.00 0.00 61.00 63.47 2g6h s PRO 531 Cb -0.35 -1.95 -0.03 0.00 0.04 0.00 0.00 34.50 32.22 2g6h s PRO 531 CO 0.44 -1.14 -0.22 -1.21 0.04 0.00 0.00 177.00 174.91 2g6h s GLU 532 N -3.38 1.42 0.11 4.56 2.02 0.73 -4.86 118.70 119.29 2g6h s GLU 532 Ca 0.76 -1.01 -0.18 0.00 0.02 0.00 0.00 54.97 54.56 2g6h s GLU 532 Cb -0.28 -1.57 -0.07 0.00 0.10 0.00 0.00 34.13 32.31 2g6h s GLU 532 CO 0.32 0.40 0.58 -0.51 0.02 0.00 0.00 175.26 176.07 2g6h s LEU 533 N -1.30 4.47 -0.11 1.80 1.43 -1.26 -0.48 118.68 123.23 2g6h s LEU 533 Ca 0.08 1.25 -0.09 0.00 -1.03 0.00 0.00 54.13 54.34 2g6h s LEU 533 Cb -0.09 -3.05 0.03 0.00 0.03 0.00 0.00 46.19 43.11 2g6h s LEU 533 CO 0.02 0.21 0.28 -0.36 0.23 0.00 0.00 176.35 176.74 2g6h s PHE 534 N -1.23 -0.33 -0.21 0.29 0.40 -0.04 -4.97 117.98 111.89 2g6h s PHE 534 Ca 0.32 0.78 -0.13 0.00 -0.60 0.00 0.00 56.93 57.31 2g6h s PHE 534 Cb -0.18 0.11 -0.04 0.00 0.51 0.00 0.00 43.02 43.41 2g6h s PHE 534 CO 0.19 -0.17 0.28 -1.14 0.70 0.00 0.00 175.22 175.08 2g6h s GLN 535 N 0.36 4.15 0.16 0.44 0.74 -1.26 0.61 119.66 124.87 2g6h s GLN 535 Ca -0.02 -0.01 -0.30 0.00 0.05 0.00 0.00 55.36 55.08 2g6h s GLN 535 Cb -0.03 -3.51 -0.08 0.00 1.10 0.00 0.00 33.01 30.48 2g6h s GLN 535 CO -0.01 0.07 1.34 0.42 -0.55 0.00 0.00 175.29 176.55 2g6h s ILE 536 N 1.01 3.26 -0.06 -2.34 1.01 -1.26 -4.90 121.20 117.91 2g6h s ILE 536 Ca 0.14 0.98 -0.34 0.00 0.00 0.00 0.00 60.65 61.42 2g6h s ILE 536 Cb -0.14 -3.63 -0.12 0.00 0.01 0.00 0.00 42.46 38.59 2g6h s ILE 536 CO 0.05 0.12 1.83 -2.65 0.00 0.00 0.00 174.94 174.29 2g6h n PRO 537 N 3.15 2.13 -0.31 2.79 -0.02 -1.26 -4.83 135.00 136.65 2g6h n PRO 537 Ca 0.08 0.78 0.19 0.00 -2.02 0.00 0.00 63.50 62.53 2g6h n PRO 537 Cb 0.43 -2.61 0.45 0.00 -0.02 0.00 0.00 33.50 31.75 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 8.61 0.49 0.00 0.52 0.11 -1.95 0.21 132.00 139.99 2g6h h PRO 538 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2g6h h PRO 538 Cb 1.27 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2g6h h PRO 538 CO 0.94 0.33 0.00 1.05 -0.21 0.00 0.00 178.00 180.11 2g6h h GLU 539 N 0.51 0.00 0.00 1.05 9.09 -2.03 -0.82 114.58 122.38 2g6h h GLU 539 Ca 0.56 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.97 2g6h h GLU 539 Cb 1.23 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.33 2g6h h GLU 539 CO -0.29 0.00 -0.56 1.28 0.05 0.00 0.00 179.01 179.49 2g6h n LEU 540 N -2.63 0.55 -4.39 3.06 4.32 0.73 -4.77 117.00 113.87 2g6h n LEU 540 Ca -0.01 -0.04 -0.44 0.00 -0.02 0.00 0.00 56.01 55.50 2g6h n LEU 540 Cb 0.14 -0.22 -0.07 0.00 -1.62 0.00 0.00 43.42 41.64 2g6h n LEU 540 CO 0.18 0.13 0.04 -0.69 -1.22 0.00 0.00 177.39 175.83 2g6h s VAL 541 N -3.01 5.23 -0.07 4.08 1.01 -0.31 -4.79 120.40 122.54 2g6h s VAL 541 Ca 0.10 -1.07 -0.28 0.00 0.00 0.00 0.00 61.98 60.73 2g6h s VAL 541 Cb 0.17 -4.14 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 2g6h s VAL 541 CO 0.72 -0.59 0.93 -0.22 0.00 0.00 0.00 175.10 175.94 2g6h s LEU 542 N 1.65 4.29 0.11 3.92 2.96 -1.26 -5.01 118.68 125.34 2g6h s LEU 542 Ca 0.04 1.48 0.07 0.00 -0.22 0.00 0.00 54.13 55.50 2g6h s LEU 542 Cb -0.24 -3.45 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 2g6h s LEU 542 CO 0.07 -0.33 -0.17 -1.61 -1.32 0.00 0.00 176.35 172.98 2g6h s GLU 543 N 1.53 1.06 -0.15 1.98 2.02 -1.26 -1.26 118.70 122.62 2g6h s GLU 543 Ca 0.47 -1.19 0.01 0.00 0.02 0.00 0.00 54.97 54.27 2g6h s GLU 543 Cb -0.19 -1.12 0.02 0.00 0.10 0.00 0.00 34.13 32.94 2g6h s GLU 543 CO 0.21 0.24 -0.16 0.08 0.02 0.00 0.00 175.26 175.64 2g6h s VAL 544 N -1.64 1.71 0.16 2.63 1.01 0.27 -4.92 120.40 119.61 2g6h s VAL 544 Ca 0.07 -0.73 -0.30 0.00 0.00 0.00 0.00 61.98 61.02 2g6h s VAL 544 Cb -0.08 -1.58 -0.08 0.00 0.00 0.00 0.00 36.38 34.65 2g6h s VAL 544 CO 0.04 0.48 1.23 -2.84 0.00 0.00 0.00 175.10 174.01 2g6h s PRO 545 N 1.35 4.45 -0.21 2.72 0.02 -1.26 -2.13 135.00 139.95 2g6h s PRO 545 Ca 0.03 1.90 -0.15 0.00 0.02 0.00 0.00 61.00 62.80 2g6h s PRO 545 Cb -0.13 -3.26 -0.04 0.00 0.02 0.00 0.00 34.50 31.09 2g6h s PRO 545 CO -0.10 -0.17 0.35 0.42 -0.33 0.00 0.00 177.00 177.17 2g6h s ILE 546 N 0.29 5.23 0.11 2.83 -1.09 0.63 -4.85 121.20 124.35 2g6h s ILE 546 Ca 0.56 0.61 0.00 0.00 -2.23 0.00 0.00 60.65 59.59 2g6h s ILE 546 Cb -0.33 -3.69 -0.04 0.00 -1.58 0.00 0.00 42.46 36.82 2g6h s ILE 546 CO 0.35 0.27 -0.00 0.00 -1.23 0.00 0.00 174.94 174.32 2g6h s ARG 547 N 1.24 0.87 -0.07 2.79 3.03 -1.26 -4.05 118.95 121.50 2g6h s ARG 547 Ca 0.17 -1.38 -0.01 0.00 2.03 0.00 0.00 55.73 56.54 2g6h s ARG 547 Cb -0.14 0.02 -0.03 0.00 -1.03 0.00 0.00 34.95 33.76 2g6h s ARG 547 CO 0.07 -0.14 -0.01 -1.58 -1.13 0.00 0.00 175.30 172.51 2g6h s HIS 548 N -3.83 3.12 0.51 5.89 2.46 -1.26 -4.26 115.29 117.92 2g6h s HIS 548 Ca 0.17 0.16 0.38 0.00 0.47 0.00 0.00 55.06 56.23 2g6h s HIS 548 Cb 0.07 -1.76 1.99 0.00 -0.13 0.00 0.00 32.58 32.75 2g6h s HIS 548 CO -0.02 0.45 2.24 -1.00 -2.47 0.00 0.00 174.74 173.94 2g6h h PRO 549 N 5.05 0.00 0.00 2.88 0.13 -1.92 -3.30 132.00 134.84 2g6h h PRO 549 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2g6h h PRO 549 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2g6h h PRO 549 CO 0.54 0.02 -0.92 1.63 -0.23 0.00 0.00 178.00 179.05 2g6h n LYS 550 N -3.29 2.19 -3.40 0.86 5.02 -1.26 -4.97 118.16 113.31 2g6h n LYS 550 Ca -0.02 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.83 2g6h n LYS 550 Cb 0.14 -0.96 -0.09 0.00 -0.02 0.00 0.00 35.03 34.11 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 -1.88 3.22 -0.20 2.13 0.08 -1.24 -4.93 117.98 115.16 2g6h s PHE 551 Ca 0.00 -0.68 0.29 0.00 0.12 0.00 0.00 56.93 56.66 2g6h s PHE 551 Cb 0.00 -2.90 1.10 0.00 -0.57 0.00 0.00 43.02 40.65 2g6h s PHE 551 CO 0.00 -0.71 1.85 0.22 -0.10 0.00 0.00 175.22 176.48 2g6h h ASP 552 N 8.71 0.00 1.65 1.36 3.58 -1.93 -2.88 116.42 126.91 2g6h h ASP 552 Ca -0.27 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.18 2g6h h ASP 552 Cb 1.11 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.16 2g6h h ASP 552 CO 0.81 0.00 0.00 4.11 -2.88 0.00 0.00 179.24 181.28 2g6h h TRP 553 N 0.00 0.00 -0.31 0.28 5.08 -1.95 -3.33 115.95 115.71 2g6h h TRP 553 Ca 0.00 0.00 0.06 0.00 1.08 0.00 0.00 58.89 60.03 2g6h h TRP 553 Cb 0.54 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.65 2g6h h TRP 553 CO 0.00 0.00 -0.04 0.35 -1.28 0.00 0.00 178.44 177.47 2g6h h PHE 554 N 0.00 -0.10 -0.62 0.12 3.04 -1.88 0.14 116.94 117.64 2g6h h PHE 554 Ca 0.00 0.03 0.18 0.00 3.98 0.00 0.00 57.97 62.16 2g6h h PHE 554 Cb 0.83 0.09 -0.02 0.00 2.56 0.00 0.00 35.95 39.40 2g6h h PHE 554 CO 0.00 -0.10 0.45 1.57 -2.02 0.00 0.00 178.31 178.21 2g6h h LYS 555 N 0.04 0.00 0.00 1.11 2.10 -1.70 0.23 116.57 118.35 2g6h h LYS 555 Ca 0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 2g6h h LYS 555 Cb 0.22 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.55 2g6h h LYS 555 CO -0.29 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 176.91 2g6h n ASP 556 N -4.32 0.00 0.10 7.07 8.00 0.48 -1.77 116.55 126.11 2g6h n ASP 556 Ca 0.12 -0.39 0.13 0.00 0.71 0.00 0.00 54.79 55.35 2g6h n ASP 556 Cb 0.70 -0.11 0.43 0.00 -0.02 0.00 0.00 41.12 42.12 2g6h n ASP 556 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2g6h n LEU 557 N -1.11 0.75 -1.60 0.64 4.77 0.81 -4.92 117.00 116.34 2g6h n LEU 557 Ca 0.13 0.59 -0.12 0.00 -0.03 0.00 0.00 56.01 56.58 2g6h n LEU 557 Cb 0.10 -0.37 0.01 0.00 -2.33 0.00 0.00 43.42 40.83 2g6h n LEU 557 CO 0.13 -0.24 -0.07 0.61 -1.33 0.00 0.00 177.39 176.50 2g6h n GLY 558 N 1.10 -0.05 3.88 -0.72 0.00 -0.73 -5.01 105.19 103.66 2g6h n GLY 558 Ca 0.05 -0.32 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.71 4.22 0.21 0.99 1.43 -1.26 -5.01 118.68 115.55 2g6h s LEU 559 Ca 0.10 0.81 -0.22 0.00 -1.03 0.00 0.00 54.13 53.79 2g6h s LEU 559 Cb -0.04 -3.51 0.05 0.00 0.03 0.00 0.00 46.19 42.71 2g6h s LEU 559 CO 0.12 -0.01 0.67 -1.59 0.23 0.00 0.00 176.35 175.76 2g6h s LYS 560 N -2.68 1.50 0.19 1.70 -2.85 -1.26 -0.27 119.74 116.07 2g6h s LYS 560 Ca 0.44 -0.71 -0.10 0.00 -1.00 0.00 0.00 55.97 54.60 2g6h s LYS 560 Cb -0.12 0.59 -0.01 0.00 -2.06 0.00 0.00 37.83 36.24 2g6h s LYS 560 CO 0.22 -0.68 0.34 -0.46 0.10 0.00 0.00 175.35 174.88 2g6h s TRP 561 N -3.81 0.41 0.36 1.78 -0.11 -0.90 -4.93 118.94 111.74 2g6h s TRP 561 Ca 0.06 -0.76 -0.06 0.00 1.22 0.00 0.00 56.10 56.56 2g6h s TRP 561 Cb -0.03 0.00 -0.05 0.00 -1.50 0.00 0.00 33.47 31.89 2g6h s TRP 561 CO -0.04 -0.80 0.65 1.52 -4.62 0.00 0.00 176.95 173.66 2g6h s TYR 562 N -3.99 3.49 -0.25 5.86 -0.85 -1.26 -0.57 117.35 119.78 2g6h s TYR 562 Ca 0.20 0.75 0.22 0.00 -0.52 0.00 0.00 57.07 57.72 2g6h s TYR 562 Cb 0.02 -2.21 0.03 0.00 0.38 0.00 0.00 41.96 40.18 2g6h s TYR 562 CO 0.03 0.02 1.11 0.78 -1.52 0.00 0.00 175.55 175.97 2g6h h GLY 563 N 1.24 0.00 -7.56 5.49 0.00 -1.54 -3.46 103.07 97.25 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 0.64 0.00 -0.50 -2.27 0.00 0.00 0.00 176.54 174.42 2g6h s LEU 564 N -5.55 4.82 -0.33 3.11 2.96 -1.26 -4.52 118.68 117.91 2g6h s LEU 564 Ca 0.00 -1.04 -0.23 0.00 -0.22 0.00 0.00 54.13 52.64 2g6h s LEU 564 Cb 0.09 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 44.74 2g6h s LEU 564 CO 0.78 -0.41 0.77 -2.16 -1.32 0.00 0.00 176.35 174.01 2g6h s PRO 565 N 1.56 3.88 -0.46 0.98 0.04 -1.26 -4.71 135.00 135.03 2g6h s PRO 565 Ca 0.02 0.46 0.03 0.00 0.04 0.00 0.00 61.00 61.55 2g6h s PRO 565 Cb -0.20 -3.76 0.15 0.00 0.04 0.00 0.00 34.50 30.74 2g6h s PRO 565 CO 0.07 -0.73 0.30 0.00 0.04 0.00 0.00 177.00 176.67 2g6h s ALA 566 N 2.98 2.06 0.18 8.56 0.00 -1.26 -3.00 121.76 131.29 2g6h s ALA 566 Ca 0.31 -2.65 -0.33 0.00 0.00 0.00 0.00 51.96 49.29 2g6h s ALA 566 Cb -0.14 -1.82 -0.13 0.00 0.00 0.00 0.00 23.12 21.03 2g6h s ALA 566 CO 0.14 -2.05 1.61 0.28 0.00 0.00 0.00 175.76 175.74 2g6h n VAL 567 N 3.21 0.08 -0.61 0.00 0.31 -0.79 -1.21 118.33 119.32 2g6h n VAL 567 Ca 0.16 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 2g6h n VAL 567 Cb 0.38 -1.67 0.00 0.00 -0.91 0.00 0.00 33.84 31.64 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 3.46 0.85 -0.41 4.52 3.41 0.14 -1.62 113.62 123.97 2g6h n SER 568 Ca 0.16 -1.45 0.04 0.00 -0.26 0.00 0.00 58.87 57.35 2g6h n SER 568 Cb 0.31 -0.01 0.10 0.00 -0.26 0.00 0.00 64.21 64.35 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 -0.22 2.62 -4.94 4.04 6.94 -1.23 -4.40 115.26 118.07 2g6h n ASN 569 Ca 0.00 -2.05 -0.21 0.00 -0.02 0.00 0.00 54.58 52.30 2g6h n ASN 569 Cb 0.40 -0.16 0.05 0.00 -2.36 0.00 0.00 39.78 37.71 2g6h n ASN 569 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 2g6h s MET 570 N -1.09 2.42 -0.11 -3.83 -1.94 -1.26 -4.36 119.30 109.13 2g6h s MET 570 Ca 0.16 -0.84 0.01 0.00 -1.71 0.00 0.00 55.69 53.31 2g6h s MET 570 Cb 0.09 -2.47 -0.01 0.00 2.01 0.00 0.00 34.83 34.45 2g6h s MET 570 CO 0.10 -0.82 -0.16 -1.17 -0.01 0.00 0.00 175.02 172.95 2g6h s LEU 571 N -4.81 2.54 -0.30 -0.03 0.20 0.30 -4.32 118.68 112.25 2g6h s LEU 571 Ca 0.59 -0.38 -0.11 0.00 0.69 0.00 0.00 54.13 54.91 2g6h s LEU 571 Cb -0.10 -1.55 -0.04 0.00 -0.43 0.00 0.00 46.19 44.08 2g6h s LEU 571 CO 0.39 0.18 0.20 -0.22 -0.29 0.00 0.00 176.35 176.62 2g6h s LEU 572 N 0.22 4.15 -0.19 -0.68 2.96 -0.43 -0.07 118.68 124.65 2g6h s LEU 572 Ca -0.10 -0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 53.58 2g6h s LEU 572 Cb -0.16 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.38 2g6h s LEU 572 CO 0.06 -0.11 0.04 -0.70 -1.32 0.00 0.00 176.35 174.32 2g6h s GLU 573 N 1.74 3.86 -0.06 1.98 2.12 0.18 -0.49 118.70 128.03 2g6h s GLU 573 Ca 0.07 -0.41 -0.01 0.00 0.36 0.00 0.00 54.97 54.98 2g6h s GLU 573 Cb -0.16 -3.16 0.03 0.00 0.26 0.00 0.00 34.13 31.09 2g6h s GLU 573 CO 0.10 0.19 0.02 0.42 -0.54 0.00 0.00 175.26 175.46 2g6h s ILE 574 N 0.56 0.17 -1.56 -3.70 1.01 -0.57 -1.85 121.20 115.27 2g6h s ILE 574 Ca 0.02 0.24 -0.16 0.00 0.00 0.00 0.00 60.65 60.75 2g6h s ILE 574 Cb -0.13 -0.36 0.13 0.00 0.01 0.00 0.00 42.46 42.10 2g6h s ILE 574 CO 0.02 0.22 0.73 0.61 0.00 0.00 0.00 174.94 176.52 2g6h n GLY 575 N 5.12 -0.46 2.23 6.18 0.00 -1.26 0.00 105.19 117.00 2g6h n GLY 575 Ca -0.07 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.35 3.17 3.77 -0.02 0.00 -1.26 -3.37 105.19 106.13 2g6h n GLY 576 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 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 4.36 -0.26 0.99 1.43 0.10 -4.98 118.68 120.33 2g6h s LEU 577 Ca 0.00 1.96 -0.04 0.00 -1.03 0.00 0.00 54.13 55.02 2g6h s LEU 577 Cb 0.00 -3.95 0.02 0.00 0.03 0.00 0.00 46.19 42.29 2g6h s LEU 577 CO 0.00 -0.14 -0.01 -1.61 0.23 0.00 0.00 176.35 174.82 2g6h s GLU 578 N -1.95 2.98 -0.66 1.70 2.02 -1.26 -1.51 118.70 120.01 2g6h s GLU 578 Ca 0.50 -0.90 -0.12 0.00 0.02 0.00 0.00 54.97 54.47 2g6h s GLU 578 Cb -0.22 -3.12 0.17 0.00 0.10 0.00 0.00 34.13 31.06 2g6h s GLU 578 CO 0.28 -0.39 0.58 -0.06 0.02 0.00 0.00 175.26 175.68 2g6h s PHE 579 N 1.40 3.52 -0.55 1.61 0.40 0.36 -0.02 117.98 124.69 2g6h s PHE 579 Ca 0.02 -1.87 0.23 0.00 -0.60 0.00 0.00 56.93 54.71 2g6h s PHE 579 Cb -0.17 -3.68 0.94 0.00 0.51 0.00 0.00 43.02 40.62 2g6h s PHE 579 CO -0.02 -0.98 1.70 -1.13 0.70 0.00 0.00 175.22 175.50 2g6h n SER 580 N 4.43 0.63 -3.83 1.36 3.41 -1.26 -1.32 113.62 117.04 2g6h n SER 580 Ca 0.02 0.64 -0.30 0.00 -0.26 0.00 0.00 58.87 58.97 2g6h n SER 580 Cb 0.43 -0.78 -0.15 0.00 -0.26 0.00 0.00 64.21 63.44 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 -3.27 1.85 -0.36 7.33 0.00 -1.20 -4.63 121.76 121.48 2g6h s ALA 581 Ca 0.05 -1.72 0.14 0.00 0.00 0.00 0.00 51.96 50.43 2g6h s ALA 581 Cb 0.10 -1.63 0.40 0.00 0.00 0.00 0.00 23.12 21.99 2g6h s ALA 581 CO 0.41 -1.55 0.92 0.00 0.00 0.00 0.00 175.76 175.54 2g6h n PRO 583 N 0.05 1.62 -4.16 0.00 -0.04 -1.20 -4.64 135.00 126.64 2g6h n PRO 583 Ca 0.14 0.58 -0.15 0.00 -0.04 0.00 0.00 63.50 64.03 2g6h n PRO 583 Cb 0.75 -2.25 -0.11 0.00 -0.04 0.00 0.00 33.50 31.85 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 0.47 1.02 0.04 0.54 -0.12 -0.64 -1.22 117.98 118.07 2g6h s PHE 584 Ca 0.79 -0.60 -0.04 0.00 -0.05 0.00 0.00 56.93 57.02 2g6h s PHE 584 Cb -0.80 -0.57 -0.02 0.00 -0.63 0.00 0.00 43.02 41.00 2g6h s PHE 584 CO 0.45 -0.01 0.06 -1.54 -0.05 0.00 0.00 175.22 174.13 2g6h s SER 585 N -2.20 0.24 0.00 1.98 1.04 0.44 -1.88 113.70 113.32 2g6h s SER 585 Ca 0.02 -0.62 0.00 0.00 0.48 0.00 0.00 55.95 55.83 2g6h s SER 585 Cb -0.05 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.28 2g6h s SER 585 CO 0.00 -0.51 0.00 0.61 0.98 0.00 0.00 173.24 174.32 2g6h n GLY 586 N 0.70 4.60 3.15 7.32 0.00 -1.16 -1.60 105.19 118.20 2g6h n GLY 586 Ca -0.18 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 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 3.70 0.21 0.50 1.61 -2.14 -1.26 -4.49 118.94 117.07 2g6h s TRP 587 Ca 0.00 -0.58 -0.19 0.00 2.66 0.00 0.00 56.10 57.99 2g6h s TRP 587 Cb 0.00 -0.13 -0.08 0.00 -3.10 0.00 0.00 33.47 30.16 2g6h s TRP 587 CO 0.00 -0.44 1.04 0.71 -2.66 0.00 0.00 176.95 175.60 2g6h s TYR 588 N -3.21 3.01 -0.16 1.66 1.51 -1.26 -4.92 117.35 113.97 2g6h s TYR 588 Ca 0.00 1.56 -0.07 0.00 -1.01 0.00 0.00 57.07 57.55 2g6h s TYR 588 Cb 0.02 -3.04 -0.04 0.00 -0.11 0.00 0.00 41.96 38.79 2g6h s TYR 588 CO -0.07 -0.85 0.08 1.41 -1.11 0.00 0.00 175.55 175.00 2g6h s MET 589 N -3.40 3.83 0.27 -0.62 -2.45 -1.26 -1.31 119.30 114.36 2g6h s MET 589 Ca 0.66 -0.29 -0.04 0.00 -1.25 0.00 0.00 55.69 54.78 2g6h s MET 589 Cb -0.16 -3.21 0.56 0.00 1.25 0.00 0.00 34.83 33.27 2g6h s MET 589 CO 0.23 0.41 1.60 0.78 1.05 0.00 0.00 175.02 179.10 2g6h h GLY 590 N 6.22 0.98 1.88 2.11 0.00 -1.27 -1.66 103.07 111.33 2g6h h GLY 590 Ca -0.42 0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.06 2g6h h GLY 590 CO 0.68 -0.38 0.05 -0.91 0.00 0.00 0.00 176.54 175.98 2g6h h THR 591 N 0.06 0.19 -0.49 4.70 1.35 -1.94 -0.50 112.91 116.29 2g6h h THR 591 Ca 0.49 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 66.34 2g6h h THR 591 Cb 0.91 0.95 -0.02 0.00 -1.73 0.00 0.00 68.15 68.26 2g6h h THR 591 CO -0.80 0.00 0.26 -0.33 -0.25 0.00 0.00 175.52 174.40 2g6h h GLU 592 N 0.00 0.69 0.00 4.72 5.08 -1.71 -0.06 114.58 123.30 2g6h h GLU 592 Ca 0.01 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2g6h h GLU 592 Cb 0.12 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 2g6h h GLU 592 CO -0.00 0.55 -0.17 0.82 -1.00 0.00 0.00 179.01 179.21 2g6h h ILE 593 N 0.65 0.66 -0.63 3.13 2.04 -1.58 -0.70 117.51 121.08 2g6h h ILE 593 Ca 0.17 -1.54 0.00 0.00 1.00 0.00 0.00 64.86 64.49 2g6h h ILE 593 Cb 0.07 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 2g6h h ILE 593 CO -0.03 0.22 0.40 1.23 0.00 0.00 0.00 178.15 179.97 2g6h h GLY 594 N -1.00 0.90 0.00 5.37 0.00 -1.16 0.13 103.07 107.31 2g6h h GLY 594 Ca -0.03 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2g6h h GLY 594 CO -0.02 0.35 -0.43 -0.62 0.00 0.00 0.00 176.54 175.82 2g6h n VAL 595 N -4.62 1.12 0.15 4.60 0.31 -0.07 -3.91 118.33 115.91 2g6h n VAL 595 Ca 0.05 0.27 -0.07 0.00 -0.01 0.00 0.00 64.34 64.58 2g6h n VAL 595 Cb 0.04 -2.20 -0.03 0.00 -0.91 0.00 0.00 33.84 30.73 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 -0.79 -0.45 -0.32 5.55 2.47 -1.48 -0.40 114.38 118.96 2g6h h ARG 596 Ca 0.00 0.03 -0.07 0.00 -1.26 0.00 0.00 59.98 58.68 2g6h h ARG 596 Cb 0.43 0.10 -0.02 0.00 -1.65 0.00 0.00 29.97 28.84 2g6h h ARG 596 CO 0.00 -0.30 -0.09 -0.44 0.56 0.00 0.00 179.97 179.70 2g6h h ASP 597 N -1.08 0.50 0.22 7.04 3.32 -1.00 -2.07 116.42 123.34 2g6h h ASP 597 Ca -0.05 -0.12 -0.34 0.00 0.02 0.00 0.00 57.03 56.54 2g6h h ASP 597 Cb 0.36 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.74 2g6h h ASP 597 CO 0.08 0.63 -1.99 -1.22 -1.72 0.00 0.00 179.24 175.02 2g6h n TYR 598 N -4.22 0.94 0.69 4.55 0.53 0.44 -2.03 117.16 118.06 2g6h n TYR 598 Ca 0.01 0.25 0.08 0.00 -1.02 0.00 0.00 57.90 57.21 2g6h n TYR 598 Cb 0.30 -1.14 0.00 0.00 -1.03 0.00 0.00 39.34 37.47 2g6h n TYR 598 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2g6h s ASP 600 N -1.83 6.42 0.51 0.00 -0.00 -0.78 -4.68 116.67 116.31 2g6h s ASP 600 Ca 0.13 2.96 0.16 0.00 -0.00 0.00 0.00 52.55 55.81 2g6h s ASP 600 Cb 0.13 -2.66 1.24 0.00 -0.00 0.00 0.00 42.92 41.63 2g6h s ASP 600 CO 0.38 -0.81 2.12 0.78 -0.00 0.00 0.00 175.17 177.64 2g6h h ASN 601 N 3.05 0.05 -0.24 0.27 -0.26 -1.93 -1.52 115.58 115.01 2g6h h ASN 601 Ca -0.50 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.23 2g6h h ASN 601 Cb 1.24 -0.01 0.00 0.00 -1.06 0.00 0.00 38.32 38.49 2g6h h ASN 601 CO 0.64 0.03 0.00 -1.20 -1.06 0.00 0.00 177.43 175.85 2g6h n SER 602 N -4.51 1.80 0.00 5.81 7.64 -1.26 -4.58 113.62 118.51 2g6h n SER 602 Ca -0.01 -1.81 0.00 0.00 1.01 0.00 0.00 58.87 58.06 2g6h n SER 602 Cb 0.15 -0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2g6h n SER 602 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2g6h n ARG 603 N 0.43 1.10 0.21 1.43 5.12 -0.58 -4.30 116.66 120.07 2g6h n ARG 603 Ca 0.15 0.00 0.15 0.00 -1.93 0.00 0.00 57.85 56.22 2g6h n ARG 603 Cb 0.33 0.00 0.60 0.00 -1.16 0.00 0.00 32.46 32.23 2g6h n ARG 603 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 2g6h h TYR 604 N 0.00 0.00 -6.63 -1.55 -1.99 -1.55 -3.42 116.97 101.82 2g6h h TYR 604 Ca 0.00 0.00 -0.51 0.00 2.00 0.00 0.00 58.73 60.22 2g6h h TYR 604 Cb 0.00 0.00 0.02 0.00 2.00 0.00 0.00 36.73 38.75 2g6h h TYR 604 CO 0.00 0.00 -0.97 -1.71 -0.00 0.00 0.00 178.16 175.48 2g6h n ASN 605 N -2.70 -4.74 -1.02 3.88 4.05 -0.53 -4.90 115.26 109.31 2g6h n ASN 605 Ca 0.01 -1.14 0.12 0.00 0.45 0.00 0.00 54.58 54.03 2g6h n ASN 605 Cb 0.27 -2.35 0.21 0.00 1.23 0.00 0.00 39.78 39.14 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 -4.41 0.31 -0.09 -1.44 -5.35 -0.63 -4.60 119.36 103.14 2g6h n ILE 606 Ca -0.12 -0.62 -0.06 0.00 -0.27 0.00 0.00 62.75 61.68 2g6h n ILE 606 Cb 0.58 1.06 0.01 0.00 -1.74 0.00 0.00 39.64 39.55 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 4.27 -0.20 0.43 7.28 3.38 -1.88 -1.76 115.31 126.83 2g6h h LEU 607 Ca 0.00 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2g6h h LEU 607 Cb 0.93 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2g6h h LEU 607 CO 0.00 -0.06 -0.28 -0.33 0.09 0.00 0.00 178.44 177.85 2g6h h GLU 608 N 0.06 -0.67 -0.88 1.13 5.08 -1.99 0.63 114.58 117.93 2g6h h GLU 608 Ca 0.16 0.05 0.12 0.00 -1.00 0.00 0.00 59.36 58.68 2g6h h GLU 608 Cb 0.23 0.15 -0.07 0.00 0.50 0.00 0.00 28.75 29.57 2g6h h GLU 608 CO -0.30 -0.44 0.57 1.49 -1.00 0.00 0.00 179.01 179.33 2g6h h GLU 609 N -0.69 0.77 -0.20 2.33 4.81 -1.84 0.07 114.58 119.83 2g6h h GLU 609 Ca -0.04 -0.05 -0.19 0.00 -0.13 0.00 0.00 59.36 58.95 2g6h h GLU 609 Cb 0.58 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.78 2g6h h GLU 609 CO 0.03 0.51 -0.63 0.28 -0.73 0.00 0.00 179.01 178.47 2g6h h VAL 610 N 0.80 1.30 -0.31 0.32 2.07 -1.04 -2.92 116.25 116.46 2g6h h VAL 610 Ca 0.42 -1.86 -0.08 0.00 0.82 0.00 0.00 66.70 66.00 2g6h h VAL 610 Cb 0.53 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 32.11 2g6h h VAL 610 CO -0.19 0.59 -0.14 0.00 0.02 0.00 0.00 177.57 177.85 2g6h h ALA 611 N 0.76 1.17 0.73 1.67 0.00 0.55 -2.70 119.26 121.45 2g6h h ALA 611 Ca -0.01 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 2g6h h ALA 611 Cb 1.22 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.88 2g6h h ALA 611 CO 0.13 0.53 -0.35 0.87 0.00 0.00 0.00 179.25 180.42 2g6h h LYS 612 N 0.50 -0.95 -0.76 0.00 1.57 -0.97 -2.31 116.57 113.65 2g6h h LYS 612 Ca 0.09 0.06 0.22 0.00 -1.87 0.00 0.00 60.65 59.15 2g6h h LYS 612 Cb 0.54 0.21 -0.03 0.00 0.08 0.00 0.00 32.23 33.03 2g6h h LYS 612 CO 0.03 -0.62 0.64 0.87 -0.57 0.00 0.00 179.45 179.81 2g6h h LYS 613 N -1.03 0.00 -0.01 3.15 1.79 -1.42 1.13 116.57 120.19 2g6h h LYS 613 Ca -0.10 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.37 2g6h h LYS 613 Cb 0.76 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.41 2g6h h LYS 613 CO 0.16 0.00 -0.16 -1.33 -1.08 0.00 0.00 179.45 177.04 2g6h n MET 614 N -3.97 0.95 -3.60 3.15 2.81 -0.99 -4.95 117.12 110.52 2g6h n MET 614 Ca 0.16 -0.49 -0.26 0.00 -1.81 0.00 0.00 57.70 55.29 2g6h n MET 614 Cb 0.91 -1.49 0.04 0.00 -0.71 0.00 0.00 33.22 31.97 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 -0.59 -5.65 -4.90 7.83 -0.08 0.39 -4.97 116.55 108.57 2g6h n ASP 615 Ca 0.14 -0.89 -0.30 0.00 -1.51 0.00 0.00 54.79 52.24 2g6h n ASP 615 Cb 0.32 -3.52 -0.04 0.00 2.34 0.00 0.00 41.12 40.22 2g6h n ASP 615 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2g6h s LEU 616 N -5.98 4.26 -0.67 -2.67 1.43 -1.01 -5.02 118.68 109.02 2g6h s LEU 616 Ca 0.38 0.19 -0.26 0.00 -1.03 0.00 0.00 54.13 53.41 2g6h s LEU 616 Cb -0.13 -2.86 -0.03 0.00 0.03 0.00 0.00 46.19 43.20 2g6h s LEU 616 CO 0.85 0.14 1.87 -0.62 0.23 0.00 0.00 176.35 178.82 2g6h s ASP 617 N -2.69 5.25 -0.10 2.29 3.68 -1.26 -4.78 116.67 119.05 2g6h s ASP 617 Ca 0.34 0.14 0.18 0.00 2.13 0.00 0.00 52.55 55.33 2g6h s ASP 617 Cb -0.12 -2.54 0.69 0.00 -1.45 0.00 0.00 42.92 39.50 2g6h s ASP 617 CO 0.27 -2.45 1.59 0.23 0.13 0.00 0.00 175.17 174.94 2g6h n MET 618 N 9.13 3.56 -0.09 4.34 2.81 -1.26 -4.37 117.12 131.24 2g6h n MET 618 Ca 0.24 -2.72 -0.14 0.00 -1.81 0.00 0.00 57.70 53.27 2g6h n MET 618 Cb 0.51 -1.86 -0.04 0.00 -0.71 0.00 0.00 33.22 31.12 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 3.93 0.83 -4.32 0.03 3.08 -2.03 -3.45 114.38 112.44 2g6h h ARG 619 Ca 0.00 -0.50 -0.40 0.00 0.07 0.00 0.00 59.98 59.15 2g6h h ARG 619 Cb 1.37 0.05 -0.31 0.00 0.08 0.00 0.00 29.97 31.16 2g6h h ARG 619 CO 0.21 1.13 -0.78 -1.59 -1.07 0.00 0.00 179.97 177.88 2g6h s LYS 620 N -4.20 0.81 0.41 0.04 -2.85 -1.26 -5.04 119.74 107.64 2g6h s LYS 620 Ca -0.11 -0.21 0.14 0.00 -1.00 0.00 0.00 55.97 54.79 2g6h s LYS 620 Cb 0.10 -0.78 1.00 0.00 -2.06 0.00 0.00 37.83 36.09 2g6h s LYS 620 CO 0.87 0.04 1.89 1.79 0.10 0.00 0.00 175.35 180.04 2g6h h THR 621 N 5.61 0.77 0.00 3.79 1.35 -1.90 -1.66 112.91 120.87 2g6h h THR 621 Ca -0.34 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.35 2g6h h THR 621 Cb 1.17 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 2g6h h THR 621 CO 0.49 0.09 0.00 -1.54 -0.25 0.00 0.00 175.52 174.30 2g6h n SER 622 N -4.51 0.00 -0.03 5.36 3.41 -1.26 0.29 113.62 116.88 2g6h n SER 622 Ca 0.16 0.06 0.13 0.00 -0.26 0.00 0.00 58.87 58.96 2g6h n SER 622 Cb 0.56 -0.11 0.50 0.00 -0.26 0.00 0.00 64.21 64.89 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 -1.11 0.27 -3.87 4.04 3.41 -0.62 -4.92 113.62 110.82 2g6h n SER 623 Ca 0.01 0.00 -0.29 0.00 -0.26 0.00 0.00 58.87 58.34 2g6h n SER 623 Cb 0.01 -0.15 0.03 0.00 -0.26 0.00 0.00 64.21 63.84 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 -1.37 -2.66 0.04 1.04 4.77 0.14 -4.87 117.00 114.09 2g6h n LEU 624 Ca 0.08 -0.78 -0.03 0.00 -0.03 0.00 0.00 56.01 55.25 2g6h n LEU 624 Cb 0.32 -2.59 0.20 0.00 -2.33 0.00 0.00 43.42 39.03 2g6h n LEU 624 CO 0.29 0.47 0.69 4.11 -1.33 0.00 0.00 177.39 181.61 2g6h h TRP 625 N -2.07 0.46 -0.37 -1.77 5.08 -1.81 -0.69 115.95 114.77 2g6h h TRP 625 Ca -0.59 -0.11 -0.04 0.00 1.08 0.00 0.00 58.89 59.24 2g6h h TRP 625 Cb 1.37 -0.11 -0.02 0.00 -3.00 0.00 0.00 29.16 27.41 2g6h h TRP 625 CO 0.55 0.68 0.08 0.87 -1.28 0.00 0.00 178.44 179.34 2g6h h LYS 626 N 0.35 0.61 -0.61 0.12 1.57 -1.89 -1.63 116.57 115.08 2g6h h LYS 626 Ca 0.04 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 2g6h h LYS 626 Cb 0.74 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 2g6h h LYS 626 CO 0.06 0.66 0.11 -0.44 -0.57 0.00 0.00 179.45 179.26 2g6h h ASP 627 N 0.46 0.97 -0.39 0.86 5.19 -1.87 -1.14 116.42 120.50 2g6h h ASP 627 Ca 0.12 -0.26 -0.03 0.00 -0.62 0.00 0.00 57.03 56.24 2g6h h ASP 627 Cb 0.33 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.57 2g6h h ASP 627 CO 0.00 0.98 0.11 1.56 -3.12 0.00 0.00 179.24 178.78 2g6h h GLN 628 N 0.92 0.61 -0.52 3.56 4.20 -0.98 -2.55 115.11 120.36 2g6h h GLN 628 Ca 0.19 -0.14 -0.07 0.00 0.06 0.00 0.00 58.65 58.69 2g6h h GLN 628 Cb 0.42 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.09 2g6h h GLN 628 CO 0.01 0.62 0.02 0.00 -0.67 0.00 0.00 178.83 178.82 2g6h h ALA 629 N 0.96 1.06 -0.02 3.87 0.00 -1.19 -2.91 119.26 121.04 2g6h h ALA 629 Ca 0.12 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.78 2g6h h ALA 629 Cb 0.27 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2g6h h ALA 629 CO -0.00 0.59 -0.06 1.25 0.00 0.00 0.00 179.25 181.03 2g6h h LEU 630 N 0.80 -0.18 -0.28 0.00 5.85 -1.01 -1.27 115.31 119.22 2g6h h LEU 630 Ca 0.16 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.96 2g6h h LEU 630 Cb 0.45 0.08 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 2g6h h LEU 630 CO 0.02 -0.09 -0.05 0.58 -0.34 0.00 0.00 178.44 178.56 2g6h h VAL 631 N -0.10 0.74 -0.17 1.05 2.07 -1.34 -0.97 116.25 117.53 2g6h h VAL 631 Ca 0.03 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.58 2g6h h VAL 631 Cb 0.14 0.72 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2g6h h VAL 631 CO -0.08 0.00 -0.09 -0.33 0.02 0.00 0.00 177.57 177.09 2g6h h GLU 632 N 0.02 -0.08 -0.98 1.57 4.39 -1.29 0.12 114.58 118.34 2g6h h GLU 632 Ca 0.14 0.01 0.08 0.00 0.34 0.00 0.00 59.36 59.92 2g6h h GLU 632 Cb 0.20 0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.80 2g6h h GLU 632 CO -0.27 -0.05 0.63 0.82 -1.16 0.00 0.00 179.01 178.97 2g6h h ILE 633 N -0.08 1.05 0.00 3.13 2.04 -0.88 0.35 117.51 123.11 2g6h h ILE 633 Ca 0.10 -0.38 -0.12 0.00 1.00 0.00 0.00 64.86 65.46 2g6h h ILE 633 Cb 0.23 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.13 2g6h h ILE 633 CO -0.22 0.20 -0.55 0.78 0.00 0.00 0.00 178.15 178.36 2g6h h ASN 634 N 1.11 0.00 -0.54 1.72 2.35 -0.22 -2.07 115.58 117.93 2g6h h ASN 634 Ca 0.44 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 56.08 2g6h h ASN 634 Cb 0.23 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 2g6h h ASN 634 CO -0.19 0.55 -0.09 0.40 -1.65 0.00 0.00 177.43 176.45 2g6h h ILE 635 N 0.00 1.27 -0.49 2.81 2.04 0.69 -2.82 117.51 121.01 2g6h h ILE 635 Ca -0.01 -1.24 -0.03 0.00 1.00 0.00 0.00 64.86 64.58 2g6h h ILE 635 Cb 0.98 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 38.01 2g6h h ILE 635 CO 0.07 0.44 0.18 0.00 0.00 0.00 0.00 178.15 178.84 2g6h h ALA 636 N 0.93 0.64 0.34 1.87 0.00 -0.63 -1.29 119.26 121.11 2g6h h ALA 636 Ca 0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2g6h h ALA 636 Cb 0.65 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2g6h h ALA 636 CO 0.04 0.27 -0.18 0.28 0.00 0.00 0.00 179.25 179.67 2g6h h VAL 637 N 0.66 0.64 -0.49 0.00 2.07 -1.31 -0.51 116.25 117.30 2g6h h VAL 637 Ca 0.16 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.69 2g6h h VAL 637 Cb 0.23 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2g6h h VAL 637 CO -0.01 0.00 0.32 -0.07 0.02 0.00 0.00 177.57 177.83 2g6h h LEU 638 N -0.48 0.54 0.18 2.57 3.38 -1.48 -2.20 115.31 117.83 2g6h h LEU 638 Ca -0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2g6h h LEU 638 Cb 0.38 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2g6h h LEU 638 CO 0.06 0.39 -0.15 0.22 0.09 0.00 0.00 178.44 179.06 2g6h h TYR 639 N 0.65 -0.38 -0.37 1.13 3.20 -1.12 -1.56 116.97 118.52 2g6h h TYR 639 Ca 0.18 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.09 2g6h h TYR 639 Cb -0.06 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.32 2g6h h TYR 639 CO -0.05 -0.22 0.15 0.77 -1.64 0.00 0.00 178.16 177.17 2g6h h SER 640 N -0.34 0.20 -0.32 -2.11 0.02 -0.96 0.18 113.55 110.22 2g6h h SER 640 Ca -0.01 0.03 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2g6h h SER 640 Cb 0.31 -0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 2g6h h SER 640 CO -0.02 0.15 0.17 -0.26 -1.14 0.00 0.00 176.83 175.74 2g6h h PHE 641 N 0.33 0.43 -0.62 3.45 -1.00 -1.33 -2.12 116.94 116.08 2g6h h PHE 641 Ca 0.16 -0.01 -0.01 0.00 2.81 0.00 0.00 57.97 60.92 2g6h h PHE 641 Cb 0.11 -0.14 -0.03 0.00 3.61 0.00 0.00 35.95 39.50 2g6h h PHE 641 CO -0.12 0.35 0.33 1.96 -1.61 0.00 0.00 178.31 179.22 2g6h h GLN 642 N 0.39 0.87 -0.24 1.51 4.20 -0.98 0.45 115.11 121.32 2g6h h GLN 642 Ca 0.11 -0.11 0.01 0.00 0.06 0.00 0.00 58.65 58.72 2g6h h GLN 642 Cb 0.06 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 2g6h h GLN 642 CO -0.02 0.67 0.13 0.77 -0.67 0.00 0.00 178.83 179.71 2g6h h SER 643 N 0.84 0.21 0.00 1.46 0.02 -0.82 -0.79 113.55 114.47 2g6h h SER 643 Ca 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.17 2g6h h SER 643 Cb 0.06 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.57 2g6h h SER 643 CO -0.03 0.15 0.00 0.47 -1.14 0.00 0.00 176.83 176.28 2g6h n ASP 644 N -4.97 0.00 -3.51 3.07 8.00 -0.81 -4.89 116.55 113.45 2g6h n ASP 644 Ca -0.02 -1.30 -0.25 0.00 0.71 0.00 0.00 54.79 53.93 2g6h n ASP 644 Cb 0.05 0.00 0.05 0.00 -0.02 0.00 0.00 41.12 41.20 2g6h n ASP 644 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2g6h n LYS 645 N -0.76 -6.45 -3.86 -1.24 5.02 -0.30 -4.99 118.16 105.58 2g6h n LYS 645 Ca 0.11 0.78 -0.35 0.00 -2.02 0.00 0.00 58.31 56.83 2g6h n LYS 645 Cb 0.05 -5.74 -0.09 0.00 -0.02 0.00 0.00 35.03 29.23 2g6h n LYS 645 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2g6h s VAL 646 N -3.26 5.01 0.20 -0.18 1.01 0.03 -4.35 120.40 118.86 2g6h s VAL 646 Ca 0.52 0.05 -0.32 0.00 0.00 0.00 0.00 61.98 62.23 2g6h s VAL 646 Cb -0.24 -3.28 -0.15 0.00 0.00 0.00 0.00 36.38 32.71 2g6h s VAL 646 CO 0.65 0.42 1.29 0.41 0.00 0.00 0.00 175.10 177.87 2g6h n THR 647 N 3.78 0.88 -3.55 3.92 -1.04 0.13 -4.34 114.28 114.07 2g6h n THR 647 Ca -0.16 -0.22 -0.13 0.00 -2.04 0.00 0.00 64.05 61.50 2g6h n THR 647 Cb 0.52 -1.14 -0.05 0.00 -1.82 0.00 0.00 70.33 67.84 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 -0.09 0.00 -0.02 12.58 2.07 -1.26 -4.41 121.20 130.06 2g6h s ILE 648 Ca 0.71 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.98 2g6h s ILE 648 Cb -0.76 -1.00 -0.00 0.00 0.13 0.00 0.00 42.46 40.83 2g6h s ILE 648 CO 0.51 0.00 -0.11 0.54 -1.91 0.00 0.00 174.94 173.96 2g6h s VAL 649 N -1.34 0.93 0.66 4.00 0.11 -0.43 -5.00 120.40 119.34 2g6h s VAL 649 Ca -0.04 -0.46 -0.11 0.00 -2.93 0.00 0.00 61.98 58.43 2g6h s VAL 649 Cb -0.00 -0.80 -0.01 0.00 -1.53 0.00 0.00 36.38 34.04 2g6h s VAL 649 CO 0.04 0.28 1.06 1.51 -3.33 0.00 0.00 175.10 174.65 2g6h s ASP 650 N -0.01 5.79 0.43 3.54 -4.77 -1.26 -0.76 116.67 119.63 2g6h s ASP 650 Ca -0.00 1.23 0.13 0.00 -3.30 0.00 0.00 52.55 50.61 2g6h s ASP 650 Cb -0.07 -2.15 0.93 0.00 -1.09 0.00 0.00 42.92 40.53 2g6h s ASP 650 CO 0.00 -1.12 1.96 1.12 0.70 0.00 0.00 175.17 177.83 2g6h h HIS 651 N -0.48 0.06 0.03 2.11 2.07 -1.98 -0.82 115.15 116.14 2g6h h HIS 651 Ca -0.45 -0.01 -0.00 0.00 -2.85 0.00 0.00 60.37 57.07 2g6h h HIS 651 Cb 1.23 -0.02 0.00 0.00 2.57 0.00 0.00 27.41 31.19 2g6h h HIS 651 CO 0.57 0.24 -0.01 0.45 -3.07 0.00 0.00 177.93 176.10 2g6h h HIS 652 N 0.05 -0.04 -0.22 6.12 3.86 -1.95 -1.16 115.15 121.81 2g6h h HIS 652 Ca 0.01 -0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2g6h h HIS 652 Cb 0.36 0.01 -0.01 0.00 1.06 0.00 0.00 27.41 28.84 2g6h h HIS 652 CO 0.00 0.27 0.07 1.03 0.86 0.00 0.00 177.93 180.17 2g6h h SER 653 N -0.35 0.31 -0.75 2.45 0.87 -1.91 -2.03 113.55 112.14 2g6h h SER 653 Ca -0.00 -0.19 -0.03 0.00 -1.23 0.00 0.00 61.79 60.34 2g6h h SER 653 Cb 0.33 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 62.17 2g6h h SER 653 CO 0.01 0.42 0.37 0.00 -0.53 0.00 0.00 176.83 177.10 2g6h h ALA 654 N 0.90 0.97 -0.19 6.23 0.00 -1.16 -1.76 119.26 124.25 2g6h h ALA 654 Ca 0.07 -0.15 -0.18 0.00 0.00 0.00 0.00 54.91 54.65 2g6h h ALA 654 Cb 0.22 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 2g6h h ALA 654 CO -0.00 0.53 -0.62 1.79 0.00 0.00 0.00 179.25 180.95 2g6h h THR 655 N 1.06 1.31 -0.50 0.00 1.35 -1.14 -1.21 112.91 113.77 2g6h h THR 655 Ca 0.26 -1.86 -0.01 0.00 -0.55 0.00 0.00 66.41 64.25 2g6h h THR 655 Cb 0.11 1.82 -0.02 0.00 -1.73 0.00 0.00 68.15 68.33 2g6h h THR 655 CO -0.03 0.59 0.28 -0.08 -0.25 0.00 0.00 175.52 176.02 2g6h h GLU 656 N 0.49 0.70 -0.66 4.72 4.81 -1.24 -1.51 114.58 121.90 2g6h h GLU 656 Ca -0.01 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2g6h h GLU 656 Cb 1.20 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 2g6h h GLU 656 CO 0.12 0.54 0.39 0.77 -0.73 0.00 0.00 179.01 180.10 2g6h h SER 657 N 0.67 0.80 -0.65 1.04 0.02 -1.19 -2.47 113.55 111.78 2g6h h SER 657 Ca 0.18 -0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.05 2g6h h SER 657 Cb 0.04 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.34 2g6h h SER 657 CO -0.03 0.63 0.37 0.15 -1.14 0.00 0.00 176.83 176.81 2g6h h PHE 658 N 0.89 0.89 -0.50 3.45 3.57 -0.75 0.41 116.94 124.91 2g6h h PHE 658 Ca 0.24 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 2g6h h PHE 658 Cb -0.01 -0.29 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 2g6h h PHE 658 CO -0.01 0.62 0.23 0.82 -2.23 0.00 0.00 178.31 177.74 2g6h h ILE 659 N 0.92 1.20 -0.35 1.41 1.08 -0.85 0.31 117.51 121.22 2g6h h ILE 659 Ca 0.24 -0.57 -0.02 0.00 -0.39 0.00 0.00 64.86 64.12 2g6h h ILE 659 Cb 0.01 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.39 2g6h h ILE 659 CO -0.04 0.22 0.15 0.11 -0.69 0.00 0.00 178.15 177.90 2g6h h LYS 660 N 0.66 0.52 -0.67 2.37 1.57 -1.01 -0.58 116.57 119.43 2g6h h LYS 660 Ca 0.17 -0.09 0.03 0.00 -1.87 0.00 0.00 60.65 58.90 2g6h h LYS 660 Cb 0.13 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 2g6h h LYS 660 CO -0.02 0.49 0.41 1.25 -0.57 0.00 0.00 179.45 181.01 2g6h h HIS 661 N 0.43 0.77 -0.06 -1.35 2.76 -0.56 -0.92 115.15 116.22 2g6h h HIS 661 Ca 0.12 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.31 2g6h h HIS 661 Cb 0.16 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 28.86 2g6h h HIS 661 CO -0.01 0.43 0.03 1.98 -1.30 0.00 0.00 177.93 179.07 2g6h h MET 662 N 0.80 0.08 -0.55 5.26 -1.53 -0.07 -0.58 114.93 118.35 2g6h h MET 662 Ca 0.27 -0.01 0.02 0.00 -3.44 0.00 0.00 59.70 56.54 2g6h h MET 662 Cb 0.04 -0.02 -0.03 0.00 -0.55 0.00 0.00 31.60 31.04 2g6h h MET 662 CO -0.11 0.14 0.34 0.93 0.14 0.00 0.00 176.91 178.34 2g6h h GLU 663 N 0.01 0.66 -0.37 0.39 5.08 -0.81 -1.36 114.58 118.17 2g6h h GLU 663 Ca 0.02 -0.04 0.05 0.00 -1.00 0.00 0.00 59.36 58.39 2g6h h GLU 663 Cb 0.08 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 2g6h h GLU 663 CO -0.00 0.43 0.11 -0.97 -1.00 0.00 0.00 179.01 177.58 2g6h h ASN 664 N 0.67 0.10 -0.86 1.42 -1.24 -0.87 -1.77 115.58 113.03 2g6h h ASN 664 Ca 0.22 0.05 0.02 0.00 0.71 0.00 0.00 56.30 57.30 2g6h h ASN 664 Cb 0.00 0.05 -0.05 0.00 0.73 0.00 0.00 38.32 39.05 2g6h h ASN 664 CO -0.09 0.09 0.56 -0.33 -1.29 0.00 0.00 177.43 176.38 2g6h h GLU 665 N 0.25 1.07 -0.21 6.67 4.39 -0.58 0.35 114.58 126.52 2g6h h GLU 665 Ca 0.17 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 2g6h h GLU 665 Cb 0.17 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 2g6h h GLU 665 CO -0.19 0.71 0.00 1.88 -1.16 0.00 0.00 179.01 180.25 2g6h h TYR 666 N 1.10 0.39 -0.45 4.33 -1.99 -0.78 0.48 116.97 120.05 2g6h h TYR 666 Ca 0.33 -0.07 -0.10 0.00 2.00 0.00 0.00 58.73 60.89 2g6h h TYR 666 Cb -0.03 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.58 2g6h h TYR 666 CO -0.00 0.55 -0.11 0.00 -0.00 0.00 0.00 178.16 178.59 2g6h h ARG 667 N 0.13 0.88 0.00 4.88 3.08 -0.78 0.46 114.38 123.02 2g6h h ARG 667 Ca 0.06 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.76 2g6h h ARG 667 Cb 0.39 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.39 2g6h h ARG 667 CO 0.01 0.98 -1.48 0.00 -1.07 0.00 0.00 179.97 178.41 2g6h n ARG 669 N -2.49 4.06 -0.36 0.00 0.63 0.16 -5.02 116.66 113.64 2g6h n ARG 669 Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 2g6h n ARG 669 Cb 0.57 -0.61 0.00 0.00 0.45 0.00 0.00 32.46 32.87 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 1.33 0.76 0.00 5.14 0.00 0.15 -4.59 105.19 107.98 2g6h n GLY 670 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.20 -2.80 3.15 -0.02 0.00 -1.07 -0.50 105.19 101.74 2g6h n GLY 671 Ca 0.00 -1.31 0.04 0.00 0.00 0.00 0.00 46.02 44.75 2g6h n GLY 671 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g6h n PRO 673 N 5.19 2.79 -3.80 0.00 -0.04 -1.26 -4.65 135.00 133.23 2g6h n PRO 673 Ca 0.06 1.00 -0.13 0.00 -0.04 0.00 0.00 63.50 64.40 2g6h n PRO 673 Cb 0.55 -2.84 -0.13 0.00 -0.04 0.00 0.00 33.50 31.03 2g6h n PRO 673 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g6h s ALA 674 N 0.97 -0.28 -0.50 0.55 0.00 0.33 -4.20 121.76 118.63 2g6h s ALA 674 Ca 0.73 0.45 -0.15 0.00 0.00 0.00 0.00 51.96 52.99 2g6h s ALA 674 Cb -0.50 -0.29 0.10 0.00 0.00 0.00 0.00 23.12 22.44 2g6h s ALA 674 CO 0.35 -0.09 0.43 0.34 0.00 0.00 0.00 175.76 176.79 2g6h s ASP 675 N 0.45 6.12 0.25 0.00 -1.08 -0.04 -3.53 116.67 118.83 2g6h s ASP 675 Ca -0.03 -1.56 -0.04 0.00 -0.52 0.00 0.00 52.55 50.40 2g6h s ASP 675 Cb -0.05 -2.18 0.44 0.00 -1.46 0.00 0.00 42.92 39.67 2g6h s ASP 675 CO -0.02 -0.73 1.78 -0.25 0.52 0.00 0.00 175.17 176.47 2g6h h TRP 676 N 8.78 0.74 -0.76 -5.34 7.01 -1.93 0.13 115.95 124.58 2g6h h TRP 676 Ca -0.28 0.03 0.12 0.00 2.11 0.00 0.00 58.89 60.87 2g6h h TRP 676 Cb 1.10 -0.21 -0.05 0.00 -2.10 0.00 0.00 29.16 27.90 2g6h h TRP 676 CO 0.67 0.24 0.50 0.28 -2.79 0.00 0.00 178.44 177.34 2g6h h VAL 677 N 0.66 0.87 0.06 2.65 2.07 -1.92 -2.05 116.25 118.58 2g6h h VAL 677 Ca 0.41 -0.19 -0.35 0.00 0.82 0.00 0.00 66.70 67.39 2g6h h VAL 677 Cb 0.49 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 2g6h h VAL 677 CO -0.31 0.10 -2.05 0.79 0.02 0.00 0.00 177.57 176.12 2g6h n TRP 678 N -4.50 0.84 -0.17 1.57 7.02 -0.71 -4.47 117.44 117.03 2g6h n TRP 678 Ca 0.14 0.22 -0.08 0.00 -1.02 0.00 0.00 57.50 56.75 2g6h n TRP 678 Cb 0.43 -1.12 0.01 0.00 -2.42 0.00 0.00 31.31 28.20 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 0.03 1.22 -2.75 -0.99 1.08 -0.54 -3.42 117.51 112.14 2g6h h ILE 679 Ca -0.43 -0.69 -0.54 0.00 -0.39 0.00 0.00 64.86 62.81 2g6h h ILE 679 Cb 2.03 0.76 0.02 0.00 -3.07 0.00 0.00 36.82 36.55 2g6h h ILE 679 CO 0.05 0.26 0.95 -0.69 -0.69 0.00 0.00 178.15 178.02 2g6h s VAL 680 N -5.49 3.22 0.59 1.67 1.01 -0.79 -4.93 120.40 115.67 2g6h s VAL 680 Ca -0.13 0.66 -0.20 0.00 0.00 0.00 0.00 61.98 62.31 2g6h s VAL 680 Cb 0.11 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 2g6h s VAL 680 CO 0.78 -0.00 1.20 -2.65 0.00 0.00 0.00 175.10 174.43 2g6h n PRO 681 N 5.48 1.24 0.00 2.72 -0.02 -1.26 -4.88 135.00 138.28 2g6h n PRO 681 Ca 0.15 0.47 0.04 0.00 -2.02 0.00 0.00 63.50 62.15 2g6h n PRO 681 Cb 0.41 -2.41 0.26 0.00 -0.02 0.00 0.00 33.50 31.74 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 -1.26 0.48 -3.80 0.52 -0.04 -1.26 -4.22 135.00 125.42 2g6h n PRO 682 Ca 0.13 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.48 2g6h n PRO 682 Cb 0.46 -1.28 -0.08 0.00 -0.04 0.00 0.00 33.50 32.55 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 -2.00 0.69 -1.29 0.54 0.23 -1.26 -4.91 119.30 111.30 2g6h s MET 683 Ca 0.13 -0.45 -0.08 0.00 -1.03 0.00 0.00 55.69 54.26 2g6h s MET 683 Cb 0.06 0.30 0.06 0.00 -1.53 0.00 0.00 34.83 33.72 2g6h s MET 683 CO 0.10 -0.20 0.46 0.43 -2.03 0.00 0.00 175.02 173.78 2g6h n SER 684 N 0.92 -3.94 -0.19 -1.18 7.64 -1.26 -4.87 113.62 110.74 2g6h n SER 684 Ca -0.20 -0.33 -0.05 0.00 1.01 0.00 0.00 58.87 59.30 2g6h n SER 684 Cb 0.58 -3.26 -0.04 0.00 -1.01 0.00 0.00 64.21 60.48 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 -1.18 -2.61 0.00 0.23 0.00 -1.26 -1.69 105.19 98.68 2g6h n GLY 685 Ca -0.03 0.80 0.08 0.00 0.00 0.00 0.00 46.02 46.86 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 -3.99 0.00 -0.74 1.61 3.41 -1.26 -1.87 113.62 110.77 2g6h n SER 686 Ca 0.01 0.31 0.08 0.00 -0.26 0.00 0.00 58.87 59.01 2g6h n SER 686 Cb 0.11 -0.41 0.25 0.00 -0.26 0.00 0.00 64.21 63.91 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 -1.41 0.45 -4.53 -1.33 -5.35 -0.68 -4.78 119.36 101.73 2g6h n ILE 687 Ca 0.05 -0.51 -0.33 0.00 -0.27 0.00 0.00 62.75 61.69 2g6h n ILE 687 Cb 0.16 0.37 -0.11 0.00 -1.74 0.00 0.00 39.64 38.32 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 -1.55 3.73 0.55 7.28 -4.23 -0.78 -5.02 115.64 115.63 2g6h s THR 688 Ca 0.31 -0.60 0.24 0.00 -1.18 0.00 0.00 61.69 60.46 2g6h s THR 688 Cb 0.16 -2.58 0.35 0.00 1.34 0.00 0.00 72.50 71.77 2g6h s THR 688 CO 0.23 0.50 2.10 1.55 -0.54 0.00 0.00 174.62 178.45 2g6h h PRO 689 N 4.89 0.00 -0.00 3.99 0.13 -1.86 -2.88 132.00 136.27 2g6h h PRO 689 Ca -0.49 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 2g6h h PRO 689 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2g6h h PRO 689 CO 0.53 0.00 -0.06 -0.39 -0.23 0.00 0.00 178.00 177.85 2g6h h VAL 690 N 0.00 1.04 -0.93 1.56 -1.51 -1.88 -2.52 116.25 112.02 2g6h h VAL 690 Ca 0.10 -0.21 0.04 0.00 -1.23 0.00 0.00 66.70 65.41 2g6h h VAL 690 Cb 0.47 1.11 -0.06 0.00 -2.13 0.00 0.00 31.29 30.68 2g6h h VAL 690 CO -0.00 0.06 0.60 0.15 -1.23 0.00 0.00 177.57 177.15 2g6h h PHE 691 N 0.00 1.11 -0.00 5.19 3.57 -1.70 -1.69 116.94 123.42 2g6h h PHE 691 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 2g6h h PHE 691 Cb 0.11 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.48 2g6h h PHE 691 CO 0.00 0.62 -0.05 0.72 -2.23 0.00 0.00 178.31 177.37 2g6h n HIS 692 N -4.52 0.00 -3.44 0.41 8.25 -0.96 -4.82 115.22 110.14 2g6h n HIS 692 Ca 0.13 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 57.20 2g6h n HIS 692 Cb 0.12 -0.11 -0.10 0.00 1.12 0.00 0.00 29.99 31.03 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 -2.26 3.96 0.45 -0.41 2.00 -0.64 -1.13 119.66 121.62 2g6h s GLN 693 Ca 0.36 -0.09 -0.23 0.00 -2.00 0.00 0.00 55.36 53.40 2g6h s GLN 693 Cb 0.21 -3.67 -0.08 0.00 0.80 0.00 0.00 33.01 30.27 2g6h s GLN 693 CO 0.42 -0.28 1.12 -1.21 -0.50 0.00 0.00 175.29 174.85 2g6h s GLU 694 N 1.99 3.86 0.06 1.67 2.02 -0.80 -4.99 118.70 122.50 2g6h s GLU 694 Ca 0.13 1.67 0.00 0.00 0.02 0.00 0.00 54.97 56.79 2g6h s GLU 694 Cb -0.16 -2.41 -0.03 0.00 0.10 0.00 0.00 34.13 31.62 2g6h s GLU 694 CO 0.10 -0.44 -0.05 -1.64 0.02 0.00 0.00 175.26 173.26 2g6h s MET 695 N -2.69 0.60 -0.11 1.61 -1.94 -1.26 -4.66 119.30 110.83 2g6h s MET 695 Ca 0.62 -1.06 0.03 0.00 -1.71 0.00 0.00 55.69 53.57 2g6h s MET 695 Cb -0.26 0.02 0.00 0.00 2.01 0.00 0.00 34.83 36.60 2g6h s MET 695 CO 0.31 -0.05 -0.22 -0.51 -0.01 0.00 0.00 175.02 174.54 2g6h s LEU 696 N -2.48 2.17 -0.17 -0.03 1.43 -1.26 -4.96 118.68 113.39 2g6h s LEU 696 Ca 0.01 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.54 2g6h s LEU 696 Cb 0.01 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.77 2g6h s LEU 696 CO -0.05 0.14 -0.04 0.21 0.23 0.00 0.00 176.35 176.83 2g6h s ASN 697 N 0.46 4.65 0.08 2.29 3.04 -1.23 -0.51 114.94 123.72 2g6h s ASN 697 Ca -0.15 -0.20 -0.24 0.00 0.04 0.00 0.00 52.86 52.32 2g6h s ASN 697 Cb -0.17 -1.76 0.06 0.00 -1.54 0.00 0.00 41.25 37.84 2g6h s ASN 697 CO 0.06 0.13 0.57 -0.72 -3.04 0.00 0.00 177.10 174.10 2g6h s TYR 698 N 0.60 -0.50 -0.33 0.43 -0.85 -1.26 -4.96 117.35 110.48 2g6h s TYR 698 Ca -0.03 0.49 -0.14 0.00 -0.52 0.00 0.00 57.07 56.87 2g6h s TYR 698 Cb -0.14 0.44 -0.02 0.00 0.38 0.00 0.00 41.96 42.62 2g6h s TYR 698 CO 0.03 -0.73 0.28 1.03 -1.52 0.00 0.00 175.55 174.64 2g6h s ARG 699 N -2.86 3.57 0.15 -3.49 0.52 -1.26 -4.79 118.95 110.79 2g6h s ARG 699 Ca -0.03 -0.52 0.07 0.00 -0.52 0.00 0.00 55.73 54.74 2g6h s ARG 699 Cb -0.00 -3.79 -0.04 0.00 0.52 0.00 0.00 34.95 31.63 2g6h s ARG 699 CO -0.05 -0.45 -0.04 -0.51 0.02 0.00 0.00 175.30 174.27 2g6h s LEU 700 N 1.84 3.21 0.14 2.53 1.43 -1.26 -3.72 118.68 122.84 2g6h s LEU 700 Ca 0.08 -0.41 0.08 0.00 -1.03 0.00 0.00 54.13 52.86 2g6h s LEU 700 Cb -0.17 -1.90 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 2g6h s LEU 700 CO 0.11 0.12 -0.12 0.42 0.23 0.00 0.00 176.35 177.11 2g6h s THR 701 N -1.57 3.15 0.77 5.49 -4.23 -1.26 -4.20 115.64 113.78 2g6h s THR 701 Ca 0.25 -1.50 -0.15 0.00 -1.18 0.00 0.00 61.69 59.11 2g6h s THR 701 Cb -0.10 -2.50 0.05 0.00 1.34 0.00 0.00 72.50 71.29 2g6h s THR 701 CO 0.17 0.01 1.13 -2.65 -0.54 0.00 0.00 174.62 172.74 2g6h n PRO 702 N 0.44 0.38 -3.83 3.99 -0.02 -1.26 -5.01 135.00 129.70 2g6h n PRO 702 Ca -0.13 0.20 -0.09 0.00 -2.02 0.00 0.00 63.50 61.46 2g6h n PRO 702 Cb 0.54 -2.38 -0.06 0.00 -0.02 0.00 0.00 33.50 31.58 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 -1.89 -0.03 -0.18 2.55 1.04 -0.77 -3.82 113.70 110.61 2g6h s SER 703 Ca 0.74 -0.63 -0.07 0.00 0.48 0.00 0.00 55.95 56.47 2g6h s SER 703 Cb -0.32 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.19 2g6h s SER 703 CO 0.50 -0.85 0.06 -0.36 0.98 0.00 0.00 173.24 173.57 2g6h s PHE 704 N -3.88 3.25 0.18 5.02 0.40 -1.26 -0.65 117.98 121.04 2g6h s PHE 704 Ca 0.09 0.07 0.07 0.00 -0.60 0.00 0.00 56.93 56.56 2g6h s PHE 704 Cb 0.03 -2.06 -0.04 0.00 0.51 0.00 0.00 43.02 41.45 2g6h s PHE 704 CO -0.07 0.17 -0.15 -1.21 0.70 0.00 0.00 175.22 174.67 2g6h s GLU 705 N 0.30 1.26 0.59 0.44 0.41 0.90 -4.94 118.70 117.67 2g6h s GLU 705 Ca 0.03 -1.51 -0.13 0.00 -0.41 0.00 0.00 54.97 52.95 2g6h s GLU 705 Cb -0.12 -1.09 -0.05 0.00 -1.78 0.00 0.00 34.13 31.09 2g6h s GLU 705 CO 0.00 0.19 1.02 0.71 -0.49 0.00 0.00 175.26 176.69 2g6h s TYR 706 N -2.76 3.48 0.05 1.61 4.12 -1.26 -0.54 117.35 122.04 2g6h s TYR 706 Ca 0.19 1.38 -0.08 0.00 0.02 0.00 0.00 57.07 58.59 2g6h s TYR 706 Cb -0.02 -2.78 -0.00 0.00 -1.52 0.00 0.00 41.96 37.64 2g6h s TYR 706 CO 0.06 -0.65 0.16 1.14 0.02 0.00 0.00 175.55 176.28 2g6h s GLN 707 N -4.69 0.69 0.56 -0.62 -2.07 -1.26 -4.74 119.66 107.53 2g6h s GLN 707 Ca 0.57 -0.74 -0.19 0.00 -1.82 0.00 0.00 55.36 53.18 2g6h s GLN 707 Cb -0.11 0.28 -0.05 0.00 -1.09 0.00 0.00 33.01 32.04 2g6h s GLN 707 CO 0.45 -0.19 1.17 -1.25 -1.32 0.00 0.00 175.29 174.15 2g6h s PRO 708 N -2.85 3.21 0.27 9.60 0.04 -1.26 -4.92 135.00 139.09 2g6h s PRO 708 Ca -0.03 1.74 -0.30 0.00 0.04 0.00 0.00 61.00 62.45 2g6h s PRO 708 Cb 0.00 -2.01 -0.13 0.00 0.04 0.00 0.00 34.50 32.41 2g6h s PRO 708 CO -0.06 -0.99 1.45 -0.25 0.04 0.00 0.00 177.00 177.19 2g6h n ASP 709 N -1.36 3.10 0.26 6.66 8.00 -1.26 -4.85 116.55 127.11 2g6h n ASP 709 Ca 0.12 1.16 0.09 0.00 0.71 0.00 0.00 54.79 56.86 2g6h n ASP 709 Cb 0.50 -1.49 0.66 0.00 -0.02 0.00 0.00 41.12 40.77 2g6h n ASP 709 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2g6h h PRO 710 N 4.11 0.00 0.00 -0.24 0.13 -1.92 -1.61 132.00 132.48 2g6h h PRO 710 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2g6h h PRO 710 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2g6h h PRO 710 CO 0.75 0.03 0.00 -2.67 -0.23 0.00 0.00 178.00 175.88 2g6h n TRP 711 N -4.38 0.64 0.12 1.56 2.14 -1.26 -0.60 117.44 115.65 2g6h n TRP 711 Ca -0.03 0.28 0.11 0.00 2.07 0.00 0.00 57.50 59.93 2g6h n TRP 711 Cb 0.12 -0.95 0.02 0.00 -0.81 0.00 0.00 31.31 29.69 2g6h n TRP 711 CO 0.00 0.00 0.00 -0.91 2.07 0.00 0.00 177.69 178.85 2g6h h ASN 712 N 0.00 0.00 0.00 -0.67 2.35 -1.64 -3.40 115.58 112.22 2g6h h ASN 712 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2g6h h ASN 712 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 2g6h h ASN 712 CO 0.00 0.03 -1.13 0.35 -1.65 0.00 0.00 177.43 175.03 2g6h n THR 713 N -2.76 0.00 -1.80 2.81 -2.24 -0.57 -5.06 114.28 104.67 2g6h n THR 713 Ca 0.00 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.29 2g6h n THR 713 Cb 0.56 0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 2g6h n THR 713 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2g6h s HIS 714 N -2.20 2.91 -0.51 4.78 5.04 0.23 -4.97 115.29 120.56 2g6h s HIS 714 Ca -0.01 0.55 -0.22 0.00 -1.54 0.00 0.00 55.06 53.84 2g6h s HIS 714 Cb 0.02 -4.06 0.05 0.00 0.04 0.00 0.00 32.58 28.62 2g6h s HIS 714 CO 0.13 -3.86 0.77 0.08 -2.34 0.00 0.00 174.74 169.52 2g6h s VAL 715 N 0.80 4.66 0.25 0.89 1.01 -1.26 -5.02 120.40 121.73 2g6h s VAL 715 Ca 0.70 -0.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.33 2g6h s VAL 715 Cb -0.48 -4.39 -0.09 0.00 0.00 0.00 0.00 36.38 31.42 2g6h s VAL 715 CO 0.37 -0.90 1.20 0.26 0.00 0.00 0.00 175.10 176.02 2g6h s TRP 716 N 3.23 3.37 -0.04 5.22 0.52 -1.26 -4.92 118.94 125.06 2g6h s TRP 716 Ca 0.23 1.49 0.22 0.00 0.02 0.00 0.00 56.10 58.06 2g6h s TRP 716 Cb -0.15 -3.46 -0.33 0.00 -1.15 0.00 0.00 33.47 28.38 2g6h s TRP 716 CO 0.16 -1.22 0.49 1.63 0.02 0.00 0.00 176.95 178.04 2g6h n LYS 717 N 1.68 0.66 -0.22 4.98 5.02 -1.26 -5.12 118.16 123.90 2g6h n LYS 717 Ca 0.02 -0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 2g6h n LYS 717 Cb 0.44 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 2g6h n LYS 717 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29