#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g6j s PHE 300 N 0.00 3.24 0.26 -0.14 0.40 -1.26 -4.83 117.98 115.64 2g6j s PHE 300 Ca 0.00 0.05 0.09 0.00 -0.60 0.00 0.00 56.93 56.47 2g6j s PHE 300 Cb 0.00 -2.26 -0.04 0.00 0.51 0.00 0.00 43.02 41.23 2g6j s PHE 300 CO 0.00 -0.06 0.06 -0.51 0.70 0.00 0.00 175.22 175.42 2g6j s LEU 301 N 1.23 3.41 0.08 -0.37 1.43 -1.08 -4.96 118.68 118.41 2g6j s LEU 301 Ca 0.06 -0.50 0.07 0.00 -1.03 0.00 0.00 54.13 52.74 2g6j s LEU 301 Cb -0.14 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 2g6j s LEU 301 CO 0.05 -0.01 -0.19 -0.54 0.23 0.00 0.00 176.35 175.90 2g6j s LYS 302 N -3.68 1.06 -0.05 1.70 1.02 -1.26 0.45 119.74 118.98 2g6j s LYS 302 Ca 0.32 -1.05 0.02 0.00 0.02 0.00 0.00 55.97 55.28 2g6j s LYS 302 Cb -0.07 -1.22 0.01 0.00 -0.52 0.00 0.00 37.83 36.03 2g6j s LYS 302 CO 0.21 0.29 -0.10 0.14 -0.92 0.00 0.00 175.35 174.97 2g6j s VAL 303 N -1.12 0.94 -0.08 3.17 -7.23 -0.61 -4.97 120.40 110.50 2g6j s VAL 303 Ca 0.04 -0.39 0.02 0.00 -1.81 0.00 0.00 61.98 59.83 2g6j s VAL 303 Cb -0.10 -0.86 -0.02 0.00 0.56 0.00 0.00 36.38 35.95 2g6j s VAL 303 CO 0.03 0.30 -0.12 -0.75 -0.31 0.00 0.00 175.10 174.26 2g6j s LYS 304 N 0.53 2.81 -0.31 4.82 2.20 -1.26 -1.70 119.74 126.83 2g6j s LYS 304 Ca -0.10 -0.65 -0.19 0.00 -0.36 0.00 0.00 55.97 54.67 2g6j s LYS 304 Cb -0.13 -2.51 -0.01 0.00 -1.51 0.00 0.00 37.83 33.67 2g6j s LYS 304 CO 0.02 0.53 0.58 1.21 -0.36 0.00 0.00 175.35 177.33 2g6j s ASN 305 N -0.46 6.44 0.00 1.43 3.84 -0.47 -2.71 114.94 123.01 2g6j s ASN 305 Ca 0.06 0.33 0.00 0.00 0.21 0.00 0.00 52.86 53.46 2g6j s ASN 305 Cb -0.12 -2.31 0.00 0.00 -0.55 0.00 0.00 41.25 38.27 2g6j s ASN 305 CO 0.02 -0.44 0.75 0.79 -2.79 0.00 0.00 177.10 175.42 2g6j n TRP 306 N 5.79 0.00 -0.03 0.43 7.02 0.66 -0.44 117.44 130.86 2g6j n TRP 306 Ca -0.03 0.00 -0.04 0.00 -1.02 0.00 0.00 57.50 56.41 2g6j n TRP 306 Cb 0.49 -0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 29.34 2g6j n TRP 306 CO 0.00 0.00 0.00 -1.91 -2.02 0.00 0.00 177.69 173.76 2g6j n GLU 307 N -0.47 1.22 0.00 -0.99 2.13 -1.26 -4.71 120.64 116.56 2g6j n GLU 307 Ca 0.00 0.02 0.06 0.00 0.66 0.00 0.00 57.16 57.91 2g6j n GLU 307 Cb 0.01 -1.14 -0.02 0.00 0.27 0.00 0.00 31.44 30.56 2g6j n GLU 307 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 2g6j n THR 308 N -2.52 0.00 -1.29 6.31 -2.24 -1.19 -4.98 114.28 108.37 2g6j n THR 308 Ca -0.11 -0.33 -0.10 0.00 -2.27 0.00 0.00 64.05 61.25 2g6j n THR 308 Cb 0.65 1.13 -0.04 0.00 -2.10 0.00 0.00 70.33 69.96 2g6j n THR 308 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2g6j n ASP 309 N -0.42 -5.56 -4.78 3.42 8.00 0.42 -4.96 116.55 112.67 2g6j n ASP 309 Ca 0.05 0.24 -0.36 0.00 0.71 0.00 0.00 54.79 55.44 2g6j n ASP 309 Cb 0.26 -3.93 -0.02 0.00 -0.02 0.00 0.00 41.12 37.42 2g6j n ASP 309 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2g6j s VAL 310 N -1.90 3.39 -0.19 2.53 1.01 -1.24 -4.80 120.40 119.19 2g6j s VAL 310 Ca 0.00 0.94 -0.03 0.00 0.00 0.00 0.00 61.98 62.90 2g6j s VAL 310 Cb 0.00 -3.43 0.06 0.00 0.00 0.00 0.00 36.38 33.01 2g6j s VAL 310 CO 0.00 -0.11 0.03 -0.69 0.00 0.00 0.00 175.10 174.33 2g6j s VAL 311 N -1.74 0.53 0.08 2.92 1.01 -1.26 -1.37 120.40 120.57 2g6j s VAL 311 Ca 0.67 -0.55 -0.04 0.00 0.00 0.00 0.00 61.98 62.06 2g6j s VAL 311 Cb -0.23 -1.03 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 2g6j s VAL 311 CO 0.27 -0.20 0.29 -0.76 0.00 0.00 0.00 175.10 174.71 2g6j s LEU 312 N 1.86 4.32 -0.21 3.92 1.43 -0.69 -4.92 118.68 124.39 2g6j s LEU 312 Ca -0.01 0.48 -0.04 0.00 -1.03 0.00 0.00 54.13 53.53 2g6j s LEU 312 Cb -0.17 -3.03 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 2g6j s LEU 312 CO -0.08 0.14 -0.03 -0.89 0.23 0.00 0.00 176.35 175.72 2g6j s THR 313 N -1.51 3.52 -0.20 5.49 2.01 -1.26 -1.58 115.64 122.10 2g6j s THR 313 Ca 0.35 -0.45 -0.16 0.00 0.31 0.00 0.00 61.69 61.74 2g6j s THR 313 Cb -0.13 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.75 2g6j s THR 313 CO 0.23 0.43 0.40 -0.62 -0.69 0.00 0.00 174.62 174.37 2g6j s ASP 314 N 1.29 6.45 0.00 3.53 -1.08 0.17 -4.68 116.67 122.35 2g6j s ASP 314 Ca 0.04 0.53 0.00 0.00 -0.52 0.00 0.00 52.55 52.59 2g6j s ASP 314 Cb -0.14 -2.23 0.00 0.00 -1.46 0.00 0.00 42.92 39.08 2g6j s ASP 314 CO -0.01 -0.07 0.00 0.35 0.52 0.00 0.00 175.17 175.96 2g6j n THR 315 N 4.30 0.00 0.13 1.71 -2.24 0.12 -2.64 114.28 115.66 2g6j n THR 315 Ca -0.08 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.78 2g6j n THR 315 Cb 0.51 0.07 0.58 0.00 -2.10 0.00 0.00 70.33 69.39 2g6j n THR 315 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2g6j h LEU 316 N 0.00 0.16 -1.70 3.22 5.85 -1.60 -2.17 115.31 119.07 2g6j h LEU 316 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2g6j h LEU 316 Cb 0.26 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.26 2g6j h LEU 316 CO 0.00 0.11 0.00 1.12 -0.34 0.00 0.00 178.44 179.33 2g6j h HIS 317 N 0.18 0.00 -0.26 1.25 2.07 -1.85 -2.19 115.15 114.35 2g6j h HIS 317 Ca 0.10 0.00 0.02 0.00 -2.85 0.00 0.00 60.37 57.64 2g6j h HIS 317 Cb 0.16 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.12 2g6j h HIS 317 CO -0.00 0.00 0.17 -0.07 -3.07 0.00 0.00 177.93 174.96 2g6j h LEU 318 N 0.00 0.23 -0.24 6.12 3.38 -1.71 0.85 115.31 123.93 2g6j h LEU 318 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2g6j h LEU 318 Cb 0.23 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2g6j h LEU 318 CO 0.00 0.16 0.00 0.29 0.09 0.00 0.00 178.44 178.98 2g6j n LYS 319 N -4.50 1.16 -1.56 1.13 5.02 -0.82 -4.93 118.16 113.66 2g6j n LYS 319 Ca 0.02 -0.24 -0.44 0.00 -2.02 0.00 0.00 58.31 55.62 2g6j n LYS 319 Cb 0.14 -1.33 -0.01 0.00 -0.02 0.00 0.00 35.03 33.80 2g6j n LYS 319 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2g6j n SER 320 N -0.56 0.88 0.00 4.39 2.88 0.29 -4.96 113.62 116.53 2g6j n SER 320 Ca 0.15 1.15 0.00 0.00 -1.33 0.00 0.00 58.87 58.84 2g6j n SER 320 Cb 0.13 -1.25 0.00 0.00 -0.75 0.00 0.00 64.21 62.34 2g6j n SER 320 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2g6j n THR 321 N 0.07 0.00 -0.60 2.46 5.66 -0.96 -5.06 114.28 115.85 2g6j n THR 321 Ca 0.11 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.89 2g6j n THR 321 Cb 0.32 -0.56 0.14 0.00 -1.55 0.00 0.00 70.33 68.68 2g6j n THR 321 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2g6j n LEU 322 N -0.87 -1.70 -4.95 1.09 4.77 -1.19 -5.01 117.00 109.13 2g6j n LEU 322 Ca 0.00 -0.29 -0.23 0.00 -0.03 0.00 0.00 56.01 55.46 2g6j n LEU 322 Cb 0.00 -0.78 0.02 0.00 -2.33 0.00 0.00 43.42 40.33 2g6j n LEU 322 CO 0.00 -3.12 0.30 -1.61 -1.33 0.00 0.00 177.39 171.63 2g6j s GLU 323 N -3.31 2.98 0.00 3.23 2.02 -1.26 -4.66 118.70 117.70 2g6j s GLU 323 Ca 0.39 -0.52 0.12 0.00 0.02 0.00 0.00 54.97 54.99 2g6j s GLU 323 Cb -0.06 -2.54 -0.12 0.00 0.10 0.00 0.00 34.13 31.51 2g6j s GLU 323 CO 0.42 -0.35 0.55 0.25 0.02 0.00 0.00 175.26 176.15 2g6j n THR 324 N -2.13 0.00 -0.20 3.63 -2.24 -1.26 -4.73 114.28 107.35 2g6j n THR 324 Ca 0.02 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2g6j n THR 324 Cb 0.58 1.02 0.00 0.00 -2.10 0.00 0.00 70.33 69.82 2g6j n THR 324 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g6j n GLY 325 N 1.27 1.51 3.86 3.38 0.00 -1.26 -4.91 105.19 109.02 2g6j n GLY 325 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 2g6j n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g6j n THR 327 N -1.46 0.00 0.19 0.00 -2.24 -0.16 -5.01 114.28 105.61 2g6j n THR 327 Ca 0.01 -1.47 0.07 0.00 -2.27 0.00 0.00 64.05 60.39 2g6j n THR 327 Cb 0.61 0.80 0.23 0.00 -2.10 0.00 0.00 70.33 69.87 2g6j n THR 327 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 2g6j h GLU 328 N 0.00 0.00 0.16 -0.78 3.07 -2.05 -3.25 114.58 111.73 2g6j h GLU 328 Ca -0.17 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 58.36 2g6j h GLU 328 Cb 0.82 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 2g6j h GLU 328 CO 0.24 0.31 -1.61 0.45 -1.40 0.00 0.00 179.01 177.01 2g6j h HIS 329 N 0.00 0.62 -3.24 4.33 3.86 -2.04 -3.47 115.15 115.21 2g6j h HIS 329 Ca -0.00 -0.45 -0.18 0.00 -1.16 0.00 0.00 60.37 58.58 2g6j h HIS 329 Cb 1.06 -0.02 -0.26 0.00 1.06 0.00 0.00 27.41 29.24 2g6j h HIS 329 CO 0.00 1.52 -0.48 -1.50 0.86 0.00 0.00 177.93 178.33 2g6j s ILE 330 N -2.60 0.00 -0.16 2.45 2.07 -1.23 -5.14 121.20 116.59 2g6j s ILE 330 Ca -0.12 -0.01 -0.06 0.00 -1.41 0.00 0.00 60.65 59.06 2g6j s ILE 330 Cb 0.06 -0.29 -0.04 0.00 0.13 0.00 0.00 42.46 42.32 2g6j s ILE 330 CO 0.86 -0.01 0.03 0.00 -1.91 0.00 0.00 174.94 173.92 2g6j n MET 332 N 3.29 1.75 -0.02 0.00 0.00 -1.26 -4.80 117.12 116.09 2g6j n MET 332 Ca -0.17 -3.24 0.23 0.00 0.00 0.00 0.00 57.70 54.52 2g6j n MET 332 Cb 0.53 -1.76 0.72 0.00 0.00 0.00 0.00 33.22 32.71 2g6j n MET 332 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 2g6j h GLY 333 N 1.00 0.00 -3.13 3.03 0.00 -1.94 -0.52 103.07 101.52 2g6j h GLY 333 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2g6j h GLY 333 CO 0.27 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.67 2g6j n SER 334 N -3.98 4.97 -4.64 0.19 3.41 -1.26 -4.86 113.62 107.44 2g6j n SER 334 Ca 0.12 -2.57 -0.39 0.00 -0.26 0.00 0.00 58.87 55.76 2g6j n SER 334 Cb 0.75 -0.60 -0.07 0.00 -0.26 0.00 0.00 64.21 64.03 2g6j n SER 334 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2g6j s ILE 335 N -2.08 5.12 0.26 -1.33 -1.09 -0.21 -4.97 121.20 116.90 2g6j s ILE 335 Ca 0.52 0.85 -0.06 0.00 -2.23 0.00 0.00 60.65 59.73 2g6j s ILE 335 Cb 0.35 -3.80 0.31 0.00 -1.58 0.00 0.00 42.46 37.73 2g6j s ILE 335 CO 0.22 0.16 1.62 -0.03 -1.23 0.00 0.00 174.94 175.68 2g6j h MET 336 N 7.69 0.08 -1.94 2.79 4.05 -1.90 -3.35 114.93 122.35 2g6j h MET 336 Ca -0.32 -0.00 -0.41 0.00 -0.28 0.00 0.00 59.70 58.68 2g6j h MET 336 Cb 1.15 -0.02 -0.31 0.00 -0.80 0.00 0.00 31.60 31.62 2g6j h MET 336 CO 0.72 0.05 -0.75 1.21 0.23 0.00 0.00 176.91 178.37 2g6j s ASN 337 N -5.17 0.89 0.00 1.39 2.47 -1.26 -5.17 114.94 108.10 2g6j s ASN 337 Ca -0.13 -2.08 0.01 0.00 0.42 0.00 0.00 52.86 51.07 2g6j s ASN 337 Cb 0.24 0.44 0.06 0.00 -1.45 0.00 0.00 41.25 40.54 2g6j s ASN 337 CO 0.76 -0.20 0.83 -2.65 -3.72 0.00 0.00 177.10 172.12 2g6j n PRO 338 N 3.60 0.02 -2.62 0.43 -0.02 -1.26 -5.18 135.00 129.97 2g6j n PRO 338 Ca 0.18 0.27 -0.42 0.00 -2.02 0.00 0.00 63.50 61.51 2g6j n PRO 338 Cb 0.47 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.42 2g6j n PRO 338 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2g6j s VAL 348 N -2.57 4.62 0.48 -1.45 0.11 -1.26 -4.87 120.40 115.46 2g6j s VAL 348 Ca 0.01 1.89 -0.23 0.00 -2.93 0.00 0.00 61.98 60.72 2g6j s VAL 348 Cb 0.01 -4.21 -0.07 0.00 -1.53 0.00 0.00 36.38 30.58 2g6j s VAL 348 CO 0.02 0.08 1.26 -0.13 -3.33 0.00 0.00 175.10 173.00 2g6j s ARG 349 N 1.51 3.59 0.33 1.54 0.52 -1.26 -5.05 118.95 120.14 2g6j s ARG 349 Ca 0.52 2.02 0.05 0.00 -0.52 0.00 0.00 55.73 57.80 2g6j s ARG 349 Cb -0.22 -2.43 -0.01 0.00 0.52 0.00 0.00 34.95 32.80 2g6j s ARG 349 CO 0.24 -0.76 0.48 0.95 0.02 0.00 0.00 175.30 176.23 2g6j s THR 350 N -1.40 4.39 0.18 0.02 -4.23 -1.26 -4.94 115.64 108.40 2g6j s THR 350 Ca 0.65 -0.89 -0.15 0.00 -1.18 0.00 0.00 61.69 60.11 2g6j s THR 350 Cb -0.35 -3.55 0.13 0.00 1.34 0.00 0.00 72.50 70.07 2g6j s THR 350 CO 0.42 -0.24 1.66 0.11 -0.54 0.00 0.00 174.62 176.03 2g6j h LYS 351 N 0.88 0.03 0.00 3.99 1.57 -1.93 -0.13 116.57 120.96 2g6j h LYS 351 Ca -0.47 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.29 2g6j h LYS 351 Cb 1.25 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.55 2g6j h LYS 351 CO 0.56 0.02 -0.08 -0.44 -0.57 0.00 0.00 179.45 178.93 2g6j h ASP 352 N 0.03 0.00 0.10 0.86 3.45 -1.99 -2.25 116.42 116.62 2g6j h ASP 352 Ca 0.23 0.00 -0.29 0.00 0.43 0.00 0.00 57.03 57.40 2g6j h ASP 352 Cb 0.35 0.00 0.03 0.00 -0.56 0.00 0.00 39.33 39.15 2g6j h ASP 352 CO -0.46 0.08 -1.20 1.56 -1.57 0.00 0.00 179.24 177.66 2g6j h GLN 353 N 0.00 0.65 -0.15 3.56 4.20 -1.46 -3.37 115.11 118.54 2g6j h GLN 353 Ca -0.00 -0.82 -0.21 0.00 0.06 0.00 0.00 58.65 57.68 2g6j h GLN 353 Cb 0.21 0.26 0.00 0.00 0.30 0.00 0.00 27.48 28.26 2g6j h GLN 353 CO 0.01 1.37 -0.74 1.25 -0.67 0.00 0.00 178.83 180.05 2g6j h LEU 354 N 0.31 0.82 -0.41 1.46 5.85 -0.73 -3.30 115.31 119.31 2g6j h LEU 354 Ca -0.17 -0.52 0.09 0.00 0.84 0.00 0.00 57.88 58.11 2g6j h LEU 354 Cb 1.87 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 42.57 2g6j h LEU 354 CO 0.23 1.31 -0.18 -0.26 -0.34 0.00 0.00 178.44 179.20 2g6j h PHE 355 N 0.48 -0.43 0.30 1.25 -1.00 -1.59 0.76 116.94 116.71 2g6j h PHE 355 Ca -0.04 0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.79 2g6j h PHE 355 Cb 1.35 0.25 -0.02 0.00 3.61 0.00 0.00 35.95 41.14 2g6j h PHE 355 CO 0.07 -0.26 -0.32 -1.35 -1.61 0.00 0.00 178.31 174.85 2g6j h PRO 356 N -0.10 -0.63 -0.58 1.51 0.11 -1.75 0.39 132.00 130.95 2g6j h PRO 356 Ca 0.20 0.04 0.08 0.00 0.11 0.00 0.00 66.00 66.44 2g6j h PRO 356 Cb 0.40 0.14 -0.07 0.00 0.11 0.00 0.00 31.00 31.59 2g6j h PRO 356 CO -0.47 -0.42 0.23 -0.07 -0.21 0.00 0.00 178.00 177.06 2g6j h LEU 357 N -0.66 0.26 -0.50 2.35 3.38 -1.56 0.13 115.31 118.71 2g6j h LEU 357 Ca -0.01 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2g6j h LEU 357 Cb 0.60 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 2g6j h LEU 357 CO -0.07 0.16 0.31 0.00 0.09 0.00 0.00 178.44 178.94 2g6j h ALA 358 N 1.38 0.64 -0.73 1.53 0.00 -0.56 -0.79 119.26 120.73 2g6j h ALA 358 Ca 0.29 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.14 2g6j h ALA 358 Cb 0.32 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2g6j h ALA 358 CO -0.27 0.04 0.31 -0.22 0.00 0.00 0.00 179.25 179.11 2g6j h LYS 359 N 0.63 1.08 -0.17 0.00 3.64 0.17 -1.08 116.57 120.85 2g6j h LYS 359 Ca 0.19 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 2g6j h LYS 359 Cb -0.02 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.60 2g6j h LYS 359 CO -0.07 0.88 0.09 1.49 -2.27 0.00 0.00 179.45 179.56 2g6j h GLU 360 N 1.04 0.18 -0.07 1.90 4.81 -0.42 -1.76 114.58 120.26 2g6j h GLU 360 Ca 0.25 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.46 2g6j h GLU 360 Cb 0.18 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 2g6j h GLU 360 CO -0.02 0.12 0.03 0.35 -0.73 0.00 0.00 179.01 178.75 2g6j h PHE 361 N 0.19 0.11 -0.70 0.92 3.57 -0.80 -2.78 116.94 117.45 2g6j h PHE 361 Ca 0.07 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2g6j h PHE 361 Cb 0.01 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.68 2g6j h PHE 361 CO -0.09 0.25 0.37 -0.07 -2.23 0.00 0.00 178.31 176.54 2g6j h LEU 362 N -0.05 0.87 -0.00 0.59 3.38 -1.16 0.31 115.31 119.24 2g6j h LEU 362 Ca 0.02 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2g6j h LEU 362 Cb 0.19 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2g6j h LEU 362 CO -0.00 0.71 -0.03 0.44 0.09 0.00 0.00 178.44 179.64 2g6j h ASP 363 N 0.98 -0.09 0.21 -0.43 3.32 -1.23 0.41 116.42 119.58 2g6j h ASP 363 Ca 0.25 0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.22 2g6j h ASP 363 Cb 0.04 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 2g6j h ASP 363 CO -0.04 -0.05 -0.34 0.06 -1.72 0.00 0.00 179.24 177.15 2g6j h GLN 364 N -0.06 0.21 0.35 3.56 3.07 -1.20 0.27 115.11 121.31 2g6j h GLN 364 Ca 0.02 -0.08 -0.02 0.00 0.09 0.00 0.00 58.65 58.66 2g6j h GLN 364 Cb 0.08 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 27.63 2g6j h GLN 364 CO -0.04 0.53 -0.17 -0.92 0.09 0.00 0.00 178.83 178.33 2g6j h TYR 365 N 0.18 -0.43 0.00 0.06 3.20 -0.25 0.22 116.97 119.95 2g6j h TYR 365 Ca 0.02 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2g6j h TYR 365 Cb 0.70 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 39.11 2g6j h TYR 365 CO 0.01 -0.11 -0.21 1.88 -1.64 0.00 0.00 178.16 178.09 2g6j h TYR 366 N -0.81 0.00 0.00 -3.82 -1.99 -0.12 -0.79 116.97 109.44 2g6j h TYR 366 Ca -0.05 0.00 -0.09 0.00 2.00 0.00 0.00 58.73 60.60 2g6j h TYR 366 Cb 0.52 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.24 2g6j h TYR 366 CO 0.02 0.21 -0.41 1.03 -0.00 0.00 0.00 178.16 179.01 2g6j h SER 367 N 0.00 0.00 0.75 3.88 0.87 -0.26 -1.25 113.55 117.54 2g6j h SER 367 Ca -0.00 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.38 2g6j h SER 367 Cb 0.40 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.34 2g6j h SER 367 CO 0.03 0.41 -0.84 0.77 -0.53 0.00 0.00 176.83 176.66 2g6j h SER 368 N 0.00 0.08 -0.34 6.23 4.64 0.52 -3.05 113.55 121.63 2g6j h SER 368 Ca -0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 2g6j h SER 368 Cb 0.83 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2g6j h SER 368 CO 0.05 0.89 0.00 2.30 -0.87 0.00 0.00 176.83 179.20 2g6j n ILE 369 N -3.59 1.38 -3.87 0.95 -5.35 -0.93 -4.93 119.36 103.02 2g6j n ILE 369 Ca -0.02 -0.75 -0.26 0.00 -0.27 0.00 0.00 62.75 61.45 2g6j n ILE 369 Cb 0.80 -0.25 0.01 0.00 -1.74 0.00 0.00 39.64 38.46 2g6j n ILE 369 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 2g6j n LYS 370 N 0.43 -4.51 -1.73 6.28 5.02 -1.07 -4.87 118.16 117.69 2g6j n LYS 370 Ca 0.15 0.54 0.03 0.00 -2.02 0.00 0.00 58.31 57.01 2g6j n LYS 370 Cb 0.71 -5.09 0.02 0.00 -0.02 0.00 0.00 35.03 30.65 2g6j n LYS 370 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2g6j n ARG 371 N -4.43 0.31 -1.76 1.97 1.74 -0.49 -5.05 116.66 108.96 2g6j n ARG 371 Ca -0.18 -2.25 -0.42 0.00 -0.77 0.00 0.00 57.85 54.24 2g6j n ARG 371 Cb 0.62 -0.28 -0.03 0.00 -1.02 0.00 0.00 32.46 31.76 2g6j n ARG 371 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2g6j s PHE 372 N -0.68 2.77 -1.20 -1.55 5.36 -1.16 -1.51 117.98 120.01 2g6j s PHE 372 Ca 0.32 0.31 0.00 0.00 -0.96 0.00 0.00 56.93 56.60 2g6j s PHE 372 Cb 0.37 -4.12 0.00 0.00 -0.34 0.00 0.00 43.02 38.93 2g6j s PHE 372 CO -0.14 -4.31 0.00 0.41 -1.46 0.00 0.00 175.22 169.72 2g6j n GLY 373 N 4.00 0.70 3.97 13.12 0.00 -1.26 -5.01 105.19 120.70 2g6j n GLY 373 Ca 0.16 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.50 2g6j n GLY 373 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g6j s SER 374 N -2.68 3.65 0.02 1.61 1.04 -0.57 -4.90 113.70 111.86 2g6j s SER 374 Ca 0.00 -0.13 -0.21 0.00 0.48 0.00 0.00 55.95 56.09 2g6j s SER 374 Cb 0.00 -0.04 -0.17 0.00 0.10 0.00 0.00 66.02 65.91 2g6j s SER 374 CO 0.00 -2.35 1.26 0.50 0.98 0.00 0.00 173.24 173.62 2g6j h LYS 375 N -1.11 0.31 -0.64 4.02 3.64 -1.95 -1.98 116.57 118.86 2g6j h LYS 375 Ca -0.39 -0.20 0.13 0.00 -1.27 0.00 0.00 60.65 58.92 2g6j h LYS 375 Cb 1.24 0.03 -0.11 0.00 -0.41 0.00 0.00 32.23 32.98 2g6j h LYS 375 CO 0.37 0.80 -0.04 0.00 -2.27 0.00 0.00 179.45 178.31 2g6j h ALA 376 N 0.51 0.58 0.33 5.00 0.00 -1.94 0.60 119.26 124.34 2g6j h ALA 376 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2g6j h ALA 376 Cb 0.79 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2g6j h ALA 376 CO 0.05 -0.41 -0.38 1.25 0.00 0.00 0.00 179.25 179.76 2g6j h HIS 377 N 0.08 -1.04 -0.76 0.00 -0.00 -1.76 -0.76 115.15 110.90 2g6j h HIS 377 Ca 0.33 0.01 0.06 0.00 -0.00 0.00 0.00 60.37 60.77 2g6j h HIS 377 Cb 0.54 0.41 -0.06 0.00 -0.00 0.00 0.00 27.41 28.31 2g6j h HIS 377 CO -0.41 -0.52 0.46 0.52 -0.00 0.00 0.00 177.93 177.97 2g6j h MET 378 N -0.75 0.82 0.14 5.26 2.07 -0.41 -1.28 114.93 120.78 2g6j h MET 378 Ca -0.02 -0.05 0.01 0.00 -2.07 0.00 0.00 59.70 57.58 2g6j h MET 378 Cb 0.69 -0.18 -0.03 0.00 -1.87 0.00 0.00 31.60 30.21 2g6j h MET 378 CO -0.10 0.54 -0.25 -0.44 1.07 0.00 0.00 176.91 177.74 2g6j h ASP 379 N 0.84 -0.70 -0.32 1.22 3.45 0.48 -0.29 116.42 121.10 2g6j h ASP 379 Ca 0.33 0.08 0.03 0.00 0.43 0.00 0.00 57.03 57.90 2g6j h ASP 379 Cb 0.16 0.26 -0.03 0.00 -0.56 0.00 0.00 39.33 39.15 2g6j h ASP 379 CO -0.17 -0.34 0.12 -0.09 -1.57 0.00 0.00 179.24 177.19 2g6j h ARG 380 N -0.47 0.25 -0.75 3.56 9.65 -0.79 0.14 114.38 125.97 2g6j h ARG 380 Ca 0.02 -0.01 0.05 0.00 -1.10 0.00 0.00 59.98 58.94 2g6j h ARG 380 Cb 0.48 -0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 28.96 2g6j h ARG 380 CO -0.13 0.16 0.49 1.25 2.80 0.00 0.00 179.97 184.55 2g6j h LEU 381 N 0.26 0.73 -0.12 3.80 5.85 -0.96 0.78 115.31 125.65 2g6j h LEU 381 Ca 0.14 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 2g6j h LEU 381 Cb 0.11 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2g6j h LEU 381 CO -0.14 0.48 -0.31 -0.08 -0.34 0.00 0.00 178.44 178.06 2g6j h GLU 382 N 0.84 0.42 -0.66 1.25 4.57 -0.05 -2.26 114.58 118.70 2g6j h GLU 382 Ca 0.31 -0.29 0.02 0.00 -1.18 0.00 0.00 59.36 58.22 2g6j h GLU 382 Cb 0.18 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.77 2g6j h GLU 382 CO -0.10 0.90 0.42 1.49 -1.18 0.00 0.00 179.01 180.54 2g6j h GLU 383 N 0.01 0.82 -0.34 1.92 4.81 0.04 -1.17 114.58 120.66 2g6j h GLU 383 Ca -0.00 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.12 2g6j h GLU 383 Cb 0.92 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 30.10 2g6j h GLU 383 CO 0.07 0.54 0.01 0.28 -0.73 0.00 0.00 179.01 179.18 2g6j h VAL 384 N 0.84 1.26 -0.67 0.32 2.07 -0.91 -0.77 116.25 118.40 2g6j h VAL 384 Ca 0.25 -0.95 0.01 0.00 0.82 0.00 0.00 66.70 66.83 2g6j h VAL 384 Cb -0.04 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 2g6j h VAL 384 CO -0.08 0.31 0.44 0.78 0.02 0.00 0.00 177.57 179.04 2g6j h ASN 385 N 0.40 0.76 0.08 0.57 -0.26 -1.10 0.16 115.58 116.19 2g6j h ASN 385 Ca 0.10 -0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.81 2g6j h ASN 385 Cb 0.44 -0.19 0.00 0.00 -1.06 0.00 0.00 38.32 37.51 2g6j h ASN 385 CO 0.02 0.55 -0.04 0.11 -1.06 0.00 0.00 177.43 177.01 2g6j h LYS 386 N 0.90 -0.10 -0.94 0.81 1.57 -0.98 -2.19 116.57 115.63 2g6j h LYS 386 Ca 0.25 0.01 0.12 0.00 -1.87 0.00 0.00 60.65 59.16 2g6j h LYS 386 Cb -0.10 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.16 2g6j h LYS 386 CO -0.05 0.25 0.60 1.49 -0.57 0.00 0.00 179.45 181.16 2g6j h GLU 387 N -0.46 0.84 -0.18 3.15 4.81 -0.57 -1.13 114.58 121.04 2g6j h GLU 387 Ca -0.01 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 2g6j h GLU 387 Cb 0.40 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 2g6j h GLU 387 CO 0.02 0.56 0.01 0.82 -0.73 0.00 0.00 179.01 179.68 2g6j h ILE 388 N 0.87 1.25 -0.79 2.32 2.04 -0.59 0.58 117.51 123.19 2g6j h ILE 388 Ca 0.46 -0.84 0.03 0.00 1.00 0.00 0.00 64.86 65.52 2g6j h ILE 388 Cb 0.56 1.45 -0.04 0.00 -0.74 0.00 0.00 36.82 38.04 2g6j h ILE 388 CO -0.23 0.25 0.52 -0.08 0.00 0.00 0.00 178.15 178.61 2g6j h GLU 389 N 0.08 0.94 0.00 2.37 4.22 -0.69 0.74 114.58 122.23 2g6j h GLU 389 Ca 0.05 -0.06 -0.10 0.00 0.08 0.00 0.00 59.36 59.34 2g6j h GLU 389 Cb 0.37 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2g6j h GLU 389 CO 0.01 0.62 -0.57 1.03 -2.18 0.00 0.00 179.01 177.92 2g6j h SER 390 N 0.97 0.00 0.45 1.04 0.87 -1.09 -3.40 113.55 112.38 2g6j h SER 390 Ca 0.31 -0.66 0.00 0.00 -1.23 0.00 0.00 61.79 60.21 2g6j h SER 390 Cb 0.04 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 2g6j h SER 390 CO -0.09 1.16 -1.00 0.35 -0.53 0.00 0.00 176.83 176.72 2g6j n THR 391 N -4.55 0.17 -3.17 2.23 -2.24 0.20 -4.97 114.28 101.95 2g6j n THR 391 Ca -0.19 -0.24 -0.17 0.00 -2.27 0.00 0.00 64.05 61.18 2g6j n THR 391 Cb 0.52 0.20 0.05 0.00 -2.10 0.00 0.00 70.33 69.00 2g6j n THR 391 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2g6j n SER 392 N -1.95 -5.16 0.00 3.42 3.41 0.26 -4.93 113.62 108.66 2g6j n SER 392 Ca 0.02 -0.34 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 2g6j n SER 392 Cb 0.43 -3.83 0.00 0.00 -0.26 0.00 0.00 64.21 60.55 2g6j n SER 392 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2g6j n THR 393 N -4.31 0.00 -3.78 6.66 5.66 -1.25 -4.89 114.28 112.38 2g6j n THR 393 Ca -0.02 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.91 2g6j n THR 393 Cb 0.56 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.32 2g6j n THR 393 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2g6j s TYR 394 N -2.40 -0.23 -0.09 1.09 -0.85 -1.26 -3.37 117.35 110.22 2g6j s TYR 394 Ca 0.00 -0.16 0.01 0.00 -0.52 0.00 0.00 57.07 56.40 2g6j s TYR 394 Cb 0.00 0.68 -0.02 0.00 0.38 0.00 0.00 41.96 43.00 2g6j s TYR 394 CO 0.00 -1.12 -0.12 -0.65 -1.52 0.00 0.00 175.55 172.14 2g6j s GLN 395 N -3.80 3.00 0.33 -3.49 -1.52 -1.26 -5.05 119.66 107.88 2g6j s GLN 395 Ca 0.10 -0.67 -0.26 0.00 -1.95 0.00 0.00 55.36 52.58 2g6j s GLN 395 Cb -0.05 -2.55 -0.10 0.00 -0.22 0.00 0.00 33.01 30.10 2g6j s GLN 395 CO 0.03 0.42 0.96 -0.51 -0.25 0.00 0.00 175.29 175.94 2g6j s LEU 396 N -0.18 4.32 0.61 2.90 1.43 -1.26 -5.04 118.68 121.47 2g6j s LEU 396 Ca 0.00 1.88 -0.16 0.00 -1.03 0.00 0.00 54.13 54.82 2g6j s LEU 396 Cb -0.13 -4.02 -0.03 0.00 0.03 0.00 0.00 46.19 42.04 2g6j s LEU 396 CO 0.03 -0.12 1.08 -0.54 0.23 0.00 0.00 176.35 177.03 2g6j s LYS 397 N -2.08 3.19 0.27 1.70 -0.14 -1.26 -4.81 119.74 116.61 2g6j s LYS 397 Ca 0.51 1.28 -0.00 0.00 -1.36 0.00 0.00 55.97 56.40 2g6j s LYS 397 Cb -0.19 -2.01 0.60 0.00 -1.68 0.00 0.00 37.83 34.55 2g6j s LYS 397 CO 0.25 -0.92 1.71 -0.44 -0.76 0.00 0.00 175.35 175.18 2g6j h ASP 398 N 0.40 0.27 -0.50 2.83 3.32 -2.00 0.64 116.42 121.38 2g6j h ASP 398 Ca -0.47 0.14 -0.02 0.00 0.02 0.00 0.00 57.03 56.69 2g6j h ASP 398 Cb 1.23 0.13 -0.03 0.00 0.22 0.00 0.00 39.33 40.88 2g6j h ASP 398 CO 0.56 0.03 0.24 0.71 -1.72 0.00 0.00 179.24 179.06 2g6j h THR 399 N 0.40 1.19 -0.23 0.35 1.35 -2.00 -2.10 112.91 111.87 2g6j h THR 399 Ca 0.49 -0.56 -0.12 0.00 -0.55 0.00 0.00 66.41 65.67 2g6j h THR 399 Cb 0.87 0.53 -0.01 0.00 -1.73 0.00 0.00 68.15 67.80 2g6j h THR 399 CO -0.49 0.23 -0.37 -0.33 -0.25 0.00 0.00 175.52 174.31 2g6j h GLU 400 N 0.76 0.50 0.16 4.72 5.08 -1.25 -2.17 114.58 122.38 2g6j h GLU 400 Ca 0.19 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2g6j h GLU 400 Cb 0.12 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2g6j h GLU 400 CO -0.02 0.80 -0.08 1.25 -1.00 0.00 0.00 179.01 179.96 2g6j h LEU 401 N 0.42 -0.18 -0.24 1.33 5.85 -0.74 0.12 115.31 121.86 2g6j h LEU 401 Ca 0.04 -0.22 0.04 0.00 0.84 0.00 0.00 57.88 58.59 2g6j h LEU 401 Cb 0.84 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.87 2g6j h LEU 401 CO 0.07 0.13 -0.02 0.40 -0.34 0.00 0.00 178.44 178.68 2g6j h ILE 402 N -0.51 0.80 -0.44 4.05 2.04 -1.38 0.12 117.51 122.19 2g6j h ILE 402 Ca -0.02 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 65.83 2g6j h ILE 402 Cb 0.39 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 2g6j h ILE 402 CO 0.04 0.01 0.28 0.22 0.00 0.00 0.00 178.15 178.70 2g6j h TYR 403 N 0.05 0.53 -0.47 1.37 3.20 -1.37 -1.17 116.97 119.11 2g6j h TYR 403 Ca 0.12 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.02 2g6j h TYR 403 Cb 0.16 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.22 2g6j h TYR 403 CO -0.21 0.33 0.27 0.78 -1.64 0.00 0.00 178.16 177.69 2g6j h GLY 404 N 0.57 0.66 0.77 1.82 0.00 -0.05 -1.41 103.07 105.42 2g6j h GLY 404 Ca 0.16 -0.20 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 2g6j h GLY 404 CO -0.05 0.17 0.00 0.00 0.00 0.00 0.00 176.54 176.66 2g6j h ALA 405 N 1.22 0.14 -0.84 3.60 0.00 -0.52 -0.97 119.26 121.87 2g6j h ALA 405 Ca 0.19 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2g6j h ALA 405 Cb 0.03 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 2g6j h ALA 405 CO -0.10 -0.19 0.56 0.87 0.00 0.00 0.00 179.25 180.39 2g6j h LYS 406 N -0.09 1.02 0.00 0.00 1.57 -1.15 -1.93 116.57 115.99 2g6j h LYS 406 Ca 0.03 -0.06 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 2g6j h LYS 406 Cb 0.33 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 2g6j h LYS 406 CO 0.00 0.67 -0.52 0.45 -0.57 0.00 0.00 179.45 179.49 2g6j h HIS 407 N 1.05 0.00 -0.41 -1.35 3.86 -1.15 -0.93 115.15 116.22 2g6j h HIS 407 Ca 0.34 0.00 -0.10 0.00 -1.16 0.00 0.00 60.37 59.45 2g6j h HIS 407 Cb 0.03 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 2g6j h HIS 407 CO -0.00 0.52 -0.13 0.00 0.86 0.00 0.00 177.93 179.17 2g6j h ALA 408 N 1.48 0.99 -0.20 2.45 0.00 -0.42 -0.08 119.26 123.48 2g6j h ALA 408 Ca -0.01 -0.32 -0.17 0.00 0.00 0.00 0.00 54.91 54.41 2g6j h ALA 408 Cb 1.20 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 2g6j h ALA 408 CO 0.07 0.60 -0.56 2.35 0.00 0.00 0.00 179.25 181.70 2g6j h TRP 409 N 0.68 0.77 -0.17 0.00 7.01 -1.19 -2.59 115.95 120.47 2g6j h TRP 409 Ca 0.11 -0.28 -0.01 0.00 2.11 0.00 0.00 58.89 60.82 2g6j h TRP 409 Cb 0.61 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.52 2g6j h TRP 409 CO 0.03 1.03 0.04 -0.09 -2.79 0.00 0.00 178.44 176.66 2g6j h ARG 410 N 0.47 0.23 -0.01 2.65 2.43 -0.35 -2.37 114.38 117.43 2g6j h ARG 410 Ca 0.01 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 2g6j h ARG 410 Cb 1.12 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2g6j h ARG 410 CO 0.11 0.22 -0.23 0.09 -1.51 0.00 0.00 179.97 178.65 2g6j n ASN 411 N -4.44 1.14 -4.56 -3.80 3.02 -0.12 -4.81 115.26 101.69 2g6j n ASN 411 Ca -0.00 -1.00 -0.22 0.00 -0.03 0.00 0.00 54.58 53.32 2g6j n ASN 411 Cb 0.14 0.13 -0.06 0.00 -0.61 0.00 0.00 39.78 39.38 2g6j n ASN 411 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2g6j s ALA 412 N -2.43 1.30 -0.54 5.41 0.00 -0.89 -4.76 121.76 119.84 2g6j s ALA 412 Ca 0.26 -1.41 0.07 0.00 0.00 0.00 0.00 51.96 50.88 2g6j s ALA 412 Cb 0.19 -4.59 0.38 0.00 0.00 0.00 0.00 23.12 19.10 2g6j s ALA 412 CO 0.50 -5.38 1.14 -1.13 0.00 0.00 0.00 175.76 170.89 2g6j n SER 413 N 15.86 0.18 -0.38 0.00 3.41 -1.26 -1.13 113.62 130.29 2g6j n SER 413 Ca 0.43 0.51 0.10 0.00 -0.26 0.00 0.00 58.87 59.66 2g6j n SER 413 Cb 0.46 -0.52 -0.03 0.00 -0.26 0.00 0.00 64.21 63.86 2g6j n SER 413 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2g6j n ARG 414 N -1.71 1.06 -3.15 4.33 1.74 -1.26 -0.39 116.66 117.28 2g6j n ARG 414 Ca -0.00 -0.78 -0.40 0.00 -0.77 0.00 0.00 57.85 55.89 2g6j n ARG 414 Cb 0.11 -1.46 -0.07 0.00 -1.02 0.00 0.00 32.46 30.03 2g6j n ARG 414 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2g6j n VAL 416 N 5.23 0.22 -0.72 0.00 3.14 -1.26 -3.81 118.33 121.13 2g6j n VAL 416 Ca -0.02 -0.12 0.03 0.00 -2.96 0.00 0.00 64.34 61.27 2g6j n VAL 416 Cb 0.49 -0.34 0.34 0.00 -1.06 0.00 0.00 33.84 33.27 2g6j n VAL 416 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2g6j n GLY 417 N 1.42 2.98 0.00 7.55 0.00 -1.26 -4.45 105.19 111.43 2g6j n GLY 417 Ca 0.06 -0.84 0.05 0.00 0.00 0.00 0.00 46.02 45.29 2g6j n GLY 417 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g6j n ARG 418 N 0.39 0.02 0.22 1.61 1.74 -1.25 -2.97 116.66 116.41 2g6j n ARG 418 Ca 0.28 0.31 0.15 0.00 -0.77 0.00 0.00 57.85 57.82 2g6j n ARG 418 Cb 1.15 -1.50 0.77 0.00 -1.02 0.00 0.00 32.46 31.85 2g6j n ARG 418 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 2g6j h ILE 419 N 0.00 0.00 -0.02 0.55 2.10 -1.89 0.15 117.51 118.39 2g6j h ILE 419 Ca 0.00 -0.07 0.00 0.00 1.08 0.00 0.00 64.86 65.87 2g6j h ILE 419 Cb 0.17 0.76 0.00 0.00 -1.09 0.00 0.00 36.82 36.66 2g6j h ILE 419 CO 0.00 0.00 -0.11 0.00 -1.08 0.00 0.00 178.15 176.96 2g6j n GLN 420 N -2.55 1.69 -0.34 2.19 1.13 -1.16 -4.67 117.38 113.68 2g6j n GLN 420 Ca -0.01 -1.22 0.14 0.00 -1.94 0.00 0.00 57.00 53.97 2g6j n GLN 420 Cb 0.09 -1.47 0.29 0.00 0.11 0.00 0.00 30.24 29.25 2g6j n GLN 420 CO 0.00 0.00 0.00 0.11 -1.44 0.00 0.00 177.06 175.73 2g6j h TRP 421 N 2.97 -0.04 0.00 1.08 5.08 -0.91 0.11 115.95 124.25 2g6j h TRP 421 Ca 0.00 0.07 0.00 0.00 1.08 0.00 0.00 58.89 60.04 2g6j h TRP 421 Cb 0.70 0.18 0.00 0.00 -3.00 0.00 0.00 29.16 27.04 2g6j h TRP 421 CO 0.00 -0.42 0.00 -1.13 -1.28 0.00 0.00 178.44 175.61 2g6j n SER 422 N -5.48 0.45 -0.76 0.11 3.41 -1.26 -3.09 113.62 107.01 2g6j n SER 422 Ca 0.23 0.62 0.10 0.00 -0.26 0.00 0.00 58.87 59.56 2g6j n SER 422 Cb 0.75 -0.71 0.29 0.00 -0.26 0.00 0.00 64.21 64.28 2g6j n SER 422 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2g6j n LYS 423 N -2.01 1.98 -1.65 4.33 5.02 0.03 -4.97 118.16 120.89 2g6j n LYS 423 Ca 0.02 -1.49 -0.48 0.00 -2.02 0.00 0.00 58.31 54.34 2g6j n LYS 423 Cb 0.19 -1.40 -0.05 0.00 -0.02 0.00 0.00 35.03 33.75 2g6j n LYS 423 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2g6j n LEU 424 N 0.70 2.63 -4.66 -0.35 7.94 -1.18 -4.86 117.00 117.22 2g6j n LEU 424 Ca 0.16 1.09 -0.40 0.00 -1.11 0.00 0.00 56.01 55.75 2g6j n LEU 424 Cb 0.40 -1.34 -0.06 0.00 0.53 0.00 0.00 43.42 42.95 2g6j n LEU 424 CO 0.13 -0.52 0.32 -1.58 -1.11 0.00 0.00 177.39 174.63 2g6j s GLN 425 N 1.11 4.19 -0.20 1.96 2.00 -1.10 -4.99 119.66 122.62 2g6j s GLN 425 Ca 0.82 0.53 -0.06 0.00 -2.00 0.00 0.00 55.36 54.65 2g6j s GLN 425 Cb -0.78 -3.58 -0.03 0.00 0.80 0.00 0.00 33.01 29.42 2g6j s GLN 425 CO 0.43 -0.22 0.03 0.08 -0.50 0.00 0.00 175.29 175.10 2g6j s VAL 426 N 1.86 4.23 -0.34 1.34 1.01 -1.26 -1.47 120.40 125.77 2g6j s VAL 426 Ca 0.27 -0.22 -0.06 0.00 0.00 0.00 0.00 61.98 61.97 2g6j s VAL 426 Cb -0.16 -2.92 0.04 0.00 0.00 0.00 0.00 36.38 33.34 2g6j s VAL 426 CO 0.10 0.42 0.10 -0.36 0.00 0.00 0.00 175.10 175.36 2g6j s PHE 427 N 0.92 3.25 -0.69 5.22 0.08 0.34 -4.99 117.98 122.12 2g6j s PHE 427 Ca 0.02 -1.43 -0.27 0.00 0.12 0.00 0.00 56.93 55.37 2g6j s PHE 427 Cb -0.14 -2.27 0.02 0.00 -0.57 0.00 0.00 43.02 40.06 2g6j s PHE 427 CO 0.02 -0.73 1.41 0.34 -0.10 0.00 0.00 175.22 176.16 2g6j s ASP 428 N 1.40 5.99 -0.37 1.36 3.68 -1.26 -0.97 116.67 126.50 2g6j s ASP 428 Ca -0.02 -0.18 0.06 0.00 2.13 0.00 0.00 52.55 54.55 2g6j s ASP 428 Cb -0.19 -2.55 0.59 0.00 -1.45 0.00 0.00 42.92 39.31 2g6j s ASP 428 CO 0.03 -1.92 1.69 0.00 0.13 0.00 0.00 175.17 175.10 2g6j n ALA 429 N 10.06 4.97 0.77 3.66 0.00 0.02 -4.64 120.51 135.35 2g6j n ALA 429 Ca 0.08 -3.04 0.09 0.00 0.00 0.00 0.00 53.44 50.57 2g6j n ALA 429 Cb 0.50 -1.09 0.43 0.00 0.00 0.00 0.00 19.45 19.29 2g6j n ALA 429 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2g6j n ARG 430 N -1.14 0.17 -0.14 0.00 1.74 -1.03 -2.35 116.66 113.91 2g6j n ARG 430 Ca 0.47 0.14 0.11 0.00 -0.77 0.00 0.00 57.85 57.80 2g6j n ARG 430 Cb 1.35 -1.50 0.28 0.00 -1.02 0.00 0.00 32.46 31.57 2g6j n ARG 430 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 2g6j n ASP 431 N -1.36 2.69 -4.77 0.55 3.85 -1.26 -4.53 116.55 111.72 2g6j n ASP 431 Ca 0.07 -1.88 -0.39 0.00 -0.71 0.00 0.00 54.79 51.88 2g6j n ASP 431 Cb 0.17 -0.19 -0.02 0.00 -1.35 0.00 0.00 41.12 39.72 2g6j n ASP 431 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2g6j n THR 433 N 0.35 0.00 -4.33 0.00 -2.24 -1.26 -4.78 114.28 102.03 2g6j n THR 433 Ca 0.03 -0.06 -0.17 0.00 -2.27 0.00 0.00 64.05 61.58 2g6j n THR 433 Cb 0.45 0.44 -0.10 0.00 -2.10 0.00 0.00 70.33 69.02 2g6j n THR 433 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2g6j s THR 434 N -0.82 0.63 0.30 4.28 -4.23 -1.26 -4.62 115.64 109.92 2g6j s THR 434 Ca 0.00 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 58.68 2g6j s THR 434 Cb 0.00 -2.64 0.12 0.00 1.34 0.00 0.00 72.50 71.32 2g6j s THR 434 CO 0.00 -0.01 1.81 0.00 -0.54 0.00 0.00 174.62 175.87 2g6j h ALA 435 N 2.36 1.19 -0.25 3.99 0.00 -1.90 -1.07 119.26 123.58 2g6j h ALA 435 Ca -0.38 -0.33 -0.18 0.00 0.00 0.00 0.00 54.91 54.01 2g6j h ALA 435 Cb 1.25 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 2g6j h ALA 435 CO 0.62 0.46 -0.56 0.45 0.00 0.00 0.00 179.25 180.22 2g6j h HIS 436 N 0.00 0.98 -0.69 0.00 -0.00 -1.96 -0.60 115.15 112.88 2g6j h HIS 436 Ca -0.00 -0.35 0.02 0.00 -0.00 0.00 0.00 60.37 60.03 2g6j h HIS 436 Cb 0.74 -0.18 -0.04 0.00 -0.00 0.00 0.00 27.41 27.93 2g6j h HIS 436 CO 0.00 1.15 0.45 0.78 -0.00 0.00 0.00 177.93 180.31 2g6j h GLY 437 N 0.81 0.98 1.25 2.45 0.00 -1.81 -0.73 103.07 106.01 2g6j h GLY 437 Ca 0.01 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 2g6j h GLY 437 CO 0.12 0.32 0.19 -0.33 0.00 0.00 0.00 176.54 176.84 2g6j h MET 438 N 0.90 0.95 -0.62 4.80 0.00 -0.87 -1.32 114.93 118.76 2g6j h MET 438 Ca 0.26 -0.19 -0.07 0.00 0.00 0.00 0.00 59.70 59.71 2g6j h MET 438 Cb -0.05 -0.15 -0.03 0.00 0.00 0.00 0.00 31.60 31.37 2g6j h MET 438 CO -0.08 0.82 0.13 0.35 0.00 0.00 0.00 176.91 178.14 2g6j h PHE 439 N 0.92 1.06 -0.63 -0.22 3.04 -0.15 -0.16 116.94 120.81 2g6j h PHE 439 Ca 0.20 -0.13 -0.03 0.00 3.98 0.00 0.00 57.97 61.99 2g6j h PHE 439 Cb 0.27 -0.30 -0.03 0.00 2.56 0.00 0.00 35.95 38.46 2g6j h PHE 439 CO 0.02 0.90 0.27 -0.97 -2.02 0.00 0.00 178.31 176.50 2g6j h ASN 440 N 0.92 0.85 -0.47 0.41 -1.24 -0.74 -1.40 115.58 113.91 2g6j h ASN 440 Ca 0.19 -0.16 -0.06 0.00 0.71 0.00 0.00 56.30 56.99 2g6j h ASN 440 Cb 0.38 -0.22 -0.02 0.00 0.73 0.00 0.00 38.32 39.19 2g6j h ASN 440 CO 0.01 0.77 0.06 1.88 -1.29 0.00 0.00 177.43 178.86 2g6j h TYR 441 N 0.87 0.84 -0.44 0.67 -1.99 -0.96 -2.39 116.97 113.59 2g6j h TYR 441 Ca 0.21 -0.12 -0.06 0.00 2.00 0.00 0.00 58.73 60.76 2g6j h TYR 441 Cb 0.18 -0.23 -0.02 0.00 2.00 0.00 0.00 36.73 38.66 2g6j h TYR 441 CO 0.01 0.79 0.03 0.82 -0.00 0.00 0.00 178.16 179.81 2g6j h ILE 442 N 0.66 1.25 -0.87 -2.88 2.04 -0.83 -1.40 117.51 115.48 2g6j h ILE 442 Ca 0.14 -0.98 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 2g6j h ILE 442 Cb 0.41 1.03 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 2g6j h ILE 442 CO 0.01 0.34 0.52 0.00 0.00 0.00 0.00 178.15 179.02 2g6j h ASN 444 N 1.20 0.87 0.03 0.00 2.35 -1.16 -1.67 115.58 117.19 2g6j h ASN 444 Ca 0.31 -0.21 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 2g6j h ASN 444 Cb -0.05 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.09 2g6j h ASN 444 CO -0.06 0.91 -0.01 -0.74 -1.65 0.00 0.00 177.43 175.87 2g6j h HIS 445 N 0.84 -0.04 -0.66 1.19 2.76 -0.06 -1.27 115.15 117.91 2g6j h HIS 445 Ca 0.16 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.42 2g6j h HIS 445 Cb 0.45 0.01 -0.07 0.00 1.55 0.00 0.00 27.41 29.36 2g6j h HIS 445 CO 0.03 0.29 0.32 0.28 -1.30 0.00 0.00 177.93 177.54 2g6j h VAL 446 N -0.37 0.86 0.14 5.26 2.07 -0.66 -0.01 116.25 123.54 2g6j h VAL 446 Ca -0.00 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2g6j h VAL 446 Cb 0.34 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 2g6j h VAL 446 CO 0.01 0.10 -0.07 0.50 0.02 0.00 0.00 177.57 178.13 2g6j h LYS 447 N 0.56 -0.18 -0.60 1.57 3.64 -1.25 -0.17 116.57 120.14 2g6j h LYS 447 Ca 0.32 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.76 2g6j h LYS 447 Cb 0.32 0.04 -0.05 0.00 -0.41 0.00 0.00 32.23 32.13 2g6j h LYS 447 CO -0.25 0.07 0.32 -0.92 -2.27 0.00 0.00 179.45 176.40 2g6j h TYR 448 N -0.41 0.59 -0.11 1.91 3.20 -1.00 -1.96 116.97 119.19 2g6j h TYR 448 Ca -0.02 0.02 -0.22 0.00 3.14 0.00 0.00 58.73 61.66 2g6j h TYR 448 Cb 0.33 -0.18 0.01 0.00 1.54 0.00 0.00 36.73 38.43 2g6j h TYR 448 CO 0.00 0.29 -0.80 0.00 -1.64 0.00 0.00 178.16 176.01 2g6j h ALA 449 N 1.31 0.37 -0.31 1.82 0.00 -0.97 -3.24 119.26 118.25 2g6j h ALA 449 Ca 0.26 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 2g6j h ALA 449 Cb 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2g6j h ALA 449 CO -0.17 0.71 0.09 1.15 0.00 0.00 0.00 179.25 181.04 2g6j h THR 450 N 0.44 1.20 -6.68 0.00 2.02 -0.92 -0.40 112.91 108.57 2g6j h THR 450 Ca -0.06 -0.66 -0.54 0.00 0.77 0.00 0.00 66.41 65.93 2g6j h THR 450 Cb 1.42 1.06 -0.09 0.00 -1.74 0.00 0.00 68.15 68.80 2g6j h THR 450 CO 0.16 0.22 -0.92 -3.20 0.37 0.00 0.00 175.52 172.15 2g6j n ASN 451 N -4.69 -0.24 -1.83 4.18 5.15 -0.75 -0.46 115.26 116.62 2g6j n ASN 451 Ca -0.02 -1.10 -0.19 0.00 -0.60 0.00 0.00 54.58 52.67 2g6j n ASN 451 Cb 0.17 -2.57 -0.06 0.00 -0.53 0.00 0.00 39.78 36.79 2g6j n ASN 451 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2g6j n LYS 452 N -4.47 -1.55 0.00 1.20 5.02 -1.26 -1.59 118.16 115.51 2g6j n LYS 452 Ca -0.30 1.05 0.00 0.00 -2.02 0.00 0.00 58.31 57.04 2g6j n LYS 452 Cb 0.68 -5.50 0.00 0.00 -0.02 0.00 0.00 35.03 30.20 2g6j n LYS 452 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2g6j n GLY 453 N -0.55 2.68 2.79 0.72 0.00 0.39 -4.94 105.19 106.27 2g6j n GLY 453 Ca -0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.40 2g6j n GLY 453 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2g6j n ASN 454 N 0.00 5.67 -4.52 1.61 4.05 -0.62 -1.06 115.26 120.39 2g6j n ASN 454 Ca 0.00 -3.13 -0.47 0.00 0.45 0.00 0.00 54.58 51.43 2g6j n ASN 454 Cb 0.00 -1.45 -0.03 0.00 1.23 0.00 0.00 39.78 39.53 2g6j n ASN 454 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2g6j n LEU 455 N 3.38 0.69 -3.94 1.20 4.77 -1.19 -4.57 117.00 117.34 2g6j n LEU 455 Ca 0.44 1.15 -0.26 0.00 -0.03 0.00 0.00 56.01 57.31 2g6j n LEU 455 Cb 0.34 -1.15 -0.17 0.00 -2.33 0.00 0.00 43.42 40.12 2g6j n LEU 455 CO 0.79 -1.90 -0.44 -0.13 -1.33 0.00 0.00 177.39 174.38 2g6j s ARG 456 N -1.03 1.51 0.48 3.23 0.52 -0.16 -5.02 118.95 118.49 2g6j s ARG 456 Ca 0.65 -0.28 -0.24 0.00 -0.52 0.00 0.00 55.73 55.34 2g6j s ARG 456 Cb -0.84 -1.47 -0.08 0.00 0.52 0.00 0.00 34.95 33.09 2g6j s ARG 456 CO 0.57 -0.17 1.32 -1.13 0.02 0.00 0.00 175.30 175.91 2g6j n SER 457 N 4.55 2.67 -3.60 0.23 3.41 -1.26 -4.39 113.62 115.22 2g6j n SER 457 Ca -0.16 1.05 -0.10 0.00 -0.26 0.00 0.00 58.87 59.40 2g6j n SER 457 Cb 0.51 -1.54 -0.02 0.00 -0.26 0.00 0.00 64.21 62.89 2g6j n SER 457 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g6j s ALA 458 N -1.25 -1.38 -0.10 7.33 0.00 -0.32 -2.73 121.76 123.31 2g6j s ALA 458 Ca 0.65 0.13 -0.12 0.00 0.00 0.00 0.00 51.96 52.63 2g6j s ALA 458 Cb -0.46 0.87 0.03 0.00 0.00 0.00 0.00 23.12 23.56 2g6j s ALA 458 CO 0.54 -0.85 0.31 -1.50 0.00 0.00 0.00 175.76 174.26 2g6j s ILE 459 N -3.82 0.01 -0.13 0.00 2.07 -0.54 -0.41 121.20 118.37 2g6j s ILE 459 Ca 0.05 -0.08 0.02 0.00 -1.41 0.00 0.00 60.65 59.24 2g6j s ILE 459 Cb -0.02 -0.47 0.01 0.00 0.13 0.00 0.00 42.46 42.10 2g6j s ILE 459 CO -0.05 -0.04 -0.21 -0.89 -1.91 0.00 0.00 174.94 171.83 2g6j s THR 460 N -0.06 1.97 -0.31 4.00 2.01 -0.66 -0.51 115.64 122.07 2g6j s THR 460 Ca -0.02 -0.92 -0.05 0.00 0.31 0.00 0.00 61.69 61.00 2g6j s THR 460 Cb -0.03 -1.74 0.03 0.00 0.01 0.00 0.00 72.50 70.77 2g6j s THR 460 CO 0.01 0.53 0.07 -0.63 -0.69 0.00 0.00 174.62 173.91 2g6j s ILE 461 N 0.83 3.64 0.91 1.82 1.01 -0.14 -3.41 121.20 125.86 2g6j s ILE 461 Ca -0.07 -1.05 -0.14 0.00 0.00 0.00 0.00 60.65 59.39 2g6j s ILE 461 Cb -0.15 -3.00 0.17 0.00 0.01 0.00 0.00 42.46 39.48 2g6j s ILE 461 CO -0.02 -0.07 1.27 -0.36 0.00 0.00 0.00 174.94 175.76 2g6j s PHE 462 N 1.40 1.87 0.52 3.97 0.08 -0.99 -0.80 117.98 124.03 2g6j s PHE 462 Ca -0.01 0.35 -0.22 0.00 0.12 0.00 0.00 56.93 57.18 2g6j s PHE 462 Cb -0.19 -3.91 -0.07 0.00 -0.57 0.00 0.00 43.02 38.28 2g6j s PHE 462 CO 0.02 -2.40 1.14 -2.30 -0.10 0.00 0.00 175.22 171.57 2g6j n PRO 463 N -3.60 1.39 -1.26 0.24 -0.02 -1.25 -4.65 135.00 125.85 2g6j n PRO 463 Ca 0.14 0.51 -0.29 0.00 -2.02 0.00 0.00 63.50 61.84 2g6j n PRO 463 Cb 0.60 -2.30 0.16 0.00 -0.02 0.00 0.00 33.50 31.94 2g6j n PRO 463 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 2g6j s GLN 464 N -2.56 0.78 0.53 -0.52 -2.07 -1.26 -4.56 119.66 109.99 2g6j s GLN 464 Ca 0.70 0.54 -0.19 0.00 -1.82 0.00 0.00 55.36 54.59 2g6j s GLN 464 Cb -0.46 -1.78 -0.07 0.00 -1.09 0.00 0.00 33.01 29.62 2g6j s GLN 464 CO 0.51 -2.50 1.05 1.03 -1.32 0.00 0.00 175.29 174.06 2g6j s ARG 465 N -5.02 3.62 0.08 9.60 0.52 0.32 -4.89 118.95 123.19 2g6j s ARG 465 Ca 0.64 1.30 0.00 0.00 -0.52 0.00 0.00 55.73 57.16 2g6j s ARG 465 Cb -0.18 -2.07 0.00 0.00 0.52 0.00 0.00 34.95 33.22 2g6j s ARG 465 CO 0.57 -0.57 0.00 0.25 0.02 0.00 0.00 175.30 175.56 2g6j n THR 466 N -1.37 1.02 -1.24 0.02 -2.24 -1.26 -4.79 114.28 104.41 2g6j n THR 466 Ca 0.09 0.34 0.02 0.00 -2.27 0.00 0.00 64.05 62.23 2g6j n THR 466 Cb 0.53 -1.48 0.03 0.00 -2.10 0.00 0.00 70.33 67.31 2g6j n THR 466 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2g6j n ASP 467 N -3.32 0.85 0.00 3.42 5.68 -1.26 -4.97 116.55 116.95 2g6j n ASP 467 Ca 0.00 -2.02 0.00 0.00 -0.50 0.00 0.00 54.79 52.27 2g6j n ASP 467 Cb 0.00 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 39.80 2g6j n ASP 467 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2g6j n GLY 468 N -0.41 2.10 0.75 6.12 0.00 -1.26 -4.74 105.19 107.74 2g6j n GLY 468 Ca 0.04 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.17 2g6j n GLY 468 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2g6j n LYS 469 N -1.98 1.84 -1.84 1.61 5.02 -1.26 -4.36 118.16 117.19 2g6j n LYS 469 Ca 0.00 -1.55 -0.04 0.00 -2.02 0.00 0.00 58.31 54.71 2g6j n LYS 469 Cb 0.00 -1.42 0.07 0.00 -0.02 0.00 0.00 35.03 33.66 2g6j n LYS 469 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2g6j n HIS 470 N 0.84 1.06 -2.32 2.13 8.25 -1.26 -4.21 115.22 119.71 2g6j n HIS 470 Ca 0.12 -1.62 -0.39 0.00 -0.26 0.00 0.00 57.72 55.56 2g6j n HIS 470 Cb 0.52 -0.24 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 2g6j n HIS 470 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2g6j s ASP 471 N -3.19 6.69 -0.10 0.41 1.11 -1.26 -3.56 116.67 116.77 2g6j s ASP 471 Ca 0.37 2.36 -0.09 0.00 0.18 0.00 0.00 52.55 55.37 2g6j s ASP 471 Cb 0.37 -2.62 -0.04 0.00 1.07 0.00 0.00 42.92 41.70 2g6j s ASP 471 CO -0.06 -0.56 0.20 -0.36 1.18 0.00 0.00 175.17 175.57 2g6j s PHE 472 N -1.35 3.61 0.04 4.23 0.40 -1.26 -1.45 117.98 122.20 2g6j s PHE 472 Ca 0.54 0.61 -0.12 0.00 -0.60 0.00 0.00 56.93 57.36 2g6j s PHE 472 Cb -0.32 -2.04 0.01 0.00 0.51 0.00 0.00 43.02 41.19 2g6j s PHE 472 CO 0.40 0.68 0.26 1.03 0.70 0.00 0.00 175.22 178.29 2g6j s ARG 473 N -0.90 0.76 -0.27 0.44 1.81 0.17 -2.87 118.95 118.09 2g6j s ARG 473 Ca 0.16 -0.54 0.02 0.00 -1.72 0.00 0.00 55.73 53.65 2g6j s ARG 473 Cb -0.13 0.32 0.06 0.00 -0.45 0.00 0.00 34.95 34.75 2g6j s ARG 473 CO 0.05 -0.23 -0.08 0.08 -0.68 0.00 0.00 175.30 174.44 2g6j s VAL 474 N -2.52 2.40 0.42 3.52 1.01 -1.26 -1.42 120.40 122.55 2g6j s VAL 474 Ca -0.05 -1.57 0.18 0.00 0.00 0.00 0.00 61.98 60.54 2g6j s VAL 474 Cb -0.01 -2.41 0.19 0.00 0.00 0.00 0.00 36.38 34.15 2g6j s VAL 474 CO -0.03 -0.05 1.97 -0.50 0.00 0.00 0.00 175.10 176.49 2g6j h TRP 475 N 7.83 0.00 -4.21 5.22 4.06 -1.75 -3.42 115.95 123.69 2g6j h TRP 475 Ca -0.20 0.00 -0.52 0.00 2.06 0.00 0.00 58.89 60.23 2g6j h TRP 475 Cb 1.05 0.00 0.14 0.00 -1.00 0.00 0.00 29.16 29.35 2g6j h TRP 475 CO 0.63 0.21 0.36 -0.80 -3.56 0.00 0.00 178.44 175.28 2g6j s ASN 476 N -6.74 4.35 0.14 -3.49 -0.87 -1.26 -4.92 114.94 102.15 2g6j s ASN 476 Ca -0.03 2.18 0.23 0.00 -1.57 0.00 0.00 52.86 53.66 2g6j s ASN 476 Cb 0.15 -2.57 0.14 0.00 -0.02 0.00 0.00 41.25 38.94 2g6j s ASN 476 CO 0.67 -2.15 1.14 -1.54 -2.57 0.00 0.00 177.10 172.65 2g6j n SER 477 N -2.88 0.73 -3.84 -1.22 3.41 -1.26 -3.99 113.62 104.56 2g6j n SER 477 Ca 0.12 0.14 -0.12 0.00 -0.26 0.00 0.00 58.87 58.75 2g6j n SER 477 Cb 0.51 0.43 -0.10 0.00 -0.26 0.00 0.00 64.21 64.80 2g6j n SER 477 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2g6j s GLN 478 N -3.26 0.51 0.35 4.33 -0.21 -1.26 -0.77 119.66 119.36 2g6j s GLN 478 Ca 0.03 -0.32 0.04 0.00 0.02 0.00 0.00 55.36 55.12 2g6j s GLN 478 Cb 0.12 0.22 0.68 0.00 1.00 0.00 0.00 33.01 35.03 2g6j s GLN 478 CO 0.77 -0.13 1.98 -0.07 -2.12 0.00 0.00 175.29 175.72 2g6j h LEU 479 N 4.26 0.71 -7.84 2.90 3.38 -1.62 -3.40 115.31 113.71 2g6j h LEU 479 Ca -0.30 -0.01 -0.56 0.00 0.09 0.00 0.00 57.88 57.11 2g6j h LEU 479 Cb 1.19 -0.16 -0.36 0.00 0.09 0.00 0.00 40.66 41.42 2g6j h LEU 479 CO 0.40 0.48 -0.82 -0.63 0.09 0.00 0.00 178.44 177.97 2g6j s ILE 480 N -5.72 1.26 0.05 1.22 1.01 -1.26 -4.85 121.20 112.91 2g6j s ILE 480 Ca -0.10 -0.46 -0.23 0.00 0.00 0.00 0.00 60.65 59.86 2g6j s ILE 480 Cb 0.19 -1.21 0.05 0.00 0.01 0.00 0.00 42.46 41.50 2g6j s ILE 480 CO 0.77 0.40 0.53 -0.13 0.00 0.00 0.00 174.94 176.51 2g6j s ARG 481 N 1.40 1.05 0.10 2.79 0.52 -1.26 -4.86 118.95 118.69 2g6j s ARG 481 Ca 0.01 -0.23 -0.23 0.00 -0.52 0.00 0.00 55.73 54.75 2g6j s ARG 481 Cb -0.13 0.48 -0.07 0.00 0.52 0.00 0.00 34.95 35.75 2g6j s ARG 481 CO -0.06 -0.38 0.71 0.71 0.02 0.00 0.00 175.30 176.29 2g6j s TYR 482 N -2.47 3.82 0.70 -0.53 4.12 -1.26 -0.38 117.35 121.34 2g6j s TYR 482 Ca -0.05 1.47 -0.14 0.00 0.02 0.00 0.00 57.07 58.37 2g6j s TYR 482 Cb -0.01 -2.70 0.02 0.00 -1.52 0.00 0.00 41.96 37.75 2g6j s TYR 482 CO -0.02 0.46 1.12 0.00 0.02 0.00 0.00 175.55 177.13 2g6j s ALA 483 N -0.78 2.37 -0.11 3.71 0.00 -0.71 -4.39 121.76 121.85 2g6j s ALA 483 Ca 0.34 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.82 2g6j s ALA 483 Cb -0.21 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.61 2g6j s ALA 483 CO 0.23 -1.47 -0.09 0.20 0.00 0.00 0.00 175.76 174.63 2g6j s GLY 484 N -2.70 0.87 -0.10 0.00 0.00 -1.25 -1.66 107.32 102.48 2g6j s GLY 484 Ca 0.66 -0.58 0.03 0.00 0.00 0.00 0.00 44.72 44.83 2g6j s GLY 484 CO 0.45 0.67 -0.18 -0.19 0.00 0.00 0.00 173.10 173.85 2g6j s TYR 485 N 1.53 2.11 -0.38 1.90 1.51 -0.13 -3.90 117.35 120.00 2g6j s TYR 485 Ca 0.02 -0.90 -0.28 0.00 -1.01 0.00 0.00 57.07 54.90 2g6j s TYR 485 Cb -0.13 -1.47 0.02 0.00 -0.11 0.00 0.00 41.96 40.27 2g6j s TYR 485 CO -0.07 -0.41 1.06 0.15 -1.11 0.00 0.00 175.55 175.17 2g6j s LYS 486 N 0.64 3.92 0.62 -0.62 1.02 -1.26 -0.60 119.74 123.45 2g6j s LYS 486 Ca -0.14 0.82 -0.10 0.00 0.02 0.00 0.00 55.97 56.58 2g6j s LYS 486 Cb -0.16 -3.80 -0.03 0.00 -0.52 0.00 0.00 37.83 33.32 2g6j s LYS 486 CO 0.04 -1.06 1.00 -0.65 -0.92 0.00 0.00 175.35 173.76 2g6j s GLN 487 N 3.86 3.41 0.47 1.68 -0.21 -0.99 -4.96 119.66 122.92 2g6j s GLN 487 Ca 0.45 0.57 0.13 0.00 0.02 0.00 0.00 55.36 56.53 2g6j s GLN 487 Cb -0.11 -2.12 1.10 0.00 1.00 0.00 0.00 33.01 32.88 2g6j s GLN 487 CO 0.21 -0.62 2.10 -1.35 -2.12 0.00 0.00 175.29 173.52 2g6j h PRO 488 N -0.30 0.23 0.00 2.91 0.11 -1.95 0.51 132.00 133.51 2g6j h PRO 488 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2g6j h PRO 488 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2g6j h PRO 488 CO 0.62 0.15 0.29 0.22 -0.21 0.00 0.00 178.00 179.08 2g6j h ASP 489 N 0.24 0.00 0.00 -2.05 -0.00 -2.02 -3.43 116.42 109.16 2g6j h ASP 489 Ca 0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.11 2g6j h ASP 489 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 39.35 2g6j h ASP 489 CO -0.02 0.00 0.00 0.61 -0.00 0.00 0.00 179.24 179.83 2g6j n GLY 490 N -1.27 3.18 0.43 -0.78 0.00 0.17 -5.01 105.19 101.91 2g6j n GLY 490 Ca -0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 2g6j n GLY 490 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2g6j n SER 491 N 0.10 -0.60 -4.03 1.61 3.41 -1.26 -4.81 113.62 108.05 2g6j n SER 491 Ca 0.00 -0.80 -0.24 0.00 -0.26 0.00 0.00 58.87 57.57 2g6j n SER 491 Cb 0.00 -0.12 -0.16 0.00 -0.26 0.00 0.00 64.21 63.67 2g6j n SER 491 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2g6j s THR 492 N -1.29 1.12 -0.24 6.66 2.01 -1.26 -2.35 115.64 120.30 2g6j s THR 492 Ca 0.09 -0.48 -0.11 0.00 0.31 0.00 0.00 61.69 61.50 2g6j s THR 492 Cb -0.01 -1.02 -0.05 0.00 0.01 0.00 0.00 72.50 71.43 2g6j s THR 492 CO 0.06 0.35 0.19 -0.22 -0.69 0.00 0.00 174.62 174.31 2g6j s LEU 493 N 0.62 4.12 0.00 4.42 2.96 0.24 -4.92 118.68 126.11 2g6j s LEU 493 Ca -0.14 0.15 0.00 0.00 -0.22 0.00 0.00 54.13 53.93 2g6j s LEU 493 Cb -0.15 -2.15 0.00 0.00 0.50 0.00 0.00 46.19 44.39 2g6j s LEU 493 CO 0.03 0.05 0.00 0.61 -1.32 0.00 0.00 176.35 175.72 2g6j n GLY 494 N 4.27 0.96 3.15 7.98 0.00 -1.26 -0.96 105.19 119.33 2g6j n GLY 494 Ca -0.14 -1.18 -0.35 0.00 0.00 0.00 0.00 46.02 44.35 2g6j n GLY 494 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2g6j s ASP 495 N -4.00 4.92 0.56 1.61 -1.08 -0.67 -4.75 116.67 113.27 2g6j s ASP 495 Ca 0.00 -1.45 0.29 0.00 -0.52 0.00 0.00 52.55 50.87 2g6j s ASP 495 Cb 0.00 -1.72 1.47 0.00 -1.46 0.00 0.00 42.92 41.21 2g6j s ASP 495 CO 0.00 -0.31 1.93 -0.65 0.52 0.00 0.00 175.17 176.66 2g6j h PRO 496 N 7.97 0.00 0.00 4.34 0.11 -1.84 -1.47 132.00 141.11 2g6j h PRO 496 Ca -0.19 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.91 2g6j h PRO 496 Cb 1.06 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 2g6j h PRO 496 CO 0.55 0.00 -0.05 0.00 -0.21 0.00 0.00 178.00 178.29 2g6j h ALA 497 N 1.56 1.43 -0.14 -0.75 0.00 -1.94 -2.91 119.26 116.50 2g6j h ALA 497 Ca 0.27 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2g6j h ALA 497 Cb 1.22 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2g6j h ALA 497 CO -0.00 0.07 0.00 0.09 0.00 0.00 0.00 179.25 179.41 2g6j n ASN 498 N -3.77 3.04 -0.08 0.00 3.02 -0.56 -4.72 115.26 112.19 2g6j n ASN 498 Ca -0.02 -2.86 -0.07 0.00 -0.03 0.00 0.00 54.58 51.59 2g6j n ASN 498 Cb 0.15 -0.42 -0.01 0.00 -0.61 0.00 0.00 39.78 38.89 2g6j n ASN 498 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2g6j h VAL 499 N 0.97 0.48 -0.81 2.41 2.07 -1.57 0.20 116.25 120.01 2g6j h VAL 499 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2g6j h VAL 499 Cb 1.13 0.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.34 2g6j h VAL 499 CO 0.10 0.00 0.35 -0.61 0.02 0.00 0.00 177.57 177.42 2g6j h GLN 500 N -0.15 1.18 -0.46 1.57 4.15 -1.84 -1.41 115.11 118.15 2g6j h GLN 500 Ca 0.16 -0.20 -0.14 0.00 0.77 0.00 0.00 58.65 59.25 2g6j h GLN 500 Cb 0.39 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 2g6j h GLN 500 CO -0.39 0.94 -0.25 0.35 -1.93 0.00 0.00 178.83 177.55 2g6j h PHE 501 N 1.16 1.12 -0.88 3.99 3.57 -1.73 -2.60 116.94 121.57 2g6j h PHE 501 Ca 0.27 -0.28 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 2g6j h PHE 501 Cb 0.18 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.62 2g6j h PHE 501 CO 0.02 1.10 0.48 1.15 -2.23 0.00 0.00 178.31 178.83 2g6j h THR 502 N 0.83 1.25 -0.89 4.41 2.02 -0.28 -2.16 112.91 118.09 2g6j h THR 502 Ca 0.10 -0.63 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 2g6j h THR 502 Cb 0.82 0.07 -0.04 0.00 -1.74 0.00 0.00 68.15 67.27 2g6j h THR 502 CO 0.07 0.29 0.52 -0.33 0.37 0.00 0.00 175.52 176.44 2g6j h GLU 503 N 1.22 1.21 0.00 6.66 5.08 -1.03 -1.76 114.58 125.97 2g6j h GLU 503 Ca 0.31 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 58.51 2g6j h GLU 503 Cb 0.03 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 2g6j h GLU 503 CO -0.05 0.86 -0.19 0.82 -1.00 0.00 0.00 179.01 179.44 2g6j h ILE 504 N 1.23 0.52 0.04 3.13 2.04 -1.05 0.30 117.51 123.72 2g6j h ILE 504 Ca 0.32 -0.97 -0.00 0.00 1.00 0.00 0.00 64.86 65.20 2g6j h ILE 504 Cb -0.03 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.72 2g6j h ILE 504 CO -0.06 0.19 -0.02 0.00 0.00 0.00 0.00 178.15 178.26 2g6j h ILE 506 N -0.76 0.67 0.00 0.00 2.04 -1.22 0.24 117.51 118.48 2g6j h ILE 506 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2g6j h ILE 506 Cb 0.65 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 2g6j h ILE 506 CO 0.01 0.00 0.14 1.67 0.00 0.00 0.00 178.15 179.97 2g6j n GLN 507 N -5.26 0.02 0.00 2.37 7.27 0.10 0.39 117.38 122.27 2g6j n GLN 507 Ca -0.06 0.41 0.04 0.00 0.07 0.00 0.00 57.00 57.46 2g6j n GLN 507 Cb 0.18 -1.70 -0.03 0.00 2.41 0.00 0.00 30.24 31.10 2g6j n GLN 507 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2g6j n GLN 508 N -1.50 4.05 0.00 3.69 1.13 0.57 -5.02 117.38 120.30 2g6j n GLN 508 Ca -0.00 -0.11 0.00 0.00 -1.94 0.00 0.00 57.00 54.94 2g6j n GLN 508 Cb 0.15 -0.89 0.00 0.00 0.11 0.00 0.00 30.24 29.61 2g6j n GLN 508 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2g6j n GLY 509 N 1.09 1.54 3.57 1.08 0.00 0.16 -5.00 105.19 107.64 2g6j n GLY 509 Ca 0.02 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.56 2g6j n GLY 509 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2g6j n TRP 510 N 0.00 1.21 -2.72 1.61 -0.00 -0.47 -4.84 117.44 112.23 2g6j n TRP 510 Ca 0.00 0.70 -0.43 0.00 -0.00 0.00 0.00 57.50 57.77 2g6j n TRP 510 Cb 0.00 -2.26 0.00 0.00 -0.00 0.00 0.00 31.31 29.06 2g6j n TRP 510 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 2g6j n LYS 511 N 1.44 3.74 -1.69 5.87 5.02 -1.26 -4.48 118.16 126.80 2g6j n LYS 511 Ca 0.14 -3.91 -0.53 0.00 -2.02 0.00 0.00 58.31 51.98 2g6j n LYS 511 Cb 0.27 -2.83 -0.06 0.00 -0.02 0.00 0.00 35.03 32.39 2g6j n LYS 511 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2g6j n ALA 512 N 3.61 0.19 0.54 7.82 0.00 -1.26 -4.84 120.51 126.57 2g6j n ALA 512 Ca 0.35 0.37 0.12 0.00 0.00 0.00 0.00 53.44 54.27 2g6j n ALA 512 Cb 0.37 -2.31 0.45 0.00 0.00 0.00 0.00 19.45 17.96 2g6j n ALA 512 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2g6j n PRO 513 N 5.37 0.16 -3.60 0.00 -0.02 -1.26 -4.93 135.00 130.72 2g6j n PRO 513 Ca 0.24 0.29 -0.24 0.00 -2.02 0.00 0.00 63.50 61.78 2g6j n PRO 513 Cb 0.20 -1.75 0.08 0.00 -0.02 0.00 0.00 33.50 32.01 2g6j n PRO 513 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2g6j n ARG 514 N -2.04 -7.62 -0.88 -0.52 5.12 -1.26 -5.02 116.66 104.44 2g6j n ARG 514 Ca 0.04 0.81 0.00 0.00 -1.93 0.00 0.00 57.85 56.77 2g6j n ARG 514 Cb 0.28 -5.85 0.00 0.00 -1.16 0.00 0.00 32.46 25.73 2g6j n ARG 514 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2g6j n GLY 515 N -1.88 2.24 0.11 -0.13 0.00 -1.26 -5.06 105.19 99.20 2g6j n GLY 515 Ca -0.03 -2.12 -0.14 0.00 0.00 0.00 0.00 46.02 43.74 2g6j n GLY 515 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2g6j n ARG 516 N -0.71 0.68 -3.11 1.61 0.63 -1.26 -4.41 116.66 110.08 2g6j n ARG 516 Ca 0.00 0.22 -0.25 0.00 -0.92 0.00 0.00 57.85 56.90 2g6j n ARG 516 Cb 0.00 -1.69 -0.05 0.00 0.45 0.00 0.00 32.46 31.18 2g6j n ARG 516 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 2g6j n PHE 517 N -3.16 2.63 -3.02 -0.14 3.01 -1.26 -4.27 117.46 111.26 2g6j n PHE 517 Ca -0.28 -3.94 -0.41 0.00 1.01 0.00 0.00 57.45 53.82 2g6j n PHE 517 Cb 1.06 -0.47 -0.05 0.00 -0.01 0.00 0.00 39.48 40.00 2g6j n PHE 517 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 2g6j s ASP 518 N -2.82 6.66 -0.02 4.37 1.01 -1.26 -4.94 116.67 119.66 2g6j s ASP 518 Ca 0.44 0.77 -0.30 0.00 0.71 0.00 0.00 52.55 54.17 2g6j s ASP 518 Cb 0.26 -2.38 -0.07 0.00 1.01 0.00 0.00 42.92 41.75 2g6j s ASP 518 CO -0.10 -0.47 1.76 -0.69 0.21 0.00 0.00 175.17 175.89 2g6j s VAL 519 N 2.69 3.38 0.86 -1.27 1.01 -1.26 -1.73 120.40 124.08 2g6j s VAL 519 Ca 0.30 0.46 -0.11 0.00 0.00 0.00 0.00 61.98 62.63 2g6j s VAL 519 Cb -0.15 -3.30 0.11 0.00 0.00 0.00 0.00 36.38 33.04 2g6j s VAL 519 CO 0.09 -0.04 1.15 -0.76 0.00 0.00 0.00 175.10 175.54 2g6j s LEU 520 N 4.17 2.97 0.14 3.92 1.43 0.48 -4.91 118.68 126.88 2g6j s LEU 520 Ca 0.79 2.18 -0.13 0.00 -1.03 0.00 0.00 54.13 55.93 2g6j s LEU 520 Cb -0.37 -4.57 -0.07 0.00 0.03 0.00 0.00 46.19 41.22 2g6j s LEU 520 CO 0.34 -2.79 0.53 -2.16 0.23 0.00 0.00 176.35 172.50 2g6j s PRO 521 N -4.54 3.94 0.41 1.29 0.04 -1.26 -4.77 135.00 130.12 2g6j s PRO 521 Ca 0.68 0.44 -0.25 0.00 0.04 0.00 0.00 61.00 61.91 2g6j s PRO 521 Cb -0.23 -2.92 -0.08 0.00 0.04 0.00 0.00 34.50 31.31 2g6j s PRO 521 CO 0.55 0.48 1.15 -0.51 0.04 0.00 0.00 177.00 178.71 2g6j s LEU 522 N -2.01 4.15 -0.29 -3.56 1.43 -0.70 -4.88 118.68 112.81 2g6j s LEU 522 Ca 0.38 2.29 0.01 0.00 -1.03 0.00 0.00 54.13 55.78 2g6j s LEU 522 Cb -0.15 -4.09 0.09 0.00 0.03 0.00 0.00 46.19 42.07 2g6j s LEU 522 CO 0.19 -0.70 0.03 -0.22 0.23 0.00 0.00 176.35 175.88 2g6j s LEU 523 N -2.62 3.20 -0.17 1.79 0.20 -1.25 -2.64 118.68 117.19 2g6j s LEU 523 Ca 0.58 -1.64 -0.05 0.00 0.69 0.00 0.00 54.13 53.72 2g6j s LEU 523 Cb -0.29 -1.24 -0.03 0.00 -0.43 0.00 0.00 46.19 44.21 2g6j s LEU 523 CO 0.36 -0.34 -0.01 -0.76 -0.29 0.00 0.00 176.35 175.31 2g6j s LEU 524 N 1.30 3.35 -0.29 -0.68 1.43 0.61 -2.01 118.68 122.38 2g6j s LEU 524 Ca 0.04 -0.10 -0.05 0.00 -1.03 0.00 0.00 54.13 52.99 2g6j s LEU 524 Cb -0.18 -1.82 0.02 0.00 0.03 0.00 0.00 46.19 44.23 2g6j s LEU 524 CO -0.13 0.15 0.04 -1.58 0.23 0.00 0.00 176.35 175.06 2g6j s GLN 525 N 0.47 2.92 -0.09 1.70 0.74 -0.51 -0.29 119.66 124.60 2g6j s GLN 525 Ca -0.02 -0.95 0.01 0.00 0.05 0.00 0.00 55.36 54.45 2g6j s GLN 525 Cb -0.14 -3.25 -0.02 0.00 1.10 0.00 0.00 33.01 30.70 2g6j s GLN 525 CO 0.02 -0.46 -0.12 0.00 -0.55 0.00 0.00 175.29 174.18 2g6j s ALA 526 N 1.42 2.71 -1.10 1.58 0.00 -1.26 -0.65 121.76 124.45 2g6j s ALA 526 Ca 0.01 -0.92 -0.06 0.00 0.00 0.00 0.00 51.96 50.99 2g6j s ALA 526 Cb -0.17 -1.15 0.05 0.00 0.00 0.00 0.00 23.12 21.85 2g6j s ALA 526 CO 0.00 0.41 0.31 -1.71 0.00 0.00 0.00 175.76 174.77 2g6j n ASN 527 N 2.89 -3.39 0.00 0.00 4.05 -1.24 -1.16 115.26 116.41 2g6j n ASN 527 Ca -0.18 -0.17 0.00 0.00 0.45 0.00 0.00 54.58 54.68 2g6j n ASN 527 Cb 0.53 -2.85 0.00 0.00 1.23 0.00 0.00 39.78 38.69 2g6j n ASN 527 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2g6j n GLY 528 N -1.00 2.94 3.36 8.20 0.00 -0.53 -4.39 105.19 113.77 2g6j n GLY 528 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 2g6j n GLY 528 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2g6j s ASN 529 N -1.42 -0.49 0.33 1.61 0.01 -0.31 -4.90 114.94 109.76 2g6j s ASN 529 Ca 0.00 1.04 -0.27 0.00 -0.71 0.00 0.00 52.86 52.92 2g6j s ASN 529 Cb 0.00 -1.53 -0.09 0.00 0.41 0.00 0.00 41.25 40.04 2g6j s ASN 529 CO 0.00 -5.04 1.07 -1.81 -1.51 0.00 0.00 177.10 169.81 2g6j s ASP 530 N -2.97 7.06 0.77 -1.22 -0.00 -1.26 -4.42 116.67 114.63 2g6j s ASP 530 Ca 0.69 2.16 -0.14 0.00 -0.00 0.00 0.00 52.55 55.26 2g6j s ASP 530 Cb -0.17 -2.61 0.06 0.00 -0.00 0.00 0.00 42.92 40.21 2g6j s ASP 530 CO 0.60 -0.28 1.19 -2.16 -0.00 0.00 0.00 175.17 174.52 2g6j s PRO 531 N -1.88 1.93 0.22 8.23 0.04 -1.26 -4.73 135.00 137.55 2g6j s PRO 531 Ca 0.50 1.68 0.08 0.00 0.04 0.00 0.00 61.00 63.30 2g6j s PRO 531 Cb -0.28 -1.82 -0.05 0.00 0.04 0.00 0.00 34.50 32.40 2g6j s PRO 531 CO 0.35 -1.98 -0.14 -1.21 0.04 0.00 0.00 177.00 174.06 2g6j s GLU 532 N -4.11 1.40 0.14 4.56 2.02 0.60 -4.84 118.70 118.46 2g6j s GLU 532 Ca 0.72 -1.64 0.03 0.00 0.02 0.00 0.00 54.97 54.11 2g6j s GLU 532 Cb -0.27 -1.21 -0.04 0.00 0.10 0.00 0.00 34.13 32.71 2g6j s GLU 532 CO 0.48 0.19 0.19 -0.51 0.02 0.00 0.00 175.26 175.63 2g6j s LEU 533 N -3.36 4.05 -0.16 1.80 1.43 -1.26 -0.29 118.68 120.89 2g6j s LEU 533 Ca 0.24 0.03 -0.26 0.00 -1.03 0.00 0.00 54.13 53.12 2g6j s LEU 533 Cb -0.01 -2.66 0.06 0.00 0.03 0.00 0.00 46.19 43.62 2g6j s LEU 533 CO 0.08 0.09 0.65 -0.36 0.23 0.00 0.00 176.35 177.04 2g6j s PHE 534 N -1.67 -0.67 -0.29 0.29 0.40 -1.08 -4.98 117.98 109.97 2g6j s PHE 534 Ca 0.32 1.46 -0.09 0.00 -0.60 0.00 0.00 56.93 58.03 2g6j s PHE 534 Cb -0.11 0.30 -0.02 0.00 0.51 0.00 0.00 43.02 43.70 2g6j s PHE 534 CO 0.25 -0.45 0.13 -1.14 0.70 0.00 0.00 175.22 174.72 2g6j s GLN 535 N -0.31 3.50 -0.01 0.44 2.00 -1.26 -1.72 119.66 122.31 2g6j s GLN 535 Ca -0.05 -0.60 -0.35 0.00 -2.00 0.00 0.00 55.36 52.36 2g6j s GLN 535 Cb -0.03 -3.50 -0.13 0.00 0.80 0.00 0.00 33.01 30.15 2g6j s GLN 535 CO 0.04 -0.32 1.72 -0.89 -0.50 0.00 0.00 175.29 175.34 2g6j n ILE 536 N 4.97 0.30 -1.34 -2.34 5.41 -1.26 -4.74 119.36 120.37 2g6j n ILE 536 Ca -0.15 -0.05 -0.58 0.00 1.00 0.00 0.00 62.75 62.97 2g6j n ILE 536 Cb 0.50 -1.60 -0.10 0.00 -0.71 0.00 0.00 39.64 37.72 2g6j n ILE 536 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2g6j n PRO 537 N 5.05 0.32 -0.39 0.38 -0.02 -1.26 -4.71 135.00 134.37 2g6j n PRO 537 Ca 0.21 0.09 0.31 0.00 -2.02 0.00 0.00 63.50 62.09 2g6j n PRO 537 Cb 0.27 -1.77 0.59 0.00 -0.02 0.00 0.00 33.50 32.57 2g6j n PRO 537 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2g6j h PRO 538 N 9.65 0.20 0.00 0.52 0.11 -1.96 1.28 132.00 141.80 2g6j h PRO 538 Ca -0.17 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.93 2g6j h PRO 538 Cb 1.39 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2g6j h PRO 538 CO 1.06 0.13 0.00 -0.85 -0.21 0.00 0.00 178.00 178.14 2g6j n GLU 539 N -4.68 0.26 -0.01 1.05 0.00 -1.26 -2.27 120.64 113.73 2g6j n GLU 539 Ca 0.32 0.11 0.08 0.00 0.00 0.00 0.00 57.16 57.67 2g6j n GLU 539 Cb 1.20 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 31.00 2g6j n GLU 539 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 2g6j n LEU 540 N -1.19 0.00 -4.50 -1.84 4.77 0.44 -4.82 117.00 109.86 2g6j n LEU 540 Ca 0.07 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.62 2g6j n LEU 540 Cb 0.08 0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 2g6j n LEU 540 CO 0.09 0.03 1.31 -0.69 -1.33 0.00 0.00 177.39 176.80 2g6j s VAL 541 N -3.19 4.53 0.20 4.08 1.01 -0.96 -4.80 120.40 121.27 2g6j s VAL 541 Ca -0.07 -1.66 -0.31 0.00 0.00 0.00 0.00 61.98 59.95 2g6j s VAL 541 Cb 0.11 -4.93 -0.10 0.00 0.00 0.00 0.00 36.38 31.47 2g6j s VAL 541 CO 0.75 -1.70 1.50 -0.22 0.00 0.00 0.00 175.10 175.42 2g6j s LEU 542 N 3.18 4.38 0.18 3.92 2.96 -1.26 -4.99 118.68 127.05 2g6j s LEU 542 Ca 0.41 2.63 0.05 0.00 -0.22 0.00 0.00 54.13 57.00 2g6j s LEU 542 Cb -0.02 -3.61 -0.05 0.00 0.50 0.00 0.00 46.19 43.01 2g6j s LEU 542 CO -0.05 -0.76 -0.08 -1.61 -1.32 0.00 0.00 176.35 172.52 2g6j s GLU 543 N 0.38 1.20 -0.11 1.98 2.02 -1.26 -1.85 118.70 121.05 2g6j s GLU 543 Ca 0.64 -1.55 -0.01 0.00 0.02 0.00 0.00 54.97 54.07 2g6j s GLU 543 Cb -0.43 -0.74 0.03 0.00 0.10 0.00 0.00 34.13 33.10 2g6j s GLU 543 CO 0.37 0.05 -0.01 0.08 0.02 0.00 0.00 175.26 175.78 2g6j s VAL 544 N -3.27 0.60 0.29 2.63 1.01 0.12 -4.89 120.40 116.90 2g6j s VAL 544 Ca 0.21 -0.16 -0.29 0.00 0.00 0.00 0.00 61.98 61.74 2g6j s VAL 544 Cb 0.03 -0.80 -0.10 0.00 0.00 0.00 0.00 36.38 35.51 2g6j s VAL 544 CO 0.04 0.18 1.15 -2.16 0.00 0.00 0.00 175.10 174.31 2g6j s PRO 545 N 1.87 4.57 -0.34 2.72 0.04 -1.26 -1.30 135.00 141.30 2g6j s PRO 545 Ca 0.03 1.90 -0.13 0.00 0.04 0.00 0.00 61.00 62.85 2g6j s PRO 545 Cb -0.14 -3.16 -0.02 0.00 0.04 0.00 0.00 34.50 31.23 2g6j s PRO 545 CO -0.07 0.11 0.25 0.42 0.04 0.00 0.00 177.00 177.75 2g6j s ILE 546 N -1.16 5.28 0.28 0.56 -1.09 0.23 -4.84 121.20 120.47 2g6j s ILE 546 Ca 0.46 -0.17 0.06 0.00 -2.23 0.00 0.00 60.65 58.77 2g6j s ILE 546 Cb -0.34 -3.71 -0.06 0.00 -1.58 0.00 0.00 42.46 36.77 2g6j s ILE 546 CO 0.44 0.00 -0.04 0.00 -1.23 0.00 0.00 174.94 174.11 2g6j s ARG 547 N 1.75 1.55 -0.01 2.79 3.03 -1.26 -4.24 118.95 122.55 2g6j s ARG 547 Ca 0.07 -1.79 0.01 0.00 2.03 0.00 0.00 55.73 56.04 2g6j s ARG 547 Cb -0.17 -1.10 -0.04 0.00 -1.03 0.00 0.00 34.95 32.62 2g6j s ARG 547 CO 0.11 0.01 0.04 -1.58 -1.13 0.00 0.00 175.30 172.74 2g6j s HIS 548 N -3.06 3.17 -1.28 5.89 2.46 -1.26 -4.28 115.29 116.94 2g6j s HIS 548 Ca 0.30 0.14 0.00 0.00 0.47 0.00 0.00 55.06 55.97 2g6j s HIS 548 Cb 0.04 -1.70 0.00 0.00 -0.13 0.00 0.00 32.58 30.79 2g6j s HIS 548 CO 0.12 0.50 0.54 -0.35 -2.47 0.00 0.00 174.74 173.08 2g6j n PRO 549 N 1.32 0.85 0.00 2.88 -0.04 -1.26 -4.07 135.00 134.68 2g6j n PRO 549 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 2g6j n PRO 549 Cb 0.53 -1.31 0.00 0.00 -0.04 0.00 0.00 33.50 32.68 2g6j n PRO 549 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2g6j n LYS 550 N -0.08 0.00 -2.83 0.54 5.02 -1.26 -5.06 118.16 114.49 2g6j n LYS 550 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 2g6j n LYS 550 Cb 0.15 -0.05 -0.04 0.00 -0.02 0.00 0.00 35.03 35.08 2g6j n LYS 550 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2g6j s PHE 551 N -1.64 2.66 -1.16 2.13 2.99 -1.26 -4.87 117.98 116.83 2g6j s PHE 551 Ca 0.00 -0.45 0.23 0.00 0.00 0.00 0.00 56.93 56.70 2g6j s PHE 551 Cb 0.00 -4.29 1.04 0.00 0.00 0.00 0.00 43.02 39.78 2g6j s PHE 551 CO 0.00 -1.65 1.74 -0.25 -0.00 0.00 0.00 175.22 175.06 2g6j n ASP 552 N 7.80 0.00 0.04 1.36 8.00 -1.26 -2.14 116.55 130.34 2g6j n ASP 552 Ca -0.03 0.29 0.13 0.00 0.71 0.00 0.00 54.79 55.90 2g6j n ASP 552 Cb 0.46 -0.42 0.49 0.00 -0.02 0.00 0.00 41.12 41.63 2g6j n ASP 552 CO 0.00 0.00 0.00 -2.67 -0.39 0.00 0.00 177.20 174.14 2g6j n TRP 553 N -1.42 0.32 -0.03 1.24 4.27 -1.26 -3.98 117.44 116.58 2g6j n TRP 553 Ca 0.08 0.09 -0.09 0.00 -3.89 0.00 0.00 57.50 53.69 2g6j n TRP 553 Cb 0.23 -0.62 -0.03 0.00 -1.36 0.00 0.00 31.31 29.53 2g6j n TRP 553 CO 0.00 0.00 0.00 0.35 -2.29 0.00 0.00 177.69 175.75 2g6j h PHE 554 N 0.00 -0.02 0.00 -2.67 3.57 -1.82 -2.04 116.94 113.97 2g6j h PHE 554 Ca 0.00 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2g6j h PHE 554 Cb 0.59 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.36 2g6j h PHE 554 CO 0.00 -0.03 0.33 1.57 -2.23 0.00 0.00 178.31 177.95 2g6j h LYS 555 N 0.05 0.00 0.00 1.11 2.10 -1.74 -1.14 116.57 116.96 2g6j h LYS 555 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.74 2g6j h LYS 555 Cb 0.11 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.44 2g6j h LYS 555 CO -0.15 0.00 0.00 -0.25 -2.00 0.00 0.00 179.45 177.05 2g6j n ASP 556 N -2.76 0.71 0.02 7.07 8.00 -0.77 -2.09 116.55 126.74 2g6j n ASP 556 Ca -0.02 0.65 0.10 0.00 0.71 0.00 0.00 54.79 56.23 2g6j n ASP 556 Cb 0.37 -0.81 0.43 0.00 -0.02 0.00 0.00 41.12 41.09 2g6j n ASP 556 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2g6j n LEU 557 N -2.26 0.13 -3.05 0.64 4.77 -0.43 -4.89 117.00 111.90 2g6j n LEU 557 Ca 0.03 0.52 -0.21 0.00 -0.03 0.00 0.00 56.01 56.32 2g6j n LEU 557 Cb 0.27 -0.50 0.05 0.00 -2.33 0.00 0.00 43.42 40.92 2g6j n LEU 557 CO 0.22 -0.20 0.12 0.61 -1.33 0.00 0.00 177.39 176.81 2g6j n GLY 558 N 0.54 -0.40 3.80 -0.72 0.00 -0.89 -4.99 105.19 102.52 2g6j n GLY 558 Ca 0.05 0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 2g6j n GLY 558 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g6j s LEU 559 N -6.43 4.44 -0.00 0.99 1.43 -1.26 -5.01 118.68 112.85 2g6j s LEU 559 Ca 0.42 1.04 -0.11 0.00 -1.03 0.00 0.00 54.13 54.44 2g6j s LEU 559 Cb -0.18 -2.73 0.01 0.00 0.03 0.00 0.00 46.19 43.32 2g6j s LEU 559 CO 0.51 0.22 0.23 -1.59 0.23 0.00 0.00 176.35 175.96 2g6j s LYS 560 N -0.64 0.60 0.03 1.70 -2.85 -1.26 0.78 119.74 118.10 2g6j s LYS 560 Ca 0.26 -0.32 0.00 0.00 -1.00 0.00 0.00 55.97 54.91 2g6j s LYS 560 Cb -0.17 0.26 -0.03 0.00 -2.06 0.00 0.00 37.83 35.83 2g6j s LYS 560 CO 0.15 -0.16 -0.04 -0.46 0.10 0.00 0.00 175.35 174.94 2g6j s TRP 561 N -1.50 0.40 0.42 1.78 -0.11 -0.42 -4.94 118.94 114.57 2g6j s TRP 561 Ca -0.13 -0.68 -0.20 0.00 1.22 0.00 0.00 56.10 56.30 2g6j s TRP 561 Cb -0.06 -0.28 -0.11 0.00 -1.50 0.00 0.00 33.47 31.53 2g6j s TRP 561 CO 0.02 -0.23 0.94 1.52 -4.62 0.00 0.00 176.95 174.58 2g6j s TYR 562 N -2.18 3.32 -0.62 5.86 -0.85 -1.26 -0.70 117.35 120.91 2g6j s TYR 562 Ca -0.08 1.58 0.24 0.00 -0.52 0.00 0.00 57.07 58.29 2g6j s TYR 562 Cb -0.05 -2.83 0.43 0.00 0.38 0.00 0.00 41.96 39.90 2g6j s TYR 562 CO -0.03 -0.10 1.43 0.78 -1.52 0.00 0.00 175.55 176.10 2g6j h GLY 563 N 1.92 0.00 -7.57 5.49 0.00 -1.71 -3.45 103.07 97.75 2g6j h GLY 563 Ca -0.49 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.14 2g6j h GLY 563 CO 0.61 0.00 -0.54 -2.27 0.00 0.00 0.00 176.54 174.34 2g6j s LEU 564 N -4.49 4.74 -0.18 3.11 2.96 -1.26 -4.60 118.68 118.95 2g6j s LEU 564 Ca 0.07 -1.33 -0.23 0.00 -0.22 0.00 0.00 54.13 52.42 2g6j s LEU 564 Cb 0.12 -1.92 -0.02 0.00 0.50 0.00 0.00 46.19 44.87 2g6j s LEU 564 CO 0.69 -0.43 0.74 -2.16 -1.32 0.00 0.00 176.35 173.87 2g6j s PRO 565 N 1.41 4.26 -0.41 0.98 0.04 -1.26 -4.72 135.00 135.30 2g6j s PRO 565 Ca 0.01 0.83 0.04 0.00 0.04 0.00 0.00 61.00 61.92 2g6j s PRO 565 Cb -0.21 -3.57 0.17 0.00 0.04 0.00 0.00 34.50 30.92 2g6j s PRO 565 CO 0.02 -0.28 0.35 0.00 0.04 0.00 0.00 177.00 177.13 2g6j s ALA 566 N 2.01 1.15 0.04 8.56 0.00 -1.26 -3.05 121.76 129.22 2g6j s ALA 566 Ca 0.34 -2.28 -0.36 0.00 0.00 0.00 0.00 51.96 49.66 2g6j s ALA 566 Cb -0.16 -1.65 -0.15 0.00 0.00 0.00 0.00 23.12 21.15 2g6j s ALA 566 CO 0.12 -2.00 1.53 0.28 0.00 0.00 0.00 175.76 175.68 2g6j n VAL 567 N 2.98 0.11 -0.45 0.00 0.31 -0.90 -1.56 118.33 118.81 2g6j n VAL 567 Ca 0.28 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.59 2g6j n VAL 567 Cb 0.47 -1.20 0.00 0.00 -0.91 0.00 0.00 33.84 32.20 2g6j n VAL 567 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2g6j n SER 568 N 3.64 0.62 -1.37 4.52 3.41 0.05 -2.05 113.62 122.44 2g6j n SER 568 Ca 0.20 -1.07 0.12 0.00 -0.26 0.00 0.00 58.87 57.85 2g6j n SER 568 Cb 0.22 0.00 0.33 0.00 -0.26 0.00 0.00 64.21 64.50 2g6j n SER 568 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2g6j n ASN 569 N -0.04 4.03 -4.93 4.04 2.04 -1.23 -4.54 115.26 114.62 2g6j n ASN 569 Ca 0.00 -2.04 -0.25 0.00 -0.44 0.00 0.00 54.58 51.85 2g6j n ASN 569 Cb 0.15 -0.50 0.02 0.00 -2.53 0.00 0.00 39.78 36.92 2g6j n ASN 569 CO 0.00 0.00 0.00 -0.04 -0.44 0.00 0.00 177.26 176.78 2g6j s MET 570 N -1.08 3.07 -0.16 -3.83 -1.94 -1.26 -4.37 119.30 109.73 2g6j s MET 570 Ca 0.49 -0.24 -0.03 0.00 -1.71 0.00 0.00 55.69 54.21 2g6j s MET 570 Cb 0.26 -2.44 -0.02 0.00 2.01 0.00 0.00 34.83 34.65 2g6j s MET 570 CO 0.32 -0.41 -0.07 -1.17 -0.01 0.00 0.00 175.02 173.68 2g6j s LEU 571 N -4.73 3.01 -0.26 -0.03 0.20 -0.02 -4.26 118.68 112.59 2g6j s LEU 571 Ca 0.50 -0.24 -0.11 0.00 0.69 0.00 0.00 54.13 54.97 2g6j s LEU 571 Cb -0.10 -1.72 -0.05 0.00 -0.43 0.00 0.00 46.19 43.89 2g6j s LEU 571 CO 0.41 0.13 0.17 -0.22 -0.29 0.00 0.00 176.35 176.55 2g6j s LEU 572 N 0.58 4.05 -0.22 -0.68 2.96 0.00 0.59 118.68 125.97 2g6j s LEU 572 Ca -0.04 0.05 -0.05 0.00 -0.22 0.00 0.00 54.13 53.87 2g6j s LEU 572 Cb -0.15 -2.10 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 2g6j s LEU 572 CO 0.03 0.01 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.36 2g6j s GLU 573 N 1.37 3.49 -0.08 1.98 2.12 -0.36 -0.09 118.70 127.13 2g6j s GLU 573 Ca 0.07 -0.57 0.00 0.00 0.36 0.00 0.00 54.97 54.84 2g6j s GLU 573 Cb -0.15 -3.09 0.02 0.00 0.26 0.00 0.00 34.13 31.18 2g6j s GLU 573 CO 0.07 -0.14 -0.07 0.42 -0.54 0.00 0.00 175.26 175.00 2g6j s ILE 574 N 1.38 0.84 -1.36 -3.70 1.01 -0.78 -2.32 121.20 116.27 2g6j s ILE 574 Ca 0.05 -0.24 -0.12 0.00 0.00 0.00 0.00 60.65 60.34 2g6j s ILE 574 Cb -0.15 -0.86 0.10 0.00 0.01 0.00 0.00 42.46 41.57 2g6j s ILE 574 CO -0.00 0.32 0.56 0.61 0.00 0.00 0.00 174.94 176.43 2g6j n GLY 575 N 4.48 -0.47 1.97 6.18 0.00 -1.26 -0.47 105.19 115.61 2g6j n GLY 575 Ca -0.17 0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2g6j n GLY 575 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g6j n GLY 576 N -1.21 3.11 3.80 -0.02 0.00 -1.26 -3.36 105.19 106.25 2g6j n GLY 576 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.70 2g6j n GLY 576 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g6j s LEU 577 N 0.00 3.84 -0.21 0.99 1.43 0.38 -4.99 118.68 120.12 2g6j s LEU 577 Ca 0.00 1.91 0.02 0.00 -1.03 0.00 0.00 54.13 55.03 2g6j s LEU 577 Cb 0.00 -4.56 0.04 0.00 0.03 0.00 0.00 46.19 41.70 2g6j s LEU 577 CO 0.00 -0.77 -0.16 -1.61 0.23 0.00 0.00 176.35 174.04 2g6j s GLU 578 N -3.26 2.68 -0.60 1.70 2.02 -1.26 -1.86 118.70 118.12 2g6j s GLU 578 Ca 0.67 -1.04 -0.14 0.00 0.02 0.00 0.00 54.97 54.49 2g6j s GLU 578 Cb -0.16 -2.70 0.15 0.00 0.10 0.00 0.00 34.13 31.53 2g6j s GLU 578 CO 0.20 -0.36 0.53 -0.06 0.02 0.00 0.00 175.26 175.60 2g6j s PHE 579 N 1.22 3.42 -0.02 1.61 0.40 0.87 -0.52 117.98 124.96 2g6j s PHE 579 Ca -0.01 -1.65 0.27 0.00 -0.60 0.00 0.00 56.93 54.94 2g6j s PHE 579 Cb -0.16 -3.72 0.91 0.00 0.51 0.00 0.00 43.02 40.57 2g6j s PHE 579 CO -0.10 -1.00 1.82 0.66 0.70 0.00 0.00 175.22 177.30 2g6j h SER 580 N 8.44 0.00 -3.73 1.36 4.64 -1.80 0.05 113.55 122.50 2g6j h SER 580 Ca -0.17 0.00 -0.67 0.00 -0.47 0.00 0.00 61.79 60.48 2g6j h SER 580 Cb 1.07 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.79 2g6j h SER 580 CO 0.92 0.11 -0.72 0.00 -0.87 0.00 0.00 176.83 176.26 2g6j s ALA 581 N -3.52 2.82 -0.42 5.18 0.00 -1.14 -4.63 121.76 120.05 2g6j s ALA 581 Ca 0.02 -2.21 0.08 0.00 0.00 0.00 0.00 51.96 49.86 2g6j s ALA 581 Cb 0.08 -1.90 0.29 0.00 0.00 0.00 0.00 23.12 21.59 2g6j s ALA 581 CO 0.61 -1.50 0.77 0.00 0.00 0.00 0.00 175.76 175.64 2g6j s PRO 583 N -0.83 3.87 0.06 0.00 0.04 -1.22 -4.76 135.00 132.16 2g6j s PRO 583 Ca 0.33 2.27 0.01 0.00 0.04 0.00 0.00 61.00 63.66 2g6j s PRO 583 Cb 0.25 -2.73 -0.03 0.00 0.04 0.00 0.00 34.50 32.03 2g6j s PRO 583 CO -0.12 -0.61 -0.06 -0.59 0.04 0.00 0.00 177.00 175.66 2g6j s PHE 584 N -1.23 0.64 0.06 0.56 -0.12 -0.87 -1.66 117.98 115.36 2g6j s PHE 584 Ca 0.58 -0.73 -0.12 0.00 -0.05 0.00 0.00 56.93 56.61 2g6j s PHE 584 Cb -0.41 -0.40 0.01 0.00 -0.63 0.00 0.00 43.02 41.60 2g6j s PHE 584 CO 0.52 -0.17 0.27 -1.54 -0.05 0.00 0.00 175.22 174.25 2g6j s SER 585 N -2.22 -0.05 0.00 1.98 1.04 0.45 -2.12 113.70 112.77 2g6j s SER 585 Ca -0.02 -0.35 0.00 0.00 0.48 0.00 0.00 55.95 56.07 2g6j s SER 585 Cb -0.02 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2g6j s SER 585 CO -0.03 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.14 2g6j n GLY 586 N 0.34 4.52 3.22 7.32 0.00 -1.17 -1.18 105.19 118.24 2g6j n GLY 586 Ca -0.17 -0.58 -0.09 0.00 0.00 0.00 0.00 46.02 45.17 2g6j n GLY 586 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2g6j s TRP 587 N 3.32 0.08 0.52 1.61 -2.14 -1.26 -4.47 118.94 116.61 2g6j s TRP 587 Ca 0.00 -0.49 -0.19 0.00 2.66 0.00 0.00 56.10 58.08 2g6j s TRP 587 Cb 0.00 -0.00 -0.07 0.00 -3.10 0.00 0.00 33.47 30.30 2g6j s TRP 587 CO 0.00 -0.56 1.06 0.71 -2.66 0.00 0.00 176.95 175.50 2g6j s TYR 588 N -3.78 2.91 -0.18 1.66 1.51 -1.26 -4.92 117.35 113.28 2g6j s TYR 588 Ca 0.04 1.56 -0.07 0.00 -1.01 0.00 0.00 57.07 57.59 2g6j s TYR 588 Cb 0.04 -3.11 -0.04 0.00 -0.11 0.00 0.00 41.96 38.74 2g6j s TYR 588 CO -0.11 -1.07 0.05 1.41 -1.11 0.00 0.00 175.55 174.72 2g6j s MET 589 N -3.38 3.89 0.27 -0.62 -2.45 -1.26 -0.76 119.30 115.00 2g6j s MET 589 Ca 0.68 -0.39 -0.08 0.00 -1.25 0.00 0.00 55.69 54.65 2g6j s MET 589 Cb -0.18 -3.18 0.44 0.00 1.25 0.00 0.00 34.83 33.16 2g6j s MET 589 CO 0.24 0.22 1.56 0.78 1.05 0.00 0.00 175.02 178.88 2g6j h GLY 590 N 6.86 0.70 1.33 2.11 0.00 0.06 -1.40 103.07 112.72 2g6j h GLY 590 Ca -0.36 0.32 0.05 0.00 0.00 0.00 0.00 47.33 47.35 2g6j h GLY 590 CO 0.68 -0.37 0.28 -0.91 0.00 0.00 0.00 176.54 176.22 2g6j h THR 591 N -0.00 0.29 -0.77 4.70 1.35 -1.94 -1.96 112.91 114.58 2g6j h THR 591 Ca 0.47 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 66.32 2g6j h THR 591 Cb 0.71 0.76 -0.04 0.00 -1.73 0.00 0.00 68.15 67.85 2g6j h THR 591 CO -1.00 0.00 0.45 -0.33 -0.25 0.00 0.00 175.52 174.38 2g6j h GLU 592 N 0.00 1.06 0.00 4.72 5.08 -1.65 -0.06 114.58 123.73 2g6j h GLU 592 Ca 0.09 -0.11 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2g6j h GLU 592 Cb 0.65 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2g6j h GLU 592 CO -0.00 0.77 -0.60 0.82 -1.00 0.00 0.00 179.01 179.00 2g6j h ILE 593 N 1.06 0.30 -0.07 3.13 2.04 -1.64 -1.98 117.51 120.35 2g6j h ILE 593 Ca 0.27 -1.34 0.03 0.00 1.00 0.00 0.00 64.86 64.83 2g6j h ILE 593 Cb -0.00 0.68 -0.04 0.00 -0.74 0.00 0.00 36.82 36.72 2g6j h ILE 593 CO -0.05 0.10 -0.13 1.23 0.00 0.00 0.00 178.15 179.30 2g6j h GLY 594 N -1.00 -0.10 0.00 5.37 0.00 -1.45 -0.46 103.07 105.43 2g6j h GLY 594 Ca -0.08 0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.39 2g6j h GLY 594 CO -0.05 -0.14 -0.14 -2.08 0.00 0.00 0.00 176.54 174.13 2g6j h VAL 595 N -0.19 0.86 0.00 4.60 2.07 -1.23 -3.33 116.25 119.04 2g6j h VAL 595 Ca 0.07 -1.69 -0.02 0.00 0.82 0.00 0.00 66.70 65.89 2g6j h VAL 595 Cb 0.29 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 2g6j h VAL 595 CO -0.19 0.29 -0.10 0.03 0.02 0.00 0.00 177.57 177.62 2g6j h ARG 596 N -1.00 0.00 -0.60 1.57 2.47 -1.49 -2.82 114.38 112.51 2g6j h ARG 596 Ca -0.03 0.00 -0.09 0.00 -1.26 0.00 0.00 59.98 58.60 2g6j h ARG 596 Cb 0.58 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.88 2g6j h ARG 596 CO -0.02 0.60 0.01 -0.44 0.56 0.00 0.00 179.97 180.69 2g6j h ASP 597 N -1.00 1.04 0.32 7.04 3.32 -1.04 -2.50 116.42 123.60 2g6j h ASP 597 Ca -0.02 -0.30 -0.33 0.00 0.02 0.00 0.00 57.03 56.40 2g6j h ASP 597 Cb 0.64 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.92 2g6j h ASP 597 CO -0.01 1.08 -1.61 1.88 -1.72 0.00 0.00 179.24 178.86 2g6j h TYR 598 N 0.96 0.64 0.00 4.55 0.99 -1.26 -2.25 116.97 120.59 2g6j h TYR 598 Ca 0.17 -0.47 0.00 0.00 2.00 0.00 0.00 58.73 60.44 2g6j h TYR 598 Cb 0.55 -0.03 0.00 0.00 1.00 0.00 0.00 36.73 38.25 2g6j h TYR 598 CO 0.04 1.53 -1.27 0.00 -0.00 0.00 0.00 178.16 178.46 2g6j n ASP 600 N -1.74 2.17 0.26 0.00 9.92 -0.94 -4.61 116.55 121.61 2g6j n ASP 600 Ca -0.00 1.18 0.09 0.00 -0.53 0.00 0.00 54.79 55.53 2g6j n ASP 600 Cb 0.33 -1.39 0.67 0.00 -0.64 0.00 0.00 41.12 40.08 2g6j n ASP 600 CO 0.00 0.00 0.00 -1.13 0.13 0.00 0.00 177.20 176.20 2g6j h ASN 601 N 2.64 0.00 -0.49 -2.24 -0.73 -1.94 -1.84 115.58 110.99 2g6j h ASN 601 Ca -0.43 0.00 0.00 0.00 1.87 0.00 0.00 56.30 57.74 2g6j h ASN 601 Cb 1.31 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.90 2g6j h ASN 601 CO 0.64 0.06 0.00 -1.54 -0.37 0.00 0.00 177.43 176.22 2g6j n SER 602 N -4.26 3.93 0.00 1.15 3.41 -1.26 -4.62 113.62 111.98 2g6j n SER 602 Ca -0.03 -2.42 0.00 0.00 -0.26 0.00 0.00 58.87 56.17 2g6j n SER 602 Cb 0.14 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2g6j n SER 602 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2g6j n ARG 603 N 0.75 1.92 0.00 4.33 5.12 -0.70 -4.38 116.66 123.70 2g6j n ARG 603 Ca 0.20 0.00 0.09 0.00 -1.93 0.00 0.00 57.85 56.21 2g6j n ARG 603 Cb 0.77 0.00 0.51 0.00 -1.16 0.00 0.00 32.46 32.58 2g6j n ARG 603 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2g6j n TYR 604 N 0.00 0.00 -2.37 -1.55 4.02 -0.85 -4.70 117.16 111.71 2g6j n TYR 604 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2g6j n TYR 604 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 2g6j n TYR 604 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 2g6j n ASN 605 N -0.99 0.00 -1.24 7.72 4.05 -0.91 -4.82 115.26 119.07 2g6j n ASN 605 Ca 0.13 0.00 0.11 0.00 0.45 0.00 0.00 54.58 55.27 2g6j n ASN 605 Cb 0.06 0.00 0.30 0.00 1.23 0.00 0.00 39.78 41.36 2g6j n ASN 605 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 177.26 176.51 2g6j n ILE 606 N -0.51 0.88 0.27 -1.44 -5.35 0.03 -4.62 119.36 108.62 2g6j n ILE 606 Ca 0.00 -0.89 -0.16 0.00 -0.27 0.00 0.00 62.75 61.43 2g6j n ILE 606 Cb 0.00 0.48 -0.08 0.00 -1.74 0.00 0.00 39.64 38.30 2g6j n ILE 606 CO 0.00 0.00 0.00 -0.07 -1.76 0.00 0.00 176.55 174.72 2g6j h LEU 607 N 3.96 -0.81 -0.10 7.28 3.38 -1.86 -2.46 115.31 124.70 2g6j h LEU 607 Ca 0.00 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.07 2g6j h LEU 607 Cb 0.90 0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.85 2g6j h LEU 607 CO 0.00 -0.48 -0.22 -0.33 0.09 0.00 0.00 178.44 177.49 2g6j h GLU 608 N -0.75 -0.29 -0.38 1.13 5.08 -1.99 0.13 114.58 117.51 2g6j h GLU 608 Ca -0.05 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.41 2g6j h GLU 608 Cb 0.63 0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.86 2g6j h GLU 608 CO 0.02 -0.19 -0.28 0.93 -1.00 0.00 0.00 179.01 178.49 2g6j h GLU 609 N -0.30 -0.21 -0.34 2.33 5.08 -1.87 0.27 114.58 119.54 2g6j h GLU 609 Ca 0.09 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 2g6j h GLU 609 Cb 0.43 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2g6j h GLU 609 CO -0.27 -0.14 0.19 0.28 -1.00 0.00 0.00 179.01 178.06 2g6j h VAL 610 N -0.22 1.11 -0.07 3.13 2.07 -1.01 -1.52 116.25 119.73 2g6j h VAL 610 Ca 0.18 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2g6j h VAL 610 Cb 0.51 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2g6j h VAL 610 CO -0.51 0.12 0.02 0.00 0.02 0.00 0.00 177.57 177.22 2g6j h ALA 611 N 1.74 0.09 0.19 1.67 0.00 0.21 -2.58 119.26 120.59 2g6j h ALA 611 Ca 0.12 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2g6j h ALA 611 Cb 0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2g6j h ALA 611 CO -0.02 -0.32 -0.27 0.87 0.00 0.00 0.00 179.25 179.52 2g6j h LYS 612 N -0.07 -0.50 -0.48 0.00 1.57 0.16 -1.74 116.57 115.52 2g6j h LYS 612 Ca 0.02 0.03 0.14 0.00 -1.87 0.00 0.00 60.65 58.97 2g6j h LYS 612 Cb 0.19 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.60 2g6j h LYS 612 CO -0.00 -0.34 0.47 0.87 -0.57 0.00 0.00 179.45 179.88 2g6j h LYS 613 N -0.52 0.00 -0.00 3.15 1.79 -1.28 0.39 116.57 120.09 2g6j h LYS 613 Ca 0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2g6j h LYS 613 Cb 0.51 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 2g6j h LYS 613 CO -0.10 0.00 -0.36 -1.33 -1.08 0.00 0.00 179.45 176.58 2g6j n MET 614 N -3.82 0.32 -3.62 3.15 2.81 -0.69 -4.96 117.12 110.31 2g6j n MET 614 Ca 0.09 -0.17 -0.21 0.00 -1.81 0.00 0.00 57.70 55.59 2g6j n MET 614 Cb 0.66 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.72 2g6j n MET 614 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2g6j n ASP 615 N -1.19 -2.13 -4.90 7.83 2.03 0.14 -4.98 116.55 113.35 2g6j n ASP 615 Ca 0.08 -0.80 -0.33 0.00 0.52 0.00 0.00 54.79 54.27 2g6j n ASP 615 Cb 0.33 -4.23 -0.05 0.00 -0.72 0.00 0.00 41.12 36.45 2g6j n ASP 615 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2g6j s LEU 616 N -6.50 4.33 -0.57 -2.67 1.43 -1.20 -5.00 118.68 108.51 2g6j s LEU 616 Ca 0.09 0.49 -0.27 0.00 -1.03 0.00 0.00 54.13 53.41 2g6j s LEU 616 Cb -0.02 -2.96 -0.03 0.00 0.03 0.00 0.00 46.19 43.21 2g6j s LEU 616 CO 0.80 0.16 1.90 -0.62 0.23 0.00 0.00 176.35 178.83 2g6j s ASP 617 N -2.16 5.27 -0.03 2.29 3.68 -1.26 -4.76 116.67 119.69 2g6j s ASP 617 Ca 0.34 0.53 0.16 0.00 2.13 0.00 0.00 52.55 55.71 2g6j s ASP 617 Cb -0.13 -2.53 0.52 0.00 -1.45 0.00 0.00 42.92 39.34 2g6j s ASP 617 CO 0.22 -2.34 1.42 0.23 0.13 0.00 0.00 175.17 174.83 2g6j n MET 618 N 9.07 2.60 -0.18 4.34 2.81 -1.26 -4.33 117.12 130.17 2g6j n MET 618 Ca 0.22 -2.09 -0.09 0.00 -1.81 0.00 0.00 57.70 53.93 2g6j n MET 618 Cb 0.52 -1.55 0.04 0.00 -0.71 0.00 0.00 33.22 31.51 2g6j n MET 618 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2g6j h ARG 619 N 3.25 1.01 -5.84 0.03 3.08 -2.04 -3.44 114.38 110.42 2g6j h ARG 619 Ca 0.00 -0.35 -0.57 0.00 0.07 0.00 0.00 59.98 59.13 2g6j h ARG 619 Cb 0.91 -0.08 -0.29 0.00 0.08 0.00 0.00 29.97 30.60 2g6j h ARG 619 CO 0.07 1.03 -0.84 -1.59 -1.07 0.00 0.00 179.97 177.57 2g6j s LYS 620 N -4.90 1.50 0.32 0.04 -2.85 -1.26 -5.05 119.74 107.55 2g6j s LYS 620 Ca -0.11 -0.71 0.01 0.00 -1.00 0.00 0.00 55.97 54.16 2g6j s LYS 620 Cb 0.13 -1.47 0.53 0.00 -2.06 0.00 0.00 37.83 34.97 2g6j s LYS 620 CO 0.86 0.40 1.93 1.79 0.10 0.00 0.00 175.35 180.43 2g6j h THR 621 N 4.63 1.19 0.00 3.79 1.35 -1.92 -2.90 112.91 119.06 2g6j h THR 621 Ca -0.38 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.95 2g6j h THR 621 Cb 1.15 0.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.00 2g6j h THR 621 CO 0.47 0.22 0.00 -1.54 -0.25 0.00 0.00 175.52 174.43 2g6j n SER 622 N -4.37 0.00 0.02 5.36 3.41 -1.26 -1.42 113.62 115.36 2g6j n SER 622 Ca 0.05 0.37 0.13 0.00 -0.26 0.00 0.00 58.87 59.16 2g6j n SER 622 Cb 0.12 -0.40 0.53 0.00 -0.26 0.00 0.00 64.21 64.20 2g6j n SER 622 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2g6j n SER 623 N -1.40 0.13 -2.74 4.04 3.41 -1.09 -4.91 113.62 111.06 2g6j n SER 623 Ca 0.02 0.52 -0.21 0.00 -0.26 0.00 0.00 58.87 58.94 2g6j n SER 623 Cb 0.05 -0.55 0.03 0.00 -0.26 0.00 0.00 64.21 63.48 2g6j n SER 623 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2g6j n LEU 624 N -1.63 -2.54 0.01 1.04 4.77 -0.51 -4.90 117.00 113.24 2g6j n LEU 624 Ca 0.06 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 2g6j n LEU 624 Cb 0.32 -2.79 0.31 0.00 -2.33 0.00 0.00 43.42 38.92 2g6j n LEU 624 CO 0.25 0.17 0.94 4.11 -1.33 0.00 0.00 177.39 181.53 2g6j h TRP 625 N -1.16 0.53 -0.72 -1.77 5.08 -1.84 -1.22 115.95 114.85 2g6j h TRP 625 Ca -0.49 -0.05 -0.06 0.00 1.08 0.00 0.00 58.89 59.37 2g6j h TRP 625 Cb 1.34 -0.15 -0.03 0.00 -3.00 0.00 0.00 29.16 27.32 2g6j h TRP 625 CO 0.49 0.52 0.21 0.87 -1.28 0.00 0.00 178.44 179.25 2g6j h LYS 626 N 0.49 1.13 -0.31 0.12 1.57 -1.90 -1.39 116.57 116.28 2g6j h LYS 626 Ca 0.11 -0.25 -0.08 0.00 -1.87 0.00 0.00 60.65 58.56 2g6j h LYS 626 Cb 0.32 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 2g6j h LYS 626 CO 0.01 0.97 -0.13 -0.44 -0.57 0.00 0.00 179.45 179.29 2g6j h ASP 627 N 1.08 0.65 -0.31 0.86 5.19 -1.78 -0.18 116.42 121.94 2g6j h ASP 627 Ca 0.23 -0.40 -0.00 0.00 -0.62 0.00 0.00 57.03 56.24 2g6j h ASP 627 Cb 0.32 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.64 2g6j h ASP 627 CO -0.01 0.90 0.19 1.56 -3.12 0.00 0.00 179.24 178.76 2g6j h GLN 628 N 0.40 0.41 -0.12 3.56 4.20 -1.05 -2.09 115.11 120.42 2g6j h GLN 628 Ca 0.07 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 2g6j h GLN 628 Cb 0.65 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 2g6j h GLN 628 CO 0.04 0.31 0.06 0.00 -0.67 0.00 0.00 178.83 178.57 2g6j h ALA 629 N 1.08 0.15 -0.70 3.87 0.00 -1.22 -2.80 119.26 119.64 2g6j h ALA 629 Ca 0.11 -0.06 0.14 0.00 0.00 0.00 0.00 54.91 55.11 2g6j h ALA 629 Cb -0.00 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.64 2g6j h ALA 629 CO -0.02 -0.31 0.17 1.25 0.00 0.00 0.00 179.25 180.34 2g6j h LEU 630 N 0.09 0.03 -0.38 0.00 5.85 -0.75 -0.91 115.31 119.23 2g6j h LEU 630 Ca 0.04 0.13 0.02 0.00 0.84 0.00 0.00 57.88 58.91 2g6j h LEU 630 Cb 0.09 0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.26 2g6j h LEU 630 CO -0.01 -0.01 0.21 0.58 -0.34 0.00 0.00 178.44 178.88 2g6j h VAL 631 N 0.28 1.02 -0.56 1.05 2.07 -1.14 -2.47 116.25 116.51 2g6j h VAL 631 Ca 0.39 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.69 2g6j h VAL 631 Cb 0.63 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 2g6j h VAL 631 CO -0.47 0.08 0.10 -0.33 0.02 0.00 0.00 177.57 176.96 2g6j h GLU 632 N 0.43 0.89 -0.40 1.57 4.39 -1.01 -1.44 114.58 119.02 2g6j h GLU 632 Ca 0.15 -0.21 -0.06 0.00 0.34 0.00 0.00 59.36 59.59 2g6j h GLU 632 Cb 0.03 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.54 2g6j h GLU 632 CO -0.08 0.83 0.01 0.82 -1.16 0.00 0.00 179.01 179.42 2g6j h ILE 633 N 0.85 1.22 0.00 3.13 2.04 -1.01 -1.85 117.51 121.88 2g6j h ILE 633 Ca 0.18 -0.86 -0.13 0.00 1.00 0.00 0.00 64.86 65.04 2g6j h ILE 633 Cb 0.37 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2g6j h ILE 633 CO 0.01 0.30 -0.63 0.78 0.00 0.00 0.00 178.15 178.61 2g6j h ASN 634 N 0.60 0.00 -0.08 1.72 2.35 -0.97 -1.90 115.58 117.30 2g6j h ASN 634 Ca 0.13 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.70 2g6j h ASN 634 Cb 0.37 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.73 2g6j h ASN 634 CO 0.01 0.63 -0.58 0.40 -1.65 0.00 0.00 177.43 176.24 2g6j h ILE 635 N 0.00 1.30 0.31 2.81 2.04 -0.98 -2.72 117.51 120.28 2g6j h ILE 635 Ca -0.01 -1.81 -0.02 0.00 1.00 0.00 0.00 64.86 64.02 2g6j h ILE 635 Cb 1.31 1.76 0.00 0.00 -0.74 0.00 0.00 36.82 39.15 2g6j h ILE 635 CO 0.08 0.57 -0.15 0.00 0.00 0.00 0.00 178.15 178.65 2g6j h ALA 636 N 0.83 -0.42 0.18 1.87 0.00 -1.20 0.51 119.26 121.04 2g6j h ALA 636 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2g6j h ALA 636 Cb 1.16 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.08 2g6j h ALA 636 CO 0.12 -0.68 -0.41 0.28 0.00 0.00 0.00 179.25 178.56 2g6j h VAL 637 N -0.53 0.00 -0.85 0.00 2.07 -1.39 0.46 116.25 116.00 2g6j h VAL 637 Ca -0.04 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.64 2g6j h VAL 637 Cb 0.40 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.06 2g6j h VAL 637 CO 0.07 0.00 0.41 -0.07 0.02 0.00 0.00 177.57 178.00 2g6j h LEU 638 N -0.65 0.44 0.72 2.57 3.38 -1.49 -2.05 115.31 118.23 2g6j h LEU 638 Ca -0.02 0.11 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 2g6j h LEU 638 Cb 0.62 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2g6j h LEU 638 CO -0.17 0.14 -0.41 0.22 0.09 0.00 0.00 178.44 178.31 2g6j h TYR 639 N 0.54 -1.09 -0.79 1.13 3.20 0.10 -1.98 116.97 118.07 2g6j h TYR 639 Ca 0.48 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.46 2g6j h TYR 639 Cb 0.76 0.38 -0.08 0.00 1.54 0.00 0.00 36.73 39.33 2g6j h TYR 639 CO -0.11 -0.63 0.40 0.77 -1.64 0.00 0.00 178.16 176.94 2g6j h SER 640 N -1.05 0.50 0.00 -2.11 0.02 0.35 -0.90 113.55 110.36 2g6j h SER 640 Ca -0.09 0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2g6j h SER 640 Cb 0.84 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.37 2g6j h SER 640 CO 0.11 0.24 -0.00 -0.26 -1.14 0.00 0.00 176.83 175.79 2g6j h PHE 641 N 0.62 -0.00 -0.54 3.45 -1.00 -1.31 -1.64 116.94 116.52 2g6j h PHE 641 Ca 0.41 -0.00 -0.00 0.00 2.81 0.00 0.00 57.97 61.19 2g6j h PHE 641 Cb 0.52 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.06 2g6j h PHE 641 CO -0.10 0.30 0.33 1.96 -1.61 0.00 0.00 178.31 179.19 2g6j h GLN 642 N -0.30 0.72 -0.16 1.51 4.20 -1.14 0.15 115.11 120.08 2g6j h GLN 642 Ca -0.00 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.60 2g6j h GLN 642 Cb 0.30 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.92 2g6j h GLN 642 CO 0.00 0.50 -0.11 0.77 -0.67 0.00 0.00 178.83 179.32 2g6j h SER 643 N 0.73 0.38 0.00 1.46 0.02 -1.07 -1.69 113.55 113.38 2g6j h SER 643 Ca 0.20 -0.44 0.00 0.00 -0.84 0.00 0.00 61.79 60.71 2g6j h SER 643 Cb -0.05 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.39 2g6j h SER 643 CO -0.04 0.73 0.00 0.47 -1.14 0.00 0.00 176.83 176.85 2g6j n ASP 644 N -4.59 0.00 -3.18 3.07 9.92 -0.63 -4.87 116.55 116.28 2g6j n ASP 644 Ca -0.06 -0.84 -0.18 0.00 -0.53 0.00 0.00 54.79 53.19 2g6j n ASP 644 Cb 0.33 0.00 0.08 0.00 -0.64 0.00 0.00 41.12 40.88 2g6j n ASP 644 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2g6j n LYS 645 N -0.88 -6.41 -4.69 -1.24 3.00 -0.43 -5.02 118.16 102.48 2g6j n LYS 645 Ca 0.12 0.74 -0.33 0.00 -0.00 0.00 0.00 58.31 58.84 2g6j n LYS 645 Cb 0.06 -5.48 -0.12 0.00 0.00 0.00 0.00 35.03 29.49 2g6j n LYS 645 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 2g6j s VAL 646 N -3.30 3.48 0.36 3.15 1.01 0.39 -4.54 120.40 120.95 2g6j s VAL 646 Ca 0.24 -0.55 -0.28 0.00 0.00 0.00 0.00 61.98 61.39 2g6j s VAL 646 Cb -0.11 -2.42 -0.12 0.00 0.00 0.00 0.00 36.38 33.73 2g6j s VAL 646 CO 0.64 0.58 1.36 0.41 0.00 0.00 0.00 175.10 178.09 2g6j n THR 647 N 2.55 2.05 -3.59 3.92 -1.04 -0.23 -4.24 114.28 113.71 2g6j n THR 647 Ca -0.18 -0.50 -0.08 0.00 -2.04 0.00 0.00 64.05 61.25 2g6j n THR 647 Cb 0.53 -1.71 -0.04 0.00 -1.82 0.00 0.00 70.33 67.28 2g6j n THR 647 CO 0.00 0.00 0.00 -0.51 -0.64 0.00 0.00 175.07 173.92 2g6j s ILE 648 N -1.11 0.00 0.01 12.58 2.07 -1.26 -4.50 121.20 128.98 2g6j s ILE 648 Ca 0.55 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.82 2g6j s ILE 648 Cb -0.53 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.05 2g6j s ILE 648 CO 0.62 0.00 -0.11 0.54 -1.91 0.00 0.00 174.94 174.09 2g6j s VAL 649 N -1.34 0.83 0.43 4.00 0.11 0.06 -4.97 120.40 119.52 2g6j s VAL 649 Ca 0.02 -0.58 -0.10 0.00 -2.93 0.00 0.00 61.98 58.38 2g6j s VAL 649 Cb -0.01 -0.72 -0.06 0.00 -1.53 0.00 0.00 36.38 34.06 2g6j s VAL 649 CO -0.02 0.13 0.80 1.51 -3.33 0.00 0.00 175.10 174.19 2g6j s ASP 650 N -0.51 6.49 0.52 3.54 -4.77 -1.26 0.80 116.67 121.47 2g6j s ASP 650 Ca 0.02 1.16 0.21 0.00 -3.30 0.00 0.00 52.55 50.64 2g6j s ASP 650 Cb -0.05 -2.34 1.32 0.00 -1.09 0.00 0.00 42.92 40.76 2g6j s ASP 650 CO 0.00 -0.45 2.04 1.12 0.70 0.00 0.00 175.17 178.58 2g6j h HIS 651 N 1.08 0.05 0.66 2.11 2.07 -1.97 -1.38 115.15 117.77 2g6j h HIS 651 Ca -0.47 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.02 2g6j h HIS 651 Cb 1.19 -0.02 0.01 0.00 2.57 0.00 0.00 27.41 31.16 2g6j h HIS 651 CO 0.61 0.03 -0.32 0.45 -3.07 0.00 0.00 177.93 175.63 2g6j h HIS 652 N 0.05 -0.82 -0.87 6.12 3.86 -1.96 -2.29 115.15 119.24 2g6j h HIS 652 Ca 0.19 -0.02 0.13 0.00 -1.16 0.00 0.00 60.37 59.50 2g6j h HIS 652 Cb 0.67 0.27 -0.09 0.00 1.06 0.00 0.00 27.41 29.33 2g6j h HIS 652 CO -0.00 -0.51 0.49 1.03 0.86 0.00 0.00 177.93 179.79 2g6j h SER 653 N -1.24 0.65 -0.32 2.45 0.87 -1.91 -1.12 113.55 112.92 2g6j h SER 653 Ca -0.09 0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.50 2g6j h SER 653 Cb 0.68 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 2g6j h SER 653 CO 0.15 0.31 0.05 0.00 -0.53 0.00 0.00 176.83 176.81 2g6j h ALA 654 N 1.53 0.43 -0.44 6.23 0.00 -1.30 -1.64 119.26 124.08 2g6j h ALA 654 Ca 0.45 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 2g6j h ALA 654 Cb 0.55 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2g6j h ALA 654 CO -0.31 0.13 -0.12 1.79 0.00 0.00 0.00 179.25 180.73 2g6j h THR 655 N 0.36 1.27 -0.61 0.00 1.35 -0.99 -0.70 112.91 113.60 2g6j h THR 655 Ca 0.10 -1.24 0.04 0.00 -0.55 0.00 0.00 66.41 64.76 2g6j h THR 655 Cb 0.35 1.17 -0.04 0.00 -1.73 0.00 0.00 68.15 67.90 2g6j h THR 655 CO 0.01 0.42 0.36 -0.08 -0.25 0.00 0.00 175.52 175.98 2g6j h GLU 656 N 0.68 0.67 -0.77 4.72 4.81 -1.17 0.35 114.58 123.87 2g6j h GLU 656 Ca 0.11 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.27 2g6j h GLU 656 Cb 0.67 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.86 2g6j h GLU 656 CO 0.05 0.44 0.37 0.77 -0.73 0.00 0.00 179.01 179.91 2g6j h SER 657 N 0.69 1.00 0.03 1.04 0.02 -0.92 -2.12 113.55 113.28 2g6j h SER 657 Ca 0.26 -0.11 -0.11 0.00 -0.84 0.00 0.00 61.79 60.98 2g6j h SER 657 Cb 0.09 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2g6j h SER 657 CO -0.14 0.84 -0.35 0.15 -1.14 0.00 0.00 176.83 176.19 2g6j h PHE 658 N 1.09 0.52 -0.18 3.45 3.57 -0.12 -0.14 116.94 125.14 2g6j h PHE 658 Ca 0.27 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 2g6j h PHE 658 Cb 0.11 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2g6j h PHE 658 CO 0.01 0.75 0.08 0.82 -2.23 0.00 0.00 178.31 177.74 2g6j h ILE 659 N 0.38 1.14 -0.45 1.41 1.08 -0.51 0.94 117.51 121.50 2g6j h ILE 659 Ca 0.04 -0.41 0.06 0.00 -0.39 0.00 0.00 64.86 64.16 2g6j h ILE 659 Cb 0.80 1.08 -0.05 0.00 -3.07 0.00 0.00 36.82 35.59 2g6j h ILE 659 CO 0.06 0.13 0.17 0.50 -0.69 0.00 0.00 178.15 178.32 2g6j h LYS 660 N 0.15 0.33 -0.71 2.37 3.64 -1.14 -1.92 116.57 119.29 2g6j h LYS 660 Ca 0.06 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2g6j h LYS 660 Cb 0.14 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 2g6j h LYS 660 CO -0.01 0.22 0.32 1.25 -2.27 0.00 0.00 179.45 178.96 2g6j h HIS 661 N 0.34 1.04 0.01 1.91 2.76 -0.73 -1.11 115.15 119.37 2g6j h HIS 661 Ca 0.21 -0.05 -0.00 0.00 -2.20 0.00 0.00 60.37 58.33 2g6j h HIS 661 Cb 0.20 -0.32 0.00 0.00 1.55 0.00 0.00 27.41 28.84 2g6j h HIS 661 CO -0.15 0.77 -0.01 0.52 -1.30 0.00 0.00 177.93 177.76 2g6j h MET 662 N 1.02 -0.01 -0.63 5.26 2.86 -0.08 0.28 114.93 123.63 2g6j h MET 662 Ca 0.24 0.00 0.02 0.00 -2.06 0.00 0.00 59.70 57.91 2g6j h MET 662 Cb 0.15 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.77 2g6j h MET 662 CO -0.03 0.03 0.39 0.93 1.06 0.00 0.00 176.91 179.29 2g6j h GLU 663 N -0.05 0.76 -0.15 1.72 5.08 -1.18 0.43 114.58 121.18 2g6j h GLU 663 Ca -0.00 -0.05 0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2g6j h GLU 663 Cb 0.05 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.11 2g6j h GLU 663 CO 0.00 0.50 0.01 -0.91 -1.00 0.00 0.00 179.01 177.62 2g6j h ASN 664 N 0.78 -0.02 -0.53 1.42 4.21 -0.80 -1.88 115.58 118.77 2g6j h ASN 664 Ca 0.25 0.03 -0.00 0.00 1.21 0.00 0.00 56.30 57.78 2g6j h ASN 664 Cb -0.01 0.04 -0.03 0.00 -1.12 0.00 0.00 38.32 37.21 2g6j h ASN 664 CO -0.09 0.01 0.31 -0.33 -1.29 0.00 0.00 177.43 176.05 2g6j h GLU 665 N 0.07 0.72 -0.68 0.81 4.39 0.45 0.57 114.58 120.90 2g6j h GLU 665 Ca 0.07 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2g6j h GLU 665 Cb 0.07 -0.15 -0.03 0.00 -0.10 0.00 0.00 28.75 28.54 2g6j h GLU 665 CO -0.10 0.52 0.44 1.88 -1.16 0.00 0.00 179.01 180.59 2g6j h TYR 666 N 0.70 0.87 0.13 4.33 -1.99 0.12 0.88 116.97 122.01 2g6j h TYR 666 Ca 0.19 0.01 -0.25 0.00 2.00 0.00 0.00 58.73 60.69 2g6j h TYR 666 Cb -0.01 -0.29 0.01 0.00 2.00 0.00 0.00 36.73 38.44 2g6j h TYR 666 CO -0.02 0.56 -1.21 0.07 -0.00 0.00 0.00 178.16 177.56 2g6j h ARG 667 N 0.93 0.27 0.00 4.88 0.11 -0.93 -1.84 114.38 117.80 2g6j h ARG 667 Ca 0.25 -0.46 0.00 0.00 0.10 0.00 0.00 59.98 59.86 2g6j h ARG 667 Cb -0.08 0.17 0.00 0.00 1.11 0.00 0.00 29.97 31.17 2g6j h ARG 667 CO -0.05 1.22 -0.07 0.00 0.10 0.00 0.00 179.97 181.17 2g6j n ARG 669 N -2.79 2.89 -0.62 0.00 0.63 0.20 -5.03 116.66 111.94 2g6j n ARG 669 Ca 0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 2g6j n ARG 669 Cb 0.50 -0.32 0.00 0.00 0.45 0.00 0.00 32.46 33.09 2g6j n ARG 669 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2g6j n GLY 670 N 0.51 0.67 0.00 5.14 0.00 -0.60 -4.55 105.19 106.35 2g6j n GLY 670 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2g6j n GLY 670 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g6j n GLY 671 N -2.62 1.48 3.00 -0.02 0.00 -1.05 -0.71 105.19 105.27 2g6j n GLY 671 Ca 0.00 -1.16 -0.04 0.00 0.00 0.00 0.00 46.02 44.82 2g6j n GLY 671 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g6j s PRO 673 N 2.66 4.22 -0.00 0.00 0.04 -1.26 -4.68 135.00 135.97 2g6j s PRO 673 Ca 0.13 2.29 0.00 0.00 0.04 0.00 0.00 61.00 63.46 2g6j s PRO 673 Cb -0.13 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 30.99 2g6j s PRO 673 CO -0.23 -0.65 -0.00 0.00 0.04 0.00 0.00 177.00 176.16 2g6j s ALA 674 N 1.98 0.05 -0.66 8.56 0.00 -0.80 -4.14 121.76 126.75 2g6j s ALA 674 Ca 0.71 0.01 -0.10 0.00 0.00 0.00 0.00 51.96 52.59 2g6j s ALA 674 Cb -0.40 -0.04 0.17 0.00 0.00 0.00 0.00 23.12 22.85 2g6j s ALA 674 CO 0.31 -0.00 0.55 0.34 0.00 0.00 0.00 175.76 176.96 2g6j s ASP 675 N 0.11 6.02 0.29 0.00 3.68 0.47 -3.40 116.67 123.84 2g6j s ASP 675 Ca -0.01 -2.47 0.02 0.00 2.13 0.00 0.00 52.55 52.22 2g6j s ASP 675 Cb -0.02 -2.06 0.71 0.00 -1.45 0.00 0.00 42.92 40.11 2g6j s ASP 675 CO -0.00 -0.57 1.63 -0.25 0.13 0.00 0.00 175.17 176.11 2g6j h TRP 676 N 7.82 0.25 -0.90 -5.34 7.01 -1.92 0.26 115.95 123.13 2g6j h TRP 676 Ca -0.04 0.05 0.15 0.00 2.11 0.00 0.00 58.89 61.17 2g6j h TRP 676 Cb 1.03 0.03 -0.07 0.00 -2.10 0.00 0.00 29.16 28.05 2g6j h TRP 676 CO 0.82 -0.27 0.58 0.28 -2.79 0.00 0.00 178.44 177.06 2g6j h VAL 677 N 0.15 0.81 0.00 2.65 2.07 -1.93 -2.13 116.25 117.87 2g6j h VAL 677 Ca 0.56 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.84 2g6j h VAL 677 Cb 1.14 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.99 2g6j h VAL 677 CO -0.71 0.12 -1.58 0.79 0.02 0.00 0.00 177.57 176.21 2g6j n TRP 678 N -4.57 0.43 0.01 1.57 7.02 -0.08 -4.52 117.44 117.30 2g6j n TRP 678 Ca 0.18 0.12 -0.18 0.00 -1.02 0.00 0.00 57.50 56.60 2g6j n TRP 678 Cb 0.50 -0.71 -0.11 0.00 -2.42 0.00 0.00 31.31 28.57 2g6j n TRP 678 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 2g6j h ILE 679 N 0.00 1.42 -2.76 -0.99 1.08 -0.49 -3.44 117.51 112.33 2g6j h ILE 679 Ca -0.01 -2.15 -0.53 0.00 -0.39 0.00 0.00 64.86 61.78 2g6j h ILE 679 Cb 1.03 2.64 0.03 0.00 -3.07 0.00 0.00 36.82 37.44 2g6j h ILE 679 CO 0.00 0.63 0.94 -0.69 -0.69 0.00 0.00 178.15 178.34 2g6j s VAL 680 N -3.14 2.99 0.77 1.67 1.01 -0.91 -4.94 120.40 117.86 2g6j s VAL 680 Ca -0.13 0.55 -0.14 0.00 0.00 0.00 0.00 61.98 62.26 2g6j s VAL 680 Cb 0.04 -3.35 0.06 0.00 0.00 0.00 0.00 36.38 33.12 2g6j s VAL 680 CO 0.83 0.01 1.20 -2.84 0.00 0.00 0.00 175.10 174.31 2g6j s PRO 681 N 2.12 1.89 0.00 2.72 0.02 -1.26 -4.89 135.00 135.59 2g6j s PRO 681 Ca 0.71 1.74 0.13 0.00 0.02 0.00 0.00 61.00 63.60 2g6j s PRO 681 Cb -0.40 -1.81 0.78 0.00 0.02 0.00 0.00 34.50 33.09 2g6j s PRO 681 CO 0.31 -2.02 1.25 -0.35 -0.33 0.00 0.00 177.00 175.86 2g6j n PRO 682 N -3.04 0.62 -3.88 5.54 -0.04 -1.26 -4.31 135.00 128.64 2g6j n PRO 682 Ca 0.13 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.49 2g6j n PRO 682 Cb 0.50 -1.33 -0.09 0.00 -0.04 0.00 0.00 33.50 32.55 2g6j n PRO 682 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g6j s MET 683 N -2.00 0.68 -0.87 0.54 0.23 -1.26 -4.89 119.30 111.72 2g6j s MET 683 Ca 0.20 -0.72 0.00 0.00 -1.03 0.00 0.00 55.69 54.14 2g6j s MET 683 Cb 0.09 0.27 0.00 0.00 -1.53 0.00 0.00 34.83 33.66 2g6j s MET 683 CO 0.15 -0.19 0.00 0.43 -2.03 0.00 0.00 175.02 173.38 2g6j n SER 684 N 0.61 -2.98 0.00 -1.18 7.64 -1.26 -4.88 113.62 111.57 2g6j n SER 684 Ca -0.18 0.26 0.00 0.00 1.01 0.00 0.00 58.87 59.95 2g6j n SER 684 Cb 0.59 -2.67 0.00 0.00 -1.01 0.00 0.00 64.21 61.12 2g6j n SER 684 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2g6j n GLY 685 N -0.55 -1.76 0.00 0.23 0.00 -1.26 -1.10 105.19 100.75 2g6j n GLY 685 Ca -0.11 0.34 0.02 0.00 0.00 0.00 0.00 46.02 46.27 2g6j n GLY 685 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2g6j n SER 686 N -2.37 0.00 -1.23 1.61 3.41 -1.26 -1.86 113.62 111.91 2g6j n SER 686 Ca 0.00 0.20 0.11 0.00 -0.26 0.00 0.00 58.87 58.92 2g6j n SER 686 Cb 0.00 -0.27 0.28 0.00 -0.26 0.00 0.00 64.21 63.97 2g6j n SER 686 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2g6j n ILE 687 N -1.27 0.90 -4.12 -1.33 -5.35 -0.26 -4.86 119.36 103.08 2g6j n ILE 687 Ca 0.02 -0.95 -0.32 0.00 -0.27 0.00 0.00 62.75 61.23 2g6j n ILE 687 Cb 0.04 0.59 -0.07 0.00 -1.74 0.00 0.00 39.64 38.46 2g6j n ILE 687 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2g6j s THR 688 N -1.08 4.52 0.39 7.28 -4.23 -0.78 -5.04 115.64 116.70 2g6j s THR 688 Ca 0.44 -0.59 0.09 0.00 -1.18 0.00 0.00 61.69 60.45 2g6j s THR 688 Cb 0.23 -3.10 0.17 0.00 1.34 0.00 0.00 72.50 71.15 2g6j s THR 688 CO 0.31 0.27 1.93 1.55 -0.54 0.00 0.00 174.62 178.14 2g6j h PRO 689 N 3.86 0.29 0.00 3.99 0.13 -1.89 -3.11 132.00 135.27 2g6j h PRO 689 Ca -0.48 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 64.59 2g6j h PRO 689 Cb 1.17 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 2g6j h PRO 689 CO 0.62 0.38 -0.00 -0.39 -0.23 0.00 0.00 178.00 178.39 2g6j h VAL 690 N 0.28 0.24 -0.76 1.56 -1.51 -1.90 -2.41 116.25 111.75 2g6j h VAL 690 Ca 0.06 -0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.52 2g6j h VAL 690 Cb 0.32 1.00 -0.04 0.00 -2.13 0.00 0.00 31.29 30.45 2g6j h VAL 690 CO 0.02 0.00 0.45 0.15 -1.23 0.00 0.00 177.57 176.96 2g6j h PHE 691 N 0.00 1.00 -0.09 5.19 3.57 -1.76 -2.19 116.94 122.66 2g6j h PHE 691 Ca -0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 2g6j h PHE 691 Cb 0.00 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.42 2g6j h PHE 691 CO 0.00 0.67 0.00 0.72 -2.23 0.00 0.00 178.31 177.47 2g6j n HIS 692 N -4.50 0.11 -3.38 0.41 8.25 -0.91 -4.80 115.22 110.40 2g6j n HIS 692 Ca 0.07 -0.06 -0.41 0.00 -0.26 0.00 0.00 57.72 57.07 2g6j n HIS 692 Cb 0.06 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.08 2g6j n HIS 692 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2g6j s GLN 693 N -1.89 3.59 0.38 -0.41 2.00 -0.82 -0.25 119.66 122.26 2g6j s GLN 693 Ca 0.33 -0.37 -0.26 0.00 -2.00 0.00 0.00 55.36 53.06 2g6j s GLN 693 Cb 0.17 -3.80 -0.09 0.00 0.80 0.00 0.00 33.01 30.09 2g6j s GLN 693 CO 0.27 -0.53 1.27 -1.21 -0.50 0.00 0.00 175.29 174.59 2g6j s GLU 694 N 2.06 4.09 0.11 1.67 2.02 -1.10 -4.98 118.70 122.57 2g6j s GLU 694 Ca 0.13 2.09 0.04 0.00 0.02 0.00 0.00 54.97 57.25 2g6j s GLU 694 Cb -0.16 -2.82 -0.04 0.00 0.10 0.00 0.00 34.13 31.21 2g6j s GLU 694 CO 0.12 -0.37 -0.11 -1.64 0.02 0.00 0.00 175.26 173.28 2g6j s MET 695 N -2.13 0.94 -0.19 1.61 -1.94 -1.26 -4.71 119.30 111.61 2g6j s MET 695 Ca 0.55 -1.23 0.01 0.00 -1.71 0.00 0.00 55.69 53.30 2g6j s MET 695 Cb -0.37 -0.66 0.02 0.00 2.01 0.00 0.00 34.83 35.83 2g6j s MET 695 CO 0.47 0.11 -0.18 -0.51 -0.01 0.00 0.00 175.02 174.90 2g6j s LEU 696 N -2.57 2.25 -0.24 -0.03 1.43 -1.25 -4.95 118.68 113.31 2g6j s LEU 696 Ca 0.08 -0.64 -0.09 0.00 -1.03 0.00 0.00 54.13 52.45 2g6j s LEU 696 Cb -0.03 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.64 2g6j s LEU 696 CO 0.01 -0.01 0.13 0.21 0.23 0.00 0.00 176.35 176.92 2g6j s ASN 697 N 1.31 5.75 0.07 2.29 3.04 -1.22 -1.90 114.94 124.28 2g6j s ASN 697 Ca 0.05 -0.01 -0.14 0.00 0.04 0.00 0.00 52.86 52.80 2g6j s ASN 697 Cb -0.13 -2.04 0.02 0.00 -1.54 0.00 0.00 41.25 37.56 2g6j s ASN 697 CO -0.12 0.03 0.33 -0.72 -3.04 0.00 0.00 177.10 173.58 2g6j s TYR 698 N 1.25 -0.11 -0.32 0.43 -0.85 -1.26 -4.98 117.35 111.49 2g6j s TYR 698 Ca 0.06 -0.10 -0.10 0.00 -0.52 0.00 0.00 57.07 56.41 2g6j s TYR 698 Cb -0.14 0.13 -0.00 0.00 0.38 0.00 0.00 41.96 42.33 2g6j s TYR 698 CO 0.05 -0.57 0.17 1.03 -1.52 0.00 0.00 175.55 174.71 2g6j s ARG 699 N -3.09 3.28 0.20 -3.49 0.52 -1.26 -4.81 118.95 110.30 2g6j s ARG 699 Ca -0.01 -0.76 0.06 0.00 -0.52 0.00 0.00 55.73 54.50 2g6j s ARG 699 Cb 0.01 -3.62 -0.04 0.00 0.52 0.00 0.00 34.95 31.82 2g6j s ARG 699 CO -0.07 -0.46 0.13 -0.51 0.02 0.00 0.00 175.30 174.42 2g6j s LEU 700 N 1.62 3.71 0.16 2.53 1.43 -1.26 -2.27 118.68 124.60 2g6j s LEU 700 Ca 0.04 -0.24 0.08 0.00 -1.03 0.00 0.00 54.13 52.99 2g6j s LEU 700 Cb -0.17 -2.29 -0.04 0.00 0.03 0.00 0.00 46.19 43.71 2g6j s LEU 700 CO 0.07 0.03 -0.18 0.28 0.23 0.00 0.00 176.35 176.78 2g6j s THR 701 N -1.93 1.77 0.63 5.49 -1.32 -1.26 -4.36 115.64 114.66 2g6j s THR 701 Ca 0.31 -1.92 -0.17 0.00 -1.21 0.00 0.00 61.69 58.70 2g6j s THR 701 Cb -0.09 -1.83 -0.05 0.00 -1.51 0.00 0.00 72.50 69.02 2g6j s THR 701 CO 0.23 -0.35 0.78 -2.65 -2.21 0.00 0.00 174.62 170.42 2g6j n PRO 702 N 0.26 0.64 -3.85 7.08 -0.02 -1.26 -5.02 135.00 132.83 2g6j n PRO 702 Ca -0.13 0.26 -0.09 0.00 -2.02 0.00 0.00 63.50 61.51 2g6j n PRO 702 Cb 0.57 -2.00 -0.05 0.00 -0.02 0.00 0.00 33.50 32.00 2g6j n PRO 702 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2g6j s SER 703 N -1.32 -0.11 -0.20 2.55 1.04 -0.98 -3.97 113.70 110.71 2g6j s SER 703 Ca 0.72 -0.68 -0.08 0.00 0.48 0.00 0.00 55.95 56.39 2g6j s SER 703 Cb -0.40 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.18 2g6j s SER 703 CO 0.51 -0.98 0.09 -0.36 0.98 0.00 0.00 173.24 173.48 2g6j s PHE 704 N -3.92 3.26 0.31 5.02 0.40 -1.26 -1.22 117.98 120.57 2g6j s PHE 704 Ca 0.13 0.07 0.10 0.00 -0.60 0.00 0.00 56.93 56.63 2g6j s PHE 704 Cb 0.01 -2.14 -0.05 0.00 0.51 0.00 0.00 43.02 41.35 2g6j s PHE 704 CO -0.01 0.10 -0.05 -1.21 0.70 0.00 0.00 175.22 174.74 2g6j s GLU 705 N 0.62 1.99 0.60 0.44 0.41 0.20 -4.92 118.70 118.03 2g6j s GLU 705 Ca 0.04 -1.73 -0.09 0.00 -0.41 0.00 0.00 54.97 52.79 2g6j s GLU 705 Cb -0.13 -1.90 -0.02 0.00 -1.78 0.00 0.00 34.13 30.30 2g6j s GLU 705 CO 0.01 0.22 0.97 0.71 -0.49 0.00 0.00 175.26 176.68 2g6j s TYR 706 N -2.50 3.50 -0.02 1.61 4.12 -1.26 -0.84 117.35 121.96 2g6j s TYR 706 Ca 0.33 1.05 -0.23 0.00 0.02 0.00 0.00 57.07 58.24 2g6j s TYR 706 Cb -0.02 -2.71 0.05 0.00 -1.52 0.00 0.00 41.96 37.76 2g6j s TYR 706 CO 0.18 -0.72 0.50 1.14 0.02 0.00 0.00 175.55 176.66 2g6j s GLN 707 N -5.10 0.89 0.28 -0.62 -2.07 -1.26 -4.67 119.66 107.12 2g6j s GLN 707 Ca 0.54 -0.02 -0.30 0.00 -1.82 0.00 0.00 55.36 53.76 2g6j s GLN 707 Cb -0.11 0.41 -0.13 0.00 -1.09 0.00 0.00 33.01 32.10 2g6j s GLN 707 CO 0.50 -0.28 1.40 -2.30 -1.32 0.00 0.00 175.29 173.30 2g6j n PRO 708 N 0.96 2.18 -1.69 9.60 -0.02 -1.26 -4.88 135.00 139.89 2g6j n PRO 708 Ca -0.20 0.77 -0.44 0.00 -2.02 0.00 0.00 63.50 61.61 2g6j n PRO 708 Cb 0.57 -2.43 -0.04 0.00 -0.02 0.00 0.00 33.50 31.59 2g6j n PRO 708 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2g6j n ASP 709 N 1.73 3.62 -0.11 2.55 8.00 -1.26 -4.84 116.55 126.23 2g6j n ASP 709 Ca 0.09 1.05 0.19 0.00 0.71 0.00 0.00 54.79 56.83 2g6j n ASP 709 Cb 0.34 -1.50 0.60 0.00 -0.02 0.00 0.00 41.12 40.54 2g6j n ASP 709 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2g6j h PRO 710 N 6.96 0.20 0.00 -0.24 0.13 -1.91 -2.21 132.00 134.93 2g6j h PRO 710 Ca -0.45 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 2g6j h PRO 710 Cb 1.23 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 2g6j h PRO 710 CO 0.93 0.13 -0.05 0.11 -0.23 0.00 0.00 178.00 178.89 2g6j h TRP 711 N 0.20 0.00 -0.20 1.56 0.09 -1.94 1.10 115.95 116.76 2g6j h TRP 711 Ca 0.35 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.33 2g6j h TRP 711 Cb 1.06 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.30 2g6j h TRP 711 CO -0.00 0.05 0.00 0.09 0.09 0.00 0.00 178.44 178.67 2g6j n ASN 712 N -3.80 1.41 0.00 0.11 3.02 -0.83 -4.22 115.26 110.95 2g6j n ASN 712 Ca -0.03 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.71 2g6j n ASN 712 Cb 0.14 -0.13 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2g6j n ASN 712 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2g6j n THR 713 N 0.20 0.00 -1.68 3.41 -1.04 0.15 -5.04 114.28 110.28 2g6j n THR 713 Ca 0.13 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.69 2g6j n THR 713 Cb 0.26 -0.25 -0.04 0.00 -1.82 0.00 0.00 70.33 68.48 2g6j n THR 713 CO 0.00 0.00 0.00 1.57 -0.64 0.00 0.00 175.07 176.00 2g6j n HIS 714 N -1.46 2.41 -3.35 -1.42 -0.00 0.33 -4.95 115.22 106.78 2g6j n HIS 714 Ca 0.00 0.17 -0.46 0.00 -0.00 0.00 0.00 57.72 57.43 2g6j n HIS 714 Cb 0.17 -2.59 -0.03 0.00 -0.00 0.00 0.00 29.99 27.54 2g6j n HIS 714 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 2g6j s VAL 715 N 1.32 5.45 -1.16 3.57 -7.23 -1.26 -4.99 120.40 116.10 2g6j s VAL 715 Ca 0.79 -2.36 0.00 0.00 -1.81 0.00 0.00 61.98 58.60 2g6j s VAL 715 Cb -0.63 -4.39 0.00 0.00 0.56 0.00 0.00 36.38 31.92 2g6j s VAL 715 CO 0.38 -1.00 0.29 0.79 -0.31 0.00 0.00 175.10 175.25