#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3l6g s LYS 321 N 0.00 4.34 0.13 0.11 1.02 -1.26 -5.03 119.74 119.05 3l6g s LYS 321 Ca 0.00 0.77 -0.07 0.00 0.02 0.00 0.00 55.97 56.68 3l6g s LYS 321 Cb 0.00 -3.35 -0.01 0.00 -0.52 0.00 0.00 37.83 33.94 3l6g s LYS 321 CO 0.00 0.34 0.20 -1.59 -0.92 0.00 0.00 175.35 173.38 3l6g s LYS 322 N -0.10 0.99 -0.25 1.68 -2.85 -1.26 -1.03 119.74 116.92 3l6g s LYS 322 Ca 0.32 -1.15 -0.26 0.00 -1.00 0.00 0.00 55.97 53.88 3l6g s LYS 322 Cb -0.18 0.34 0.08 0.00 -2.06 0.00 0.00 37.83 36.00 3l6g s LYS 322 CO 0.18 -0.33 0.75 0.54 0.10 0.00 0.00 175.35 176.59 3l6g s VAL 323 N -3.94 0.00 -0.29 1.79 0.11 -0.64 -4.62 120.40 112.81 3l6g s VAL 323 Ca 0.14 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.22 3l6g s VAL 323 Cb 0.05 -1.00 0.07 0.00 -1.53 0.00 0.00 36.38 33.97 3l6g s VAL 323 CO -0.04 0.00 -0.05 -0.62 -3.33 0.00 0.00 175.10 171.06 3l6g s ASP 324 N 0.18 4.56 0.09 3.54 -1.08 -1.26 -1.55 116.67 121.15 3l6g s ASP 324 Ca -0.01 -1.67 0.08 0.00 -0.52 0.00 0.00 52.55 50.42 3l6g s ASP 324 Cb -0.04 -1.58 -0.04 0.00 -1.46 0.00 0.00 42.92 39.80 3l6g s ASP 324 CO 0.01 -0.26 -0.15 -0.76 0.52 0.00 0.00 175.17 174.54 3l6g s LEU 325 N 1.03 2.82 0.12 -1.34 1.43 0.08 -0.90 118.68 121.92 3l6g s LEU 325 Ca -0.02 -0.44 0.08 0.00 -1.03 0.00 0.00 54.13 52.71 3l6g s LEU 325 Cb -0.20 -1.65 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 3l6g s LEU 325 CO -0.06 0.20 -0.18 0.68 0.23 0.00 0.00 176.35 177.22 3l6g s VAL 326 N -1.10 1.63 0.27 -1.59 -7.23 -0.98 -1.96 120.40 109.43 3l6g s VAL 326 Ca 0.18 -1.67 -0.07 0.00 -1.81 0.00 0.00 61.98 58.60 3l6g s VAL 326 Cb -0.11 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.23 3l6g s VAL 326 CO 0.10 -0.22 0.42 -0.72 -0.31 0.00 0.00 175.10 174.37 3l6g s TYR 327 N -1.63 0.72 0.11 2.82 -0.85 -0.85 -4.46 117.35 113.22 3l6g s TYR 327 Ca 0.09 -1.02 0.05 0.00 -0.52 0.00 0.00 57.07 55.67 3l6g s TYR 327 Cb -0.08 -0.02 -0.04 0.00 0.38 0.00 0.00 41.96 42.21 3l6g s TYR 327 CO 0.05 -0.99 0.04 0.00 -1.52 0.00 0.00 175.55 173.12 3l6g s MET 328 N -3.70 2.64 -1.54 -3.49 0.23 -1.26 -0.91 119.30 111.27 3l6g s MET 328 Ca 0.28 -0.86 -0.11 0.00 -1.03 0.00 0.00 55.69 53.97 3l6g s MET 328 Cb 0.01 -2.56 -0.02 0.00 -1.53 0.00 0.00 34.83 30.72 3l6g s MET 328 CO 0.13 0.52 2.65 -1.71 -2.03 0.00 0.00 175.02 174.59 3l6g n ASN 329 N 0.28 7.11 -4.73 -1.18 5.15 -1.26 -4.57 115.26 116.05 3l6g n ASN 329 Ca -0.10 -2.72 -0.29 0.00 -0.60 0.00 0.00 54.58 50.87 3l6g n ASN 329 Cb 0.53 -1.57 -0.07 0.00 -0.53 0.00 0.00 39.78 38.14 3l6g n ASN 329 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 3l6g s TRP 330 N 2.11 3.07 0.39 1.20 0.51 -1.26 -5.00 118.94 119.96 3l6g s TRP 330 Ca 0.60 0.00 0.08 0.00 -2.12 0.00 0.00 56.10 54.67 3l6g s TRP 330 Cb 0.16 -1.55 0.84 0.00 -0.81 0.00 0.00 33.47 32.12 3l6g s TRP 330 CO -0.07 0.50 1.98 -0.44 -0.51 0.00 0.00 176.95 178.42 3l6g h ASP 331 N 3.17 0.55 -0.11 2.95 3.32 -2.00 -0.17 116.42 124.13 3l6g h ASP 331 Ca -0.47 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.59 3l6g h ASP 331 Cb 1.17 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 3l6g h ASP 331 CO 0.62 0.36 0.04 0.77 -1.72 0.00 0.00 179.24 179.31 3l6g h SER 332 N 0.63 0.05 0.09 6.45 4.64 -1.95 -2.55 113.55 120.90 3l6g h SER 332 Ca 0.28 0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.45 3l6g h SER 332 Cb 0.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 3l6g h SER 332 CO -0.09 0.04 -0.53 -0.33 -0.87 0.00 0.00 176.83 175.05 3l6g h GLU 333 N 0.09 0.49 -0.96 4.77 4.39 -1.58 -1.85 114.58 119.92 3l6g h GLU 333 Ca 0.05 -0.30 0.02 0.00 0.34 0.00 0.00 59.36 59.47 3l6g h GLU 333 Cb 0.02 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.65 3l6g h GLU 333 CO -0.05 0.90 0.63 0.28 -1.16 0.00 0.00 179.01 179.61 3l6g h VAL 334 N 0.38 1.20 0.35 3.13 2.07 -1.03 0.15 116.25 122.50 3l6g h VAL 334 Ca 0.01 -0.43 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 3l6g h VAL 334 Cb 1.06 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 3l6g h VAL 334 CO 0.10 0.23 -0.17 0.00 0.02 0.00 0.00 177.57 177.75 3l6g h ALA 335 N 1.38 -0.48 -0.53 1.67 0.00 -1.09 -2.65 119.26 117.55 3l6g h ALA 335 Ca 0.37 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 55.02 3l6g h ALA 335 Cb -0.06 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3l6g h ALA 335 CO -0.10 -0.70 -0.11 0.66 0.00 0.00 0.00 179.25 178.99 3l6g h SER 336 N -0.61 1.01 0.54 0.00 4.64 -1.17 -2.55 113.55 115.41 3l6g h SER 336 Ca -0.05 -0.33 -0.11 0.00 -0.47 0.00 0.00 61.79 60.83 3l6g h SER 336 Cb 0.44 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 3l6g h SER 336 CO 0.08 1.12 -0.54 -0.29 -0.87 0.00 0.00 176.83 176.33 3l6g h ILE 337 N 0.89 1.39 -0.03 0.95 6.09 -1.01 -0.37 117.51 125.42 3l6g h ILE 337 Ca 0.14 -1.86 -0.25 0.00 -1.37 0.00 0.00 64.86 61.52 3l6g h ILE 337 Cb 0.67 2.00 0.02 0.00 0.47 0.00 0.00 36.82 39.98 3l6g h ILE 337 CO 0.05 0.53 -0.98 0.78 -3.07 0.00 0.00 178.15 175.46 3l6g h ASN 338 N 0.00 0.88 -0.07 2.19 2.35 -1.39 0.51 115.58 120.05 3l6g h ASN 338 Ca -0.01 -0.68 0.00 0.00 -0.55 0.00 0.00 56.30 55.07 3l6g h ASN 338 Cb 0.96 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 39.06 3l6g h ASN 338 CO 0.07 1.48 0.05 0.58 -1.65 0.00 0.00 177.43 177.96 3l6g h VAL 339 N 0.41 1.02 -0.50 2.81 2.07 -1.30 -0.44 116.25 120.32 3l6g h VAL 339 Ca -0.11 -0.03 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 3l6g h VAL 339 Cb 1.62 0.91 -0.02 0.00 -1.52 0.00 0.00 31.29 32.29 3l6g h VAL 339 CO 0.19 0.02 0.04 0.25 0.02 0.00 0.00 177.57 178.09 3l6g h LEU 340 N 0.10 0.83 -0.29 2.57 5.85 -1.05 -0.73 115.31 122.58 3l6g h LEU 340 Ca 0.03 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 58.47 3l6g h LEU 340 Cb -0.01 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 3l6g h LEU 340 CO -0.01 0.91 0.17 0.74 -0.34 0.00 0.00 178.44 179.92 3l6g h THR 341 N 0.72 1.04 -0.40 1.05 2.02 -0.80 0.09 112.91 116.63 3l6g h THR 341 Ca 0.15 -0.12 -0.14 0.00 0.77 0.00 0.00 66.41 67.07 3l6g h THR 341 Cb 0.46 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 3l6g h THR 341 CO 0.02 0.07 -0.29 1.56 0.37 0.00 0.00 175.52 177.24 3l6g h GLN 342 N 0.36 0.88 -0.19 6.66 1.08 -0.92 -0.54 115.11 122.43 3l6g h GLN 342 Ca 0.11 -0.41 0.00 0.00 -1.45 0.00 0.00 58.65 56.91 3l6g h GLN 342 Cb -0.01 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.39 3l6g h GLN 342 CO -0.05 1.05 0.12 0.00 -0.95 0.00 0.00 178.83 179.01 3l6g h ALA 343 N 0.92 0.24 -0.44 3.87 0.00 -0.96 -1.05 119.26 121.83 3l6g h ALA 343 Ca 0.08 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 3l6g h ALA 343 Cb 0.85 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3l6g h ALA 343 CO 0.08 -0.27 -0.25 0.52 0.00 0.00 0.00 179.25 179.32 3l6g h MET 344 N 0.25 0.93 -1.00 0.00 2.86 -0.81 -1.55 114.93 115.61 3l6g h MET 344 Ca 0.07 -0.41 0.05 0.00 -2.06 0.00 0.00 59.70 57.35 3l6g h MET 344 Cb -0.02 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.56 3l6g h MET 344 CO -0.01 1.07 0.65 0.87 1.06 0.00 0.00 176.91 180.55 3l6g h LYS 345 N 0.80 1.19 0.00 1.72 1.57 -1.03 -0.70 116.57 120.11 3l6g h LYS 345 Ca 0.10 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.72 3l6g h LYS 345 Cb 0.82 -0.27 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 3l6g h LYS 345 CO 0.07 0.79 -0.39 1.49 -0.57 0.00 0.00 179.45 180.83 3l6g h GLU 346 N 1.22 0.00 -0.68 3.15 4.81 -0.31 -1.80 114.58 120.97 3l6g h GLU 346 Ca 0.41 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.64 3l6g h GLU 346 Cb 0.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.46 3l6g h GLU 346 CO -0.15 0.39 0.00 0.72 -0.73 0.00 0.00 179.01 179.25 3l6g n HIS 347 N -3.85 1.41 -0.40 0.92 8.25 -0.67 -4.93 115.22 115.96 3l6g n HIS 347 Ca -0.01 -0.50 0.00 0.00 -0.26 0.00 0.00 57.72 56.95 3l6g n HIS 347 Cb 0.46 -0.36 0.00 0.00 1.12 0.00 0.00 29.99 31.21 3l6g n HIS 347 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3l6g n GLY 348 N 0.54 0.80 3.77 -1.41 0.00 -0.67 -5.04 105.19 103.18 3l6g n GLY 348 Ca 0.20 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.84 3l6g n GLY 348 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3l6g s PHE 349 N -2.05 3.80 -0.49 1.61 0.08 -0.32 -4.41 117.98 116.20 3l6g s PHE 349 Ca 0.00 1.80 -0.26 0.00 0.12 0.00 0.00 56.93 58.58 3l6g s PHE 349 Cb 0.00 -2.92 0.03 0.00 -0.57 0.00 0.00 43.02 39.56 3l6g s PHE 349 CO 0.00 0.32 1.01 0.34 -0.10 0.00 0.00 175.22 176.78 3l6g s ASP 350 N -1.45 6.50 -0.18 1.36 2.15 -0.20 -4.25 116.67 120.59 3l6g s ASP 350 Ca 0.46 0.12 -0.04 0.00 0.43 0.00 0.00 52.55 53.52 3l6g s ASP 350 Cb -0.21 -2.48 -0.02 0.00 -0.30 0.00 0.00 42.92 39.91 3l6g s ASP 350 CO 0.26 -1.18 -0.03 -0.69 -0.17 0.00 0.00 175.17 173.36 3l6g s VAL 351 N 4.09 3.71 -0.15 1.11 1.01 -1.26 -1.62 120.40 127.29 3l6g s VAL 351 Ca 0.39 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 3l6g s VAL 351 Cb -0.09 -2.65 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 3l6g s VAL 351 CO 0.26 0.46 -0.02 -0.75 0.00 0.00 0.00 175.10 175.05 3l6g s LYS 352 N 0.85 3.66 -0.01 2.72 2.20 -0.60 -5.00 119.74 123.57 3l6g s LYS 352 Ca -0.01 -0.49 0.02 0.00 -0.36 0.00 0.00 55.97 55.13 3l6g s LYS 352 Cb -0.15 -2.94 -0.00 0.00 -1.51 0.00 0.00 37.83 33.23 3l6g s LYS 352 CO 0.02 0.28 -0.06 0.95 -0.36 0.00 0.00 175.35 176.18 3l6g s THR 353 N 0.27 0.47 -0.05 3.43 -4.23 -1.26 -0.74 115.64 113.54 3l6g s THR 353 Ca -0.02 -0.25 -0.03 0.00 -1.18 0.00 0.00 61.69 60.21 3l6g s THR 353 Cb -0.14 -0.41 0.03 0.00 1.34 0.00 0.00 72.50 73.32 3l6g s THR 353 CO 0.03 0.14 0.12 -0.89 -0.54 0.00 0.00 174.62 173.48 3l6g s THR 354 N -0.09 -0.03 0.06 3.99 2.01 -0.83 -5.00 115.64 115.75 3l6g s THR 354 Ca 0.02 0.11 -0.24 0.00 0.31 0.00 0.00 61.69 61.89 3l6g s THR 354 Cb -0.03 -0.20 -0.06 0.00 0.01 0.00 0.00 72.50 72.22 3l6g s THR 354 CO -0.00 0.05 0.72 0.00 -0.69 0.00 0.00 174.62 174.69 3l6g s ALA 355 N 0.72 3.43 0.11 7.40 0.00 -1.26 -2.02 121.76 130.14 3l6g s ALA 355 Ca -0.05 0.23 -0.01 0.00 0.00 0.00 0.00 51.96 52.13 3l6g s ALA 355 Cb -0.07 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 3l6g s ALA 355 CO -0.03 0.16 0.02 -0.51 0.00 0.00 0.00 175.76 175.40 3l6g s LEU 356 N -0.41 2.03 0.73 0.00 1.43 -0.09 -4.93 118.68 117.44 3l6g s LEU 356 Ca 0.36 -1.14 -0.16 0.00 -1.03 0.00 0.00 54.13 52.16 3l6g s LEU 356 Cb -0.20 0.22 0.03 0.00 0.03 0.00 0.00 46.19 46.27 3l6g s LEU 356 CO 0.22 -0.67 1.16 0.47 0.23 0.00 0.00 176.35 177.77 3l6g n ASP 357 N -0.05 1.22 -0.02 2.29 8.00 -1.26 -4.18 116.55 122.56 3l6g n ASP 357 Ca -0.08 0.70 -0.09 0.00 0.71 0.00 0.00 54.79 56.02 3l6g n ASP 357 Cb 0.63 -1.49 -0.02 0.00 -0.02 0.00 0.00 41.12 40.21 3l6g n ASP 357 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 3l6g h ASN 358 N -0.21 -0.62 -0.41 -2.24 -0.00 -1.99 0.88 115.58 110.99 3l6g h ASN 358 Ca -0.48 0.11 -0.05 0.00 -0.00 0.00 0.00 56.30 55.88 3l6g h ASN 358 Cb 1.32 0.29 -0.02 0.00 -0.00 0.00 0.00 38.32 39.91 3l6g h ASN 358 CO 0.49 -0.24 0.11 0.00 -0.00 0.00 0.00 177.43 177.78 3l6g h ALA 359 N 0.81 1.28 -0.27 1.57 0.00 -2.00 -2.22 119.26 118.42 3l6g h ALA 359 Ca 0.11 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 3l6g h ALA 359 Cb 0.40 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3l6g h ALA 359 CO -0.30 0.50 -0.02 0.28 0.00 0.00 0.00 179.25 179.71 3l6g h VAL 360 N 0.71 1.27 -0.77 0.00 2.07 -1.77 -2.14 116.25 115.62 3l6g h VAL 360 Ca 0.16 -0.98 0.03 0.00 0.82 0.00 0.00 66.70 66.73 3l6g h VAL 360 Cb 0.28 1.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.38 3l6g h VAL 360 CO -0.00 0.31 0.48 0.00 0.02 0.00 0.00 177.57 178.38 3l6g h ALA 361 N 0.80 1.01 -0.69 1.67 0.00 -0.52 -1.61 119.26 119.91 3l6g h ALA 361 Ca 0.07 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3l6g h ALA 361 Cb 0.46 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3l6g h ALA 361 CO 0.02 0.28 0.22 -1.49 0.00 0.00 0.00 179.25 178.28 3l6g h TRP 362 N 0.94 1.12 -0.24 0.00 4.06 -1.32 -2.69 115.95 117.81 3l6g h TRP 362 Ca 0.31 -0.11 -0.13 0.00 2.06 0.00 0.00 58.89 61.02 3l6g h TRP 362 Cb 0.03 -0.32 -0.01 0.00 -1.00 0.00 0.00 29.16 27.85 3l6g h TRP 362 CO -0.03 0.89 -0.39 0.37 -3.56 0.00 0.00 178.44 175.72 3l6g h GLN 363 N 1.02 0.56 -0.52 0.49 4.15 -0.89 0.28 115.11 120.19 3l6g h GLN 363 Ca 0.22 -0.28 -0.04 0.00 0.77 0.00 0.00 58.65 59.33 3l6g h GLN 363 Cb 0.30 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.96 3l6g h GLN 363 CO -0.01 0.86 0.18 1.79 -1.93 0.00 0.00 178.83 179.72 3l6g h THR 364 N 0.46 1.20 -0.10 2.39 1.35 -1.02 -0.99 112.91 116.21 3l6g h THR 364 Ca 0.04 -0.67 -0.19 0.00 -0.55 0.00 0.00 66.41 65.05 3l6g h THR 364 Cb 0.88 0.61 0.01 0.00 -1.73 0.00 0.00 68.15 67.92 3l6g h THR 364 CO 0.08 0.26 -0.68 0.58 -0.25 0.00 0.00 175.52 175.50 3l6g h VAL 365 N 0.75 1.33 -0.28 6.82 2.07 -1.14 0.27 116.25 126.07 3l6g h VAL 365 Ca 0.18 -1.95 -0.02 0.00 0.82 0.00 0.00 66.70 65.73 3l6g h VAL 365 Cb 0.20 2.17 -0.01 0.00 -1.52 0.00 0.00 31.29 32.12 3l6g h VAL 365 CO -0.01 0.60 0.10 0.00 0.02 0.00 0.00 177.57 178.27 3l6g h ALA 366 N 0.48 1.65 -0.02 1.67 0.00 -0.67 -2.42 119.26 119.95 3l6g h ALA 366 Ca -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3l6g h ALA 366 Cb 1.33 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.00 3l6g h ALA 366 CO 0.14 0.27 -0.18 0.09 0.00 0.00 0.00 179.25 179.57 3l6g n ASN 367 N -4.41 2.20 0.00 0.00 4.13 -0.40 -4.83 115.26 111.95 3l6g n ASN 367 Ca 0.01 -1.63 0.00 0.00 1.68 0.00 0.00 54.58 54.64 3l6g n ASN 367 Cb 0.14 0.16 0.00 0.00 -1.54 0.00 0.00 39.78 38.54 3l6g n ASN 367 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3l6g n GLY 368 N 1.34 0.50 0.23 7.41 0.00 -0.83 -4.92 105.19 108.93 3l6g n GLY 368 Ca 0.13 -0.34 0.12 0.00 0.00 0.00 0.00 46.02 45.93 3l6g n GLY 368 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3l6g h GLN 369 N 0.82 0.00 -5.31 1.61 -0.00 -0.75 -3.44 115.11 108.04 3l6g h GLN 369 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 58.65 58.26 3l6g h GLN 369 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 27.48 27.31 3l6g h GLN 369 CO 0.00 0.10 -0.74 0.00 0.00 0.00 0.00 178.83 178.19 3l6g s ALA 370 N -3.39 1.54 0.12 3.38 0.00 -0.88 -4.99 121.76 117.53 3l6g s ALA 370 Ca 0.04 -1.40 -0.05 0.00 0.00 0.00 0.00 51.96 50.55 3l6g s ALA 370 Cb 0.07 -0.04 -0.13 0.00 0.00 0.00 0.00 23.12 23.03 3l6g s ALA 370 CO 0.64 0.03 1.27 -0.44 0.00 0.00 0.00 175.76 177.26 3l6g h ASP 371 N 3.17 0.57 0.00 0.00 3.32 -1.31 -3.41 116.42 118.76 3l6g h ASP 371 Ca -0.38 -0.47 0.00 0.00 0.02 0.00 0.00 57.03 56.20 3l6g h ASP 371 Cb 1.20 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.57 3l6g h ASP 371 CO 0.56 1.28 0.00 0.61 -1.72 0.00 0.00 179.24 179.97 3l6g n GLY 372 N 1.02 -1.22 3.28 2.75 0.00 -1.20 -1.12 105.19 108.71 3l6g n GLY 372 Ca -0.07 -0.93 -0.13 0.00 0.00 0.00 0.00 46.02 44.88 3l6g n GLY 372 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3l6g s MET 373 N -1.10 0.79 -0.22 1.61 0.23 -0.38 -2.32 119.30 117.93 3l6g s MET 373 Ca 0.00 -0.28 0.14 0.00 -1.03 0.00 0.00 55.69 54.52 3l6g s MET 373 Cb 0.00 0.35 0.47 0.00 -1.53 0.00 0.00 34.83 34.13 3l6g s MET 373 CO 0.00 -0.24 1.38 1.33 -2.03 0.00 0.00 175.02 175.46 3l6g n VAL 374 N 0.89 2.32 -1.43 5.16 0.24 -1.26 -1.71 118.33 122.53 3l6g n VAL 374 Ca -0.20 -2.36 0.07 0.00 -2.04 0.00 0.00 64.34 59.81 3l6g n VAL 374 Cb 0.58 -0.28 0.18 0.00 -1.47 0.00 0.00 33.84 32.85 3l6g n VAL 374 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 3l6g n SER 375 N -0.94 1.90 -4.54 -1.34 7.64 -1.19 -4.44 113.62 110.71 3l6g n SER 375 Ca 0.25 -3.56 -0.42 0.00 1.01 0.00 0.00 58.87 56.14 3l6g n SER 375 Cb 0.89 -0.49 -0.03 0.00 -1.01 0.00 0.00 64.21 63.57 3l6g n SER 375 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3l6g s ALA 376 N -3.01 3.06 -0.37 -0.43 0.00 -0.82 -4.86 121.76 115.33 3l6g s ALA 376 Ca 0.35 -1.15 -0.18 0.00 0.00 0.00 0.00 51.96 50.98 3l6g s ALA 376 Cb 0.33 -3.89 0.00 0.00 0.00 0.00 0.00 23.12 19.56 3l6g s ALA 376 CO -0.04 -2.59 0.53 -1.58 0.00 0.00 0.00 175.76 172.08 3l6g s TRP 377 N 4.46 3.16 0.05 0.00 0.52 -1.26 0.02 118.94 125.90 3l6g s TRP 377 Ca 0.35 0.10 0.03 0.00 0.02 0.00 0.00 56.10 56.60 3l6g s TRP 377 Cb -0.11 -2.98 -0.02 0.00 -1.15 0.00 0.00 33.47 29.20 3l6g s TRP 377 CO 0.20 -0.60 -0.10 -0.51 0.02 0.00 0.00 176.95 175.96 3l6g s LEU 378 N 2.43 2.24 0.06 2.99 1.43 -0.70 -1.39 118.68 125.75 3l6g s LEU 378 Ca 0.19 -0.54 0.23 0.00 -1.03 0.00 0.00 54.13 52.98 3l6g s LEU 378 Cb -0.15 -0.33 0.03 0.00 0.03 0.00 0.00 46.19 45.77 3l6g s LEU 378 CO 0.14 -0.12 1.00 -0.81 0.23 0.00 0.00 176.35 176.79 3l6g n PRO 379 N 1.53 0.33 -0.08 1.29 -0.04 -1.26 -1.91 135.00 134.86 3l6g n PRO 379 Ca -0.21 -0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.02 3l6g n PRO 379 Cb 0.55 -1.61 -0.12 0.00 -0.04 0.00 0.00 33.50 32.28 3l6g n PRO 379 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3l6g n ASN 380 N -2.03 1.95 -0.25 3.54 3.02 -1.26 -3.56 115.26 116.66 3l6g n ASN 380 Ca 0.01 0.33 -0.06 0.00 -0.03 0.00 0.00 54.58 54.84 3l6g n ASN 380 Cb 0.45 -0.90 0.05 0.00 -0.61 0.00 0.00 39.78 38.78 3l6g n ASN 380 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 3l6g h THR 381 N -0.66 1.22 -0.76 3.41 2.02 -1.91 -1.77 112.91 114.46 3l6g h THR 381 Ca -0.42 -0.55 -0.39 0.00 0.77 0.00 0.00 66.41 65.82 3l6g h THR 381 Cb 1.57 0.30 -0.23 0.00 -1.74 0.00 0.00 68.15 68.05 3l6g h THR 381 CO -0.15 0.24 0.38 1.41 0.37 0.00 0.00 175.52 177.77 3l6g n HIS 382 N -4.49 2.34 -0.21 3.16 8.25 -0.48 -4.75 115.22 119.04 3l6g n HIS 382 Ca 0.06 -1.75 0.00 0.00 -0.26 0.00 0.00 57.72 55.77 3l6g n HIS 382 Cb 0.09 -0.78 0.11 0.00 1.12 0.00 0.00 29.99 30.54 3l6g n HIS 382 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3l6g h LYS 383 N 1.05 0.39 -0.21 -0.41 3.64 -1.37 -0.24 116.57 119.42 3l6g h LYS 383 Ca 0.48 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.82 3l6g h LYS 383 Cb 2.42 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 34.14 3l6g h LYS 383 CO 0.84 0.26 0.08 1.15 -2.27 0.00 0.00 179.45 179.51 3l6g h THR 384 N 0.40 1.17 -0.72 1.00 2.02 -1.85 -0.54 112.91 114.40 3l6g h THR 384 Ca 0.31 -0.51 -0.05 0.00 0.77 0.00 0.00 66.41 66.93 3l6g h THR 384 Cb 0.40 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.90 3l6g h THR 384 CO -0.32 0.16 0.23 1.56 0.37 0.00 0.00 175.52 177.53 3l6g h GLN 385 N 0.18 1.11 -0.47 6.66 7.50 -1.81 -1.97 115.11 126.30 3l6g h GLN 385 Ca 0.07 -0.23 -0.04 0.00 0.50 0.00 0.00 58.65 58.94 3l6g h GLN 385 Cb 0.18 -0.16 -0.02 0.00 0.05 0.00 0.00 27.48 27.53 3l6g h GLN 385 CO -0.01 0.94 0.12 2.35 -1.50 0.00 0.00 178.83 180.74 3l6g h TRP 386 N 1.05 0.72 -0.41 2.96 2.91 -0.79 0.33 115.95 122.72 3l6g h TRP 386 Ca 0.23 -0.06 -0.05 0.00 1.13 0.00 0.00 58.89 60.15 3l6g h TRP 386 Cb 0.29 -0.22 -0.02 0.00 -0.51 0.00 0.00 29.16 28.71 3l6g h TRP 386 CO 0.02 0.61 0.06 1.96 -1.03 0.00 0.00 178.44 180.07 3l6g h GLN 387 N 0.69 0.68 -0.30 2.65 4.20 -0.65 0.45 115.11 122.83 3l6g h GLN 387 Ca 0.16 -0.19 -0.10 0.00 0.06 0.00 0.00 58.65 58.58 3l6g h GLN 387 Cb 0.25 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 3l6g h GLN 387 CO -0.00 0.73 -0.19 0.87 -0.67 0.00 0.00 178.83 179.57 3l6g h LYS 388 N 0.53 0.66 -0.00 1.46 1.57 -1.12 -3.40 116.57 116.27 3l6g h LYS 388 Ca 0.12 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3l6g h LYS 388 Cb 0.39 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.69 3l6g h LYS 388 CO 0.01 0.90 -0.07 0.66 -0.57 0.00 0.00 179.45 180.38 3l6g n TYR 389 N -4.35 0.00 -0.31 -1.35 4.01 0.08 -4.79 117.16 110.46 3l6g n TYR 389 Ca -0.03 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.71 3l6g n TYR 389 Cb 0.41 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.57 3l6g n TYR 389 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3l6g h GLY 390 N 0.40 1.28 2.00 2.72 0.00 -1.02 0.13 103.07 108.58 3l6g h GLY 390 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.95 3l6g h GLY 390 CO 0.00 0.26 0.00 1.17 0.00 0.00 0.00 176.54 177.97 3l6g n LYS 391 N -4.62 0.10 -0.22 4.80 3.00 -1.26 -2.64 118.16 117.31 3l6g n LYS 391 Ca 0.12 0.22 0.12 0.00 -0.00 0.00 0.00 58.31 58.77 3l6g n LYS 391 Cb 0.17 -1.65 0.25 0.00 0.00 0.00 0.00 35.03 33.80 3l6g n LYS 391 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 3l6g n SER 392 N -1.83 3.44 -4.33 3.14 7.64 0.45 -4.95 113.62 117.18 3l6g n SER 392 Ca 0.04 -1.98 -0.17 0.00 1.01 0.00 0.00 58.87 57.77 3l6g n SER 392 Cb 0.28 -0.30 -0.10 0.00 -1.01 0.00 0.00 64.21 63.08 3l6g n SER 392 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3l6g s VAL 393 N -1.41 0.77 -0.36 0.44 -7.23 -1.08 -4.48 120.40 107.05 3l6g s VAL 393 Ca 0.41 -2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 58.46 3l6g s VAL 393 Cb 0.23 -2.53 0.01 0.00 0.56 0.00 0.00 36.38 34.66 3l6g s VAL 393 CO 0.32 -0.13 0.21 -1.81 -0.31 0.00 0.00 175.10 173.37 3l6g s ASP 394 N -3.32 5.78 -0.40 4.85 1.01 -0.36 -4.90 116.67 119.34 3l6g s ASP 394 Ca 0.34 -0.81 -0.27 0.00 0.71 0.00 0.00 52.55 52.51 3l6g s ASP 394 Cb 0.07 -2.05 0.02 0.00 1.01 0.00 0.00 42.92 41.97 3l6g s ASP 394 CO 0.12 -0.34 0.99 -0.22 0.21 0.00 0.00 175.17 175.93 3l6g s LEU 395 N 1.60 3.91 0.05 1.23 2.96 -1.26 -1.47 118.68 125.71 3l6g s LEU 395 Ca 0.03 0.56 -0.06 0.00 -0.22 0.00 0.00 54.13 54.45 3l6g s LEU 395 Cb -0.18 -3.35 -0.29 0.00 0.50 0.00 0.00 46.19 42.86 3l6g s LEU 395 CO 0.07 -0.97 1.05 -0.07 -1.32 0.00 0.00 176.35 175.11 3l6g h LEU 396 N 10.38 0.48 0.00 -0.68 3.38 -1.32 -3.49 115.31 124.06 3l6g h LEU 396 Ca -0.23 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 57.19 3l6g h LEU 396 Cb 1.07 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3l6g h LEU 396 CO 1.03 1.44 0.00 0.61 0.09 0.00 0.00 178.44 181.60 3l6g n GLY 397 N 1.60 0.60 3.74 0.83 0.00 -1.23 -5.00 105.19 105.73 3l6g n GLY 397 Ca -0.12 -1.87 -0.41 0.00 0.00 0.00 0.00 46.02 43.63 3l6g n GLY 397 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3l6g s PRO 398 N -1.32 4.57 -0.01 1.61 0.04 -1.26 -0.98 135.00 137.65 3l6g s PRO 398 Ca 0.00 1.77 0.20 0.00 0.04 0.00 0.00 61.00 63.01 3l6g s PRO 398 Cb 0.00 -3.25 -0.26 0.00 0.04 0.00 0.00 34.50 31.02 3l6g s PRO 398 CO 0.00 0.05 0.66 0.27 0.04 0.00 0.00 177.00 178.02 3l6g n ASN 399 N 2.23 0.65 -3.68 6.66 0.23 0.93 -4.86 115.26 117.42 3l6g n ASN 399 Ca 0.03 -0.52 -0.10 0.00 -0.53 0.00 0.00 54.58 53.45 3l6g n ASN 399 Cb 0.46 1.43 -0.11 0.00 -2.08 0.00 0.00 39.78 39.48 3l6g n ASN 399 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 3l6g s LEU 400 N -3.62 -0.23 -0.09 -4.53 0.20 -0.91 -0.74 118.68 108.76 3l6g s LEU 400 Ca 0.01 0.89 -0.02 0.00 0.69 0.00 0.00 54.13 55.70 3l6g s LEU 400 Cb 0.14 1.30 -0.03 0.00 -0.43 0.00 0.00 46.19 47.16 3l6g s LEU 400 CO 0.83 -0.20 -0.01 -0.54 -0.29 0.00 0.00 176.35 176.13 3l6g s LYS 401 N 1.77 2.98 0.00 1.98 1.02 -1.26 -0.93 119.74 125.29 3l6g s LYS 401 Ca -0.07 -0.43 0.00 0.00 0.02 0.00 0.00 55.97 55.49 3l6g s LYS 401 Cb -0.10 -2.77 0.00 0.00 -0.52 0.00 0.00 37.83 34.45 3l6g s LYS 401 CO -0.12 0.68 0.00 0.41 -0.92 0.00 0.00 175.35 175.39 3l6g n GLY 402 N 2.21 1.11 3.77 -3.33 0.00 -0.98 -4.61 105.19 103.35 3l6g n GLY 402 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 3l6g n GLY 402 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3l6g s ALA 403 N -2.00 3.24 0.35 4.61 0.00 -0.10 -4.77 121.76 123.10 3l6g s ALA 403 Ca 0.00 1.49 -0.16 0.00 0.00 0.00 0.00 51.96 53.29 3l6g s ALA 403 Cb 0.00 -3.60 0.04 0.00 0.00 0.00 0.00 23.12 19.56 3l6g s ALA 403 CO 0.00 -1.22 0.72 -1.59 0.00 0.00 0.00 175.76 173.67 3l6g s LYS 404 N -2.46 2.05 0.17 0.00 -2.85 -0.90 -0.26 119.74 115.49 3l6g s LYS 404 Ca 0.61 -1.34 0.03 0.00 -1.00 0.00 0.00 55.97 54.27 3l6g s LYS 404 Cb -0.44 0.59 -0.05 0.00 -2.06 0.00 0.00 37.83 35.88 3l6g s LYS 404 CO 0.57 -0.94 -0.04 0.14 0.10 0.00 0.00 175.35 175.18 3l6g s VAL 405 N -2.90 0.91 -1.08 1.79 -7.23 -1.26 -1.40 120.40 109.23 3l6g s VAL 405 Ca 0.16 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 3l6g s VAL 405 Cb -0.05 -2.04 0.00 0.00 0.56 0.00 0.00 36.38 34.85 3l6g s VAL 405 CO 0.11 -0.56 0.00 0.61 -0.31 0.00 0.00 175.10 174.95 3l6g n GLY 406 N -0.25 -1.43 3.72 2.32 0.00 -0.62 -4.81 105.19 104.12 3l6g n GLY 406 Ca -0.08 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.50 3l6g n GLY 406 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3l6g s PHE 407 N -2.26 3.70 0.03 1.61 0.08 -1.26 -0.82 117.98 119.07 3l6g s PHE 407 Ca 0.00 1.59 0.08 0.00 0.12 0.00 0.00 56.93 58.71 3l6g s PHE 407 Cb 0.00 -2.97 -0.02 0.00 -0.57 0.00 0.00 43.02 39.46 3l6g s PHE 407 CO 0.00 0.14 -0.22 0.08 -0.10 0.00 0.00 175.22 175.12 3l6g s VAL 408 N 0.44 1.76 0.09 -0.44 1.01 -0.22 -1.11 120.40 121.93 3l6g s VAL 408 Ca 0.45 -1.18 0.03 0.00 0.00 0.00 0.00 61.98 61.28 3l6g s VAL 408 Cb -0.21 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 3l6g s VAL 408 CO 0.25 0.28 -0.10 0.68 0.00 0.00 0.00 175.10 176.22 3l6g s VAL 409 N -0.75 0.89 0.55 2.92 -7.23 -0.59 -0.99 120.40 115.19 3l6g s VAL 409 Ca 0.08 -1.56 -0.21 0.00 -1.81 0.00 0.00 61.98 58.48 3l6g s VAL 409 Cb -0.09 -1.26 -0.06 0.00 0.56 0.00 0.00 36.38 35.53 3l6g s VAL 409 CO 0.01 -0.53 1.14 -2.65 -0.31 0.00 0.00 175.10 172.77 3l6g n PRO 410 N 0.69 1.30 0.25 4.82 -0.02 -1.26 -1.31 135.00 139.47 3l6g n PRO 410 Ca -0.17 0.48 0.12 0.00 -2.02 0.00 0.00 63.50 61.91 3l6g n PRO 410 Cb 0.57 -2.33 0.67 0.00 -0.02 0.00 0.00 33.50 32.40 3l6g n PRO 410 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3l6g h SER 411 N 1.03 0.00 0.35 2.55 0.02 -1.25 -1.74 113.55 114.52 3l6g h SER 411 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 3l6g h SER 411 Cb 1.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.87 3l6g h SER 411 CO 0.54 0.14 0.00 0.00 -1.14 0.00 0.00 176.83 176.38 3l6g n TYR 412 N -3.58 0.47 -2.81 3.45 0.18 -1.26 -4.67 117.16 108.95 3l6g n TYR 412 Ca -0.01 0.21 -0.40 0.00 1.88 0.00 0.00 57.90 59.57 3l6g n TYR 412 Cb 0.28 -0.84 -0.05 0.00 -0.38 0.00 0.00 39.34 38.35 3l6g n TYR 412 CO 0.00 0.00 0.00 -1.64 -2.08 0.00 0.00 176.86 173.14 3l6g s MET 413 N -3.26 4.69 0.29 -3.48 -1.94 -0.66 -4.98 119.30 109.97 3l6g s MET 413 Ca 0.02 1.36 0.00 0.00 -1.71 0.00 0.00 55.69 55.36 3l6g s MET 413 Cb 0.07 -3.34 0.43 0.00 2.01 0.00 0.00 34.83 34.00 3l6g s MET 413 CO 0.24 0.34 1.80 -0.91 -0.01 0.00 0.00 175.02 176.49 3l6g h ASN 414 N 5.09 0.67 -4.02 3.03 2.35 -1.89 -3.46 115.58 117.35 3l6g h ASN 414 Ca -0.44 -0.15 -0.55 0.00 -0.55 0.00 0.00 56.30 54.61 3l6g h ASN 414 Cb 1.21 -0.18 0.13 0.00 0.05 0.00 0.00 38.32 39.53 3l6g h ASN 414 CO 0.70 0.73 0.66 0.54 -1.65 0.00 0.00 177.43 178.41 3l6g s VAL 415 N -4.99 2.02 0.00 2.81 0.11 -1.26 -4.93 120.40 114.17 3l6g s VAL 415 Ca -0.09 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 58.98 3l6g s VAL 415 Cb 0.15 -3.01 0.00 0.00 -1.53 0.00 0.00 36.38 31.99 3l6g s VAL 415 CO 0.79 0.00 0.00 0.59 -3.33 0.00 0.00 175.10 173.16 3l6g n ASN 416 N -0.68 0.77 -4.03 3.54 3.02 -1.26 -4.98 115.26 111.64 3l6g n ASN 416 Ca 0.08 -0.20 -0.11 0.00 -0.03 0.00 0.00 54.58 54.32 3l6g n ASN 416 Cb 0.43 0.55 -0.11 0.00 -0.61 0.00 0.00 39.78 40.04 3l6g n ASN 416 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3l6g s SER 417 N -0.70 0.61 0.46 6.41 0.15 -1.26 -1.18 113.70 118.19 3l6g s SER 417 Ca 0.00 -0.52 0.12 0.00 0.70 0.00 0.00 55.95 56.25 3l6g s SER 417 Cb 0.00 0.06 1.06 0.00 -1.71 0.00 0.00 66.02 65.43 3l6g s SER 417 CO 0.00 -0.24 2.09 0.40 1.20 0.00 0.00 173.24 176.69 3l6g h ILE 418 N 4.57 1.06 0.00 6.45 2.04 -1.48 -1.17 117.51 128.98 3l6g h ILE 418 Ca -0.34 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.36 3l6g h ILE 418 Cb 1.21 0.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3l6g h ILE 418 CO 0.41 0.07 0.00 -1.84 0.00 0.00 0.00 178.15 176.79 3l6g n GLU 419 N -4.48 0.11 0.00 2.37 0.28 -1.26 -2.60 120.64 115.05 3l6g n GLU 419 Ca -0.00 0.23 0.12 0.00 -0.16 0.00 0.00 57.16 57.34 3l6g n GLU 419 Cb 0.10 -1.66 0.24 0.00 1.43 0.00 0.00 31.44 31.55 3l6g n GLU 419 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 3l6g n ASP 420 N -1.85 1.26 -4.77 -1.84 8.00 -0.44 -4.90 116.55 112.02 3l6g n ASP 420 Ca 0.04 -1.02 -0.39 0.00 0.71 0.00 0.00 54.79 54.14 3l6g n ASP 420 Cb 0.28 0.28 -0.00 0.00 -0.02 0.00 0.00 41.12 41.66 3l6g n ASP 420 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3l6g s LEU 421 N -2.55 4.12 0.00 0.64 1.43 -1.07 -4.92 118.68 116.33 3l6g s LEU 421 Ca 0.21 2.54 0.00 0.00 -1.03 0.00 0.00 54.13 55.85 3l6g s LEU 421 Cb 0.19 -4.05 0.00 0.00 0.03 0.00 0.00 46.19 42.36 3l6g s LEU 421 CO 0.56 -0.93 0.00 0.35 0.23 0.00 0.00 176.35 176.56 3l6g n THR 422 N -0.17 0.00 -0.36 5.49 -2.24 -1.26 -4.81 114.28 110.93 3l6g n THR 422 Ca 0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 3l6g n THR 422 Cb 0.45 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 3l6g n THR 422 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3l6g n ASN 423 N -1.73 1.03 -4.70 3.42 6.94 -1.26 -4.85 115.26 114.11 3l6g n ASN 423 Ca 0.00 -1.39 -0.33 0.00 -0.02 0.00 0.00 54.58 52.84 3l6g n ASN 423 Cb 0.00 0.00 0.13 0.00 -2.36 0.00 0.00 39.78 37.55 3l6g n ASN 423 CO 0.00 0.00 0.00 -1.10 -1.03 0.00 0.00 177.26 175.13 3l6g s GLN 424 N -0.39 1.56 -1.55 -3.83 1.11 -1.26 -3.79 119.66 111.52 3l6g s GLN 424 Ca 0.00 1.70 -0.02 0.00 0.01 0.00 0.00 55.36 57.05 3l6g s GLN 424 Cb 0.00 -1.77 0.01 0.00 -1.01 0.00 0.00 33.01 30.23 3l6g s GLN 424 CO 0.00 -2.26 0.17 0.00 0.01 0.00 0.00 175.29 173.22 3l6g n ALA 425 N -3.45 -0.77 -2.30 6.09 0.00 -1.26 -0.91 120.51 117.91 3l6g n ALA 425 Ca 0.13 0.18 -0.19 0.00 0.00 0.00 0.00 53.44 53.55 3l6g n ALA 425 Cb 0.51 -2.48 -0.02 0.00 0.00 0.00 0.00 19.45 17.46 3l6g n ALA 425 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3l6g n ASN 426 N -2.11 -5.47 -4.09 0.00 5.15 -1.25 -1.83 115.26 105.67 3l6g n ASN 426 Ca -0.18 0.08 -0.32 0.00 -0.60 0.00 0.00 54.58 53.56 3l6g n ASN 426 Cb 0.65 -4.60 -0.02 0.00 -0.53 0.00 0.00 39.78 35.28 3l6g n ASN 426 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 3l6g n LYS 427 N -2.88 -3.60 -5.11 1.20 5.02 -0.09 -4.91 118.16 107.79 3l6g n LYS 427 Ca -0.22 0.42 -0.29 0.00 -2.02 0.00 0.00 58.31 56.20 3l6g n LYS 427 Cb 0.67 -4.99 -0.16 0.00 -0.02 0.00 0.00 35.03 30.53 3l6g n LYS 427 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 3l6g s THR 428 N -3.50 1.85 -0.25 -0.18 2.01 -0.76 -1.39 115.64 113.41 3l6g s THR 428 Ca 0.50 -1.04 -0.08 0.00 0.31 0.00 0.00 61.69 61.38 3l6g s THR 428 Cb -0.27 -1.54 -0.04 0.00 0.01 0.00 0.00 72.50 70.67 3l6g s THR 428 CO 0.90 0.49 0.10 -0.63 -0.69 0.00 0.00 174.62 174.79 3l6g s ILE 429 N -0.58 4.63 -0.63 1.82 -1.09 0.35 -4.42 121.20 121.26 3l6g s ILE 429 Ca 0.09 -0.07 -0.25 0.00 -2.23 0.00 0.00 60.65 58.20 3l6g s ILE 429 Cb -0.09 -3.17 0.05 0.00 -1.58 0.00 0.00 42.46 37.66 3l6g s ILE 429 CO -0.00 0.32 1.06 -0.89 -1.23 0.00 0.00 174.94 174.20 3l6g s THR 430 N 1.58 4.16 0.00 2.92 2.01 0.19 -1.00 115.64 125.50 3l6g s THR 430 Ca 0.06 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.27 3l6g s THR 430 Cb -0.15 -4.70 0.00 0.00 0.01 0.00 0.00 72.50 67.66 3l6g s THR 430 CO 0.06 -1.42 0.00 0.61 -0.69 0.00 0.00 174.62 173.18 3l6g n GLY 431 N 5.23 2.14 0.00 4.40 0.00 -0.33 -2.10 105.19 114.53 3l6g n GLY 431 Ca 0.01 -2.10 0.00 0.00 0.00 0.00 0.00 46.02 43.93 3l6g n GLY 431 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3l6g n ILE 432 N -0.60 0.00 -1.80 -0.61 -5.35 -1.26 -3.38 119.36 106.35 3l6g n ILE 432 Ca 0.00 0.00 -0.41 0.00 -0.27 0.00 0.00 62.75 62.07 3l6g n ILE 432 Cb 0.00 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 37.88 3l6g n ILE 432 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 3l6g s GLU 433 N 3.86 4.14 0.54 6.28 8.01 -1.25 -1.32 118.70 138.96 3l6g s GLU 433 Ca 0.00 2.55 0.24 0.00 0.01 0.00 0.00 54.97 57.77 3l6g s GLU 433 Cb 0.00 -3.03 1.42 0.00 -4.31 0.00 0.00 34.13 28.21 3l6g s GLU 433 CO 0.00 -0.61 2.04 -1.35 0.01 0.00 0.00 175.26 175.35 3l6g h PRO 434 N 4.84 0.00 -0.05 0.39 0.11 -1.95 -1.85 132.00 133.49 3l6g h PRO 434 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3l6g h PRO 434 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3l6g h PRO 434 CO 0.79 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.99 3l6g n GLY 435 N -1.58 -0.52 3.81 -0.55 0.00 -1.26 -4.78 105.19 100.32 3l6g n GLY 435 Ca 0.06 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 3l6g n GLY 435 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3l6g s ALA 436 N -1.93 3.21 0.30 4.61 0.00 -0.70 -4.94 121.76 122.31 3l6g s ALA 436 Ca 0.32 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.63 3l6g s ALA 436 Cb 0.16 -3.04 0.52 0.00 0.00 0.00 0.00 23.12 20.76 3l6g s ALA 436 CO 0.26 0.21 1.93 0.78 0.00 0.00 0.00 175.76 178.94 3l6g h GLY 437 N 2.64 1.26 2.00 0.00 0.00 -1.92 0.65 103.07 107.70 3l6g h GLY 437 Ca -0.48 -0.41 -0.03 0.00 0.00 0.00 0.00 47.33 46.41 3l6g h GLY 437 CO 0.64 0.32 -0.16 -0.24 0.00 0.00 0.00 176.54 177.10 3l6g h VAL 438 N 1.03 0.65 -0.07 4.60 3.04 -1.95 -2.52 116.25 121.03 3l6g h VAL 438 Ca 0.37 -0.68 -0.23 0.00 -1.01 0.00 0.00 66.70 65.14 3l6g h VAL 438 Cb 0.13 1.43 0.01 0.00 -2.01 0.00 0.00 31.29 30.85 3l6g h VAL 438 CO -0.12 0.15 -0.89 0.24 -1.01 0.00 0.00 177.57 175.94 3l6g h MET 439 N 0.00 0.65 -0.47 4.17 2.07 -1.19 -0.22 114.93 119.94 3l6g h MET 439 Ca -0.00 -0.61 0.01 0.00 -2.07 0.00 0.00 59.70 57.03 3l6g h MET 439 Cb 0.42 0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 30.27 3l6g h MET 439 CO 0.02 1.22 0.31 0.00 1.07 0.00 0.00 176.91 179.53 3l6g h ALA 440 N 0.59 0.60 -0.78 6.32 0.00 -1.17 -1.55 119.26 123.27 3l6g h ALA 440 Ca -0.08 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.76 3l6g h ALA 440 Cb 1.52 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 19.09 3l6g h ALA 440 CO 0.17 0.04 0.32 0.00 0.00 0.00 0.00 179.25 179.77 3l6g h ALA 441 N 1.18 1.01 -0.55 0.00 0.00 -1.36 -1.67 119.26 117.86 3l6g h ALA 441 Ca 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3l6g h ALA 441 Cb -0.06 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.40 3l6g h ALA 441 CO -0.05 0.63 0.29 0.77 0.00 0.00 0.00 179.25 180.89 3l6g h SER 442 N 1.12 0.70 -0.30 0.00 0.02 -0.84 0.04 113.55 114.30 3l6g h SER 442 Ca 0.26 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 61.12 3l6g h SER 442 Cb 0.21 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 3l6g h SER 442 CO -0.02 0.61 0.14 -0.33 -1.14 0.00 0.00 176.83 176.09 3l6g h GLU 443 N 0.74 0.29 -0.87 3.45 5.08 -1.00 -0.15 114.58 122.12 3l6g h GLU 443 Ca 0.19 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.56 3l6g h GLU 443 Cb 0.08 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 3l6g h GLU 443 CO -0.03 0.19 0.56 -0.22 -1.00 0.00 0.00 179.01 178.51 3l6g h LYS 444 N 0.29 1.08 -0.76 2.33 3.64 -1.08 -1.87 116.57 120.20 3l6g h LYS 444 Ca 0.12 -0.06 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 3l6g h LYS 444 Cb 0.05 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 31.59 3l6g h LYS 444 CO -0.09 0.71 0.28 1.15 -2.27 0.00 0.00 179.45 179.23 3l6g h THR 445 N 1.11 1.26 0.00 1.00 2.02 -0.44 -1.64 112.91 116.22 3l6g h THR 445 Ca 0.34 -0.84 -0.08 0.00 0.77 0.00 0.00 66.41 66.60 3l6g h THR 445 Cb -0.03 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 66.75 3l6g h THR 445 CO -0.10 0.34 -0.39 -0.07 0.37 0.00 0.00 175.52 175.66 3l6g h LEU 446 N 1.10 0.00 -1.58 2.58 3.38 -0.50 -2.17 115.31 118.12 3l6g h LEU 446 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 3l6g h LEU 446 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3l6g h LEU 446 CO -0.02 0.39 0.00 0.59 0.09 0.00 0.00 178.44 179.49 3l6g n ASN 447 N -3.62 2.35 -0.01 -0.43 3.02 -0.75 -4.31 115.26 111.50 3l6g n ASN 447 Ca -0.01 -1.87 0.01 0.00 -0.03 0.00 0.00 54.58 52.68 3l6g n ASN 447 Cb 0.49 -0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.43 3l6g n ASN 447 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3l6g n SER 448 N 0.77 4.03 -4.59 6.41 7.64 -0.66 -4.98 113.62 122.24 3l6g n SER 448 Ca 0.17 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.69 3l6g n SER 448 Cb 0.41 0.98 -0.10 0.00 -1.01 0.00 0.00 64.21 64.49 3l6g n SER 448 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 3l6g s TYR 449 N -2.22 3.22 0.22 1.43 2.02 -1.02 -4.98 117.35 116.02 3l6g s TYR 449 Ca -0.02 -0.02 -0.08 0.00 -0.37 0.00 0.00 57.07 56.59 3l6g s TYR 449 Cb 0.02 -2.18 0.18 0.00 -0.40 0.00 0.00 41.96 39.59 3l6g s TYR 449 CO 0.17 -0.01 1.84 -0.44 -1.57 0.00 0.00 175.55 175.54 3l6g h ASP 450 N 7.36 1.05 0.43 2.29 3.32 -1.92 -1.61 116.42 127.34 3l6g h ASP 450 Ca -0.37 -0.10 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3l6g h ASP 450 Cb 1.17 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.45 3l6g h ASP 450 CO 0.65 0.85 0.00 -0.55 -1.72 0.00 0.00 179.24 178.47 3l6g h ASN 451 N 1.17 0.00 -0.62 6.45 -1.07 -1.90 -2.70 115.58 116.90 3l6g h ASN 451 Ca 0.29 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.66 3l6g h ASN 451 Cb 0.03 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.28 3l6g h ASN 451 CO -0.05 0.00 0.00 0.18 0.07 0.00 0.00 177.43 177.63 3l6g n LEU 452 N -2.34 3.67 0.04 6.14 4.77 -0.61 -4.59 117.00 124.09 3l6g n LEU 452 Ca 0.00 -1.84 0.09 0.00 -0.03 0.00 0.00 56.01 54.23 3l6g n LEU 452 Cb 0.15 -0.46 0.53 0.00 -2.33 0.00 0.00 43.42 41.31 3l6g n LEU 452 CO 0.16 0.82 1.15 0.50 -1.33 0.00 0.00 177.39 178.69 3l6g h LYS 453 N 3.72 0.29 -0.52 3.23 3.64 -1.59 -2.09 116.57 123.25 3l6g h LYS 453 Ca 0.00 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 3l6g h LYS 453 Cb 0.99 -0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.69 3l6g h LYS 453 CO 0.06 0.19 0.09 -0.25 -2.27 0.00 0.00 179.45 177.27 3l6g n ASP 454 N -4.48 4.67 -4.96 4.20 8.00 -1.26 -4.98 116.55 117.74 3l6g n ASP 454 Ca 0.04 -3.12 -0.23 0.00 0.71 0.00 0.00 54.79 52.20 3l6g n ASP 454 Cb 0.22 -0.66 -0.02 0.00 -0.02 0.00 0.00 41.12 40.64 3l6g n ASP 454 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3l6g s TRP 455 N -2.90 3.46 -0.06 1.24 0.52 -0.79 -4.93 118.94 115.48 3l6g s TRP 455 Ca 0.51 0.05 0.01 0.00 0.02 0.00 0.00 56.10 56.70 3l6g s TRP 455 Cb 0.40 -1.63 0.02 0.00 -1.15 0.00 0.00 33.47 31.11 3l6g s TRP 455 CO 0.12 0.43 -0.08 0.21 0.02 0.00 0.00 176.95 177.65 3l6g s LYS 456 N -3.81 1.23 -0.31 4.98 2.20 -0.49 -5.02 119.74 118.52 3l6g s LYS 456 Ca 0.35 -0.24 -0.24 0.00 -0.36 0.00 0.00 55.97 55.48 3l6g s LYS 456 Cb -0.10 -1.11 0.00 0.00 -1.51 0.00 0.00 37.83 35.12 3l6g s LYS 456 CO 0.29 -0.04 0.81 -1.17 -0.36 0.00 0.00 175.35 174.88 3l6g s LEU 457 N 0.84 4.08 -0.45 5.43 2.96 -1.26 -0.50 118.68 129.78 3l6g s LEU 457 Ca -0.12 0.68 -0.09 0.00 -0.22 0.00 0.00 54.13 54.38 3l6g s LEU 457 Cb -0.15 -3.11 0.10 0.00 0.50 0.00 0.00 46.19 43.53 3l6g s LEU 457 CO 0.01 -0.64 0.30 -0.69 -1.32 0.00 0.00 176.35 174.01 3l6g s VAL 458 N 3.02 4.19 0.66 1.68 1.01 -0.17 -4.95 120.40 125.84 3l6g s VAL 458 Ca 0.33 -1.62 -0.15 0.00 0.00 0.00 0.00 61.98 60.55 3l6g s VAL 458 Cb -0.14 -3.67 -0.00 0.00 0.00 0.00 0.00 36.38 32.57 3l6g s VAL 458 CO 0.13 -0.65 1.10 -2.84 0.00 0.00 0.00 175.10 172.83 3l6g s PRO 459 N 1.38 2.86 0.00 2.72 0.02 -1.26 -1.19 135.00 139.54 3l6g s PRO 459 Ca 0.05 1.32 0.00 0.00 0.02 0.00 0.00 61.00 62.38 3l6g s PRO 459 Cb -0.25 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.31 3l6g s PRO 459 CO 0.00 -1.19 0.00 -1.13 -0.33 0.00 0.00 177.00 174.35 3l6g n SER 460 N -2.46 0.00 -3.88 2.53 3.41 -0.43 -4.87 113.62 107.92 3l6g n SER 460 Ca 0.10 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.63 3l6g n SER 460 Cb 0.52 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.45 3l6g n SER 460 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3l6g s SER 461 N 1.57 -0.23 0.12 4.04 1.04 -1.26 -3.88 113.70 115.10 3l6g s SER 461 Ca 0.00 -0.67 -0.16 0.00 0.48 0.00 0.00 55.95 55.60 3l6g s SER 461 Cb 0.00 0.70 -0.03 0.00 0.10 0.00 0.00 66.02 66.79 3l6g s SER 461 CO 0.00 -1.30 1.62 0.28 0.98 0.00 0.00 173.24 174.82 3l6g h SER 462 N 2.05 0.55 -0.28 7.02 0.02 -1.89 -1.12 113.55 119.90 3l6g h SER 462 Ca -0.21 -0.23 0.02 0.00 -0.84 0.00 0.00 61.79 60.54 3l6g h SER 462 Cb 1.25 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.62 3l6g h SER 462 CO 0.26 0.63 0.14 1.23 -1.14 0.00 0.00 176.83 177.95 3l6g h GLY 463 N 0.44 0.38 1.26 -3.77 0.00 -1.98 -1.93 103.07 97.46 3l6g h GLY 463 Ca 0.11 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.35 3l6g h GLY 463 CO 0.00 0.08 0.50 0.00 0.00 0.00 0.00 176.54 177.12 3l6g h ALA 464 N 1.14 1.45 -0.41 3.60 0.00 -1.91 -1.53 119.26 121.61 3l6g h ALA 464 Ca 0.12 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3l6g h ALA 464 Cb 0.03 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3l6g h ALA 464 CO -0.08 0.51 -0.00 1.98 0.00 0.00 0.00 179.25 181.66 3l6g h MET 465 N 1.03 0.72 -0.06 0.00 4.05 -0.87 -1.37 114.93 118.43 3l6g h MET 465 Ca 0.28 -0.23 -0.15 0.00 -0.28 0.00 0.00 59.70 59.32 3l6g h MET 465 Cb -0.11 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 30.61 3l6g h MET 465 CO -0.06 0.81 -0.62 1.79 0.23 0.00 0.00 176.91 179.06 3l6g h THR 466 N 0.56 1.40 -0.51 -0.77 1.35 -1.10 0.59 112.91 114.42 3l6g h THR 466 Ca 0.12 -2.02 -0.01 0.00 -0.55 0.00 0.00 66.41 63.94 3l6g h THR 466 Cb 0.48 2.04 -0.02 0.00 -1.73 0.00 0.00 68.15 68.92 3l6g h THR 466 CO 0.02 0.59 0.28 0.58 -0.25 0.00 0.00 175.52 176.75 3l6g h VAL 467 N 0.15 1.17 -0.59 6.82 2.07 -1.19 -1.59 116.25 123.10 3l6g h VAL 467 Ca -0.01 -0.44 -0.09 0.00 0.82 0.00 0.00 66.70 66.98 3l6g h VAL 467 Cb 1.12 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 3l6g h VAL 467 CO 0.09 0.18 0.00 0.00 0.02 0.00 0.00 177.57 177.87 3l6g h ALA 468 N 1.12 0.89 -0.55 1.67 0.00 -0.75 -1.95 119.26 119.69 3l6g h ALA 468 Ca 0.18 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.81 3l6g h ALA 468 Cb 0.04 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 3l6g h ALA 468 CO -0.03 0.65 0.33 1.25 0.00 0.00 0.00 179.25 181.46 3l6g h LEU 469 N 0.93 0.55 -0.39 0.00 5.85 -0.68 -1.21 115.31 120.36 3l6g h LEU 469 Ca 0.17 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.87 3l6g h LEU 469 Cb 0.54 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 3l6g h LEU 469 CO 0.03 0.39 0.15 1.23 -0.34 0.00 0.00 178.44 179.90 3l6g h GLY 470 N 0.67 0.63 1.15 3.75 0.00 -0.81 -1.57 103.07 106.88 3l6g h GLY 470 Ca 0.22 -0.35 -0.12 0.00 0.00 0.00 0.00 47.33 47.09 3l6g h GLY 470 CO -0.09 0.33 -0.15 0.83 0.00 0.00 0.00 176.54 177.45 3l6g h GLU 471 N 0.49 0.98 -0.48 4.80 4.39 -1.13 -1.63 114.58 122.00 3l6g h GLU 471 Ca 0.13 -0.38 0.00 0.00 0.34 0.00 0.00 59.36 59.45 3l6g h GLU 471 Cb 0.19 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 3l6g h GLU 471 CO -0.01 1.05 0.30 0.00 -1.16 0.00 0.00 179.01 179.20 3l6g h ALA 472 N 0.95 0.61 -0.27 3.43 0.00 -1.12 -2.53 119.26 120.33 3l6g h ALA 472 Ca 0.13 -0.05 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3l6g h ALA 472 Cb 0.71 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 3l6g h ALA 472 CO 0.05 0.07 -0.41 0.82 0.00 0.00 0.00 179.25 179.78 3l6g h ILE 473 N 0.64 1.30 -0.78 0.00 2.04 -1.01 0.21 117.51 119.91 3l6g h ILE 473 Ca 0.17 -1.59 0.06 0.00 1.00 0.00 0.00 64.86 64.50 3l6g h ILE 473 Cb -0.04 1.53 -0.05 0.00 -0.74 0.00 0.00 36.82 37.52 3l6g h ILE 473 CO -0.04 0.51 0.51 0.50 0.00 0.00 0.00 178.15 179.64 3l6g h LYS 474 N 0.53 0.84 -0.63 2.37 3.64 -1.15 -2.07 116.57 120.11 3l6g h LYS 474 Ca 0.04 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3l6g h LYS 474 Cb 0.94 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 3l6g h LYS 474 CO 0.08 0.55 0.00 1.04 -2.27 0.00 0.00 179.45 178.86 3l6g n GLN 475 N -4.48 3.17 -3.67 1.90 6.02 -0.97 -4.96 117.38 114.40 3l6g n GLN 475 Ca 0.11 -2.68 -0.28 0.00 -0.01 0.00 0.00 57.00 54.15 3l6g n GLN 475 Cb 0.20 -1.67 -0.00 0.00 1.02 0.00 0.00 30.24 29.79 3l6g n GLN 475 CO 0.00 0.00 0.00 1.58 -1.01 0.00 0.00 177.06 177.63 3l6g n HIS 476 N 1.18 -1.90 -3.12 1.08 -0.00 -0.48 -4.96 115.22 107.03 3l6g n HIS 476 Ca 0.23 0.64 -0.29 0.00 0.46 0.00 0.00 57.72 58.76 3l6g n HIS 476 Cb 0.71 -3.23 -0.03 0.00 -0.12 0.00 0.00 29.99 27.33 3l6g n HIS 476 CO 0.00 0.00 0.00 0.15 0.46 0.00 0.00 176.34 176.95 3l6g s LYS 477 N -6.34 3.70 0.28 1.57 -0.14 0.63 -5.02 119.74 114.41 3l6g s LYS 477 Ca 0.54 0.21 -0.29 0.00 -1.36 0.00 0.00 55.97 55.06 3l6g s LYS 477 Cb -0.28 -2.53 -0.10 0.00 -1.68 0.00 0.00 37.83 33.24 3l6g s LYS 477 CO 0.66 0.10 1.28 -0.51 -0.76 0.00 0.00 175.35 176.12 3l6g s ASP 478 N -3.18 6.89 -0.09 2.83 1.01 -1.26 -4.61 116.67 118.26 3l6g s ASP 478 Ca 0.47 2.54 -0.23 0.00 0.71 0.00 0.00 52.55 56.04 3l6g s ASP 478 Cb -0.10 -2.63 0.05 0.00 1.01 0.00 0.00 42.92 41.24 3l6g s ASP 478 CO 0.31 -0.47 0.53 -0.51 0.21 0.00 0.00 175.17 175.24 3l6g s ILE 479 N -0.73 0.02 -0.17 0.77 2.07 -1.26 -4.63 121.20 117.26 3l6g s ILE 479 Ca 0.51 -0.14 0.00 0.00 -1.41 0.00 0.00 60.65 59.61 3l6g s ILE 479 Cb -0.38 -0.82 0.04 0.00 0.13 0.00 0.00 42.46 41.43 3l6g s ILE 479 CO 0.46 -0.08 -0.10 -0.69 -1.91 0.00 0.00 174.94 172.63 3l6g s VAL 480 N -0.77 1.43 0.24 4.00 1.01 -1.26 -4.36 120.40 120.69 3l6g s VAL 480 Ca -0.08 -0.77 0.09 0.00 0.00 0.00 0.00 61.98 61.21 3l6g s VAL 480 Cb -0.03 -1.50 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 3l6g s VAL 480 CO 0.05 0.23 0.02 0.27 0.00 0.00 0.00 175.10 175.68 3l6g s ILE 481 N 1.50 3.63 -0.85 2.22 -4.36 -0.16 -0.64 121.20 122.54 3l6g s ILE 481 Ca 0.01 -1.73 -0.25 0.00 -0.26 0.00 0.00 60.65 58.42 3l6g s ILE 481 Cb -0.15 -2.91 0.02 0.00 1.25 0.00 0.00 42.46 40.67 3l6g s ILE 481 CO -0.09 -0.30 1.51 0.42 0.24 0.00 0.00 174.94 176.72 3l6g s THR 482 N -2.14 3.71 0.42 8.37 -4.23 -0.89 -1.05 115.64 119.83 3l6g s THR 482 Ca 0.30 -0.15 0.03 0.00 -1.18 0.00 0.00 61.69 60.69 3l6g s THR 482 Cb -0.07 -4.72 0.00 0.00 1.34 0.00 0.00 72.50 69.05 3l6g s THR 482 CO 0.20 -1.64 0.61 -0.83 -0.54 0.00 0.00 174.62 172.42 3l6g s GLY 483 N 5.35 1.65 0.11 3.99 0.00 0.00 -4.87 107.32 113.55 3l6g s GLY 483 Ca 0.48 -1.29 -0.17 0.00 0.00 0.00 0.00 44.72 43.74 3l6g s GLY 483 CO 0.04 -1.13 0.42 0.66 0.00 0.00 0.00 173.10 173.09 3l6g s TRP 484 N -2.44 -0.24 0.02 1.90 -2.14 -1.26 -1.58 118.94 113.20 3l6g s TRP 484 Ca 0.49 -0.00 0.01 0.00 2.66 0.00 0.00 56.10 59.25 3l6g s TRP 484 Cb -0.10 0.27 -0.02 0.00 -3.10 0.00 0.00 33.47 30.52 3l6g s TRP 484 CO 0.35 -0.68 -0.04 -1.12 -2.66 0.00 0.00 176.95 172.81 3l6g s SER 485 N -2.60 0.37 0.39 -2.66 0.01 -0.49 -4.09 113.70 104.62 3l6g s SER 485 Ca 0.01 -0.45 -0.25 0.00 1.31 0.00 0.00 55.95 56.57 3l6g s SER 485 Cb 0.01 0.07 -0.09 0.00 0.21 0.00 0.00 66.02 66.22 3l6g s SER 485 CO -0.10 -0.24 1.08 -2.84 0.41 0.00 0.00 173.24 171.55 3l6g s PRO 486 N -1.30 4.16 -0.22 12.44 0.02 -1.26 -2.13 135.00 146.72 3l6g s PRO 486 Ca -0.13 1.60 -0.23 0.00 0.02 0.00 0.00 61.00 62.27 3l6g s PRO 486 Cb -0.09 -2.61 0.06 0.00 0.02 0.00 0.00 34.50 31.88 3l6g s PRO 486 CO -0.01 -0.16 0.64 -1.58 -0.33 0.00 0.00 177.00 175.56 3l6g s HIS 487 N -1.57 -0.69 0.66 6.54 2.46 -1.26 -4.93 115.29 116.50 3l6g s HIS 487 Ca 0.57 1.65 0.43 0.00 0.47 0.00 0.00 55.06 58.17 3l6g s HIS 487 Cb -0.25 0.25 2.36 0.00 -0.13 0.00 0.00 32.58 34.81 3l6g s HIS 487 CO 0.31 -0.36 2.36 0.11 -2.47 0.00 0.00 174.74 174.69 3l6g h TRP 488 N 4.92 0.00 0.00 3.88 5.08 -1.90 -2.58 115.95 125.35 3l6g h TRP 488 Ca -0.28 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.68 3l6g h TRP 488 Cb 1.16 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.32 3l6g h TRP 488 CO 0.39 0.00 -0.03 0.00 -1.28 0.00 0.00 178.44 177.53 3l6g h MET 489 N 0.00 0.00 0.00 0.12 -0.00 -1.95 -0.24 114.93 112.86 3l6g h MET 489 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3l6g h MET 489 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.60 3l6g h MET 489 CO -0.00 0.03 -0.02 0.74 -0.00 0.00 0.00 176.91 177.65 3l6g h PHE 490 N 0.00 0.00 0.13 -0.10 0.04 -1.69 -0.94 116.94 114.39 3l6g h PHE 490 Ca -0.00 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.44 3l6g h PHE 490 Cb 0.05 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 3l6g h PHE 490 CO 0.00 0.02 -1.77 -0.97 -0.60 0.00 0.00 178.31 175.00 3l6g h ASN 491 N 0.00 0.42 -0.45 2.17 -0.73 -1.28 -3.40 115.58 112.32 3l6g h ASN 491 Ca -0.00 -0.90 -0.02 0.00 1.87 0.00 0.00 56.30 57.25 3l6g h ASN 491 Cb 0.69 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 39.12 3l6g h ASN 491 CO 0.00 1.77 0.20 0.50 -0.37 0.00 0.00 177.43 179.53 3l6g h LYS 492 N -0.08 0.66 -5.81 6.67 3.64 -1.08 -3.45 116.57 117.12 3l6g h LYS 492 Ca -0.38 -0.11 -0.62 0.00 -1.27 0.00 0.00 60.65 58.28 3l6g h LYS 492 Cb 1.94 -0.11 -0.13 0.00 -0.41 0.00 0.00 32.23 33.52 3l6g h LYS 492 CO 0.08 0.58 -0.63 0.71 -2.27 0.00 0.00 179.45 177.92 3l6g s TYR 493 N -5.64 2.48 -0.53 1.91 2.02 -0.36 -5.10 117.35 112.13 3l6g s TYR 493 Ca -0.13 -0.58 -0.16 0.00 -0.37 0.00 0.00 57.07 55.83 3l6g s TYR 493 Cb 0.11 -1.61 0.12 0.00 -0.40 0.00 0.00 41.96 40.19 3l6g s TYR 493 CO 0.76 0.49 0.49 0.34 -1.57 0.00 0.00 175.55 176.06 3l6g s ASP 494 N -3.68 6.17 0.33 2.29 -1.08 -1.26 -4.51 116.67 114.94 3l6g s ASP 494 Ca 0.34 -1.75 0.06 0.00 -0.52 0.00 0.00 52.55 50.69 3l6g s ASP 494 Cb 0.06 -2.20 -0.07 0.00 -1.46 0.00 0.00 42.92 39.25 3l6g s ASP 494 CO 0.18 -0.83 -0.01 -0.76 0.52 0.00 0.00 175.17 174.26 3l6g s LEU 495 N 1.60 2.52 -0.01 -1.34 1.43 -1.26 -0.79 118.68 120.82 3l6g s LEU 495 Ca 0.03 -1.29 -0.11 0.00 -1.03 0.00 0.00 54.13 51.73 3l6g s LEU 495 Cb -0.29 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.27 3l6g s LEU 495 CO 0.03 -0.44 0.23 -1.59 0.23 0.00 0.00 176.35 174.82 3l6g s LYS 496 N -3.76 0.57 0.25 1.70 -2.85 -0.43 -4.71 119.74 110.52 3l6g s LYS 496 Ca 0.33 -0.26 -0.30 0.00 -1.00 0.00 0.00 55.97 54.74 3l6g s LYS 496 Cb 0.07 0.25 -0.09 0.00 -2.06 0.00 0.00 37.83 35.99 3l6g s LYS 496 CO 0.15 -0.15 0.94 0.71 0.10 0.00 0.00 175.35 177.10 3l6g s TYR 497 N -1.29 3.96 0.13 1.78 2.02 -1.26 -1.55 117.35 121.13 3l6g s TYR 497 Ca -0.14 1.90 -0.28 0.00 -0.37 0.00 0.00 57.07 58.18 3l6g s TYR 497 Cb -0.06 -2.97 -0.06 0.00 -0.40 0.00 0.00 41.96 38.46 3l6g s TYR 497 CO 0.03 0.43 0.90 -0.51 -1.57 0.00 0.00 175.55 174.83 3l6g s LEU 498 N -1.28 4.53 0.47 -1.29 1.43 -0.27 -4.93 118.68 117.33 3l6g s LEU 498 Ca 0.42 1.73 -0.23 0.00 -1.03 0.00 0.00 54.13 55.02 3l6g s LEU 498 Cb -0.25 -3.49 -0.09 0.00 0.03 0.00 0.00 46.19 42.39 3l6g s LEU 498 CO 0.31 0.02 1.13 0.00 0.23 0.00 0.00 176.35 178.04 3l6g n ALA 499 N 2.44 0.73 -3.36 4.21 0.00 -0.33 -4.67 120.51 119.54 3l6g n ALA 499 Ca -0.00 0.19 -0.26 0.00 0.00 0.00 0.00 53.44 53.37 3l6g n ALA 499 Cb 0.49 -2.18 -0.08 0.00 0.00 0.00 0.00 19.45 17.68 3l6g n ALA 499 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3l6g n ASP 500 N 0.02 2.47 0.28 0.00 2.03 -1.26 -1.33 116.55 118.76 3l6g n ASP 500 Ca 0.09 -3.17 0.13 0.00 0.52 0.00 0.00 54.79 52.36 3l6g n ASP 500 Cb 0.41 -0.66 0.79 0.00 -0.72 0.00 0.00 41.12 40.95 3l6g n ASP 500 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3l6g h PRO 501 N 4.17 0.00 0.00 -0.67 0.13 -2.01 0.20 132.00 133.82 3l6g h PRO 501 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 3l6g h PRO 501 Cb 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 3l6g h PRO 501 CO 0.70 0.07 -0.11 1.63 -0.23 0.00 0.00 178.00 180.06 3l6g n LYS 502 N -3.78 0.02 -1.12 0.86 5.02 -1.26 -4.93 118.16 112.97 3l6g n LYS 502 Ca -0.02 0.01 -0.04 0.00 -2.02 0.00 0.00 58.31 56.24 3l6g n LYS 502 Cb 0.17 -1.52 -0.02 0.00 -0.02 0.00 0.00 35.03 33.65 3l6g n LYS 502 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3l6g n GLY 503 N 1.49 0.63 0.10 0.72 0.00 0.69 -4.89 105.19 103.92 3l6g n GLY 503 Ca 0.07 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 45.96 3l6g n GLY 503 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3l6g n THR 504 N -2.60 0.78 1.02 2.61 -2.24 -1.26 -1.49 114.28 111.09 3l6g n THR 504 Ca -0.04 0.14 0.10 0.00 -2.27 0.00 0.00 64.05 61.98 3l6g n THR 504 Cb 0.28 -1.01 0.32 0.00 -2.10 0.00 0.00 70.33 67.82 3l6g n THR 504 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3l6g n MET 505 N -2.07 1.88 0.00 -0.78 2.81 -1.26 -4.62 117.12 113.07 3l6g n MET 505 Ca 0.03 -1.33 0.00 0.00 -1.81 0.00 0.00 57.70 54.60 3l6g n MET 505 Cb 0.26 -1.40 0.00 0.00 -0.71 0.00 0.00 33.22 31.37 3l6g n MET 505 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3l6g n GLY 506 N 1.19 -0.19 3.95 3.03 0.00 -0.56 -4.59 105.19 108.02 3l6g n GLY 506 Ca 0.16 -1.87 -0.24 0.00 0.00 0.00 0.00 46.02 44.07 3l6g n GLY 506 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3l6g s THR 507 N -1.21 1.85 0.61 2.61 -4.23 -1.26 -4.94 115.64 109.06 3l6g s THR 507 Ca 0.00 -1.31 -0.09 0.00 -1.18 0.00 0.00 61.69 59.11 3l6g s THR 507 Cb 0.00 -2.16 -0.01 0.00 1.34 0.00 0.00 72.50 71.67 3l6g s THR 507 CO 0.00 0.00 0.97 -0.94 -0.54 0.00 0.00 174.62 174.11 3l6g s SER 508 N -4.42 5.88 0.30 3.99 1.04 -1.26 -4.78 113.70 114.45 3l6g s SER 508 Ca 0.44 1.08 0.07 0.00 0.48 0.00 0.00 55.95 58.03 3l6g s SER 508 Cb -0.04 -2.10 -0.06 0.00 0.10 0.00 0.00 66.02 63.92 3l6g s SER 508 CO 0.28 -0.98 -0.07 -1.61 0.98 0.00 0.00 173.24 171.84 3l6g s GLU 509 N -5.10 1.62 0.18 4.02 2.02 0.64 -4.81 118.70 117.29 3l6g s GLU 509 Ca 0.54 -1.83 0.11 0.00 0.02 0.00 0.00 54.97 53.81 3l6g s GLU 509 Cb -0.11 -1.29 -0.04 0.00 0.10 0.00 0.00 34.13 32.79 3l6g s GLU 509 CO 0.50 0.06 -0.23 -0.80 0.02 0.00 0.00 175.26 174.80 3l6g s ASN 510 N -3.49 3.48 -0.12 -0.19 0.01 -0.80 -0.92 114.94 112.91 3l6g s ASN 510 Ca 0.30 -0.83 -0.15 0.00 -0.71 0.00 0.00 52.86 51.48 3l6g s ASN 510 Cb 0.04 -0.28 -0.05 0.00 0.41 0.00 0.00 41.25 41.36 3l6g s ASN 510 CO 0.13 0.13 0.35 -0.63 -1.51 0.00 0.00 177.10 175.57 3l6g s ILE 511 N -1.59 5.24 0.31 0.60 1.01 -0.11 -1.72 121.20 124.94 3l6g s ILE 511 Ca 0.20 0.69 0.09 0.00 0.00 0.00 0.00 60.65 61.63 3l6g s ILE 511 Cb -0.08 -3.69 -0.06 0.00 0.01 0.00 0.00 42.46 38.64 3l6g s ILE 511 CO 0.10 0.41 -0.11 0.20 0.00 0.00 0.00 174.94 175.54 3l6g s ASN 512 N 0.23 3.37 -0.17 3.58 0.01 0.10 -0.05 114.94 122.01 3l6g s ASN 512 Ca 0.20 -1.16 -0.05 0.00 -0.71 0.00 0.00 52.86 51.15 3l6g s ASN 512 Cb -0.14 -0.28 -0.03 0.00 0.41 0.00 0.00 41.25 41.21 3l6g s ASN 512 CO 0.07 -0.20 -0.00 -0.89 -1.51 0.00 0.00 177.10 174.57 3l6g s THR 513 N -2.72 4.12 0.02 1.60 2.01 -0.16 -1.95 115.64 118.56 3l6g s THR 513 Ca 0.31 -0.27 0.07 0.00 0.31 0.00 0.00 61.69 62.10 3l6g s THR 513 Cb 0.01 -2.83 -0.02 0.00 0.01 0.00 0.00 72.50 69.67 3l6g s THR 513 CO 0.14 0.47 -0.21 0.27 -0.69 0.00 0.00 174.62 174.61 3l6g s ILE 514 N 0.51 1.65 0.17 1.82 -4.36 -0.70 -0.75 121.20 119.55 3l6g s ILE 514 Ca -0.01 -1.08 0.06 0.00 -0.26 0.00 0.00 60.65 59.36 3l6g s ILE 514 Cb -0.14 -1.41 -0.05 0.00 1.25 0.00 0.00 42.46 42.12 3l6g s ILE 514 CO 0.02 0.30 -0.12 0.68 0.24 0.00 0.00 174.94 176.06 3l6g s VAL 515 N -0.68 1.43 0.53 8.37 -7.23 -0.54 -1.25 120.40 121.04 3l6g s VAL 515 Ca 0.08 -2.12 -0.21 0.00 -1.81 0.00 0.00 61.98 57.91 3l6g s VAL 515 Cb -0.08 -1.93 -0.05 0.00 0.56 0.00 0.00 36.38 34.87 3l6g s VAL 515 CO 0.01 -0.67 1.22 0.00 -0.31 0.00 0.00 175.10 175.35 3l6g s ARG 516 N -3.68 3.32 0.31 4.82 1.70 -0.27 -1.22 118.95 123.92 3l6g s ARG 516 Ca 0.19 1.89 0.01 0.00 -0.47 0.00 0.00 55.73 57.36 3l6g s ARG 516 Cb 0.01 -2.18 0.56 0.00 -0.57 0.00 0.00 34.95 32.77 3l6g s ARG 516 CO 0.03 -0.95 1.92 0.87 -1.08 0.00 0.00 175.30 176.10 3l6g h LYS 517 N 1.45 0.96 0.00 3.89 1.57 -1.83 -1.88 116.57 120.73 3l6g h LYS 517 Ca -0.50 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.22 3l6g h LYS 517 Cb 1.28 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.37 3l6g h LYS 517 CO 0.57 0.64 0.00 0.41 -0.57 0.00 0.00 179.45 180.50 3l6g n GLY 518 N -1.41 -0.90 0.13 3.86 0.00 -1.26 -4.23 105.19 101.38 3l6g n GLY 518 Ca 0.13 -0.09 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 3l6g n GLY 518 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3l6g h LEU 519 N 0.00 0.30 -0.99 0.99 5.85 -1.71 -0.77 115.31 118.98 3l6g h LEU 519 Ca 0.00 -0.07 0.16 0.00 0.84 0.00 0.00 57.88 58.81 3l6g h LEU 519 Cb 0.17 -0.08 -0.10 0.00 0.37 0.00 0.00 40.66 41.02 3l6g h LEU 519 CO 0.00 0.29 0.61 0.50 -0.34 0.00 0.00 178.44 179.49 3l6g h LYS 520 N 0.29 0.82 0.13 1.25 3.64 -1.81 0.21 116.57 121.10 3l6g h LYS 520 Ca 0.09 -0.05 -0.25 0.00 -1.27 0.00 0.00 60.65 59.17 3l6g h LYS 520 Cb 0.05 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3l6g h LYS 520 CO -0.01 0.54 -1.20 -0.22 -2.27 0.00 0.00 179.45 176.29 3l6g h LYS 521 N 0.84 0.28 0.00 1.90 3.64 -1.80 -3.32 116.57 118.12 3l6g h LYS 521 Ca 0.54 -0.48 -0.21 0.00 -1.27 0.00 0.00 60.65 59.23 3l6g h LYS 521 Cb 0.72 0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.69 3l6g h LYS 521 CO -0.34 1.23 -1.20 0.93 -2.27 0.00 0.00 179.45 177.80 3l6g h GLU 522 N -0.30 0.00 -1.76 1.90 5.08 -0.86 -3.39 114.58 115.24 3l6g h GLU 522 Ca -0.24 0.00 -0.52 0.00 -1.00 0.00 0.00 59.36 57.60 3l6g h GLU 522 Cb 1.74 0.00 -0.36 0.00 0.50 0.00 0.00 28.75 30.63 3l6g h GLU 522 CO 0.11 0.63 -1.03 -1.71 -1.00 0.00 0.00 179.01 176.01 3l6g n ASN 523 N -3.15 -0.21 0.21 1.42 2.85 0.70 -4.98 115.26 112.10 3l6g n ASN 523 Ca -0.06 -2.76 0.05 0.00 -0.11 0.00 0.00 54.58 51.69 3l6g n ASN 523 Cb 0.92 -0.34 0.51 0.00 1.24 0.00 0.00 39.78 42.11 3l6g n ASN 523 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3l6g h PRO 524 N 4.01 0.04 0.33 1.20 0.13 -1.66 -1.78 132.00 134.28 3l6g h PRO 524 Ca 0.04 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.15 3l6g h PRO 524 Cb 0.90 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.02 3l6g h PRO 524 CO 0.44 0.18 -0.16 0.93 -0.23 0.00 0.00 178.00 179.17 3l6g h GLU 525 N 0.04 -0.43 -0.55 0.86 4.39 -1.91 -1.54 114.58 115.44 3l6g h GLU 525 Ca 0.01 0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.69 3l6g h GLU 525 Cb 0.27 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 3l6g h GLU 525 CO 0.02 -0.28 0.15 0.00 -1.16 0.00 0.00 179.01 177.74 3l6g h ALA 526 N 0.21 0.72 -0.54 3.43 0.00 -1.78 -3.14 119.26 118.16 3l6g h ALA 526 Ca -0.05 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 54.73 3l6g h ALA 526 Cb 0.35 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.87 3l6g h ALA 526 CO 0.08 0.41 0.22 -0.92 0.00 0.00 0.00 179.25 179.04 3l6g h TYR 527 N 0.78 0.40 -0.80 0.00 3.20 -1.11 -0.66 116.97 118.77 3l6g h TYR 527 Ca 0.18 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 3l6g h TYR 527 Cb 0.31 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.45 3l6g h TYR 527 CO 0.02 0.15 0.41 0.87 -1.64 0.00 0.00 178.16 177.97 3l6g h LYS 528 N 0.42 1.13 -0.22 1.82 1.57 -1.28 0.40 116.57 120.42 3l6g h LYS 528 Ca 0.26 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 3l6g h LYS 528 Cb 0.26 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3l6g h LYS 528 CO -0.24 0.85 0.05 0.28 -0.57 0.00 0.00 179.45 179.83 3l6g h VAL 529 N 1.12 1.21 -0.21 0.50 2.07 -1.39 -2.71 116.25 116.85 3l6g h VAL 529 Ca 0.28 -0.68 -0.05 0.00 0.82 0.00 0.00 66.70 67.07 3l6g h VAL 529 Cb 0.07 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 3l6g h VAL 529 CO -0.04 0.22 -0.08 -0.07 0.02 0.00 0.00 177.57 177.61 3l6g h LEU 530 N 0.17 0.30 -1.30 2.57 3.38 -0.73 -0.86 115.31 118.84 3l6g h LEU 530 Ca 0.07 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.92 3l6g h LEU 530 Cb 0.28 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3l6g h LEU 530 CO 0.00 0.42 -0.23 -0.78 0.09 0.00 0.00 178.44 177.94 3l6g h ASP 531 N 0.31 0.18 0.00 -0.43 3.58 -0.75 -3.23 116.42 116.08 3l6g h ASP 531 Ca 0.06 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.47 3l6g h ASP 531 Cb 0.34 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.35 3l6g h ASP 531 CO 0.02 0.42 -1.69 0.29 -2.88 0.00 0.00 179.24 175.39 3l6g n LYS 532 N -4.20 0.50 -1.64 0.28 5.02 -0.81 -4.93 118.16 112.37 3l6g n LYS 532 Ca -0.01 -0.14 -0.49 0.00 -2.02 0.00 0.00 58.31 55.65 3l6g n LYS 532 Cb 0.33 -1.50 -0.05 0.00 -0.02 0.00 0.00 35.03 33.79 3l6g n LYS 532 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3l6g n PHE 533 N -2.03 2.01 -3.58 2.13 7.35 -0.39 -4.76 117.46 118.19 3l6g n PHE 533 Ca -0.02 0.39 -0.12 0.00 -0.76 0.00 0.00 57.45 56.94 3l6g n PHE 533 Cb 0.49 -2.47 -0.06 0.00 0.35 0.00 0.00 39.48 37.79 3l6g n PHE 533 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3l6g s ASN 534 N 1.03 -0.46 0.19 -2.13 2.20 -1.26 -4.50 114.94 110.00 3l6g s ASN 534 Ca 0.82 0.61 -0.07 0.00 -0.94 0.00 0.00 52.86 53.28 3l6g s ASN 534 Cb -0.79 0.51 0.03 0.00 -2.00 0.00 0.00 41.25 39.00 3l6g s ASN 534 CO 0.43 -0.36 0.37 -2.67 -2.94 0.00 0.00 177.10 171.92 3l6g n TRP 535 N 1.13 -1.61 -4.32 1.54 4.27 0.08 -5.01 117.44 113.52 3l6g n TRP 535 Ca -0.13 -0.90 -0.25 0.00 -3.89 0.00 0.00 57.50 52.33 3l6g n TRP 535 Cb 0.57 0.43 -0.09 0.00 -1.36 0.00 0.00 31.31 30.87 3l6g n TRP 535 CO 0.00 0.00 0.00 0.95 -2.29 0.00 0.00 177.69 176.35 3l6g s THR 536 N -2.58 2.35 0.22 -1.67 -4.23 -1.26 -4.24 115.64 104.23 3l6g s THR 536 Ca 0.08 -1.87 -0.08 0.00 -1.18 0.00 0.00 61.69 58.64 3l6g s THR 536 Cb -0.02 -2.93 0.16 0.00 1.34 0.00 0.00 72.50 71.05 3l6g s THR 536 CO 0.06 -0.07 1.79 0.71 -0.54 0.00 0.00 174.62 176.56 3l6g h THR 537 N 1.65 0.89 -0.41 3.99 1.35 -1.97 -1.53 112.91 116.88 3l6g h THR 537 Ca -0.43 -0.21 -0.03 0.00 -0.55 0.00 0.00 66.41 65.19 3l6g h THR 537 Cb 1.25 0.23 -0.02 0.00 -1.73 0.00 0.00 68.15 67.88 3l6g h THR 537 CO 0.71 0.11 0.13 0.11 -0.25 0.00 0.00 175.52 176.33 3l6g h LYS 538 N 0.61 0.59 0.09 4.72 1.57 -1.98 0.05 116.57 122.23 3l6g h LYS 538 Ca 0.32 -0.09 -0.00 0.00 -1.87 0.00 0.00 60.65 59.01 3l6g h LYS 538 Cb 0.29 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3l6g h LYS 538 CO -0.23 0.52 -0.04 -0.44 -0.57 0.00 0.00 179.45 178.69 3l6g h ASP 539 N 0.58 -0.10 -0.90 0.86 3.32 -1.77 -1.87 116.42 116.55 3l6g h ASP 539 Ca 0.14 -0.21 0.05 0.00 0.02 0.00 0.00 57.03 57.03 3l6g h ASP 539 Cb 0.18 0.03 -0.06 0.00 0.22 0.00 0.00 39.33 39.70 3l6g h ASP 539 CO -0.01 0.16 0.57 -0.03 -1.72 0.00 0.00 179.24 178.21 3l6g h MET 540 N -0.36 1.04 -0.30 3.56 4.05 -1.06 -2.19 114.93 119.67 3l6g h MET 540 Ca -0.01 -0.06 -0.08 0.00 -0.28 0.00 0.00 59.70 59.27 3l6g h MET 540 Cb 0.30 -0.24 -0.02 0.00 -0.80 0.00 0.00 31.60 30.85 3l6g h MET 540 CO 0.02 0.69 -0.14 0.93 0.23 0.00 0.00 176.91 178.64 3l6g h GLU 541 N 1.07 0.52 -0.03 0.39 5.08 -0.84 0.20 114.58 120.97 3l6g h GLU 541 Ca 0.37 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.57 3l6g h GLU 541 Cb 0.09 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3l6g h GLU 541 CO -0.15 0.65 0.01 0.00 -1.00 0.00 0.00 179.01 178.52 3l6g h ALA 542 N 1.38 0.04 -0.58 3.43 0.00 -0.94 -0.49 119.26 122.11 3l6g h ALA 542 Ca 0.09 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.88 3l6g h ALA 542 Cb 0.52 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 3l6g h ALA 542 CO 0.03 -0.32 0.36 0.28 0.00 0.00 0.00 179.25 179.60 3l6g h VAL 543 N -0.19 1.10 -0.65 0.00 2.07 -1.27 -2.28 116.25 115.02 3l6g h VAL 543 Ca 0.01 -0.25 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 3l6g h VAL 543 Cb 0.26 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 3l6g h VAL 543 CO 0.00 0.13 0.29 0.24 0.02 0.00 0.00 177.57 178.25 3l6g h MET 544 N 0.73 0.94 -0.38 1.57 2.07 -0.78 -2.01 114.93 117.07 3l6g h MET 544 Ca 0.22 -0.14 -0.08 0.00 -2.07 0.00 0.00 59.70 57.63 3l6g h MET 544 Cb -0.02 -0.17 -0.01 0.00 -1.87 0.00 0.00 31.60 29.53 3l6g h MET 544 CO -0.08 0.75 -0.09 1.25 1.07 0.00 0.00 176.91 179.81 3l6g h LEU 545 N 0.93 0.74 -0.75 1.22 5.85 -0.89 -0.38 115.31 122.03 3l6g h LEU 545 Ca 0.22 -0.36 0.11 0.00 0.84 0.00 0.00 57.88 58.69 3l6g h LEU 545 Cb 0.14 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 40.89 3l6g h LEU 545 CO -0.02 0.93 0.38 0.44 -0.34 0.00 0.00 178.44 179.82 3l6g h ASP 546 N 0.54 0.48 -0.26 1.25 5.19 -0.98 -0.56 116.42 122.06 3l6g h ASP 546 Ca 0.10 0.07 -0.09 0.00 -0.62 0.00 0.00 57.03 56.49 3l6g h ASP 546 Cb 0.60 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 3l6g h ASP 546 CO 0.04 0.25 -0.19 0.40 -3.12 0.00 0.00 179.24 176.62 3l6g h ILE 547 N 0.61 1.31 -0.12 0.35 2.04 -1.14 -0.88 117.51 119.68 3l6g h ILE 547 Ca 0.38 -1.32 0.03 0.00 1.00 0.00 0.00 64.86 64.96 3l6g h ILE 547 Cb 0.45 1.58 -0.00 0.00 -0.74 0.00 0.00 36.82 38.11 3l6g h ILE 547 CO -0.30 0.42 0.09 -0.61 0.00 0.00 0.00 178.15 177.74 3l6g h GLN 548 N 0.32 0.00 -0.18 2.37 5.75 -0.66 -1.26 115.11 121.45 3l6g h GLN 548 Ca 0.05 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.55 3l6g h GLN 548 Cb 0.73 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.28 3l6g h GLN 548 CO 0.05 0.00 0.00 0.09 -2.65 0.00 0.00 178.83 176.32 3l6g n ASN 549 N -4.40 1.96 0.00 -0.69 3.02 -0.26 -4.94 115.26 109.95 3l6g n ASN 549 Ca -0.00 -1.74 0.00 0.00 -0.03 0.00 0.00 54.58 52.80 3l6g n ASN 549 Cb 0.21 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 3l6g n ASN 549 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3l6g n GLY 550 N 1.20 1.18 3.77 7.41 0.00 -0.48 -5.05 105.19 113.22 3l6g n GLY 550 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3l6g n GLY 550 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3l6g s LYS 551 N -0.21 4.12 0.64 1.61 -0.14 -0.38 -4.99 119.74 120.40 3l6g s LYS 551 Ca 0.00 1.76 -0.18 0.00 -1.36 0.00 0.00 55.97 56.20 3l6g s LYS 551 Cb 0.00 -2.69 -0.01 0.00 -1.68 0.00 0.00 37.83 33.45 3l6g s LYS 551 CO 0.00 -0.24 1.22 0.95 -0.76 0.00 0.00 175.35 176.52 3l6g s THR 552 N -1.45 2.50 0.33 2.17 -4.23 -1.26 -4.30 115.64 109.40 3l6g s THR 552 Ca 0.56 0.29 0.04 0.00 -1.18 0.00 0.00 61.69 61.41 3l6g s THR 552 Cb -0.29 -3.03 0.30 0.00 1.34 0.00 0.00 72.50 70.81 3l6g s THR 552 CO 0.36 -0.09 1.91 -0.65 -0.54 0.00 0.00 174.62 175.62 3l6g h PRO 553 N 0.52 0.83 -0.45 3.99 0.11 -1.95 0.87 132.00 135.92 3l6g h PRO 553 Ca -0.50 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.55 3l6g h PRO 553 Cb 1.30 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3l6g h PRO 553 CO 0.54 0.55 0.23 0.93 -0.21 0.00 0.00 178.00 180.03 3l6g h GLU 554 N 0.85 0.65 -0.22 1.05 3.07 -1.92 -1.17 114.58 116.88 3l6g h GLU 554 Ca 0.39 -0.09 -0.20 0.00 -0.50 0.00 0.00 59.36 58.95 3l6g h GLU 554 Cb 0.37 -0.12 0.01 0.00 -0.84 0.00 0.00 28.75 28.17 3l6g h GLU 554 CO -0.16 0.54 -0.66 1.05 -1.40 0.00 0.00 179.01 178.38 3l6g h GLU 555 N 0.59 0.83 -0.76 2.33 4.11 -1.69 -1.42 114.58 118.56 3l6g h GLU 555 Ca 0.16 -0.60 0.11 0.00 0.07 0.00 0.00 59.36 59.10 3l6g h GLU 555 Cb 0.10 0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.37 3l6g h GLU 555 CO -0.02 1.22 0.38 0.00 0.07 0.00 0.00 179.01 180.66 3l6g h ALA 556 N 0.63 1.09 -0.26 1.06 0.00 -0.80 -1.11 119.26 119.87 3l6g h ALA 556 Ca -0.02 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 3l6g h ALA 556 Cb 1.28 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3l6g h ALA 556 CO 0.14 -0.06 -0.12 0.00 0.00 0.00 0.00 179.25 179.22 3l6g h ALA 557 N 1.48 0.36 -0.74 0.00 0.00 -1.06 -1.68 119.26 117.61 3l6g h ALA 557 Ca 0.39 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3l6g h ALA 557 Cb 0.46 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3l6g h ALA 557 CO -0.30 0.22 0.26 0.87 0.00 0.00 0.00 179.25 180.29 3l6g h LYS 558 N 0.26 1.14 -0.38 0.00 1.57 -1.01 0.54 116.57 118.69 3l6g h LYS 558 Ca 0.06 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.56 3l6g h LYS 558 Cb 0.62 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 3l6g h LYS 558 CO 0.04 0.95 0.06 -0.91 -0.57 0.00 0.00 179.45 179.01 3l6g h ASN 559 N 1.10 0.61 -0.69 0.86 4.21 -1.11 -0.99 115.58 119.57 3l6g h ASN 559 Ca 0.24 -0.26 -0.03 0.00 1.21 0.00 0.00 56.30 57.46 3l6g h ASN 559 Cb 0.27 -0.16 -0.03 0.00 -1.12 0.00 0.00 38.32 37.28 3l6g h ASN 559 CO -0.01 0.72 0.33 -0.25 -1.29 0.00 0.00 177.43 176.92 3l6g h TRP 560 N 0.47 1.00 -0.41 1.19 7.01 -0.75 -2.63 115.95 121.84 3l6g h TRP 560 Ca 0.11 -0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.05 3l6g h TRP 560 Cb 0.37 -0.31 -0.02 0.00 -2.10 0.00 0.00 29.16 27.10 3l6g h TRP 560 CO 0.03 0.75 0.19 0.82 -2.79 0.00 0.00 178.44 177.44 3l6g h ILE 561 N 0.97 1.18 -0.72 2.65 2.04 -0.60 -2.35 117.51 120.68 3l6g h ILE 561 Ca 0.24 -0.52 0.10 0.00 1.00 0.00 0.00 64.86 65.68 3l6g h ILE 561 Cb 0.13 0.77 -0.08 0.00 -0.74 0.00 0.00 36.82 36.90 3l6g h ILE 561 CO -0.03 0.20 0.35 0.11 0.00 0.00 0.00 178.15 178.77 3l6g h LYS 562 N 0.52 0.56 0.00 2.37 1.57 -1.01 -0.52 116.57 120.06 3l6g h LYS 562 Ca 0.14 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3l6g h LYS 562 Cb 0.13 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3l6g h LYS 562 CO -0.02 0.37 0.00 -0.25 -0.57 0.00 0.00 179.45 178.98 3l6g n ASP 563 N -4.89 0.00 -2.62 0.86 8.00 -0.94 -3.78 116.55 113.20 3l6g n ASP 563 Ca 0.12 -0.02 -0.03 0.00 0.71 0.00 0.00 54.79 55.57 3l6g n ASP 563 Cb 0.30 -0.31 0.05 0.00 -0.02 0.00 0.00 41.12 41.13 3l6g n ASP 563 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3l6g n HIS 564 N -1.31 1.38 -0.37 1.24 8.25 -0.28 -4.91 115.22 119.22 3l6g n HIS 564 Ca 0.12 -2.04 -0.02 0.00 -0.26 0.00 0.00 57.72 55.51 3l6g n HIS 564 Cb 0.22 -0.24 0.11 0.00 1.12 0.00 0.00 29.99 31.20 3l6g n HIS 564 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 3l6g h GLN 565 N 2.43 1.30 -0.84 -0.41 5.75 -1.45 -1.47 115.11 120.43 3l6g h GLN 565 Ca -0.07 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.31 3l6g h GLN 565 Cb 1.34 -0.29 -0.04 0.00 1.07 0.00 0.00 27.48 29.57 3l6g h GLN 565 CO 0.26 0.87 0.40 -0.22 -2.65 0.00 0.00 178.83 177.48 3l6g h LYS 566 N 1.34 1.21 -0.31 1.69 3.64 -1.91 -0.78 116.57 121.45 3l6g h LYS 566 Ca 0.36 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.50 3l6g h LYS 566 Cb -0.14 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.45 3l6g h LYS 566 CO -0.08 0.94 -0.04 0.93 -2.27 0.00 0.00 179.45 178.93 3l6g h GLU 567 N 1.20 0.58 -0.26 1.90 3.07 -1.73 -3.01 114.58 116.33 3l6g h GLU 567 Ca 0.29 -0.20 -0.02 0.00 -0.50 0.00 0.00 59.36 58.92 3l6g h GLU 567 Cb 0.13 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 3l6g h GLU 567 CO -0.04 0.74 0.07 0.28 -1.40 0.00 0.00 179.01 178.67 3l6g h VAL 568 N 0.36 1.21 -0.10 3.13 2.07 -1.05 -2.89 116.25 118.98 3l6g h VAL 568 Ca 0.08 -0.67 0.03 0.00 0.82 0.00 0.00 66.70 66.96 3l6g h VAL 568 Cb 0.51 1.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.44 3l6g h VAL 568 CO 0.02 0.22 0.11 0.44 0.02 0.00 0.00 177.57 178.38 3l6g h ASP 569 N 0.24 0.00 -0.01 0.57 3.32 -1.09 -1.93 116.42 117.52 3l6g h ASP 569 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3l6g h ASP 569 Cb 0.27 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.82 3l6g h ASP 569 CO -0.00 0.00 0.01 0.11 -1.72 0.00 0.00 179.24 177.64 3l6g h LYS 570 N 0.00 0.00 0.00 3.56 1.57 -1.37 -1.53 116.57 118.80 3l6g h LYS 570 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3l6g h LYS 570 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 3l6g h LYS 570 CO -0.00 0.00 0.00 0.91 -0.57 0.00 0.00 179.45 179.79 3l6g n TRP 571 N -4.36 0.43 -0.04 -1.35 8.01 -0.73 -3.39 117.44 116.01 3l6g n TRP 571 Ca -0.03 0.17 0.03 0.00 -1.31 0.00 0.00 57.50 56.36 3l6g n TRP 571 Cb 0.10 -0.78 0.07 0.00 -2.01 0.00 0.00 31.31 28.68 3l6g n TRP 571 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.69 177.87 3l6g n PHE 572 N -1.90 0.19 -3.98 -5.99 3.01 -0.58 -4.09 117.46 104.13 3l6g n PHE 572 Ca 0.03 -0.44 -0.10 0.00 1.01 0.00 0.00 57.45 57.95 3l6g n PHE 572 Cb 0.19 -0.03 -0.07 0.00 -0.01 0.00 0.00 39.48 39.55 3l6g n PHE 572 CO 0.00 0.00 0.00 -1.59 1.01 0.00 0.00 176.76 176.18 3l6g s LYS 573 N -0.93 1.16 0.00 -1.08 -2.85 -1.22 -5.04 119.74 109.78 3l6g s LYS 573 Ca 0.10 -1.21 0.00 0.00 -1.00 0.00 0.00 55.97 53.87 3l6g s LYS 573 Cb 0.05 0.37 0.00 0.00 -2.06 0.00 0.00 37.83 36.20 3l6g s LYS 573 CO 0.07 -0.42 0.00 0.41 0.10 0.00 0.00 175.35 175.51 3l6g n GLY 574 N -0.22 -0.08 0.00 0.59 0.00 -1.26 -4.93 105.19 99.29 3l6g n GLY 574 Ca -0.07 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.31 3l6g n GLY 574 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06