#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h3d n MET 315 N 0.00 -5.34 -1.01 1.57 0.00 -1.26 -4.98 117.12 106.11 3h3d n MET 315 Ca 0.00 3.81 -0.33 0.00 0.00 0.00 0.00 57.70 61.18 3h3d n MET 315 Cb 0.00 -4.23 0.12 0.00 0.00 0.00 0.00 33.22 29.11 3h3d n MET 315 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 3h3d n SER 316 N 1.83 0.01 0.10 6.12 3.41 -1.26 -4.70 113.62 119.12 3h3d n SER 316 Ca 0.00 0.52 -0.06 0.00 -0.26 0.00 0.00 58.87 59.07 3h3d n SER 316 Cb 0.00 -1.40 0.03 0.00 -0.26 0.00 0.00 64.21 62.58 3h3d n SER 316 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 3h3d h ARG 317 N -1.09 0.09 -0.73 4.33 0.11 -1.98 0.18 114.38 115.29 3h3d h ARG 317 Ca -0.45 -0.10 0.09 0.00 0.10 0.00 0.00 59.98 59.62 3h3d h ARG 317 Cb 1.30 0.03 -0.07 0.00 1.11 0.00 0.00 29.97 32.33 3h3d h ARG 317 CO 0.42 0.85 0.38 1.25 0.10 0.00 0.00 179.97 182.97 3h3d h LEU 318 N 0.05 0.50 -0.10 0.08 5.85 -1.99 0.19 115.31 119.90 3h3d h LEU 318 Ca -0.02 0.06 -0.23 0.00 0.84 0.00 0.00 57.88 58.53 3h3d h LEU 318 Cb 1.41 -0.03 0.01 0.00 0.37 0.00 0.00 40.66 42.42 3h3d h LEU 318 CO 0.11 0.29 -0.82 0.25 -0.34 0.00 0.00 178.44 177.93 3h3d h LEU 319 N 0.64 0.90 -0.29 2.25 5.85 -1.80 -1.74 115.31 121.13 3h3d h LEU 319 Ca 0.36 -0.66 0.02 0.00 0.84 0.00 0.00 57.88 58.44 3h3d h LEU 319 Cb 0.36 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3h3d h LEU 319 CO -0.26 1.43 0.12 -0.33 -0.34 0.00 0.00 178.44 179.06 3h3d h GLU 320 N 0.45 0.26 0.35 1.25 5.08 -0.44 -2.43 114.58 119.09 3h3d h GLU 320 Ca -0.07 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 3h3d h GLU 320 Cb 1.46 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.66 3h3d h GLU 320 CO 0.17 0.17 -0.17 -0.44 -1.00 0.00 0.00 179.01 177.74 3h3d h ASP 321 N 0.27 -0.40 -0.96 1.42 3.32 -0.57 -1.09 116.42 118.41 3h3d h ASP 321 Ca 0.12 0.01 0.31 0.00 0.02 0.00 0.00 57.03 57.49 3h3d h ASP 321 Cb 0.07 0.10 -0.16 0.00 0.22 0.00 0.00 39.33 39.56 3h3d h ASP 321 CO -0.10 -0.27 0.40 0.15 -1.72 0.00 0.00 179.24 177.69 3h3d h PHE 322 N -0.48 0.62 -0.20 4.55 3.57 -1.31 -1.67 116.94 122.03 3h3d h PHE 322 Ca -0.05 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.44 3h3d h PHE 322 Cb 0.36 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 3h3d h PHE 322 CO -0.05 -0.27 -0.11 0.00 -2.23 0.00 0.00 178.31 175.66 3h3d h ARG 323 N 0.20 0.43 -1.64 1.11 3.08 -0.72 -2.61 114.38 114.24 3h3d h ARG 323 Ca 0.68 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.54 3h3d h ARG 323 Cb 1.55 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.58 3h3d h ARG 323 CO -0.69 0.73 0.00 0.09 -1.07 0.00 0.00 179.97 179.03 3h3d n ASN 324 N -4.55 2.87 -4.41 7.04 3.02 -0.66 -4.85 115.26 113.72 3h3d n ASN 324 Ca -0.05 -1.67 -0.39 0.00 -0.03 0.00 0.00 54.58 52.44 3h3d n ASN 324 Cb 0.33 -0.56 -0.08 0.00 -0.61 0.00 0.00 39.78 38.86 3h3d n ASN 324 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h3d n GLN 325 N 1.13 -0.78 0.02 3.52 3.00 -0.98 -4.84 117.38 118.45 3h3d n GLN 325 Ca 0.00 0.12 0.11 0.00 -0.01 0.00 0.00 57.00 57.22 3h3d n GLN 325 Cb 0.35 -4.30 -0.04 0.00 0.00 0.00 0.00 30.24 26.25 3h3d n GLN 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 3h3d n ARG 326 N -4.10 0.37 -3.61 -1.09 3.00 -1.01 -4.84 116.66 105.37 3h3d n ARG 326 Ca 0.00 -0.03 -0.36 0.00 -0.01 0.00 0.00 57.85 57.44 3h3d n ARG 326 Cb 0.50 -1.59 -0.08 0.00 0.00 0.00 0.00 32.46 31.29 3h3d n ARG 326 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 3h3d s TYR 327 N -3.26 3.38 0.14 -1.55 1.51 -1.26 -4.98 117.35 111.34 3h3d s TYR 327 Ca 0.01 0.40 -0.04 0.00 -1.01 0.00 0.00 57.07 56.43 3h3d s TYR 327 Cb 0.14 -2.30 -0.05 0.00 -0.11 0.00 0.00 41.96 39.64 3h3d s TYR 327 CO 0.83 0.15 1.34 -1.35 -1.11 0.00 0.00 175.55 175.42 3h3d h PRO 328 N 7.07 0.42 -0.60 -1.71 0.11 -2.01 -3.39 132.00 131.89 3h3d h PRO 328 Ca -0.39 -0.41 -0.30 0.00 0.11 0.00 0.00 66.00 65.00 3h3d h PRO 328 Cb 1.16 0.11 -0.31 0.00 0.11 0.00 0.00 31.00 32.07 3h3d h PRO 328 CO 0.72 1.07 -0.88 -1.71 -0.21 0.00 0.00 178.00 176.99 3h3d n ASN 329 N -3.78 0.21 -4.59 -2.05 5.15 -1.26 -5.11 115.26 103.83 3h3d n ASN 329 Ca -0.06 -2.58 -0.40 0.00 -0.60 0.00 0.00 54.58 50.94 3h3d n ASN 329 Cb 0.80 0.04 0.02 0.00 -0.53 0.00 0.00 39.78 40.11 3h3d n ASN 329 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 3h3d n LEU 330 N -0.31 2.59 -4.23 1.20 7.94 -1.26 -5.01 117.00 117.93 3h3d n LEU 330 Ca 0.04 0.96 -0.13 0.00 -1.11 0.00 0.00 56.01 55.77 3h3d n LEU 330 Cb 0.83 -1.34 -0.10 0.00 0.53 0.00 0.00 43.42 43.34 3h3d n LEU 330 CO 0.13 -1.72 -0.35 0.00 -1.11 0.00 0.00 177.39 174.34 3h3d s GLN 331 N -2.15 1.05 0.54 1.96 -2.07 -1.26 -5.04 119.66 112.68 3h3d s GLN 331 Ca 0.66 -1.49 0.20 0.00 -1.82 0.00 0.00 55.36 52.91 3h3d s GLN 331 Cb -0.52 -0.27 1.42 0.00 -1.09 0.00 0.00 33.01 32.55 3h3d s GLN 331 CO 0.55 -0.10 2.17 -0.07 -1.32 0.00 0.00 175.29 176.52 3h3d h LEU 332 N 2.76 0.00 -1.32 2.60 3.38 -1.94 0.17 115.31 120.95 3h3d h LEU 332 Ca -0.36 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.55 3h3d h LEU 332 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 3h3d h LEU 332 CO 0.63 0.00 -0.10 0.03 0.09 0.00 0.00 178.44 179.09 3h3d h ARG 333 N 0.00 0.33 0.00 1.13 3.08 -1.96 -2.19 114.38 114.78 3h3d h ARG 333 Ca 0.01 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3h3d h ARG 333 Cb 0.03 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3h3d h ARG 333 CO -0.00 0.45 0.00 -0.25 -1.07 0.00 0.00 179.97 179.10 3h3d n ASP 334 N -4.26 0.00 -1.08 7.04 8.00 0.59 -2.98 116.55 123.86 3h3d n ASP 334 Ca -0.00 -0.86 0.11 0.00 0.71 0.00 0.00 54.79 54.74 3h3d n ASP 334 Cb 0.27 0.00 0.21 0.00 -0.02 0.00 0.00 41.12 41.58 3h3d n ASP 334 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3h3d n LEU 335 N -0.85 3.38 -4.60 0.64 4.77 -0.82 -4.97 117.00 114.54 3h3d n LEU 335 Ca 0.11 -1.58 -0.49 0.00 -0.03 0.00 0.00 56.01 54.02 3h3d n LEU 335 Cb 0.05 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 40.84 3h3d n LEU 335 CO 0.08 0.75 0.89 0.00 -1.33 0.00 0.00 177.39 177.78 3h3d n ALA 336 N 1.36 -0.40 -1.07 -1.18 0.00 -1.16 0.19 120.51 118.26 3h3d n ALA 336 Ca 0.18 0.48 -0.02 0.00 0.00 0.00 0.00 53.44 54.08 3h3d n ALA 336 Cb 0.57 -2.11 -0.01 0.00 0.00 0.00 0.00 19.45 17.90 3h3d n ALA 336 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3h3d n ASN 337 N 2.42 -4.53 0.00 0.00 3.02 -1.26 -4.79 115.26 110.11 3h3d n ASN 337 Ca 0.16 0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.77 3h3d n ASN 337 Cb 0.23 -2.24 0.00 0.00 -0.61 0.00 0.00 39.78 37.17 3h3d n ASN 337 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3h3d n HIS 338 N -2.52 0.00 -0.01 3.10 8.25 0.13 -4.89 115.22 119.28 3h3d n HIS 338 Ca -0.02 -0.37 -0.13 0.00 -0.26 0.00 0.00 57.72 56.93 3h3d n HIS 338 Cb 0.28 -0.04 -0.10 0.00 1.12 0.00 0.00 29.99 31.26 3h3d n HIS 338 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3h3d h ILE 339 N 0.37 1.40 -0.53 1.59 1.08 -1.86 -1.17 117.51 118.39 3h3d h ILE 339 Ca 0.00 -1.31 0.11 0.00 -0.39 0.00 0.00 64.86 63.27 3h3d h ILE 339 Cb 0.50 2.27 -0.10 0.00 -3.07 0.00 0.00 36.82 36.42 3h3d h ILE 339 CO 0.00 0.33 -0.16 0.58 -0.69 0.00 0.00 178.15 178.21 3h3d h VAL 340 N -0.59 0.42 -0.58 1.67 2.07 -1.90 0.93 116.25 118.27 3h3d h VAL 340 Ca -0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3h3d h VAL 340 Cb 0.56 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3h3d h VAL 340 CO 0.00 0.00 0.36 -0.08 0.02 0.00 0.00 177.57 177.88 3h3d h GLU 341 N -0.03 0.78 -0.47 1.57 4.81 -1.92 -2.89 114.58 116.43 3h3d h GLU 341 Ca 0.25 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.34 3h3d h GLU 341 Cb 0.42 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 3h3d h GLU 341 CO -0.56 0.54 -0.04 0.74 -0.73 0.00 0.00 179.01 178.96 3h3d h PHE 342 N 0.79 0.94 -0.75 0.92 -1.00 -0.55 -2.98 116.94 114.31 3h3d h PHE 342 Ca 0.21 -0.18 0.17 0.00 2.81 0.00 0.00 57.97 60.98 3h3d h PHE 342 Cb -0.05 -0.24 -0.05 0.00 3.61 0.00 0.00 35.95 39.23 3h3d h PHE 342 CO -0.03 0.91 0.51 0.77 -1.61 0.00 0.00 178.31 178.86 3h3d h SER 343 N 0.70 0.29 1.37 2.17 0.02 -0.73 -1.02 113.55 116.34 3h3d h SER 343 Ca 0.13 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 3h3d h SER 343 Cb 0.56 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.06 3h3d h SER 343 CO 0.03 0.14 0.00 0.00 -1.14 0.00 0.00 176.83 175.86 3h3d n GLN 344 N -4.45 0.25 -3.22 3.45 6.02 -1.10 -1.95 117.38 116.38 3h3d n GLN 344 Ca 0.15 0.24 -0.34 0.00 -0.01 0.00 0.00 57.00 57.03 3h3d n GLN 344 Cb 0.61 -1.81 -0.06 0.00 1.02 0.00 0.00 30.24 29.99 3h3d n GLN 344 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3h3d s ASP 345 N -4.49 6.86 0.33 1.08 -1.08 -0.66 -4.70 116.67 114.03 3h3d s ASP 345 Ca 0.10 1.22 0.02 0.00 -0.52 0.00 0.00 52.55 53.37 3h3d s ASP 345 Cb 0.12 -2.35 0.61 0.00 -1.46 0.00 0.00 42.92 39.84 3h3d s ASP 345 CO 0.57 -0.02 1.97 -0.61 0.52 0.00 0.00 175.17 177.60 3h3d h GLN 346 N 3.05 0.89 0.04 4.34 4.15 -1.89 -1.66 115.11 124.03 3h3d h GLN 346 Ca -0.48 -0.05 -0.38 0.00 0.77 0.00 0.00 58.65 58.51 3h3d h GLN 346 Cb 1.19 -0.20 -0.05 0.00 0.21 0.00 0.00 27.48 28.63 3h3d h GLN 346 CO 0.66 0.59 -2.21 0.72 -1.93 0.00 0.00 178.83 176.66 3h3d n HIS 347 N -4.45 0.51 0.31 3.99 8.25 -1.26 -3.49 115.22 119.08 3h3d n HIS 347 Ca 0.10 0.13 0.19 0.00 -0.26 0.00 0.00 57.72 57.88 3h3d n HIS 347 Cb 0.12 -1.06 1.01 0.00 1.12 0.00 0.00 29.99 31.17 3h3d n HIS 347 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 3h3d h GLY 348 N 0.92 0.00 0.37 -1.41 0.00 -1.71 0.19 103.07 101.43 3h3d h GLY 348 Ca -0.53 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.79 3h3d h GLY 348 CO -0.10 0.00 -0.13 0.23 0.00 0.00 0.00 176.54 176.54 3h3d h SER 349 N 0.00 -0.30 -0.76 0.19 0.87 -0.21 -2.08 113.55 111.26 3h3d h SER 349 Ca -0.00 -0.18 0.17 0.00 -1.23 0.00 0.00 61.79 60.55 3h3d h SER 349 Cb 0.15 0.08 -0.13 0.00 -0.44 0.00 0.00 62.40 62.06 3h3d h SER 349 CO 0.00 0.20 0.05 -0.09 -0.53 0.00 0.00 176.83 176.46 3h3d h ARG 350 N -0.99 0.13 0.40 2.24 2.43 -1.52 0.59 114.38 117.67 3h3d h ARG 350 Ca -0.04 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 3h3d h ARG 350 Cb 0.46 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 3h3d h ARG 350 CO 0.06 0.09 -0.19 0.35 -1.51 0.00 0.00 179.97 178.76 3h3d h PHE 351 N 0.14 -0.50 -0.97 2.20 3.57 -0.74 -1.75 116.94 118.89 3h3d h PHE 351 Ca 0.42 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 62.02 3h3d h PHE 351 Cb 0.75 0.16 -0.08 0.00 2.79 0.00 0.00 35.95 39.57 3h3d h PHE 351 CO -0.38 -0.25 0.60 0.82 -2.23 0.00 0.00 178.31 176.87 3h3d h ILE 352 N -0.64 0.94 0.12 1.41 2.04 -1.00 -1.31 117.51 119.07 3h3d h ILE 352 Ca -0.05 -0.34 0.02 0.00 1.00 0.00 0.00 64.86 65.49 3h3d h ILE 352 Cb 0.47 -0.13 -0.04 0.00 -0.74 0.00 0.00 36.82 36.38 3h3d h ILE 352 CO 0.09 0.18 -0.35 1.56 0.00 0.00 0.00 178.15 179.63 3h3d h GLN 353 N 0.98 -0.56 -0.50 2.37 4.20 -0.66 -3.01 115.11 117.92 3h3d h GLN 353 Ca 0.47 0.04 -0.02 0.00 0.06 0.00 0.00 58.65 59.19 3h3d h GLN 353 Cb 0.43 0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 3h3d h GLN 353 CO -0.25 -0.37 0.22 1.96 -0.67 0.00 0.00 178.83 179.71 3h3d h GLN 354 N -0.58 0.74 0.00 1.46 4.20 -0.97 -2.05 115.11 117.91 3h3d h GLN 354 Ca 0.03 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.61 3h3d h GLN 354 Cb 0.61 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.27 3h3d h GLN 354 CO -0.20 0.64 0.00 1.63 -0.67 0.00 0.00 178.83 180.23 3h3d n LYS 355 N -4.57 0.02 0.01 1.46 4.76 -0.53 -3.94 118.16 115.37 3h3d n LYS 355 Ca 0.02 0.22 -0.19 0.00 -2.87 0.00 0.00 58.31 55.49 3h3d n LYS 355 Cb 0.14 -1.53 -0.14 0.00 -1.84 0.00 0.00 35.03 31.66 3h3d n LYS 355 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3h3d h LEU 356 N 0.00 0.37 -0.87 -0.35 5.85 -1.23 -2.07 115.31 117.01 3h3d h LEU 356 Ca 0.00 -0.78 0.16 0.00 0.84 0.00 0.00 57.88 58.10 3h3d h LEU 356 Cb 0.30 -0.12 -0.16 0.00 0.37 0.00 0.00 40.66 41.06 3h3d h LEU 356 CO 0.00 1.70 -0.29 -0.33 -0.34 0.00 0.00 178.44 179.18 3h3d h GLU 357 N 0.06 -0.03 -0.40 1.25 5.08 -1.68 -2.85 114.58 116.01 3h3d h GLU 357 Ca -0.39 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 3h3d h GLU 357 Cb 2.04 0.01 0.00 0.00 0.50 0.00 0.00 28.75 31.29 3h3d h GLU 357 CO 0.10 -0.02 0.00 0.54 -1.00 0.00 0.00 179.01 178.63 3h3d n ARG 358 N -5.52 3.64 -1.80 2.33 1.74 -1.24 -5.01 116.66 110.80 3h3d n ARG 358 Ca 0.11 -2.90 -0.30 0.00 -0.77 0.00 0.00 57.85 53.98 3h3d n ARG 358 Cb 0.42 -1.95 0.06 0.00 -1.02 0.00 0.00 32.46 29.97 3h3d n ARG 358 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3h3d s ALA 359 N -2.61 2.73 0.84 7.54 0.00 -0.78 -5.06 121.76 124.43 3h3d s ALA 359 Ca 0.46 -0.30 -0.07 0.00 0.00 0.00 0.00 51.96 52.05 3h3d s ALA 359 Cb 0.35 -3.05 0.15 0.00 0.00 0.00 0.00 23.12 20.58 3h3d s ALA 359 CO 0.13 -1.29 0.96 0.25 0.00 0.00 0.00 175.76 175.81 3h3d n THR 360 N -3.12 0.00 0.04 0.00 -2.24 -1.26 -4.93 114.28 102.77 3h3d n THR 360 Ca 0.07 -1.06 -0.22 0.00 -2.27 0.00 0.00 64.05 60.57 3h3d n THR 360 Cb 0.57 -1.29 -0.14 0.00 -2.10 0.00 0.00 70.33 67.37 3h3d n THR 360 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h3d h ALA 361 N -1.21 0.23 -0.59 6.98 0.00 -1.99 -2.91 119.26 119.77 3h3d h ALA 361 Ca -0.31 -1.19 -0.06 0.00 0.00 0.00 0.00 54.91 53.34 3h3d h ALA 361 Cb 0.99 0.53 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 3h3d h ALA 361 CO 0.27 1.04 0.11 0.00 0.00 0.00 0.00 179.25 180.67 3h3d h ALA 362 N 0.05 1.09 -1.40 0.00 0.00 -1.98 -1.80 119.26 115.22 3h3d h ALA 362 Ca -0.36 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.32 3h3d h ALA 362 Cb 1.99 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.55 3h3d h ALA 362 CO 0.12 0.60 0.00 0.39 0.00 0.00 0.00 179.25 180.36 3h3d n GLU 363 N -4.24 0.00 -0.11 0.00 1.02 -1.23 -2.09 120.64 114.00 3h3d n GLU 363 Ca 0.04 0.45 -0.00 0.00 -0.02 0.00 0.00 57.16 57.63 3h3d n GLU 363 Cb 0.26 -1.27 0.01 0.00 -0.02 0.00 0.00 31.44 30.42 3h3d n GLU 363 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3h3d n LYS 364 N -1.59 -0.06 0.26 3.49 5.02 -1.10 0.21 118.16 124.38 3h3d n LYS 364 Ca 0.00 0.44 0.14 0.00 -2.02 0.00 0.00 58.31 56.87 3h3d n LYS 364 Cb 0.00 -0.65 0.62 0.00 -0.02 0.00 0.00 35.03 34.99 3h3d n LYS 364 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 3h3d h GLN 365 N 0.00 0.00 0.22 1.97 1.08 -1.31 0.26 115.11 117.33 3h3d h GLN 365 Ca 0.10 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.29 3h3d h GLN 365 Cb 0.17 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.60 3h3d h GLN 365 CO -0.28 0.10 -0.11 1.98 -0.95 0.00 0.00 178.83 179.57 3h3d h MET 366 N 0.00 -0.29 -0.72 1.46 4.05 0.30 -2.50 114.93 117.23 3h3d h MET 366 Ca -0.00 0.02 0.14 0.00 -0.28 0.00 0.00 59.70 59.58 3h3d h MET 366 Cb 0.56 0.07 -0.14 0.00 -0.80 0.00 0.00 31.60 31.29 3h3d h MET 366 CO 0.01 -0.19 -0.25 0.28 0.23 0.00 0.00 176.91 176.99 3h3d h VAL 367 N -0.88 0.20 -0.95 -5.77 2.07 -1.23 -1.88 116.25 107.81 3h3d h VAL 367 Ca -0.03 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 3h3d h VAL 367 Cb 0.23 0.20 -0.05 0.00 -1.52 0.00 0.00 31.29 30.15 3h3d h VAL 367 CO 0.05 0.00 0.57 0.15 0.02 0.00 0.00 177.57 178.36 3h3d h PHE 368 N -0.05 1.26 0.00 1.57 3.57 -0.56 0.62 116.94 123.34 3h3d h PHE 368 Ca 0.32 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.77 3h3d h PHE 368 Cb 0.56 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3h3d h PHE 368 CO -0.63 0.83 -0.23 1.03 -2.23 0.00 0.00 178.31 177.08 3h3d h SER 369 N 1.31 0.00 0.00 0.41 0.87 -0.90 0.13 113.55 115.38 3h3d h SER 369 Ca 0.34 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.90 3h3d h SER 369 Cb -0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 3h3d h SER 369 CO -0.06 0.23 -0.00 -0.33 -0.53 0.00 0.00 176.83 176.14 3h3d h GLU 370 N 0.00 -0.00 -0.77 2.24 5.08 -0.48 -3.15 114.58 117.49 3h3d h GLU 370 Ca -0.00 0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.53 3h3d h GLU 370 Cb 0.85 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.05 3h3d h GLU 370 CO 0.03 0.89 0.53 -0.84 -1.00 0.00 0.00 179.01 178.62 3h3d h ILE 371 N -0.95 0.73 -0.48 3.13 3.07 0.21 -2.97 117.51 120.26 3h3d h ILE 371 Ca -0.00 -0.10 -0.06 0.00 1.55 0.00 0.00 64.86 66.25 3h3d h ILE 371 Cb 0.90 0.40 -0.02 0.00 -0.27 0.00 0.00 36.82 37.83 3h3d h ILE 371 CO 0.00 0.06 0.08 0.25 -1.05 0.00 0.00 178.15 177.48 3h3d h LEU 372 N 0.30 0.77 -2.16 0.16 5.85 -0.98 -1.33 115.31 117.92 3h3d h LEU 372 Ca 0.38 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.84 3h3d h LEU 372 Cb 1.05 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.88 3h3d h LEU 372 CO -0.10 0.83 0.00 0.00 -0.34 0.00 0.00 178.44 178.83 3h3d h ALA 373 N 0.96 1.00 -0.02 1.25 0.00 -1.48 -2.77 119.26 118.20 3h3d h ALA 373 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3h3d h ALA 373 Cb 0.39 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3h3d h ALA 373 CO 0.01 0.00 -0.41 0.00 0.00 0.00 0.00 179.25 178.85 3h3d n ALA 374 N -2.06 3.52 0.04 0.00 0.00 -0.97 -4.97 120.51 116.07 3h3d n ALA 374 Ca -0.01 -3.21 -0.11 0.00 0.00 0.00 0.00 53.44 50.11 3h3d n ALA 374 Cb 0.18 -0.38 -0.04 0.00 0.00 0.00 0.00 19.45 19.22 3h3d n ALA 374 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h3d h ALA 375 N 0.88 -0.22 0.13 0.00 0.00 -0.96 -2.16 119.26 116.93 3h3d h ALA 375 Ca 0.01 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3h3d h ALA 375 Cb 1.04 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3h3d h ALA 375 CO 0.02 -0.68 -0.10 -0.92 0.00 0.00 0.00 179.25 177.57 3h3d h TYR 376 N -0.30 -0.25 -1.00 0.00 3.20 -1.88 0.56 116.97 117.29 3h3d h TYR 376 Ca 0.07 -0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.14 3h3d h TYR 376 Cb 0.40 0.09 -0.11 0.00 1.54 0.00 0.00 36.73 38.65 3h3d h TYR 376 CO -0.27 -0.16 0.61 0.77 -1.64 0.00 0.00 178.16 177.47 3h3d h SER 377 N -0.24 0.76 0.58 -2.11 0.02 -1.95 -2.85 113.55 107.77 3h3d h SER 377 Ca -0.01 0.11 -0.28 0.00 -0.84 0.00 0.00 61.79 60.77 3h3d h SER 377 Cb 0.21 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.72 3h3d h SER 377 CO -0.01 0.24 -1.33 -0.07 -1.14 0.00 0.00 176.83 174.53 3h3d h LEU 378 N 0.73 0.41 -2.11 5.07 3.38 -0.60 -3.22 115.31 118.97 3h3d h LEU 378 Ca 0.59 -0.47 0.09 0.00 0.09 0.00 0.00 57.88 58.18 3h3d h LEU 378 Cb 0.97 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 3h3d h LEU 378 CO -0.40 1.37 0.26 0.24 0.09 0.00 0.00 178.44 180.01 3h3d h MET 379 N 0.07 0.00 -0.51 1.13 2.86 0.29 -0.78 114.93 117.99 3h3d h MET 379 Ca -0.16 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.48 3h3d h MET 379 Cb 1.98 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.64 3h3d h MET 379 CO 0.19 0.00 0.00 0.25 1.06 0.00 0.00 176.91 178.41 3h3d n THR 380 N -4.03 1.31 -3.86 2.22 -2.24 -1.10 -3.02 114.28 103.55 3h3d n THR 380 Ca 0.04 -1.13 -0.37 0.00 -2.27 0.00 0.00 64.05 60.32 3h3d n THR 380 Cb 0.42 0.35 -0.06 0.00 -2.10 0.00 0.00 70.33 68.94 3h3d n THR 380 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3h3d s ASP 381 N -1.08 6.41 0.30 3.42 -1.08 -0.98 -4.76 116.67 118.91 3h3d s ASP 381 Ca 0.38 0.49 0.05 0.00 -0.52 0.00 0.00 52.55 52.95 3h3d s ASP 381 Cb 0.22 -2.07 0.70 0.00 -1.46 0.00 0.00 42.92 40.31 3h3d s ASP 381 CO 0.22 0.39 1.79 1.62 0.52 0.00 0.00 175.17 179.72 3h3d h VAL 382 N 3.87 0.76 0.00 1.11 3.04 -1.92 -2.75 116.25 120.36 3h3d h VAL 382 Ca -0.54 -0.28 -0.23 0.00 -1.01 0.00 0.00 66.70 64.64 3h3d h VAL 382 Cb 1.23 -0.13 -0.04 0.00 -2.01 0.00 0.00 31.29 30.33 3h3d h VAL 382 CO 0.59 0.15 -1.97 0.49 -1.01 0.00 0.00 177.57 175.82 3h3d n PHE 383 N -4.72 0.00 0.24 3.17 0.99 -1.26 -4.53 117.46 111.35 3h3d n PHE 383 Ca 0.22 0.00 0.12 0.00 -0.00 0.00 0.00 57.45 57.79 3h3d n PHE 383 Cb 0.52 -0.67 0.54 0.00 -1.00 0.00 0.00 39.48 38.86 3h3d n PHE 383 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 3h3d h GLY 384 N 2.92 0.00 1.31 1.37 0.00 -1.35 -3.20 103.07 104.11 3h3d h GLY 384 Ca -0.34 0.00 0.02 0.00 0.00 0.00 0.00 47.33 47.01 3h3d h GLY 384 CO 0.02 0.00 0.43 3.45 0.00 0.00 0.00 176.54 180.44 3h3d h ASN 385 N 0.00 0.71 0.36 0.19 7.08 -0.84 -0.36 115.58 122.72 3h3d h ASN 385 Ca -0.00 -0.01 -0.03 0.00 -3.08 0.00 0.00 56.30 53.17 3h3d h ASN 385 Cb 0.64 -0.17 -0.00 0.00 -2.08 0.00 0.00 38.32 36.71 3h3d h ASN 385 CO 0.02 0.50 -0.14 1.88 -2.08 0.00 0.00 177.43 177.61 3h3d h TYR 386 N 0.83 0.00 -0.02 4.14 -1.99 -1.84 0.10 116.97 118.19 3h3d h TYR 386 Ca 0.25 0.00 -0.23 0.00 2.00 0.00 0.00 58.73 60.74 3h3d h TYR 386 Cb -0.02 0.00 0.02 0.00 2.00 0.00 0.00 36.73 38.73 3h3d h TYR 386 CO -0.00 0.14 -0.90 0.28 -0.00 0.00 0.00 178.16 177.68 3h3d h VAL 387 N 0.00 1.31 0.11 -2.88 2.07 -1.22 -1.72 116.25 113.92 3h3d h VAL 387 Ca -0.00 -2.16 -0.01 0.00 0.82 0.00 0.00 66.70 65.35 3h3d h VAL 387 Cb 0.36 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3h3d h VAL 387 CO 0.02 0.66 -0.05 0.40 0.02 0.00 0.00 177.57 178.62 3h3d h ILE 388 N 0.30 0.95 -0.47 4.57 1.08 -1.28 -2.76 117.51 119.91 3h3d h ILE 388 Ca -0.11 -0.24 0.08 0.00 -0.39 0.00 0.00 64.86 64.20 3h3d h ILE 388 Cb 1.57 1.11 -0.06 0.00 -3.07 0.00 0.00 36.82 36.36 3h3d h ILE 388 CO 0.18 0.06 0.10 1.56 -0.69 0.00 0.00 178.15 179.35 3h3d h GLN 389 N -0.26 0.23 -0.87 2.37 4.20 -0.81 -2.46 115.11 117.52 3h3d h GLN 389 Ca -0.02 -0.01 0.19 0.00 0.06 0.00 0.00 58.65 58.87 3h3d h GLN 389 Cb 0.21 -0.05 -0.11 0.00 0.30 0.00 0.00 27.48 27.83 3h3d h GLN 389 CO 0.03 0.15 0.40 0.87 -0.67 0.00 0.00 178.83 179.61 3h3d h LYS 390 N 0.23 0.48 0.00 1.46 1.79 -1.21 -1.52 116.57 117.80 3h3d h LYS 390 Ca 0.23 -0.03 -0.05 0.00 -2.18 0.00 0.00 60.65 58.62 3h3d h LYS 390 Cb 0.30 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 3h3d h LYS 390 CO -0.30 0.31 -0.23 0.74 -1.08 0.00 0.00 179.45 178.89 3h3d h PHE 391 N 0.49 0.00 -0.13 -1.35 -1.00 -1.16 0.93 116.94 114.72 3h3d h PHE 391 Ca 0.51 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 61.11 3h3d h PHE 391 Cb 0.87 0.00 0.01 0.00 3.61 0.00 0.00 35.95 40.44 3h3d h PHE 391 CO -0.12 0.23 -0.63 0.74 -1.61 0.00 0.00 178.31 176.92 3h3d h PHE 392 N 0.00 0.89 0.00 -0.55 0.05 -0.95 -3.38 116.94 112.99 3h3d h PHE 392 Ca -0.00 -0.39 0.00 0.00 3.82 0.00 0.00 57.97 61.40 3h3d h PHE 392 Cb 0.70 -0.14 0.00 0.00 2.00 0.00 0.00 35.95 38.51 3h3d h PHE 392 CO 0.00 1.20 0.00 -1.91 -0.18 0.00 0.00 178.31 177.42 3h3d n GLU 393 N -4.09 0.00 0.00 1.51 4.07 -0.65 -4.88 120.64 116.60 3h3d n GLU 393 Ca -0.08 0.12 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 3h3d n GLU 393 Cb 0.67 -1.05 0.00 0.00 -0.06 0.00 0.00 31.44 31.00 3h3d n GLU 393 CO 0.00 0.00 0.00 1.19 -0.06 0.00 0.00 177.13 178.26 3h3d n PHE 394 N -0.87 -1.26 0.00 4.31 3.01 0.31 -4.99 117.46 117.98 3h3d n PHE 394 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 3h3d n PHE 394 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.47 3h3d n PHE 394 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3h3d n GLY 395 N 3.09 -2.18 3.73 1.37 0.00 -1.26 -4.60 105.19 105.35 3h3d n GLY 395 Ca 0.00 -1.23 -0.31 0.00 0.00 0.00 0.00 46.02 44.48 3h3d n GLY 395 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3h3d s THR 396 N -1.84 2.91 0.19 2.61 -1.32 -1.26 -4.76 115.64 112.17 3h3d s THR 396 Ca 0.00 0.30 -0.12 0.00 -1.21 0.00 0.00 61.69 60.66 3h3d s THR 396 Cb 0.00 -2.65 0.11 0.00 -1.51 0.00 0.00 72.50 68.45 3h3d s THR 396 CO 0.00 -0.39 1.75 -0.65 -2.21 0.00 0.00 174.62 173.12 3h3d h PRO 397 N -1.39 0.38 -0.64 7.08 0.11 -1.96 0.83 132.00 136.41 3h3d h PRO 397 Ca -0.44 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.63 3h3d h PRO 397 Cb 1.25 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 3h3d h PRO 397 CO 0.49 0.25 0.35 0.93 -0.21 0.00 0.00 178.00 179.81 3h3d h GLU 398 N 0.39 0.89 -0.51 1.05 3.07 -1.98 0.04 114.58 117.53 3h3d h GLU 398 Ca 0.26 -0.10 0.01 0.00 -0.50 0.00 0.00 59.36 59.02 3h3d h GLU 398 Cb 0.28 -0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 27.99 3h3d h GLU 398 CO -0.26 0.67 0.34 1.96 -1.40 0.00 0.00 179.01 180.32 3h3d h GLN 399 N 0.87 0.67 -0.48 2.33 4.20 -1.87 -0.44 115.11 120.39 3h3d h GLN 399 Ca 0.22 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.82 3h3d h GLN 399 Cb 0.04 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 27.65 3h3d h GLN 399 CO -0.04 0.44 0.01 0.87 -0.67 0.00 0.00 178.83 179.44 3h3d h LYS 400 N 0.69 0.80 -0.34 1.46 1.57 -0.46 -1.19 116.57 119.10 3h3d h LYS 400 Ca 0.19 -0.21 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 3h3d h LYS 400 Cb -0.08 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.13 3h3d h LYS 400 CO -0.04 0.80 -0.27 -0.97 -0.57 0.00 0.00 179.45 178.40 3h3d h ASN 401 N 0.75 0.72 0.46 0.86 -0.73 -0.39 -1.51 115.58 115.75 3h3d h ASN 401 Ca 0.15 -0.27 -0.28 0.00 1.87 0.00 0.00 56.30 57.77 3h3d h ASN 401 Cb 0.44 -0.20 0.01 0.00 0.27 0.00 0.00 38.32 38.85 3h3d h ASN 401 CO 0.02 0.96 -1.23 0.74 -0.37 0.00 0.00 177.43 177.54 3h3d h THR 402 N 0.61 1.42 -0.19 -3.57 2.02 -0.77 -2.35 112.91 110.08 3h3d h THR 402 Ca 0.08 -2.83 -0.12 0.00 0.77 0.00 0.00 66.41 64.31 3h3d h THR 402 Cb 0.77 2.84 -0.01 0.00 -1.74 0.00 0.00 68.15 70.01 3h3d h THR 402 CO 0.06 0.84 -0.41 -0.07 0.37 0.00 0.00 175.52 176.31 3h3d h LEU 403 N 0.14 0.45 -1.13 2.58 3.38 -1.09 -3.09 115.31 116.55 3h3d h LEU 403 Ca -0.15 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.53 3h3d h LEU 403 Cb 1.93 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 3h3d h LEU 403 CO 0.21 0.81 -0.42 1.23 0.09 0.00 0.00 178.44 180.37 3h3d h GLY 404 N 1.13 0.04 1.60 0.83 0.00 -1.25 -1.72 103.07 103.71 3h3d h GLY 404 Ca 0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.30 3h3d h GLY 404 CO 0.07 0.04 0.16 -0.33 0.00 0.00 0.00 176.54 176.47 3h3d h MET 405 N 0.03 0.52 -0.23 4.80 2.86 -1.36 -1.01 114.93 120.55 3h3d h MET 405 Ca 0.00 -0.06 -0.17 0.00 -2.06 0.00 0.00 59.70 57.40 3h3d h MET 405 Cb 0.75 -0.10 0.00 0.00 0.06 0.00 0.00 31.60 32.31 3h3d h MET 405 CO 0.06 0.43 -0.53 1.96 1.06 0.00 0.00 176.91 179.89 3h3d h GLN 406 N 0.53 0.77 -0.11 1.72 1.08 -1.41 -2.28 115.11 115.41 3h3d h GLN 406 Ca 0.13 -0.52 -0.00 0.00 -1.45 0.00 0.00 58.65 56.81 3h3d h GLN 406 Cb 0.10 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 3h3d h GLN 406 CO -0.01 1.14 0.05 0.28 -0.95 0.00 0.00 178.83 179.34 3h3d h VAL 407 N 0.51 1.12 -0.97 -0.54 2.07 -1.27 -3.10 116.25 114.07 3h3d h VAL 407 Ca -0.00 -0.34 0.22 0.00 0.82 0.00 0.00 66.70 67.41 3h3d h VAL 407 Cb 1.14 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 31.97 3h3d h VAL 407 CO 0.12 0.10 0.63 0.50 0.02 0.00 0.00 177.57 178.94 3h3d h LYS 408 N 0.05 0.43 0.00 1.57 3.64 -1.14 0.20 116.57 121.32 3h3d h LYS 408 Ca 0.04 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3h3d h LYS 408 Cb 0.12 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3h3d h LYS 408 CO -0.00 0.29 -0.18 0.41 -2.27 0.00 0.00 179.45 177.69 3h3d n GLY 409 N -1.48 -1.46 0.00 5.01 0.00 -0.86 -3.66 105.19 102.73 3h3d n GLY 409 Ca 0.22 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3h3d n GLY 409 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3h3d n HIS 410 N -1.65 0.00 -0.34 1.61 8.25 -0.87 -4.92 115.22 117.30 3h3d n HIS 410 Ca 0.06 -0.10 0.10 0.00 -0.26 0.00 0.00 57.72 57.52 3h3d n HIS 410 Cb 0.36 -0.01 0.27 0.00 1.12 0.00 0.00 29.99 31.73 3h3d n HIS 410 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 3h3d h VAL 411 N 1.84 0.77 -0.35 1.59 3.04 -1.05 0.47 116.25 122.55 3h3d h VAL 411 Ca 0.00 -0.27 0.01 0.00 -1.01 0.00 0.00 66.70 65.43 3h3d h VAL 411 Cb 0.74 -0.08 -0.02 0.00 -2.01 0.00 0.00 31.29 29.93 3h3d h VAL 411 CO 0.00 0.14 0.22 -0.07 -1.01 0.00 0.00 177.57 176.85 3h3d h LEU 412 N 0.78 0.38 -0.21 3.16 3.38 -1.88 1.06 115.31 121.97 3h3d h LEU 412 Ca 0.52 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.46 3h3d h LEU 412 Cb 0.72 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3h3d h LEU 412 CO -0.35 0.27 0.01 1.56 0.09 0.00 0.00 178.44 180.03 3h3d h GLN 413 N 0.46 0.36 -0.42 1.13 4.20 -1.74 -3.16 115.11 115.94 3h3d h GLN 413 Ca 0.13 -0.11 -0.04 0.00 0.06 0.00 0.00 58.65 58.69 3h3d h GLN 413 Cb -0.04 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 3h3d h GLN 413 CO -0.04 0.54 0.08 -0.07 -0.67 0.00 0.00 178.83 178.67 3h3d h LEU 414 N 0.13 0.59 -1.90 1.46 3.38 -0.73 -2.53 115.31 115.72 3h3d h LEU 414 Ca 0.06 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3h3d h LEU 414 Cb 0.37 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 3h3d h LEU 414 CO 0.01 0.61 -0.11 0.00 0.09 0.00 0.00 178.44 179.04 3h3d h ALA 415 N 1.47 1.22 -0.16 1.53 0.00 0.12 -2.86 119.26 120.59 3h3d h ALA 415 Ca 0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3h3d h ALA 415 Cb 0.27 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3h3d h ALA 415 CO 0.00 0.14 0.00 1.28 0.00 0.00 0.00 179.25 180.67 3h3d n LEU 416 N -3.54 2.78 -4.39 0.00 4.77 -0.96 -1.99 117.00 113.67 3h3d n LEU 416 Ca -0.02 -1.05 -0.30 0.00 -0.03 0.00 0.00 56.01 54.61 3h3d n LEU 416 Cb 0.24 -0.09 -0.14 0.00 -2.33 0.00 0.00 43.42 41.10 3h3d n LEU 416 CO 0.29 0.52 -0.54 -1.58 -1.33 0.00 0.00 177.39 174.76 3h3d s GLN 417 N -1.82 1.91 0.34 3.23 -0.44 -1.08 -4.71 119.66 117.09 3h3d s GLN 417 Ca 0.33 -1.06 0.12 0.00 -2.50 0.00 0.00 55.36 52.25 3h3d s GLN 417 Cb 0.21 -2.07 0.93 0.00 -1.64 0.00 0.00 33.01 30.44 3h3d s GLN 417 CO 0.31 0.52 1.76 1.98 0.50 0.00 0.00 175.29 180.36 3h3d h MET 418 N 4.67 0.54 0.00 1.67 1.85 -1.90 0.82 114.93 122.58 3h3d h MET 418 Ca -0.47 -0.03 -0.19 0.00 -0.61 0.00 0.00 59.70 58.39 3h3d h MET 418 Cb 1.15 -0.12 -0.04 0.00 0.43 0.00 0.00 31.60 33.02 3h3d h MET 418 CO 0.45 0.36 -1.96 0.66 -0.40 0.00 0.00 176.91 176.02 3h3d n TYR 419 N -4.77 0.31 0.03 1.39 4.02 -1.26 -3.21 117.16 113.67 3h3d n TYR 419 Ca 0.25 0.10 -0.07 0.00 -0.01 0.00 0.00 57.90 58.18 3h3d n TYR 419 Cb 0.75 -0.88 0.12 0.00 -0.02 0.00 0.00 39.34 39.31 3h3d n TYR 419 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3h3d h GLY 420 N 3.91 0.50 -0.26 2.72 0.00 -1.41 -2.18 103.07 106.36 3h3d h GLY 420 Ca -0.26 -0.53 0.03 0.00 0.00 0.00 0.00 47.33 46.56 3h3d h GLY 420 CO 0.03 0.48 -0.24 0.00 0.00 0.00 0.00 176.54 176.81 3h3d h ARG 422 N -0.11 0.93 -0.30 0.00 3.08 -1.52 -2.77 114.38 113.69 3h3d h ARG 422 Ca 0.04 -0.15 -0.11 0.00 0.07 0.00 0.00 59.98 59.83 3h3d h ARG 422 Cb 0.22 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3h3d h ARG 422 CO -0.30 0.76 -0.26 0.28 -1.07 0.00 0.00 179.97 179.39 3h3d h VAL 423 N 0.88 1.30 -0.15 2.04 2.07 -1.28 -1.82 116.25 119.29 3h3d h VAL 423 Ca 0.22 -1.41 0.04 0.00 0.82 0.00 0.00 66.70 66.36 3h3d h VAL 423 Cb 0.16 1.53 -0.04 0.00 -1.52 0.00 0.00 31.29 31.42 3h3d h VAL 423 CO -0.02 0.45 -0.10 0.40 0.02 0.00 0.00 177.57 178.32 3h3d h ILE 424 N 0.46 0.69 -0.77 4.57 2.04 -1.26 0.21 117.51 123.45 3h3d h ILE 424 Ca 0.05 0.00 0.06 0.00 1.00 0.00 0.00 64.86 65.97 3h3d h ILE 424 Cb 0.82 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 3h3d h ILE 424 CO 0.07 0.00 0.46 1.56 0.00 0.00 0.00 178.15 180.24 3h3d h GLN 425 N -0.11 0.82 -0.39 2.37 4.20 -1.56 0.20 115.11 120.64 3h3d h GLN 425 Ca 0.09 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.63 3h3d h GLN 425 Cb 0.24 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 3h3d h GLN 425 CO -0.22 0.54 -0.27 -0.22 -0.67 0.00 0.00 178.83 178.00 3h3d h LYS 426 N 0.85 0.81 -0.51 1.46 1.63 -1.12 -3.05 116.57 116.64 3h3d h LYS 426 Ca 0.34 -0.35 -0.10 0.00 -0.85 0.00 0.00 60.65 59.68 3h3d h LYS 426 Cb 0.17 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 31.76 3h3d h LYS 426 CO -0.17 0.98 -0.08 0.00 -3.45 0.00 0.00 179.45 176.73 3h3d h ALA 427 N 1.00 0.90 -0.10 5.00 0.00 0.05 -3.10 119.26 123.01 3h3d h ALA 427 Ca 0.09 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3h3d h ALA 427 Cb 0.80 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3h3d h ALA 427 CO 0.07 0.64 0.05 -0.07 0.00 0.00 0.00 179.25 179.93 3h3d h LEU 428 N 0.83 0.14 -0.86 0.00 3.38 -0.97 -1.80 115.31 116.02 3h3d h LEU 428 Ca 0.14 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3h3d h LEU 428 Cb 0.60 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3h3d h LEU 428 CO 0.04 0.24 0.00 -1.84 0.09 0.00 0.00 178.44 176.96 3h3d n GLU 429 N -4.94 0.57 0.00 1.13 0.28 -1.15 -4.18 120.64 112.35 3h3d n GLU 429 Ca -0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.94 3h3d n GLU 429 Cb 0.10 -1.25 0.00 0.00 1.43 0.00 0.00 31.44 31.72 3h3d n GLU 429 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 3h3d n SER 430 N 0.11 0.00 -4.71 -1.84 7.64 -0.71 -5.05 113.62 109.07 3h3d n SER 430 Ca 0.00 0.00 -0.25 0.00 1.01 0.00 0.00 58.87 59.63 3h3d n SER 430 Cb 0.12 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.24 3h3d n SER 430 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3h3d s ILE 431 N 0.00 2.25 0.48 0.44 -1.09 -1.02 -5.00 121.20 117.26 3h3d s ILE 431 Ca 0.00 -1.78 -0.22 0.00 -2.23 0.00 0.00 60.65 56.42 3h3d s ILE 431 Cb 0.00 -2.99 -0.09 0.00 -1.58 0.00 0.00 42.46 37.80 3h3d s ILE 431 CO 0.00 -0.01 0.98 -1.54 -1.23 0.00 0.00 174.94 173.14 3h3d n SER 432 N -1.16 1.04 0.08 3.58 3.41 -1.26 -4.71 113.62 114.60 3h3d n SER 432 Ca -0.02 0.95 0.09 0.00 -0.26 0.00 0.00 58.87 59.63 3h3d n SER 432 Cb 0.65 -1.36 0.40 0.00 -0.26 0.00 0.00 64.21 63.64 3h3d n SER 432 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 3h3d n PRO 433 N -0.19 0.11 -0.05 4.33 -0.04 -1.26 -0.92 135.00 136.98 3h3d n PRO 433 Ca 0.10 0.40 -0.13 0.00 -0.04 0.00 0.00 63.50 63.83 3h3d n PRO 433 Cb 0.42 -1.72 -0.07 0.00 -0.04 0.00 0.00 33.50 32.08 3h3d n PRO 433 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3h3d h GLU 434 N 0.00 0.37 0.01 0.54 3.07 -2.01 -3.19 114.58 113.37 3h3d h GLU 434 Ca 0.00 -0.21 -0.26 0.00 -0.50 0.00 0.00 59.36 58.39 3h3d h GLU 434 Cb 0.25 0.01 0.02 0.00 -0.84 0.00 0.00 28.75 28.19 3h3d h GLU 434 CO 0.00 0.77 -1.04 1.96 -1.40 0.00 0.00 179.01 179.30 3h3d h GLN 435 N -0.01 0.64 -0.91 2.33 4.20 -1.76 -2.92 115.11 116.67 3h3d h GLN 435 Ca 0.02 -0.70 0.25 0.00 0.06 0.00 0.00 58.65 58.28 3h3d h GLN 435 Cb 0.72 0.20 -0.16 0.00 0.30 0.00 0.00 27.48 28.54 3h3d h GLN 435 CO 0.04 1.29 0.13 1.96 -0.67 0.00 0.00 178.83 181.57 3h3d h GLN 436 N 0.35 0.09 -0.34 1.46 4.20 -1.16 -2.44 115.11 117.28 3h3d h GLN 436 Ca -0.12 -0.01 -0.12 0.00 0.06 0.00 0.00 58.65 58.46 3h3d h GLN 436 Cb 1.69 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.45 3h3d h GLN 436 CO 0.20 0.06 -0.25 1.96 -0.67 0.00 0.00 178.83 180.13 3h3d h GLN 437 N 0.09 0.77 -0.66 1.46 4.20 -1.52 -3.08 115.11 116.37 3h3d h GLN 437 Ca 0.57 -0.37 0.06 0.00 0.06 0.00 0.00 58.65 58.96 3h3d h GLN 437 Cb 1.17 -0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.89 3h3d h GLN 437 CO -0.78 1.00 0.37 0.93 -0.67 0.00 0.00 178.83 179.67 3h3d h GLU 438 N 0.55 0.66 -0.25 1.46 5.08 -1.29 -1.47 114.58 119.33 3h3d h GLU 438 Ca 0.07 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3h3d h GLU 438 Cb 0.81 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 3h3d h GLU 438 CO 0.07 0.43 0.16 0.82 -1.00 0.00 0.00 179.01 179.49 3h3d h ILE 439 N 0.68 1.08 -0.29 3.13 2.04 -1.42 -2.59 117.51 120.14 3h3d h ILE 439 Ca 0.30 -0.16 0.06 0.00 1.00 0.00 0.00 64.86 66.06 3h3d h ILE 439 Cb 0.19 0.74 -0.07 0.00 -0.74 0.00 0.00 36.82 36.94 3h3d h ILE 439 CO -0.18 0.07 -0.15 0.58 0.00 0.00 0.00 178.15 178.47 3h3d h VAL 440 N 0.32 0.55 -0.58 1.67 2.07 -1.44 -2.49 116.25 116.35 3h3d h VAL 440 Ca 0.09 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.67 3h3d h VAL 440 Cb -0.02 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.27 3h3d h VAL 440 CO -0.02 0.00 0.38 -0.74 0.02 0.00 0.00 177.57 177.22 3h3d h HIS 441 N -0.11 0.57 -0.00 1.57 -0.00 -1.11 0.57 115.15 116.63 3h3d h HIS 441 Ca 0.15 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.54 3h3d h HIS 441 Cb 0.34 -0.19 -0.00 0.00 -0.00 0.00 0.00 27.41 27.56 3h3d h HIS 441 CO -0.34 0.31 0.27 0.93 -0.00 0.00 0.00 177.93 179.10 3h3d h GLU 442 N 0.57 0.00 0.00 5.26 4.39 -1.04 -1.35 114.58 122.40 3h3d h GLU 442 Ca 0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.95 3h3d h GLU 442 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 3h3d h GLU 442 CO -0.07 0.00 -0.48 1.28 -1.16 0.00 0.00 179.01 178.58 3h3d n LEU 443 N -2.93 0.49 -4.66 1.33 4.77 0.19 -4.83 117.00 111.35 3h3d n LEU 443 Ca -0.02 0.09 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 3h3d n LEU 443 Cb 0.32 -0.26 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3h3d n LEU 443 CO 0.15 0.08 1.54 -0.62 -1.33 0.00 0.00 177.39 177.21 3h3d s ASP 444 N -3.21 6.49 0.00 -1.43 -1.08 -0.51 0.60 116.67 117.52 3h3d s ASP 444 Ca 0.10 2.61 0.00 0.00 -0.52 0.00 0.00 52.55 54.74 3h3d s ASP 444 Cb 0.17 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.09 3h3d s ASP 444 CO 0.69 -1.02 0.00 0.61 0.52 0.00 0.00 175.17 175.97 3h3d n GLY 445 N 4.42 0.87 0.39 2.66 0.00 -1.26 -4.92 105.19 107.35 3h3d n GLY 445 Ca 0.19 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.23 3h3d n GLY 445 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3h3d n HIS 446 N -2.00 0.00 -0.10 1.61 8.25 0.20 -4.90 115.22 118.28 3h3d n HIS 446 Ca 0.00 -0.24 -0.13 0.00 -0.26 0.00 0.00 57.72 57.09 3h3d n HIS 446 Cb 0.00 -0.07 -0.04 0.00 1.12 0.00 0.00 29.99 31.00 3h3d n HIS 446 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 3h3d h VAL 447 N 5.23 1.30 -0.12 1.59 3.04 -1.84 -3.25 116.25 122.19 3h3d h VAL 447 Ca 0.00 -1.49 -0.05 0.00 -1.01 0.00 0.00 66.70 64.15 3h3d h VAL 447 Cb 1.29 1.56 -0.00 0.00 -2.01 0.00 0.00 31.29 32.13 3h3d h VAL 447 CO 0.00 0.48 -0.13 -0.07 -1.01 0.00 0.00 177.57 176.85 3h3d h LEU 448 N 0.51 0.32 -0.64 3.16 3.38 -1.92 0.42 115.31 120.55 3h3d h LEU 448 Ca 0.05 -0.49 0.13 0.00 0.09 0.00 0.00 57.88 57.66 3h3d h LEU 448 Cb 0.90 -0.09 -0.12 0.00 0.09 0.00 0.00 40.66 41.44 3h3d h LEU 448 CO 0.08 0.74 -0.13 0.50 0.09 0.00 0.00 178.44 179.72 3h3d h LYS 449 N -0.09 0.02 -0.24 1.13 1.63 -1.96 -0.03 116.57 117.02 3h3d h LYS 449 Ca 0.02 -0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.80 3h3d h LYS 449 Cb 0.65 -0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.27 3h3d h LYS 449 CO 0.03 0.01 0.07 0.00 -3.45 0.00 0.00 179.45 176.11 3h3d h VAL 451 N 0.22 0.96 -0.01 0.00 2.07 0.21 0.36 116.25 120.07 3h3d h VAL 451 Ca 0.08 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.34 3h3d h VAL 451 Cb 0.26 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 3h3d h VAL 451 CO -0.00 0.14 -0.03 0.29 0.02 0.00 0.00 177.57 177.98 3h3d n LYS 452 N -4.50 1.45 -3.73 1.57 5.02 -0.06 -3.51 118.16 114.41 3h3d n LYS 452 Ca 0.13 -0.77 -0.37 0.00 -2.02 0.00 0.00 58.31 55.28 3h3d n LYS 452 Cb 0.30 -1.48 -0.06 0.00 -0.02 0.00 0.00 35.03 33.77 3h3d n LYS 452 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3h3d s ASP 453 N -2.08 6.53 0.42 4.39 2.15 -0.97 -4.87 116.67 122.25 3h3d s ASP 453 Ca 0.37 0.63 0.22 0.00 0.43 0.00 0.00 52.55 54.21 3h3d s ASP 453 Cb 0.21 -2.14 1.21 0.00 -0.30 0.00 0.00 42.92 41.90 3h3d s ASP 453 CO 0.37 0.36 1.76 -0.61 -0.17 0.00 0.00 175.17 176.87 3h3d h GLN 454 N 5.02 0.29 0.02 4.34 4.15 -1.90 -2.33 115.11 124.70 3h3d h GLN 454 Ca -0.53 -0.02 -0.39 0.00 0.77 0.00 0.00 58.65 58.48 3h3d h GLN 454 Cb 1.22 -0.07 -0.06 0.00 0.21 0.00 0.00 27.48 28.79 3h3d h GLN 454 CO 0.61 0.19 -2.34 0.09 -1.93 0.00 0.00 178.83 175.45 3h3d n ASN 455 N -4.57 1.99 0.27 -0.69 3.02 -1.26 -4.59 115.26 109.43 3h3d n ASN 455 Ca 0.27 0.07 0.15 0.00 -0.03 0.00 0.00 54.58 55.03 3h3d n ASN 455 Cb 1.00 -0.62 0.76 0.00 -0.61 0.00 0.00 39.78 40.31 3h3d n ASN 455 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 3h3d h GLY 456 N 0.95 0.00 2.00 7.41 0.00 -1.31 -1.82 103.07 110.30 3h3d h GLY 456 Ca -0.57 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 46.67 3h3d h GLY 456 CO -0.15 0.00 -0.43 3.45 0.00 0.00 0.00 176.54 179.41 3h3d h ASN 457 N 0.00 0.00 -0.50 0.19 7.08 0.28 -0.83 115.58 121.80 3h3d h ASN 457 Ca -0.00 0.00 -0.03 0.00 -3.08 0.00 0.00 56.30 53.19 3h3d h ASN 457 Cb 0.38 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.60 3h3d h ASN 457 CO 0.01 0.43 0.18 0.45 -2.08 0.00 0.00 177.43 176.43 3h3d h HIS 458 N 0.00 0.77 -0.21 4.14 3.86 -1.58 0.95 115.15 123.07 3h3d h HIS 458 Ca -0.00 -0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 59.11 3h3d h HIS 458 Cb 0.78 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 29.01 3h3d h HIS 458 CO 0.00 0.65 -0.01 0.28 0.86 0.00 0.00 177.93 179.72 3h3d h VAL 459 N 0.66 1.26 -0.52 2.45 2.07 -1.56 -0.48 116.25 120.13 3h3d h VAL 459 Ca 0.16 -0.90 0.05 0.00 0.82 0.00 0.00 66.70 66.83 3h3d h VAL 459 Cb 0.22 1.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 3h3d h VAL 459 CO -0.01 0.28 0.26 0.58 0.02 0.00 0.00 177.57 178.69 3h3d h VAL 460 N 0.14 0.94 -0.82 2.57 2.07 -1.00 -1.25 116.25 118.91 3h3d h VAL 460 Ca 0.06 -0.17 0.05 0.00 0.82 0.00 0.00 66.70 67.46 3h3d h VAL 460 Cb 0.41 0.40 -0.06 0.00 -1.52 0.00 0.00 31.29 30.53 3h3d h VAL 460 CO 0.01 0.09 0.51 1.56 0.02 0.00 0.00 177.57 179.76 3h3d h GLN 461 N 0.50 0.93 -0.48 1.57 4.20 -0.70 -1.34 115.11 119.79 3h3d h GLN 461 Ca 0.23 -0.06 0.05 0.00 0.06 0.00 0.00 58.65 58.94 3h3d h GLN 461 Cb 0.15 -0.21 -0.05 0.00 0.30 0.00 0.00 27.48 27.67 3h3d h GLN 461 CO -0.17 0.62 0.21 -0.22 -0.67 0.00 0.00 178.83 178.60 3h3d h LYS 462 N 0.96 0.40 -0.55 1.46 1.63 -0.80 0.97 116.57 120.64 3h3d h LYS 462 Ca 0.34 -0.02 -0.03 0.00 -0.85 0.00 0.00 60.65 60.09 3h3d h LYS 462 Cb 0.10 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 31.62 3h3d h LYS 462 CO -0.15 0.26 0.21 0.00 -3.45 0.00 0.00 179.45 176.33 3h3d h ILE 464 N 0.75 1.17 -0.00 0.00 2.04 -0.97 -2.61 117.51 117.88 3h3d h ILE 464 Ca 0.18 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.67 3h3d h ILE 464 Cb 0.21 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.67 3h3d h ILE 464 CO -0.01 0.17 -0.03 -1.84 0.00 0.00 0.00 178.15 176.44 3h3d n GLU 465 N -4.64 0.28 -0.08 2.37 0.28 0.31 -4.10 120.64 115.06 3h3d n GLU 465 Ca 0.04 -0.02 -0.08 0.00 -0.16 0.00 0.00 57.16 56.93 3h3d n GLU 465 Cb 0.05 -1.50 -0.13 0.00 1.43 0.00 0.00 31.44 31.29 3h3d n GLU 465 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3h3d s VAL 467 N -2.40 3.64 0.02 0.00 1.01 -1.00 -5.04 120.40 116.64 3h3d s VAL 467 Ca -0.09 -1.08 -0.32 0.00 0.00 0.00 0.00 61.98 60.49 3h3d s VAL 467 Cb 0.05 -3.25 -0.11 0.00 0.00 0.00 0.00 36.38 33.07 3h3d s VAL 467 CO 0.67 -0.11 1.87 -0.67 0.00 0.00 0.00 175.10 176.86 3h3d n ASP 468 N -1.64 3.77 -0.25 3.32 -0.08 -1.26 -4.90 116.55 115.52 3h3d n ASP 468 Ca 0.02 0.96 0.14 0.00 -1.51 0.00 0.00 54.79 54.40 3h3d n ASP 468 Cb 0.59 -1.46 0.27 0.00 2.34 0.00 0.00 41.12 42.85 3h3d n ASP 468 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 3h3d n PRO 469 N 6.38 -0.06 -0.42 -0.67 -0.01 -1.26 -0.34 135.00 138.62 3h3d n PRO 469 Ca 0.20 1.09 0.40 0.00 -0.01 0.00 0.00 63.50 65.18 3h3d n PRO 469 Cb 0.35 -1.78 0.76 0.00 -0.01 0.00 0.00 33.50 32.82 3h3d n PRO 469 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 175.50 175.77 3h3d h VAL 470 N 0.00 0.30 -0.02 -1.45 2.07 -1.95 0.12 116.25 115.32 3h3d h VAL 470 Ca 0.49 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.01 3h3d h VAL 470 Cb 1.10 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3h3d h VAL 470 CO -0.67 0.00 0.00 0.00 0.02 0.00 0.00 177.57 176.92 3h3d n ALA 471 N -2.80 2.61 -0.52 1.67 0.00 0.53 -3.76 120.51 118.24 3h3d n ALA 471 Ca 0.30 -0.35 0.09 0.00 0.00 0.00 0.00 53.44 53.49 3h3d n ALA 471 Cb 1.44 -1.28 0.31 0.00 0.00 0.00 0.00 19.45 19.91 3h3d n ALA 471 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3h3d n LEU 472 N -0.26 4.21 -0.22 0.00 4.77 0.41 -4.48 117.00 121.44 3h3d n LEU 472 Ca 0.20 -2.30 0.02 0.00 -0.03 0.00 0.00 56.01 53.90 3h3d n LEU 472 Cb 0.25 -0.50 0.27 0.00 -2.33 0.00 0.00 43.42 41.12 3h3d n LEU 472 CO 0.16 0.84 1.24 -0.61 -1.33 0.00 0.00 177.39 177.69 3h3d h GLN 473 N 3.65 0.93 -0.10 3.23 4.15 -1.69 -2.46 115.11 122.83 3h3d h GLN 473 Ca 0.00 -0.06 -0.08 0.00 0.77 0.00 0.00 58.65 59.28 3h3d h GLN 473 Cb 1.22 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.69 3h3d h GLN 473 CO 0.14 0.62 -0.30 0.27 -1.93 0.00 0.00 178.83 177.62 3h3d h PHE 474 N 0.96 0.21 -0.29 3.99 -5.15 -1.91 -2.17 116.94 112.58 3h3d h PHE 474 Ca 0.30 -0.04 -0.06 0.00 -0.20 0.00 0.00 57.97 57.97 3h3d h PHE 474 Cb 0.00 -0.05 -0.01 0.00 0.22 0.00 0.00 35.95 36.11 3h3d h PHE 474 CO -0.00 0.47 -0.04 0.82 -2.00 0.00 0.00 178.31 177.56 3h3d h ILE 475 N 0.17 1.27 -0.62 0.88 2.04 -1.78 -2.48 117.51 116.99 3h3d h ILE 475 Ca 0.02 -1.03 0.12 0.00 1.00 0.00 0.00 64.86 64.97 3h3d h ILE 475 Cb 0.62 1.37 -0.09 0.00 -0.74 0.00 0.00 36.82 37.98 3h3d h ILE 475 CO 0.05 0.33 0.14 0.40 0.00 0.00 0.00 178.15 179.06 3h3d h ILE 476 N 0.31 0.63 -0.38 -0.67 5.03 -1.35 -2.23 117.51 118.84 3h3d h ILE 476 Ca 0.08 -0.09 -0.07 0.00 -0.12 0.00 0.00 64.86 64.65 3h3d h ILE 476 Cb 0.50 0.34 -0.02 0.00 -3.03 0.00 0.00 36.82 34.61 3h3d h ILE 476 CO 0.02 0.05 -0.07 0.78 -0.68 0.00 0.00 178.15 178.25 3h3d h ASN 477 N 0.27 0.62 0.74 1.72 2.35 -1.36 -2.40 115.58 117.53 3h3d h ASN 477 Ca 0.33 -0.16 -0.12 0.00 -0.55 0.00 0.00 56.30 55.80 3h3d h ASN 477 Cb 0.49 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 3h3d h ASN 477 CO -0.41 0.74 -0.55 0.00 -1.65 0.00 0.00 177.43 175.56 3h3d h ALA 478 N 1.33 0.94 0.00 -0.83 0.00 -0.97 -2.98 119.26 116.75 3h3d h ALA 478 Ca 0.11 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.52 3h3d h ALA 478 Cb 0.48 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3h3d h ALA 478 CO 0.03 0.69 -0.02 0.74 0.00 0.00 0.00 179.25 180.69 3h3d h PHE 479 N 0.00 0.00 -1.94 0.00 0.05 -0.93 -3.44 116.94 110.68 3h3d h PHE 479 Ca -0.01 0.00 -0.64 0.00 3.82 0.00 0.00 57.97 61.14 3h3d h PHE 479 Cb 1.07 0.00 0.02 0.00 2.00 0.00 0.00 35.95 39.04 3h3d h PHE 479 CO 0.00 0.02 1.03 1.63 -0.18 0.00 0.00 178.31 180.80 3h3d n LYS 480 N -3.11 1.95 -0.95 1.51 5.02 -1.00 -0.31 118.16 121.27 3h3d n LYS 480 Ca 0.02 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 57.03 3h3d n LYS 480 Cb 0.43 -2.52 0.00 0.00 -0.02 0.00 0.00 35.03 32.92 3h3d n LYS 480 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3h3d n GLY 481 N 4.26 0.56 0.00 0.72 0.00 -1.26 -4.85 105.19 104.62 3h3d n GLY 481 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3h3d n GLY 481 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h3d n GLN 482 N -2.07 -0.02 -0.15 1.61 1.13 0.58 -4.86 117.38 113.60 3h3d n GLN 482 Ca 0.00 -0.72 -0.11 0.00 -1.94 0.00 0.00 57.00 54.22 3h3d n GLN 482 Cb 0.06 -0.98 0.00 0.00 0.11 0.00 0.00 30.24 29.43 3h3d n GLN 482 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 3h3d h VAL 483 N 0.05 1.27 -0.13 5.09 2.07 -1.85 -1.22 116.25 121.53 3h3d h VAL 483 Ca 0.00 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.09 3h3d h VAL 483 Cb 0.14 1.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 3h3d h VAL 483 CO 0.00 0.49 0.03 0.22 0.02 0.00 0.00 177.57 178.32 3h3d h TYR 484 N 0.84 0.22 -0.50 1.57 3.20 -1.89 0.73 116.97 121.14 3h3d h TYR 484 Ca 0.10 -0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.00 3h3d h TYR 484 Cb 0.83 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.98 3h3d h TYR 484 CO 0.05 0.38 0.22 1.03 -1.64 0.00 0.00 178.16 178.20 3h3d h SER 485 N -0.00 0.27 -0.12 -2.11 0.87 -1.89 -0.70 113.55 109.88 3h3d h SER 485 Ca 0.04 0.04 -0.21 0.00 -1.23 0.00 0.00 61.79 60.44 3h3d h SER 485 Cb 0.27 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.24 3h3d h SER 485 CO 0.00 0.19 -0.71 -0.07 -0.53 0.00 0.00 176.83 175.71 3h3d h LEU 486 N 0.42 0.88 -1.92 2.23 3.38 -1.15 -3.19 115.31 115.96 3h3d h LEU 486 Ca 0.23 -0.55 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 3h3d h LEU 486 Cb 0.20 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 3h3d h LEU 486 CO -0.20 1.34 -0.07 0.28 0.09 0.00 0.00 178.44 179.87 3h3d h SER 487 N 0.53 0.00 -0.68 -0.43 0.02 0.82 0.85 113.55 114.66 3h3d h SER 487 Ca -0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 3h3d h SER 487 Cb 1.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.86 3h3d h SER 487 CO 0.14 0.07 0.00 0.35 -1.14 0.00 0.00 176.83 176.26 3h3d n THR 488 N -3.34 1.37 -4.60 -2.27 -2.24 -0.30 -2.67 114.28 100.23 3h3d n THR 488 Ca -0.01 -1.05 -0.34 0.00 -2.27 0.00 0.00 64.05 60.37 3h3d n THR 488 Cb 0.24 0.30 -0.11 0.00 -2.10 0.00 0.00 70.33 68.66 3h3d n THR 488 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 3h3d s HIS 489 N -1.44 2.96 0.48 4.78 5.04 -1.05 -4.74 115.29 121.32 3h3d s HIS 489 Ca 0.49 0.04 0.14 0.00 -1.54 0.00 0.00 55.06 54.19 3h3d s HIS 489 Cb 0.29 -1.72 1.12 0.00 0.04 0.00 0.00 32.58 32.31 3h3d s HIS 489 CO 0.29 0.35 2.09 -1.00 -2.34 0.00 0.00 174.74 174.12 3h3d h PRO 490 N 5.23 0.10 0.02 2.88 0.13 -1.92 -2.72 132.00 135.73 3h3d h PRO 490 Ca -0.49 -0.01 -0.37 0.00 -0.87 0.00 0.00 66.00 64.26 3h3d h PRO 490 Cb 1.17 -0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.23 3h3d h PRO 490 CO 0.52 0.12 -2.11 0.66 -0.23 0.00 0.00 178.00 176.97 3h3d n TYR 491 N -4.47 0.47 -0.23 1.56 0.53 -1.26 -4.55 117.16 109.21 3h3d n TYR 491 Ca -0.02 0.16 0.00 0.00 -1.02 0.00 0.00 57.90 57.03 3h3d n TYR 491 Cb 0.13 -1.05 0.24 0.00 -1.03 0.00 0.00 39.34 37.62 3h3d n TYR 491 CO 0.00 0.00 0.00 0.78 -1.02 0.00 0.00 176.86 176.62 3h3d h GLY 492 N -0.08 1.09 0.27 2.72 0.00 -1.59 -2.61 103.07 102.87 3h3d h GLY 492 Ca -0.54 -0.41 0.18 0.00 0.00 0.00 0.00 47.33 46.56 3h3d h GLY 492 CO -0.22 0.40 0.61 0.00 0.00 0.00 0.00 176.54 177.32 3h3d h ARG 494 N 0.71 0.74 -0.28 0.00 3.08 -1.71 -1.03 114.38 115.90 3h3d h ARG 494 Ca 0.53 -0.44 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 3h3d h ARG 494 Cb 0.88 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.95 3h3d h ARG 494 CO -0.29 1.06 0.10 0.28 -1.07 0.00 0.00 179.97 180.05 3h3d h VAL 495 N 0.59 1.19 -0.28 2.04 2.07 -1.45 -2.35 116.25 118.06 3h3d h VAL 495 Ca 0.03 -0.58 0.06 0.00 0.82 0.00 0.00 66.70 67.03 3h3d h VAL 495 Cb 1.05 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.81 3h3d h VAL 495 CO 0.10 0.19 -0.12 0.40 0.02 0.00 0.00 177.57 178.16 3h3d h ILE 496 N 0.30 0.60 -0.54 4.57 1.08 -1.37 -0.28 117.51 121.86 3h3d h ILE 496 Ca 0.09 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.59 3h3d h ILE 496 Cb 0.20 0.60 -0.03 0.00 -3.07 0.00 0.00 36.82 34.53 3h3d h ILE 496 CO -0.01 0.00 0.36 1.56 -0.69 0.00 0.00 178.15 179.37 3h3d h GLN 497 N -0.08 0.61 -0.10 2.37 4.20 -1.18 -2.87 115.11 118.06 3h3d h GLN 497 Ca 0.14 -0.04 -0.07 0.00 0.06 0.00 0.00 58.65 58.75 3h3d h GLN 497 Cb 0.30 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.94 3h3d h GLN 497 CO -0.33 0.41 -0.21 0.00 -0.67 0.00 0.00 178.83 178.02 3h3d h ARG 498 N 0.63 0.32 -7.21 1.46 2.47 -0.82 -2.75 114.38 108.48 3h3d h ARG 498 Ca 0.22 -0.21 -0.53 0.00 -1.26 0.00 0.00 59.98 58.20 3h3d h ARG 498 Cb 0.08 0.03 0.16 0.00 -1.65 0.00 0.00 29.97 28.59 3h3d h ARG 498 CO -0.06 0.81 0.36 0.42 0.56 0.00 0.00 179.97 182.06 3h3d s ILE 499 N -3.96 2.43 0.00 2.04 1.01 -0.18 -2.55 121.20 119.99 3h3d s ILE 499 Ca -0.14 0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.70 3h3d s ILE 499 Cb 0.04 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.86 3h3d s ILE 499 CO 0.76 -0.13 0.00 0.18 0.00 0.00 0.00 174.94 175.75 3h3d n LEU 500 N -3.02 0.00 0.13 2.97 4.77 -1.26 -4.55 117.00 116.04 3h3d n LEU 500 Ca 0.13 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.23 3h3d n LEU 500 Cb 0.51 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.80 3h3d n LEU 500 CO 0.48 0.00 0.57 -0.08 -1.33 0.00 0.00 177.39 177.04 3h3d h GLU 501 N 0.00 0.00 0.00 3.23 4.81 -1.34 -3.40 114.58 117.87 3h3d h GLU 501 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3h3d h GLU 501 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3h3d h GLU 501 CO 0.00 0.00 -0.68 0.72 -0.73 0.00 0.00 179.01 178.32 3h3d n HIS 502 N -2.56 0.00 -2.88 0.92 8.25 -1.05 -5.00 115.22 112.90 3h3d n HIS 502 Ca 0.03 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.18 3h3d n HIS 502 Cb 0.48 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.55 3h3d n HIS 502 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h3d s THR 504 N -2.24 3.11 0.22 0.00 -4.23 -1.26 -4.37 115.64 106.88 3h3d s THR 504 Ca 0.56 0.36 0.24 0.00 -1.18 0.00 0.00 61.69 61.66 3h3d s THR 504 Cb -0.10 -2.82 0.23 0.00 1.34 0.00 0.00 72.50 71.15 3h3d s THR 504 CO 0.23 -0.47 1.88 0.00 -0.54 0.00 0.00 174.62 175.72 3h3d h ALA 505 N -1.27 1.09 -0.51 3.99 0.00 -1.96 -0.56 119.26 120.06 3h3d h ALA 505 Ca -0.45 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.14 3h3d h ALA 505 Cb 1.24 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3h3d h ALA 505 CO 0.51 0.28 -0.14 1.49 0.00 0.00 0.00 179.25 181.40 3h3d h GLU 506 N 0.00 0.99 0.00 0.00 4.57 -2.01 -2.81 114.58 115.31 3h3d h GLU 506 Ca -0.00 -0.38 -0.14 0.00 -1.18 0.00 0.00 59.36 57.66 3h3d h GLU 506 Cb 0.66 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 3h3d h GLU 506 CO 0.03 1.06 -0.65 1.96 -1.18 0.00 0.00 179.01 180.23 3h3d h GLN 507 N 0.85 0.00 -0.09 1.92 4.20 -1.64 -3.20 115.11 117.15 3h3d h GLN 507 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 3h3d h GLN 507 Cb 0.70 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.48 3h3d h GLN 507 CO 0.05 0.65 0.00 2.41 -0.67 0.00 0.00 178.83 181.27 3h3d n THR 508 N -3.35 0.10 -0.16 -0.54 -1.04 -0.32 -4.38 114.28 104.59 3h3d n THR 508 Ca 0.01 -0.25 -0.03 0.00 -2.04 0.00 0.00 64.05 61.74 3h3d n THR 508 Cb 0.76 0.27 0.06 0.00 -1.82 0.00 0.00 70.33 69.60 3h3d n THR 508 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 3h3d h THR 509 N 1.84 0.83 -0.53 12.58 2.02 -1.49 -1.40 112.91 126.76 3h3d h THR 509 Ca 0.00 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.05 3h3d h THR 509 Cb 0.40 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 3h3d h THR 509 CO 0.00 0.06 0.29 -0.65 0.37 0.00 0.00 175.52 175.59 3h3d h PRO 510 N 0.35 0.72 0.78 6.66 0.11 -1.86 -0.53 132.00 138.24 3h3d h PRO 510 Ca 0.24 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.24 3h3d h PRO 510 Cb 0.25 -0.15 0.01 0.00 0.11 0.00 0.00 31.00 31.22 3h3d h PRO 510 CO -0.24 0.53 -0.38 0.82 -0.21 0.00 0.00 178.00 178.53 3h3d h ILE 511 N 0.73 0.19 -1.02 4.15 2.04 -1.73 -2.89 117.51 118.98 3h3d h ILE 511 Ca 0.19 -0.08 0.28 0.00 1.00 0.00 0.00 64.86 66.24 3h3d h ILE 511 Cb 0.02 0.20 -0.13 0.00 -0.74 0.00 0.00 36.82 36.17 3h3d h ILE 511 CO -0.03 0.01 0.60 -0.07 0.00 0.00 0.00 178.15 178.66 3h3d h LEU 512 N -1.12 0.59 -0.28 1.44 -0.00 -1.25 0.22 115.31 114.92 3h3d h LEU 512 Ca -0.11 0.15 0.01 0.00 -0.00 0.00 0.00 57.88 57.93 3h3d h LEU 512 Cb 0.82 0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 41.53 3h3d h LEU 512 CO 0.18 0.02 0.17 0.44 -0.00 0.00 0.00 178.44 179.24 3h3d h ASP 513 N 0.47 0.28 0.83 -0.43 3.32 -1.11 0.10 116.42 119.88 3h3d h ASP 513 Ca 0.67 -0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.52 3h3d h ASP 513 Cb 1.43 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.90 3h3d h ASP 513 CO -0.50 0.20 -0.94 -0.33 -1.72 0.00 0.00 179.24 175.95 3h3d h GLU 514 N 0.35 0.06 -0.60 3.56 5.08 -1.16 -2.61 114.58 119.26 3h3d h GLU 514 Ca 0.11 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3h3d h GLU 514 Cb -0.02 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 3h3d h GLU 514 CO -0.04 0.95 0.35 -0.07 -1.00 0.00 0.00 179.01 179.20 3h3d h LEU 515 N 0.03 0.74 -0.45 1.33 3.38 -0.40 -2.99 115.31 116.94 3h3d h LEU 515 Ca -0.03 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3h3d h LEU 515 Cb 1.63 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 3h3d h LEU 515 CO 0.13 0.60 0.23 0.45 0.09 0.00 0.00 178.44 179.94 3h3d h HIS 516 N 0.81 0.63 -0.66 1.13 3.86 -0.90 -2.14 115.15 117.88 3h3d h HIS 516 Ca 0.21 -0.02 0.19 0.00 -1.16 0.00 0.00 60.37 59.59 3h3d h HIS 516 Cb 0.01 -0.20 -0.03 0.00 1.06 0.00 0.00 27.41 28.26 3h3d h HIS 516 CO -0.02 0.50 0.53 1.49 0.86 0.00 0.00 177.93 181.29 3h3d h GLU 517 N 0.58 0.00 0.00 2.45 4.57 -1.32 -3.15 114.58 117.71 3h3d h GLU 517 Ca 0.16 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.34 3h3d h GLU 517 Cb 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 3h3d h GLU 517 CO -0.02 0.00 -0.04 0.72 -1.18 0.00 0.00 179.01 178.49 3h3d n HIS 518 N -4.12 0.00 -0.32 0.92 8.25 -1.14 -4.86 115.22 113.96 3h3d n HIS 518 Ca 0.13 -0.41 0.04 0.00 -0.26 0.00 0.00 57.72 57.22 3h3d n HIS 518 Cb 0.78 -0.05 0.11 0.00 1.12 0.00 0.00 29.99 31.94 3h3d n HIS 518 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3h3d n THR 519 N -0.48 -0.38 -0.04 1.59 -1.04 -0.82 -0.50 114.28 112.61 3h3d n THR 519 Ca 0.03 2.00 -0.11 0.00 -2.04 0.00 0.00 64.05 63.93 3h3d n THR 519 Cb 0.41 -2.75 -0.04 0.00 -1.82 0.00 0.00 70.33 66.13 3h3d n THR 519 CO 0.00 0.00 0.00 -0.33 -0.64 0.00 0.00 175.07 174.10 3h3d h GLU 520 N 0.00 0.23 -0.29 -2.82 5.08 -1.89 0.29 114.58 115.18 3h3d h GLU 520 Ca 0.40 -0.02 -0.11 0.00 -1.00 0.00 0.00 59.36 58.62 3h3d h GLU 520 Cb 0.62 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 3h3d h GLU 520 CO -0.89 0.22 -0.28 1.96 -1.00 0.00 0.00 179.01 179.01 3h3d h GLN 521 N 0.18 0.60 0.05 2.33 4.20 -1.64 -3.23 115.11 117.60 3h3d h GLN 521 Ca 0.06 -0.25 -0.24 0.00 0.06 0.00 0.00 58.65 58.28 3h3d h GLN 521 Cb 0.05 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 3h3d h GLN 521 CO -0.01 0.82 -1.05 -0.07 -0.67 0.00 0.00 178.83 177.84 3h3d h LEU 522 N 0.52 0.40 -2.03 1.46 3.38 -0.31 -2.69 115.31 116.04 3h3d h LEU 522 Ca 0.07 -0.37 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 3h3d h LEU 522 Cb 0.75 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 3h3d h LEU 522 CO 0.06 1.22 -0.09 0.16 0.09 0.00 0.00 178.44 179.88 3h3d h ILE 523 N 0.13 0.64 -0.00 1.22 3.07 -0.46 -0.50 117.51 121.61 3h3d h ILE 523 Ca -0.09 -0.39 0.00 0.00 1.55 0.00 0.00 64.86 65.93 3h3d h ILE 523 Cb 1.73 1.24 0.00 0.00 -0.27 0.00 0.00 36.82 39.53 3h3d h ILE 523 CO 0.17 0.09 -0.31 0.00 -1.05 0.00 0.00 178.15 177.06 3h3d n GLN 524 N -3.81 0.35 -3.05 0.16 6.02 -1.19 -2.71 117.38 113.15 3h3d n GLN 524 Ca -0.02 -0.17 -0.39 0.00 -0.01 0.00 0.00 57.00 56.41 3h3d n GLN 524 Cb 0.19 -1.50 -0.06 0.00 1.02 0.00 0.00 30.24 29.90 3h3d n GLN 524 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3h3d s ASP 525 N -2.77 7.28 0.27 1.08 2.15 -0.72 -4.78 116.67 119.17 3h3d s ASP 525 Ca 0.18 1.54 -0.04 0.00 0.43 0.00 0.00 52.55 54.67 3h3d s ASP 525 Cb 0.19 -2.46 0.54 0.00 -0.30 0.00 0.00 42.92 40.89 3h3d s ASP 525 CO 0.59 0.19 1.62 -0.61 -0.17 0.00 0.00 175.17 176.80 3h3d h GLN 526 N 4.21 0.10 0.05 4.34 4.15 -1.92 -2.14 115.11 123.90 3h3d h GLN 526 Ca -0.48 -0.01 -0.34 0.00 0.77 0.00 0.00 58.65 58.60 3h3d h GLN 526 Cb 1.21 -0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.83 3h3d h GLN 526 CO 0.65 0.07 -1.99 0.66 -1.93 0.00 0.00 178.83 176.29 3h3d n TYR 527 N -5.36 0.87 0.18 3.99 4.02 -1.26 -4.56 117.16 115.04 3h3d n TYR 527 Ca 0.17 0.24 0.05 0.00 -0.01 0.00 0.00 57.90 58.35 3h3d n TYR 527 Cb 0.56 -1.13 0.29 0.00 -0.02 0.00 0.00 39.34 39.03 3h3d n TYR 527 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3h3d h GLY 528 N 2.45 0.00 1.30 2.72 0.00 -1.45 -1.75 103.07 106.33 3h3d h GLY 528 Ca -0.40 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.00 3h3d h GLY 528 CO 0.06 0.00 0.29 3.45 0.00 0.00 0.00 176.54 180.34 3h3d h ASN 529 N 0.00 0.20 0.66 0.19 7.08 -0.42 0.13 115.58 123.42 3h3d h ASN 529 Ca -0.00 0.00 -0.14 0.00 -3.08 0.00 0.00 56.30 53.08 3h3d h ASN 529 Cb 0.98 -0.04 -0.02 0.00 -2.08 0.00 0.00 38.32 37.16 3h3d h ASN 529 CO 0.05 0.13 -0.66 1.88 -2.08 0.00 0.00 177.43 176.75 3h3d h TYR 530 N 0.23 0.00 -0.29 4.14 -1.99 -1.58 -0.48 116.97 117.00 3h3d h TYR 530 Ca 0.19 0.00 -0.11 0.00 2.00 0.00 0.00 58.73 60.82 3h3d h TYR 530 Cb 0.46 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.19 3h3d h TYR 530 CO -0.00 0.66 -0.23 0.28 -0.00 0.00 0.00 178.16 178.86 3h3d h VAL 531 N 0.00 1.30 -0.69 -2.88 2.07 -1.03 -2.33 116.25 112.69 3h3d h VAL 531 Ca -0.01 -1.38 0.06 0.00 0.82 0.00 0.00 66.70 66.19 3h3d h VAL 531 Cb 1.17 1.55 -0.06 0.00 -1.52 0.00 0.00 31.29 32.43 3h3d h VAL 531 CO 0.09 0.44 0.39 0.40 0.02 0.00 0.00 177.57 178.91 3h3d h ILE 532 N 0.42 0.98 -0.27 4.57 1.08 -1.21 -2.24 117.51 120.84 3h3d h ILE 532 Ca 0.05 -0.25 -0.05 0.00 -0.39 0.00 0.00 64.86 64.22 3h3d h ILE 532 Cb 0.79 0.19 -0.02 0.00 -3.07 0.00 0.00 36.82 34.71 3h3d h ILE 532 CO 0.06 0.13 -0.06 1.56 -0.69 0.00 0.00 178.15 179.15 3h3d h GLN 533 N 0.73 0.43 -0.08 2.37 4.20 -0.98 -0.93 115.11 120.84 3h3d h GLN 533 Ca 0.31 -0.10 -0.00 0.00 0.06 0.00 0.00 58.65 58.92 3h3d h GLN 533 Cb 0.18 -0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.90 3h3d h GLN 533 CO -0.18 0.51 0.05 1.25 -0.67 0.00 0.00 178.83 179.79 3h3d h HIS 534 N 0.41 0.11 -0.37 2.96 2.76 -1.04 -0.77 115.15 119.22 3h3d h HIS 534 Ca 0.09 -0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.25 3h3d h HIS 534 Cb 0.37 -0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.28 3h3d h HIS 534 CO 0.01 0.13 0.20 0.28 -1.30 0.00 0.00 177.93 177.25 3h3d h VAL 535 N 0.07 1.11 -0.53 5.26 2.07 -0.78 -1.57 116.25 121.88 3h3d h VAL 535 Ca 0.03 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 3h3d h VAL 535 Cb 0.05 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 3h3d h VAL 535 CO -0.01 0.12 0.17 -0.07 0.02 0.00 0.00 177.57 177.81 3h3d h LEU 536 N 0.50 0.76 0.00 2.57 3.38 -0.66 0.22 115.31 122.09 3h3d h LEU 536 Ca 0.13 -0.20 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 3h3d h LEU 536 Cb 0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.54 3h3d h LEU 536 CO -0.02 0.76 -0.70 -0.33 0.09 0.00 0.00 178.44 178.24 3h3d h GLU 537 N 0.72 0.00 0.00 1.13 5.08 -0.88 -3.40 114.58 117.24 3h3d h GLU 537 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3h3d h GLU 537 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3h3d h GLU 537 CO -0.01 0.54 0.00 0.72 -1.00 0.00 0.00 179.01 179.26 3h3d n HIS 538 N -3.19 0.00 -2.17 4.33 8.25 -0.62 -5.10 115.22 116.73 3h3d n HIS 538 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.22 3h3d n HIS 538 Cb 0.78 0.00 0.15 0.00 1.12 0.00 0.00 29.99 32.04 3h3d n HIS 538 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3h3d n GLY 539 N 0.16 -0.51 3.77 -1.41 0.00 0.77 -4.99 105.19 102.99 3h3d n GLY 539 Ca 0.00 -1.85 -0.36 0.00 0.00 0.00 0.00 46.02 43.81 3h3d n GLY 539 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3h3d s LYS 540 N -5.27 3.63 0.41 1.61 -0.14 -1.26 -4.88 119.74 113.84 3h3d s LYS 540 Ca 0.64 1.71 0.09 0.00 -1.36 0.00 0.00 55.97 57.05 3h3d s LYS 540 Cb -0.03 -2.27 0.90 0.00 -1.68 0.00 0.00 37.83 34.75 3h3d s LYS 540 CO 0.44 -0.65 2.03 0.37 -0.76 0.00 0.00 175.35 176.78 3h3d h GLN 541 N 1.76 0.52 -0.60 1.68 4.15 -1.97 -0.14 115.11 120.51 3h3d h GLN 541 Ca -0.50 -0.03 -0.09 0.00 0.77 0.00 0.00 58.65 58.80 3h3d h GLN 541 Cb 1.25 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 28.80 3h3d h GLN 541 CO 0.59 0.34 0.01 1.49 -1.93 0.00 0.00 178.83 179.33 3h3d h GLU 542 N 0.53 1.05 -0.24 1.69 4.81 -1.99 0.16 114.58 120.59 3h3d h GLU 542 Ca 0.20 -0.32 -0.11 0.00 -0.13 0.00 0.00 59.36 59.00 3h3d h GLU 542 Cb 0.13 -0.10 -0.00 0.00 0.63 0.00 0.00 28.75 29.41 3h3d h GLU 542 CO -0.05 1.02 -0.26 -0.44 -0.73 0.00 0.00 179.01 178.55 3h3d h ASP 543 N 0.96 0.65 -0.81 1.04 3.32 -1.82 -2.49 116.42 117.27 3h3d h ASP 543 Ca 0.17 -0.48 0.08 0.00 0.02 0.00 0.00 57.03 56.82 3h3d h ASP 543 Cb 0.54 -0.18 -0.05 0.00 0.22 0.00 0.00 39.33 39.86 3h3d h ASP 543 CO 0.03 1.00 0.53 0.11 -1.72 0.00 0.00 179.24 179.19 3h3d h LYS 544 N 0.31 0.80 0.02 3.56 1.57 -0.76 -1.29 116.57 120.78 3h3d h LYS 544 Ca 0.04 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3h3d h LYS 544 Cb 0.82 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.95 3h3d h LYS 544 CO 0.06 0.53 -0.01 0.77 -0.57 0.00 0.00 179.45 180.23 3h3d h SER 545 N 0.82 -0.03 -1.00 0.86 0.02 -1.01 -0.02 113.55 113.20 3h3d h SER 545 Ca 0.36 -0.52 0.22 0.00 -0.84 0.00 0.00 61.79 61.01 3h3d h SER 545 Cb 0.34 0.01 -0.12 0.00 0.14 0.00 0.00 62.40 62.77 3h3d h SER 545 CO -0.14 0.52 0.60 0.40 -1.14 0.00 0.00 176.83 177.07 3h3d h ILE 546 N -0.59 0.62 -0.02 3.27 2.04 -1.41 -0.93 117.51 120.48 3h3d h ILE 546 Ca -0.00 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 3h3d h ILE 546 Cb 0.55 -0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.52 3h3d h ILE 546 CO 0.01 0.12 -0.02 -0.07 0.00 0.00 0.00 178.15 178.18 3h3d h LEU 547 N 0.67 0.06 -0.27 1.44 3.38 -0.94 -3.11 115.31 116.54 3h3d h LEU 547 Ca 0.61 -0.48 0.06 0.00 0.09 0.00 0.00 57.88 58.17 3h3d h LEU 547 Cb 1.06 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 41.72 3h3d h LEU 547 CO -0.43 0.53 -0.18 0.40 0.09 0.00 0.00 178.44 178.84 3h3d h ILE 548 N -0.40 0.49 -0.56 1.22 2.04 -0.78 -2.19 117.51 117.32 3h3d h ILE 548 Ca 0.00 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.03 3h3d h ILE 548 Cb 0.51 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 3h3d h ILE 548 CO 0.01 0.00 0.58 0.78 0.00 0.00 0.00 178.15 179.51 3h3d h ASN 549 N -0.16 0.00 1.45 1.72 2.35 -1.20 -0.13 115.58 119.60 3h3d h ASN 549 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3h3d h ASN 549 Cb 0.39 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.76 3h3d h ASN 549 CO -0.37 0.00 -0.03 -1.54 -1.65 0.00 0.00 177.43 173.84 3h3d n SER 550 N -3.72 0.81 -0.07 5.81 3.41 -0.83 -3.83 113.62 115.20 3h3d n SER 550 Ca 0.11 0.56 -0.18 0.00 -0.26 0.00 0.00 58.87 59.09 3h3d n SER 550 Cb 0.79 -0.75 -0.12 0.00 -0.26 0.00 0.00 64.21 63.86 3h3d n SER 550 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3h3d h VAL 551 N 0.00 1.35 0.00 -3.33 2.07 -1.03 -3.46 116.25 111.84 3h3d h VAL 551 Ca 0.00 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.23 3h3d h VAL 551 Cb 0.74 2.83 0.00 0.00 -1.52 0.00 0.00 31.29 33.34 3h3d h VAL 551 CO 0.00 0.49 0.00 0.54 0.02 0.00 0.00 177.57 178.62 3h3d n ARG 552 N -4.46 0.00 -1.08 1.57 5.12 -1.12 0.15 116.66 116.84 3h3d n ARG 552 Ca -0.21 0.00 -0.20 0.00 -1.93 0.00 0.00 57.85 55.52 3h3d n ARG 552 Cb 0.61 0.00 0.17 0.00 -1.16 0.00 0.00 32.46 32.09 3h3d n ARG 552 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3h3d n GLY 553 N 0.00 4.14 0.10 -0.13 0.00 -1.26 -4.14 105.19 103.89 3h3d n GLY 553 Ca 0.00 -0.96 0.01 0.00 0.00 0.00 0.00 46.02 45.07 3h3d n GLY 553 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h3d n LYS 554 N -0.87 -0.64 -0.28 1.61 5.02 0.12 -4.81 118.16 118.31 3h3d n LYS 554 Ca 0.52 -0.65 0.07 0.00 -2.02 0.00 0.00 58.31 56.23 3h3d n LYS 554 Cb 1.52 -1.05 0.22 0.00 -0.02 0.00 0.00 35.03 35.71 3h3d n LYS 554 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3h3d h VAL 555 N 0.49 0.62 -0.28 -0.18 2.07 -1.69 0.39 116.25 117.66 3h3d h VAL 555 Ca 0.00 -0.16 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 3h3d h VAL 555 Cb 0.10 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 29.99 3h3d h VAL 555 CO 0.00 0.08 -0.06 0.25 0.02 0.00 0.00 177.57 177.86 3h3d h LEU 556 N 0.46 0.54 -0.62 2.57 5.85 -1.93 -0.19 115.31 121.99 3h3d h LEU 556 Ca 0.46 -0.36 -0.11 0.00 0.84 0.00 0.00 57.88 58.71 3h3d h LEU 556 Cb 0.74 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 3h3d h LEU 556 CO -0.43 0.78 -0.53 0.58 -0.34 0.00 0.00 178.44 178.49 3h3d h VAL 557 N 0.31 1.11 0.22 1.05 2.07 -1.82 -3.32 116.25 115.87 3h3d h VAL 557 Ca 0.07 -2.01 -0.33 0.00 0.82 0.00 0.00 66.70 65.25 3h3d h VAL 557 Cb 0.53 2.18 0.03 0.00 -1.52 0.00 0.00 31.29 32.51 3h3d h VAL 557 CO 0.03 0.52 -1.50 -0.07 0.02 0.00 0.00 177.57 176.56 3h3d h LEU 558 N 0.00 0.74 -1.98 2.57 3.38 -0.90 -3.27 115.31 115.85 3h3d h LEU 558 Ca -0.01 -0.93 0.00 0.00 0.09 0.00 0.00 57.88 57.04 3h3d h LEU 558 Cb 1.13 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.64 3h3d h LEU 558 CO 0.07 1.71 0.22 0.28 0.09 0.00 0.00 178.44 180.81 3h3d h SER 559 N 0.07 0.00 -0.73 -0.43 0.02 -1.12 -0.33 113.55 111.03 3h3d h SER 559 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 3h3d h SER 559 Cb 2.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.63 3h3d h SER 559 CO 0.23 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.92 3h3d n GLN 560 N -2.73 2.70 -3.37 3.45 6.02 -1.23 -1.77 117.38 120.44 3h3d n GLN 560 Ca -0.02 -2.64 -0.38 0.00 -0.01 0.00 0.00 57.00 53.95 3h3d n GLN 560 Cb 0.27 -1.57 -0.06 0.00 1.02 0.00 0.00 30.24 29.90 3h3d n GLN 560 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 3h3d s HIS 561 N -1.03 3.63 0.20 1.08 2.46 -0.14 -4.95 115.29 116.55 3h3d s HIS 561 Ca 0.49 0.98 -0.23 0.00 0.47 0.00 0.00 55.06 56.77 3h3d s HIS 561 Cb 0.26 -2.45 0.11 0.00 -0.13 0.00 0.00 32.58 30.37 3h3d s HIS 561 CO 0.34 0.40 1.55 -0.22 -2.47 0.00 0.00 174.74 174.33 3h3d h LYS 562 N 5.68 -0.00 -5.25 2.88 3.64 -1.89 -3.00 116.57 118.63 3h3d h LYS 562 Ca -0.46 0.00 -0.63 0.00 -1.27 0.00 0.00 60.65 58.29 3h3d h LYS 562 Cb 1.20 0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 32.83 3h3d h LYS 562 CO 0.69 -0.00 -0.60 -0.06 -2.27 0.00 0.00 179.45 177.20 3h3d s PHE 563 N -5.76 3.16 0.00 1.91 0.40 -1.26 -4.36 117.98 112.06 3h3d s PHE 563 Ca -0.13 -0.10 0.00 0.00 -0.60 0.00 0.00 56.93 56.10 3h3d s PHE 563 Cb 0.16 -2.06 0.00 0.00 0.51 0.00 0.00 43.02 41.64 3h3d s PHE 563 CO 0.68 0.04 0.00 0.00 0.70 0.00 0.00 175.22 176.63 3h3d n ALA 564 N 3.69 0.00 -0.34 5.36 0.00 -1.10 -4.26 120.51 123.86 3h3d n ALA 564 Ca -0.17 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.39 3h3d n ALA 564 Cb 0.52 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.30 3h3d n ALA 564 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3h3d h SER 565 N 0.00 0.78 -0.78 0.00 4.64 -1.46 0.51 113.55 117.24 3h3d h SER 565 Ca 0.00 0.07 0.05 0.00 -0.47 0.00 0.00 61.79 61.44 3h3d h SER 565 Cb 0.00 -0.07 -0.05 0.00 -0.31 0.00 0.00 62.40 61.97 3h3d h SER 565 CO 0.00 0.32 0.51 0.78 -0.87 0.00 0.00 176.83 177.58 3h3d h ASN 566 N 0.78 0.79 0.03 4.97 2.35 -1.83 -1.52 115.58 121.16 3h3d h ASN 566 Ca 0.54 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 56.28 3h3d h ASN 566 Cb 0.81 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 39.01 3h3d h ASN 566 CO -0.32 0.53 -0.02 0.58 -1.65 0.00 0.00 177.43 176.56 3h3d h VAL 567 N 0.92 1.34 -0.59 2.81 2.07 -1.37 -2.97 116.25 118.46 3h3d h VAL 567 Ca 0.32 -1.74 0.12 0.00 0.82 0.00 0.00 66.70 66.21 3h3d h VAL 567 Cb 0.12 2.42 -0.11 0.00 -1.52 0.00 0.00 31.29 32.19 3h3d h VAL 567 CO -0.10 0.41 -0.20 0.58 0.02 0.00 0.00 177.57 178.28 3h3d h VAL 568 N -0.88 0.33 -0.81 2.57 2.07 -0.10 0.21 116.25 119.64 3h3d h VAL 568 Ca -0.00 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.70 3h3d h VAL 568 Cb 0.71 0.33 -0.11 0.00 -1.52 0.00 0.00 31.29 30.69 3h3d h VAL 568 CO 0.01 0.00 0.28 -0.33 0.02 0.00 0.00 177.57 177.55 3h3d h GLU 569 N -0.06 0.34 -0.01 1.57 5.08 -1.31 -1.61 114.58 118.59 3h3d h GLU 569 Ca 0.27 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.36 3h3d h GLU 569 Cb 0.48 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.67 3h3d h GLU 569 CO -0.63 0.23 -1.00 0.87 -1.00 0.00 0.00 179.01 177.47 3h3d h LYS 570 N 0.35 0.61 -0.33 2.33 1.79 -0.75 -2.52 116.57 118.06 3h3d h LYS 570 Ca 0.47 -0.65 0.06 0.00 -2.18 0.00 0.00 60.65 58.35 3h3d h LYS 570 Cb 0.83 0.18 -0.08 0.00 -1.58 0.00 0.00 32.23 31.58 3h3d h LYS 570 CO -0.50 1.25 -0.42 0.00 -1.08 0.00 0.00 179.45 178.70 3h3d h VAL 572 N -0.36 0.89 0.22 0.00 2.07 -1.24 0.53 116.25 118.35 3h3d h VAL 572 Ca 0.12 -0.26 -0.32 0.00 0.82 0.00 0.00 66.70 67.06 3h3d h VAL 572 Cb 0.59 0.06 0.03 0.00 -1.52 0.00 0.00 31.29 30.45 3h3d h VAL 572 CO -0.52 0.14 -1.46 0.74 0.02 0.00 0.00 177.57 176.49 3h3d h THR 573 N 0.76 1.30 -0.01 2.57 2.02 -0.93 -3.37 112.91 115.25 3h3d h THR 573 Ca 0.43 -2.77 0.00 0.00 0.77 0.00 0.00 66.41 64.84 3h3d h THR 573 Cb 0.59 2.99 0.00 0.00 -1.74 0.00 0.00 68.15 69.99 3h3d h THR 573 CO -0.19 0.83 -0.53 1.41 0.37 0.00 0.00 175.52 177.41 3h3d n HIS 574 N -3.65 0.00 -1.58 3.16 8.25 0.08 -4.97 115.22 116.51 3h3d n HIS 574 Ca -0.16 0.00 -0.39 0.00 -0.26 0.00 0.00 57.72 56.91 3h3d n HIS 574 Cb 1.08 0.00 0.04 0.00 1.12 0.00 0.00 29.99 32.23 3h3d n HIS 574 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h3d n ALA 575 N -0.77 -0.15 -0.90 -1.41 0.00 0.18 -5.04 120.51 112.43 3h3d n ALA 575 Ca 0.05 0.07 -0.29 0.00 0.00 0.00 0.00 53.44 53.27 3h3d n ALA 575 Cb 0.29 -2.03 0.19 0.00 0.00 0.00 0.00 19.45 17.90 3h3d n ALA 575 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3h3d s THR 576 N -1.49 2.20 0.16 0.00 -4.23 -1.26 -4.73 115.64 106.29 3h3d s THR 576 Ca 0.70 0.07 -0.29 0.00 -1.18 0.00 0.00 61.69 60.99 3h3d s THR 576 Cb -0.47 -2.35 -0.02 0.00 1.34 0.00 0.00 72.50 71.00 3h3d s THR 576 CO 0.52 -0.09 1.56 -0.09 -0.54 0.00 0.00 174.62 175.98 3h3d h ARG 577 N -2.08 -0.24 -0.47 3.99 2.43 -1.99 0.17 114.38 116.19 3h3d h ARG 577 Ca -0.55 0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 58.58 3h3d h ARG 577 Cb 1.31 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.90 3h3d h ARG 577 CO 0.53 -0.16 0.05 0.78 -1.51 0.00 0.00 179.97 179.66 3h3d h GLY 578 N -0.25 0.85 0.95 2.80 0.00 -1.99 -0.65 103.07 104.79 3h3d h GLY 578 Ca 0.15 -0.59 -0.00 0.00 0.00 0.00 0.00 47.33 46.89 3h3d h GLY 578 CO -0.70 0.54 0.09 0.83 0.00 0.00 0.00 176.54 177.31 3h3d h GLU 579 N 0.65 0.23 -0.37 4.80 5.08 -1.84 -1.86 114.58 121.27 3h3d h GLU 579 Ca 0.14 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 3h3d h GLU 579 Cb 0.42 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 3h3d h GLU 579 CO 0.01 0.22 0.01 -0.09 -1.00 0.00 0.00 179.01 178.16 3h3d h ARG 580 N 0.18 0.66 0.00 2.33 2.43 -0.64 0.13 114.38 119.47 3h3d h ARG 580 Ca 0.06 -0.21 -0.02 0.00 -0.81 0.00 0.00 59.98 59.00 3h3d h ARG 580 Cb 0.05 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.54 3h3d h ARG 580 CO -0.01 0.76 -0.09 1.79 -1.51 0.00 0.00 179.97 180.90 3h3d h THR 581 N 0.48 0.94 0.00 0.20 1.35 -1.06 0.79 112.91 115.60 3h3d h THR 581 Ca 0.11 -0.32 -0.07 0.00 -0.55 0.00 0.00 66.41 65.57 3h3d h THR 581 Cb 0.46 1.18 -0.01 0.00 -1.73 0.00 0.00 68.15 68.05 3h3d h THR 581 CO 0.02 0.09 -0.35 1.23 -0.25 0.00 0.00 175.52 176.26 3h3d h GLY 582 N 0.32 0.00 1.33 5.82 0.00 -0.99 -1.55 103.07 108.00 3h3d h GLY 582 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 47.33 47.07 3h3d h GLY 582 CO 0.01 0.00 -1.05 -2.00 0.00 0.00 0.00 176.54 173.50 3h3d h LEU 583 N 0.00 0.79 -0.07 3.11 5.85 0.12 -3.11 115.31 121.99 3h3d h LEU 583 Ca -0.00 -0.65 -0.00 0.00 0.84 0.00 0.00 57.88 58.07 3h3d h LEU 583 Cb 1.25 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 42.03 3h3d h LEU 583 CO 0.05 1.45 0.04 0.40 -0.34 0.00 0.00 178.44 180.03 3h3d h ILE 584 N 0.32 1.10 -0.48 4.05 1.08 0.49 -3.01 117.51 121.06 3h3d h ILE 584 Ca -0.12 -0.28 0.14 0.00 -0.39 0.00 0.00 64.86 64.21 3h3d h ILE 584 Cb 1.71 1.15 -0.02 0.00 -3.07 0.00 0.00 36.82 36.59 3h3d h ILE 584 CO 0.20 0.08 0.36 0.44 -0.69 0.00 0.00 178.15 178.55 3h3d h ASP 585 N 0.01 0.00 -0.35 1.72 5.19 -1.37 -0.46 116.42 121.16 3h3d h ASP 585 Ca 0.02 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.36 3h3d h ASP 585 Cb 0.10 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.59 3h3d h ASP 585 CO -0.00 0.00 -0.03 -0.08 -3.12 0.00 0.00 179.24 176.00 3h3d h GLU 586 N 0.00 0.74 0.10 3.56 4.57 -1.45 -3.31 114.58 118.79 3h3d h GLU 586 Ca 0.23 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 58.20 3h3d h GLU 586 Cb 0.96 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.46 3h3d h GLU 586 CO -0.00 0.77 -0.05 0.28 -1.18 0.00 0.00 179.01 178.83 3h3d h VAL 587 N 0.69 0.48 -2.70 0.32 2.07 -1.17 -3.28 116.25 112.66 3h3d h VAL 587 Ca 0.13 -1.19 -0.34 0.00 0.82 0.00 0.00 66.70 66.12 3h3d h VAL 587 Cb 0.47 0.88 0.20 0.00 -1.52 0.00 0.00 31.29 31.31 3h3d h VAL 587 CO 0.02 0.15 -0.21 0.00 0.02 0.00 0.00 177.57 177.56 3h3d n THR 589 N -5.37 0.00 -0.03 0.00 -1.04 -1.25 -4.78 114.28 101.81 3h3d n THR 589 Ca 0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.11 3h3d n THR 589 Cb 0.53 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.04 3h3d n THR 589 CO 0.00 0.00 0.00 2.22 -0.64 0.00 0.00 175.07 176.65 3h3d n PHE 590 N 0.00 0.00 -0.25 -1.42 1.16 -1.14 -5.04 117.46 110.76 3h3d n PHE 590 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 3h3d n PHE 590 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 3h3d n PHE 590 CO 0.00 0.00 0.00 0.27 -1.87 0.00 0.00 176.76 175.16 3h3d n ASN 591 N -0.09 0.00 -0.04 5.98 0.23 -1.26 -4.93 115.26 115.15 3h3d n ASN 591 Ca 0.00 0.00 -0.14 0.00 -0.53 0.00 0.00 54.58 53.91 3h3d n ASN 591 Cb 0.00 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 37.58 3h3d n ASN 591 CO 0.00 0.00 0.00 -0.78 -0.93 0.00 0.00 177.26 175.55 3h3d h ASP 592 N 0.00 0.02 -0.95 0.53 1.82 -1.96 -3.26 116.42 112.62 3h3d h ASP 592 Ca 0.00 -0.76 0.02 0.00 -0.39 0.00 0.00 57.03 55.90 3h3d h ASP 592 Cb 0.00 -0.01 -0.05 0.00 0.68 0.00 0.00 39.33 39.95 3h3d h ASP 592 CO 0.00 0.78 0.62 -1.13 -1.61 0.00 0.00 179.24 177.90 3h3d h ASN 593 N -0.74 1.06 0.27 2.28 -0.73 -2.02 -3.25 115.58 112.45 3h3d h ASN 593 Ca -0.00 -0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.13 3h3d h ASN 593 Cb 0.78 -0.26 0.00 0.00 0.27 0.00 0.00 38.32 39.12 3h3d h ASN 593 CO 0.00 0.75 -0.13 0.00 -0.37 0.00 0.00 177.43 177.69 3h3d h ALA 594 N 1.43 -0.36 -2.85 1.57 0.00 -1.92 -3.29 119.26 113.83 3h3d h ALA 594 Ca 0.36 -0.17 -0.55 0.00 0.00 0.00 0.00 54.91 54.54 3h3d h ALA 594 Cb -0.08 0.14 0.12 0.00 0.00 0.00 0.00 17.79 17.97 3h3d h ALA 594 CO -0.09 -0.55 0.62 1.47 0.00 0.00 0.00 179.25 180.69 3h3d n LEU 595 N -5.12 4.61 0.00 0.00 -0.00 -1.23 -3.62 117.00 111.64 3h3d n LEU 595 Ca -0.09 1.13 0.00 0.00 -0.00 0.00 0.00 56.01 57.04 3h3d n LEU 595 Cb 0.25 -1.56 0.00 0.00 -0.00 0.00 0.00 43.42 42.11 3h3d n LEU 595 CO 0.32 -0.34 0.00 1.41 -0.00 0.00 0.00 177.39 178.78 3h3d n HIS 596 N -0.14 0.00 -0.24 1.47 8.25 -1.26 -4.50 115.22 118.80 3h3d n HIS 596 Ca 0.05 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.56 3h3d n HIS 596 Cb 0.40 0.00 0.15 0.00 1.12 0.00 0.00 29.99 31.66 3h3d n HIS 596 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3h3d h VAL 597 N 0.00 0.41 -0.54 1.59 2.07 -1.75 1.06 116.25 119.09 3h3d h VAL 597 Ca 0.00 -0.05 0.03 0.00 0.82 0.00 0.00 66.70 67.50 3h3d h VAL 597 Cb 0.00 0.26 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 3h3d h VAL 597 CO 0.00 0.02 0.32 -0.03 0.02 0.00 0.00 177.57 177.90 3h3d h MET 598 N 0.14 0.61 0.00 1.57 -1.53 -1.71 -0.77 114.93 113.24 3h3d h MET 598 Ca 0.39 -0.04 -0.14 0.00 -3.44 0.00 0.00 59.70 56.47 3h3d h MET 598 Cb 0.68 -0.14 -0.02 0.00 -0.55 0.00 0.00 31.60 31.57 3h3d h MET 598 CO -0.60 0.40 -0.80 0.52 0.14 0.00 0.00 176.91 176.57 3h3d h MET 599 N 0.63 0.00 0.15 0.39 2.86 -1.29 -2.46 114.93 115.20 3h3d h MET 599 Ca 0.22 0.00 -0.21 0.00 -2.06 0.00 0.00 59.70 57.65 3h3d h MET 599 Cb 0.04 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.72 3h3d h MET 599 CO -0.10 0.55 -0.92 -0.22 1.06 0.00 0.00 176.91 177.28 3h3d h LYS 600 N 0.00 0.35 -6.34 1.72 3.64 0.11 -3.43 116.57 112.62 3h3d h LYS 600 Ca -0.04 -0.58 -0.64 0.00 -1.27 0.00 0.00 60.65 58.12 3h3d h LYS 600 Cb 1.51 0.21 0.04 0.00 -0.41 0.00 0.00 32.23 33.59 3h3d h LYS 600 CO 0.07 1.27 0.80 -3.47 -2.27 0.00 0.00 179.45 175.86 3h3d n ASP 601 N -4.06 2.73 0.05 4.20 -0.08 -0.30 -4.88 116.55 114.20 3h3d n ASP 601 Ca -0.14 1.06 0.21 0.00 -1.51 0.00 0.00 54.79 54.42 3h3d n ASP 601 Cb 0.87 -1.32 0.72 0.00 2.34 0.00 0.00 41.12 43.73 3h3d n ASP 601 CO 0.00 0.00 0.00 0.06 0.12 0.00 0.00 177.20 177.38 3h3d h GLN 602 N 6.54 0.00 0.01 -0.67 3.07 -1.92 -2.96 115.11 119.19 3h3d h GLN 602 Ca -0.47 0.00 -0.40 0.00 0.09 0.00 0.00 58.65 57.87 3h3d h GLN 602 Cb 1.29 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 28.79 3h3d h GLN 602 CO 0.88 0.00 -2.30 0.66 0.09 0.00 0.00 178.83 178.17 3h3d n TYR 603 N -3.68 0.27 0.28 0.06 4.02 -1.26 -4.57 117.16 112.27 3h3d n TYR 603 Ca 0.09 0.09 0.15 0.00 -0.01 0.00 0.00 57.90 58.23 3h3d n TYR 603 Cb 0.72 -1.03 0.81 0.00 -0.02 0.00 0.00 39.34 39.82 3h3d n TYR 603 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3h3d h ALA 604 N -0.52 1.17 -0.02 -0.72 0.00 -1.24 -2.68 119.26 115.24 3h3d h ALA 604 Ca -0.59 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.26 3h3d h ALA 604 Cb 1.70 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 3h3d h ALA 604 CO -0.24 0.09 -0.05 -0.97 0.00 0.00 0.00 179.25 178.08 3h3d h ASN 605 N 0.00 -0.14 0.41 0.00 -0.73 -1.27 -1.77 115.58 112.07 3h3d h ASN 605 Ca -0.00 0.03 -0.05 0.00 1.87 0.00 0.00 56.30 58.15 3h3d h ASN 605 Cb 0.32 0.07 -0.01 0.00 0.27 0.00 0.00 38.32 38.97 3h3d h ASN 605 CO 0.01 -0.07 -0.22 1.88 -0.37 0.00 0.00 177.43 178.66 3h3d h TYR 606 N -0.08 0.00 -0.12 0.67 -1.99 -1.72 -1.73 116.97 112.00 3h3d h TYR 606 Ca 0.03 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 3h3d h TYR 606 Cb 0.11 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.84 3h3d h TYR 606 CO -0.13 0.22 0.02 0.28 -0.00 0.00 0.00 178.16 178.55 3h3d h VAL 607 N 0.00 1.21 -0.81 -2.88 2.07 -1.52 -1.21 116.25 113.12 3h3d h VAL 607 Ca -0.00 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 3h3d h VAL 607 Cb 0.48 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 3h3d h VAL 607 CO 0.03 0.20 0.47 0.58 0.02 0.00 0.00 177.57 178.87 3h3d h VAL 608 N -0.02 1.23 0.00 2.57 2.07 -0.84 -0.80 116.25 120.45 3h3d h VAL 608 Ca 0.04 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 3h3d h VAL 608 Cb 0.29 0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 3h3d h VAL 608 CO 0.00 0.25 -0.16 1.56 0.02 0.00 0.00 177.57 179.24 3h3d h GLN 609 N 1.11 0.00 0.16 1.57 4.20 -1.25 0.23 115.11 121.13 3h3d h GLN 609 Ca 0.29 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.72 3h3d h GLN 609 Cb -0.02 0.00 0.03 0.00 0.30 0.00 0.00 27.48 27.79 3h3d h GLN 609 CO -0.05 0.16 -1.16 0.87 -0.67 0.00 0.00 178.83 177.97 3h3d h LYS 610 N 0.00 0.51 -0.47 1.46 1.79 -0.18 -2.81 116.57 116.86 3h3d h LYS 610 Ca -0.00 -0.76 0.09 0.00 -2.18 0.00 0.00 60.65 57.80 3h3d h LYS 610 Cb 0.36 0.27 -0.08 0.00 -1.58 0.00 0.00 32.23 31.19 3h3d h LYS 610 CO 0.02 1.35 -0.05 0.52 -1.08 0.00 0.00 179.45 180.20 3h3d h MET 611 N 0.05 0.06 -0.13 3.15 2.86 -0.50 -1.74 114.93 118.68 3h3d h MET 611 Ca -0.19 -0.00 0.04 0.00 -2.06 0.00 0.00 59.70 57.48 3h3d h MET 611 Cb 1.88 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 33.47 3h3d h MET 611 CO 0.22 0.04 -0.49 0.82 1.06 0.00 0.00 176.91 178.56 3h3d h ILE 612 N 0.06 0.06 0.00 -1.22 2.04 -0.65 -2.55 117.51 115.25 3h3d h ILE 612 Ca 0.23 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.09 3h3d h ILE 612 Cb 0.35 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 3h3d h ILE 612 CO -0.43 0.00 0.13 0.44 0.00 0.00 0.00 178.15 178.29 3h3d h ASP 613 N -0.55 0.00 -0.02 1.72 3.32 -1.04 -2.91 116.42 116.92 3h3d h ASP 613 Ca 0.05 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 3h3d h ASP 613 Cb 0.67 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.22 3h3d h ASP 613 CO -0.42 0.00 0.00 0.52 -1.72 0.00 0.00 179.24 177.62 3h3d n VAL 614 N -2.42 0.58 -0.42 -1.35 0.31 -0.97 -5.06 118.33 108.99 3h3d n VAL 614 Ca -0.02 -0.79 0.00 0.00 -0.01 0.00 0.00 64.34 63.52 3h3d n VAL 614 Cb 0.17 0.72 0.00 0.00 -0.91 0.00 0.00 33.84 33.82 3h3d n VAL 614 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 3h3d n SER 615 N -0.20 0.00 0.00 4.52 7.64 -1.10 -5.06 113.62 119.43 3h3d n SER 615 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 3h3d n SER 615 Cb 0.17 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 3h3d n SER 615 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3h3d n GLU 616 N 0.00 -0.11 0.00 1.43 -0.58 -1.26 -4.90 120.64 115.23 3h3d n GLU 616 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3h3d n GLU 616 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 3h3d n GLU 616 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 3h3d n PRO 617 N -0.54 0.00 0.04 3.49 -0.02 -1.26 0.25 135.00 136.97 3h3d n PRO 617 Ca 0.00 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.32 3h3d n PRO 617 Cb 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 33.50 33.34 3h3d n PRO 617 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 3h3d h THR 618 N 0.00 1.06 -0.99 3.45 1.35 -1.98 -3.24 112.91 112.56 3h3d h THR 618 Ca 0.00 -2.75 0.29 0.00 -0.55 0.00 0.00 66.41 63.40 3h3d h THR 618 Cb 0.00 2.67 -0.18 0.00 -1.73 0.00 0.00 68.15 68.91 3h3d h THR 618 CO 0.00 0.78 0.08 -0.61 -0.25 0.00 0.00 175.52 175.52 3h3d h GLN 619 N 0.05 0.01 0.33 4.72 5.75 0.30 1.04 115.11 127.31 3h3d h GLN 619 Ca -0.26 -0.00 -0.02 0.00 -0.15 0.00 0.00 58.65 58.22 3h3d h GLN 619 Cb 2.01 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 30.56 3h3d h GLN 619 CO 0.14 0.01 -0.16 1.25 -2.65 0.00 0.00 178.83 177.42 3h3d h LEU 620 N 0.01 -0.37 -2.78 -2.39 7.12 -1.75 0.39 115.31 115.54 3h3d h LEU 620 Ca 0.62 -0.16 0.00 0.00 0.13 0.00 0.00 57.88 58.47 3h3d h LEU 620 Cb 1.33 0.10 0.00 0.00 -0.53 0.00 0.00 40.66 41.56 3h3d h LEU 620 CO -0.90 -0.01 0.00 0.07 -0.13 0.00 0.00 178.44 177.47 3h3d h LYS 621 N -0.78 0.00 0.01 1.25 2.10 -1.27 0.43 116.57 118.32 3h3d h LYS 621 Ca -0.04 0.00 -0.21 0.00 -2.00 0.00 0.00 60.65 58.40 3h3d h LYS 621 Cb 0.51 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.81 3h3d h LYS 621 CO 0.07 0.00 -1.12 -0.22 -2.00 0.00 0.00 179.45 176.19 3h3d h LYS 622 N 0.00 0.02 0.00 0.07 1.63 0.11 -3.32 116.57 115.08 3h3d h LYS 622 Ca 0.00 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 3h3d h LYS 622 Cb 0.03 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.67 3h3d h LYS 622 CO 0.00 1.01 0.00 -0.07 -3.45 0.00 0.00 179.45 176.94 3h3d h LEU 623 N -0.94 0.00 0.00 5.20 4.07 -0.07 -2.62 115.31 120.95 3h3d h LEU 623 Ca -0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.66 3h3d h LEU 623 Cb 1.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.04 3h3d h LEU 623 CO -0.16 0.00 0.00 0.80 -1.08 0.00 0.00 178.44 178.00 3h3d n MET 624 N -2.60 0.33 -4.04 1.13 1.56 0.15 -3.36 117.12 110.28 3h3d n MET 624 Ca 0.04 0.00 -0.32 0.00 -0.27 0.00 0.00 57.70 57.15 3h3d n MET 624 Cb 0.38 -1.39 -0.15 0.00 2.15 0.00 0.00 33.22 34.22 3h3d n MET 624 CO 0.00 0.00 0.00 0.95 -0.73 0.00 0.00 175.97 176.19 3h3d s THR 625 N -2.00 1.95 -0.45 1.12 -4.23 -0.99 -4.98 115.64 106.06 3h3d s THR 625 Ca 0.12 -1.37 -0.08 0.00 -1.18 0.00 0.00 61.69 59.18 3h3d s THR 625 Cb 0.06 -2.04 0.11 0.00 1.34 0.00 0.00 72.50 71.96 3h3d s THR 625 CO 0.09 0.06 0.30 -0.75 -0.54 0.00 0.00 174.62 173.79 3h3d s LYS 626 N 1.23 2.44 0.00 3.99 2.47 -1.21 -4.96 119.74 123.70 3h3d s LYS 626 Ca -0.05 -1.70 0.00 0.00 -1.56 0.00 0.00 55.97 52.66 3h3d s LYS 626 Cb -0.18 -3.84 0.00 0.00 -1.46 0.00 0.00 37.83 32.35 3h3d s LYS 626 CO -0.07 -1.12 0.00 -0.89 0.16 0.00 0.00 175.35 173.44