#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o2r s ILE 406 N 0.00 5.06 0.07 2.52 1.01 -1.26 -5.08 121.20 123.51 2o2r s ILE 406 Ca 0.00 0.04 -0.30 0.00 0.00 0.00 0.00 60.65 60.39 2o2r s ILE 406 Cb 0.00 -3.20 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 2o2r s ILE 406 CO 0.00 0.58 1.11 0.20 0.00 0.00 0.00 174.94 176.83 2o2r s ASN 407 N -0.65 7.21 0.23 3.58 0.02 -1.26 -5.05 114.94 119.01 2o2r s ASN 407 Ca 0.12 1.92 0.11 0.00 -1.02 0.00 0.00 52.86 53.99 2o2r s ASN 407 Cb -0.12 -2.58 -0.05 0.00 0.02 0.00 0.00 41.25 38.52 2o2r s ASN 407 CO 0.02 -0.36 -0.21 -0.31 0.02 0.00 0.00 177.10 176.27 2o2r s TYR 408 N 0.79 2.19 -0.35 2.20 2.02 -1.26 -4.37 117.35 118.57 2o2r s TYR 408 Ca 0.55 -0.38 -0.15 0.00 -0.37 0.00 0.00 57.07 56.72 2o2r s TYR 408 Cb -0.27 -1.01 -0.01 0.00 -0.40 0.00 0.00 41.96 40.27 2o2r s TYR 408 CO 0.30 0.57 0.33 0.08 -1.57 0.00 0.00 175.55 175.26 2o2r s VAL 409 N -2.24 5.20 0.03 0.71 1.01 0.54 -4.88 120.40 120.77 2o2r s VAL 409 Ca 0.25 -0.09 -0.17 0.00 0.00 0.00 0.00 61.98 61.96 2o2r s VAL 409 Cb -0.06 -3.81 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 2o2r s VAL 409 CO 0.12 -0.10 0.49 -0.70 0.00 0.00 0.00 175.10 174.90 2o2r s GLU 410 N 1.92 4.07 -0.17 2.72 2.12 -1.26 -1.43 118.70 126.67 2o2r s GLU 410 Ca 0.10 0.58 -0.09 0.00 0.36 0.00 0.00 54.97 55.92 2o2r s GLU 410 Cb -0.17 -3.23 0.06 0.00 0.26 0.00 0.00 34.13 31.05 2o2r s GLU 410 CO 0.11 0.65 0.41 0.21 -0.54 0.00 0.00 175.26 176.10 2o2r s LYS 411 N -1.05 0.38 -0.36 4.30 2.20 -0.93 -4.99 119.74 119.28 2o2r s LYS 411 Ca 0.26 0.82 -0.17 0.00 -0.36 0.00 0.00 55.97 56.52 2o2r s LYS 411 Cb -0.18 0.03 -0.00 0.00 -1.51 0.00 0.00 37.83 36.16 2o2r s LYS 411 CO 0.16 -0.17 0.48 0.00 -0.36 0.00 0.00 175.35 175.45 2o2r s ALA 412 N 1.60 3.47 0.02 3.13 0.00 -1.26 -0.07 121.76 128.64 2o2r s ALA 412 Ca -0.08 -1.13 -0.24 0.00 0.00 0.00 0.00 51.96 50.51 2o2r s ALA 412 Cb -0.09 -2.99 0.05 0.00 0.00 0.00 0.00 23.12 20.09 2o2r s ALA 412 CO -0.13 -1.27 0.54 0.14 0.00 0.00 0.00 175.76 175.05 2o2r s VAL 413 N 2.30 0.02 -1.37 0.00 -7.23 -0.69 -4.94 120.40 108.50 2o2r s VAL 413 Ca 0.17 -0.20 -0.05 0.00 -1.81 0.00 0.00 61.98 60.09 2o2r s VAL 413 Cb -0.16 -0.95 0.03 0.00 0.56 0.00 0.00 36.38 35.86 2o2r s VAL 413 CO 0.13 -0.11 0.38 -3.20 -0.31 0.00 0.00 175.10 171.99 2o2r n ASN 414 N 0.57 -4.76 -1.78 4.85 5.15 -1.26 -1.41 115.26 116.62 2o2r n ASN 414 Ca -0.19 -0.19 -0.16 0.00 -0.60 0.00 0.00 54.58 53.44 2o2r n ASN 414 Cb 0.59 -3.92 -0.01 0.00 -0.53 0.00 0.00 39.78 35.91 2o2r n ASN 414 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2o2r n LYS 415 N -3.56 -1.26 -4.15 1.20 5.02 -1.26 -4.98 118.16 109.16 2o2r n LYS 415 Ca -0.10 0.79 -0.10 0.00 -2.02 0.00 0.00 58.31 56.88 2o2r n LYS 415 Cb 0.60 -5.16 -0.10 0.00 -0.02 0.00 0.00 35.03 30.34 2o2r n LYS 415 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2o2r s LEU 416 N -4.53 2.43 -0.39 -0.35 1.43 -0.50 -5.11 118.68 111.66 2o2r s LEU 416 Ca 0.00 -1.03 -0.08 0.00 -1.03 0.00 0.00 54.13 51.99 2o2r s LEU 416 Cb 0.00 0.04 0.06 0.00 0.03 0.00 0.00 46.19 46.32 2o2r s LEU 416 CO 0.00 -0.53 0.20 -0.89 0.23 0.00 0.00 176.35 175.36 2o2r s THR 417 N -3.75 4.04 0.26 5.49 2.01 -1.26 -1.70 115.64 120.73 2o2r s THR 417 Ca 0.12 -1.32 -0.30 0.00 0.31 0.00 0.00 61.69 60.51 2o2r s THR 417 Cb 0.06 -3.42 -0.09 0.00 0.01 0.00 0.00 72.50 69.06 2o2r s THR 417 CO -0.05 -0.39 1.09 -0.76 -0.69 0.00 0.00 174.62 173.81 2o2r s LEU 418 N 1.41 4.55 -0.32 4.42 1.43 0.89 -4.91 118.68 126.15 2o2r s LEU 418 Ca 0.02 2.21 0.02 0.00 -1.03 0.00 0.00 54.13 55.35 2o2r s LEU 418 Cb -0.22 -3.62 0.09 0.00 0.03 0.00 0.00 46.19 42.48 2o2r s LEU 418 CO 0.02 -0.14 0.05 -1.10 0.23 0.00 0.00 176.35 175.41 2o2r s GLN 419 N -1.21 1.29 -0.31 1.70 -1.52 -1.26 -2.20 119.66 116.15 2o2r s GLN 419 Ca 0.45 -1.53 -0.05 0.00 -1.95 0.00 0.00 55.36 52.28 2o2r s GLN 419 Cb -0.31 -2.77 0.03 0.00 -0.22 0.00 0.00 33.01 29.75 2o2r s GLN 419 CO 0.39 -0.91 0.06 -1.64 -0.25 0.00 0.00 175.29 172.95 2o2r s MET 420 N 1.17 2.70 0.75 2.91 -1.94 -0.51 -4.91 119.30 119.47 2o2r s MET 420 Ca 0.08 -1.11 -0.14 0.00 -1.71 0.00 0.00 55.69 52.81 2o2r s MET 420 Cb -0.18 -3.34 0.05 0.00 2.01 0.00 0.00 34.83 33.36 2o2r s MET 420 CO -0.13 -0.59 1.18 -2.14 -0.01 0.00 0.00 175.02 173.34 2o2r s PRO 421 N 1.39 2.07 0.00 2.03 0.02 -1.26 -0.34 135.00 138.90 2o2r s PRO 421 Ca -0.01 1.66 0.00 0.00 0.02 0.00 0.00 61.00 62.67 2o2r s PRO 421 Cb -0.19 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.50 2o2r s PRO 421 CO 0.01 -1.87 0.18 2.48 -0.33 0.00 0.00 177.00 177.47 2o2r n TYR 422 N -2.93 0.00 -2.99 6.54 4.11 -1.26 -4.71 117.16 115.91 2o2r n TYR 422 Ca 0.13 0.00 -0.18 0.00 -0.00 0.00 0.00 57.90 57.85 2o2r n TYR 422 Cb 0.51 0.01 0.02 0.00 -0.00 0.00 0.00 39.34 39.87 2o2r n TYR 422 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.86 176.21 2o2r s GLN 423 N 0.00 2.74 0.42 -3.48 -0.21 -1.26 -1.12 119.66 116.76 2o2r s GLN 423 Ca 0.00 -1.27 -0.25 0.00 0.02 0.00 0.00 55.36 53.86 2o2r s GLN 423 Cb 0.00 -2.73 -0.08 0.00 1.00 0.00 0.00 33.01 31.20 2o2r s GLN 423 CO 0.00 -0.37 1.27 -0.51 -2.12 0.00 0.00 175.29 173.55 2o2r s LEU 424 N -4.41 4.16 -0.34 2.90 1.43 -0.26 -4.76 118.68 117.38 2o2r s LEU 424 Ca 0.56 2.56 -0.05 0.00 -1.03 0.00 0.00 54.13 56.18 2o2r s LEU 424 Cb -0.09 -3.99 0.05 0.00 0.03 0.00 0.00 46.19 42.18 2o2r s LEU 424 CO 0.34 -0.88 0.10 0.12 0.23 0.00 0.00 176.35 176.26 2o2r s PHE 425 N -1.32 3.30 -0.06 0.29 5.36 -0.42 -0.76 117.98 124.37 2o2r s PHE 425 Ca 0.59 -1.66 -0.00 0.00 -0.96 0.00 0.00 56.93 54.90 2o2r s PHE 425 Cb -0.36 -2.39 0.03 0.00 -0.34 0.00 0.00 43.02 39.96 2o2r s PHE 425 CO 0.45 -0.79 -0.01 0.42 -1.46 0.00 0.00 175.22 173.83 2o2r s ILE 426 N 1.34 0.38 -1.46 3.12 1.01 -0.23 -0.25 121.20 125.11 2o2r s ILE 426 Ca -0.01 0.05 -0.11 0.00 0.00 0.00 0.00 60.65 60.57 2o2r s ILE 426 Cb -0.20 -0.49 0.05 0.00 0.01 0.00 0.00 42.46 41.83 2o2r s ILE 426 CO 0.01 0.23 1.05 0.61 0.00 0.00 0.00 174.94 176.84 2o2r n GLY 427 N 4.66 -0.52 2.13 6.18 0.00 -1.26 -1.67 105.19 114.71 2o2r n GLY 427 Ca -0.15 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2o2r n GLY 427 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o2r n GLY 428 N -1.81 0.58 3.12 -0.02 0.00 -1.26 -4.36 105.19 101.44 2o2r n GLY 428 Ca 0.02 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 2o2r n GLY 428 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o2r s GLU 429 N -0.01 1.14 -0.12 1.61 2.02 -0.67 -5.03 118.70 117.64 2o2r s GLU 429 Ca 0.00 -0.56 -0.23 0.00 0.02 0.00 0.00 54.97 54.20 2o2r s GLU 429 Cb 0.00 -1.12 -0.03 0.00 0.10 0.00 0.00 34.13 33.08 2o2r s GLU 429 CO 0.00 0.30 0.68 -0.06 0.02 0.00 0.00 175.26 176.20 2o2r s PHE 430 N -0.42 3.50 0.02 1.61 0.40 -1.26 -1.06 117.98 120.76 2o2r s PHE 430 Ca 0.05 1.14 -0.04 0.00 -0.60 0.00 0.00 56.93 57.48 2o2r s PHE 430 Cb -0.06 -2.81 -0.01 0.00 0.51 0.00 0.00 43.02 40.65 2o2r s PHE 430 CO -0.00 -0.01 0.06 0.14 0.70 0.00 0.00 175.22 176.10 2o2r s VAL 431 N 1.24 0.11 0.70 -0.44 -7.23 0.06 -4.94 120.40 109.89 2o2r s VAL 431 Ca 0.34 -0.88 -0.13 0.00 -1.81 0.00 0.00 61.98 59.50 2o2r s VAL 431 Cb -0.17 -0.47 0.02 0.00 0.56 0.00 0.00 36.38 36.32 2o2r s VAL 431 CO 0.15 -0.48 1.10 -1.81 -0.31 0.00 0.00 175.10 173.74 2o2r s ASP 432 N -1.58 4.93 1.03 4.85 1.01 -1.26 -1.11 116.67 124.54 2o2r s ASP 432 Ca -0.13 1.92 -0.12 0.00 0.71 0.00 0.00 52.55 54.92 2o2r s ASP 432 Cb -0.07 -2.54 0.21 0.00 1.01 0.00 0.00 42.92 41.53 2o2r s ASP 432 CO -0.01 -1.75 1.07 0.00 0.21 0.00 0.00 175.17 174.70 2o2r s ALA 433 N -2.57 0.63 0.20 5.23 0.00 -1.26 -4.85 121.76 119.14 2o2r s ALA 433 Ca 0.64 -0.15 -0.33 0.00 0.00 0.00 0.00 51.96 52.13 2o2r s ALA 433 Cb -0.19 -3.20 -0.13 0.00 0.00 0.00 0.00 23.12 19.60 2o2r s ALA 433 CO 0.47 -3.07 1.62 -1.91 0.00 0.00 0.00 175.76 172.86 2o2r n GLU 434 N -4.37 2.42 -2.04 0.00 2.13 -1.26 -1.75 120.64 115.76 2o2r n GLU 434 Ca 0.05 0.87 -0.18 0.00 0.66 0.00 0.00 57.16 58.57 2o2r n GLU 434 Cb 0.55 -2.66 -0.03 0.00 0.27 0.00 0.00 31.44 29.57 2o2r n GLU 434 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2o2r n GLY 435 N 3.41 0.40 2.89 8.31 0.00 -1.26 -3.35 105.19 115.59 2o2r n GLY 435 Ca 0.15 -0.14 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 2o2r n GLY 435 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2o2r n SER 436 N -1.23 -2.17 -4.75 1.61 7.64 -0.72 -4.92 113.62 109.09 2o2r n SER 436 Ca -0.20 0.07 -0.38 0.00 1.01 0.00 0.00 58.87 59.37 2o2r n SER 436 Cb 0.63 -1.91 0.03 0.00 -1.01 0.00 0.00 64.21 61.96 2o2r n SER 436 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2o2r s LYS 437 N -5.46 3.20 0.25 1.43 1.02 -1.21 -4.87 119.74 114.10 2o2r s LYS 437 Ca 0.17 2.05 -0.06 0.00 0.02 0.00 0.00 55.97 58.15 2o2r s LYS 437 Cb -0.10 -2.20 -0.02 0.00 -0.52 0.00 0.00 37.83 35.00 2o2r s LYS 437 CO 0.21 -1.08 0.34 0.95 -0.92 0.00 0.00 175.35 174.85 2o2r s THR 438 N -1.41 0.00 0.21 2.17 -4.23 -1.26 -1.76 115.64 109.36 2o2r s THR 438 Ca 0.72 -1.68 -0.08 0.00 -1.18 0.00 0.00 61.69 59.47 2o2r s THR 438 Cb -0.36 -2.39 -0.02 0.00 1.34 0.00 0.00 72.50 71.07 2o2r s THR 438 CO 0.42 0.00 0.32 -0.72 -0.54 0.00 0.00 174.62 174.10 2o2r s TYR 439 N -3.89 0.62 -0.10 3.99 -0.85 -0.46 -4.77 117.35 111.88 2o2r s TYR 439 Ca 0.31 -0.94 -0.13 0.00 -0.52 0.00 0.00 57.07 55.79 2o2r s TYR 439 Cb 0.02 -0.10 -0.05 0.00 0.38 0.00 0.00 41.96 42.21 2o2r s TYR 439 CO 0.13 -0.82 0.31 -0.80 -1.52 0.00 0.00 175.55 172.85 2o2r s ASN 440 N -3.05 6.57 -0.14 -0.18 0.01 -1.26 -0.71 114.94 116.17 2o2r s ASN 440 Ca 0.26 0.67 -0.07 0.00 -0.71 0.00 0.00 52.86 53.01 2o2r s ASN 440 Cb 0.03 -2.19 -0.04 0.00 0.41 0.00 0.00 41.25 39.45 2o2r s ASN 440 CO 0.08 0.23 0.10 0.28 -1.51 0.00 0.00 177.10 176.28 2o2r s THR 441 N -0.31 5.19 -0.11 1.60 -1.32 -0.75 -4.97 115.64 114.96 2o2r s THR 441 Ca 0.19 0.10 -0.01 0.00 -1.21 0.00 0.00 61.69 60.76 2o2r s THR 441 Cb -0.14 -3.29 -0.03 0.00 -1.51 0.00 0.00 72.50 67.53 2o2r s THR 441 CO 0.07 0.55 -0.06 -0.63 -2.21 0.00 0.00 174.62 172.34 2o2r s ILE 442 N -0.48 3.71 -0.31 5.08 -1.09 -1.26 -0.44 121.20 126.41 2o2r s ILE 442 Ca 0.11 -0.45 -0.25 0.00 -2.23 0.00 0.00 60.65 57.83 2o2r s ILE 442 Cb -0.12 -2.56 0.00 0.00 -1.58 0.00 0.00 42.46 38.20 2o2r s ILE 442 CO 0.02 0.55 0.86 0.21 -1.23 0.00 0.00 174.94 175.35 2o2r s ASN 443 N -0.21 6.74 0.00 3.58 3.84 0.20 -4.83 114.94 124.26 2o2r s ASN 443 Ca 0.03 0.78 0.20 0.00 0.21 0.00 0.00 52.86 54.08 2o2r s ASN 443 Cb -0.13 -2.44 0.87 0.00 -0.55 0.00 0.00 41.25 39.00 2o2r s ASN 443 CO 0.03 -0.68 1.64 -0.81 -2.79 0.00 0.00 177.10 174.49 2o2r n PRO 444 N 6.36 0.04 0.13 0.43 -0.04 -1.26 -0.49 135.00 140.17 2o2r n PRO 444 Ca 0.06 0.15 -0.01 0.00 -0.04 0.00 0.00 63.50 63.66 2o2r n PRO 444 Cb 0.48 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.57 2o2r n PRO 444 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2o2r h THR 445 N 0.00 1.36 0.00 0.52 2.02 -1.90 -0.19 112.91 114.72 2o2r h THR 445 Ca 0.00 -2.27 0.00 0.00 0.77 0.00 0.00 66.41 64.91 2o2r h THR 445 Cb 0.32 2.26 0.00 0.00 -1.74 0.00 0.00 68.15 68.99 2o2r h THR 445 CO 0.00 0.63 0.00 -0.90 0.37 0.00 0.00 175.52 175.62 2o2r n ASP 446 N -3.63 0.00 0.00 4.18 3.85 -1.17 -3.21 116.55 116.57 2o2r n ASP 446 Ca -0.01 -1.00 0.00 0.00 -0.71 0.00 0.00 54.79 53.07 2o2r n ASP 446 Cb 0.67 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.44 2o2r n ASP 446 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2o2r n GLY 447 N 0.00 0.91 3.80 6.12 0.00 0.35 -4.29 105.19 112.09 2o2r n GLY 447 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2o2r n GLY 447 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2o2r s SER 448 N -2.83 5.49 -0.06 1.61 1.04 -1.22 -4.70 113.70 113.03 2o2r s SER 448 Ca 0.00 1.76 -0.30 0.00 0.48 0.00 0.00 55.95 57.89 2o2r s SER 448 Cb 0.00 -2.52 -0.02 0.00 0.10 0.00 0.00 66.02 63.58 2o2r s SER 448 CO 0.00 -1.37 1.04 -0.69 0.98 0.00 0.00 173.24 173.21 2o2r s VAL 449 N -2.69 4.68 -0.12 5.02 1.01 -1.26 -0.62 120.40 126.41 2o2r s VAL 449 Ca 0.62 1.94 -0.28 0.00 0.00 0.00 0.00 61.98 64.26 2o2r s VAL 449 Cb -0.16 -4.25 -0.25 0.00 0.00 0.00 0.00 36.38 31.73 2o2r s VAL 449 CO 0.45 0.05 0.83 0.40 0.00 0.00 0.00 175.10 176.83 2o2r h ILE 450 N 4.97 1.72 -2.23 2.22 2.04 -1.10 -3.47 117.51 121.66 2o2r h ILE 450 Ca -0.35 -2.17 0.22 0.00 1.00 0.00 0.00 64.86 63.57 2o2r h ILE 450 Cb 1.17 3.20 -0.04 0.00 -0.74 0.00 0.00 36.82 40.41 2o2r h ILE 450 CO 0.83 0.56 0.66 0.00 0.00 0.00 0.00 178.15 180.20 2o2r s GLN 452 N -2.03 3.58 -0.02 0.00 1.11 -1.26 -1.82 119.66 119.23 2o2r s GLN 452 Ca 0.23 0.01 0.06 0.00 0.01 0.00 0.00 55.36 55.67 2o2r s GLN 452 Cb -0.02 -3.17 -0.01 0.00 -1.01 0.00 0.00 33.01 28.80 2o2r s GLN 452 CO 0.02 0.73 -0.19 0.08 0.01 0.00 0.00 175.29 175.94 2o2r s VAL 453 N -1.10 1.51 0.41 1.09 1.01 0.11 -4.85 120.40 118.58 2o2r s VAL 453 Ca 0.20 -0.81 -0.25 0.00 0.00 0.00 0.00 61.98 61.12 2o2r s VAL 453 Cb -0.13 -1.26 -0.11 0.00 0.00 0.00 0.00 36.38 34.88 2o2r s VAL 453 CO 0.09 0.43 1.01 -1.20 0.00 0.00 0.00 175.10 175.43 2o2r n SER 454 N 2.69 1.26 -4.13 3.32 7.64 -0.27 -1.36 113.62 122.77 2o2r n SER 454 Ca -0.15 1.04 -0.37 0.00 1.01 0.00 0.00 58.87 60.40 2o2r n SER 454 Cb 0.53 -1.35 -0.11 0.00 -1.01 0.00 0.00 64.21 62.28 2o2r n SER 454 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2o2r s LEU 455 N -0.44 5.31 0.34 -3.43 2.96 -0.72 -4.59 118.68 118.11 2o2r s LEU 455 Ca 0.63 -2.18 -0.29 0.00 -0.22 0.00 0.00 54.13 52.07 2o2r s LEU 455 Cb -0.57 -1.86 -0.12 0.00 0.50 0.00 0.00 46.19 44.15 2o2r s LEU 455 CO 0.57 -0.53 1.47 0.00 -1.32 0.00 0.00 176.35 176.54 2o2r n ALA 456 N 4.41 2.14 -2.35 5.97 0.00 -0.72 -4.69 120.51 125.28 2o2r n ALA 456 Ca -0.01 0.36 -0.24 0.00 0.00 0.00 0.00 53.44 53.55 2o2r n ALA 456 Cb 0.41 -2.39 -0.05 0.00 0.00 0.00 0.00 19.45 17.42 2o2r n ALA 456 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2o2r s GLN 457 N -1.58 2.34 0.26 0.00 -1.52 -1.26 -4.76 119.66 113.14 2o2r s GLN 457 Ca 0.57 -1.76 -0.02 0.00 -1.95 0.00 0.00 55.36 52.20 2o2r s GLN 457 Cb -0.51 -2.13 0.52 0.00 -0.22 0.00 0.00 33.01 30.67 2o2r s GLN 457 CO 0.59 -0.21 1.76 0.28 -0.25 0.00 0.00 175.29 177.46 2o2r h VAL 458 N 1.20 0.72 0.00 1.09 2.07 -1.95 -0.22 116.25 119.15 2o2r h VAL 458 Ca -0.42 -0.20 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 2o2r h VAL 458 Cb 1.26 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 2o2r h VAL 458 CO 0.64 0.11 -0.18 0.77 0.02 0.00 0.00 177.57 178.92 2o2r h SER 459 N 0.60 0.00 -0.11 0.57 4.64 -1.99 -1.79 113.55 115.47 2o2r h SER 459 Ca 0.45 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.57 2o2r h SER 459 Cb 0.65 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.75 2o2r h SER 459 CO -0.37 0.18 -0.73 0.44 -0.87 0.00 0.00 176.83 175.49 2o2r h ASP 460 N 0.00 0.83 -0.57 4.97 3.32 -1.45 -1.70 116.42 121.82 2o2r h ASP 460 Ca -0.00 -0.66 0.05 0.00 0.02 0.00 0.00 57.03 56.45 2o2r h ASP 460 Cb 0.39 -0.25 -0.05 0.00 0.22 0.00 0.00 39.33 39.64 2o2r h ASP 460 CO 0.02 1.36 0.29 0.58 -1.72 0.00 0.00 179.24 179.77 2o2r h VAL 461 N 0.36 0.94 -0.51 -1.35 2.07 -1.01 -0.60 116.25 116.17 2o2r h VAL 461 Ca -0.06 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.21 2o2r h VAL 461 Cb 1.37 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.46 2o2r h VAL 461 CO 0.15 0.10 0.07 0.44 0.02 0.00 0.00 177.57 178.35 2o2r h ASP 462 N 0.55 0.75 -0.55 0.57 3.45 -1.28 -0.45 116.42 119.47 2o2r h ASP 462 Ca 0.26 -0.15 -0.11 0.00 0.43 0.00 0.00 57.03 57.45 2o2r h ASP 462 Cb 0.17 -0.20 -0.02 0.00 -0.56 0.00 0.00 39.33 38.73 2o2r h ASP 462 CO -0.18 0.78 -0.07 0.11 -1.57 0.00 0.00 179.24 178.31 2o2r h LYS 463 N 0.76 1.03 -0.05 3.56 1.57 -0.82 -1.56 116.57 121.06 2o2r h LYS 463 Ca 0.16 -0.36 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 2o2r h LYS 463 Cb 0.36 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 2o2r h LYS 463 CO 0.01 1.05 0.00 0.00 -0.57 0.00 0.00 179.45 179.94 2o2r h ALA 464 N 0.98 0.06 -0.87 3.86 0.00 -0.75 -1.26 119.26 121.29 2o2r h ALA 464 Ca 0.15 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2o2r h ALA 464 Cb 0.63 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 2o2r h ALA 464 CO 0.04 -0.28 0.57 0.28 0.00 0.00 0.00 179.25 179.86 2o2r h VAL 465 N -0.19 1.23 -0.61 0.00 2.07 -1.10 0.88 116.25 118.52 2o2r h VAL 465 Ca 0.01 -0.43 -0.08 0.00 0.82 0.00 0.00 66.70 67.03 2o2r h VAL 465 Cb 0.31 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 2o2r h VAL 465 CO 0.00 0.22 0.07 0.00 0.02 0.00 0.00 177.57 177.88 2o2r h ALA 466 N 1.44 0.97 -0.35 1.67 0.00 -1.16 0.78 119.26 122.62 2o2r h ALA 466 Ca 0.32 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2o2r h ALA 466 Cb -0.12 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 2o2r h ALA 466 CO -0.07 0.64 -0.45 0.00 0.00 0.00 0.00 179.25 179.37 2o2r h ALA 467 N 1.12 0.53 -0.19 0.00 0.00 -0.66 -1.19 119.26 118.86 2o2r h ALA 467 Ca 0.18 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2o2r h ALA 467 Cb 0.45 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2o2r h ALA 467 CO 0.02 0.68 0.09 0.00 0.00 0.00 0.00 179.25 180.04 2o2r h ALA 468 N 0.74 0.25 -0.32 0.00 0.00 -0.63 -0.82 119.26 118.48 2o2r h ALA 468 Ca 0.04 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2o2r h ALA 468 Cb 1.05 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 2o2r h ALA 468 CO 0.11 -0.19 0.14 -0.22 0.00 0.00 0.00 179.25 179.09 2o2r h LYS 469 N 0.19 0.30 -0.35 0.00 3.64 -0.84 -0.28 116.57 119.22 2o2r h LYS 469 Ca 0.07 -0.02 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 2o2r h LYS 469 Cb 0.12 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2o2r h LYS 469 CO -0.01 0.20 0.22 1.49 -2.27 0.00 0.00 179.45 179.08 2o2r h GLU 470 N 0.30 0.43 -1.00 1.90 4.57 -1.17 0.65 114.58 120.26 2o2r h GLU 470 Ca 0.14 -0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.31 2o2r h GLU 470 Cb 0.07 -0.10 -0.05 0.00 -0.16 0.00 0.00 28.75 28.51 2o2r h GLU 470 CO -0.11 0.29 0.66 0.00 -1.18 0.00 0.00 179.01 178.67 2o2r h ALA 471 N 1.14 1.29 0.16 2.92 0.00 -0.86 0.17 119.26 124.09 2o2r h ALA 471 Ca 0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2o2r h ALA 471 Cb -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.38 2o2r h ALA 471 CO -0.05 0.63 -0.08 0.35 0.00 0.00 0.00 179.25 180.10 2o2r h PHE 472 N 1.33 -0.20 0.13 0.00 3.57 -0.81 -2.78 116.94 118.18 2o2r h PHE 472 Ca 0.38 -0.00 -0.29 0.00 3.53 0.00 0.00 57.97 61.59 2o2r h PHE 472 Cb -0.11 0.07 0.02 0.00 2.79 0.00 0.00 35.95 38.72 2o2r h PHE 472 CO -0.00 0.19 -1.24 0.93 -2.23 0.00 0.00 178.31 175.96 2o2r h GLU 473 N -0.64 0.49 0.00 1.11 5.08 -0.77 -3.36 114.58 116.49 2o2r h GLU 473 Ca -0.02 -0.70 -0.00 0.00 -1.00 0.00 0.00 59.36 57.64 2o2r h GLU 473 Cb 0.48 0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 2o2r h GLU 473 CO 0.04 1.31 -1.01 0.09 -1.00 0.00 0.00 179.01 178.43 2o2r n ASN 474 N -3.71 4.95 -4.07 1.42 3.02 0.53 -5.00 115.26 112.40 2o2r n ASN 474 Ca -0.12 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.13 2o2r n ASN 474 Cb 0.99 0.99 0.20 0.00 -0.61 0.00 0.00 39.78 41.36 2o2r n ASN 474 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 2o2r s GLY 475 N -2.06 1.71 0.29 7.41 0.00 -0.69 -4.98 107.32 109.00 2o2r s GLY 475 Ca -0.00 -1.09 -0.01 0.00 0.00 0.00 0.00 44.72 43.62 2o2r s GLY 475 CO 0.01 -0.30 1.85 -2.00 0.00 0.00 0.00 173.10 172.67 2o2r h LEU 476 N -1.91 0.78 -1.33 0.66 5.85 -1.93 -3.02 115.31 114.41 2o2r h LEU 476 Ca -0.45 -0.12 0.18 0.00 0.84 0.00 0.00 57.88 58.33 2o2r h LEU 476 Cb 1.26 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 42.01 2o2r h LEU 476 CO 0.38 0.73 0.60 -0.25 -0.34 0.00 0.00 178.44 179.56 2o2r h TRP 477 N 0.83 0.74 -0.00 1.25 2.91 -1.92 0.93 115.95 120.69 2o2r h TRP 477 Ca 0.19 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.23 2o2r h TRP 477 Cb 0.23 -0.23 0.00 0.00 -0.51 0.00 0.00 29.16 28.65 2o2r h TRP 477 CO 0.01 0.21 -0.10 0.41 -1.03 0.00 0.00 178.44 177.95 2o2r n GLY 478 N -1.45 -1.13 0.04 2.65 0.00 -1.14 -4.17 105.19 99.99 2o2r n GLY 478 Ca 0.20 -0.22 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 2o2r n GLY 478 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2o2r n LYS 479 N -1.15 1.77 -1.89 1.61 5.02 0.22 -5.03 118.16 118.71 2o2r n LYS 479 Ca 0.13 -0.03 -0.33 0.00 -2.02 0.00 0.00 58.31 56.05 2o2r n LYS 479 Cb 0.28 -1.26 0.03 0.00 -0.02 0.00 0.00 35.03 34.06 2o2r n LYS 479 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 2o2r s ILE 480 N -2.39 3.35 0.64 -0.18 -4.36 -0.61 -5.00 121.20 112.64 2o2r s ILE 480 Ca -0.05 0.66 -0.18 0.00 -0.26 0.00 0.00 60.65 60.83 2o2r s ILE 480 Cb 0.04 -3.18 -0.04 0.00 1.25 0.00 0.00 42.46 40.53 2o2r s ILE 480 CO 0.43 -0.36 0.94 0.59 0.24 0.00 0.00 174.94 176.77 2o2r n ASN 481 N -2.18 0.59 -0.33 4.36 3.02 -1.26 -4.81 115.26 114.64 2o2r n ASN 481 Ca 0.10 0.76 0.03 0.00 -0.03 0.00 0.00 54.58 55.44 2o2r n ASN 481 Cb 0.52 -1.38 0.17 0.00 -0.61 0.00 0.00 39.78 38.48 2o2r n ASN 481 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2o2r h ALA 482 N 0.26 1.30 -0.78 5.41 0.00 -1.94 -1.10 119.26 122.41 2o2r h ALA 482 Ca -0.48 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.43 2o2r h ALA 482 Cb 1.36 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.88 2o2r h ALA 482 CO 0.49 0.29 0.51 -0.09 0.00 0.00 0.00 179.25 180.46 2o2r h ARG 483 N 1.01 1.03 0.02 0.00 2.43 -1.91 -1.67 114.38 115.28 2o2r h ARG 483 Ca 0.42 -0.06 -0.23 0.00 -0.81 0.00 0.00 59.98 59.30 2o2r h ARG 483 Cb 0.25 -0.23 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 2o2r h ARG 483 CO -0.20 0.68 -0.96 -0.44 -1.51 0.00 0.00 179.97 177.54 2o2r h ASP 484 N 1.06 0.45 -0.64 -3.80 3.32 -1.78 -2.02 116.42 113.01 2o2r h ASP 484 Ca 0.29 -0.38 0.05 0.00 0.02 0.00 0.00 57.03 57.01 2o2r h ASP 484 Cb -0.12 -0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.24 2o2r h ASP 484 CO -0.06 1.19 0.36 -0.09 -1.72 0.00 0.00 179.24 178.92 2o2r h ARG 485 N 0.18 0.66 -0.56 3.56 2.43 -0.97 -1.42 114.38 118.26 2o2r h ARG 485 Ca -0.08 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.09 2o2r h ARG 485 Cb 1.61 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.97 2o2r h ARG 485 CO 0.16 0.44 0.32 0.78 -1.51 0.00 0.00 179.97 180.16 2o2r h GLY 486 N 0.68 0.80 0.65 2.80 0.00 -1.22 -2.25 103.07 104.53 2o2r h GLY 486 Ca 0.28 -0.23 0.05 0.00 0.00 0.00 0.00 47.33 47.44 2o2r h GLY 486 CO -0.16 0.17 0.25 3.21 0.00 0.00 0.00 176.54 180.00 2o2r h ARG 487 N 0.62 0.46 -1.01 4.80 2.47 -0.83 0.26 114.38 121.14 2o2r h ARG 487 Ca 0.24 -0.03 0.02 0.00 -1.26 0.00 0.00 59.98 58.95 2o2r h ARG 487 Cb 0.09 -0.10 -0.05 0.00 -1.65 0.00 0.00 29.97 28.25 2o2r h ARG 487 CO -0.13 0.30 0.67 -0.07 0.56 0.00 0.00 179.97 181.30 2o2r h LEU 488 N 0.47 1.13 -0.59 3.04 3.38 -1.02 -0.76 115.31 120.97 2o2r h LEU 488 Ca 0.24 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 58.03 2o2r h LEU 488 Cb 0.19 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 2o2r h LEU 488 CO -0.19 0.80 -0.66 -0.07 0.09 0.00 0.00 178.44 178.41 2o2r h LEU 489 N 1.33 0.23 -0.02 1.67 3.38 -0.81 -0.03 115.31 121.05 2o2r h LEU 489 Ca 0.39 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 2o2r h LEU 489 Cb -0.08 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2o2r h LEU 489 CO -0.10 0.82 0.01 1.88 0.09 0.00 0.00 178.44 181.14 2o2r h TYR 490 N 0.14 0.04 -0.70 1.13 -1.99 -0.72 -2.13 116.97 112.73 2o2r h TYR 490 Ca -0.01 -0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.77 2o2r h TYR 490 Cb 1.19 -0.01 -0.05 0.00 2.00 0.00 0.00 36.73 39.85 2o2r h TYR 490 CO 0.02 0.25 0.40 -0.09 -0.00 0.00 0.00 178.16 178.74 2o2r h ARG 491 N -0.19 0.72 -0.76 4.88 9.65 -0.99 -0.20 114.38 127.50 2o2r h ARG 491 Ca 0.01 -0.04 0.09 0.00 -1.10 0.00 0.00 59.98 58.94 2o2r h ARG 491 Cb 0.23 -0.16 -0.07 0.00 -1.39 0.00 0.00 29.97 28.58 2o2r h ARG 491 CO 0.00 0.48 0.40 1.25 2.80 0.00 0.00 179.97 184.90 2o2r h LEU 492 N 0.74 0.54 -0.95 3.80 5.85 -0.94 0.56 115.31 124.91 2o2r h LEU 492 Ca 0.31 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 59.05 2o2r h LEU 492 Cb 0.16 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 2o2r h LEU 492 CO -0.17 0.31 0.30 0.00 -0.34 0.00 0.00 178.44 178.54 2o2r h ALA 493 N 1.44 1.17 -0.50 1.25 0.00 -0.47 -1.15 119.26 121.01 2o2r h ALA 493 Ca 0.37 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 2o2r h ALA 493 Cb 0.37 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2o2r h ALA 493 CO -0.26 0.61 0.06 -0.44 0.00 0.00 0.00 179.25 179.22 2o2r h ASP 494 N 1.04 0.81 -0.52 0.00 3.45 -0.14 -0.13 116.42 120.93 2o2r h ASP 494 Ca 0.25 -0.27 -0.02 0.00 0.43 0.00 0.00 57.03 57.41 2o2r h ASP 494 Cb 0.17 -0.21 -0.02 0.00 -0.56 0.00 0.00 39.33 38.71 2o2r h ASP 494 CO -0.02 0.88 0.23 0.58 -1.57 0.00 0.00 179.24 179.33 2o2r h VAL 495 N 0.71 1.20 -0.80 -1.35 2.07 -0.77 -0.26 116.25 117.05 2o2r h VAL 495 Ca 0.15 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 67.07 2o2r h VAL 495 Cb 0.43 0.65 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 2o2r h VAL 495 CO 0.01 0.23 0.53 0.24 0.02 0.00 0.00 177.57 178.61 2o2r h MET 496 N 0.69 1.04 -0.43 1.57 2.86 -1.05 -2.15 114.93 117.46 2o2r h MET 496 Ca 0.17 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 2o2r h MET 496 Cb 0.15 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2o2r h MET 496 CO -0.02 0.69 -0.03 1.49 1.06 0.00 0.00 176.91 180.11 2o2r h GLU 497 N 1.08 0.72 0.00 1.72 4.81 -0.69 -2.03 114.58 120.19 2o2r h GLU 497 Ca 0.30 -0.19 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2o2r h GLU 497 Cb -0.11 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.18 2o2r h GLU 497 CO -0.07 0.75 -0.09 1.96 -0.73 0.00 0.00 179.01 180.83 2o2r h GLN 498 N 0.67 0.00 -0.32 1.92 4.20 -0.61 -2.93 115.11 118.04 2o2r h GLN 498 Ca 0.13 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.75 2o2r h GLN 498 Cb 0.46 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.18 2o2r h GLN 498 CO 0.02 0.09 0.00 0.72 -0.67 0.00 0.00 178.83 178.99 2o2r n HIS 499 N -3.53 1.08 -0.02 2.96 8.25 -0.82 -4.81 115.22 118.33 2o2r n HIS 499 Ca -0.02 -1.19 -0.09 0.00 -0.26 0.00 0.00 57.72 56.17 2o2r n HIS 499 Cb 0.22 -0.41 0.08 0.00 1.12 0.00 0.00 29.99 31.00 2o2r n HIS 499 CO 0.00 0.00 0.00 -0.56 0.64 0.00 0.00 176.34 176.42 2o2r h GLN 500 N 1.45 0.62 -0.34 -0.41 3.07 -1.21 -1.06 115.11 117.23 2o2r h GLN 500 Ca 0.11 -0.33 -0.04 0.00 0.09 0.00 0.00 58.65 58.48 2o2r h GLN 500 Cb 1.58 0.01 -0.01 0.00 0.08 0.00 0.00 27.48 29.14 2o2r h GLN 500 CO 0.32 0.93 0.06 0.93 0.09 0.00 0.00 178.83 181.16 2o2r h GLU 501 N 0.50 0.56 -0.43 0.06 3.07 -1.87 -0.99 114.58 115.48 2o2r h GLU 501 Ca 0.04 -0.15 0.01 0.00 -0.50 0.00 0.00 59.36 58.76 2o2r h GLU 501 Cb 0.95 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.77 2o2r h GLU 501 CO 0.09 0.63 0.28 1.49 -1.40 0.00 0.00 179.01 180.10 2o2r h GLU 502 N 0.39 0.55 -0.46 2.33 4.81 -1.88 -1.34 114.58 118.98 2o2r h GLU 502 Ca 0.10 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.23 2o2r h GLU 502 Cb 0.35 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.59 2o2r h GLU 502 CO 0.01 0.37 0.02 -0.07 -0.73 0.00 0.00 179.01 178.60 2o2r h LEU 503 N 0.57 0.79 -1.21 1.64 3.38 -1.13 -0.66 115.31 118.68 2o2r h LEU 503 Ca 0.16 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.79 2o2r h LEU 503 Cb -0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2o2r h LEU 503 CO -0.04 0.89 0.05 0.00 0.09 0.00 0.00 178.44 179.42 2o2r h ALA 504 N 0.93 1.36 -0.16 1.53 0.00 -1.08 -0.82 119.26 121.01 2o2r h ALA 504 Ca 0.13 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 2o2r h ALA 504 Cb 0.47 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 2o2r h ALA 504 CO 0.02 0.45 -0.12 1.15 0.00 0.00 0.00 179.25 180.75 2o2r h THR 505 N 0.57 1.33 -0.87 0.00 2.02 -0.96 -0.39 112.91 114.61 2o2r h THR 505 Ca 0.13 -1.23 0.07 0.00 0.77 0.00 0.00 66.41 66.15 2o2r h THR 505 Cb 0.29 1.78 -0.06 0.00 -1.74 0.00 0.00 68.15 68.42 2o2r h THR 505 CO 0.00 0.36 0.53 0.40 0.37 0.00 0.00 175.52 177.19 2o2r h ILE 506 N 0.02 1.01 -0.37 3.11 2.04 -0.93 -0.45 117.51 121.94 2o2r h ILE 506 Ca 0.03 -0.32 -0.11 0.00 1.00 0.00 0.00 64.86 65.46 2o2r h ILE 506 Cb 0.63 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 2o2r h ILE 506 CO 0.03 0.17 -0.21 -0.08 0.00 0.00 0.00 178.15 178.07 2o2r h GLU 507 N 0.95 0.71 -0.64 2.37 4.57 -1.06 0.15 114.58 121.62 2o2r h GLU 507 Ca 0.39 -0.27 -0.03 0.00 -1.18 0.00 0.00 59.36 58.27 2o2r h GLU 507 Cb 0.22 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 2o2r h GLU 507 CO -0.19 0.86 0.29 0.00 -1.18 0.00 0.00 179.01 178.78 2o2r h ALA 508 N 1.15 0.83 -0.21 2.92 0.00 -0.29 -1.13 119.26 122.53 2o2r h ALA 508 Ca 0.09 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 2o2r h ALA 508 Cb 0.69 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2o2r h ALA 508 CO 0.05 0.42 -0.18 -0.07 0.00 0.00 0.00 179.25 179.47 2o2r h LEU 509 N 0.89 0.53 0.08 0.00 3.38 -0.83 -2.01 115.31 117.34 2o2r h LEU 509 Ca 0.22 -0.46 -0.26 0.00 0.09 0.00 0.00 57.88 57.47 2o2r h LEU 509 Cb 0.16 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2o2r h LEU 509 CO -0.02 0.87 -1.22 -0.78 0.09 0.00 0.00 178.44 177.38 2o2r h ASP 510 N 0.19 0.26 0.00 -0.43 3.58 -0.71 -3.37 116.42 115.93 2o2r h ASP 510 Ca 0.04 -0.29 0.00 0.00 0.42 0.00 0.00 57.03 57.20 2o2r h ASP 510 Cb 0.71 -0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.68 2o2r h ASP 510 CO 0.05 1.23 0.00 0.00 -2.88 0.00 0.00 179.24 177.64 2o2r n ALA 511 N -2.49 1.70 -1.01 -0.78 0.00 -0.44 -4.74 120.51 112.75 2o2r n ALA 511 Ca -0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 53.44 53.33 2o2r n ALA 511 Cb 1.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.45 2o2r n ALA 511 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2o2r n GLY 512 N 0.76 0.47 3.70 0.00 0.00 -0.76 -4.40 105.19 104.95 2o2r n GLY 512 Ca 0.00 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 2o2r n GLY 512 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o2r s ALA 513 N -1.99 3.65 0.15 4.61 0.00 -1.19 -4.07 121.76 122.92 2o2r s ALA 513 Ca 0.00 1.13 -0.33 0.00 0.00 0.00 0.00 51.96 52.75 2o2r s ALA 513 Cb 0.00 -3.63 -0.13 0.00 0.00 0.00 0.00 23.12 19.36 2o2r s ALA 513 CO 0.00 -0.93 1.66 0.28 0.00 0.00 0.00 175.76 176.77 2o2r n VAL 514 N 4.48 0.08 -0.16 0.00 0.31 -1.26 -3.95 118.33 117.83 2o2r n VAL 514 Ca 0.14 -0.01 -0.04 0.00 -0.01 0.00 0.00 64.34 64.42 2o2r n VAL 514 Cb 0.41 -1.72 0.05 0.00 -0.91 0.00 0.00 33.84 31.67 2o2r n VAL 514 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 2o2r h TYR 515 N 6.64 0.39 -0.56 3.52 3.20 -1.45 0.16 116.97 128.88 2o2r h TYR 515 Ca -0.45 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.41 2o2r h TYR 515 Cb 1.24 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 39.38 2o2r h TYR 515 CO 0.66 0.17 0.20 1.79 -1.64 0.00 0.00 178.16 179.34 2o2r h THR 516 N 0.43 1.21 -0.26 1.81 1.35 -1.90 -1.45 112.91 114.10 2o2r h THR 516 Ca 0.22 -0.68 -0.10 0.00 -0.55 0.00 0.00 66.41 65.30 2o2r h THR 516 Cb 0.18 0.57 -0.00 0.00 -1.73 0.00 0.00 68.15 67.17 2o2r h THR 516 CO -0.19 0.26 -0.25 0.25 -0.25 0.00 0.00 175.52 175.35 2o2r h LEU 517 N 0.80 0.67 -1.62 3.87 6.46 -1.76 -3.15 115.31 120.58 2o2r h LEU 517 Ca 0.19 -0.47 -0.00 0.00 -0.12 0.00 0.00 57.88 57.48 2o2r h LEU 517 Cb 0.19 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.92 2o2r h LEU 517 CO -0.01 1.00 0.21 0.00 -0.62 0.00 0.00 178.44 179.02 2o2r h ALA 518 N 0.69 1.72 -0.59 1.25 0.00 -0.26 0.14 119.26 122.21 2o2r h ALA 518 Ca 0.04 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2o2r h ALA 518 Cb 0.80 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.43 2o2r h ALA 518 CO 0.06 0.25 0.06 -0.07 0.00 0.00 0.00 179.25 179.55 2o2r h LEU 519 N 0.48 0.97 0.23 0.00 3.38 -1.27 0.33 115.31 119.42 2o2r h LEU 519 Ca 0.13 -0.28 -0.32 0.00 0.09 0.00 0.00 57.88 57.49 2o2r h LEU 519 Cb -0.02 -0.26 0.03 0.00 0.09 0.00 0.00 40.66 40.50 2o2r h LEU 519 CO -0.02 1.00 -1.44 0.50 0.09 0.00 0.00 178.44 178.57 2o2r h LYS 520 N 0.90 0.48 0.00 1.13 3.64 -1.42 -1.49 116.57 119.81 2o2r h LYS 520 Ca 0.17 -0.82 0.00 0.00 -1.27 0.00 0.00 60.65 58.73 2o2r h LYS 520 Cb 0.47 0.31 0.00 0.00 -0.41 0.00 0.00 32.23 32.59 2o2r h LYS 520 CO 0.02 1.39 0.00 2.41 -2.27 0.00 0.00 179.45 181.00 2o2r n THR 521 N -3.67 0.00 -0.30 1.00 -1.04 0.45 -3.32 114.28 107.40 2o2r n THR 521 Ca -0.15 0.10 0.11 0.00 -2.04 0.00 0.00 64.05 62.07 2o2r n THR 521 Cb 1.09 -1.07 0.28 0.00 -1.82 0.00 0.00 70.33 68.80 2o2r n THR 521 CO 0.00 0.00 0.00 0.45 -0.64 0.00 0.00 175.07 174.88 2o2r h HIS 522 N 0.00 0.72 0.00 -1.42 3.86 -1.61 -1.02 115.15 115.67 2o2r h HIS 522 Ca 0.00 0.04 -0.41 0.00 -1.16 0.00 0.00 60.37 58.84 2o2r h HIS 522 Cb 0.00 -0.18 -0.06 0.00 1.06 0.00 0.00 27.41 28.23 2o2r h HIS 522 CO 0.00 0.05 -2.39 0.28 0.86 0.00 0.00 177.93 176.73 2o2r n VAL 523 N -4.97 1.37 -0.24 2.45 0.31 0.12 -3.62 118.33 113.76 2o2r n VAL 523 Ca 0.20 -0.38 -0.04 0.00 -0.01 0.00 0.00 64.34 64.12 2o2r n VAL 523 Cb 0.57 -1.75 0.07 0.00 -0.91 0.00 0.00 33.84 31.83 2o2r n VAL 523 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2o2r h GLY 524 N -0.41 0.97 1.87 2.92 0.00 -1.23 -1.82 103.07 105.37 2o2r h GLY 524 Ca -0.62 -0.31 -0.11 0.00 0.00 0.00 0.00 47.33 46.28 2o2r h GLY 524 CO -0.33 0.26 -0.49 1.98 0.00 0.00 0.00 176.54 177.96 2o2r h MET 525 N 0.81 0.14 -0.66 4.80 4.05 -1.18 -2.02 114.93 120.88 2o2r h MET 525 Ca 0.27 -0.08 -0.06 0.00 -0.28 0.00 0.00 59.70 59.55 2o2r h MET 525 Cb 0.03 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 30.80 2o2r h MET 525 CO -0.11 0.60 0.18 0.77 0.23 0.00 0.00 176.91 178.58 2o2r h SER 526 N 0.12 0.97 -0.11 1.39 0.02 -1.52 0.74 113.55 115.15 2o2r h SER 526 Ca 0.00 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.75 2o2r h SER 526 Cb 0.91 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 63.19 2o2r h SER 526 CO 0.07 0.92 0.01 0.40 -1.14 0.00 0.00 176.83 177.09 2o2r h ILE 527 N 0.99 1.23 -1.00 3.27 2.04 -1.18 -2.24 117.51 120.61 2o2r h ILE 527 Ca 0.21 -0.72 0.10 0.00 1.00 0.00 0.00 64.86 65.45 2o2r h ILE 527 Cb 0.32 1.50 -0.08 0.00 -0.74 0.00 0.00 36.82 37.83 2o2r h ILE 527 CO -0.00 0.21 0.63 1.56 0.00 0.00 0.00 178.15 180.55 2o2r h GLN 528 N -0.06 1.03 0.30 2.37 4.20 -1.25 -1.78 115.11 119.92 2o2r h GLN 528 Ca 0.03 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2o2r h GLN 528 Cb 0.31 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.86 2o2r h GLN 528 CO 0.00 0.68 -0.14 1.15 -0.67 0.00 0.00 178.83 179.85 2o2r h THR 529 N 1.06 0.71 -0.88 -0.54 2.02 -0.67 0.13 112.91 114.73 2o2r h THR 529 Ca 0.47 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.60 2o2r h THR 529 Cb 0.37 0.74 -0.04 0.00 -1.74 0.00 0.00 68.15 67.48 2o2r h THR 529 CO -0.23 0.01 0.55 -0.26 0.37 0.00 0.00 175.52 175.96 2o2r h PHE 530 N -0.43 1.14 -0.65 3.16 -1.00 -1.23 -1.61 116.94 116.32 2o2r h PHE 530 Ca -0.04 0.01 -0.07 0.00 2.81 0.00 0.00 57.97 60.67 2o2r h PHE 530 Cb 0.33 -0.38 -0.03 0.00 3.61 0.00 0.00 35.95 39.48 2o2r h PHE 530 CO -0.05 0.74 0.12 0.00 -1.61 0.00 0.00 178.31 177.52 2o2r h ARG 531 N 1.20 1.06 0.57 1.51 3.08 -1.17 -0.64 114.38 119.99 2o2r h ARG 531 Ca 0.32 -0.27 -0.03 0.00 0.07 0.00 0.00 59.98 60.07 2o2r h ARG 531 Cb -0.08 -0.13 0.01 0.00 0.08 0.00 0.00 29.97 29.84 2o2r h ARG 531 CO -0.06 0.97 -0.27 -0.92 -1.07 0.00 0.00 179.97 178.61 2o2r h TYR 532 N 0.98 -0.71 -0.01 3.04 3.20 -0.56 -3.11 116.97 119.80 2o2r h TYR 532 Ca 0.20 -0.02 -0.07 0.00 3.14 0.00 0.00 58.73 61.98 2o2r h TYR 532 Cb 0.41 0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 2o2r h TYR 532 CO 0.03 -0.42 -0.34 0.74 -1.64 0.00 0.00 178.16 176.53 2o2r h PHE 533 N -0.80 0.02 -0.83 -3.82 0.04 -1.32 -2.42 116.94 107.82 2o2r h PHE 533 Ca -0.08 -0.00 0.10 0.00 2.80 0.00 0.00 57.97 60.79 2o2r h PHE 533 Cb 0.60 -0.01 -0.06 0.00 2.20 0.00 0.00 35.95 38.69 2o2r h PHE 533 CO -0.03 0.36 0.54 0.00 -0.60 0.00 0.00 178.31 178.58 2o2r h ALA 534 N 1.64 1.73 0.00 2.45 0.00 -1.10 -0.57 119.26 123.40 2o2r h ALA 534 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2o2r h ALA 534 Cb 0.61 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2o2r h ALA 534 CO 0.04 0.10 0.00 0.78 0.00 0.00 0.00 179.25 180.18 2o2r h GLY 535 N 0.78 0.00 2.00 0.00 0.00 -1.37 -3.17 103.07 101.31 2o2r h GLY 535 Ca 0.38 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.59 2o2r h GLY 535 CO -0.15 0.00 -0.60 1.49 0.00 0.00 0.00 176.54 177.28 2o2r h TRP 536 N 0.00 0.00 -0.63 5.60 4.06 -1.07 -3.39 115.95 120.51 2o2r h TRP 536 Ca 0.00 0.00 0.13 0.00 2.06 0.00 0.00 58.89 61.08 2o2r h TRP 536 Cb 0.69 0.00 -0.11 0.00 -1.00 0.00 0.00 29.16 28.74 2o2r h TRP 536 CO 0.00 0.60 0.01 0.00 -3.56 0.00 0.00 178.44 175.49 2o2r n ASP 538 N -5.28 4.69 0.00 0.00 5.75 -1.26 -3.90 116.55 116.56 2o2r n ASP 538 Ca 0.10 -2.48 0.00 0.00 -0.01 0.00 0.00 54.79 52.40 2o2r n ASP 538 Cb 0.37 -0.58 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 2o2r n ASP 538 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2o2r n LYS 539 N 1.03 1.88 -2.69 0.11 5.02 0.16 -4.96 118.16 118.71 2o2r n LYS 539 Ca 0.25 -1.21 -0.43 0.00 -2.02 0.00 0.00 58.31 54.91 2o2r n LYS 539 Cb 0.89 -0.98 -0.02 0.00 -0.02 0.00 0.00 35.03 34.90 2o2r n LYS 539 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2o2r s ILE 540 N -0.71 4.57 -0.01 -0.18 1.01 -0.82 -5.02 121.20 120.04 2o2r s ILE 540 Ca 0.00 1.69 0.04 0.00 0.00 0.00 0.00 60.65 62.39 2o2r s ILE 540 Cb 0.00 -4.36 -0.01 0.00 0.01 0.00 0.00 42.46 38.10 2o2r s ILE 540 CO 0.00 -0.41 -0.14 -1.10 0.00 0.00 0.00 174.94 173.29 2o2r s GLN 541 N 3.50 1.17 0.00 2.79 -0.21 -1.26 -4.96 119.66 120.68 2o2r s GLN 541 Ca 0.43 -0.50 0.00 0.00 0.02 0.00 0.00 55.36 55.32 2o2r s GLN 541 Cb -0.13 -1.12 0.00 0.00 1.00 0.00 0.00 33.01 32.76 2o2r s GLN 541 CO 0.14 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 174.00 2o2r n GLY 542 N 2.80 0.75 3.22 3.09 0.00 -1.26 -4.88 105.19 108.91 2o2r n GLY 542 Ca -0.15 -1.79 -0.14 0.00 0.00 0.00 0.00 46.02 43.94 2o2r n GLY 542 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o2r s ALA 543 N -3.17 1.30 -0.06 4.61 0.00 -1.21 -4.93 121.76 118.30 2o2r s ALA 543 Ca 0.00 -1.37 0.05 0.00 0.00 0.00 0.00 51.96 50.64 2o2r s ALA 543 Cb 0.00 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.15 2o2r s ALA 543 CO 0.00 -0.08 -0.20 0.95 0.00 0.00 0.00 175.76 176.43 2o2r s THR 544 N -3.00 2.55 -0.09 0.00 -4.23 -1.26 -0.40 115.64 109.21 2o2r s THR 544 Ca 0.12 -0.90 0.03 0.00 -1.18 0.00 0.00 61.69 59.76 2o2r s THR 544 Cb 0.01 -1.97 0.01 0.00 1.34 0.00 0.00 72.50 71.88 2o2r s THR 544 CO -0.00 0.57 -0.18 -0.63 -0.54 0.00 0.00 174.62 173.84 2o2r s ILE 545 N -0.37 1.60 -1.46 2.99 1.01 0.04 -4.99 121.20 120.01 2o2r s ILE 545 Ca 0.03 -0.75 -0.13 0.00 0.00 0.00 0.00 60.65 59.81 2o2r s ILE 545 Cb -0.12 -1.41 0.04 0.00 0.01 0.00 0.00 42.46 40.97 2o2r s ILE 545 CO 0.02 0.46 2.31 -0.81 0.00 0.00 0.00 174.94 176.92 2o2r n PRO 546 N 3.72 3.13 -1.40 2.79 -0.04 -1.26 -4.22 135.00 137.72 2o2r n PRO 546 Ca -0.21 -2.67 -0.31 0.00 -0.04 0.00 0.00 63.50 60.27 2o2r n PRO 546 Cb 0.52 -3.15 0.07 0.00 -0.04 0.00 0.00 33.50 30.91 2o2r n PRO 546 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2o2r s ILE 547 N 2.58 3.57 0.43 0.52 -0.00 -1.26 -5.00 121.20 122.04 2o2r s ILE 547 Ca 0.50 0.52 -0.26 0.00 -0.00 0.00 0.00 60.65 61.42 2o2r s ILE 547 Cb 0.14 -3.10 -0.09 0.00 -0.00 0.00 0.00 42.46 39.41 2o2r s ILE 547 CO -0.07 -0.66 1.34 0.59 -0.00 0.00 0.00 174.94 176.14 2o2r n ASN 548 N -3.33 2.88 -4.73 4.36 4.13 -1.26 -4.98 115.26 112.33 2o2r n ASN 548 Ca 0.09 1.12 -0.35 0.00 1.68 0.00 0.00 54.58 57.11 2o2r n ASN 548 Cb 0.53 -1.54 -0.08 0.00 -1.54 0.00 0.00 39.78 37.15 2o2r n ASN 548 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2o2r s GLN 549 N -2.28 4.18 -1.24 3.52 -1.52 -1.26 -4.86 119.66 116.19 2o2r s GLN 549 Ca 0.61 -0.22 -0.17 0.00 -1.95 0.00 0.00 55.36 53.64 2o2r s GLN 549 Cb -0.49 -3.42 -0.02 0.00 -0.22 0.00 0.00 33.01 28.87 2o2r s GLN 549 CO 0.58 0.31 2.13 0.00 -0.25 0.00 0.00 175.29 178.06 2o2r n ALA 550 N 3.49 4.84 -1.71 6.09 0.00 -1.26 -4.95 120.51 127.02 2o2r n ALA 550 Ca -0.16 -3.70 -0.41 0.00 0.00 0.00 0.00 53.44 49.17 2o2r n ALA 550 Cb 0.52 -3.57 0.02 0.00 0.00 0.00 0.00 19.45 16.41 2o2r n ALA 550 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2o2r n ARG 551 N 6.39 1.94 -0.08 0.00 5.12 -1.26 -0.90 116.66 127.87 2o2r n ARG 551 Ca 0.51 0.69 0.04 0.00 -1.93 0.00 0.00 57.85 57.16 2o2r n ARG 551 Cb 0.39 -2.42 0.15 0.00 -1.16 0.00 0.00 32.46 29.42 2o2r n ARG 551 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 2o2r n PRO 552 N -0.07 1.40 -2.34 5.56 -0.04 -1.26 -5.07 135.00 133.19 2o2r n PRO 552 Ca 0.07 -0.63 -0.25 0.00 -0.04 0.00 0.00 63.50 62.65 2o2r n PRO 552 Cb 0.40 -1.17 0.11 0.00 -0.04 0.00 0.00 33.50 32.80 2o2r n PRO 552 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2o2r s ASN 553 N -1.10 4.27 0.24 3.54 0.01 -0.08 -5.12 114.94 116.70 2o2r s ASN 553 Ca 0.15 0.03 0.11 0.00 -0.71 0.00 0.00 52.86 52.44 2o2r s ASN 553 Cb 0.08 -0.44 -0.05 0.00 0.41 0.00 0.00 41.25 41.25 2o2r s ASN 553 CO 0.11 -1.93 -0.19 -0.13 -1.51 0.00 0.00 177.10 173.45 2o2r s ARG 554 N -5.31 1.70 -0.00 -0.60 0.52 0.08 -4.02 118.95 111.32 2o2r s ARG 554 Ca 0.66 -1.62 0.03 0.00 -0.52 0.00 0.00 55.73 54.27 2o2r s ARG 554 Cb -0.07 -1.86 -0.01 0.00 0.52 0.00 0.00 34.95 33.54 2o2r s ARG 554 CO 0.46 0.36 -0.08 -0.80 0.02 0.00 0.00 175.30 175.26 2o2r s ASN 555 N -3.19 0.96 -0.08 0.23 -0.87 -1.26 -1.21 114.94 109.51 2o2r s ASN 555 Ca 0.27 -0.16 0.05 0.00 -1.57 0.00 0.00 52.86 51.44 2o2r s ASN 555 Cb -0.06 -0.10 -0.00 0.00 -0.02 0.00 0.00 41.25 41.06 2o2r s ASN 555 CO 0.14 0.09 -0.23 -0.22 -2.57 0.00 0.00 177.10 174.31 2o2r s LEU 556 N -0.24 2.03 -0.08 0.60 2.96 -0.96 -4.91 118.68 118.09 2o2r s LEU 556 Ca 0.03 -0.50 0.03 0.00 -0.22 0.00 0.00 54.13 53.46 2o2r s LEU 556 Cb -0.03 -1.31 0.01 0.00 0.50 0.00 0.00 46.19 45.36 2o2r s LEU 556 CO -0.00 0.17 -0.15 -0.89 -1.32 0.00 0.00 176.35 174.16 2o2r s THR 557 N 0.19 1.36 0.14 3.68 2.01 -1.26 -0.32 115.64 121.44 2o2r s THR 557 Ca -0.13 -0.60 0.04 0.00 0.31 0.00 0.00 61.69 61.31 2o2r s THR 557 Cb -0.16 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.08 2o2r s THR 557 CO 0.06 0.41 -0.10 -1.48 -0.69 0.00 0.00 174.62 172.81 2o2r s LEU 558 N 0.65 2.50 0.06 4.42 0.05 -0.25 -0.78 118.68 125.32 2o2r s LEU 558 Ca -0.14 -0.96 0.06 0.00 0.05 0.00 0.00 54.13 53.14 2o2r s LEU 558 Cb -0.16 -0.36 -0.04 0.00 -2.05 0.00 0.00 46.19 43.59 2o2r s LEU 558 CO 0.04 -0.30 -0.14 0.42 -0.55 0.00 0.00 176.35 175.82 2o2r s THR 559 N -3.06 3.13 -0.11 5.48 -4.23 0.46 -0.81 115.64 116.50 2o2r s THR 559 Ca 0.14 -1.15 0.03 0.00 -1.18 0.00 0.00 61.69 59.53 2o2r s THR 559 Cb 0.01 -2.38 -0.01 0.00 1.34 0.00 0.00 72.50 71.47 2o2r s THR 559 CO 0.01 0.27 -0.20 -0.75 -0.54 0.00 0.00 174.62 173.40 2o2r s LYS 560 N -1.70 3.14 -0.12 3.99 2.20 0.75 -3.30 119.74 124.71 2o2r s LYS 560 Ca 0.17 -0.81 -0.19 0.00 -0.36 0.00 0.00 55.97 54.78 2o2r s LYS 560 Cb -0.11 -2.41 -0.04 0.00 -1.51 0.00 0.00 37.83 33.76 2o2r s LYS 560 CO 0.08 0.20 0.53 0.15 -0.36 0.00 0.00 175.35 175.95 2o2r s LYS 561 N 0.31 4.34 0.08 4.03 -0.14 -1.26 -0.65 119.74 126.46 2o2r s LYS 561 Ca -0.15 0.53 0.04 0.00 -1.36 0.00 0.00 55.97 55.03 2o2r s LYS 561 Cb -0.17 -3.45 -0.03 0.00 -1.68 0.00 0.00 37.83 32.49 2o2r s LYS 561 CO 0.08 0.10 -0.12 -1.21 -0.76 0.00 0.00 175.35 173.44 2o2r s GLU 562 N 0.78 0.82 0.60 1.68 2.02 -0.06 -4.96 118.70 119.58 2o2r s GLU 562 Ca 0.28 -1.03 -0.19 0.00 0.02 0.00 0.00 54.97 54.05 2o2r s GLU 562 Cb -0.16 -0.67 -0.03 0.00 0.10 0.00 0.00 34.13 33.37 2o2r s GLU 562 CO 0.12 0.13 1.26 -2.14 0.02 0.00 0.00 175.26 174.65 2o2r s PRO 563 N -2.19 2.85 0.19 0.39 0.02 -1.25 -0.44 135.00 134.57 2o2r s PRO 563 Ca 0.01 1.98 0.05 0.00 0.02 0.00 0.00 61.00 63.05 2o2r s PRO 563 Cb -0.07 -1.95 0.06 0.00 0.02 0.00 0.00 34.50 32.56 2o2r s PRO 563 CO 0.01 -1.34 1.43 -0.39 -0.33 0.00 0.00 177.00 176.38 2o2r h VAL 564 N 0.86 1.51 0.00 3.83 -1.51 -1.85 -3.41 116.25 115.67 2o2r h VAL 564 Ca -0.51 -2.59 0.00 0.00 -1.23 0.00 0.00 66.70 62.37 2o2r h VAL 564 Cb 1.31 2.42 0.00 0.00 -2.13 0.00 0.00 31.29 32.89 2o2r h VAL 564 CO 0.55 0.75 0.00 0.61 -1.23 0.00 0.00 177.57 178.25 2o2r n GLY 565 N 0.77 0.07 3.68 5.19 0.00 -1.26 -4.88 105.19 108.75 2o2r n GLY 565 Ca -0.02 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 2o2r n GLY 565 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2o2r s VAL 566 N -0.18 4.40 0.06 1.61 1.01 -1.26 -2.86 120.40 123.18 2o2r s VAL 566 Ca 0.00 1.70 0.07 0.00 0.00 0.00 0.00 61.98 63.75 2o2r s VAL 566 Cb 0.00 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 2o2r s VAL 566 CO 0.00 -0.04 -0.15 0.00 0.00 0.00 0.00 175.10 174.91 2o2r s GLY 568 N -1.71 1.71 -0.13 0.00 0.00 0.07 -0.95 107.32 106.31 2o2r s GLY 568 Ca 0.17 -0.84 0.03 0.00 0.00 0.00 0.00 44.72 44.08 2o2r s GLY 568 CO 0.08 -0.26 -0.22 -0.42 0.00 0.00 0.00 173.10 172.28 2o2r s ILE 569 N -0.01 2.03 -0.15 0.90 1.01 -0.26 -0.73 121.20 123.99 2o2r s ILE 569 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.69 2o2r s ILE 569 Cb -0.13 -1.78 0.02 0.00 0.01 0.00 0.00 42.46 40.58 2o2r s ILE 569 CO 0.03 0.55 -0.13 -0.69 0.00 0.00 0.00 174.94 174.69 2o2r s VAL 570 N 0.72 1.50 0.20 2.92 1.01 -0.50 -0.11 120.40 126.13 2o2r s VAL 570 Ca -0.10 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.34 2o2r s VAL 570 Cb -0.16 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 2o2r s VAL 570 CO 0.00 0.44 -0.10 0.27 0.00 0.00 0.00 175.10 175.71 2o2r s ILE 571 N 1.51 1.41 0.25 2.22 -4.36 -0.96 -2.39 121.20 118.88 2o2r s ILE 571 Ca 0.05 -2.12 0.00 0.00 -0.26 0.00 0.00 60.65 58.32 2o2r s ILE 571 Cb -0.13 -2.07 0.05 0.00 1.25 0.00 0.00 42.46 41.56 2o2r s ILE 571 CO -0.10 -0.57 0.34 -0.81 0.24 0.00 0.00 174.94 174.04 2o2r n PRO 572 N -0.34 0.38 0.00 0.37 -0.04 -1.24 -2.57 135.00 131.56 2o2r n PRO 572 Ca -0.08 -0.95 0.09 0.00 -0.04 0.00 0.00 63.50 62.52 2o2r n PRO 572 Cb 0.61 -0.23 -0.05 0.00 -0.04 0.00 0.00 33.50 33.80 2o2r n PRO 572 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2o2r n TRP 573 N -1.88 0.00 -0.01 0.54 4.27 -1.26 -4.37 117.44 114.73 2o2r n TRP 573 Ca 0.06 0.00 -0.09 0.00 -3.89 0.00 0.00 57.50 53.57 2o2r n TRP 573 Cb 0.21 0.00 0.06 0.00 -1.36 0.00 0.00 31.31 30.21 2o2r n TRP 573 CO 0.00 0.00 0.00 -2.95 -2.29 0.00 0.00 177.69 172.45 2o2r h ASN 574 N 1.10 0.64 -2.55 -0.67 -1.07 -1.97 -3.35 115.58 107.73 2o2r h ASN 574 Ca 0.00 -0.33 -0.60 0.00 0.07 0.00 0.00 56.30 55.44 2o2r h ASN 574 Cb 0.53 -0.18 -0.39 0.00 -2.07 0.00 0.00 38.32 36.21 2o2r h ASN 574 CO 0.00 1.04 -0.87 -0.31 0.07 0.00 0.00 177.43 177.35 2o2r s TYR 575 N -4.08 1.73 0.11 4.14 1.51 -1.26 -4.98 117.35 114.52 2o2r s TYR 575 Ca -0.08 -2.59 -0.21 0.00 -1.01 0.00 0.00 57.07 53.18 2o2r s TYR 575 Cb 0.11 -1.38 -0.09 0.00 -0.11 0.00 0.00 41.96 40.50 2o2r s TYR 575 CO 0.84 -0.76 1.73 -1.35 -1.11 0.00 0.00 175.55 174.90 2o2r h PRO 576 N 5.56 0.02 -0.30 -1.71 0.11 -1.79 -0.83 132.00 133.06 2o2r h PRO 576 Ca 0.24 -0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.17 2o2r h PRO 576 Cb 0.87 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 2o2r h PRO 576 CO 0.46 0.01 -0.52 1.25 -0.21 0.00 0.00 178.00 178.99 2o2r h LEU 577 N 0.02 0.96 -0.25 2.35 5.85 -1.93 -2.89 115.31 119.41 2o2r h LEU 577 Ca 0.05 -0.50 -0.11 0.00 0.84 0.00 0.00 57.88 58.16 2o2r h LEU 577 Cb 0.07 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 2o2r h LEU 577 CO -0.10 1.29 -0.28 -0.03 -0.34 0.00 0.00 178.44 178.99 2o2r h MET 578 N 0.67 0.63 -0.66 1.25 4.05 -1.57 -0.84 114.93 118.45 2o2r h MET 578 Ca 0.02 -0.34 -0.07 0.00 -0.28 0.00 0.00 59.70 59.03 2o2r h MET 578 Cb 1.12 0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 31.91 2o2r h MET 578 CO 0.12 0.95 0.15 0.52 0.23 0.00 0.00 176.91 178.87 2o2r h MET 579 N 0.34 1.07 -0.56 0.39 2.86 -1.25 -0.91 114.93 116.86 2o2r h MET 579 Ca 0.04 -0.26 0.05 0.00 -2.06 0.00 0.00 59.70 57.46 2o2r h MET 579 Cb 0.85 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 32.33 2o2r h MET 579 CO 0.07 0.96 0.30 1.25 1.06 0.00 0.00 176.91 180.56 2o2r h LEU 580 N 0.99 0.45 -0.17 1.22 6.46 -1.38 -3.15 115.31 119.73 2o2r h LEU 580 Ca 0.21 0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.96 2o2r h LEU 580 Cb 0.38 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.24 2o2r h LEU 580 CO 0.00 0.31 -0.00 0.28 -0.62 0.00 0.00 178.44 178.41 2o2r h SER 581 N 0.58 0.30 -0.49 1.25 0.02 -0.64 0.43 113.55 115.00 2o2r h SER 581 Ca 0.25 -0.32 0.09 0.00 -0.84 0.00 0.00 61.79 60.97 2o2r h SER 581 Cb 0.13 -0.08 -0.10 0.00 0.14 0.00 0.00 62.40 62.49 2o2r h SER 581 CO -0.16 0.54 -0.38 -0.50 -1.14 0.00 0.00 176.83 175.20 2o2r h TRP 582 N 0.04 -1.08 0.05 3.45 4.06 -1.18 0.44 115.95 121.74 2o2r h TRP 582 Ca 0.05 0.07 -0.25 0.00 2.06 0.00 0.00 58.89 60.82 2o2r h TRP 582 Cb 0.39 0.54 0.02 0.00 -1.00 0.00 0.00 29.16 29.12 2o2r h TRP 582 CO 0.04 -0.41 -1.00 0.87 -3.56 0.00 0.00 178.44 174.38 2o2r h LYS 583 N -0.24 0.60 -0.40 0.49 1.57 -1.55 -3.20 116.57 113.84 2o2r h LYS 583 Ca 0.18 -0.70 -0.15 0.00 -1.87 0.00 0.00 60.65 58.11 2o2r h LYS 583 Cb 0.56 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.08 2o2r h LYS 583 CO -0.62 1.29 -0.33 1.15 -0.57 0.00 0.00 179.45 180.37 2o2r h THR 584 N 0.21 1.27 -0.14 -0.16 2.02 -0.75 -1.34 112.91 114.02 2o2r h THR 584 Ca -0.14 -1.50 -0.01 0.00 0.77 0.00 0.00 66.41 65.53 2o2r h THR 584 Cb 1.68 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 69.42 2o2r h THR 584 CO 0.19 0.50 0.06 0.00 0.37 0.00 0.00 175.52 176.65 2o2r h ALA 585 N 0.79 0.18 -0.52 6.16 0.00 -1.01 -0.50 119.26 124.35 2o2r h ALA 585 Ca 0.07 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 2o2r h ALA 585 Cb 0.92 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 2o2r h ALA 585 CO 0.09 -0.24 0.26 0.00 0.00 0.00 0.00 179.25 179.36 2o2r h ALA 586 N 0.92 0.67 -0.53 0.00 0.00 -1.55 -0.99 119.26 117.78 2o2r h ALA 586 Ca 0.05 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2o2r h ALA 586 Cb 0.15 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2o2r h ALA 586 CO -0.00 0.22 0.32 0.00 0.00 0.00 0.00 179.25 179.79 2o2r h LEU 588 N 0.71 0.32 -1.52 0.00 3.38 -1.01 -2.79 115.31 114.40 2o2r h LEU 588 Ca 0.19 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2o2r h LEU 588 Cb -0.03 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 2o2r h LEU 588 CO -0.04 1.13 0.16 0.00 0.09 0.00 0.00 178.44 179.79 2o2r h ALA 589 N 0.84 1.63 0.00 1.53 0.00 -1.07 -1.59 119.26 120.59 2o2r h ALA 589 Ca -0.07 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2o2r h ALA 589 Cb 1.66 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2o2r h ALA 589 CO 0.16 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.71 2o2r n ALA 590 N -2.48 2.31 -0.11 0.00 0.00 -0.94 -4.50 120.51 114.79 2o2r n ALA 590 Ca 0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2o2r n ALA 590 Cb 0.12 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.14 2o2r n ALA 590 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2o2r n GLY 591 N 0.95 0.95 3.94 0.00 0.00 -0.60 -3.89 105.19 106.54 2o2r n GLY 591 Ca 0.12 -0.01 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 2o2r n GLY 591 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2o2r s ASN 592 N -2.01 4.97 0.33 1.61 0.01 -1.06 -4.86 114.94 113.93 2o2r s ASN 592 Ca 0.00 0.32 0.10 0.00 -0.71 0.00 0.00 52.86 52.56 2o2r s ASN 592 Cb 0.00 -1.05 -0.06 0.00 0.41 0.00 0.00 41.25 40.56 2o2r s ASN 592 CO 0.00 -1.45 -0.06 0.42 -1.51 0.00 0.00 177.10 174.50 2o2r s THR 593 N -3.09 2.47 0.00 1.60 -4.23 -1.13 -4.54 115.64 106.71 2o2r s THR 593 Ca 0.59 -2.13 -0.06 0.00 -1.18 0.00 0.00 61.69 58.91 2o2r s THR 593 Cb -0.11 -2.67 -0.00 0.00 1.34 0.00 0.00 72.50 71.06 2o2r s THR 593 CO 0.43 -0.23 0.12 0.54 -0.54 0.00 0.00 174.62 174.94 2o2r s VAL 594 N -2.55 0.08 -0.18 2.29 0.11 -0.33 -1.00 120.40 118.82 2o2r s VAL 594 Ca 0.33 -0.68 0.01 0.00 -2.93 0.00 0.00 61.98 58.71 2o2r s VAL 594 Cb 0.00 -0.40 0.03 0.00 -1.53 0.00 0.00 36.38 34.47 2o2r s VAL 594 CO 0.18 -0.37 -0.16 -0.69 -3.33 0.00 0.00 175.10 170.72 2o2r s VAL 595 N -1.31 1.87 -0.14 2.04 1.01 -0.13 -2.41 120.40 121.34 2o2r s VAL 595 Ca -0.14 -0.92 -0.05 0.00 0.00 0.00 0.00 61.98 60.87 2o2r s VAL 595 Cb -0.07 -1.77 -0.04 0.00 0.00 0.00 0.00 36.38 34.50 2o2r s VAL 595 CO 0.01 0.42 0.04 -0.63 0.00 0.00 0.00 175.10 174.94 2o2r s ILE 596 N 1.34 4.63 -0.42 2.22 1.01 0.10 -1.10 121.20 128.98 2o2r s ILE 596 Ca 0.03 -0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.55 2o2r s ILE 596 Cb -0.14 -3.02 0.11 0.00 0.01 0.00 0.00 42.46 39.42 2o2r s ILE 596 CO -0.11 0.53 0.21 -0.75 0.00 0.00 0.00 174.94 174.83 2o2r s LYS 597 N -0.24 2.01 0.78 2.79 2.36 0.84 -0.70 119.74 127.57 2o2r s LYS 597 Ca 0.07 -1.89 -0.11 0.00 -2.55 0.00 0.00 55.97 51.50 2o2r s LYS 597 Cb -0.12 -3.57 0.06 0.00 -1.05 0.00 0.00 37.83 33.15 2o2r s LYS 597 CO 0.02 -1.07 1.09 -1.25 1.55 0.00 0.00 175.35 175.68 2o2r s PRO 598 N 1.01 2.18 0.35 4.03 0.04 -1.26 -2.27 135.00 139.09 2o2r s PRO 598 Ca 0.09 1.14 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 2o2r s PRO 598 Cb -0.22 -1.89 -0.11 0.00 0.04 0.00 0.00 34.50 32.31 2o2r s PRO 598 CO -0.04 -1.69 1.48 0.00 0.04 0.00 0.00 177.00 176.79 2o2r n ALA 599 N -3.55 2.22 -0.30 8.56 0.00 -1.06 -4.53 120.51 121.85 2o2r n ALA 599 Ca 0.09 0.35 0.09 0.00 0.00 0.00 0.00 53.44 53.97 2o2r n ALA 599 Cb 0.53 -2.40 0.24 0.00 0.00 0.00 0.00 19.45 17.82 2o2r n ALA 599 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2o2r h GLN 600 N 3.32 0.56 0.00 0.00 4.15 -1.90 -1.77 115.11 119.46 2o2r h GLN 600 Ca -0.49 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.90 2o2r h GLN 600 Cb 1.25 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.81 2o2r h GLN 600 CO 0.67 0.37 0.00 1.33 -1.93 0.00 0.00 178.83 179.27 2o2r n VAL 601 N -4.91 0.71 -3.16 2.39 0.24 -1.26 -4.07 118.33 108.27 2o2r n VAL 601 Ca 0.18 0.18 -0.21 0.00 -2.04 0.00 0.00 64.34 62.45 2o2r n VAL 601 Cb 0.48 -0.86 -0.05 0.00 -1.47 0.00 0.00 33.84 31.94 2o2r n VAL 601 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 2o2r n THR 602 N -1.48 -0.50 1.03 3.34 -2.24 -0.67 -4.68 114.28 109.08 2o2r n THR 602 Ca 0.05 -4.01 0.12 0.00 -2.27 0.00 0.00 64.05 57.94 2o2r n THR 602 Cb 0.21 -1.24 0.25 0.00 -2.10 0.00 0.00 70.33 67.45 2o2r n THR 602 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2o2r n PRO 603 N 1.08 0.12 0.03 -0.78 -0.04 -1.24 -4.48 135.00 129.69 2o2r n PRO 603 Ca 0.21 -0.07 -0.19 0.00 -0.04 0.00 0.00 63.50 63.41 2o2r n PRO 603 Cb 0.58 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.43 2o2r n PRO 603 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2o2r h LEU 604 N 0.18 0.74 -1.08 1.53 3.38 -1.93 -1.90 115.31 116.23 2o2r h LEU 604 Ca 0.00 -0.76 -0.06 0.00 0.09 0.00 0.00 57.88 57.15 2o2r h LEU 604 Cb 0.50 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2o2r h LEU 604 CO 0.00 1.41 -0.03 0.71 0.09 0.00 0.00 178.44 180.62 2o2r h THR 605 N 0.16 1.22 -0.52 0.22 1.35 -1.88 -0.65 112.91 112.81 2o2r h THR 605 Ca -0.11 -0.93 -0.00 0.00 -0.55 0.00 0.00 66.41 64.82 2o2r h THR 605 Cb 1.55 0.97 -0.02 0.00 -1.73 0.00 0.00 68.15 68.91 2o2r h THR 605 CO 0.17 0.32 0.31 0.00 -0.25 0.00 0.00 175.52 176.07 2o2r h ALA 606 N 1.39 0.66 -0.24 6.62 0.00 -1.82 0.61 119.26 126.47 2o2r h ALA 606 Ca 0.12 -0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 2o2r h ALA 606 Cb 0.41 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2o2r h ALA 606 CO 0.02 0.14 -0.39 -0.07 0.00 0.00 0.00 179.25 178.94 2o2r h LEU 607 N 0.69 0.59 -0.25 0.00 3.38 -1.03 -0.53 115.31 118.16 2o2r h LEU 607 Ca 0.19 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 2o2r h LEU 607 Cb -0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2o2r h LEU 607 CO -0.04 0.92 -0.05 0.50 0.09 0.00 0.00 178.44 179.86 2o2r h LYS 608 N 0.46 0.48 -0.77 1.13 1.63 -0.66 -2.57 116.57 116.27 2o2r h LYS 608 Ca 0.04 -0.18 0.18 0.00 -0.85 0.00 0.00 60.65 59.84 2o2r h LYS 608 Cb 0.89 -0.03 -0.13 0.00 -0.60 0.00 0.00 32.23 32.36 2o2r h LYS 608 CO 0.08 0.70 0.09 0.35 -3.45 0.00 0.00 179.45 177.21 2o2r h PHE 609 N 0.23 0.10 -0.79 1.91 3.57 0.31 -1.40 116.94 120.87 2o2r h PHE 609 Ca 0.06 0.05 0.09 0.00 3.53 0.00 0.00 57.97 61.70 2o2r h PHE 609 Cb 0.51 0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.26 2o2r h PHE 609 CO 0.05 -0.20 0.45 0.00 -2.23 0.00 0.00 178.31 176.38 2o2r h ALA 610 N 1.70 1.12 -0.44 2.41 0.00 -0.71 -1.01 119.26 122.33 2o2r h ALA 610 Ca 0.44 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.29 2o2r h ALA 610 Cb 0.80 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2o2r h ALA 610 CO -0.63 0.08 -0.08 1.49 0.00 0.00 0.00 179.25 180.11 2o2r h GLU 611 N 0.76 0.77 -0.23 0.00 4.81 -1.05 -2.68 114.58 116.96 2o2r h GLU 611 Ca 0.38 -0.24 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 2o2r h GLU 611 Cb 0.33 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 2o2r h GLU 611 CO -0.24 0.83 0.07 -0.07 -0.73 0.00 0.00 179.01 178.87 2o2r h LEU 612 N 0.70 0.28 -1.62 1.64 3.38 -0.17 -1.99 115.31 117.54 2o2r h LEU 612 Ca 0.12 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2o2r h LEU 612 Cb 0.55 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 2o2r h LEU 612 CO 0.03 0.28 -0.09 0.71 0.09 0.00 0.00 178.44 179.47 2o2r h THR 613 N 0.32 1.12 -0.32 0.22 1.35 -0.98 -0.28 112.91 114.34 2o2r h THR 613 Ca 0.08 -0.53 -0.10 0.00 -0.55 0.00 0.00 66.41 65.31 2o2r h THR 613 Cb 0.11 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 67.67 2o2r h THR 613 CO -0.01 0.16 -0.19 -0.07 -0.25 0.00 0.00 175.52 175.17 2o2r h LEU 614 N 0.13 0.72 -1.21 3.87 3.38 -1.38 -0.07 115.31 120.76 2o2r h LEU 614 Ca 0.03 -0.42 -0.06 0.00 0.09 0.00 0.00 57.88 57.51 2o2r h LEU 614 Cb 0.25 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2o2r h LEU 614 CO 0.01 0.99 -0.15 0.11 0.09 0.00 0.00 178.44 179.49 2o2r h LYS 615 N 0.46 0.37 0.00 1.13 1.57 -1.17 -2.70 116.57 116.22 2o2r h LYS 615 Ca 0.07 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2o2r h LYS 615 Cb 0.73 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2o2r h LYS 615 CO 0.05 0.51 0.00 0.00 -0.57 0.00 0.00 179.45 179.45 2o2r h ALA 616 N 1.51 1.00 0.00 3.86 0.00 -0.98 -3.48 119.26 121.18 2o2r h ALA 616 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2o2r h ALA 616 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2o2r h ALA 616 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 2o2r n GLY 617 N 1.13 0.61 3.69 0.00 0.00 -0.81 -4.71 105.19 105.10 2o2r n GLY 617 Ca 0.05 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.89 2o2r n GLY 617 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2o2r s ILE 618 N -2.00 3.05 0.53 -0.61 -1.09 -0.10 -4.94 121.20 116.05 2o2r s ILE 618 Ca 0.00 0.47 -0.20 0.00 -2.23 0.00 0.00 60.65 58.69 2o2r s ILE 618 Cb 0.00 -3.30 -0.08 0.00 -1.58 0.00 0.00 42.46 37.50 2o2r s ILE 618 CO 0.00 -0.01 0.87 -2.65 -1.23 0.00 0.00 174.94 171.93 2o2r n PRO 619 N 5.75 0.95 -1.93 2.79 -0.02 -1.26 -4.70 135.00 136.57 2o2r n PRO 619 Ca 0.16 0.36 -0.41 0.00 -2.02 0.00 0.00 63.50 61.58 2o2r n PRO 619 Cb 0.41 -2.01 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 2o2r n PRO 619 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2o2r s LYS 620 N -2.35 4.22 0.00 -0.52 -2.85 -1.26 -2.44 119.74 114.53 2o2r s LYS 620 Ca 0.70 2.40 0.00 0.00 -1.00 0.00 0.00 55.97 58.07 2o2r s LYS 620 Cb -0.47 -3.07 0.00 0.00 -2.06 0.00 0.00 37.83 32.23 2o2r s LYS 620 CO 0.52 -0.48 0.00 0.41 0.10 0.00 0.00 175.35 175.90 2o2r n GLY 621 N 1.95 2.50 0.28 0.59 0.00 -1.26 -4.68 105.19 104.56 2o2r n GLY 621 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.99 2o2r n GLY 621 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2o2r h VAL 622 N 0.00 1.26 -3.55 1.61 2.07 -1.75 -3.25 116.25 112.64 2o2r h VAL 622 Ca 0.00 -1.09 -0.64 0.00 0.82 0.00 0.00 66.70 65.79 2o2r h VAL 622 Cb 0.00 0.89 -0.33 0.00 -1.52 0.00 0.00 31.29 30.33 2o2r h VAL 622 CO 0.00 0.39 -0.86 -0.69 0.02 0.00 0.00 177.57 176.42 2o2r s VAL 623 N -5.04 1.83 -0.02 2.57 1.01 -1.26 -1.19 120.40 118.29 2o2r s VAL 623 Ca -0.12 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 60.96 2o2r s VAL 623 Cb 0.12 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.94 2o2r s VAL 623 CO 0.83 0.51 -0.00 0.20 0.00 0.00 0.00 175.10 176.64 2o2r s ASN 624 N 0.26 0.29 -0.07 3.32 0.01 -1.01 -4.58 114.94 113.16 2o2r s ASN 624 Ca -0.13 -0.02 0.02 0.00 -0.71 0.00 0.00 52.86 52.01 2o2r s ASN 624 Cb -0.16 -0.13 0.02 0.00 0.41 0.00 0.00 41.25 41.38 2o2r s ASN 624 CO 0.06 -0.07 -0.10 -0.63 -1.51 0.00 0.00 177.10 174.86 2o2r s ILE 625 N 0.71 1.00 -0.49 0.60 1.01 0.65 0.03 121.20 124.71 2o2r s ILE 625 Ca -0.07 -0.38 0.03 0.00 0.00 0.00 0.00 60.65 60.24 2o2r s ILE 625 Cb -0.10 -0.95 0.15 0.00 0.01 0.00 0.00 42.46 41.57 2o2r s ILE 625 CO -0.01 0.33 0.31 -0.76 0.00 0.00 0.00 174.94 174.81 2o2r s LEU 626 N 0.90 2.93 0.50 2.97 1.43 0.12 -1.31 118.68 126.22 2o2r s LEU 626 Ca -0.10 -2.96 -0.23 0.00 -1.03 0.00 0.00 54.13 49.80 2o2r s LEU 626 Cb -0.15 -1.06 -0.07 0.00 0.03 0.00 0.00 46.19 44.94 2o2r s LEU 626 CO 0.01 -0.21 1.28 -2.65 0.23 0.00 0.00 176.35 175.01 2o2r n PRO 627 N 3.09 1.72 -1.65 1.29 -0.02 -1.26 -4.40 135.00 133.77 2o2r n PRO 627 Ca 0.15 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.25 2o2r n PRO 627 Cb 0.37 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.40 2o2r n PRO 627 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2o2r n GLY 628 N 0.83 -0.39 3.85 -1.23 0.00 -1.26 -1.75 105.19 105.25 2o2r n GLY 628 Ca 0.09 -1.67 -0.33 0.00 0.00 0.00 0.00 46.02 44.11 2o2r n GLY 628 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2o2r s SER 629 N -1.45 6.78 0.19 1.61 1.04 -1.26 -3.84 113.70 116.76 2o2r s SER 629 Ca 0.00 1.15 -0.11 0.00 0.48 0.00 0.00 55.95 57.47 2o2r s SER 629 Cb 0.00 -2.32 0.10 0.00 0.10 0.00 0.00 66.02 63.90 2o2r s SER 629 CO 0.00 -0.08 1.79 1.23 0.98 0.00 0.00 173.24 177.16 2o2r h GLY 630 N 2.74 0.98 2.00 7.32 0.00 -1.95 0.40 103.07 114.56 2o2r h GLY 630 Ca -0.48 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.39 2o2r h GLY 630 CO 0.67 0.44 0.00 1.48 0.00 0.00 0.00 176.54 179.13 2o2r h SER 631 N 0.89 0.00 0.00 0.19 4.64 -1.95 0.21 113.55 117.53 2o2r h SER 631 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2o2r h SER 631 Cb 0.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2o2r h SER 631 CO -0.03 0.00 -0.65 -0.11 -0.87 0.00 0.00 176.83 175.16 2o2r n LEU 632 N -2.96 1.52 -0.03 5.97 0.00 -1.09 -4.45 117.00 115.96 2o2r n LEU 632 Ca -0.01 0.25 -0.15 0.00 0.00 0.00 0.00 56.01 56.10 2o2r n LEU 632 Cb 0.17 -0.60 -0.12 0.00 0.00 0.00 0.00 43.42 42.87 2o2r n LEU 632 CO 0.22 -0.41 0.40 0.58 0.00 0.00 0.00 177.39 178.18 2o2r h VAL 633 N -0.65 1.56 -0.58 1.96 2.07 -0.28 -2.60 116.25 117.73 2o2r h VAL 633 Ca 0.00 -1.95 -0.01 0.00 0.82 0.00 0.00 66.70 65.56 2o2r h VAL 633 Cb 0.65 2.80 -0.03 0.00 -1.52 0.00 0.00 31.29 33.20 2o2r h VAL 633 CO 0.00 0.53 0.33 1.23 0.02 0.00 0.00 177.57 179.68 2o2r h GLY 634 N -0.55 0.85 0.98 2.17 0.00 -1.14 -1.72 103.07 103.68 2o2r h GLY 634 Ca -0.03 -0.38 -0.00 0.00 0.00 0.00 0.00 47.33 46.92 2o2r h GLY 634 CO 0.04 0.36 0.24 -1.61 0.00 0.00 0.00 176.54 175.58 2o2r h GLN 635 N 0.78 0.54 -0.24 4.80 5.75 -0.73 -2.15 115.11 123.86 2o2r h GLN 635 Ca 0.20 -0.05 -0.09 0.00 -0.15 0.00 0.00 58.65 58.57 2o2r h GLN 635 Cb 0.02 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.44 2o2r h GLN 635 CO -0.03 0.40 -0.23 -0.09 -2.65 0.00 0.00 178.83 176.23 2o2r h ARG 636 N 0.53 0.45 -0.16 1.69 9.65 -1.17 -1.95 114.38 123.43 2o2r h ARG 636 Ca 0.14 -0.16 0.01 0.00 -1.10 0.00 0.00 59.98 58.87 2o2r h ARG 636 Cb -0.00 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 28.54 2o2r h ARG 636 CO -0.03 0.65 0.09 -0.07 2.80 0.00 0.00 179.97 183.42 2o2r h LEU 637 N 0.40 0.15 -1.44 3.80 3.38 -1.09 -0.87 115.31 119.65 2o2r h LEU 637 Ca 0.06 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 2o2r h LEU 637 Cb 0.62 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.34 2o2r h LEU 637 CO 0.04 0.11 -0.12 0.77 0.09 0.00 0.00 178.44 179.33 2o2r h SER 638 N 0.19 0.00 0.82 -0.43 4.64 -1.10 -2.92 113.55 114.74 2o2r h SER 638 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2o2r h SER 638 Cb -0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2o2r h SER 638 CO -0.03 0.12 -0.93 0.47 -0.87 0.00 0.00 176.83 175.59 2o2r n ASP 639 N -3.32 0.73 -4.73 4.97 8.00 -0.76 -3.94 116.55 117.51 2o2r n ASP 639 Ca -0.00 0.16 -0.42 0.00 0.71 0.00 0.00 54.79 55.24 2o2r n ASP 639 Cb 0.34 0.48 -0.03 0.00 -0.02 0.00 0.00 41.12 41.90 2o2r n ASP 639 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2o2r s HIS 640 N -3.28 3.01 0.13 1.24 2.46 -0.34 -4.84 115.29 113.66 2o2r s HIS 640 Ca 0.02 0.67 0.34 0.00 0.47 0.00 0.00 55.06 56.56 2o2r s HIS 640 Cb 0.12 -3.95 1.46 0.00 -0.13 0.00 0.00 32.58 30.08 2o2r s HIS 640 CO 0.78 -3.43 2.01 -1.00 -2.47 0.00 0.00 174.74 170.63 2o2r h PRO 641 N 6.33 0.00 -0.00 2.88 0.13 -1.91 -3.03 132.00 136.40 2o2r h PRO 641 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2o2r h PRO 641 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2o2r h PRO 641 CO 0.89 0.00 -0.72 -0.25 -0.23 0.00 0.00 178.00 177.68 2o2r n ASP 642 N -3.03 0.87 -4.74 1.44 10.43 -1.26 -4.88 116.55 115.38 2o2r n ASP 642 Ca 0.00 -0.73 -0.40 0.00 2.57 0.00 0.00 54.79 56.24 2o2r n ASP 642 Cb 0.27 0.62 -0.05 0.00 1.84 0.00 0.00 41.12 43.80 2o2r n ASP 642 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2o2r s VAL 643 N -2.94 4.91 -0.54 2.53 1.01 -1.15 -4.51 120.40 119.72 2o2r s VAL 643 Ca 0.11 1.47 0.09 0.00 0.00 0.00 0.00 61.98 63.65 2o2r s VAL 643 Cb 0.17 -4.04 -0.07 0.00 0.00 0.00 0.00 36.38 32.43 2o2r s VAL 643 CO 0.76 0.32 0.44 0.54 0.00 0.00 0.00 175.10 177.17 2o2r n ARG 644 N 3.23 3.55 -3.64 2.72 5.12 -0.06 -4.83 116.66 122.75 2o2r n ARG 644 Ca -0.03 -0.15 -0.10 0.00 -1.93 0.00 0.00 57.85 55.64 2o2r n ARG 644 Cb 0.51 -0.96 -0.07 0.00 -1.16 0.00 0.00 32.46 30.78 2o2r n ARG 644 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2o2r s LYS 645 N -1.70 0.75 -0.12 5.56 2.36 -1.23 -1.92 119.74 123.44 2o2r s LYS 645 Ca 0.05 1.11 0.00 0.00 -2.55 0.00 0.00 55.97 54.57 2o2r s LYS 645 Cb 0.07 0.25 -0.02 0.00 -1.05 0.00 0.00 37.83 37.08 2o2r s LYS 645 CO 0.33 -0.13 -0.13 0.42 1.55 0.00 0.00 175.35 177.39 2o2r s ILE 646 N 1.07 3.06 -0.19 5.43 -1.09 -0.22 -0.75 121.20 128.51 2o2r s ILE 646 Ca -0.06 -0.67 -0.04 0.00 -2.23 0.00 0.00 60.65 57.65 2o2r s ILE 646 Cb -0.05 -2.28 -0.02 0.00 -1.58 0.00 0.00 42.46 38.53 2o2r s ILE 646 CO -0.11 0.53 -0.02 -0.83 -1.23 0.00 0.00 174.94 173.29 2o2r s GLY 647 N 0.24 1.69 -0.05 6.18 0.00 0.09 -2.20 107.32 113.27 2o2r s GLY 647 Ca -0.09 -0.99 0.02 0.00 0.00 0.00 0.00 44.72 43.66 2o2r s GLY 647 CO 0.05 0.21 -0.11 -0.12 0.00 0.00 0.00 173.10 173.13 2o2r s PHE 648 N 0.97 1.25 -0.03 1.90 5.36 -0.54 -1.41 117.98 125.48 2o2r s PHE 648 Ca 0.01 -0.41 0.05 0.00 -0.96 0.00 0.00 56.93 55.62 2o2r s PHE 648 Cb -0.14 -0.93 -0.01 0.00 -0.34 0.00 0.00 43.02 41.60 2o2r s PHE 648 CO 0.01 -0.21 -0.17 0.99 -1.46 0.00 0.00 175.22 174.38 2o2r s THR 649 N 0.55 1.42 -4.39 0.12 2.01 -1.01 -1.13 115.64 113.21 2o2r s THR 649 Ca -0.11 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.16 2o2r s THR 649 Cb -0.14 -1.21 0.00 0.00 0.01 0.00 0.00 72.50 71.17 2o2r s THR 649 CO 0.02 0.41 0.00 0.61 -0.69 0.00 0.00 174.62 174.97 2o2r n GLY 650 N 2.94 -0.50 3.88 4.40 0.00 -0.56 -3.59 105.19 111.76 2o2r n GLY 650 Ca -0.17 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.83 2o2r n GLY 650 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2o2r s SER 651 N -4.00 6.46 0.22 1.61 1.04 -1.26 -3.83 113.70 113.94 2o2r s SER 651 Ca 0.00 1.10 -0.08 0.00 0.48 0.00 0.00 55.95 57.45 2o2r s SER 651 Cb 0.00 -2.31 0.30 0.00 0.10 0.00 0.00 66.02 64.10 2o2r s SER 651 CO 0.00 -0.45 1.79 0.74 0.98 0.00 0.00 173.24 176.30 2o2r h THR 652 N 0.87 0.89 -0.38 2.02 2.02 -1.88 -0.53 112.91 115.92 2o2r h THR 652 Ca -0.47 -0.21 -0.12 0.00 0.77 0.00 0.00 66.41 66.37 2o2r h THR 652 Cb 1.19 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2o2r h THR 652 CO 0.63 0.11 -0.24 -0.33 0.37 0.00 0.00 175.52 176.06 2o2r h GLU 653 N 0.62 0.83 -0.56 6.66 4.39 -1.94 0.08 114.58 124.67 2o2r h GLU 653 Ca 0.33 -0.39 -0.08 0.00 0.34 0.00 0.00 59.36 59.56 2o2r h GLU 653 Cb 0.30 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2o2r h GLU 653 CO -0.24 1.03 0.05 0.28 -1.16 0.00 0.00 179.01 178.97 2o2r h VAL 654 N 0.63 1.26 -0.47 3.13 2.07 -1.94 -2.78 116.25 118.15 2o2r h VAL 654 Ca 0.08 -1.04 0.06 0.00 0.82 0.00 0.00 66.70 66.61 2o2r h VAL 654 Cb 0.81 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 2o2r h VAL 654 CO 0.07 0.38 0.18 1.23 0.02 0.00 0.00 177.57 179.44 2o2r h GLY 655 N 0.84 0.63 0.12 2.17 0.00 -0.66 0.15 103.07 106.31 2o2r h GLY 655 Ca 0.16 -0.10 0.10 0.00 0.00 0.00 0.00 47.33 47.49 2o2r h GLY 655 CO 0.02 0.03 -0.05 0.50 0.00 0.00 0.00 176.54 177.04 2o2r h LYS 656 N 0.36 0.06 -0.49 4.80 1.57 -0.95 -0.91 116.57 121.00 2o2r h LYS 656 Ca 0.22 -0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.87 2o2r h LYS 656 Cb 0.22 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2o2r h LYS 656 CO -0.22 0.04 -0.18 1.25 -0.57 0.00 0.00 179.45 179.78 2o2r h HIS 657 N 0.07 1.13 -0.64 -1.35 2.76 -1.05 -0.79 115.15 115.28 2o2r h HIS 657 Ca 0.24 -0.26 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 2o2r h HIS 657 Cb 0.37 -0.27 -0.03 0.00 1.55 0.00 0.00 27.41 29.03 2o2r h HIS 657 CO -0.35 1.08 0.40 0.82 -1.30 0.00 0.00 177.93 178.58 2o2r h ILE 658 N 0.85 1.18 -0.48 6.26 2.04 -0.40 -1.31 117.51 125.65 2o2r h ILE 658 Ca 0.12 -0.36 -0.05 0.00 1.00 0.00 0.00 64.86 65.56 2o2r h ILE 658 Cb 0.75 0.27 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 2o2r h ILE 658 CO 0.06 0.18 0.10 -0.03 0.00 0.00 0.00 178.15 178.46 2o2r h MET 659 N 0.86 0.77 -0.41 2.37 4.05 -0.89 0.04 114.93 121.72 2o2r h MET 659 Ca 0.23 -0.19 0.07 0.00 -0.28 0.00 0.00 59.70 59.53 2o2r h MET 659 Cb -0.06 -0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 30.58 2o2r h MET 659 CO -0.05 0.77 0.04 -0.22 0.23 0.00 0.00 176.91 177.68 2o2r h LYS 660 N 0.65 0.15 -0.36 0.39 3.64 -1.07 -0.85 116.57 119.12 2o2r h LYS 660 Ca 0.15 -0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.43 2o2r h LYS 660 Cb 0.35 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 2o2r h LYS 660 CO 0.00 0.10 -0.15 0.77 -2.27 0.00 0.00 179.45 177.91 2o2r h SER 661 N 0.16 0.64 -0.63 4.20 0.02 -0.83 -0.54 113.55 116.57 2o2r h SER 661 Ca 0.20 -0.19 -0.02 0.00 -0.84 0.00 0.00 61.79 60.95 2o2r h SER 661 Cb 0.27 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 2o2r h SER 661 CO -0.30 0.80 0.33 0.00 -1.14 0.00 0.00 176.83 176.52 2o2r h ALA 663 N 1.15 -0.73 0.00 0.00 0.00 -0.58 -1.63 119.26 117.48 2o2r h ALA 663 Ca 0.22 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2o2r h ALA 663 Cb 0.07 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2o2r h ALA 663 CO -0.03 -0.93 0.00 -0.07 0.00 0.00 0.00 179.25 178.22 2o2r h LEU 664 N -0.72 0.00 0.00 0.00 3.38 -1.11 -3.26 115.31 113.60 2o2r h LEU 664 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2o2r h LEU 664 Cb 0.61 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.36 2o2r h LEU 664 CO 0.01 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 177.00 2o2r n SER 665 N -2.77 0.00 -1.45 -0.43 3.41 -0.97 -4.93 113.62 106.48 2o2r n SER 665 Ca 0.02 0.00 0.03 0.00 -0.26 0.00 0.00 58.87 58.66 2o2r n SER 665 Cb 0.36 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.37 2o2r n SER 665 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2o2r n ASN 666 N -0.36 1.36 -4.38 4.04 6.94 -1.18 -4.99 115.26 116.69 2o2r n ASN 666 Ca 0.00 -2.49 -0.34 0.00 -0.02 0.00 0.00 54.58 51.72 2o2r n ASN 666 Cb 0.00 -0.37 -0.09 0.00 -2.36 0.00 0.00 39.78 36.96 2o2r n ASN 666 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 2o2r n VAL 667 N -0.02 -0.76 -1.83 3.53 0.24 -0.62 -4.92 118.33 113.96 2o2r n VAL 667 Ca 0.10 -0.35 -0.38 0.00 -2.04 0.00 0.00 64.34 61.67 2o2r n VAL 667 Cb 1.00 -0.90 0.04 0.00 -1.47 0.00 0.00 33.84 32.51 2o2r n VAL 667 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 2o2r s LYS 668 N -7.33 3.22 0.59 7.34 -2.85 -1.16 -4.96 119.74 114.59 2o2r s LYS 668 Ca 0.25 2.20 -0.19 0.00 -1.00 0.00 0.00 55.97 57.22 2o2r s LYS 668 Cb -0.14 -2.29 -0.03 0.00 -2.06 0.00 0.00 37.83 33.31 2o2r s LYS 668 CO 1.01 -1.11 1.25 0.15 0.10 0.00 0.00 175.35 176.74 2o2r s LYS 669 N -2.87 2.93 -0.01 1.78 1.02 -0.81 -4.73 119.74 117.05 2o2r s LYS 669 Ca 0.70 1.94 -0.04 0.00 0.02 0.00 0.00 55.97 58.59 2o2r s LYS 669 Cb -0.39 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 2o2r s LYS 669 CO 0.47 -1.26 0.09 0.54 -0.92 0.00 0.00 175.35 174.27 2o2r s VAL 670 N -1.50 0.05 0.07 3.17 0.11 -1.26 -1.06 120.40 119.99 2o2r s VAL 670 Ca 0.77 -0.44 0.05 0.00 -2.93 0.00 0.00 61.98 59.44 2o2r s VAL 670 Cb -0.33 -0.28 -0.03 0.00 -1.53 0.00 0.00 36.38 34.21 2o2r s VAL 670 CO 0.37 -0.24 -0.14 -0.94 -3.33 0.00 0.00 175.10 170.82 2o2r s SER 671 N -0.77 1.69 -0.04 3.54 1.04 -0.93 -4.95 113.70 113.27 2o2r s SER 671 Ca -0.09 -0.63 -0.02 0.00 0.48 0.00 0.00 55.95 55.70 2o2r s SER 671 Cb -0.05 -0.05 0.03 0.00 0.10 0.00 0.00 66.02 66.05 2o2r s SER 671 CO 0.00 -0.08 0.07 -0.76 0.98 0.00 0.00 173.24 173.45 2o2r s LEU 672 N -1.78 0.22 -0.27 2.42 1.43 -0.81 -1.46 118.68 118.43 2o2r s LEU 672 Ca -0.01 0.10 -0.03 0.00 -1.03 0.00 0.00 54.13 53.16 2o2r s LEU 672 Cb -0.10 -0.10 0.03 0.00 0.03 0.00 0.00 46.19 46.05 2o2r s LEU 672 CO 0.02 -0.24 -0.02 -0.70 0.23 0.00 0.00 176.35 175.64 2o2r s GLU 673 N 2.07 2.79 -0.18 1.70 -6.30 -0.28 -1.32 118.70 117.18 2o2r s GLU 673 Ca 0.03 -1.02 0.15 0.00 -2.50 0.00 0.00 54.97 51.64 2o2r s GLU 673 Cb -0.12 -3.10 0.41 0.00 0.00 0.00 0.00 34.13 31.32 2o2r s GLU 673 CO -0.03 -0.46 1.29 1.28 0.02 0.00 0.00 175.26 177.36 2o2r n LEU 674 N 4.70 3.13 0.00 2.70 4.77 0.25 -1.50 117.00 131.04 2o2r n LEU 674 Ca -0.15 -3.31 0.05 0.00 -0.03 0.00 0.00 56.01 52.57 2o2r n LEU 674 Cb 0.46 -0.51 -0.01 0.00 -2.33 0.00 0.00 43.42 41.03 2o2r n LEU 674 CO 0.28 0.90 -0.07 0.61 -1.33 0.00 0.00 177.39 177.77 2o2r n GLY 675 N -1.08 -1.55 0.00 -0.72 0.00 -1.25 -3.82 105.19 96.77 2o2r n GLY 675 Ca 0.21 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 45.05 2o2r n GLY 675 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o2r n GLY 676 N -1.25 1.30 2.47 -0.02 0.00 -1.26 -4.44 105.19 101.98 2o2r n GLY 676 Ca 0.00 -0.82 -0.20 0.00 0.00 0.00 0.00 46.02 45.01 2o2r n GLY 676 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2o2r n LYS 677 N 0.00 0.39 -2.97 1.61 3.00 -1.26 -4.49 118.16 114.43 2o2r n LYS 677 Ca 0.00 -2.82 -0.41 0.00 -0.00 0.00 0.00 58.31 55.08 2o2r n LYS 677 Cb 0.00 -1.54 -0.04 0.00 0.00 0.00 0.00 35.03 33.45 2o2r n LYS 677 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2o2r s SER 678 N -0.08 6.96 0.27 3.14 0.01 -1.26 -4.75 113.70 117.99 2o2r s SER 678 Ca 0.33 1.17 -0.18 0.00 1.31 0.00 0.00 55.95 58.58 2o2r s SER 678 Cb 0.07 -2.43 -0.09 0.00 0.21 0.00 0.00 66.02 63.78 2o2r s SER 678 CO -0.15 -0.25 0.74 -2.16 0.41 0.00 0.00 173.24 171.82 2o2r s PRO 679 N 1.45 4.16 -0.13 12.44 0.04 -1.26 -0.06 135.00 151.64 2o2r s PRO 679 Ca 0.38 0.80 -0.00 0.00 0.04 0.00 0.00 61.00 62.21 2o2r s PRO 679 Cb -0.17 -2.69 0.03 0.00 0.04 0.00 0.00 34.50 31.70 2o2r s PRO 679 CO 0.16 0.29 -0.07 -1.17 0.04 0.00 0.00 177.00 176.25 2o2r s LEU 680 N -2.39 1.36 -0.21 -3.56 2.96 -0.23 -0.98 118.68 115.63 2o2r s LEU 680 Ca 0.48 -0.43 -0.07 0.00 -0.22 0.00 0.00 54.13 53.89 2o2r s LEU 680 Cb -0.14 -0.89 -0.04 0.00 0.50 0.00 0.00 46.19 45.62 2o2r s LEU 680 CO 0.19 -0.13 0.07 -0.63 -1.32 0.00 0.00 176.35 174.53 2o2r s ILE 681 N 1.67 4.62 -0.23 6.68 1.01 -0.25 -0.50 121.20 134.20 2o2r s ILE 681 Ca 0.04 -0.08 0.02 0.00 0.00 0.00 0.00 60.65 60.63 2o2r s ILE 681 Cb -0.13 -3.12 0.05 0.00 0.01 0.00 0.00 42.46 39.27 2o2r s ILE 681 CO -0.08 0.40 -0.12 -0.63 0.00 0.00 0.00 174.94 174.51 2o2r s ILE 682 N 0.90 2.03 0.35 2.92 1.01 0.33 -0.66 121.20 128.09 2o2r s ILE 682 Ca 0.04 -1.39 -0.06 0.00 0.00 0.00 0.00 60.65 59.24 2o2r s ILE 682 Cb -0.14 -2.09 -0.05 0.00 0.01 0.00 0.00 42.46 40.19 2o2r s ILE 682 CO 0.03 0.10 0.65 -0.36 0.00 0.00 0.00 174.94 175.35 2o2r s PHE 683 N 1.20 3.49 0.53 3.97 0.08 -0.71 -1.48 117.98 125.06 2o2r s PHE 683 Ca -0.05 0.76 0.37 0.00 0.12 0.00 0.00 56.93 58.13 2o2r s PHE 683 Cb -0.18 -2.21 1.99 0.00 -0.57 0.00 0.00 43.02 42.05 2o2r s PHE 683 CO -0.07 0.03 2.24 0.00 -0.10 0.00 0.00 175.22 177.32 2o2r h ALA 684 N 1.28 1.16 -0.32 5.36 0.00 -1.88 -2.60 119.26 122.26 2o2r h ALA 684 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2o2r h ALA 684 Cb 1.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2o2r h ALA 684 CO 0.64 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 179.52 2o2r n ASP 685 N -3.34 3.25 -4.42 0.00 5.68 -1.26 -4.92 116.55 111.54 2o2r n ASP 685 Ca -0.02 -2.40 -0.29 0.00 -0.50 0.00 0.00 54.79 51.58 2o2r n ASP 685 Cb 0.14 -0.54 0.15 0.00 -1.14 0.00 0.00 41.12 39.73 2o2r n ASP 685 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2o2r s ASP 687 N -4.78 6.50 0.11 0.00 3.68 -1.26 -4.85 116.67 116.07 2o2r s ASP 687 Ca 0.69 0.12 -0.17 0.00 2.13 0.00 0.00 52.55 55.32 2o2r s ASP 687 Cb -0.06 -2.49 -0.04 0.00 -1.45 0.00 0.00 42.92 38.88 2o2r s ASP 687 CO 0.51 -1.18 1.62 0.25 0.13 0.00 0.00 175.17 176.49 2o2r h LEU 688 N 10.97 0.48 -0.60 -1.34 5.85 -1.95 0.35 115.31 129.07 2o2r h LEU 688 Ca -0.24 -0.22 -0.04 0.00 0.84 0.00 0.00 57.88 58.22 2o2r h LEU 688 Cb 1.07 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 2o2r h LEU 688 CO 1.08 0.57 0.22 0.78 -0.34 0.00 0.00 178.44 180.76 2o2r h ASN 689 N 0.36 0.84 -0.93 1.25 2.35 -2.00 -0.12 115.58 117.33 2o2r h ASN 689 Ca 0.10 -0.18 -0.00 0.00 -0.55 0.00 0.00 56.30 55.67 2o2r h ASN 689 Cb 0.27 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.38 2o2r h ASN 689 CO -0.00 0.79 0.57 0.50 -1.65 0.00 0.00 177.43 177.64 2o2r h LYS 690 N 0.83 1.26 -0.46 0.81 3.11 -1.95 -2.04 116.57 118.13 2o2r h LYS 690 Ca 0.20 -0.11 -0.04 0.00 -2.81 0.00 0.00 60.65 57.89 2o2r h LYS 690 Cb 0.23 -0.27 -0.02 0.00 -1.00 0.00 0.00 32.23 31.17 2o2r h LYS 690 CO -0.01 0.87 0.11 0.00 -2.81 0.00 0.00 179.45 177.61 2o2r h ALA 691 N 1.31 1.33 0.14 5.00 0.00 -0.15 0.20 119.26 127.10 2o2r h ALA 691 Ca 0.34 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2o2r h ALA 691 Cb -0.07 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.53 2o2r h ALA 691 CO -0.06 0.48 -0.07 0.28 0.00 0.00 0.00 179.25 179.87 2o2r h VAL 692 N 0.67 1.00 -0.10 0.00 2.07 -0.87 0.55 116.25 119.57 2o2r h VAL 692 Ca 0.15 -0.69 0.04 0.00 0.82 0.00 0.00 66.70 67.03 2o2r h VAL 692 Cb 0.26 1.42 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 2o2r h VAL 692 CO -0.00 0.16 -0.16 1.56 0.02 0.00 0.00 177.57 179.14 2o2r h GLN 693 N -0.52 -0.21 -0.07 1.57 1.08 -1.08 0.18 115.11 116.07 2o2r h GLN 693 Ca -0.02 0.01 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 2o2r h GLN 693 Cb 0.41 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2o2r h GLN 693 CO 0.03 -0.14 -0.79 0.52 -0.95 0.00 0.00 178.83 177.50 2o2r h MET 694 N -0.22 0.45 -0.80 1.46 2.86 -0.65 -1.82 114.93 116.21 2o2r h MET 694 Ca 0.09 -0.39 0.01 0.00 -2.06 0.00 0.00 59.70 57.35 2o2r h MET 694 Cb 0.34 0.09 -0.04 0.00 0.06 0.00 0.00 31.60 32.05 2o2r h MET 694 CO -0.23 1.03 0.53 0.78 1.06 0.00 0.00 176.91 180.08 2o2r h GLY 695 N 1.20 1.13 0.93 8.32 0.00 0.26 0.55 103.07 115.45 2o2r h GLY 695 Ca -0.05 -0.41 -0.10 0.00 0.00 0.00 0.00 47.33 46.77 2o2r h GLY 695 CO 0.14 0.40 -0.22 -0.33 0.00 0.00 0.00 176.54 176.52 2o2r h MET 696 N 1.07 0.65 -0.60 4.80 2.07 -0.90 -2.95 114.93 119.05 2o2r h MET 696 Ca 0.30 -0.32 0.09 0.00 -2.07 0.00 0.00 59.70 57.69 2o2r h MET 696 Cb -0.11 0.00 -0.07 0.00 -1.87 0.00 0.00 31.60 29.56 2o2r h MET 696 CO -0.07 0.92 0.25 1.03 1.07 0.00 0.00 176.91 180.10 2o2r h SER 697 N 0.38 0.27 -0.53 1.22 0.87 -1.12 0.26 113.55 114.91 2o2r h SER 697 Ca 0.05 0.07 0.15 0.00 -1.23 0.00 0.00 61.79 60.83 2o2r h SER 697 Cb 0.77 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.75 2o2r h SER 697 CO 0.06 0.17 0.43 0.77 -0.53 0.00 0.00 176.83 177.72 2o2r h SER 698 N 0.44 0.00 0.00 6.23 4.64 -0.71 -2.50 113.55 121.65 2o2r h SER 698 Ca 0.30 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.23 2o2r h SER 698 Cb 0.34 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.37 2o2r h SER 698 CO -0.28 0.00 -2.29 0.52 -0.87 0.00 0.00 176.83 173.91 2o2r n VAL 699 N -4.13 1.27 0.95 0.95 0.31 -0.93 -0.85 118.33 115.90 2o2r n VAL 699 Ca 0.10 -0.33 0.12 0.00 -0.01 0.00 0.00 64.34 64.22 2o2r n VAL 699 Cb 0.64 -1.78 0.29 0.00 -0.91 0.00 0.00 33.84 32.09 2o2r n VAL 699 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2o2r n PHE 700 N -3.98 0.07 -1.73 3.52 3.72 0.88 -3.71 117.46 116.23 2o2r n PHE 700 Ca -0.45 0.02 -0.42 0.00 -0.05 0.00 0.00 57.45 56.54 2o2r n PHE 700 Cb 0.83 -0.33 -0.01 0.00 -0.94 0.00 0.00 39.48 39.02 2o2r n PHE 700 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 2o2r n PHE 701 N -1.57 2.68 -3.99 1.38 7.35 -0.95 -1.76 117.46 120.60 2o2r n PHE 701 Ca 0.05 0.36 -0.28 0.00 -0.76 0.00 0.00 57.45 56.82 2o2r n PHE 701 Cb 0.35 -2.54 -0.01 0.00 0.35 0.00 0.00 39.48 37.63 2o2r n PHE 701 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2o2r n ASN 702 N 1.70 -1.41 -3.60 -2.13 5.15 -1.26 -1.47 115.26 112.25 2o2r n ASN 702 Ca 0.07 -0.97 -0.25 0.00 -0.60 0.00 0.00 54.58 52.83 2o2r n ASN 702 Cb 0.36 -3.15 -0.03 0.00 -0.53 0.00 0.00 39.78 36.43 2o2r n ASN 702 CO 0.00 0.00 0.00 2.29 1.40 0.00 0.00 177.26 180.95 2o2r n LYS 703 N -4.42 -2.59 -0.80 1.20 0.00 -0.72 -1.04 118.16 109.79 2o2r n LYS 703 Ca -0.20 0.29 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 2o2r n LYS 703 Cb 0.63 -4.93 0.00 0.00 -0.00 0.00 0.00 35.03 30.73 2o2r n LYS 703 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2o2r n GLY 704 N -1.04 0.98 3.15 2.58 0.00 -0.54 -3.49 105.19 106.83 2o2r n GLY 704 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 2o2r n GLY 704 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2o2r n GLU 705 N -2.00 3.43 -3.39 1.61 1.02 -0.21 -3.05 120.64 118.05 2o2r n GLU 705 Ca 0.00 -3.57 -0.09 0.00 -0.02 0.00 0.00 57.16 53.48 2o2r n GLU 705 Cb 0.00 -3.04 -0.08 0.00 -0.02 0.00 0.00 31.44 28.30 2o2r n GLU 705 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2o2r s ASN 706 N 2.08 0.19 0.39 1.62 3.04 -1.26 -4.74 114.94 116.25 2o2r s ASN 706 Ca 0.43 0.31 0.17 0.00 0.04 0.00 0.00 52.86 53.81 2o2r s ASN 706 Cb 0.04 1.13 1.05 0.00 -1.54 0.00 0.00 41.25 41.94 2o2r s ASN 706 CO 0.00 -0.29 1.78 0.00 -3.04 0.00 0.00 177.10 175.56 2o2r n ILE 708 N -4.63 0.49 -1.50 0.00 -5.35 -1.26 -4.29 119.36 102.82 2o2r n ILE 708 Ca 0.24 -0.72 -0.46 0.00 -0.27 0.00 0.00 62.75 61.55 2o2r n ILE 708 Cb 0.81 0.90 -0.02 0.00 -1.74 0.00 0.00 39.64 39.59 2o2r n ILE 708 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2o2r n ALA 709 N 1.39 -1.44 -2.11 -1.28 0.00 -0.72 -4.80 120.51 111.55 2o2r n ALA 709 Ca 0.19 0.39 -0.43 0.00 0.00 0.00 0.00 53.44 53.60 2o2r n ALA 709 Cb 0.58 -1.83 -0.03 0.00 0.00 0.00 0.00 19.45 18.18 2o2r n ALA 709 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2o2r s ALA 710 N -1.07 3.00 -0.85 0.00 0.00 -0.03 -4.13 121.76 118.69 2o2r s ALA 710 Ca 0.61 0.22 0.26 0.00 0.00 0.00 0.00 51.96 53.05 2o2r s ALA 710 Cb -0.79 -3.96 0.80 0.00 0.00 0.00 0.00 23.12 19.17 2o2r s ALA 710 CO 0.58 -2.42 1.67 0.41 0.00 0.00 0.00 175.76 176.01 2o2r n GLY 711 N 5.17 -1.50 3.17 0.00 0.00 0.91 -4.63 105.19 108.32 2o2r n GLY 711 Ca 0.20 -0.15 -0.13 0.00 0.00 0.00 0.00 46.02 45.95 2o2r n GLY 711 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o2r s ARG 712 N -3.06 0.36 -0.13 1.61 0.52 -1.09 -4.58 118.95 112.57 2o2r s ARG 712 Ca 0.11 0.31 0.01 0.00 -0.52 0.00 0.00 55.73 55.64 2o2r s ARG 712 Cb 0.16 0.17 -0.01 0.00 0.52 0.00 0.00 34.95 35.79 2o2r s ARG 712 CO 0.62 -0.05 -0.17 -0.51 0.02 0.00 0.00 175.30 175.21 2o2r s LEU 713 N -0.03 2.47 -0.22 2.53 1.02 -0.11 -1.06 118.68 123.27 2o2r s LEU 713 Ca -0.02 -0.44 -0.07 0.00 0.02 0.00 0.00 54.13 53.62 2o2r s LEU 713 Cb -0.02 -1.54 -0.03 0.00 0.02 0.00 0.00 46.19 44.61 2o2r s LEU 713 CO 0.01 0.13 0.06 -0.36 0.02 0.00 0.00 176.35 176.21 2o2r s PHE 714 N 0.54 3.12 -0.06 0.29 0.40 0.35 -0.80 117.98 121.83 2o2r s PHE 714 Ca -0.10 -0.26 0.05 0.00 -0.60 0.00 0.00 56.93 56.02 2o2r s PHE 714 Cb -0.16 -2.17 -0.01 0.00 0.51 0.00 0.00 43.02 41.20 2o2r s PHE 714 CO 0.04 -0.18 -0.22 0.08 0.70 0.00 0.00 175.22 175.64 2o2r s VAL 715 N 1.13 1.83 0.35 -0.44 1.01 -0.03 -0.51 120.40 123.74 2o2r s VAL 715 Ca 0.04 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 60.81 2o2r s VAL 715 Cb -0.14 -1.56 -0.10 0.00 0.00 0.00 0.00 36.38 34.58 2o2r s VAL 715 CO 0.03 0.51 1.37 -0.70 0.00 0.00 0.00 175.10 176.31 2o2r s GLU 716 N -0.02 4.25 0.22 2.72 2.12 -0.55 -1.72 118.70 125.71 2o2r s GLU 716 Ca -0.06 2.34 -0.14 0.00 0.36 0.00 0.00 54.97 57.47 2o2r s GLU 716 Cb -0.14 -3.02 0.25 0.00 0.26 0.00 0.00 34.13 31.49 2o2r s GLU 716 CO 0.04 -0.32 1.61 1.49 -0.54 0.00 0.00 175.26 177.54 2o2r h GLU 717 N 3.21 -0.02 0.00 4.30 4.22 -0.73 -1.88 114.58 123.68 2o2r h GLU 717 Ca -0.50 0.00 0.00 0.00 0.08 0.00 0.00 59.36 58.95 2o2r h GLU 717 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 2o2r h GLU 717 CO 0.65 -0.01 0.00 -1.13 -2.18 0.00 0.00 179.01 176.33 2o2r n SER 718 N -5.46 0.36 -0.07 1.04 3.41 -1.26 -2.09 113.62 109.56 2o2r n SER 718 Ca 0.08 0.61 0.01 0.00 -0.26 0.00 0.00 58.87 59.31 2o2r n SER 718 Cb 0.35 -0.68 0.00 0.00 -0.26 0.00 0.00 64.21 63.63 2o2r n SER 718 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2o2r n ILE 719 N -1.92 0.00 -0.04 -1.33 -5.35 -0.75 -4.83 119.36 105.14 2o2r n ILE 719 Ca 0.02 -0.49 -0.09 0.00 -0.27 0.00 0.00 62.75 61.92 2o2r n ILE 719 Cb 0.15 1.04 -0.03 0.00 -1.74 0.00 0.00 39.64 39.06 2o2r n ILE 719 CO 0.00 0.00 0.00 -0.74 -1.76 0.00 0.00 176.55 174.05 2o2r h HIS 720 N 0.34 -0.03 -0.12 4.28 2.76 -0.90 0.11 115.15 121.59 2o2r h HIS 720 Ca 0.00 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.17 2o2r h HIS 720 Cb 0.08 0.04 -0.00 0.00 1.55 0.00 0.00 27.41 29.08 2o2r h HIS 720 CO 0.00 -0.04 0.01 -0.91 -1.30 0.00 0.00 177.93 175.69 2o2r h ASN 721 N 0.05 0.19 -0.88 3.26 2.35 -1.88 -0.17 115.58 118.49 2o2r h ASN 721 Ca 0.09 -0.27 0.03 0.00 -0.55 0.00 0.00 56.30 55.60 2o2r h ASN 721 Cb 0.12 -0.05 -0.05 0.00 0.05 0.00 0.00 38.32 38.39 2o2r h ASN 721 CO -0.17 0.42 0.58 -0.61 -1.65 0.00 0.00 177.43 176.00 2o2r h GLN 722 N -0.04 1.09 -0.18 0.81 4.15 -1.87 -1.84 115.11 117.23 2o2r h GLN 722 Ca 0.04 -0.07 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 2o2r h GLN 722 Cb 0.31 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 2o2r h GLN 722 CO 0.00 0.72 0.09 0.35 -1.93 0.00 0.00 178.83 178.07 2o2r h PHE 723 N 1.13 0.25 -0.46 3.99 3.04 -0.38 -1.78 116.94 122.73 2o2r h PHE 723 Ca 0.34 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.27 2o2r h PHE 723 Cb -0.02 -0.08 -0.02 0.00 2.56 0.00 0.00 35.95 38.39 2o2r h PHE 723 CO -0.00 0.26 0.23 0.28 -2.02 0.00 0.00 178.31 177.06 2o2r h VAL 724 N 0.17 1.18 -0.42 1.41 2.07 -0.76 -1.30 116.25 118.60 2o2r h VAL 724 Ca 0.06 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.07 2o2r h VAL 724 Cb 0.09 0.66 -0.02 0.00 -1.52 0.00 0.00 31.29 30.51 2o2r h VAL 724 CO -0.01 0.20 0.20 1.56 0.02 0.00 0.00 177.57 179.54 2o2r h GLN 725 N 0.60 0.60 -0.77 1.57 4.20 -1.32 -1.26 115.11 118.74 2o2r h GLN 725 Ca 0.16 -0.09 -0.02 0.00 0.06 0.00 0.00 58.65 58.77 2o2r h GLN 725 Cb 0.10 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.74 2o2r h GLN 725 CO -0.02 0.52 0.42 0.87 -0.67 0.00 0.00 178.83 179.95 2o2r h LYS 726 N 0.53 1.06 -0.32 1.46 1.57 -1.19 -1.01 116.57 118.68 2o2r h LYS 726 Ca 0.14 -0.12 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 2o2r h LYS 726 Cb 0.12 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2o2r h LYS 726 CO -0.02 0.78 0.11 0.28 -0.57 0.00 0.00 179.45 180.03 2o2r h VAL 727 N 1.07 1.20 -0.44 0.50 2.07 -0.89 -2.43 116.25 117.33 2o2r h VAL 727 Ca 0.27 -0.63 0.02 0.00 0.82 0.00 0.00 66.70 67.18 2o2r h VAL 727 Cb 0.03 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 2o2r h VAL 727 CO -0.04 0.22 0.26 0.58 0.02 0.00 0.00 177.57 178.60 2o2r h VAL 728 N 0.36 1.04 -0.90 2.57 2.07 -0.91 0.20 116.25 120.68 2o2r h VAL 728 Ca 0.10 -0.18 0.14 0.00 0.82 0.00 0.00 66.70 67.59 2o2r h VAL 728 Cb 0.23 0.48 -0.09 0.00 -1.52 0.00 0.00 31.29 30.39 2o2r h VAL 728 CO -0.00 0.09 0.51 -0.33 0.02 0.00 0.00 177.57 177.86 2o2r h GLU 729 N 0.52 0.74 0.06 1.57 5.08 -1.13 -1.59 114.58 119.81 2o2r h GLU 729 Ca 0.18 -0.04 -0.24 0.00 -1.00 0.00 0.00 59.36 58.26 2o2r h GLU 729 Cb 0.02 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2o2r h GLU 729 CO -0.09 0.49 -1.09 0.93 -1.00 0.00 0.00 179.01 178.25 2o2r h GLU 730 N 0.76 0.14 -0.85 2.33 4.39 -0.90 -3.22 114.58 117.23 2o2r h GLU 730 Ca 0.48 -0.23 -0.03 0.00 0.34 0.00 0.00 59.36 59.92 2o2r h GLU 730 Cb 0.60 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.30 2o2r h GLU 730 CO -0.32 1.09 0.41 0.28 -1.16 0.00 0.00 179.01 179.31 2o2r h VAL 731 N 0.04 1.26 0.00 3.13 2.07 -0.17 -2.36 116.25 120.23 2o2r h VAL 731 Ca -0.07 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.72 2o2r h VAL 731 Cb 1.83 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 31.78 2o2r h VAL 731 CO 0.16 0.31 -0.01 -0.33 0.02 0.00 0.00 177.57 177.73 2o2r h GLU 732 N 1.21 0.00 0.00 1.57 5.08 -1.32 -2.32 114.58 118.81 2o2r h GLU 732 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2o2r h GLU 732 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2o2r h GLU 732 CO -0.04 0.01 -0.15 1.63 -1.00 0.00 0.00 179.01 179.47 2o2r n LYS 733 N -4.29 0.11 -2.20 2.33 5.02 -0.89 -4.88 118.16 113.36 2o2r n LYS 733 Ca -0.03 0.07 -0.42 0.00 -2.02 0.00 0.00 58.31 55.91 2o2r n LYS 733 Cb 0.10 -1.61 -0.03 0.00 -0.02 0.00 0.00 35.03 33.46 2o2r n LYS 733 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2o2r s MET 734 N -3.05 4.33 -0.32 1.97 -1.94 -0.87 -4.98 119.30 114.44 2o2r s MET 734 Ca 0.12 2.04 -0.17 0.00 -1.71 0.00 0.00 55.69 55.96 2o2r s MET 734 Cb 0.16 -3.26 -0.01 0.00 2.01 0.00 0.00 34.83 33.73 2o2r s MET 734 CO 0.60 -0.41 0.49 0.21 -0.01 0.00 0.00 175.02 175.89 2o2r s LYS 735 N 1.10 3.76 -0.03 2.03 2.47 -1.26 -4.96 119.74 122.84 2o2r s LYS 735 Ca 0.64 -0.05 -0.14 0.00 -1.56 0.00 0.00 55.97 54.85 2o2r s LYS 735 Cb -0.36 -3.76 -0.05 0.00 -1.46 0.00 0.00 37.83 32.20 2o2r s LYS 735 CO 0.30 -0.53 0.38 0.42 0.16 0.00 0.00 175.35 176.08 2o2r s ILE 736 N 2.32 5.09 -1.73 5.43 1.01 -1.26 -0.21 121.20 131.85 2o2r s ILE 736 Ca 0.18 0.78 0.00 0.00 0.00 0.00 0.00 60.65 61.61 2o2r s ILE 736 Cb -0.16 -3.69 0.00 0.00 0.01 0.00 0.00 42.46 38.63 2o2r s ILE 736 CO 0.12 0.56 0.00 0.61 0.00 0.00 0.00 174.94 176.23 2o2r n GLY 737 N 2.00 -1.38 3.70 6.18 0.00 -0.89 -4.95 105.19 109.85 2o2r n GLY 737 Ca -0.14 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 2o2r n GLY 737 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2o2r n ASN 738 N 1.04 3.94 0.28 1.61 2.85 -1.26 -4.44 115.26 119.27 2o2r n ASN 738 Ca 0.00 1.02 0.12 0.00 -0.11 0.00 0.00 54.58 55.61 2o2r n ASN 738 Cb 0.00 -1.54 0.80 0.00 1.24 0.00 0.00 39.78 40.28 2o2r n ASN 738 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2o2r h PRO 739 N 7.72 0.00 0.00 1.20 0.13 -1.87 -2.05 132.00 137.12 2o2r h PRO 739 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2o2r h PRO 739 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2o2r h PRO 739 CO 0.95 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 180.00 2o2r n LEU 740 N -4.13 0.74 -4.72 1.56 4.77 -1.26 -1.15 117.00 112.81 2o2r n LEU 740 Ca -0.03 0.61 -0.41 0.00 -0.03 0.00 0.00 56.01 56.15 2o2r n LEU 740 Cb 0.09 -0.43 -0.04 0.00 -2.33 0.00 0.00 43.42 40.71 2o2r n LEU 740 CO 0.30 -0.34 0.62 -1.61 -1.33 0.00 0.00 177.39 175.03 2o2r s GLU 741 N -3.19 4.59 0.59 3.23 0.41 -0.77 -4.91 118.70 118.64 2o2r s GLU 741 Ca 0.08 1.33 0.36 0.00 -0.41 0.00 0.00 54.97 56.33 2o2r s GLU 741 Cb 0.11 -3.42 1.75 0.00 -1.78 0.00 0.00 34.13 30.79 2o2r s GLU 741 CO 0.51 0.10 2.13 0.00 -0.49 0.00 0.00 175.26 177.51 2o2r h ARG 742 N 6.20 0.00 -0.00 1.61 2.47 -1.87 -2.07 114.38 120.71 2o2r h ARG 742 Ca -0.42 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.30 2o2r h ARG 742 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.53 2o2r h ARG 742 CO 0.73 0.03 -0.43 -0.40 0.56 0.00 0.00 179.97 180.46 2o2r n ASP 743 N -3.18 0.63 -4.71 7.04 5.68 -1.26 -4.91 116.55 115.84 2o2r n ASP 743 Ca -0.01 -0.42 -0.42 0.00 -0.50 0.00 0.00 54.79 53.44 2o2r n ASP 743 Cb 0.22 0.21 -0.03 0.00 -1.14 0.00 0.00 41.12 40.38 2o2r n ASP 743 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2o2r s THR 744 N -2.86 2.52 -0.18 2.12 2.01 -0.78 -4.70 115.64 113.77 2o2r s THR 744 Ca 0.15 0.27 0.13 0.00 0.31 0.00 0.00 61.69 62.54 2o2r s THR 744 Cb 0.18 -3.17 -0.23 0.00 0.01 0.00 0.00 72.50 69.29 2o2r s THR 744 CO 0.65 0.01 0.15 0.59 -0.69 0.00 0.00 174.62 175.33 2o2r n ASN 745 N 4.59 0.64 -3.68 3.53 5.03 0.70 -4.95 115.26 121.11 2o2r n ASN 745 Ca 0.15 0.07 -0.26 0.00 0.87 0.00 0.00 54.58 55.41 2o2r n ASN 745 Cb 0.38 0.44 -0.17 0.00 -1.02 0.00 0.00 39.78 39.41 2o2r n ASN 745 CO 0.00 0.00 0.00 -2.28 -1.83 0.00 0.00 177.26 173.15 2o2r s HIS 746 N -2.52 0.57 0.45 3.10 5.04 -0.59 -4.93 115.29 116.40 2o2r s HIS 746 Ca -0.14 -0.47 -0.02 0.00 -1.54 0.00 0.00 55.06 52.88 2o2r s HIS 746 Cb 0.07 -0.82 0.09 0.00 0.04 0.00 0.00 32.58 31.96 2o2r s HIS 746 CO 0.79 -0.51 0.61 0.41 -2.34 0.00 0.00 174.74 173.70 2o2r n GLY 747 N 5.17 0.27 3.82 1.59 0.00 -1.26 -2.10 105.19 112.68 2o2r n GLY 747 Ca -0.07 -1.93 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 2o2r n GLY 747 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2o2r s PRO 748 N -4.10 3.25 0.91 1.61 0.04 -1.26 -4.76 135.00 130.69 2o2r s PRO 748 Ca 0.39 1.05 -0.12 0.00 0.04 0.00 0.00 61.00 62.36 2o2r s PRO 748 Cb -0.02 -2.03 0.14 0.00 0.04 0.00 0.00 34.50 32.63 2o2r s PRO 748 CO 0.26 -0.86 1.09 -0.65 0.04 0.00 0.00 177.00 176.89 2o2r s GLN 749 N -4.54 1.10 0.19 4.56 -1.52 0.30 -4.70 119.66 115.06 2o2r s GLN 749 Ca 0.60 0.85 -0.07 0.00 -1.95 0.00 0.00 55.36 54.79 2o2r s GLN 749 Cb -0.14 -1.79 0.11 0.00 -0.22 0.00 0.00 33.01 30.97 2o2r s GLN 749 CO 0.45 -2.35 1.59 -0.97 -0.25 0.00 0.00 175.29 173.75 2o2r h ASN 750 N -1.63 0.89 -5.00 5.90 -0.73 -1.85 -3.45 115.58 109.71 2o2r h ASN 750 Ca -0.50 -0.33 0.06 0.00 1.87 0.00 0.00 56.30 57.40 2o2r h ASN 750 Cb 1.29 -0.24 -0.06 0.00 0.27 0.00 0.00 38.32 39.58 2o2r h ASN 750 CO 0.54 1.08 0.23 -1.38 -0.37 0.00 0.00 177.43 177.53 2o2r s HIS 751 N -4.63 -0.22 0.04 0.67 -3.43 -1.26 -4.57 115.29 101.91 2o2r s HIS 751 Ca -0.10 -0.22 -0.21 0.00 -0.80 0.00 0.00 55.06 53.72 2o2r s HIS 751 Cb 0.13 0.70 -0.14 0.00 -1.43 0.00 0.00 32.58 31.84 2o2r s HIS 751 CO 0.85 -1.21 1.42 1.49 -2.00 0.00 0.00 174.74 175.29 2o2r h GLU 752 N 2.00 0.27 -0.85 -0.38 4.81 -1.95 -2.32 114.58 116.16 2o2r h GLU 752 Ca -0.20 -0.11 0.14 0.00 -0.13 0.00 0.00 59.36 59.06 2o2r h GLU 752 Cb 1.25 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.56 2o2r h GLU 752 CO 0.24 0.57 0.55 0.00 -0.73 0.00 0.00 179.01 179.65 2o2r h ALA 753 N 0.69 1.90 -0.12 2.92 0.00 -1.99 -1.34 119.26 121.30 2o2r h ALA 753 Ca 0.03 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 2o2r h ALA 753 Cb 0.48 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2o2r h ALA 753 CO 0.02 -0.12 -0.34 1.25 0.00 0.00 0.00 179.25 180.06 2o2r h HIS 754 N 0.62 0.58 -0.87 0.00 -0.00 -1.93 -2.21 115.15 111.35 2o2r h HIS 754 Ca 0.42 -0.23 0.17 0.00 -0.00 0.00 0.00 60.37 60.73 2o2r h HIS 754 Cb 0.72 -0.10 -0.10 0.00 -0.00 0.00 0.00 27.41 27.93 2o2r h HIS 754 CO -0.00 0.95 0.43 1.25 -0.00 0.00 0.00 177.93 180.57 2o2r h LEU 755 N 0.04 0.49 -0.45 0.26 5.85 -0.91 -1.59 115.31 119.00 2o2r h LEU 755 Ca -0.01 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 2o2r h LEU 755 Cb 0.95 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 2o2r h LEU 755 CO 0.07 0.17 0.10 0.03 -0.34 0.00 0.00 178.44 178.47 2o2r h ARG 756 N 0.57 0.74 -0.67 1.25 2.47 -1.09 -1.34 114.38 116.30 2o2r h ARG 756 Ca 0.49 -0.18 0.09 0.00 -1.26 0.00 0.00 59.98 59.12 2o2r h ARG 756 Cb 0.76 -0.09 -0.07 0.00 -1.65 0.00 0.00 29.97 28.92 2o2r h ARG 756 CO -0.40 0.74 0.31 -0.22 0.56 0.00 0.00 179.97 180.96 2o2r h LYS 757 N 0.61 0.52 -0.48 0.04 3.11 -0.90 -1.38 116.57 118.07 2o2r h LYS 757 Ca 0.14 -0.03 -0.07 0.00 -2.81 0.00 0.00 60.65 57.88 2o2r h LYS 757 Cb 0.34 -0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 31.44 2o2r h LYS 757 CO 0.00 0.34 0.03 -0.07 -2.81 0.00 0.00 179.45 176.95 2o2r h LEU 758 N 0.53 0.81 -0.19 5.20 3.38 -0.83 0.20 115.31 124.40 2o2r h LEU 758 Ca 0.33 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 58.04 2o2r h LEU 758 Cb 0.37 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2o2r h LEU 758 CO -0.28 0.89 0.07 0.58 0.09 0.00 0.00 178.44 179.79 2o2r h VAL 759 N 0.69 0.96 -0.78 1.22 2.07 -0.94 -2.43 116.25 117.04 2o2r h VAL 759 Ca 0.14 -0.06 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 2o2r h VAL 759 Cb 0.46 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2o2r h VAL 759 CO 0.02 0.03 0.42 -0.33 0.02 0.00 0.00 177.57 177.73 2o2r h GLU 760 N 0.16 1.08 -0.31 1.57 5.08 -1.01 -2.37 114.58 118.79 2o2r h GLU 760 Ca 0.08 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.37 2o2r h GLU 760 Cb 0.05 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.04 2o2r h GLU 760 CO -0.08 0.80 0.03 -0.92 -1.00 0.00 0.00 179.01 177.83 2o2r h TYR 761 N 1.09 0.04 0.00 4.33 5.03 -0.40 -1.96 116.97 125.10 2o2r h TYR 761 Ca 0.27 0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.49 2o2r h TYR 761 Cb 0.03 0.03 -0.02 0.00 1.55 0.00 0.00 36.73 38.32 2o2r h TYR 761 CO 0.01 -0.02 -0.57 0.00 -1.32 0.00 0.00 178.16 176.26 2o2r h GLN 763 N 0.00 0.03 -0.79 0.00 4.20 -1.28 -2.08 115.11 115.19 2o2r h GLN 763 Ca -0.01 -0.00 0.04 0.00 0.06 0.00 0.00 58.65 58.74 2o2r h GLN 763 Cb 1.12 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.85 2o2r h GLN 763 CO 0.07 0.14 0.50 -0.09 -0.67 0.00 0.00 178.83 178.78 2o2r h ARG 764 N -0.09 0.93 -0.67 1.46 2.43 -1.25 0.16 114.38 117.35 2o2r h ARG 764 Ca 0.01 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.14 2o2r h ARG 764 Cb 0.12 -0.21 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 2o2r h ARG 764 CO -0.00 0.62 0.43 0.78 -1.51 0.00 0.00 179.97 180.29 2o2r h GLY 765 N 0.96 0.96 0.86 2.80 0.00 -1.26 0.30 103.07 107.69 2o2r h GLY 765 Ca 0.32 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 47.29 2o2r h GLY 765 CO -0.12 0.31 0.04 -2.08 0.00 0.00 0.00 176.54 174.68 2o2r h VAL 766 N 0.87 1.22 -0.16 4.60 2.07 -1.06 -1.81 116.25 121.97 2o2r h VAL 766 Ca 0.26 -0.75 0.05 0.00 0.82 0.00 0.00 66.70 67.08 2o2r h VAL 766 Cb -0.04 1.26 -0.06 0.00 -1.52 0.00 0.00 31.29 30.93 2o2r h VAL 766 CO -0.08 0.24 -0.21 0.50 0.02 0.00 0.00 177.57 178.04 2o2r h LYS 767 N 0.20 -0.24 0.00 1.57 3.64 -0.26 -1.79 116.57 119.69 2o2r h LYS 767 Ca 0.07 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2o2r h LYS 767 Cb 0.32 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 2o2r h LYS 767 CO 0.00 -0.16 0.00 -0.85 -2.27 0.00 0.00 179.45 176.17 2o2r n GLU 768 N -5.35 0.37 0.00 1.90 0.28 0.06 -4.89 120.64 113.01 2o2r n GLU 768 Ca -0.02 0.08 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 2o2r n GLU 768 Cb 0.26 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.63 2o2r n GLU 768 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2o2r n GLY 769 N 0.35 0.92 3.78 -1.84 0.00 -0.67 -5.04 105.19 102.68 2o2r n GLY 769 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 2o2r n GLY 769 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2o2r s ALA 770 N -2.00 2.69 -0.34 4.61 0.00 -0.70 -4.98 121.76 121.04 2o2r s ALA 770 Ca 0.00 0.68 -0.26 0.00 0.00 0.00 0.00 51.96 52.38 2o2r s ALA 770 Cb 0.00 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.81 2o2r s ALA 770 CO 0.00 -0.78 0.92 0.99 0.00 0.00 0.00 175.76 176.89 2o2r s THR 771 N -2.00 4.63 -0.29 0.00 2.01 -0.67 -4.47 115.64 114.85 2o2r s THR 771 Ca 0.70 1.34 -0.28 0.00 0.31 0.00 0.00 61.69 63.75 2o2r s THR 771 Cb -0.21 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.02 2o2r s THR 771 CO 0.29 -0.43 1.01 -0.22 -0.69 0.00 0.00 174.62 174.58 2o2r s LEU 772 N 3.36 4.00 -0.13 4.42 2.96 -1.26 -0.74 118.68 131.29 2o2r s LEU 772 Ca 0.38 1.06 0.06 0.00 -0.22 0.00 0.00 54.13 55.41 2o2r s LEU 772 Cb -0.13 -3.45 -0.23 0.00 0.50 0.00 0.00 46.19 42.88 2o2r s LEU 772 CO 0.16 -0.78 0.31 0.52 -1.32 0.00 0.00 176.35 175.24 2o2r n VAL 773 N 5.67 1.61 -3.47 1.68 0.31 0.40 -4.99 118.33 119.54 2o2r n VAL 773 Ca 0.10 -0.73 -0.10 0.00 -0.01 0.00 0.00 64.34 63.61 2o2r n VAL 773 Cb 0.47 -1.22 -0.02 0.00 -0.91 0.00 0.00 33.84 32.16 2o2r n VAL 773 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2o2r n GLY 775 N -0.29 0.01 0.00 0.00 0.00 -1.25 -2.01 105.19 101.65 2o2r n GLY 775 Ca -0.12 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 44.94 2o2r n GLY 775 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2o2r n GLY 776 N 0.00 0.31 3.38 -0.02 0.00 -1.25 -4.95 105.19 102.65 2o2r n GLY 776 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2o2r n GLY 776 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o2r s ASN 777 N -2.02 3.03 0.20 1.61 4.22 -1.26 -4.72 114.94 116.00 2o2r s ASN 777 Ca 0.00 -0.90 -0.33 0.00 -2.14 0.00 0.00 52.86 49.50 2o2r s ASN 777 Cb 0.00 -0.20 -0.13 0.00 1.28 0.00 0.00 41.25 42.19 2o2r s ASN 777 CO 0.00 0.01 1.54 1.67 -2.04 0.00 0.00 177.10 178.28 2o2r n GLN 778 N 0.12 2.22 -2.14 3.55 7.27 -1.26 -1.20 117.38 125.93 2o2r n GLN 778 Ca -0.12 0.80 -0.41 0.00 0.07 0.00 0.00 57.00 57.34 2o2r n GLN 778 Cb 0.57 -2.54 -0.03 0.00 2.41 0.00 0.00 30.24 30.66 2o2r n GLN 778 CO 0.00 0.00 0.00 0.08 0.07 0.00 0.00 177.06 177.21 2o2r s VAL 779 N 0.54 3.02 -0.91 1.69 1.01 -0.57 -4.82 120.40 120.35 2o2r s VAL 779 Ca 0.74 0.83 -0.24 0.00 0.00 0.00 0.00 61.98 63.30 2o2r s VAL 779 Cb -0.64 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 2o2r s VAL 779 CO 0.42 0.12 1.92 -2.84 0.00 0.00 0.00 175.10 174.73 2o2r s PRO 780 N -0.06 2.60 -0.03 2.72 0.02 -1.26 -4.73 135.00 134.27 2o2r s PRO 780 Ca 0.59 -0.34 -0.30 0.00 0.02 0.00 0.00 61.00 60.97 2o2r s PRO 780 Cb -0.38 -5.08 0.11 0.00 0.02 0.00 0.00 34.50 29.17 2o2r s PRO 780 CO 0.39 -3.33 1.12 -0.98 -0.33 0.00 0.00 177.00 173.86 2o2r s ARG 781 N 6.91 0.63 0.97 5.54 1.70 -1.26 -5.16 118.95 128.28 2o2r s ARG 781 Ca 0.69 -0.30 -0.11 0.00 -0.47 0.00 0.00 55.73 55.54 2o2r s ARG 781 Cb -0.06 0.24 0.18 0.00 -0.57 0.00 0.00 34.95 34.74 2o2r s ARG 781 CO -0.01 -0.28 1.12 -2.14 -1.08 0.00 0.00 175.30 172.91 2o2r s PRO 782 N -2.74 0.56 2.01 3.89 0.02 -1.26 -4.82 135.00 132.66 2o2r s PRO 782 Ca 0.11 1.43 0.00 0.00 0.02 0.00 0.00 61.00 62.55 2o2r s PRO 782 Cb 0.01 -1.68 0.00 0.00 0.02 0.00 0.00 34.50 32.84 2o2r s PRO 782 CO -0.04 -2.91 0.00 0.41 -0.33 0.00 0.00 177.00 174.14 2o2r n GLY 783 N 0.40 -1.19 2.82 0.52 0.00 -1.20 -4.62 105.19 101.93 2o2r n GLY 783 Ca 0.10 -1.34 -0.26 0.00 0.00 0.00 0.00 46.02 44.52 2o2r n GLY 783 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2o2r n PHE 784 N 0.00 3.49 -3.37 1.61 3.72 -0.08 -4.89 117.46 117.93 2o2r n PHE 784 Ca 0.00 -3.96 -0.36 0.00 -0.05 0.00 0.00 57.45 53.08 2o2r n PHE 784 Cb 0.00 -0.47 -0.06 0.00 -0.94 0.00 0.00 39.48 38.01 2o2r n PHE 784 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 2o2r s PHE 785 N -3.33 3.63 -0.02 1.38 0.08 -1.26 -0.54 117.98 117.92 2o2r s PHE 785 Ca 0.48 1.07 0.03 0.00 0.12 0.00 0.00 56.93 58.63 2o2r s PHE 785 Cb 0.29 -2.37 -0.00 0.00 -0.57 0.00 0.00 43.02 40.37 2o2r s PHE 785 CO -0.13 0.46 -0.12 0.12 -0.10 0.00 0.00 175.22 175.45 2o2r s PHE 786 N -1.40 1.21 0.12 0.36 5.36 -1.26 -1.51 117.98 120.86 2o2r s PHE 786 Ca 0.36 -0.29 -0.30 0.00 -0.96 0.00 0.00 56.93 55.74 2o2r s PHE 786 Cb -0.15 -0.82 -0.07 0.00 -0.34 0.00 0.00 43.02 41.64 2o2r s PHE 786 CO 0.19 -0.08 1.18 -1.14 -1.46 0.00 0.00 175.22 173.90 2o2r s GLN 787 N -0.03 4.48 0.15 10.12 2.00 -0.34 -4.81 119.66 131.23 2o2r s GLN 787 Ca -0.00 1.79 -0.34 0.00 -2.00 0.00 0.00 55.36 54.81 2o2r s GLN 787 Cb -0.08 -3.30 -0.13 0.00 0.80 0.00 0.00 33.01 30.30 2o2r s GLN 787 CO 0.00 -0.14 1.62 -2.30 -0.50 0.00 0.00 175.29 173.98 2o2r n PRO 788 N 3.18 2.24 -5.09 1.67 -0.02 -1.26 -3.96 135.00 131.76 2o2r n PRO 788 Ca 0.06 0.81 -0.30 0.00 -2.02 0.00 0.00 63.50 62.05 2o2r n PRO 788 Cb 0.46 -2.60 -0.15 0.00 -0.02 0.00 0.00 33.50 31.19 2o2r n PRO 788 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2o2r s THR 789 N 1.19 2.08 -0.14 3.45 2.01 -0.05 -3.93 115.64 120.26 2o2r s THR 789 Ca 0.79 -1.25 -0.00 0.00 0.31 0.00 0.00 61.69 61.54 2o2r s THR 789 Cb -0.65 -1.76 0.03 0.00 0.01 0.00 0.00 72.50 70.13 2o2r s THR 789 CO 0.38 0.47 -0.08 -0.69 -0.69 0.00 0.00 174.62 174.00 2o2r s VAL 790 N -0.71 1.17 -0.12 3.82 1.01 -0.85 -0.38 120.40 124.33 2o2r s VAL 790 Ca 0.11 -0.47 -0.05 0.00 0.00 0.00 0.00 61.98 61.57 2o2r s VAL 790 Cb -0.10 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.03 2o2r s VAL 790 CO 0.01 0.31 0.06 -0.36 0.00 0.00 0.00 175.10 175.12 2o2r s PHE 791 N 1.64 3.32 0.32 5.22 0.08 0.81 -0.45 117.98 128.91 2o2r s PHE 791 Ca 0.04 0.26 0.01 0.00 0.12 0.00 0.00 56.93 57.36 2o2r s PHE 791 Cb -0.13 -1.91 0.01 0.00 -0.57 0.00 0.00 43.02 40.41 2o2r s PHE 791 CO -0.09 0.46 0.08 0.25 -0.10 0.00 0.00 175.22 175.83 2o2r n THR 792 N 2.47 0.00 -3.51 0.64 -2.24 0.08 -1.09 114.28 110.65 2o2r n THR 792 Ca -0.18 -1.42 -0.26 0.00 -2.27 0.00 0.00 64.05 59.92 2o2r n THR 792 Cb 0.54 0.13 0.01 0.00 -2.10 0.00 0.00 70.33 68.90 2o2r n THR 792 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2o2r n ASP 793 N -1.42 -4.24 -4.73 3.42 10.43 -1.20 -1.66 116.55 117.14 2o2r n ASP 793 Ca -0.09 -0.51 -0.41 0.00 2.57 0.00 0.00 54.79 56.35 2o2r n ASP 793 Cb 0.39 -3.46 -0.05 0.00 1.84 0.00 0.00 41.12 39.84 2o2r n ASP 793 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2o2r s VAL 794 N -3.07 4.65 0.16 2.53 1.01 -1.06 -4.57 120.40 120.05 2o2r s VAL 794 Ca 0.47 1.86 0.07 0.00 0.00 0.00 0.00 61.98 64.39 2o2r s VAL 794 Cb -0.24 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.87 2o2r s VAL 794 CO 0.58 0.32 -0.03 -1.61 0.00 0.00 0.00 175.10 174.37 2o2r s GLU 795 N 0.09 2.32 0.53 2.72 0.41 -1.26 -4.52 118.70 118.99 2o2r s GLU 795 Ca 0.43 -1.11 0.22 0.00 -0.41 0.00 0.00 54.97 54.10 2o2r s GLU 795 Cb -0.22 -2.33 1.43 0.00 -1.78 0.00 0.00 34.13 31.23 2o2r s GLU 795 CO 0.26 0.46 2.14 -0.44 -0.49 0.00 0.00 175.26 177.19 2o2r h ASP 796 N 2.88 0.00 1.34 -0.19 3.45 -1.97 -1.67 116.42 120.26 2o2r h ASP 796 Ca -0.47 0.00 0.00 0.00 0.43 0.00 0.00 57.03 56.99 2o2r h ASP 796 Cb 1.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.97 2o2r h ASP 796 CO 0.57 0.06 0.00 1.12 -1.57 0.00 0.00 179.24 179.42 2o2r h HIS 797 N 0.00 0.00 -4.07 4.55 2.07 -1.97 -3.44 115.15 112.28 2o2r h HIS 797 Ca -0.00 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 56.99 2o2r h HIS 797 Cb 0.13 0.00 0.10 0.00 2.57 0.00 0.00 27.41 30.22 2o2r h HIS 797 CO 0.00 0.00 0.49 -1.64 -3.07 0.00 0.00 177.93 173.71 2o2r s MET 798 N -3.37 3.18 0.32 5.12 -1.94 -0.63 -4.92 119.30 117.06 2o2r s MET 798 Ca 0.05 1.85 0.01 0.00 -1.71 0.00 0.00 55.69 55.89 2o2r s MET 798 Cb 0.08 -2.07 0.54 0.00 2.01 0.00 0.00 34.83 35.39 2o2r s MET 798 CO 0.56 -1.05 1.96 -0.92 -0.01 0.00 0.00 175.02 175.56 2o2r h TYR 799 N 1.21 0.86 0.00 -0.03 5.03 -1.90 -1.77 116.97 120.37 2o2r h TYR 799 Ca -0.50 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 60.81 2o2r h TYR 799 Cb 1.29 -0.28 0.00 0.00 1.55 0.00 0.00 36.73 39.28 2o2r h TYR 799 CO 0.48 0.58 0.00 0.44 -1.32 0.00 0.00 178.16 178.35 2o2r n ILE 800 N -4.39 0.53 0.45 1.81 -5.35 -1.26 -0.63 119.36 110.52 2o2r n ILE 800 Ca 0.06 -0.07 0.13 0.00 -0.27 0.00 0.00 62.75 62.60 2o2r n ILE 800 Cb 0.08 -0.71 0.29 0.00 -1.74 0.00 0.00 39.64 37.56 2o2r n ILE 800 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2o2r h ALA 801 N 2.59 0.96 0.00 -1.28 0.00 -1.59 -3.39 119.26 116.55 2o2r h ALA 801 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2o2r h ALA 801 Cb 0.57 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2o2r h ALA 801 CO 0.00 0.00 -1.46 1.63 0.00 0.00 0.00 179.25 179.42 2o2r n LYS 802 N -2.58 1.95 -3.90 0.00 5.02 -0.86 -4.98 118.16 112.81 2o2r n LYS 802 Ca 0.05 0.02 -0.36 0.00 -2.02 0.00 0.00 58.31 55.99 2o2r n LYS 802 Cb 0.47 -1.17 -0.06 0.00 -0.02 0.00 0.00 35.03 34.26 2o2r n LYS 802 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2o2r s GLU 803 N -2.16 3.43 -0.10 1.97 -6.30 0.20 -4.92 118.70 110.81 2o2r s GLU 803 Ca -0.06 -0.19 -0.30 0.00 -2.50 0.00 0.00 54.97 51.92 2o2r s GLU 803 Cb 0.02 -3.15 -0.01 0.00 0.00 0.00 0.00 34.13 30.99 2o2r s GLU 803 CO 0.24 0.75 1.03 -2.00 0.02 0.00 0.00 175.26 175.30 2o2r s GLU 804 N -1.30 4.42 -0.00 4.30 2.12 -1.26 -4.80 118.70 122.18 2o2r s GLU 804 Ca 0.19 1.42 -0.19 0.00 0.36 0.00 0.00 54.97 56.75 2o2r s GLU 804 Cb -0.12 -3.54 -0.33 0.00 0.26 0.00 0.00 34.13 30.39 2o2r s GLU 804 CO 0.08 -0.33 0.97 0.66 -0.54 0.00 0.00 175.26 176.10 2o2r h SER 805 N 7.13 0.69 -3.75 -1.70 4.64 -1.94 -3.48 113.55 115.14 2o2r h SER 805 Ca -0.31 -0.92 -0.37 0.00 -0.47 0.00 0.00 61.79 59.72 2o2r h SER 805 Cb 1.15 -0.22 0.04 0.00 -0.31 0.00 0.00 62.40 63.06 2o2r h SER 805 CO 0.86 1.56 -0.53 0.33 -0.87 0.00 0.00 176.83 178.18 2o2r n PHE 806 N -3.91 -1.58 -4.11 4.77 7.35 -1.26 -4.90 117.46 113.82 2o2r n PHE 806 Ca -0.15 0.37 -0.14 0.00 -0.76 0.00 0.00 57.45 56.77 2o2r n PHE 806 Cb 0.97 -4.05 -0.06 0.00 0.35 0.00 0.00 39.48 36.69 2o2r n PHE 806 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2o2r s GLY 807 N -2.61 1.40 -1.58 7.13 0.00 -1.17 -3.96 107.32 106.52 2o2r s GLY 807 Ca 0.21 -1.49 -0.11 0.00 0.00 0.00 0.00 44.72 43.33 2o2r s GLY 807 CO 0.27 -1.05 2.74 -1.55 0.00 0.00 0.00 173.10 173.51 2o2r n PRO 808 N -0.49 3.46 -3.88 2.90 -0.04 -1.23 -4.51 135.00 131.21 2o2r n PRO 808 Ca 0.01 -2.33 -0.30 0.00 -0.04 0.00 0.00 63.50 60.85 2o2r n PRO 808 Cb 0.62 -2.95 -0.16 0.00 -0.04 0.00 0.00 33.50 30.98 2o2r n PRO 808 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2o2r s ILE 809 N 2.46 1.29 -0.37 0.52 1.01 -1.26 -0.87 121.20 123.98 2o2r s ILE 809 Ca 0.63 -1.19 -0.26 0.00 0.00 0.00 0.00 60.65 59.82 2o2r s ILE 809 Cb 0.17 -1.69 0.02 0.00 0.01 0.00 0.00 42.46 40.97 2o2r s ILE 809 CO -0.07 -0.24 0.96 -0.32 0.00 0.00 0.00 174.94 175.27 2o2r s MET 810 N 1.48 3.85 -0.42 2.79 1.75 0.49 -4.95 119.30 124.28 2o2r s MET 810 Ca -0.02 0.62 -0.04 0.00 -1.25 0.00 0.00 55.69 55.01 2o2r s MET 810 Cb -0.18 -3.81 0.11 0.00 2.84 0.00 0.00 34.83 33.79 2o2r s MET 810 CO -0.09 -0.98 0.23 0.42 -0.65 0.00 0.00 175.02 173.95 2o2r s ILE 811 N 3.57 3.40 -0.19 10.11 1.01 -1.26 -0.14 121.20 137.71 2o2r s ILE 811 Ca 0.40 -2.07 -0.07 0.00 0.00 0.00 0.00 60.65 58.91 2o2r s ILE 811 Cb -0.12 -3.32 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 2o2r s ILE 811 CO 0.19 -0.71 0.05 -0.63 0.00 0.00 0.00 174.94 173.85 2o2r s ILE 812 N 1.11 4.63 0.12 2.92 1.01 -0.25 -0.94 121.20 129.81 2o2r s ILE 812 Ca 0.08 -0.09 0.10 0.00 0.00 0.00 0.00 60.65 60.75 2o2r s ILE 812 Cb -0.23 -3.09 -0.04 0.00 0.01 0.00 0.00 42.46 39.11 2o2r s ILE 812 CO -0.04 0.45 -0.26 -0.44 0.00 0.00 0.00 174.94 174.65 2o2r s SER 813 N 0.53 3.18 0.39 3.58 0.01 0.02 -2.57 113.70 118.84 2o2r s SER 813 Ca 0.02 -0.72 -0.01 0.00 1.31 0.00 0.00 55.95 56.55 2o2r s SER 813 Cb -0.13 -0.21 -0.03 0.00 0.21 0.00 0.00 66.02 65.86 2o2r s SER 813 CO 0.01 0.17 0.62 -0.13 0.41 0.00 0.00 173.24 174.32 2o2r s ARG 814 N -1.95 3.42 0.03 12.44 0.52 -1.26 -0.85 118.95 131.30 2o2r s ARG 814 Ca 0.13 -0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.09 2o2r s ARG 814 Cb -0.10 -2.58 -0.02 0.00 0.52 0.00 0.00 34.95 32.76 2o2r s ARG 814 CO 0.05 -0.00 -0.04 -0.59 0.02 0.00 0.00 175.30 174.74 2o2r s PHE 815 N -2.45 0.38 0.50 -0.53 -0.71 -0.70 -4.78 117.98 109.69 2o2r s PHE 815 Ca 0.43 -0.61 -0.22 0.00 -1.04 0.00 0.00 56.93 55.49 2o2r s PHE 815 Cb -0.10 -0.26 -0.06 0.00 -1.21 0.00 0.00 43.02 41.39 2o2r s PHE 815 CO 0.38 -0.20 1.22 0.00 -1.34 0.00 0.00 175.22 175.28 2o2r s ALA 816 N -1.85 2.86 0.07 1.99 0.00 -1.26 -0.03 121.76 123.54 2o2r s ALA 816 Ca -0.11 1.04 -0.35 0.00 0.00 0.00 0.00 51.96 52.54 2o2r s ALA 816 Cb -0.07 -3.44 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 2o2r s ALA 816 CO -0.02 -0.91 1.60 -0.25 0.00 0.00 0.00 175.76 176.18 2o2r n ASP 817 N -0.82 2.83 0.00 0.00 8.00 -1.26 -1.94 116.55 123.36 2o2r n ASP 817 Ca 0.09 1.07 0.00 0.00 0.71 0.00 0.00 54.79 56.66 2o2r n ASP 817 Cb 0.48 -1.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.22 2o2r n ASP 817 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2o2r n GLY 818 N 3.48 0.73 2.64 0.44 0.00 -1.26 -4.99 105.19 106.24 2o2r n GLY 818 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 2o2r n GLY 818 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2o2r n ASP 819 N 0.00 6.90 0.05 1.61 4.64 -0.82 -4.84 116.55 124.09 2o2r n ASP 819 Ca 0.00 -3.46 -0.12 0.00 -1.38 0.00 0.00 54.79 49.83 2o2r n ASP 819 Cb 0.00 -1.16 -0.06 0.00 -1.04 0.00 0.00 41.12 38.86 2o2r n ASP 819 CO 0.00 0.00 0.00 0.58 -0.82 0.00 0.00 177.20 176.96 2o2r h VAL 820 N 1.97 0.21 -0.27 5.18 2.07 -1.94 -1.73 116.25 121.73 2o2r h VAL 820 Ca 0.46 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.91 2o2r h VAL 820 Cb 0.45 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.42 2o2r h VAL 820 CO 1.10 0.00 -0.14 0.44 0.02 0.00 0.00 177.57 178.99 2o2r h ASP 821 N -0.52 0.45 -0.17 0.57 3.32 -2.00 -2.35 116.42 115.72 2o2r h ASP 821 Ca 0.06 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 2o2r h ASP 821 Cb 0.61 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.04 2o2r h ASP 821 CO -0.32 0.62 0.06 0.00 -1.72 0.00 0.00 179.24 177.88 2o2r h ALA 822 N 1.43 0.22 -0.63 3.45 0.00 -1.85 -1.95 119.26 119.92 2o2r h ALA 822 Ca 0.08 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2o2r h ALA 822 Cb 0.50 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2o2r h ALA 822 CO 0.03 -0.19 0.11 -0.24 0.00 0.00 0.00 179.25 178.96 2o2r h VAL 823 N 0.11 1.26 -0.90 0.00 3.04 -1.29 -2.45 116.25 116.02 2o2r h VAL 823 Ca 0.06 -1.00 0.09 0.00 -1.01 0.00 0.00 66.70 64.83 2o2r h VAL 823 Cb 0.19 0.70 -0.07 0.00 -2.01 0.00 0.00 31.29 30.09 2o2r h VAL 823 CO -0.00 0.37 0.55 -0.07 -1.01 0.00 0.00 177.57 177.41 2o2r h LEU 824 N 0.94 0.84 -0.46 3.16 3.38 -1.35 0.25 115.31 122.07 2o2r h LEU 824 Ca 0.19 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 2o2r h LEU 824 Cb 0.42 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 2o2r h LEU 824 CO 0.01 0.50 0.28 -1.28 0.09 0.00 0.00 178.44 178.03 2o2r h SER 825 N 0.95 0.56 -0.60 -0.43 0.87 -1.01 0.98 113.55 114.87 2o2r h SER 825 Ca 0.42 -0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.83 2o2r h SER 825 Cb 0.30 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.10 2o2r h SER 825 CO -0.22 0.45 0.01 0.03 -0.53 0.00 0.00 176.83 176.57 2o2r h ARG 826 N 0.62 1.04 -0.52 2.24 3.08 -0.90 -2.26 114.38 117.68 2o2r h ARG 826 Ca 0.17 -0.33 -0.08 0.00 0.07 0.00 0.00 59.98 59.81 2o2r h ARG 826 Cb -0.00 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 2o2r h ARG 826 CO -0.03 1.02 0.01 0.00 -1.07 0.00 0.00 179.97 179.90 2o2r h ALA 827 N 0.98 1.04 -0.00 0.04 0.00 -0.14 -2.83 119.26 118.36 2o2r h ALA 827 Ca 0.17 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2o2r h ALA 827 Cb 0.54 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2o2r h ALA 827 CO 0.03 0.60 -0.10 0.09 0.00 0.00 0.00 179.25 179.86 2o2r n ASN 828 N -4.21 0.53 -3.47 0.00 3.02 0.31 -4.57 115.26 106.87 2o2r n ASN 828 Ca 0.03 -0.67 -0.40 0.00 -0.03 0.00 0.00 54.58 53.51 2o2r n ASN 828 Cb 0.31 -0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.41 2o2r n ASN 828 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2o2r n ALA 829 N -0.87 6.87 -3.03 5.41 0.00 -0.86 -4.80 120.51 123.22 2o2r n ALA 829 Ca 0.15 -3.78 -0.12 0.00 0.00 0.00 0.00 53.44 49.70 2o2r n ALA 829 Cb 0.27 -3.25 -0.08 0.00 0.00 0.00 0.00 19.45 16.40 2o2r n ALA 829 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 2o2r s THR 830 N 1.49 0.08 -1.67 0.00 -1.32 -1.26 -5.04 115.64 107.93 2o2r s THR 830 Ca 0.60 -0.67 0.28 0.00 -1.21 0.00 0.00 61.69 60.69 2o2r s THR 830 Cb 0.17 -0.87 0.41 0.00 -1.51 0.00 0.00 72.50 70.70 2o2r s THR 830 CO -0.07 -0.37 1.79 -0.62 -2.21 0.00 0.00 174.62 173.14 2o2r n GLU 831 N 0.74 0.72 -2.67 7.08 -0.58 -1.26 -4.85 120.64 119.82 2o2r n GLU 831 Ca -0.19 -0.30 -0.25 0.00 -0.42 0.00 0.00 57.16 56.00 2o2r n GLU 831 Cb 0.59 -1.49 0.02 0.00 -0.57 0.00 0.00 31.44 29.98 2o2r n GLU 831 CO 0.00 0.00 0.00 -0.06 -0.48 0.00 0.00 177.13 176.59 2o2r s PHE 832 N -2.49 3.25 -0.40 -0.32 0.08 -1.26 -0.25 117.98 116.59 2o2r s PHE 832 Ca 0.28 0.46 0.05 0.00 0.12 0.00 0.00 56.93 57.84 2o2r s PHE 832 Cb 0.20 -2.53 0.32 0.00 -0.57 0.00 0.00 43.02 40.43 2o2r s PHE 832 CO 0.49 -0.60 1.24 0.41 -0.10 0.00 0.00 175.22 176.66 2o2r n GLY 833 N -2.35 -0.27 0.07 4.36 0.00 -1.21 -4.83 105.19 100.97 2o2r n GLY 833 Ca 0.03 0.36 -0.07 0.00 0.00 0.00 0.00 46.02 46.34 2o2r n GLY 833 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2o2r h LEU 834 N 2.57 0.00 -8.71 0.99 5.85 -1.83 0.21 115.31 114.39 2o2r h LEU 834 Ca -0.21 -0.07 -0.37 0.00 0.84 0.00 0.00 57.88 58.08 2o2r h LEU 834 Cb 1.16 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 42.08 2o2r h LEU 834 CO 0.06 0.85 -0.38 0.00 -0.34 0.00 0.00 178.44 178.63 2o2r s ALA 835 N -2.68 1.33 -0.07 1.25 0.00 -1.26 -2.42 121.76 117.91 2o2r s ALA 835 Ca -0.16 -1.80 -0.32 0.00 0.00 0.00 0.00 51.96 49.68 2o2r s ALA 835 Cb 0.03 1.34 0.13 0.00 0.00 0.00 0.00 23.12 24.61 2o2r s ALA 835 CO 0.26 -0.71 1.27 -1.54 0.00 0.00 0.00 175.76 175.05 2o2r s SER 836 N -3.29 -0.07 0.14 0.00 1.04 -0.66 -4.03 113.70 106.83 2o2r s SER 836 Ca 0.36 -0.10 -0.20 0.00 0.48 0.00 0.00 55.95 56.49 2o2r s SER 836 Cb 0.02 0.15 0.06 0.00 0.10 0.00 0.00 66.02 66.35 2o2r s SER 836 CO 0.23 -0.27 0.52 -0.83 0.98 0.00 0.00 173.24 173.87 2o2r s GLY 837 N -2.77 -0.49 -0.08 7.32 0.00 -0.16 -1.16 107.32 109.99 2o2r s GLY 837 Ca 0.13 0.29 -0.05 0.00 0.00 0.00 0.00 44.72 45.09 2o2r s GLY 837 CO -0.04 -0.01 0.19 0.54 0.00 0.00 0.00 173.10 173.78 2o2r s VAL 838 N -3.74 -0.03 -0.16 1.40 0.11 -0.22 -1.09 120.40 116.68 2o2r s VAL 838 Ca 0.02 0.11 -0.00 0.00 -2.93 0.00 0.00 61.98 59.17 2o2r s VAL 838 Cb 0.00 -0.30 -0.01 0.00 -1.53 0.00 0.00 36.38 34.55 2o2r s VAL 838 CO -0.12 0.04 -0.13 -0.36 -3.33 0.00 0.00 175.10 171.20 2o2r s PHE 839 N 0.85 2.81 -0.25 1.54 0.08 0.17 -1.00 117.98 122.17 2o2r s PHE 839 Ca -0.06 -0.93 -0.27 0.00 0.12 0.00 0.00 56.93 55.78 2o2r s PHE 839 Cb -0.08 -1.90 0.15 0.00 -0.57 0.00 0.00 43.02 40.63 2o2r s PHE 839 CO -0.05 -0.42 1.18 -0.08 -0.10 0.00 0.00 175.22 175.76 2o2r s THR 840 N 0.77 0.00 -1.13 0.64 -1.32 -1.26 -1.73 115.64 111.61 2o2r s THR 840 Ca -0.05 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.70 2o2r s THR 840 Cb -0.15 -1.00 0.16 0.00 -1.51 0.00 0.00 72.50 70.00 2o2r s THR 840 CO 0.01 0.00 1.66 0.54 -2.21 0.00 0.00 174.62 174.62 2o2r n ARG 841 N 1.26 0.14 -2.93 7.08 1.74 -0.92 -4.84 116.66 118.19 2o2r n ARG 841 Ca -0.09 -0.06 -0.43 0.00 -0.77 0.00 0.00 57.85 56.51 2o2r n ARG 841 Cb 0.57 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.46 2o2r n ARG 841 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2o2r s ASP 842 N -2.90 6.49 0.27 0.55 3.68 -1.26 -4.95 116.67 118.55 2o2r s ASP 842 Ca 0.15 0.15 -0.01 0.00 2.13 0.00 0.00 52.55 54.97 2o2r s ASP 842 Cb 0.18 -2.40 0.47 0.00 -1.45 0.00 0.00 42.92 39.72 2o2r s ASP 842 CO 0.60 -0.86 1.86 -0.29 0.13 0.00 0.00 175.17 176.61 2o2r h ILE 843 N 5.90 1.00 -0.59 4.11 2.10 -1.99 -1.46 117.51 126.57 2o2r h ILE 843 Ca -0.25 -0.37 -0.04 0.00 1.08 0.00 0.00 64.86 65.29 2o2r h ILE 843 Cb 1.09 -0.17 -0.03 0.00 -1.09 0.00 0.00 36.82 36.63 2o2r h ILE 843 CO 0.95 0.20 0.22 0.78 -1.08 0.00 0.00 178.15 179.22 2o2r h ASN 844 N 1.07 0.83 -0.26 2.19 2.35 -2.00 -1.25 115.58 118.52 2o2r h ASN 844 Ca 0.46 -0.18 -0.08 0.00 -0.55 0.00 0.00 56.30 55.95 2o2r h ASN 844 Cb 0.32 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 2o2r h ASN 844 CO -0.22 0.79 -0.14 0.11 -1.65 0.00 0.00 177.43 176.32 2o2r h LYS 845 N 0.82 0.55 -0.54 0.81 1.57 -1.92 -1.95 116.57 115.91 2o2r h LYS 845 Ca 0.20 -0.25 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 2o2r h LYS 845 Cb 0.23 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2o2r h LYS 845 CO -0.01 0.81 0.34 0.00 -0.57 0.00 0.00 179.45 180.02 2o2r h ALA 846 N 0.72 0.69 -0.17 3.86 0.00 -1.02 0.19 119.26 123.53 2o2r h ALA 846 Ca 0.06 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 2o2r h ALA 846 Cb 0.65 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2o2r h ALA 846 CO 0.04 0.08 -0.33 -0.07 0.00 0.00 0.00 179.25 178.98 2o2r h LEU 847 N 0.69 0.58 -0.29 0.00 3.38 -1.25 -1.90 115.31 116.53 2o2r h LEU 847 Ca 0.21 -0.55 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 2o2r h LEU 847 Cb -0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2o2r h LEU 847 CO -0.07 1.02 0.17 0.22 0.09 0.00 0.00 178.44 179.87 2o2r h TYR 848 N 0.17 0.39 -0.44 1.13 3.20 -1.25 -1.95 116.97 118.22 2o2r h TYR 848 Ca 0.01 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 61.85 2o2r h TYR 848 Cb 0.92 -0.13 -0.02 0.00 1.54 0.00 0.00 36.73 39.04 2o2r h TYR 848 CO 0.09 0.30 0.17 0.28 -1.64 0.00 0.00 178.16 177.37 2o2r h VAL 849 N 0.36 1.20 -0.33 1.81 2.07 -0.98 -1.92 116.25 118.46 2o2r h VAL 849 Ca 0.10 -0.63 -0.05 0.00 0.82 0.00 0.00 66.70 66.94 2o2r h VAL 849 Cb 0.04 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 2o2r h VAL 849 CO -0.02 0.23 0.00 0.77 0.02 0.00 0.00 177.57 178.58 2o2r h SER 850 N 0.56 0.47 -0.19 0.57 4.64 -1.20 -1.01 113.55 117.40 2o2r h SER 850 Ca 0.15 -0.08 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2o2r h SER 850 Cb 0.20 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 2o2r h SER 850 CO -0.01 0.54 0.12 0.44 -0.87 0.00 0.00 176.83 177.04 2o2r h ASP 851 N 0.49 0.23 1.74 4.97 3.32 -1.05 -3.25 116.42 122.87 2o2r h ASP 851 Ca 0.11 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 2o2r h ASP 851 Cb 0.31 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 39.80 2o2r h ASP 851 CO 0.01 0.20 -0.02 0.11 -1.72 0.00 0.00 179.24 177.82 2o2r h LYS 852 N 0.24 0.00 -6.56 3.56 1.79 -0.92 -3.45 116.57 111.22 2o2r h LYS 852 Ca 0.07 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 58.01 2o2r h LYS 852 Cb 0.01 0.00 0.02 0.00 -1.58 0.00 0.00 32.23 30.68 2o2r h LYS 852 CO -0.01 0.02 0.68 -0.51 -1.08 0.00 0.00 179.45 178.54 2o2r s LEU 853 N -6.22 4.38 -1.25 2.94 1.43 -0.42 -4.93 118.68 114.61 2o2r s LEU 853 Ca 0.05 2.27 -0.06 0.00 -1.03 0.00 0.00 54.13 55.37 2o2r s LEU 853 Cb 0.06 -3.59 0.18 0.00 0.03 0.00 0.00 46.19 42.87 2o2r s LEU 853 CO 0.64 -0.59 2.06 0.00 0.23 0.00 0.00 176.35 178.69 2o2r n GLN 854 N 3.70 4.37 -3.89 1.70 1.13 -1.26 -4.92 117.38 118.20 2o2r n GLN 854 Ca 0.10 -3.74 -0.11 0.00 -1.94 0.00 0.00 57.00 51.31 2o2r n GLN 854 Cb 0.43 -2.70 -0.10 0.00 0.11 0.00 0.00 30.24 27.98 2o2r n GLN 854 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2o2r s ALA 855 N -1.20 -0.22 0.38 -1.58 0.00 -1.26 -4.40 121.76 113.47 2o2r s ALA 855 Ca 0.45 -0.21 0.37 0.00 0.00 0.00 0.00 51.96 52.57 2o2r s ALA 855 Cb 0.14 0.10 1.79 0.00 0.00 0.00 0.00 23.12 25.15 2o2r s ALA 855 CO -0.04 -0.19 2.15 0.78 0.00 0.00 0.00 175.76 178.46 2o2r h GLY 856 N 4.46 0.00 -6.11 0.00 0.00 -1.12 -3.42 103.07 96.88 2o2r h GLY 856 Ca -0.31 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 46.76 2o2r h GLY 856 CO 0.41 0.00 -0.71 -1.59 0.00 0.00 0.00 176.54 174.64 2o2r s THR 857 N -3.95 -0.04 -0.15 4.70 2.01 -1.02 -4.74 115.64 112.46 2o2r s THR 857 Ca -0.02 0.13 0.02 0.00 0.31 0.00 0.00 61.69 62.12 2o2r s THR 857 Cb 0.11 -0.07 0.02 0.00 0.01 0.00 0.00 72.50 72.57 2o2r s THR 857 CO 0.50 0.05 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.60 2o2r s VAL 858 N 0.65 1.93 -0.12 3.82 1.01 -1.26 -1.65 120.40 124.79 2o2r s VAL 858 Ca -0.05 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 60.93 2o2r s VAL 858 Cb -0.08 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.52 2o2r s VAL 858 CO -0.02 0.52 0.25 -0.36 0.00 0.00 0.00 175.10 175.49 2o2r s PHE 859 N 1.10 3.56 -0.24 5.22 0.08 -0.31 -4.96 117.98 122.43 2o2r s PHE 859 Ca -0.01 0.63 0.01 0.00 0.12 0.00 0.00 56.93 57.69 2o2r s PHE 859 Cb -0.14 -2.18 0.04 0.00 -0.57 0.00 0.00 43.02 40.17 2o2r s PHE 859 CO -0.07 0.49 -0.12 0.42 -0.10 0.00 0.00 175.22 175.84 2o2r s ILE 860 N -0.36 2.33 -1.85 0.64 1.01 -1.26 -1.06 121.20 120.66 2o2r s ILE 860 Ca 0.17 -1.32 0.00 0.00 0.00 0.00 0.00 60.65 59.50 2o2r s ILE 860 Cb -0.13 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.11 2o2r s ILE 860 CO 0.05 0.16 0.00 0.59 0.00 0.00 0.00 174.94 175.75 2o2r n ASN 861 N 4.54 -5.58 -2.95 3.58 3.02 -0.17 -4.95 115.26 112.74 2o2r n ASN 861 Ca -0.16 0.16 -0.10 0.00 -0.03 0.00 0.00 54.58 54.45 2o2r n ASN 861 Cb 0.45 -4.69 0.01 0.00 -0.61 0.00 0.00 39.78 34.95 2o2r n ASN 861 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2o2r s THR 862 N -2.90 0.00 0.15 3.41 -1.32 -1.26 -5.07 115.64 108.64 2o2r s THR 862 Ca 0.00 -1.10 -0.22 0.00 -1.21 0.00 0.00 61.69 59.16 2o2r s THR 862 Cb 0.00 -2.87 0.06 0.00 -1.51 0.00 0.00 72.50 68.19 2o2r s THR 862 CO 0.00 0.00 0.57 -0.47 -2.21 0.00 0.00 174.62 172.51 2o2r s TYR 863 N -2.38 -0.48 -1.92 9.09 5.04 -1.26 -4.74 117.35 120.69 2o2r s TYR 863 Ca 0.18 0.27 0.00 0.00 -2.44 0.00 0.00 57.07 55.08 2o2r s TYR 863 Cb -0.04 0.50 0.00 0.00 0.35 0.00 0.00 41.96 42.77 2o2r s TYR 863 CO 0.13 -0.82 0.00 0.09 -1.34 0.00 0.00 175.55 173.61 2o2r n ASN 864 N -0.31 -5.00 -4.37 4.32 3.02 -1.26 -4.90 115.26 106.76 2o2r n ASN 864 Ca -0.17 0.40 -0.44 0.00 -0.03 0.00 0.00 54.58 54.34 2o2r n ASN 864 Cb 0.65 -4.42 0.00 0.00 -0.61 0.00 0.00 39.78 35.40 2o2r n ASN 864 CO 0.00 0.00 0.00 1.17 -2.62 0.00 0.00 177.26 175.81 2o2r n LYS 865 N -2.35 3.43 -2.99 3.52 3.00 -1.26 -4.97 118.16 116.53 2o2r n LYS 865 Ca -0.19 -3.85 -0.23 0.00 -0.00 0.00 0.00 58.31 54.04 2o2r n LYS 865 Cb 0.62 -2.99 0.01 0.00 0.00 0.00 0.00 35.03 32.67 2o2r n LYS 865 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2o2r s THR 866 N 1.20 4.04 -0.13 3.15 -4.23 -1.26 -5.11 115.64 113.30 2o2r s THR 866 Ca 0.42 -0.48 -0.22 0.00 -1.18 0.00 0.00 61.69 60.23 2o2r s THR 866 Cb -0.01 -3.50 0.05 0.00 1.34 0.00 0.00 72.50 70.38 2o2r s THR 866 CO -0.00 -0.35 0.54 -0.62 -0.54 0.00 0.00 174.62 173.65 2o2r s ASP 867 N -4.21 -0.53 0.61 3.99 -1.08 -1.26 -5.04 116.67 109.15 2o2r s ASP 867 Ca 0.48 0.83 0.41 0.00 -0.52 0.00 0.00 52.55 53.74 2o2r s ASP 867 Cb -0.10 0.83 2.16 0.00 -1.46 0.00 0.00 42.92 44.35 2o2r s ASP 867 CO 0.38 -0.35 2.24 -0.37 0.52 0.00 0.00 175.17 177.59 2o2r h VAL 868 N 3.86 0.00 0.00 1.11 -1.51 -1.94 -1.84 116.25 115.93 2o2r h VAL 868 Ca -0.28 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 2o2r h VAL 868 Cb 1.16 0.97 0.00 0.00 -2.13 0.00 0.00 31.29 31.29 2o2r h VAL 868 CO 0.26 0.00 -0.82 0.00 -1.23 0.00 0.00 177.57 175.78 2o2r n ALA 869 N -2.03 3.39 -2.86 5.19 0.00 -1.26 -0.23 120.51 122.71 2o2r n ALA 869 Ca -0.02 -0.37 -0.38 0.00 0.00 0.00 0.00 53.44 52.67 2o2r n ALA 869 Cb 0.09 -1.04 -0.12 0.00 0.00 0.00 0.00 19.45 18.38 2o2r n ALA 869 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2o2r s ALA 870 N -3.14 3.29 0.43 0.00 0.00 -0.69 -3.91 121.76 117.74 2o2r s ALA 870 Ca 0.06 -1.33 -0.25 0.00 0.00 0.00 0.00 51.96 50.43 2o2r s ALA 870 Cb 0.15 -2.36 -0.08 0.00 0.00 0.00 0.00 23.12 20.82 2o2r s ALA 870 CO 0.77 -0.83 1.34 -1.25 0.00 0.00 0.00 175.76 175.79 2o2r s PRO 871 N 1.63 3.83 -0.09 0.00 0.04 -1.25 -4.38 135.00 134.78 2o2r s PRO 871 Ca 0.05 2.22 0.00 0.00 0.04 0.00 0.00 61.00 63.32 2o2r s PRO 871 Cb -0.17 -2.68 0.02 0.00 0.04 0.00 0.00 34.50 31.71 2o2r s PRO 871 CO 0.06 -0.63 -0.08 0.12 0.04 0.00 0.00 177.00 176.52 2o2r s PHE 872 N -1.26 1.33 -0.04 0.56 5.36 0.11 -4.96 117.98 119.09 2o2r s PHE 872 Ca 0.59 -0.58 -0.31 0.00 -0.96 0.00 0.00 56.93 55.68 2o2r s PHE 872 Cb -0.39 -1.09 0.11 0.00 -0.34 0.00 0.00 43.02 41.31 2o2r s PHE 872 CO 0.50 -0.40 1.12 0.20 -1.46 0.00 0.00 175.22 175.19 2o2r s GLY 873 N 1.37 -0.35 0.44 13.12 0.00 -1.26 -0.82 107.32 119.82 2o2r s GLY 873 Ca -0.02 0.93 0.08 0.00 0.00 0.00 0.00 44.72 45.71 2o2r s GLY 873 CO -0.04 0.27 0.45 -0.32 0.00 0.00 0.00 173.10 173.46 2o2r s GLY 874 N -2.63 2.10 0.42 0.20 0.00 -1.26 -4.15 107.32 102.01 2o2r s GLY 874 Ca 0.10 -1.81 0.07 0.00 0.00 0.00 0.00 44.72 43.09 2o2r s GLY 874 CO -0.04 -1.68 0.25 -1.36 0.00 0.00 0.00 173.10 170.27 2o2r s PHE 875 N -2.49 2.56 0.00 1.90 0.08 0.69 -4.17 117.98 116.54 2o2r s PHE 875 Ca 0.49 -0.58 0.00 0.00 0.12 0.00 0.00 56.93 56.96 2o2r s PHE 875 Cb -0.04 -2.01 0.00 0.00 -0.57 0.00 0.00 43.02 40.39 2o2r s PHE 875 CO 0.29 0.05 0.00 1.63 -0.10 0.00 0.00 175.22 177.09 2o2r n LYS 876 N -1.36 0.00 -0.00 0.44 5.02 -1.26 -0.80 118.16 120.19 2o2r n LYS 876 Ca -0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 2o2r n LYS 876 Cb 0.64 0.00 0.73 0.00 -0.02 0.00 0.00 35.03 36.38 2o2r n LYS 876 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2o2r n GLN 877 N 14.00 1.07 0.00 1.97 6.02 0.65 -2.58 117.38 138.51 2o2r n GLN 877 Ca 0.00 -0.11 0.14 0.00 -0.01 0.00 0.00 57.00 57.03 2o2r n GLN 877 Cb 0.00 -1.41 0.85 0.00 1.02 0.00 0.00 30.24 30.70 2o2r n GLN 877 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 2o2r n SER 878 N -0.78 0.00 0.00 1.08 7.64 0.02 -4.74 113.62 116.83 2o2r n SER 878 Ca 0.19 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 59.13 2o2r n SER 878 Cb 0.12 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2o2r n SER 878 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2o2r n GLY 879 N 0.82 -0.49 3.54 0.23 0.00 -1.07 -0.58 105.19 107.65 2o2r n GLY 879 Ca 0.21 -1.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.17 2o2r n GLY 879 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2o2r s PHE 880 N 0.00 -0.43 0.00 1.61 -0.12 -0.43 -4.18 117.98 114.43 2o2r s PHE 880 Ca 0.00 0.16 0.00 0.00 -0.05 0.00 0.00 56.93 57.04 2o2r s PHE 880 Cb 0.00 0.60 0.00 0.00 -0.63 0.00 0.00 43.02 42.99 2o2r s PHE 880 CO 0.00 -0.91 0.00 0.41 -0.05 0.00 0.00 175.22 174.67 2o2r n GLY 881 N -0.39 -0.83 3.35 1.99 0.00 -1.26 -1.92 105.19 106.12 2o2r n GLY 881 Ca -0.13 -1.56 -0.31 0.00 0.00 0.00 0.00 46.02 44.03 2o2r n GLY 881 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2o2r s LYS 882 N -3.41 2.03 0.07 1.61 -0.14 -1.26 -4.38 119.74 114.26 2o2r s LYS 882 Ca 0.00 -0.98 0.02 0.00 -1.36 0.00 0.00 55.97 53.65 2o2r s LYS 882 Cb 0.00 -2.06 -0.04 0.00 -1.68 0.00 0.00 37.83 34.05 2o2r s LYS 882 CO 0.00 0.55 0.14 -0.51 -0.76 0.00 0.00 175.35 174.77 2o2r s ASP 883 N -0.93 5.92 0.28 2.83 1.01 0.00 -4.19 116.67 121.59 2o2r s ASP 883 Ca 0.11 0.12 0.00 0.00 0.71 0.00 0.00 52.55 53.49 2o2r s ASP 883 Cb -0.10 -1.71 0.00 0.00 1.01 0.00 0.00 42.92 42.12 2o2r s ASP 883 CO 0.01 0.17 0.00 0.18 0.21 0.00 0.00 175.17 175.74 2o2r n LEU 884 N 0.35 -0.53 -0.53 1.23 4.77 -1.26 0.09 117.00 121.13 2o2r n LEU 884 Ca -0.07 1.13 0.07 0.00 -0.03 0.00 0.00 56.01 57.11 2o2r n LEU 884 Cb 0.51 -1.27 -0.02 0.00 -2.33 0.00 0.00 43.42 40.31 2o2r n LEU 884 CO 0.48 -0.84 -0.17 0.61 -1.33 0.00 0.00 177.39 176.14 2o2r n GLY 885 N -2.85 -2.20 0.37 -0.72 0.00 0.69 -3.14 105.19 97.33 2o2r n GLY 885 Ca -0.04 -1.35 0.13 0.00 0.00 0.00 0.00 46.02 44.76 2o2r n GLY 885 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2o2r h GLU 886 N -0.50 0.72 -0.71 1.61 4.81 -1.88 -2.47 114.58 116.15 2o2r h GLU 886 Ca -0.03 -0.04 0.17 0.00 -0.13 0.00 0.00 59.36 59.33 2o2r h GLU 886 Cb 0.49 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 2o2r h GLU 886 CO 0.02 0.47 0.49 0.00 -0.73 0.00 0.00 179.01 179.26 2o2r h ALA 887 N 1.62 2.36 -0.14 2.92 0.00 -1.94 -1.72 119.26 122.36 2o2r h ALA 887 Ca 0.54 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.41 2o2r h ALA 887 Cb 0.87 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 2o2r h ALA 887 CO -0.31 -0.57 -0.07 0.00 0.00 0.00 0.00 179.25 178.30 2o2r h ALA 888 N 1.66 1.63 -0.26 0.00 0.00 -1.39 -2.76 119.26 118.14 2o2r h ALA 888 Ca 0.35 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2o2r h ALA 888 Cb 1.07 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2o2r h ALA 888 CO -0.07 0.27 0.06 -0.07 0.00 0.00 0.00 179.25 179.45 2o2r h LEU 889 N 0.21 0.33 -2.07 0.00 3.38 -1.47 -2.77 115.31 112.92 2o2r h LEU 889 Ca 0.05 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2o2r h LEU 889 Cb 0.26 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 2o2r h LEU 889 CO 0.01 0.34 -0.08 0.78 0.09 0.00 0.00 178.44 179.58 2o2r h ASN 890 N 0.37 0.00 0.35 -0.43 2.35 -1.63 -0.47 115.58 116.12 2o2r h ASN 890 Ca 0.09 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.79 2o2r h ASN 890 Cb 0.15 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 2o2r h ASN 890 CO -0.00 0.08 -0.21 -0.33 -1.65 0.00 0.00 177.43 175.31 2o2r h GLU 891 N 0.00 0.00 -0.30 0.81 4.39 -1.65 -3.20 114.58 114.63 2o2r h GLU 891 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2o2r h GLU 891 Cb 0.19 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.84 2o2r h GLU 891 CO 0.01 0.21 0.00 0.66 -1.16 0.00 0.00 179.01 178.73 2o2r n TYR 892 N -3.93 0.39 -4.35 4.33 4.01 -0.22 -4.97 117.16 112.42 2o2r n TYR 892 Ca -0.02 -0.39 -0.22 0.00 -0.16 0.00 0.00 57.90 57.11 2o2r n TYR 892 Cb 0.30 -0.02 -0.11 0.00 -0.31 0.00 0.00 39.34 39.20 2o2r n TYR 892 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2o2r s LEU 893 N -1.00 2.46 0.17 7.72 1.43 -0.98 -3.20 118.68 125.27 2o2r s LEU 893 Ca 0.23 -0.88 0.11 0.00 -1.03 0.00 0.00 54.13 52.56 2o2r s LEU 893 Cb 0.12 -0.85 -0.04 0.00 0.03 0.00 0.00 46.19 45.45 2o2r s LEU 893 CO 0.17 -0.03 -0.25 0.00 0.23 0.00 0.00 176.35 176.46 2o2r s ARG 894 N -2.90 1.47 -0.24 1.70 1.70 0.42 -4.81 118.95 116.29 2o2r s ARG 894 Ca 0.17 -1.46 -0.07 0.00 -0.47 0.00 0.00 55.73 53.90 2o2r s ARG 894 Cb -0.05 -1.87 -0.03 0.00 -0.57 0.00 0.00 34.95 32.43 2o2r s ARG 894 CO 0.07 0.42 0.07 0.42 -1.08 0.00 0.00 175.30 175.20 2o2r s ILE 895 N -1.43 4.36 -0.22 4.99 1.01 -1.26 -0.88 121.20 127.78 2o2r s ILE 895 Ca 0.18 -0.16 -0.09 0.00 0.00 0.00 0.00 60.65 60.58 2o2r s ILE 895 Cb -0.09 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.31 2o2r s ILE 895 CO 0.08 0.36 0.11 -0.75 0.00 0.00 0.00 174.94 174.74 2o2r s LYS 896 N 1.42 4.01 -0.18 2.79 2.20 0.17 -4.94 119.74 125.21 2o2r s LYS 896 Ca 0.05 -0.31 -0.12 0.00 -0.36 0.00 0.00 55.97 55.23 2o2r s LYS 896 Cb -0.15 -3.39 -0.05 0.00 -1.51 0.00 0.00 37.83 32.74 2o2r s LYS 896 CO 0.03 0.14 0.23 0.99 -0.36 0.00 0.00 175.35 176.39 2o2r s THR 897 N 0.77 5.34 -0.14 3.43 2.01 -1.26 -0.18 115.64 125.62 2o2r s THR 897 Ca 0.06 0.41 0.02 0.00 0.31 0.00 0.00 61.69 62.49 2o2r s THR 897 Cb -0.13 -3.57 0.01 0.00 0.01 0.00 0.00 72.50 68.82 2o2r s THR 897 CO 0.02 0.40 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.48 2o2r s VAL 898 N 0.50 1.80 -0.17 3.82 1.01 0.01 -5.00 120.40 122.36 2o2r s VAL 898 Ca 0.13 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.31 2o2r s VAL 898 Cb -0.12 -1.62 0.03 0.00 0.00 0.00 0.00 36.38 34.66 2o2r s VAL 898 CO 0.02 0.50 -0.16 -0.89 0.00 0.00 0.00 175.10 174.57 2o2r s THR 899 N 1.04 1.82 0.05 3.92 2.01 -1.26 -1.09 115.64 122.14 2o2r s THR 899 Ca -0.03 -0.86 -0.02 0.00 0.31 0.00 0.00 61.69 61.09 2o2r s THR 899 Cb -0.15 -1.71 -0.04 0.00 0.01 0.00 0.00 72.50 70.61 2o2r s THR 899 CO -0.05 0.43 0.23 -0.36 -0.69 0.00 0.00 174.62 174.19 2o2r s PHE 900 N 1.37 3.52 -0.05 4.92 0.40 0.57 -4.97 117.98 123.75 2o2r s PHE 900 Ca 0.04 0.34 0.05 0.00 -0.60 0.00 0.00 56.93 56.75 2o2r s PHE 900 Cb -0.14 -1.83 -0.02 0.00 0.51 0.00 0.00 43.02 41.54 2o2r s PHE 900 CO -0.11 0.58 -0.17 -2.00 0.70 0.00 0.00 175.22 174.22 2o2r s GLU 901 N -2.35 2.44 0.00 0.44 2.12 -1.26 -2.25 118.70 117.84 2o2r s GLU 901 Ca 0.34 -0.75 0.00 0.00 0.36 0.00 0.00 54.97 54.91 2o2r s GLU 901 Cb -0.13 -2.31 0.00 0.00 0.26 0.00 0.00 34.13 31.96 2o2r s GLU 901 CO 0.25 0.59 0.00 2.48 -0.54 0.00 0.00 175.26 178.04