#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 5.42 0.03 1.34 1.01 -1.26 -5.08 121.20 122.65 2o2r s ILE 406 Ca 0.00 -0.03 -0.30 0.00 0.00 0.00 0.00 60.65 60.32 2o2r s ILE 406 Cb 0.00 -3.46 -0.04 0.00 0.01 0.00 0.00 42.46 38.97 2o2r s ILE 406 CO 0.00 0.44 1.06 0.20 0.00 0.00 0.00 174.94 176.65 2o2r s ASN 407 N -1.57 7.26 0.21 3.58 0.02 -1.26 -5.06 114.94 118.12 2o2r s ASN 407 Ca 0.22 1.80 0.11 0.00 -1.02 0.00 0.00 52.86 53.98 2o2r s ASN 407 Cb -0.12 -2.57 -0.05 0.00 0.02 0.00 0.00 41.25 38.53 2o2r s ASN 407 CO 0.13 -0.34 -0.23 -0.31 0.02 0.00 0.00 177.10 176.37 2o2r s TYR 408 N 0.99 2.31 -0.23 2.20 2.02 -1.26 -4.34 117.35 119.04 2o2r s TYR 408 Ca 0.54 -0.35 -0.17 0.00 -0.37 0.00 0.00 57.07 56.73 2o2r s TYR 408 Cb -0.24 -1.11 -0.03 0.00 -0.40 0.00 0.00 41.96 40.17 2o2r s TYR 408 CO 0.29 0.55 0.44 0.08 -1.57 0.00 0.00 175.55 175.33 2o2r s VAL 409 N -1.84 5.14 -0.16 0.71 1.01 0.25 -4.87 120.40 120.65 2o2r s VAL 409 Ca 0.23 0.76 -0.08 0.00 0.00 0.00 0.00 61.98 62.89 2o2r s VAL 409 Cb -0.07 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2o2r s VAL 409 CO 0.11 0.17 0.12 -0.70 0.00 0.00 0.00 175.10 174.81 2o2r s GLU 410 N 1.80 3.77 -0.16 2.72 2.12 -1.26 -1.22 118.70 126.47 2o2r s GLU 410 Ca 0.19 -0.20 -0.05 0.00 0.36 0.00 0.00 54.97 55.27 2o2r s GLU 410 Cb -0.15 -3.26 0.08 0.00 0.26 0.00 0.00 34.13 31.05 2o2r s GLU 410 CO 0.09 0.53 0.28 0.21 -0.54 0.00 0.00 175.26 175.83 2o2r s LYS 411 N -0.32 0.19 -0.41 4.30 2.20 -0.83 -4.97 119.74 119.89 2o2r s LYS 411 Ca 0.11 0.69 -0.26 0.00 -0.36 0.00 0.00 55.97 56.15 2o2r s LYS 411 Cb -0.12 -0.19 0.02 0.00 -1.51 0.00 0.00 37.83 36.04 2o2r s LYS 411 CO 0.01 -0.36 0.93 0.00 -0.36 0.00 0.00 175.35 175.57 2o2r s ALA 412 N 2.44 3.32 -0.12 3.13 0.00 -1.26 -0.69 121.76 128.58 2o2r s ALA 412 Ca 0.03 -0.59 -0.29 0.00 0.00 0.00 0.00 51.96 51.10 2o2r s ALA 412 Cb -0.13 -3.60 0.08 0.00 0.00 0.00 0.00 23.12 19.47 2o2r s ALA 412 CO -0.10 -1.82 0.72 0.54 0.00 0.00 0.00 175.76 175.10 2o2r s VAL 413 N 3.64 0.00 -1.73 0.00 0.11 -0.58 -4.94 120.40 116.89 2o2r s VAL 413 Ca 0.38 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.43 2o2r s VAL 413 Cb -0.11 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.74 2o2r s VAL 413 CO 0.22 0.00 0.00 -3.20 -3.33 0.00 0.00 175.10 168.79 2o2r n ASN 414 N 1.39 -5.59 -1.39 3.54 5.15 -1.26 -1.76 115.26 115.34 2o2r n ASN 414 Ca -0.17 0.05 -0.14 0.00 -0.60 0.00 0.00 54.58 53.72 2o2r n ASN 414 Cb 0.57 -4.65 -0.03 0.00 -0.53 0.00 0.00 39.78 35.14 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 -2.82 -1.05 -4.23 1.20 5.02 -1.26 -5.01 118.16 110.01 2o2r n LYS 415 Ca -0.23 0.79 -0.13 0.00 -2.02 0.00 0.00 58.31 56.72 2o2r n LYS 415 Cb 0.67 -4.99 -0.10 0.00 -0.02 0.00 0.00 35.03 30.59 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 -3.68 2.45 -0.34 -0.35 1.43 -0.72 -5.12 118.68 112.36 2o2r s LEU 416 Ca 0.00 -1.04 -0.06 0.00 -1.03 0.00 0.00 54.13 52.00 2o2r s LEU 416 Cb 0.00 -0.22 0.04 0.00 0.03 0.00 0.00 46.19 46.05 2o2r s LEU 416 CO 0.00 -0.41 0.11 -0.89 0.23 0.00 0.00 176.35 175.38 2o2r s THR 417 N -3.47 3.73 0.25 5.49 2.01 -1.26 -1.52 115.64 120.87 2o2r s THR 417 Ca 0.17 -1.20 -0.30 0.00 0.31 0.00 0.00 61.69 60.67 2o2r s THR 417 Cb 0.04 -3.14 -0.09 0.00 0.01 0.00 0.00 72.50 69.32 2o2r s THR 417 CO -0.00 -0.21 0.96 -0.76 -0.69 0.00 0.00 174.62 173.92 2o2r s LEU 418 N 1.38 4.63 -0.31 4.42 1.02 0.13 -4.91 118.68 125.05 2o2r s LEU 418 Ca -0.01 1.99 0.01 0.00 0.02 0.00 0.00 54.13 56.13 2o2r s LEU 418 Cb -0.20 -3.63 0.09 0.00 0.02 0.00 0.00 46.19 42.48 2o2r s LEU 418 CO 0.02 0.11 0.07 -1.10 0.02 0.00 0.00 176.35 175.47 2o2r s GLN 419 N -1.24 1.05 -0.30 1.70 -1.52 -1.26 -1.96 119.66 116.11 2o2r s GLN 419 Ca 0.42 -1.30 -0.05 0.00 -1.95 0.00 0.00 55.36 52.48 2o2r s GLN 419 Cb -0.27 -2.44 0.03 0.00 -0.22 0.00 0.00 33.01 30.12 2o2r s GLN 419 CO 0.33 -0.92 0.05 -1.64 -0.25 0.00 0.00 175.29 172.86 2o2r s MET 420 N 1.37 2.75 0.75 2.91 -1.94 -0.36 -4.90 119.30 119.88 2o2r s MET 420 Ca 0.08 -1.07 -0.15 0.00 -1.71 0.00 0.00 55.69 52.84 2o2r s MET 420 Cb -0.18 -3.30 0.05 0.00 2.01 0.00 0.00 34.83 33.40 2o2r s MET 420 CO -0.17 -0.55 1.23 -2.14 -0.01 0.00 0.00 175.02 173.38 2o2r s PRO 421 N 1.39 1.98 0.00 2.03 0.02 -1.26 -0.58 135.00 138.58 2o2r s PRO 421 Ca -0.01 1.84 0.00 0.00 0.02 0.00 0.00 61.00 62.85 2o2r s PRO 421 Cb -0.18 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.53 2o2r s PRO 421 CO 0.01 -1.98 0.08 2.48 -0.33 0.00 0.00 177.00 177.26 2o2r n TYR 422 N -2.81 0.00 -3.26 6.54 4.11 -1.26 -4.72 117.16 115.76 2o2r n TYR 422 Ca 0.14 -0.00 -0.20 0.00 -0.00 0.00 0.00 57.90 57.84 2o2r n TYR 422 Cb 0.50 -0.00 0.02 0.00 -0.00 0.00 0.00 39.34 39.85 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 -0.01 2.49 0.52 -3.48 -0.21 -1.26 -1.03 119.66 116.68 2o2r s GLN 423 Ca 0.00 -1.56 -0.22 0.00 0.02 0.00 0.00 55.36 53.60 2o2r s GLN 423 Cb 0.00 -2.54 -0.06 0.00 1.00 0.00 0.00 33.01 31.41 2o2r s GLN 423 CO 0.00 -0.52 1.27 -0.51 -2.12 0.00 0.00 175.29 173.41 2o2r s LEU 424 N -4.41 3.90 -0.32 2.90 1.43 -0.26 -4.78 118.68 117.14 2o2r s LEU 424 Ca 0.53 2.56 -0.02 0.00 -1.03 0.00 0.00 54.13 56.17 2o2r s LEU 424 Cb -0.06 -4.29 0.06 0.00 0.03 0.00 0.00 46.19 41.94 2o2r s LEU 424 CO 0.32 -1.32 0.04 0.12 0.23 0.00 0.00 176.35 175.74 2o2r s PHE 425 N -1.42 3.34 -0.05 0.29 5.36 -0.61 -0.55 117.98 124.34 2o2r s PHE 425 Ca 0.69 -1.98 0.00 0.00 -0.96 0.00 0.00 56.93 54.68 2o2r s PHE 425 Cb -0.35 -2.34 0.02 0.00 -0.34 0.00 0.00 43.02 40.01 2o2r s PHE 425 CO 0.42 -0.83 -0.03 0.42 -1.46 0.00 0.00 175.22 173.73 2o2r s ILE 426 N 1.23 0.47 -1.50 3.12 1.01 -0.24 -0.48 121.20 124.81 2o2r s ILE 426 Ca -0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 60.65 60.54 2o2r s ILE 426 Cb -0.20 -0.54 0.02 0.00 0.01 0.00 0.00 42.46 41.74 2o2r s ILE 426 CO -0.02 0.23 0.44 0.61 0.00 0.00 0.00 174.94 176.20 2o2r n GLY 427 N 4.39 -0.51 1.61 6.18 0.00 -1.26 -1.63 105.19 113.96 2o2r n GLY 427 Ca -0.20 0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.32 0.57 2.97 -0.02 0.00 -1.26 -4.28 105.19 101.86 2o2r n GLY 428 Ca -0.12 -0.26 -0.10 0.00 0.00 0.00 0.00 46.02 45.55 2o2r n GLY 428 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2o2r s GLU 429 N -0.60 0.26 -0.12 1.61 -1.05 -0.65 -5.01 118.70 113.14 2o2r s GLU 429 Ca 0.00 -0.43 -0.27 0.00 -0.15 0.00 0.00 54.97 54.11 2o2r s GLU 429 Cb 0.00 0.10 -0.02 0.00 -0.44 0.00 0.00 34.13 33.77 2o2r s GLU 429 CO 0.00 -0.05 0.92 -0.06 0.95 0.00 0.00 175.26 177.02 2o2r s PHE 430 N -1.10 3.50 0.04 4.83 0.40 -1.25 -1.08 117.98 123.31 2o2r s PHE 430 Ca -0.12 1.45 0.00 0.00 -0.60 0.00 0.00 56.93 57.66 2o2r s PHE 430 Cb -0.07 -3.09 -0.03 0.00 0.51 0.00 0.00 43.02 40.34 2o2r s PHE 430 CO -0.00 -0.19 -0.04 0.14 0.70 0.00 0.00 175.22 175.83 2o2r s VAL 431 N 1.88 0.26 0.62 -0.44 -7.23 0.29 -4.95 120.40 110.83 2o2r s VAL 431 Ca 0.44 -1.27 -0.15 0.00 -1.81 0.00 0.00 61.98 59.19 2o2r s VAL 431 Cb -0.18 -0.79 -0.02 0.00 0.56 0.00 0.00 36.38 35.96 2o2r s VAL 431 CO 0.17 -0.65 1.07 -1.81 -0.31 0.00 0.00 175.10 173.57 2o2r s ASP 432 N -2.02 5.55 0.86 4.85 1.01 -1.26 -1.10 116.67 124.56 2o2r s ASP 432 Ca -0.06 1.86 -0.11 0.00 0.71 0.00 0.00 52.55 54.94 2o2r s ASP 432 Cb -0.04 -2.54 0.11 0.00 1.01 0.00 0.00 42.92 41.46 2o2r s ASP 432 CO -0.04 -1.32 1.10 0.00 0.21 0.00 0.00 175.17 175.12 2o2r s ALA 433 N -2.46 1.75 0.14 5.23 0.00 -1.26 -4.87 121.76 120.28 2o2r s ALA 433 Ca 0.64 0.18 -0.35 0.00 0.00 0.00 0.00 51.96 52.44 2o2r s ALA 433 Cb -0.17 -3.27 -0.16 0.00 0.00 0.00 0.00 23.12 19.52 2o2r s ALA 433 CO 0.40 -2.23 1.33 -1.91 0.00 0.00 0.00 175.76 173.34 2o2r n GLU 434 N -3.83 1.38 -1.19 0.00 2.13 -1.26 -1.15 120.64 116.72 2o2r n GLU 434 Ca 0.08 0.49 -0.06 0.00 0.66 0.00 0.00 57.16 58.34 2o2r n GLU 434 Cb 0.54 -2.12 -0.03 0.00 0.27 0.00 0.00 31.44 30.10 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 2.47 0.82 2.40 8.31 0.00 -1.26 -3.29 105.19 114.64 2o2r n GLY 435 Ca 0.17 -0.33 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.02 -2.90 -4.76 1.61 7.64 -0.30 -4.94 113.62 109.95 2o2r n SER 436 Ca -0.06 0.29 -0.39 0.00 1.01 0.00 0.00 58.87 59.71 2o2r n SER 436 Cb 0.31 -2.54 0.01 0.00 -1.01 0.00 0.00 64.21 60.98 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 -4.85 3.73 0.26 1.43 1.02 -1.21 -4.89 119.74 115.24 2o2r s LYS 437 Ca 0.00 2.17 -0.01 0.00 0.02 0.00 0.00 55.97 58.15 2o2r s LYS 437 Cb 0.00 -2.60 -0.03 0.00 -0.52 0.00 0.00 37.83 34.69 2o2r s LYS 437 CO 0.00 -0.69 0.25 0.95 -0.92 0.00 0.00 175.35 174.94 2o2r s THR 438 N -1.30 0.00 0.18 2.17 -4.23 -1.26 -1.39 115.64 109.81 2o2r s THR 438 Ca 0.61 -1.88 -0.13 0.00 -1.18 0.00 0.00 61.69 59.12 2o2r s THR 438 Cb -0.38 -2.48 0.01 0.00 1.34 0.00 0.00 72.50 70.98 2o2r s THR 438 CO 0.48 0.00 0.39 -0.72 -0.54 0.00 0.00 174.62 174.23 2o2r s TYR 439 N -3.82 0.17 -0.08 3.99 -0.85 -0.34 -4.74 117.35 111.67 2o2r s TYR 439 Ca 0.36 -0.53 -0.12 0.00 -0.52 0.00 0.00 57.07 56.27 2o2r s TYR 439 Cb 0.04 0.15 -0.05 0.00 0.38 0.00 0.00 41.96 42.48 2o2r s TYR 439 CO 0.17 -0.81 0.29 -0.80 -1.52 0.00 0.00 175.55 172.88 2o2r s ASN 440 N -2.93 6.58 -0.12 -0.18 0.01 -1.26 -0.37 114.94 116.67 2o2r s ASN 440 Ca 0.14 0.68 -0.06 0.00 -0.71 0.00 0.00 52.86 52.92 2o2r s ASN 440 Cb 0.01 -2.18 -0.04 0.00 0.41 0.00 0.00 41.25 39.46 2o2r s ASN 440 CO -0.01 0.29 0.09 0.28 -1.51 0.00 0.00 177.10 176.23 2o2r s THR 441 N -0.63 5.04 -0.13 1.60 -1.32 -0.89 -4.97 115.64 114.33 2o2r s THR 441 Ca 0.19 0.04 -0.02 0.00 -1.21 0.00 0.00 61.69 60.69 2o2r s THR 441 Cb -0.14 -3.19 -0.02 0.00 -1.51 0.00 0.00 72.50 67.64 2o2r s THR 441 CO 0.08 0.59 -0.08 -0.63 -2.21 0.00 0.00 174.62 172.37 2o2r s ILE 442 N -0.76 3.53 -0.28 5.08 -1.09 -1.26 -0.35 121.20 126.08 2o2r s ILE 442 Ca 0.13 -0.49 -0.29 0.00 -2.23 0.00 0.00 60.65 57.76 2o2r s ILE 442 Cb -0.12 -2.51 0.01 0.00 -1.58 0.00 0.00 42.46 38.26 2o2r s ILE 442 CO 0.03 0.52 1.16 0.21 -1.23 0.00 0.00 174.94 175.63 2o2r s ASN 443 N 0.21 6.88 0.00 3.58 3.84 0.12 -4.84 114.94 124.73 2o2r s ASN 443 Ca -0.05 1.24 0.27 0.00 0.21 0.00 0.00 52.86 54.53 2o2r s ASN 443 Cb -0.14 -2.54 1.21 0.00 -0.55 0.00 0.00 41.25 39.22 2o2r s ASN 443 CO 0.04 -0.89 1.88 -0.81 -2.79 0.00 0.00 177.10 174.52 2o2r n PRO 444 N 6.88 0.12 0.15 0.43 -0.04 -1.26 0.36 135.00 141.64 2o2r n PRO 444 Ca 0.13 0.04 0.01 0.00 -0.04 0.00 0.00 63.50 63.64 2o2r n PRO 444 Cb 0.46 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.64 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 1.29 0.00 0.52 2.02 -1.89 -0.95 112.91 113.89 2o2r h THR 445 Ca 0.00 -1.93 0.00 0.00 0.77 0.00 0.00 66.41 65.25 2o2r h THR 445 Cb 0.39 2.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.87 2o2r h THR 445 CO 0.00 0.53 0.00 -0.90 0.37 0.00 0.00 175.52 175.52 2o2r n ASP 446 N -3.74 0.07 0.00 4.18 3.85 -1.16 -3.48 116.55 116.26 2o2r n ASP 446 Ca -0.01 -0.73 0.00 0.00 -0.71 0.00 0.00 54.79 53.34 2o2r n ASP 446 Cb 0.58 0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.38 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 0.03 0.75 3.87 6.12 0.00 0.16 -4.06 105.19 112.06 2o2r n GLY 447 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.51 6.35 -0.04 1.61 1.04 -1.22 -4.72 113.70 114.21 2o2r s SER 448 Ca 0.00 1.38 -0.30 0.00 0.48 0.00 0.00 55.95 57.51 2o2r s SER 448 Cb 0.00 -2.44 -0.04 0.00 0.10 0.00 0.00 66.02 63.64 2o2r s SER 448 CO 0.00 -0.73 1.24 -0.69 0.98 0.00 0.00 173.24 174.04 2o2r s VAL 449 N -2.93 4.14 -0.09 5.02 1.01 -1.26 0.11 120.40 126.41 2o2r s VAL 449 Ca 0.55 1.48 -0.24 0.00 0.00 0.00 0.00 61.98 63.77 2o2r s VAL 449 Cb -0.11 -3.95 -0.20 0.00 0.00 0.00 0.00 36.38 32.12 2o2r s VAL 449 CO 0.45 0.00 0.85 0.40 0.00 0.00 0.00 175.10 176.81 2o2r h ILE 450 N 4.97 1.30 -2.15 2.22 2.04 -1.03 -3.46 117.51 121.40 2o2r h ILE 450 Ca -0.35 -1.63 0.26 0.00 1.00 0.00 0.00 64.86 64.14 2o2r h ILE 450 Cb 1.17 2.31 -0.07 0.00 -0.74 0.00 0.00 36.82 39.49 2o2r h ILE 450 CO 0.88 0.38 0.74 0.00 0.00 0.00 0.00 178.15 180.15 2o2r s GLN 452 N -2.26 3.90 -0.03 0.00 1.11 -1.26 -2.10 119.66 119.01 2o2r s GLN 452 Ca 0.22 0.38 0.04 0.00 0.01 0.00 0.00 55.36 56.02 2o2r s GLN 452 Cb -0.00 -3.14 -0.01 0.00 -1.01 0.00 0.00 33.01 28.86 2o2r s GLN 452 CO 0.01 0.63 -0.15 0.08 0.01 0.00 0.00 175.29 175.87 2o2r s VAL 453 N -1.20 1.25 0.35 1.09 1.01 0.50 -4.86 120.40 118.54 2o2r s VAL 453 Ca 0.28 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.35 2o2r s VAL 453 Cb -0.16 -1.07 -0.13 0.00 0.00 0.00 0.00 36.38 35.03 2o2r s VAL 453 CO 0.15 0.36 0.98 -1.20 0.00 0.00 0.00 175.10 175.39 2o2r n SER 454 N 2.98 1.13 -4.15 3.32 7.64 -0.20 -1.20 113.62 123.14 2o2r n SER 454 Ca -0.17 1.11 -0.38 0.00 1.01 0.00 0.00 58.87 60.44 2o2r n SER 454 Cb 0.54 -1.30 -0.10 0.00 -1.01 0.00 0.00 64.21 62.34 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 0.20 5.45 0.36 -3.43 2.96 -0.49 -4.61 118.68 119.11 2o2r s LEU 455 Ca 0.60 -2.22 -0.28 0.00 -0.22 0.00 0.00 54.13 52.02 2o2r s LEU 455 Cb -0.64 -1.90 -0.11 0.00 0.50 0.00 0.00 46.19 44.03 2o2r s LEU 455 CO 0.59 -0.55 1.45 0.00 -1.32 0.00 0.00 176.35 176.52 2o2r n ALA 456 N 4.40 2.12 -2.43 5.97 0.00 -0.38 -4.71 120.51 125.48 2o2r n ALA 456 Ca -0.01 0.35 -0.26 0.00 0.00 0.00 0.00 53.44 53.52 2o2r n ALA 456 Cb 0.41 -2.38 -0.03 0.00 0.00 0.00 0.00 19.45 17.44 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 -1.85 2.27 0.25 0.00 -1.52 -1.26 -4.74 119.66 112.81 2o2r s GLN 457 Ca 0.55 -1.97 -0.05 0.00 -1.95 0.00 0.00 55.36 51.94 2o2r s GLN 457 Cb -0.50 -2.04 0.33 0.00 -0.22 0.00 0.00 33.01 30.58 2o2r s GLN 457 CO 0.62 -0.42 1.87 0.28 -0.25 0.00 0.00 175.29 177.39 2o2r h VAL 458 N 1.02 1.09 -0.39 1.09 2.07 -1.95 -1.86 116.25 117.31 2o2r h VAL 458 Ca -0.40 -0.37 -0.05 0.00 0.82 0.00 0.00 66.70 66.70 2o2r h VAL 458 Cb 1.29 -0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 2o2r h VAL 458 CO 0.62 0.20 0.02 0.77 0.02 0.00 0.00 177.57 179.20 2o2r h SER 459 N 1.08 0.57 -0.65 0.57 4.64 -1.99 -2.05 113.55 115.72 2o2r h SER 459 Ca 0.38 -0.11 -0.05 0.00 -0.47 0.00 0.00 61.79 61.55 2o2r h SER 459 Cb 0.11 -0.15 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 2o2r h SER 459 CO -0.15 0.63 0.22 0.44 -0.87 0.00 0.00 176.83 177.10 2o2r h ASP 460 N 0.58 0.93 -0.28 4.97 3.32 -1.75 -2.00 116.42 122.19 2o2r h ASP 460 Ca 0.13 -0.19 0.01 0.00 0.02 0.00 0.00 57.03 56.99 2o2r h ASP 460 Cb 0.33 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.62 2o2r h ASP 460 CO 0.01 0.88 0.17 0.58 -1.72 0.00 0.00 179.24 179.15 2o2r h VAL 461 N 0.93 1.04 -0.59 -1.35 2.07 -1.06 0.05 116.25 117.35 2o2r h VAL 461 Ca 0.21 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.63 2o2r h VAL 461 Cb 0.26 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 2o2r h VAL 461 CO -0.01 0.06 0.39 0.44 0.02 0.00 0.00 177.57 178.47 2o2r h ASP 462 N 0.35 0.64 -0.24 0.57 3.45 -1.32 0.87 116.42 120.74 2o2r h ASP 462 Ca 0.11 -0.01 -0.20 0.00 0.43 0.00 0.00 57.03 57.36 2o2r h ASP 462 Cb -0.01 -0.15 0.00 0.00 -0.56 0.00 0.00 39.33 38.61 2o2r h ASP 462 CO -0.04 0.45 -0.61 0.11 -1.57 0.00 0.00 179.24 177.58 2o2r h LYS 463 N 0.75 0.85 -0.23 3.56 1.57 -1.02 -1.83 116.57 120.22 2o2r h LYS 463 Ca 0.22 -0.58 -0.01 0.00 -1.87 0.00 0.00 60.65 58.42 2o2r h LYS 463 Cb -0.01 0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 2o2r h LYS 463 CO -0.05 1.21 0.10 0.00 -0.57 0.00 0.00 179.45 180.13 2o2r h ALA 464 N 0.66 0.29 -0.45 3.86 0.00 -0.26 -0.65 119.26 122.72 2o2r h ALA 464 Ca -0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2o2r h ALA 464 Cb 1.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2o2r h ALA 464 CO 0.13 -0.14 0.21 0.28 0.00 0.00 0.00 179.25 179.74 2o2r h VAL 465 N 0.22 1.19 -0.41 0.00 2.07 -0.90 0.25 116.25 118.68 2o2r h VAL 465 Ca 0.08 -0.53 0.05 0.00 0.82 0.00 0.00 66.70 67.11 2o2r h VAL 465 Cb 0.14 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 2o2r h VAL 465 CO -0.01 0.20 0.15 0.00 0.02 0.00 0.00 177.57 177.93 2o2r h ALA 466 N 1.05 0.48 -0.86 1.67 0.00 -1.26 0.12 119.26 120.46 2o2r h ALA 466 Ca 0.15 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2o2r h ALA 466 Cb 0.13 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2o2r h ALA 466 CO -0.02 -0.24 0.52 0.00 0.00 0.00 0.00 179.25 179.51 2o2r h ALA 467 N 1.26 1.10 -0.51 0.00 0.00 -0.74 -1.75 119.26 118.61 2o2r h ALA 467 Ca 0.19 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 2o2r h ALA 467 Cb 0.16 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2o2r h ALA 467 CO -0.19 0.56 0.08 0.00 0.00 0.00 0.00 179.25 179.70 2o2r h ALA 468 N 1.28 0.68 -0.17 0.00 0.00 -0.19 -1.55 119.26 119.31 2o2r h ALA 468 Ca 0.31 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2o2r h ALA 468 Cb -0.05 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 2o2r h ALA 468 CO -0.06 0.42 0.04 -0.22 0.00 0.00 0.00 179.25 179.44 2o2r h LYS 469 N 0.73 0.27 -0.32 0.00 3.64 -0.69 -0.94 116.57 119.27 2o2r h LYS 469 Ca 0.15 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 2o2r h LYS 469 Cb 0.41 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 2o2r h LYS 469 CO 0.01 0.41 0.12 1.49 -2.27 0.00 0.00 179.45 179.22 2o2r h GLU 470 N 0.08 0.26 -0.98 1.90 4.57 -1.34 -0.04 114.58 119.03 2o2r h GLU 470 Ca 0.05 -0.02 0.08 0.00 -1.18 0.00 0.00 59.36 58.30 2o2r h GLU 470 Cb 0.26 -0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 28.72 2o2r h GLU 470 CO 0.00 0.17 0.62 0.00 -1.18 0.00 0.00 179.01 178.63 2o2r h ALA 471 N 1.19 1.39 0.05 2.92 0.00 -1.10 0.14 119.26 123.85 2o2r h ALA 471 Ca 0.14 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2o2r h ALA 471 Cb 0.09 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.62 2o2r h ALA 471 CO -0.13 0.35 -0.02 0.35 0.00 0.00 0.00 179.25 179.80 2o2r h PHE 472 N 1.09 -0.06 0.10 0.00 3.57 -0.95 -2.83 116.94 117.86 2o2r h PHE 472 Ca 0.44 -0.00 -0.27 0.00 3.53 0.00 0.00 57.97 61.67 2o2r h PHE 472 Cb 0.26 0.02 0.01 0.00 2.79 0.00 0.00 35.95 39.03 2o2r h PHE 472 CO -0.01 0.44 -1.17 0.93 -2.23 0.00 0.00 178.31 176.26 2o2r h GLU 473 N -0.59 0.34 0.00 1.11 5.08 -0.88 -3.36 114.58 116.28 2o2r h GLU 473 Ca -0.01 -0.51 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 2o2r h GLU 473 Cb 0.52 0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.95 2o2r h GLU 473 CO 0.01 1.21 -0.69 0.09 -1.00 0.00 0.00 179.01 178.63 2o2r n ASN 474 N -3.62 3.45 -4.62 1.42 3.02 0.38 -5.00 115.26 110.29 2o2r n ASN 474 Ca -0.09 -0.02 -0.29 0.00 -0.03 0.00 0.00 54.58 54.15 2o2r n ASN 474 Cb 0.97 0.73 0.13 0.00 -0.61 0.00 0.00 39.78 41.00 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 -1.42 1.63 0.31 7.41 0.00 -0.49 -4.98 107.32 109.79 2o2r s GLY 475 Ca 0.00 -0.77 0.03 0.00 0.00 0.00 0.00 44.72 43.98 2o2r s GLY 475 CO 0.00 -0.17 1.88 -2.00 0.00 0.00 0.00 173.10 172.81 2o2r h LEU 476 N -1.41 0.85 -1.05 0.66 5.85 -1.92 -2.78 115.31 115.51 2o2r h LEU 476 Ca -0.47 0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.42 2o2r h LEU 476 Cb 1.31 -0.15 -0.09 0.00 0.37 0.00 0.00 40.66 42.10 2o2r h LEU 476 CO 0.56 0.49 0.62 -0.25 -0.34 0.00 0.00 178.44 179.53 2o2r h TRP 477 N 0.93 1.09 0.00 1.25 2.91 -1.93 -0.24 115.95 119.97 2o2r h TRP 477 Ca 0.43 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.48 2o2r h TRP 477 Cb 0.40 -0.34 0.00 0.00 -0.51 0.00 0.00 29.16 28.71 2o2r h TRP 477 CO -0.00 0.39 0.00 0.41 -1.03 0.00 0.00 178.44 178.20 2o2r n GLY 478 N -1.36 -1.20 0.02 2.65 0.00 -1.05 -4.00 105.19 100.26 2o2r n GLY 478 Ca 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.28 1.90 -1.68 1.61 5.02 -0.19 -5.05 118.16 118.49 2o2r n LYS 479 Ca 0.13 -0.03 -0.32 0.00 -2.02 0.00 0.00 58.31 56.07 2o2r n LYS 479 Cb 0.22 -1.16 0.05 0.00 -0.02 0.00 0.00 35.03 34.12 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 -2.27 3.36 0.54 -0.18 -4.36 -0.69 -4.99 121.20 112.61 2o2r s ILE 480 Ca -0.03 0.59 -0.21 0.00 -0.26 0.00 0.00 60.65 60.74 2o2r s ILE 480 Cb 0.03 -3.11 -0.06 0.00 1.25 0.00 0.00 42.46 40.57 2o2r s ILE 480 CO 0.26 -0.44 1.09 0.59 0.24 0.00 0.00 174.94 176.69 2o2r n ASN 481 N -2.63 1.47 -0.32 4.36 3.02 -1.26 -4.83 115.26 115.08 2o2r n ASN 481 Ca 0.10 0.91 0.07 0.00 -0.03 0.00 0.00 54.58 55.63 2o2r n ASN 481 Cb 0.52 -1.44 0.22 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 1.03 1.35 -0.93 5.41 0.00 -1.94 -0.27 119.26 123.90 2o2r h ALA 482 Ca -0.48 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.50 2o2r h ALA 482 Cb 1.34 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 2o2r h ALA 482 CO 0.54 0.04 0.62 -0.09 0.00 0.00 0.00 179.25 180.36 2o2r h ARG 483 N 0.77 1.22 -0.02 0.00 2.43 -1.91 -0.41 114.38 116.45 2o2r h ARG 483 Ca 0.47 -0.07 -0.20 0.00 -0.81 0.00 0.00 59.98 59.36 2o2r h ARG 483 Cb 0.56 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2o2r h ARG 483 CO -0.31 0.81 -0.83 -0.44 -1.51 0.00 0.00 179.97 177.68 2o2r h ASP 484 N 1.26 0.40 -0.47 -3.80 3.32 -1.63 -1.73 116.42 113.77 2o2r h ASP 484 Ca 0.35 -0.30 0.05 0.00 0.02 0.00 0.00 57.03 57.15 2o2r h ASP 484 Cb -0.13 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 39.25 2o2r h ASP 484 CO -0.08 1.07 0.20 -0.09 -1.72 0.00 0.00 179.24 178.62 2o2r h ARG 485 N 0.19 0.38 -0.58 3.56 2.43 -0.67 -2.13 114.38 117.56 2o2r h ARG 485 Ca -0.05 -0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 2o2r h ARG 485 Cb 1.44 -0.09 -0.05 0.00 -0.42 0.00 0.00 29.97 30.86 2o2r h ARG 485 CO 0.14 0.25 0.32 0.78 -1.51 0.00 0.00 179.97 179.95 2o2r h GLY 486 N 0.39 0.83 1.14 2.80 0.00 -0.88 -2.06 103.07 105.29 2o2r h GLY 486 Ca 0.21 -0.23 0.01 0.00 0.00 0.00 0.00 47.33 47.33 2o2r h GLY 486 CO -0.19 0.16 0.57 3.21 0.00 0.00 0.00 176.54 180.29 2o2r h ARG 487 N 0.62 1.12 -0.56 4.80 3.08 -1.05 -0.63 114.38 121.75 2o2r h ARG 487 Ca 0.25 -0.07 -0.10 0.00 0.07 0.00 0.00 59.98 60.14 2o2r h ARG 487 Cb 0.12 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2o2r h ARG 487 CO -0.15 0.74 -0.04 -0.07 -1.07 0.00 0.00 179.97 179.38 2o2r h LEU 488 N 1.15 1.00 -0.77 3.04 3.38 -0.93 -0.73 115.31 121.46 2o2r h LEU 488 Ca 0.32 -0.32 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 2o2r h LEU 488 Cb -0.11 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.36 2o2r h LEU 488 CO -0.07 1.08 -0.26 -0.07 0.09 0.00 0.00 178.44 179.21 2o2r h LEU 489 N 0.89 0.66 -0.86 1.67 3.38 -1.10 0.71 115.31 120.66 2o2r h LEU 489 Ca 0.15 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 2o2r h LEU 489 Cb 0.59 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.15 2o2r h LEU 489 CO 0.04 0.90 -0.30 0.22 0.09 0.00 0.00 178.44 179.38 2o2r h TYR 490 N 0.56 0.56 -0.35 1.13 3.20 -1.00 -1.51 116.97 119.56 2o2r h TYR 490 Ca 0.08 -0.13 -0.05 0.00 3.14 0.00 0.00 58.73 61.76 2o2r h TYR 490 Cb 0.74 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.86 2o2r h TYR 490 CO 0.03 0.74 0.01 -0.09 -1.64 0.00 0.00 178.16 177.22 2o2r h ARG 491 N 0.43 0.61 -0.47 1.82 9.65 -0.91 -2.17 114.38 123.34 2o2r h ARG 491 Ca 0.05 -0.19 0.09 0.00 -1.10 0.00 0.00 59.98 58.84 2o2r h ARG 491 Cb 0.74 -0.06 -0.08 0.00 -1.39 0.00 0.00 29.97 29.19 2o2r h ARG 491 CO 0.06 0.71 -0.00 1.25 2.80 0.00 0.00 179.97 184.79 2o2r h LEU 492 N 0.42 -0.20 -1.07 3.80 5.85 -0.64 -0.92 115.31 122.55 2o2r h LEU 492 Ca 0.10 0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.97 2o2r h LEU 492 Cb 0.43 0.20 -0.06 0.00 0.37 0.00 0.00 40.66 41.60 2o2r h LEU 492 CO 0.02 -0.06 0.63 0.00 -0.34 0.00 0.00 178.44 178.68 2o2r h ALA 493 N 1.41 1.40 -0.63 1.25 0.00 -1.18 -1.26 119.26 120.25 2o2r h ALA 493 Ca 0.23 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 2o2r h ALA 493 Cb 0.34 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2o2r h ALA 493 CO -0.39 0.50 0.13 -0.44 0.00 0.00 0.00 179.25 179.05 2o2r h ASP 494 N 1.19 0.98 -0.52 0.00 3.45 -0.68 -1.01 116.42 119.83 2o2r h ASP 494 Ca 0.39 -0.25 -0.06 0.00 0.43 0.00 0.00 57.03 57.54 2o2r h ASP 494 Cb 0.04 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.53 2o2r h ASP 494 CO -0.13 0.98 0.08 0.58 -1.57 0.00 0.00 179.24 179.18 2o2r h VAL 495 N 0.95 1.25 -0.86 -1.35 2.07 -0.81 -1.27 116.25 116.23 2o2r h VAL 495 Ca 0.20 -0.96 0.03 0.00 0.82 0.00 0.00 66.70 66.79 2o2r h VAL 495 Cb 0.40 0.86 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 2o2r h VAL 495 CO 0.01 0.34 0.56 0.24 0.02 0.00 0.00 177.57 178.74 2o2r h MET 496 N 0.75 1.07 -0.55 1.57 2.86 -1.07 -2.23 114.93 117.32 2o2r h MET 496 Ca 0.16 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.73 2o2r h MET 496 Cb 0.41 -0.24 -0.03 0.00 0.06 0.00 0.00 31.60 31.80 2o2r h MET 496 CO 0.01 0.71 0.33 1.49 1.06 0.00 0.00 176.91 180.51 2o2r h GLU 497 N 1.10 0.75 -0.06 1.72 4.81 -0.90 -1.55 114.58 120.44 2o2r h GLU 497 Ca 0.34 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.52 2o2r h GLU 497 Cb -0.03 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.19 2o2r h GLU 497 CO -0.10 0.54 0.10 1.96 -0.73 0.00 0.00 179.01 180.78 2o2r h GLN 498 N 0.74 0.00 -0.22 1.92 4.20 -0.84 -2.51 115.11 118.40 2o2r h GLN 498 Ca 0.20 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.90 2o2r h GLN 498 Cb -0.01 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2o2r h GLN 498 CO -0.04 0.00 -0.00 0.72 -0.67 0.00 0.00 178.83 178.84 2o2r n HIS 499 N -3.57 0.79 -0.08 2.96 8.25 -0.66 -4.82 115.22 118.09 2o2r n HIS 499 Ca -0.01 -0.94 -0.06 0.00 -0.26 0.00 0.00 57.72 56.45 2o2r n HIS 499 Cb 0.19 -0.30 0.13 0.00 1.12 0.00 0.00 29.99 31.14 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 1.44 0.73 -0.35 -0.41 3.07 -0.88 -0.13 115.11 118.57 2o2r h GLN 500 Ca 0.01 -0.25 -0.05 0.00 0.09 0.00 0.00 58.65 58.45 2o2r h GLN 500 Cb 1.38 -0.05 -0.01 0.00 0.08 0.00 0.00 27.48 28.87 2o2r h GLN 500 CO 0.19 0.84 0.02 0.93 0.09 0.00 0.00 178.83 180.90 2o2r h GLU 501 N 0.65 0.61 -0.57 0.06 3.07 -1.87 -0.14 114.58 116.39 2o2r h GLU 501 Ca 0.11 -0.18 -0.04 0.00 -0.50 0.00 0.00 59.36 58.75 2o2r h GLU 501 Cb 0.62 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.44 2o2r h GLU 501 CO 0.04 0.71 0.21 1.49 -1.40 0.00 0.00 179.01 180.06 2o2r h GLU 502 N 0.43 0.86 -0.43 2.33 4.81 -1.84 -1.48 114.58 119.26 2o2r h GLU 502 Ca 0.10 -0.17 -0.07 0.00 -0.13 0.00 0.00 59.36 59.09 2o2r h GLU 502 Cb 0.42 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 2o2r h GLU 502 CO 0.01 0.75 -0.02 -0.07 -0.73 0.00 0.00 179.01 178.96 2o2r h LEU 503 N 0.79 0.76 -1.39 1.64 3.38 -0.91 -1.04 115.31 118.54 2o2r h LEU 503 Ca 0.19 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2o2r h LEU 503 Cb 0.23 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 2o2r h LEU 503 CO -0.01 0.89 0.13 0.00 0.09 0.00 0.00 178.44 179.54 2o2r h ALA 504 N 0.89 1.52 -0.22 1.53 0.00 -0.95 -1.70 119.26 120.33 2o2r h ALA 504 Ca 0.12 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.73 2o2r h ALA 504 Cb 0.52 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2o2r h ALA 504 CO 0.03 0.37 -0.54 1.15 0.00 0.00 0.00 179.25 180.25 2o2r h THR 505 N 0.54 1.30 -0.85 0.00 2.02 -0.95 -1.24 112.91 113.72 2o2r h THR 505 Ca 0.13 -1.75 -0.02 0.00 0.77 0.00 0.00 66.41 65.54 2o2r h THR 505 Cb 0.15 1.82 -0.04 0.00 -1.74 0.00 0.00 68.15 68.34 2o2r h THR 505 CO -0.01 0.55 0.46 0.40 0.37 0.00 0.00 175.52 177.29 2o2r h ILE 506 N 0.48 1.25 -0.55 3.11 2.04 -0.94 -1.05 117.51 121.85 2o2r h ILE 506 Ca -0.01 -0.64 -0.11 0.00 1.00 0.00 0.00 64.86 65.11 2o2r h ILE 506 Cb 1.15 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.33 2o2r h ILE 506 CO 0.12 0.29 -0.09 -0.08 0.00 0.00 0.00 178.15 178.39 2o2r h GLU 507 N 1.19 1.02 -0.13 2.37 4.57 -1.27 0.71 114.58 123.04 2o2r h GLU 507 Ca 0.30 -0.36 0.04 0.00 -1.18 0.00 0.00 59.36 58.15 2o2r h GLU 507 Cb 0.04 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.52 2o2r h GLU 507 CO -0.05 1.05 -0.10 0.00 -1.18 0.00 0.00 179.01 178.73 2o2r h ALA 508 N 0.98 0.01 -0.51 2.92 0.00 -0.91 -0.32 119.26 121.42 2o2r h ALA 508 Ca 0.15 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2o2r h ALA 508 Cb 0.65 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 2o2r h ALA 508 CO 0.04 -0.55 0.32 -0.07 0.00 0.00 0.00 179.25 179.00 2o2r h LEU 509 N -0.11 0.61 0.11 0.00 3.38 -0.98 -1.71 115.31 116.62 2o2r h LEU 509 Ca 0.08 -0.04 -0.32 0.00 0.09 0.00 0.00 57.88 57.69 2o2r h LEU 509 Cb 0.23 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 2o2r h LEU 509 CO -0.19 0.47 -1.68 -0.78 0.09 0.00 0.00 178.44 176.36 2o2r h ASP 510 N 0.69 0.37 -0.00 -0.43 3.58 -0.81 -3.36 116.42 116.45 2o2r h ASP 510 Ca 0.19 -0.59 0.00 0.00 0.42 0.00 0.00 57.03 57.04 2o2r h ASP 510 Cb -0.03 -0.12 0.00 0.00 1.72 0.00 0.00 39.33 40.90 2o2r h ASP 510 CO -0.04 1.51 -0.14 0.00 -2.88 0.00 0.00 179.24 177.69 2o2r n ALA 511 N -2.74 2.54 -1.06 -0.78 0.00 -0.15 -4.71 120.51 113.61 2o2r n ALA 511 Ca -0.21 -0.24 -0.02 0.00 0.00 0.00 0.00 53.44 52.97 2o2r n ALA 511 Cb 1.05 -0.16 -0.01 0.00 0.00 0.00 0.00 19.45 20.33 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 0.86 0.55 3.72 0.00 0.00 -0.64 -4.35 105.19 105.33 2o2r n GLY 512 Ca 0.01 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 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 -1.98 3.64 0.12 4.61 0.00 -1.19 -4.13 121.76 122.84 2o2r s ALA 513 Ca 0.00 1.19 -0.31 0.00 0.00 0.00 0.00 51.96 52.84 2o2r s ALA 513 Cb 0.00 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 19.46 2o2r s ALA 513 CO 0.00 -0.66 1.84 0.08 0.00 0.00 0.00 175.76 177.02 2o2r s VAL 514 N 1.06 2.54 0.24 0.00 1.01 -1.26 -3.82 120.40 120.16 2o2r s VAL 514 Ca 0.66 0.04 -0.05 0.00 0.00 0.00 0.00 61.98 62.62 2o2r s VAL 514 Cb -0.39 -3.02 0.20 0.00 0.00 0.00 0.00 36.38 33.17 2o2r s VAL 514 CO 0.31 -0.00 1.74 0.22 0.00 0.00 0.00 175.10 177.37 2o2r h TYR 515 N 8.67 0.51 -0.25 5.22 3.20 -1.39 0.15 116.97 133.08 2o2r h TYR 515 Ca -0.46 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.37 2o2r h TYR 515 Cb 1.22 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.36 2o2r h TYR 515 CO 0.80 0.09 -0.15 1.79 -1.64 0.00 0.00 178.16 179.05 2o2r h THR 516 N 0.46 1.23 -0.16 1.81 1.35 -1.90 -1.34 112.91 114.36 2o2r h THR 516 Ca 0.39 -1.01 -0.08 0.00 -0.55 0.00 0.00 66.41 65.15 2o2r h THR 516 Cb 0.55 1.20 -0.00 0.00 -1.73 0.00 0.00 68.15 68.17 2o2r h THR 516 CO -0.37 0.32 -0.23 0.25 -0.25 0.00 0.00 175.52 175.24 2o2r h LEU 517 N 0.39 0.47 -1.30 3.87 5.85 -1.46 -2.98 115.31 120.16 2o2r h LEU 517 Ca 0.07 -0.52 0.06 0.00 0.84 0.00 0.00 57.88 58.33 2o2r h LEU 517 Cb 0.49 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 2o2r h LEU 517 CO 0.03 0.90 0.51 0.00 -0.34 0.00 0.00 178.44 179.55 2o2r h ALA 518 N 0.58 1.62 -0.37 1.25 0.00 -0.50 0.37 119.26 122.22 2o2r h ALA 518 Ca 0.02 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2o2r h ALA 518 Cb 0.80 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2o2r h ALA 518 CO 0.05 0.27 -0.00 1.25 0.00 0.00 0.00 179.25 180.82 2o2r h LEU 519 N 0.87 0.64 0.06 0.00 5.85 -1.28 0.25 115.31 121.71 2o2r h LEU 519 Ca 0.33 -0.31 -0.20 0.00 0.84 0.00 0.00 57.88 58.54 2o2r h LEU 519 Cb 0.20 -0.17 0.02 0.00 0.37 0.00 0.00 40.66 41.07 2o2r h LEU 519 CO -0.11 0.80 -0.83 0.50 -0.34 0.00 0.00 178.44 178.46 2o2r h LYS 520 N 0.47 0.45 0.00 1.25 3.64 -1.24 -1.52 116.57 119.63 2o2r h LYS 520 Ca 0.10 -0.57 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2o2r h LYS 520 Cb 0.47 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.47 2o2r h LYS 520 CO 0.02 1.22 0.00 2.41 -2.27 0.00 0.00 179.45 180.83 2o2r n THR 521 N -4.07 0.00 -0.31 1.00 -1.04 0.13 -3.37 114.28 106.62 2o2r n THR 521 Ca -0.12 0.28 0.14 0.00 -2.04 0.00 0.00 64.05 62.31 2o2r n THR 521 Cb 0.79 -1.27 0.32 0.00 -1.82 0.00 0.00 70.33 68.35 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 0.61 0.00 -1.42 3.86 -1.57 -0.57 115.15 116.07 2o2r h HIS 522 Ca 0.00 0.04 -0.44 0.00 -1.16 0.00 0.00 60.37 58.81 2o2r h HIS 522 Cb 0.00 -0.13 -0.07 0.00 1.06 0.00 0.00 27.41 28.28 2o2r h HIS 522 CO 0.00 -0.09 -2.48 0.28 0.86 0.00 0.00 177.93 176.50 2o2r n VAL 523 N -5.08 1.46 -0.30 2.45 0.31 0.85 -3.69 118.33 114.32 2o2r n VAL 523 Ca 0.23 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 64.17 2o2r n VAL 523 Cb 0.68 -1.81 0.14 0.00 -0.91 0.00 0.00 33.84 31.94 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 -0.62 1.27 1.94 2.92 0.00 -1.20 -1.70 103.07 105.68 2o2r h GLY 524 Ca -0.66 -0.38 -0.14 0.00 0.00 0.00 0.00 47.33 46.14 2o2r h GLY 524 CO -0.37 0.26 -0.67 1.98 0.00 0.00 0.00 176.54 177.74 2o2r h MET 525 N 0.96 0.06 -0.89 4.80 4.05 -1.11 -2.65 114.93 120.15 2o2r h MET 525 Ca 0.37 -0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.73 2o2r h MET 525 Cb 0.16 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.93 2o2r h MET 525 CO -0.17 0.70 0.52 0.77 0.23 0.00 0.00 176.91 178.96 2o2r h SER 526 N 0.04 1.07 -0.11 1.39 0.02 -1.50 0.08 113.55 114.54 2o2r h SER 526 Ca -0.01 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 2o2r h SER 526 Cb 1.18 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 63.45 2o2r h SER 526 CO 0.09 0.84 -0.01 0.40 -1.14 0.00 0.00 176.83 177.00 2o2r h ILE 527 N 1.23 1.27 -0.97 3.27 2.04 -1.22 -2.67 117.51 120.46 2o2r h ILE 527 Ca 0.32 -0.88 0.09 0.00 1.00 0.00 0.00 64.86 65.38 2o2r h ILE 527 Cb -0.03 1.63 -0.07 0.00 -0.74 0.00 0.00 36.82 37.62 2o2r h ILE 527 CO -0.06 0.25 0.62 1.56 0.00 0.00 0.00 178.15 180.53 2o2r h GLN 528 N -0.09 1.01 -0.15 2.37 4.20 -1.34 -2.17 115.11 118.94 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 0.40 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 2o2r h GLN 528 CO 0.01 0.67 0.06 1.15 -0.67 0.00 0.00 178.83 180.05 2o2r h THR 529 N 1.04 1.15 -0.52 -0.54 2.02 -0.78 -0.18 112.91 115.10 2o2r h THR 529 Ca 0.44 -0.45 -0.10 0.00 0.77 0.00 0.00 66.41 67.07 2o2r h THR 529 Cb 0.32 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 2o2r h THR 529 CO -0.19 0.14 -0.07 -0.26 0.37 0.00 0.00 175.52 175.51 2o2r h PHE 530 N 0.09 1.04 -0.35 3.16 -1.00 -1.34 -1.75 116.94 116.79 2o2r h PHE 530 Ca 0.05 -0.19 -0.12 0.00 2.81 0.00 0.00 57.97 60.52 2o2r h PHE 530 Cb 0.17 -0.27 -0.01 0.00 3.61 0.00 0.00 35.95 39.45 2o2r h PHE 530 CO -0.02 0.96 -0.27 0.00 -1.61 0.00 0.00 178.31 177.37 2o2r h ARG 531 N 0.85 0.73 0.46 1.51 3.08 -1.28 -0.62 114.38 119.11 2o2r h ARG 531 Ca 0.14 -0.32 -0.02 0.00 0.07 0.00 0.00 59.98 59.86 2o2r h ARG 531 Cb 0.60 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2o2r h ARG 531 CO 0.04 0.92 -0.22 -0.92 -1.07 0.00 0.00 179.97 178.72 2o2r h TYR 532 N 0.63 -0.57 -0.06 3.04 3.20 -0.86 -3.04 116.97 119.31 2o2r h TYR 532 Ca 0.08 -0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.85 2o2r h TYR 532 Cb 0.78 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 2o2r h TYR 532 CO 0.04 -0.28 -0.38 0.74 -1.64 0.00 0.00 178.16 176.64 2o2r h PHE 533 N -0.77 0.13 -0.92 -3.82 0.04 -1.35 -2.35 116.94 107.91 2o2r h PHE 533 Ca -0.06 -0.03 0.16 0.00 2.80 0.00 0.00 57.97 60.83 2o2r h PHE 533 Cb 0.54 -0.03 -0.08 0.00 2.20 0.00 0.00 35.95 38.59 2o2r h PHE 533 CO -0.01 0.48 0.59 0.00 -0.60 0.00 0.00 178.31 178.77 2o2r h ALA 534 N 1.52 1.85 0.00 2.45 0.00 -1.11 -1.04 119.26 122.92 2o2r h ALA 534 Ca 0.01 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2o2r h ALA 534 Cb 0.72 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 2o2r h ALA 534 CO 0.05 -0.11 -0.20 0.78 0.00 0.00 0.00 179.25 179.78 2o2r h GLY 535 N 0.68 0.00 2.00 0.00 0.00 -1.30 -3.19 103.07 101.26 2o2r h GLY 535 Ca 0.47 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.70 2o2r h GLY 535 CO -0.23 0.00 -0.48 1.49 0.00 0.00 0.00 176.54 177.32 2o2r h TRP 536 N 0.00 0.00 -0.40 5.60 4.06 -1.20 -3.39 115.95 120.62 2o2r h TRP 536 Ca -0.00 0.00 0.08 0.00 2.06 0.00 0.00 58.89 61.03 2o2r h TRP 536 Cb 0.55 0.00 -0.09 0.00 -1.00 0.00 0.00 29.16 28.62 2o2r h TRP 536 CO 0.00 0.48 -0.19 0.00 -3.56 0.00 0.00 178.44 175.18 2o2r n ASP 538 N -5.37 3.16 0.00 0.00 5.75 -1.26 -3.74 116.55 115.09 2o2r n ASP 538 Ca 0.02 -2.25 0.00 0.00 -0.01 0.00 0.00 54.79 52.56 2o2r n ASP 538 Cb 0.28 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.93 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 0.69 1.85 -2.64 0.11 5.02 -0.11 -4.97 118.16 118.11 2o2r n LYS 539 Ca 0.17 -1.20 -0.43 0.00 -2.02 0.00 0.00 58.31 54.82 2o2r n LYS 539 Cb 0.59 -0.99 -0.02 0.00 -0.02 0.00 0.00 35.03 34.59 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 4.61 0.02 -0.18 1.01 -0.91 -5.02 121.20 120.03 2o2r s ILE 540 Ca 0.00 1.93 0.03 0.00 0.00 0.00 0.00 60.65 62.61 2o2r s ILE 540 Cb 0.00 -4.31 -0.02 0.00 0.01 0.00 0.00 42.46 38.14 2o2r s ILE 540 CO 0.00 -0.25 -0.09 -1.10 0.00 0.00 0.00 174.94 173.50 2o2r s GLN 541 N 3.33 0.64 0.00 2.79 -0.21 -1.26 -4.95 119.66 120.00 2o2r s GLN 541 Ca 0.45 -0.55 0.00 0.00 0.02 0.00 0.00 55.36 55.28 2o2r s GLN 541 Cb -0.15 -0.56 0.00 0.00 1.00 0.00 0.00 33.01 33.30 2o2r s GLN 541 CO 0.09 0.14 0.00 0.41 -2.12 0.00 0.00 175.29 173.81 2o2r n GLY 542 N 2.16 1.50 3.30 3.09 0.00 -1.26 -4.85 105.19 109.13 2o2r n GLY 542 Ca -0.18 -1.93 -0.16 0.00 0.00 0.00 0.00 46.02 43.75 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 -2.57 1.71 -0.05 4.61 0.00 -1.18 -4.93 121.76 119.34 2o2r s ALA 543 Ca 0.00 -1.60 0.05 0.00 0.00 0.00 0.00 51.96 50.41 2o2r s ALA 543 Cb 0.00 0.09 -0.02 0.00 0.00 0.00 0.00 23.12 23.19 2o2r s ALA 543 CO 0.00 -0.07 -0.20 0.95 0.00 0.00 0.00 175.76 176.44 2o2r s THR 544 N -3.23 2.58 -0.06 0.00 -4.23 -1.26 -0.58 115.64 108.86 2o2r s THR 544 Ca 0.21 -0.89 0.03 0.00 -1.18 0.00 0.00 61.69 59.85 2o2r s THR 544 Cb 0.02 -1.98 0.01 0.00 1.34 0.00 0.00 72.50 71.90 2o2r s THR 544 CO 0.04 0.58 -0.13 -0.63 -0.54 0.00 0.00 174.62 173.94 2o2r s ILE 545 N -0.48 1.21 -1.46 2.99 1.01 -0.23 -4.99 121.20 119.25 2o2r s ILE 545 Ca 0.06 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 60.04 2o2r s ILE 545 Cb -0.12 -1.09 0.04 0.00 0.01 0.00 0.00 42.46 41.30 2o2r s ILE 545 CO 0.01 0.37 2.24 -0.81 0.00 0.00 0.00 174.94 176.75 2o2r n PRO 546 N 3.72 2.94 -1.33 2.79 -0.04 -1.26 -4.23 135.00 137.59 2o2r n PRO 546 Ca -0.22 -2.64 -0.30 0.00 -0.04 0.00 0.00 63.50 60.30 2o2r n PRO 546 Cb 0.52 -3.25 0.10 0.00 -0.04 0.00 0.00 33.50 30.84 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 2.98 3.14 0.44 0.52 -0.00 -1.26 -5.00 121.20 122.01 2o2r s ILE 547 Ca 0.48 0.37 -0.25 0.00 -0.00 0.00 0.00 60.65 61.24 2o2r s ILE 547 Cb 0.14 -2.93 -0.08 0.00 -0.00 0.00 0.00 42.46 39.59 2o2r s ILE 547 CO -0.08 -0.48 1.38 0.20 -0.00 0.00 0.00 174.94 175.95 2o2r s ASN 548 N -3.54 6.01 -0.17 4.36 -0.87 -1.26 -4.98 114.94 114.48 2o2r s ASN 548 Ca 0.61 2.81 -0.09 0.00 -1.57 0.00 0.00 52.86 54.63 2o2r s ASN 548 Cb -0.17 -2.65 -0.05 0.00 -0.02 0.00 0.00 41.25 38.37 2o2r s ASN 548 CO 0.56 -1.07 0.12 -1.10 -2.57 0.00 0.00 177.10 173.03 2o2r s GLN 549 N -2.40 3.94 -1.45 -0.60 -1.52 -1.26 -4.86 119.66 111.51 2o2r s GLN 549 Ca 0.60 -0.23 -0.14 0.00 -1.95 0.00 0.00 55.36 53.64 2o2r s GLN 549 Cb -0.41 -3.31 0.02 0.00 -0.22 0.00 0.00 33.01 29.09 2o2r s GLN 549 CO 0.53 0.42 2.27 0.00 -0.25 0.00 0.00 175.29 178.26 2o2r n ALA 550 N 3.12 5.60 -1.67 6.09 0.00 -1.26 -4.95 120.51 127.44 2o2r n ALA 550 Ca -0.17 -3.83 -0.43 0.00 0.00 0.00 0.00 53.44 49.00 2o2r n ALA 550 Cb 0.53 -3.53 -0.01 0.00 0.00 0.00 0.00 19.45 16.44 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 5.96 1.96 -0.01 0.00 5.12 -1.26 -1.02 116.66 127.42 2o2r n ARG 551 Ca 0.54 0.69 0.14 0.00 -1.93 0.00 0.00 57.85 57.28 2o2r n ARG 551 Cb 0.38 -2.23 0.73 0.00 -1.16 0.00 0.00 32.46 30.19 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 0.64 1.19 -2.03 5.56 -0.04 -1.26 -5.07 135.00 133.99 2o2r n PRO 552 Ca 0.06 -0.28 -0.29 0.00 -0.04 0.00 0.00 63.50 62.96 2o2r n PRO 552 Cb 0.35 -1.44 0.16 0.00 -0.04 0.00 0.00 33.50 32.53 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 -1.87 3.52 0.27 3.54 0.01 -0.19 -5.11 114.94 115.12 2o2r s ASN 553 Ca 0.40 0.25 0.11 0.00 -0.71 0.00 0.00 52.86 52.92 2o2r s ASN 553 Cb 0.19 -0.42 -0.05 0.00 0.41 0.00 0.00 41.25 41.38 2o2r s ASN 553 CO 0.32 -2.47 -0.18 -0.13 -1.51 0.00 0.00 177.10 173.13 2o2r s ARG 554 N -5.72 1.63 0.00 -0.60 0.52 0.43 -4.02 118.95 111.19 2o2r s ARG 554 Ca 0.71 -1.75 0.02 0.00 -0.52 0.00 0.00 55.73 54.19 2o2r s ARG 554 Cb -0.05 -1.65 -0.01 0.00 0.52 0.00 0.00 34.95 33.76 2o2r s ARG 554 CO 0.51 0.29 -0.07 -0.80 0.02 0.00 0.00 175.30 175.25 2o2r s ASN 555 N -3.48 0.82 -0.05 0.23 -0.87 -1.26 -0.85 114.94 109.48 2o2r s ASN 555 Ca 0.29 -0.20 0.05 0.00 -1.57 0.00 0.00 52.86 51.43 2o2r s ASN 555 Cb -0.04 -0.07 -0.01 0.00 -0.02 0.00 0.00 41.25 41.12 2o2r s ASN 555 CO 0.14 0.04 -0.21 -0.22 -2.57 0.00 0.00 177.10 174.28 2o2r s LEU 556 N -0.41 1.99 -0.05 0.60 2.96 -0.85 -4.91 118.68 118.01 2o2r s LEU 556 Ca 0.01 -0.42 0.02 0.00 -0.22 0.00 0.00 54.13 53.52 2o2r s LEU 556 Cb -0.04 -1.14 0.01 0.00 0.50 0.00 0.00 46.19 45.53 2o2r s LEU 556 CO -0.00 0.20 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.24 2o2r s THR 557 N -0.10 0.93 0.13 3.68 2.01 -1.26 -0.11 115.64 120.92 2o2r s THR 557 Ca -0.02 -0.39 0.01 0.00 0.31 0.00 0.00 61.69 61.60 2o2r s THR 557 Cb -0.12 -0.86 -0.04 0.00 0.01 0.00 0.00 72.50 71.49 2o2r s THR 557 CO 0.02 0.30 -0.02 -1.48 -0.69 0.00 0.00 174.62 172.75 2o2r s LEU 558 N 0.55 2.28 0.05 4.42 0.05 -0.18 -1.06 118.68 124.78 2o2r s LEU 558 Ca -0.10 -1.09 0.08 0.00 0.05 0.00 0.00 54.13 53.07 2o2r s LEU 558 Cb -0.13 0.00 -0.03 0.00 -2.05 0.00 0.00 46.19 43.98 2o2r s LEU 558 CO 0.02 -0.55 -0.23 0.42 -0.55 0.00 0.00 176.35 175.46 2o2r s THR 559 N -3.71 2.42 -0.11 5.48 -4.23 0.25 -0.03 115.64 115.71 2o2r s THR 559 Ca 0.17 -1.32 0.00 0.00 -1.18 0.00 0.00 61.69 59.36 2o2r s THR 559 Cb 0.06 -1.98 -0.02 0.00 1.34 0.00 0.00 72.50 71.90 2o2r s THR 559 CO -0.01 0.34 -0.12 -0.75 -0.54 0.00 0.00 174.62 173.54 2o2r s LYS 560 N -1.36 3.21 -0.22 3.99 2.36 0.78 -3.11 119.74 125.39 2o2r s LYS 560 Ca 0.13 -0.66 -0.21 0.00 -2.55 0.00 0.00 55.97 52.67 2o2r s LYS 560 Cb -0.10 -2.61 -0.02 0.00 -1.05 0.00 0.00 37.83 34.05 2o2r s LYS 560 CO 0.04 0.32 0.67 0.15 1.55 0.00 0.00 175.35 178.08 2o2r s LYS 561 N 0.07 4.18 0.17 4.03 -0.14 -1.26 -0.87 119.74 125.91 2o2r s LYS 561 Ca -0.05 0.67 0.08 0.00 -1.36 0.00 0.00 55.97 55.31 2o2r s LYS 561 Cb -0.14 -3.61 -0.04 0.00 -1.68 0.00 0.00 37.83 32.35 2o2r s LYS 561 CO 0.04 -0.35 -0.18 -1.21 -0.76 0.00 0.00 175.35 172.89 2o2r s GLU 562 N 2.29 1.27 0.77 1.68 2.02 0.38 -4.95 118.70 122.16 2o2r s GLU 562 Ca 0.29 -1.42 -0.13 0.00 0.02 0.00 0.00 54.97 53.73 2o2r s GLU 562 Cb -0.16 -1.30 0.06 0.00 0.10 0.00 0.00 34.13 32.83 2o2r s GLU 562 CO 0.09 0.26 1.17 -2.14 0.02 0.00 0.00 175.26 174.66 2o2r s PRO 563 N -2.86 1.94 0.20 0.39 0.02 -1.26 -0.51 135.00 132.93 2o2r s PRO 563 Ca 0.16 1.60 0.12 0.00 0.02 0.00 0.00 61.00 62.90 2o2r s PRO 563 Cb -0.05 -1.83 -0.06 0.00 0.02 0.00 0.00 34.50 32.58 2o2r s PRO 563 CO 0.07 -1.95 1.32 -0.39 -0.33 0.00 0.00 177.00 175.71 2o2r h VAL 564 N -0.76 1.14 0.00 3.83 -1.51 -1.86 -3.41 116.25 113.68 2o2r h VAL 564 Ca -0.46 -2.65 0.00 0.00 -1.23 0.00 0.00 66.70 62.36 2o2r h VAL 564 Cb 1.28 2.55 0.00 0.00 -2.13 0.00 0.00 31.29 32.98 2o2r h VAL 564 CO 0.48 0.65 0.00 0.61 -1.23 0.00 0.00 177.57 178.08 2o2r n GLY 565 N 1.29 0.24 3.69 5.19 0.00 -1.26 -4.84 105.19 109.49 2o2r n GLY 565 Ca -0.00 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 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 0.00 4.82 0.07 1.61 1.01 -1.26 -2.86 120.40 123.79 2o2r s VAL 566 Ca 0.00 1.91 0.07 0.00 0.00 0.00 0.00 61.98 63.96 2o2r s VAL 566 Cb 0.00 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2o2r s VAL 566 CO 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 175.10 174.98 2o2r s GLY 568 N -1.80 1.78 -0.21 0.00 0.00 0.05 -1.18 107.32 105.97 2o2r s GLY 568 Ca 0.17 -0.80 -0.02 0.00 0.00 0.00 0.00 44.72 44.07 2o2r s GLY 568 CO 0.09 -0.11 -0.10 -0.42 0.00 0.00 0.00 173.10 172.56 2o2r s ILE 569 N 0.18 2.90 -0.21 0.90 1.01 0.11 -0.82 121.20 125.27 2o2r s ILE 569 Ca -0.00 -0.67 -0.00 0.00 0.00 0.00 0.00 60.65 59.98 2o2r s ILE 569 Cb -0.13 -2.30 0.02 0.00 0.01 0.00 0.00 42.46 40.05 2o2r s ILE 569 CO 0.02 0.45 -0.13 -0.69 0.00 0.00 0.00 174.94 174.59 2o2r s VAL 570 N 1.41 2.51 0.25 2.92 1.01 -0.24 -0.05 120.40 128.21 2o2r s VAL 570 Ca 0.05 -0.93 0.09 0.00 0.00 0.00 0.00 61.98 61.19 2o2r s VAL 570 Cb -0.14 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2o2r s VAL 570 CO -0.07 0.39 -0.14 0.27 0.00 0.00 0.00 175.10 175.56 2o2r s ILE 571 N 1.32 1.95 0.34 2.22 -4.36 -0.98 -2.08 121.20 119.62 2o2r s ILE 571 Ca 0.03 -2.25 0.01 0.00 -0.26 0.00 0.00 60.65 58.18 2o2r s ILE 571 Cb -0.15 -2.24 0.07 0.00 1.25 0.00 0.00 42.46 41.39 2o2r s ILE 571 CO -0.08 -0.45 0.47 -0.81 0.24 0.00 0.00 174.94 174.30 2o2r n PRO 572 N -0.52 0.34 0.00 0.37 -0.04 -1.22 -2.71 135.00 131.22 2o2r n PRO 572 Ca -0.06 -1.34 0.11 0.00 -0.04 0.00 0.00 63.50 62.16 2o2r n PRO 572 Cb 0.61 -0.29 -0.03 0.00 -0.04 0.00 0.00 33.50 33.75 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 -2.03 0.00 -0.10 0.54 4.27 -1.26 -4.39 117.44 114.48 2o2r n TRP 573 Ca 0.08 0.00 -0.14 0.00 -3.89 0.00 0.00 57.50 53.55 2o2r n TRP 573 Cb 0.29 0.00 -0.03 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 1.91 1.00 -2.53 -0.67 -1.07 -1.97 -3.35 115.58 108.89 2o2r h ASN 574 Ca 0.00 -0.49 -0.60 0.00 0.07 0.00 0.00 56.30 55.28 2o2r h ASN 574 Cb 0.69 -0.28 -0.40 0.00 -2.07 0.00 0.00 38.32 36.26 2o2r h ASN 574 CO 0.00 1.29 -0.84 -1.22 0.07 0.00 0.00 177.43 176.73 2o2r n TYR 575 N -4.03 0.75 0.09 4.14 4.02 -1.26 -4.99 117.16 115.87 2o2r n TYR 575 Ca -0.03 -3.70 -0.12 0.00 -0.01 0.00 0.00 57.90 54.03 2o2r n TYR 575 Cb 0.58 -0.14 -0.05 0.00 -0.02 0.00 0.00 39.34 39.71 2o2r n TYR 575 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 2o2r h PRO 576 N 5.26 -0.29 -0.41 -0.72 0.11 -1.79 -0.70 132.00 133.46 2o2r h PRO 576 Ca 0.21 0.02 -0.13 0.00 0.11 0.00 0.00 66.00 66.20 2o2r h PRO 576 Cb 0.84 0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 2o2r h PRO 576 CO 0.52 -0.20 -0.27 1.25 -0.21 0.00 0.00 178.00 179.09 2o2r h LEU 577 N -0.30 0.90 -0.10 2.35 5.85 -1.93 -2.76 115.31 119.32 2o2r h LEU 577 Ca 0.03 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.35 2o2r h LEU 577 Cb 0.33 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 2o2r h LEU 577 CO -0.11 1.11 -0.11 -0.03 -0.34 0.00 0.00 178.44 178.96 2o2r h MET 578 N 0.74 0.25 -0.94 1.25 4.05 -1.55 -0.25 114.93 118.48 2o2r h MET 578 Ca 0.09 -0.14 0.02 0.00 -0.28 0.00 0.00 59.70 59.39 2o2r h MET 578 Cb 0.83 0.01 -0.05 0.00 -0.80 0.00 0.00 31.60 31.59 2o2r h MET 578 CO 0.07 0.68 0.62 0.52 0.23 0.00 0.00 176.91 179.03 2o2r h MET 579 N -0.17 1.21 -0.10 0.39 2.86 -1.24 -0.11 114.93 117.77 2o2r h MET 579 Ca 0.01 -0.07 0.00 0.00 -2.06 0.00 0.00 59.70 57.58 2o2r h MET 579 Cb 0.64 -0.27 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 2o2r h MET 579 CO 0.03 0.80 0.07 1.25 1.06 0.00 0.00 176.91 180.11 2o2r h LEU 580 N 1.24 0.12 -0.39 1.22 6.46 -1.34 -3.20 115.31 119.42 2o2r h LEU 580 Ca 0.35 -0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 58.05 2o2r h LEU 580 Cb -0.10 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 39.78 2o2r h LEU 580 CO -0.09 0.11 0.12 0.28 -0.62 0.00 0.00 178.44 178.25 2o2r h SER 581 N 0.12 0.57 -0.40 1.25 0.02 -0.42 -0.54 113.55 114.16 2o2r h SER 581 Ca 0.04 -0.21 0.08 0.00 -0.84 0.00 0.00 61.79 60.86 2o2r h SER 581 Cb 0.01 -0.15 -0.09 0.00 0.14 0.00 0.00 62.40 62.31 2o2r h SER 581 CO -0.01 0.63 -0.26 -0.50 -1.14 0.00 0.00 176.83 175.55 2o2r h TRP 582 N 0.49 -0.70 0.18 3.45 4.06 -1.07 0.30 115.95 122.67 2o2r h TRP 582 Ca 0.13 0.05 -0.29 0.00 2.06 0.00 0.00 58.89 60.84 2o2r h TRP 582 Cb 0.26 0.37 0.03 0.00 -1.00 0.00 0.00 29.16 28.82 2o2r h TRP 582 CO 0.01 -0.34 -1.25 0.87 -3.56 0.00 0.00 178.44 174.18 2o2r h LYS 583 N -0.19 0.53 -0.48 0.49 1.57 -1.54 -3.22 116.57 113.74 2o2r h LYS 583 Ca 0.19 -0.81 -0.12 0.00 -1.87 0.00 0.00 60.65 58.04 2o2r h LYS 583 Cb 0.49 0.29 -0.02 0.00 0.08 0.00 0.00 32.23 33.07 2o2r h LYS 583 CO -0.52 1.38 -0.16 1.15 -0.57 0.00 0.00 179.45 180.73 2o2r h THR 584 N 0.09 1.27 -0.38 -0.16 2.02 -0.97 -0.65 112.91 114.13 2o2r h THR 584 Ca -0.21 -1.30 -0.02 0.00 0.77 0.00 0.00 66.41 65.65 2o2r h THR 584 Cb 1.96 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 69.42 2o2r h THR 584 CO 0.24 0.45 0.15 0.00 0.37 0.00 0.00 175.52 176.72 2o2r h ALA 585 N 1.00 0.49 -0.32 6.16 0.00 -1.04 -0.59 119.26 124.97 2o2r h ALA 585 Ca 0.12 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 2o2r h ALA 585 Cb 0.70 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 2o2r h ALA 585 CO 0.05 0.10 -0.23 0.00 0.00 0.00 0.00 179.25 179.18 2o2r h ALA 586 N 0.99 0.45 -0.17 0.00 0.00 -1.54 -1.23 119.26 117.76 2o2r h ALA 586 Ca 0.13 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.68 2o2r h ALA 586 Cb 0.20 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2o2r h ALA 586 CO -0.01 0.43 0.03 0.00 0.00 0.00 0.00 179.25 179.70 2o2r h LEU 588 N 0.10 0.83 -1.86 0.00 3.38 -1.09 -2.82 115.31 113.85 2o2r h LEU 588 Ca 0.08 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2o2r h LEU 588 Cb 0.07 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 2o2r h LEU 588 CO -0.11 1.19 0.09 0.00 0.09 0.00 0.00 178.44 179.70 2o2r h ALA 589 N 0.84 1.90 -0.00 1.53 0.00 -1.09 0.56 119.26 122.99 2o2r h ALA 589 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2o2r h ALA 589 Cb 1.08 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2o2r h ALA 589 CO 0.11 0.09 -0.01 0.00 0.00 0.00 0.00 179.25 179.44 2o2r n ALA 590 N -2.52 2.56 -0.22 0.00 0.00 -0.95 -4.45 120.51 114.93 2o2r n ALA 590 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.26 2o2r n ALA 590 Cb 0.08 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.04 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 1.20 0.88 3.94 0.00 0.00 0.19 -4.03 105.19 107.37 2o2r n GLY 591 Ca 0.17 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.03 4.52 0.35 1.61 0.01 -1.07 -4.86 114.94 113.46 2o2r s ASN 592 Ca 0.00 0.27 0.09 0.00 -0.71 0.00 0.00 52.86 52.51 2o2r s ASN 592 Cb 0.00 -0.80 -0.06 0.00 0.41 0.00 0.00 41.25 40.80 2o2r s ASN 592 CO 0.00 -1.78 -0.05 0.42 -1.51 0.00 0.00 177.10 174.18 2o2r s THR 593 N -3.30 2.34 -0.06 1.60 -4.23 -1.13 -4.53 115.64 106.33 2o2r s THR 593 Ca 0.63 -2.11 -0.06 0.00 -1.18 0.00 0.00 61.69 58.97 2o2r s THR 593 Cb -0.09 -2.73 0.02 0.00 1.34 0.00 0.00 72.50 71.04 2o2r s THR 593 CO 0.45 -0.18 0.17 0.54 -0.54 0.00 0.00 174.62 175.06 2o2r s VAL 594 N -2.59 0.01 -0.20 2.29 0.11 0.61 -1.40 120.40 119.22 2o2r s VAL 594 Ca 0.34 -0.05 -0.03 0.00 -2.93 0.00 0.00 61.98 59.31 2o2r s VAL 594 Cb 0.02 -0.26 -0.00 0.00 -1.53 0.00 0.00 36.38 34.61 2o2r s VAL 594 CO 0.18 -0.03 -0.08 -0.69 -3.33 0.00 0.00 175.10 171.15 2o2r s VAL 595 N -0.01 3.11 -0.18 2.04 1.01 -0.32 -1.70 120.40 124.35 2o2r s VAL 595 Ca -0.01 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.33 2o2r s VAL 595 Cb -0.02 -2.39 -0.03 0.00 0.00 0.00 0.00 36.38 33.94 2o2r s VAL 595 CO 0.00 0.45 0.01 -0.63 0.00 0.00 0.00 175.10 174.93 2o2r s ILE 596 N 1.33 4.20 -0.45 2.22 1.01 0.54 -0.71 121.20 129.34 2o2r s ILE 596 Ca 0.04 -0.24 -0.07 0.00 0.00 0.00 0.00 60.65 60.38 2o2r s ILE 596 Cb -0.14 -2.87 0.11 0.00 0.01 0.00 0.00 42.46 39.57 2o2r s ILE 596 CO -0.04 0.46 0.29 -0.75 0.00 0.00 0.00 174.94 174.90 2o2r s LYS 597 N 0.54 2.33 0.72 2.79 2.36 0.92 -0.75 119.74 128.65 2o2r s LYS 597 Ca -0.00 -1.76 -0.11 0.00 -2.55 0.00 0.00 55.97 51.55 2o2r s LYS 597 Cb -0.14 -3.80 0.02 0.00 -1.05 0.00 0.00 37.83 32.86 2o2r s LYS 597 CO 0.02 -1.13 1.07 -1.25 1.55 0.00 0.00 175.35 175.60 2o2r s PRO 598 N 1.29 2.76 0.34 4.03 0.04 -1.26 -2.31 135.00 139.89 2o2r s PRO 598 Ca 0.06 1.01 -0.28 0.00 0.04 0.00 0.00 61.00 61.83 2o2r s PRO 598 Cb -0.25 -1.97 -0.12 0.00 0.04 0.00 0.00 34.50 32.21 2o2r s PRO 598 CO -0.02 -1.24 1.36 0.00 0.04 0.00 0.00 177.00 177.15 2o2r n ALA 599 N -3.23 1.63 -0.32 8.56 0.00 -1.10 -4.54 120.51 121.51 2o2r n ALA 599 Ca 0.08 0.36 0.08 0.00 0.00 0.00 0.00 53.44 53.96 2o2r n ALA 599 Cb 0.53 -2.31 0.24 0.00 0.00 0.00 0.00 19.45 17.92 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 2.87 0.74 0.00 0.00 4.15 -1.90 -2.01 115.11 118.96 2o2r h GLN 600 Ca -0.47 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 58.90 2o2r h GLN 600 Cb 1.27 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.79 2o2r h GLN 600 CO 0.65 0.49 0.00 -0.39 -1.93 0.00 0.00 178.83 177.65 2o2r h VAL 601 N 0.76 0.00 -2.06 2.39 -1.51 -1.91 -3.36 116.25 110.56 2o2r h VAL 601 Ca 0.49 -0.30 -0.55 0.00 -1.23 0.00 0.00 66.70 65.11 2o2r h VAL 601 Cb 0.63 1.10 -0.40 0.00 -2.13 0.00 0.00 31.29 30.49 2o2r h VAL 601 CO -0.33 0.00 -0.99 0.35 -1.23 0.00 0.00 177.57 175.37 2o2r n THR 602 N -2.45 0.30 0.80 7.19 -2.24 -0.75 -4.66 114.28 112.46 2o2r n THR 602 Ca 0.02 -4.49 0.12 0.00 -2.27 0.00 0.00 64.05 57.43 2o2r n THR 602 Cb 0.25 -1.58 0.21 0.00 -2.10 0.00 0.00 70.33 67.11 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 0.93 0.13 0.05 -0.78 -0.04 -1.25 -4.50 135.00 129.55 2o2r n PRO 603 Ca 0.24 0.03 -0.20 0.00 -0.04 0.00 0.00 63.50 63.53 2o2r n PRO 603 Cb 0.52 -1.58 -0.11 0.00 -0.04 0.00 0.00 33.50 32.30 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 0.00 0.91 -0.98 1.53 3.38 -1.92 -2.50 115.31 115.74 2o2r h LEU 604 Ca 0.00 -0.74 -0.10 0.00 0.09 0.00 0.00 57.88 57.13 2o2r h LEU 604 Cb 0.61 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2o2r h LEU 604 CO 0.00 1.54 -0.41 0.71 0.09 0.00 0.00 178.44 180.37 2o2r h THR 605 N 0.39 1.31 -0.74 0.22 1.35 -1.88 -1.91 112.91 111.64 2o2r h THR 605 Ca -0.13 -1.51 -0.01 0.00 -0.55 0.00 0.00 66.41 64.20 2o2r h THR 605 Cb 1.72 1.70 -0.03 0.00 -1.73 0.00 0.00 68.15 69.80 2o2r h THR 605 CO 0.21 0.45 0.41 0.00 -0.25 0.00 0.00 175.52 176.34 2o2r h ALA 606 N 1.41 0.95 -0.16 6.62 0.00 -1.82 0.24 119.26 126.49 2o2r h ALA 606 Ca 0.01 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 2o2r h ALA 606 Cb 0.81 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2o2r h ALA 606 CO 0.06 0.46 -0.59 -0.07 0.00 0.00 0.00 179.25 179.11 2o2r h LEU 607 N 1.02 0.58 -0.36 0.00 3.38 -1.28 -0.13 115.31 118.52 2o2r h LEU 607 Ca 0.26 -0.32 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 2o2r h LEU 607 Cb 0.03 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2o2r h LEU 607 CO -0.04 1.04 -0.15 0.50 0.09 0.00 0.00 178.44 179.87 2o2r h LYS 608 N 0.39 0.73 -0.71 1.13 1.63 -1.17 -2.60 116.57 115.98 2o2r h LYS 608 Ca -0.00 -0.31 0.13 0.00 -0.85 0.00 0.00 60.65 59.62 2o2r h LYS 608 Cb 1.14 -0.03 -0.09 0.00 -0.60 0.00 0.00 32.23 32.65 2o2r h LYS 608 CO 0.11 0.92 0.25 0.35 -3.45 0.00 0.00 179.45 177.63 2o2r h PHE 609 N 0.52 0.43 -0.80 1.91 3.57 -0.36 -1.48 116.94 120.74 2o2r h PHE 609 Ca 0.08 0.04 0.10 0.00 3.53 0.00 0.00 57.97 61.71 2o2r h PHE 609 Cb 0.69 -0.08 -0.07 0.00 2.79 0.00 0.00 35.95 39.27 2o2r h PHE 609 CO 0.06 0.05 0.44 0.00 -2.23 0.00 0.00 178.31 176.63 2o2r h ALA 610 N 1.52 1.13 -0.38 2.41 0.00 -0.70 -0.73 119.26 122.51 2o2r h ALA 610 Ca 0.38 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.25 2o2r h ALA 610 Cb 0.56 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2o2r h ALA 610 CO -0.39 0.06 -0.10 1.49 0.00 0.00 0.00 179.25 180.30 2o2r h GLU 611 N 0.74 0.66 0.00 0.00 4.81 -0.96 -2.69 114.58 117.14 2o2r h GLU 611 Ca 0.39 -0.20 -0.07 0.00 -0.13 0.00 0.00 59.36 59.35 2o2r h GLU 611 Cb 0.37 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.68 2o2r h GLU 611 CO -0.26 0.74 -0.33 -0.07 -0.73 0.00 0.00 179.01 178.37 2o2r h LEU 612 N 0.60 0.00 -1.24 1.64 3.38 -0.19 -2.08 115.31 117.42 2o2r h LEU 612 Ca 0.11 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 2o2r h LEU 612 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2o2r h LEU 612 CO 0.03 0.33 -0.01 0.71 0.09 0.00 0.00 178.44 179.59 2o2r h THR 613 N 0.00 1.20 -0.09 0.22 1.35 -0.97 -1.13 112.91 113.49 2o2r h THR 613 Ca -0.00 -0.78 -0.00 0.00 -0.55 0.00 0.00 66.41 65.07 2o2r h THR 613 Cb 0.69 0.96 -0.00 0.00 -1.73 0.00 0.00 68.15 68.07 2o2r h THR 613 CO 0.04 0.27 0.04 -0.07 -0.25 0.00 0.00 175.52 175.55 2o2r h LEU 614 N 0.48 0.12 -1.63 3.87 3.38 -1.35 -1.12 115.31 119.07 2o2r h LEU 614 Ca 0.10 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2o2r h LEU 614 Cb 0.33 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 2o2r h LEU 614 CO 0.01 0.24 0.27 0.11 0.09 0.00 0.00 178.44 179.15 2o2r h LYS 615 N 0.01 0.49 0.00 1.13 1.57 -1.24 -2.56 116.57 115.97 2o2r h LYS 615 Ca 0.03 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2o2r h LYS 615 Cb 0.15 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2o2r h LYS 615 CO -0.00 0.33 -0.07 0.00 -0.57 0.00 0.00 179.45 179.14 2o2r n ALA 616 N -2.48 2.42 -0.82 3.86 0.00 -0.45 -4.95 120.51 118.10 2o2r n ALA 616 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2o2r n ALA 616 Cb 0.09 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.11 2o2r n ALA 616 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2o2r n GLY 617 N 1.43 0.58 3.68 0.00 0.00 -0.92 -4.70 105.19 105.24 2o2r n GLY 617 Ca 0.06 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.87 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 3.46 0.45 -0.61 -1.09 -0.47 -4.95 121.20 115.99 2o2r s ILE 618 Ca 0.00 0.81 -0.23 0.00 -2.23 0.00 0.00 60.65 59.00 2o2r s ILE 618 Cb 0.00 -3.52 -0.10 0.00 -1.58 0.00 0.00 42.46 37.26 2o2r s ILE 618 CO 0.00 -0.02 0.89 -2.65 -1.23 0.00 0.00 174.94 171.93 2o2r n PRO 619 N 5.86 1.09 -1.91 2.79 -0.02 -1.26 -4.72 135.00 136.83 2o2r n PRO 619 Ca 0.15 0.40 -0.41 0.00 -2.02 0.00 0.00 63.50 61.62 2o2r n PRO 619 Cb 0.42 -1.94 -0.01 0.00 -0.02 0.00 0.00 33.50 31.95 2o2r n PRO 619 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2o2r s LYS 620 N -2.04 4.19 0.00 -0.52 -0.14 -1.26 -2.49 119.74 117.48 2o2r s LYS 620 Ca 0.65 2.45 0.00 0.00 -1.36 0.00 0.00 55.97 57.71 2o2r s LYS 620 Cb -0.54 -3.01 0.00 0.00 -1.68 0.00 0.00 37.83 32.60 2o2r s LYS 620 CO 0.56 -0.43 0.00 0.41 -0.76 0.00 0.00 175.35 175.13 2o2r n GLY 621 N 0.75 1.88 0.19 -3.33 0.00 -1.26 -4.71 105.19 98.71 2o2r n GLY 621 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.90 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 1.31 -3.21 1.61 2.07 -1.76 -3.26 116.25 113.01 2o2r h VAL 622 Ca 0.00 -1.39 -0.67 0.00 0.82 0.00 0.00 66.70 65.46 2o2r h VAL 622 Cb 0.00 1.63 -0.33 0.00 -1.52 0.00 0.00 31.29 31.07 2o2r h VAL 622 CO 0.00 0.44 -0.85 -0.69 0.02 0.00 0.00 177.57 176.48 2o2r s VAL 623 N -4.38 2.21 -0.02 2.57 1.01 -1.26 -0.28 120.40 120.24 2o2r s VAL 623 Ca -0.13 -0.93 0.03 0.00 0.00 0.00 0.00 61.98 60.95 2o2r s VAL 623 Cb 0.08 -1.90 -0.00 0.00 0.00 0.00 0.00 36.38 34.56 2o2r s VAL 623 CO 0.81 0.54 -0.10 0.20 0.00 0.00 0.00 175.10 176.55 2o2r s ASN 624 N 0.86 1.26 -0.09 3.32 0.01 -0.69 -4.60 114.94 115.01 2o2r s ASN 624 Ca -0.05 -0.20 0.01 0.00 -0.71 0.00 0.00 52.86 51.91 2o2r s ASN 624 Cb -0.15 -0.27 0.02 0.00 0.41 0.00 0.00 41.25 41.26 2o2r s ASN 624 CO -0.02 0.09 -0.09 -0.63 -1.51 0.00 0.00 177.10 174.94 2o2r s ILE 625 N 0.03 1.02 -0.57 0.60 1.01 0.37 -0.34 121.20 123.32 2o2r s ILE 625 Ca -0.01 -0.34 0.04 0.00 0.00 0.00 0.00 60.65 60.35 2o2r s ILE 625 Cb -0.07 -1.00 0.16 0.00 0.01 0.00 0.00 42.46 41.56 2o2r s ILE 625 CO 0.00 0.35 0.38 -0.76 0.00 0.00 0.00 174.94 174.91 2o2r s LEU 626 N 1.28 3.80 0.31 2.97 1.43 0.07 -1.57 118.68 126.95 2o2r s LEU 626 Ca -0.03 -3.34 -0.29 0.00 -1.03 0.00 0.00 54.13 49.44 2o2r s LEU 626 Cb -0.14 -1.34 -0.13 0.00 0.03 0.00 0.00 46.19 44.62 2o2r s LEU 626 CO -0.03 -0.16 1.32 -2.65 0.23 0.00 0.00 176.35 175.06 2o2r n PRO 627 N 2.63 2.09 -3.42 1.29 -0.02 -1.26 -4.37 135.00 131.93 2o2r n PRO 627 Ca 0.16 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.38 2o2r n PRO 627 Cb 0.36 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.51 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 1.26 -2.04 3.86 -1.23 0.00 -1.26 -1.26 105.19 104.51 2o2r n GLY 628 Ca 0.07 -1.40 -0.32 0.00 0.00 0.00 0.00 46.02 44.37 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 -1.02 6.73 0.25 1.61 1.04 -1.26 -3.83 113.70 117.22 2o2r s SER 629 Ca 0.00 1.19 -0.03 0.00 0.48 0.00 0.00 55.95 57.59 2o2r s SER 629 Cb 0.00 -2.33 0.29 0.00 0.10 0.00 0.00 66.02 64.07 2o2r s SER 629 CO 0.00 -0.18 1.73 1.23 0.98 0.00 0.00 173.24 177.00 2o2r h GLY 630 N 2.30 0.86 2.00 7.32 0.00 -1.94 0.36 103.07 113.96 2o2r h GLY 630 Ca -0.48 -0.61 0.00 0.00 0.00 0.00 0.00 47.33 46.24 2o2r h GLY 630 CO 0.66 0.57 0.00 1.48 0.00 0.00 0.00 176.54 179.25 2o2r h SER 631 N 0.74 0.00 0.00 0.19 4.64 -1.95 0.15 113.55 117.31 2o2r h SER 631 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2o2r h SER 631 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 2o2r h SER 631 CO 0.03 0.00 -0.41 -0.11 -0.87 0.00 0.00 176.83 175.47 2o2r n LEU 632 N -2.96 1.00 0.05 5.97 0.00 -1.10 -4.50 117.00 115.46 2o2r n LEU 632 Ca -0.00 0.16 -0.12 0.00 0.00 0.00 0.00 56.01 56.05 2o2r n LEU 632 Cb 0.21 -0.50 -0.08 0.00 0.00 0.00 0.00 43.42 43.05 2o2r n LEU 632 CO 0.23 -0.45 0.47 0.58 0.00 0.00 0.00 177.39 178.22 2o2r h VAL 633 N -0.41 0.99 -0.70 1.96 2.07 -0.40 -2.28 116.25 117.48 2o2r h VAL 633 Ca 0.00 -1.12 0.10 0.00 0.82 0.00 0.00 66.70 66.50 2o2r h VAL 633 Cb 0.41 1.62 -0.07 0.00 -1.52 0.00 0.00 31.29 31.72 2o2r h VAL 633 CO 0.00 0.24 0.33 1.23 0.02 0.00 0.00 177.57 179.39 2o2r h GLY 634 N -0.77 1.05 0.98 2.17 0.00 -1.37 -1.37 103.07 103.76 2o2r h GLY 634 Ca -0.02 -0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.05 2o2r h GLY 634 CO 0.03 0.03 0.07 -1.61 0.00 0.00 0.00 176.54 175.06 2o2r h GLN 635 N 0.56 0.80 -0.54 4.80 5.75 -0.76 -1.79 115.11 123.94 2o2r h GLN 635 Ca 0.35 -0.22 -0.06 0.00 -0.15 0.00 0.00 58.65 58.57 2o2r h GLN 635 Cb 0.40 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.84 2o2r h GLN 635 CO -0.29 0.81 0.09 -0.09 -2.65 0.00 0.00 178.83 176.71 2o2r h ARG 636 N 0.67 0.88 -0.52 1.69 9.65 -0.96 -1.87 114.38 123.93 2o2r h ARG 636 Ca 0.15 -0.23 0.07 0.00 -1.10 0.00 0.00 59.98 58.86 2o2r h ARG 636 Cb 0.40 -0.11 -0.06 0.00 -1.39 0.00 0.00 29.97 28.82 2o2r h ARG 636 CO 0.01 0.86 0.18 -0.07 2.80 0.00 0.00 179.97 183.75 2o2r h LEU 637 N 0.77 0.17 -1.56 3.80 3.38 -1.05 0.68 115.31 121.50 2o2r h LEU 637 Ca 0.16 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 2o2r h LEU 637 Cb 0.40 0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2o2r h LEU 637 CO 0.01 0.12 -0.05 0.77 0.09 0.00 0.00 178.44 179.38 2o2r h SER 638 N 0.35 0.00 0.63 -0.43 4.64 -1.11 -2.79 113.55 114.84 2o2r h SER 638 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2o2r h SER 638 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2o2r h SER 638 CO -0.26 0.05 -1.28 0.47 -0.87 0.00 0.00 176.83 174.93 2o2r n ASP 639 N -3.18 0.57 -4.73 4.97 8.00 -0.72 -3.89 116.55 117.56 2o2r n ASP 639 Ca 0.00 0.15 -0.42 0.00 0.71 0.00 0.00 54.79 55.24 2o2r n ASP 639 Cb 0.30 0.94 -0.03 0.00 -0.02 0.00 0.00 41.12 42.31 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 -3.38 3.08 -0.78 1.24 2.46 0.15 -4.82 115.29 113.25 2o2r s HIS 640 Ca -0.02 0.95 0.20 0.00 0.47 0.00 0.00 55.06 56.66 2o2r s HIS 640 Cb 0.12 -3.80 0.83 0.00 -0.13 0.00 0.00 32.58 29.59 2o2r s HIS 640 CO 0.82 -2.72 1.63 -0.35 -2.47 0.00 0.00 174.74 171.65 2o2r n PRO 641 N 2.95 0.10 0.00 2.88 -0.04 -1.26 -3.04 135.00 136.59 2o2r n PRO 641 Ca 0.09 0.29 0.10 0.00 -0.04 0.00 0.00 63.50 63.94 2o2r n PRO 641 Cb 0.40 -1.67 -0.09 0.00 -0.04 0.00 0.00 33.50 32.10 2o2r n PRO 641 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2o2r n ASP 642 N -1.85 1.17 -4.72 3.54 10.43 -1.26 -4.89 116.55 118.97 2o2r n ASP 642 Ca 0.03 -1.09 -0.41 0.00 2.57 0.00 0.00 54.79 55.90 2o2r n ASP 642 Cb 0.23 0.88 -0.04 0.00 1.84 0.00 0.00 41.12 44.03 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 -2.78 4.82 -0.81 2.53 1.01 -1.17 -4.47 120.40 119.53 2o2r s VAL 643 Ca 0.10 1.80 0.10 0.00 0.00 0.00 0.00 61.98 63.97 2o2r s VAL 643 Cb 0.16 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.32 2o2r s VAL 643 CO 0.76 0.26 0.58 0.54 0.00 0.00 0.00 175.10 177.24 2o2r n ARG 644 N 3.42 2.41 -3.63 2.72 5.12 -0.04 -4.83 116.66 121.83 2o2r n ARG 644 Ca 0.01 -0.49 -0.12 0.00 -1.93 0.00 0.00 57.85 55.32 2o2r n ARG 644 Cb 0.51 -1.05 -0.07 0.00 -1.16 0.00 0.00 32.46 30.69 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 -1.42 0.78 -0.13 5.56 2.36 -1.23 -2.02 119.74 123.64 2o2r s LYS 645 Ca 0.07 1.04 0.00 0.00 -2.55 0.00 0.00 55.97 54.54 2o2r s LYS 645 Cb 0.08 0.32 -0.01 0.00 -1.05 0.00 0.00 37.83 37.17 2o2r s LYS 645 CO 0.26 -0.11 -0.14 0.42 1.55 0.00 0.00 175.35 177.34 2o2r s ILE 646 N 0.74 2.95 -0.21 5.43 -1.09 0.01 -0.77 121.20 128.26 2o2r s ILE 646 Ca -0.03 -0.69 -0.07 0.00 -2.23 0.00 0.00 60.65 57.63 2o2r s ILE 646 Cb -0.05 -2.24 -0.03 0.00 -1.58 0.00 0.00 42.46 38.56 2o2r s ILE 646 CO -0.05 0.52 0.05 -0.83 -1.23 0.00 0.00 174.94 173.40 2o2r s GLY 647 N 0.44 1.80 -0.05 6.18 0.00 -0.00 -2.00 107.32 113.68 2o2r s GLY 647 Ca -0.10 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 43.67 2o2r s GLY 647 CO 0.05 0.30 -0.11 -0.12 0.00 0.00 0.00 173.10 173.22 2o2r s PHE 648 N 1.06 1.25 -0.06 1.90 5.36 -0.47 -1.08 117.98 125.95 2o2r s PHE 648 Ca 0.04 -0.39 0.04 0.00 -0.96 0.00 0.00 56.93 55.66 2o2r s PHE 648 Cb -0.14 -0.90 -0.00 0.00 -0.34 0.00 0.00 43.02 41.63 2o2r s PHE 648 CO 0.03 -0.18 -0.18 0.99 -1.46 0.00 0.00 175.22 174.41 2o2r s THR 649 N 0.41 1.54 -2.76 0.12 2.01 -0.88 -1.22 115.64 114.86 2o2r s THR 649 Ca -0.08 -0.76 0.00 0.00 0.31 0.00 0.00 61.69 61.16 2o2r s THR 649 Cb -0.12 -1.33 0.00 0.00 0.01 0.00 0.00 72.50 71.05 2o2r s THR 649 CO 0.02 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 175.00 2o2r n GLY 650 N 3.28 -0.57 3.88 4.40 0.00 -0.52 -3.40 105.19 112.25 2o2r n GLY 650 Ca -0.19 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 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 6.40 0.23 1.61 1.04 -1.26 -3.63 113.70 114.10 2o2r s SER 651 Ca 0.00 1.16 -0.07 0.00 0.48 0.00 0.00 55.95 57.51 2o2r s SER 651 Cb 0.00 -2.34 0.21 0.00 0.10 0.00 0.00 66.02 63.99 2o2r s SER 651 CO 0.00 -0.55 1.88 0.74 0.98 0.00 0.00 173.24 176.29 2o2r h THR 652 N 0.57 1.25 -0.14 2.02 2.02 -1.89 0.10 112.91 116.84 2o2r h THR 652 Ca -0.47 -0.52 -0.13 0.00 0.77 0.00 0.00 66.41 66.06 2o2r h THR 652 Cb 1.19 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.56 2o2r h THR 652 CO 0.63 0.25 -0.49 -0.08 0.37 0.00 0.00 175.52 176.20 2o2r h GLU 653 N 1.24 0.38 -0.09 6.66 4.57 -1.94 -1.14 114.58 124.26 2o2r h GLU 653 Ca 0.32 -0.22 -0.22 0.00 -1.18 0.00 0.00 59.36 58.07 2o2r h GLU 653 Cb -0.07 0.02 0.01 0.00 -0.16 0.00 0.00 28.75 28.54 2o2r h GLU 653 CO -0.06 0.79 -0.83 0.28 -1.18 0.00 0.00 179.01 178.01 2o2r h VAL 654 N 0.30 1.33 -0.51 0.32 2.07 -1.90 -2.96 116.25 114.89 2o2r h VAL 654 Ca 0.01 -2.13 0.07 0.00 0.82 0.00 0.00 66.70 65.47 2o2r h VAL 654 Cb 0.98 2.14 -0.06 0.00 -1.52 0.00 0.00 31.29 32.83 2o2r h VAL 654 CO 0.08 0.66 0.18 1.23 0.02 0.00 0.00 177.57 179.74 2o2r h GLY 655 N 0.86 0.67 1.01 2.17 0.00 -0.73 0.44 103.07 107.49 2o2r h GLY 655 Ca -0.06 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 2o2r h GLY 655 CO 0.16 0.01 0.42 0.50 0.00 0.00 0.00 176.54 177.62 2o2r h LYS 656 N 0.36 1.01 -0.44 4.80 1.57 -1.23 -1.12 116.57 121.50 2o2r h LYS 656 Ca 0.24 -0.11 -0.12 0.00 -1.87 0.00 0.00 60.65 58.80 2o2r h LYS 656 Cb 0.26 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 2o2r h LYS 656 CO -0.25 0.73 -0.19 1.25 -0.57 0.00 0.00 179.45 180.42 2o2r h HIS 657 N 1.00 1.05 -0.15 -1.35 2.76 -1.27 -1.34 115.15 115.85 2o2r h HIS 657 Ca 0.26 -0.25 0.03 0.00 -2.20 0.00 0.00 60.37 58.20 2o2r h HIS 657 Cb 0.00 -0.24 -0.02 0.00 1.55 0.00 0.00 27.41 28.70 2o2r h HIS 657 CO -0.01 1.05 -0.01 0.82 -1.30 0.00 0.00 177.93 178.48 2o2r h ILE 658 N 0.75 0.89 -0.84 6.26 1.08 -0.63 -0.58 117.51 124.43 2o2r h ILE 658 Ca 0.10 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.55 2o2r h ILE 658 Cb 0.76 0.84 -0.04 0.00 -3.07 0.00 0.00 36.82 35.31 2o2r h ILE 658 CO 0.06 0.01 0.50 -0.03 -0.69 0.00 0.00 178.15 178.00 2o2r h MET 659 N 0.04 1.14 -0.50 2.37 4.05 -1.15 0.13 114.93 121.01 2o2r h MET 659 Ca 0.07 -0.11 -0.00 0.00 -0.28 0.00 0.00 59.70 59.38 2o2r h MET 659 Cb 0.09 -0.24 -0.02 0.00 -0.80 0.00 0.00 31.60 30.63 2o2r h MET 659 CO -0.13 0.80 0.30 -0.22 0.23 0.00 0.00 176.91 177.90 2o2r h LYS 660 N 1.15 0.68 -0.32 0.39 3.64 -1.09 -1.66 116.57 119.36 2o2r h LYS 660 Ca 0.30 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.53 2o2r h LYS 660 Cb -0.04 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 2o2r h LYS 660 CO -0.06 0.49 -0.16 0.77 -2.27 0.00 0.00 179.45 178.22 2o2r h SER 661 N 0.67 0.57 -0.51 4.20 0.02 -0.36 -1.51 113.55 116.64 2o2r h SER 661 Ca 0.18 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 2o2r h SER 661 Cb -0.01 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 2o2r h SER 661 CO -0.03 0.75 0.27 0.00 -1.14 0.00 0.00 176.83 176.68 2o2r h ALA 663 N 1.11 -0.39 0.00 0.00 0.00 -0.96 -2.42 119.26 116.60 2o2r h ALA 663 Ca 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2o2r h ALA 663 Cb 0.06 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2o2r h ALA 663 CO -0.03 -0.75 0.00 -0.07 0.00 0.00 0.00 179.25 178.41 2o2r h LEU 664 N -0.42 0.00 0.00 0.00 3.38 -1.26 -3.29 115.31 113.72 2o2r h LEU 664 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2o2r h LEU 664 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2o2r h LEU 664 CO -0.06 0.00 0.00 -1.54 0.09 0.00 0.00 178.44 176.93 2o2r n SER 665 N -3.08 0.00 -1.95 -0.43 3.41 -1.05 -4.93 113.62 105.59 2o2r n SER 665 Ca 0.02 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.64 2o2r n SER 665 Cb 0.40 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.40 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 -0.64 1.56 -4.39 4.04 6.94 -1.20 -4.99 115.26 116.58 2o2r n ASN 666 Ca 0.00 -2.31 -0.35 0.00 -0.02 0.00 0.00 54.58 51.90 2o2r n ASN 666 Cb 0.00 -0.39 -0.09 0.00 -2.36 0.00 0.00 39.78 36.94 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 -0.14 -0.69 -1.90 3.53 0.24 -0.93 -4.92 118.33 113.53 2o2r n VAL 667 Ca 0.10 -0.34 -0.37 0.00 -2.04 0.00 0.00 64.34 61.69 2o2r n VAL 667 Cb 0.97 -0.84 0.04 0.00 -1.47 0.00 0.00 33.84 32.53 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 -7.34 3.03 0.62 7.34 -2.85 -1.14 -4.96 119.74 114.44 2o2r s LYS 668 Ca 0.26 2.03 -0.18 0.00 -1.00 0.00 0.00 55.97 57.08 2o2r s LYS 668 Cb -0.15 -2.09 -0.02 0.00 -2.06 0.00 0.00 37.83 33.51 2o2r s LYS 668 CO 1.01 -1.21 1.18 0.15 0.10 0.00 0.00 175.35 176.58 2o2r s LYS 669 N -3.11 2.86 -0.05 1.78 1.02 -0.86 -4.73 119.74 116.66 2o2r s LYS 669 Ca 0.75 1.72 -0.08 0.00 0.02 0.00 0.00 55.97 58.39 2o2r s LYS 669 Cb -0.36 -1.93 0.02 0.00 -0.52 0.00 0.00 37.83 35.04 2o2r s LYS 669 CO 0.40 -1.27 0.19 0.54 -0.92 0.00 0.00 175.35 174.30 2o2r s VAL 670 N -1.79 0.02 0.05 3.17 0.11 -1.26 -0.81 120.40 119.90 2o2r s VAL 670 Ca 0.75 -0.19 0.05 0.00 -2.93 0.00 0.00 61.98 59.66 2o2r s VAL 670 Cb -0.28 -0.34 -0.02 0.00 -1.53 0.00 0.00 36.38 34.21 2o2r s VAL 670 CO 0.35 -0.11 -0.14 -0.94 -3.33 0.00 0.00 175.10 170.94 2o2r s SER 671 N -0.33 1.67 -0.06 3.54 1.04 -0.85 -4.97 113.70 113.75 2o2r s SER 671 Ca -0.04 -0.51 -0.01 0.00 0.48 0.00 0.00 55.95 55.86 2o2r s SER 671 Cb -0.03 -0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.03 2o2r s SER 671 CO 0.01 -0.00 0.01 -0.76 0.98 0.00 0.00 173.24 173.48 2o2r s LEU 672 N -1.35 0.56 -0.28 2.42 1.43 -0.74 -1.37 118.68 119.35 2o2r s LEU 672 Ca 0.00 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 2o2r s LEU 672 Cb -0.09 -0.36 0.05 0.00 0.03 0.00 0.00 46.19 45.83 2o2r s LEU 672 CO 0.02 -0.19 -0.05 -0.70 0.23 0.00 0.00 176.35 175.65 2o2r s GLU 673 N 1.91 2.38 -0.23 1.70 -6.30 -0.36 -1.53 118.70 116.28 2o2r s GLU 673 Ca 0.03 -1.28 0.12 0.00 -2.50 0.00 0.00 54.97 51.35 2o2r s GLU 673 Cb -0.12 -3.05 0.46 0.00 0.00 0.00 0.00 34.13 31.41 2o2r s GLU 673 CO -0.04 -0.58 1.35 1.28 0.02 0.00 0.00 175.26 177.28 2o2r n LEU 674 N 4.55 3.47 0.00 2.70 4.77 -0.28 -1.44 117.00 130.77 2o2r n LEU 674 Ca -0.14 -3.55 0.12 0.00 -0.03 0.00 0.00 56.01 52.41 2o2r n LEU 674 Cb 0.43 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 2o2r n LEU 674 CO 0.24 1.09 -0.16 0.61 -1.33 0.00 0.00 177.39 177.84 2o2r n GLY 675 N -1.07 -1.72 1.23 -0.72 0.00 -1.24 -3.88 105.19 97.80 2o2r n GLY 675 Ca 0.25 -1.17 -0.01 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.71 1.01 2.42 -0.02 0.00 -1.26 -4.36 105.19 100.26 2o2r n GLY 676 Ca 0.01 -0.98 -0.26 0.00 0.00 0.00 0.00 46.02 44.78 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 -0.24 0.79 -2.63 1.61 3.00 -1.26 -4.52 118.16 114.92 2o2r n LYS 677 Ca -0.00 -3.53 -0.43 0.00 -0.00 0.00 0.00 58.31 54.35 2o2r n LYS 677 Cb 0.19 -1.69 -0.02 0.00 0.00 0.00 0.00 35.03 33.50 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 -0.75 7.12 0.14 3.14 0.01 -1.26 -4.76 113.70 117.34 2o2r s SER 678 Ca 0.33 1.49 -0.25 0.00 1.31 0.00 0.00 55.95 58.82 2o2r s SER 678 Cb 0.07 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.68 2o2r s SER 678 CO -0.15 -0.62 0.77 -2.16 0.41 0.00 0.00 173.24 171.49 2o2r s PRO 679 N 2.85 4.55 -0.16 12.44 0.04 -1.26 -0.21 135.00 153.25 2o2r s PRO 679 Ca 0.47 1.14 0.01 0.00 0.04 0.00 0.00 61.00 62.66 2o2r s PRO 679 Cb -0.17 -3.28 0.01 0.00 0.04 0.00 0.00 34.50 31.09 2o2r s PRO 679 CO 0.11 0.51 -0.19 -1.17 0.04 0.00 0.00 177.00 176.30 2o2r s LEU 680 N -0.90 2.23 -0.25 -3.56 2.96 0.21 -0.97 118.68 118.39 2o2r s LEU 680 Ca 0.36 -0.58 -0.07 0.00 -0.22 0.00 0.00 54.13 53.62 2o2r s LEU 680 Cb -0.23 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 44.95 2o2r s LEU 680 CO 0.26 0.05 0.06 -0.63 -1.32 0.00 0.00 176.35 174.76 2o2r s ILE 681 N 1.02 4.11 -0.33 6.68 1.01 -0.11 -0.47 121.20 133.11 2o2r s ILE 681 Ca -0.02 -0.32 -0.04 0.00 0.00 0.00 0.00 60.65 60.27 2o2r s ILE 681 Cb -0.15 -2.96 0.05 0.00 0.01 0.00 0.00 42.46 39.42 2o2r s ILE 681 CO -0.06 0.30 0.06 -0.63 0.00 0.00 0.00 174.94 174.62 2o2r s ILE 682 N 1.57 3.37 0.43 2.92 1.01 0.86 -0.95 121.20 130.42 2o2r s ILE 682 Ca 0.06 -1.33 -0.10 0.00 0.00 0.00 0.00 60.65 59.27 2o2r s ILE 682 Cb -0.15 -2.95 -0.06 0.00 0.01 0.00 0.00 42.46 39.30 2o2r s ILE 682 CO 0.02 -0.19 0.79 -0.36 0.00 0.00 0.00 174.94 175.21 2o2r s PHE 683 N 1.31 3.49 0.42 3.97 0.08 -0.62 -1.31 117.98 125.31 2o2r s PHE 683 Ca -0.03 1.04 0.26 0.00 0.12 0.00 0.00 56.93 58.33 2o2r s PHE 683 Cb -0.20 -2.45 1.42 0.00 -0.57 0.00 0.00 43.02 41.22 2o2r s PHE 683 CO 0.00 -0.17 2.07 0.00 -0.10 0.00 0.00 175.22 177.02 2o2r h ALA 684 N 1.02 1.31 -0.24 5.36 0.00 -1.88 -2.56 119.26 122.27 2o2r h ALA 684 Ca -0.47 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.32 2o2r h ALA 684 Cb 1.19 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2o2r h ALA 684 CO 0.63 0.15 0.02 -0.40 0.00 0.00 0.00 179.25 179.65 2o2r n ASP 685 N -3.69 2.89 -4.69 0.00 5.68 -1.26 -4.92 116.55 110.56 2o2r n ASP 685 Ca -0.02 -2.38 -0.26 0.00 -0.50 0.00 0.00 54.79 51.63 2o2r n ASP 685 Cb 0.24 -0.58 0.10 0.00 -1.14 0.00 0.00 41.12 39.74 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 -4.65 6.49 0.12 0.00 3.68 -1.26 -4.89 116.67 116.17 2o2r s ASP 687 Ca 0.65 0.71 -0.14 0.00 2.13 0.00 0.00 52.55 55.89 2o2r s ASP 687 Cb -0.08 -2.54 -0.04 0.00 -1.45 0.00 0.00 42.92 38.81 2o2r s ASP 687 CO 0.47 -1.32 1.52 0.25 0.13 0.00 0.00 175.17 176.21 2o2r h LEU 688 N 11.66 0.73 -0.49 -1.34 5.85 -1.95 0.17 115.31 129.95 2o2r h LEU 688 Ca -0.25 -0.36 -0.04 0.00 0.84 0.00 0.00 57.88 58.07 2o2r h LEU 688 Cb 1.09 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.90 2o2r h LEU 688 CO 1.10 0.92 0.16 0.78 -0.34 0.00 0.00 178.44 181.07 2o2r h ASN 689 N 0.52 0.70 -0.83 1.25 2.35 -2.00 -0.75 115.58 116.82 2o2r h ASN 689 Ca 0.09 -0.20 0.07 0.00 -0.55 0.00 0.00 56.30 55.72 2o2r h ASN 689 Cb 0.61 -0.18 -0.06 0.00 0.05 0.00 0.00 38.32 38.73 2o2r h ASN 689 CO 0.04 0.71 0.50 0.11 -1.65 0.00 0.00 177.43 177.15 2o2r h LYS 690 N 0.65 0.87 -0.47 0.81 6.56 -1.96 -1.93 116.57 121.11 2o2r h LYS 690 Ca 0.16 -0.05 -0.02 0.00 -1.06 0.00 0.00 60.65 59.67 2o2r h LYS 690 Cb 0.25 -0.20 -0.02 0.00 -0.57 0.00 0.00 32.23 31.69 2o2r h LYS 690 CO -0.01 0.58 0.20 0.00 -2.06 0.00 0.00 179.45 178.16 2o2r h ALA 691 N 1.41 1.47 -0.04 3.86 0.00 -0.26 0.13 119.26 125.83 2o2r h ALA 691 Ca 0.38 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 2o2r h ALA 691 Cb 0.22 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 2o2r h ALA 691 CO -0.19 0.41 -0.01 0.28 0.00 0.00 0.00 179.25 179.74 2o2r h VAL 692 N 0.67 1.30 0.39 0.00 2.07 -0.79 0.24 116.25 120.13 2o2r h VAL 692 Ca 0.16 -0.90 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 2o2r h VAL 692 Cb 0.12 1.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2o2r h VAL 692 CO -0.02 0.24 -0.19 1.56 0.02 0.00 0.00 177.57 179.19 2o2r h GLN 693 N -0.28 -0.50 -0.67 1.57 1.08 -1.03 0.13 115.11 115.41 2o2r h GLN 693 Ca 0.01 0.03 -0.05 0.00 -1.45 0.00 0.00 58.65 57.19 2o2r h GLN 693 Cb 0.40 0.11 -0.03 0.00 -0.05 0.00 0.00 27.48 27.91 2o2r h GLN 693 CO 0.00 -0.29 0.22 0.52 -0.95 0.00 0.00 178.83 178.33 2o2r h MET 694 N -0.59 1.01 -0.77 1.46 2.86 -0.85 -1.30 114.93 116.75 2o2r h MET 694 Ca -0.05 -0.20 -0.05 0.00 -2.06 0.00 0.00 59.70 57.34 2o2r h MET 694 Cb 0.44 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 2o2r h MET 694 CO 0.09 0.86 0.29 0.78 1.06 0.00 0.00 176.91 179.99 2o2r h GLY 695 N 1.06 1.25 0.94 8.32 0.00 -0.37 -0.48 103.07 113.79 2o2r h GLY 695 Ca 0.22 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 2o2r h GLY 695 CO -0.01 0.65 0.05 -0.33 0.00 0.00 0.00 176.54 176.90 2o2r h MET 696 N 1.12 0.12 -0.55 4.80 2.07 -0.49 -2.96 114.93 119.04 2o2r h MET 696 Ca 0.25 -0.01 0.06 0.00 -2.07 0.00 0.00 59.70 57.93 2o2r h MET 696 Cb 0.23 -0.02 -0.05 0.00 -1.87 0.00 0.00 31.60 29.89 2o2r h MET 696 CO -0.02 0.15 0.26 1.03 1.07 0.00 0.00 176.91 179.40 2o2r h SER 697 N 0.05 0.34 -0.27 1.22 0.87 -1.06 0.12 113.55 114.83 2o2r h SER 697 Ca 0.03 0.04 0.08 0.00 -1.23 0.00 0.00 61.79 60.71 2o2r h SER 697 Cb 0.07 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 2o2r h SER 697 CO -0.01 0.23 0.25 0.77 -0.53 0.00 0.00 176.83 177.54 2o2r h SER 698 N 0.49 0.00 0.00 6.23 4.64 -0.92 -2.05 113.55 121.93 2o2r h SER 698 Ca 0.25 0.00 -0.44 0.00 -0.47 0.00 0.00 61.79 61.13 2o2r h SER 698 Cb 0.20 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.22 2o2r h SER 698 CO -0.20 0.00 -2.50 0.52 -0.87 0.00 0.00 176.83 173.78 2o2r n VAL 699 N -4.02 1.48 1.04 0.95 0.31 -1.03 -1.08 118.33 115.98 2o2r n VAL 699 Ca 0.04 -0.41 0.11 0.00 -0.01 0.00 0.00 64.34 64.06 2o2r n VAL 699 Cb 0.40 -1.77 0.05 0.00 -0.91 0.00 0.00 33.84 31.61 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 -4.02 0.00 -1.67 3.52 3.72 0.40 -3.53 117.46 115.88 2o2r n PHE 700 Ca -0.52 0.00 -0.46 0.00 -0.05 0.00 0.00 57.45 56.43 2o2r n PHE 700 Cb 0.90 -0.05 -0.04 0.00 -0.94 0.00 0.00 39.48 39.35 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 -0.80 2.26 -3.87 1.38 7.35 -0.78 -2.01 117.46 120.99 2o2r n PHE 701 Ca 0.07 0.31 -0.27 0.00 -0.76 0.00 0.00 57.45 56.81 2o2r n PHE 701 Cb 0.39 -2.52 0.02 0.00 0.35 0.00 0.00 39.48 37.71 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 3.05 -2.67 -3.86 -2.13 5.15 -1.26 -1.67 115.26 111.89 2o2r n ASN 702 Ca 0.15 -0.85 -0.30 0.00 -0.60 0.00 0.00 54.58 52.98 2o2r n ASN 702 Cb 0.30 -3.73 -0.01 0.00 -0.53 0.00 0.00 39.78 35.80 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 -4.47 -3.37 -0.77 1.20 0.00 -0.85 -1.48 118.16 108.42 2o2r n LYS 703 Ca -0.13 0.41 0.00 0.00 -0.00 0.00 0.00 58.31 58.58 2o2r n LYS 703 Cb 0.60 -5.14 0.00 0.00 -0.00 0.00 0.00 35.03 30.49 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 -1.30 0.40 3.04 2.58 0.00 -0.67 -3.26 105.19 105.98 2o2r n GLY 704 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.79 3.48 -3.48 1.61 1.02 -0.55 -2.98 120.64 117.96 2o2r n GLU 705 Ca 0.00 -3.53 -0.11 0.00 -0.02 0.00 0.00 57.16 53.50 2o2r n GLU 705 Cb 0.05 -3.01 -0.10 0.00 -0.02 0.00 0.00 31.44 28.36 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 1.71 0.32 0.35 1.62 3.04 -1.26 -4.73 114.94 115.99 2o2r s ASN 706 Ca 0.42 0.37 0.10 0.00 0.04 0.00 0.00 52.86 53.79 2o2r s ASN 706 Cb 0.06 1.00 0.86 0.00 -1.54 0.00 0.00 41.25 41.63 2o2r s ASN 706 CO -0.00 -0.28 1.83 0.00 -3.04 0.00 0.00 177.10 175.61 2o2r n ILE 708 N -4.61 0.40 -1.56 0.00 -5.35 -1.26 -4.30 119.36 102.68 2o2r n ILE 708 Ca 0.20 -0.56 -0.45 0.00 -0.27 0.00 0.00 62.75 61.67 2o2r n ILE 708 Cb 0.56 0.64 -0.01 0.00 -1.74 0.00 0.00 39.64 39.09 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 0.93 -0.60 -2.18 -1.28 0.00 -0.76 -4.80 120.51 111.83 2o2r n ALA 709 Ca 0.18 0.38 -0.43 0.00 0.00 0.00 0.00 53.44 53.57 2o2r n ALA 709 Cb 0.47 -1.96 -0.02 0.00 0.00 0.00 0.00 19.45 17.93 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 -1.08 3.41 -1.14 0.00 0.00 -0.24 -4.19 121.76 118.51 2o2r s ALA 710 Ca 0.60 0.51 0.25 0.00 0.00 0.00 0.00 51.96 53.32 2o2r s ALA 710 Cb -0.72 -3.79 0.49 0.00 0.00 0.00 0.00 23.12 19.11 2o2r s ALA 710 CO 0.59 -1.70 1.40 0.41 0.00 0.00 0.00 175.76 176.46 2o2r n GLY 711 N 4.36 -1.11 3.21 0.00 0.00 0.71 -4.64 105.19 107.71 2o2r n GLY 711 Ca 0.17 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.91 0.34 -0.18 1.61 0.52 -1.12 -4.63 118.95 112.58 2o2r s ARG 712 Ca 0.13 0.70 -0.05 0.00 -0.52 0.00 0.00 55.73 55.99 2o2r s ARG 712 Cb 0.18 -0.04 -0.03 0.00 0.52 0.00 0.00 34.95 35.57 2o2r s ARG 712 CO 0.68 -0.15 0.00 -0.51 0.02 0.00 0.00 175.30 175.34 2o2r s LEU 713 N 1.30 3.43 -0.27 2.53 1.02 0.08 -0.62 118.68 126.15 2o2r s LEU 713 Ca -0.09 -0.08 -0.08 0.00 0.02 0.00 0.00 54.13 53.90 2o2r s LEU 713 Cb -0.09 -1.85 -0.02 0.00 0.02 0.00 0.00 46.19 44.26 2o2r s LEU 713 CO -0.11 0.14 0.10 -0.36 0.02 0.00 0.00 176.35 176.14 2o2r s PHE 714 N 0.55 3.12 -0.10 0.29 0.40 0.38 -0.58 117.98 122.04 2o2r s PHE 714 Ca -0.00 -0.55 0.03 0.00 -0.60 0.00 0.00 56.93 55.80 2o2r s PHE 714 Cb -0.14 -2.28 -0.01 0.00 0.51 0.00 0.00 43.02 41.10 2o2r s PHE 714 CO 0.02 -0.42 -0.18 0.08 0.70 0.00 0.00 175.22 175.42 2o2r s VAL 715 N 1.60 2.64 0.32 -0.44 1.01 0.30 -0.10 120.40 125.73 2o2r s VAL 715 Ca 0.05 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 60.91 2o2r s VAL 715 Cb -0.16 -2.05 -0.10 0.00 0.00 0.00 0.00 36.38 34.06 2o2r s VAL 715 CO 0.04 0.55 1.36 -0.70 0.00 0.00 0.00 175.10 176.36 2o2r s GLU 716 N 0.08 4.30 0.32 2.72 2.12 -0.43 -2.08 118.70 125.74 2o2r s GLU 716 Ca -0.08 2.28 0.06 0.00 0.36 0.00 0.00 54.97 57.60 2o2r s GLU 716 Cb -0.15 -3.07 0.72 0.00 0.26 0.00 0.00 34.13 31.90 2o2r s GLU 716 CO 0.05 -0.29 1.84 1.49 -0.54 0.00 0.00 175.26 177.82 2o2r h GLU 717 N 3.71 0.78 0.00 4.30 4.22 -1.12 -1.42 114.58 125.05 2o2r h GLU 717 Ca -0.49 -0.05 0.00 0.00 0.08 0.00 0.00 59.36 58.91 2o2r h GLU 717 Cb 1.23 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.30 2o2r h GLU 717 CO 0.68 0.52 0.00 0.66 -2.18 0.00 0.00 179.01 178.68 2o2r h SER 718 N 0.80 0.00 -0.00 1.04 4.64 -1.90 -3.04 113.55 115.10 2o2r h SER 718 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 2o2r h SER 718 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2o2r h SER 718 CO -0.25 0.00 -0.05 2.30 -0.87 0.00 0.00 176.83 177.96 2o2r n ILE 719 N -2.48 0.00 0.17 0.95 -5.35 -0.60 -4.84 119.36 107.21 2o2r n ILE 719 Ca 0.01 -0.48 -0.16 0.00 -0.27 0.00 0.00 62.75 61.86 2o2r n ILE 719 Cb 0.24 1.06 -0.09 0.00 -1.74 0.00 0.00 39.64 39.10 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 0.53 -1.33 -0.54 4.28 2.76 -1.25 0.30 115.15 119.89 2o2r h HIS 720 Ca 0.00 0.03 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 2o2r h HIS 720 Cb 0.14 0.55 -0.03 0.00 1.55 0.00 0.00 27.41 29.61 2o2r h HIS 720 CO 0.00 -0.58 0.34 -0.91 -1.30 0.00 0.00 177.93 175.47 2o2r h ASN 721 N -0.78 0.56 -0.66 3.26 2.35 -1.88 0.38 115.58 118.80 2o2r h ASN 721 Ca -0.01 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.70 2o2r h ASN 721 Cb 0.76 -0.12 -0.03 0.00 0.05 0.00 0.00 38.32 38.97 2o2r h ASN 721 CO -0.20 0.39 0.26 -0.61 -1.65 0.00 0.00 177.43 175.62 2o2r h GLN 722 N 0.67 1.02 0.01 0.81 4.15 -1.84 -1.09 115.11 118.84 2o2r h GLN 722 Ca 0.21 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.45 2o2r h GLN 722 Cb -0.01 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.51 2o2r h GLN 722 CO -0.08 0.84 -0.01 0.35 -1.93 0.00 0.00 178.83 178.00 2o2r h PHE 723 N 0.99 -0.02 -0.50 3.99 3.04 0.57 -1.52 116.94 123.50 2o2r h PHE 723 Ca 0.23 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.18 2o2r h PHE 723 Cb 0.21 0.01 -0.02 0.00 2.56 0.00 0.00 35.95 38.70 2o2r h PHE 723 CO 0.02 0.05 0.33 0.28 -2.02 0.00 0.00 178.31 176.97 2o2r h VAL 724 N -0.08 1.13 -0.21 1.41 2.07 -0.79 -0.95 116.25 118.84 2o2r h VAL 724 Ca -0.00 -0.24 0.03 0.00 0.82 0.00 0.00 66.70 67.31 2o2r h VAL 724 Cb 0.07 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 2o2r h VAL 724 CO 0.00 0.13 0.02 1.56 0.02 0.00 0.00 177.57 179.30 2o2r h GLN 725 N 0.68 0.09 -0.13 1.57 4.20 -1.13 -0.98 115.11 119.41 2o2r h GLN 725 Ca 0.18 -0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.82 2o2r h GLN 725 Cb -0.07 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 2o2r h GLN 725 CO -0.04 0.06 -0.24 0.87 -0.67 0.00 0.00 178.83 178.81 2o2r h LYS 726 N 0.09 0.22 -0.18 1.46 1.57 -1.03 -2.32 116.57 116.38 2o2r h LYS 726 Ca 0.09 -0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2o2r h LYS 726 Cb 0.11 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 2o2r h LYS 726 CO -0.15 0.46 -0.06 0.28 -0.57 0.00 0.00 179.45 179.41 2o2r h VAL 727 N 0.20 1.30 -0.75 0.50 2.07 -0.73 -2.61 116.25 116.22 2o2r h VAL 727 Ca 0.03 -1.07 0.04 0.00 0.82 0.00 0.00 66.70 66.53 2o2r h VAL 727 Cb 0.54 1.63 -0.05 0.00 -1.52 0.00 0.00 31.29 31.89 2o2r h VAL 727 CO 0.04 0.32 0.46 0.58 0.02 0.00 0.00 177.57 178.99 2o2r h VAL 728 N 0.06 1.06 -0.36 2.57 2.07 -1.03 0.16 116.25 120.77 2o2r h VAL 728 Ca 0.04 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.31 2o2r h VAL 728 Cb 0.52 0.10 -0.05 0.00 -1.52 0.00 0.00 31.29 30.35 2o2r h VAL 728 CO 0.02 0.16 0.08 -0.33 0.02 0.00 0.00 177.57 177.52 2o2r h GLU 729 N 0.88 0.20 -0.53 1.57 5.08 -1.41 -2.00 114.58 118.37 2o2r h GLU 729 Ca 0.32 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.56 2o2r h GLU 729 Cb 0.09 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2o2r h GLU 729 CO -0.14 0.13 -0.09 0.93 -1.00 0.00 0.00 179.01 178.84 2o2r h GLU 730 N 0.21 0.98 -0.90 2.33 4.39 -1.02 -3.10 114.58 117.46 2o2r h GLU 730 Ca 0.17 -0.35 -0.01 0.00 0.34 0.00 0.00 59.36 59.51 2o2r h GLU 730 Cb 0.19 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.73 2o2r h GLU 730 CO -0.22 1.02 0.51 0.28 -1.16 0.00 0.00 179.01 179.44 2o2r h VAL 731 N 0.88 1.26 0.00 3.13 2.07 -0.51 -2.15 116.25 120.93 2o2r h VAL 731 Ca 0.14 -0.61 -0.02 0.00 0.82 0.00 0.00 66.70 67.04 2o2r h VAL 731 Cb 0.64 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 2o2r h VAL 731 CO 0.04 0.28 -0.08 -0.33 0.02 0.00 0.00 177.57 177.51 2o2r h GLU 732 N 1.25 0.00 -0.00 1.57 5.08 -1.30 -2.42 114.58 118.76 2o2r h GLU 732 Ca 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2o2r h GLU 732 Cb -0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2o2r h GLU 732 CO -0.05 0.08 -0.10 1.63 -1.00 0.00 0.00 179.01 179.56 2o2r n LYS 733 N -3.50 0.60 -2.37 2.33 5.02 -0.81 -4.88 118.16 114.54 2o2r n LYS 733 Ca -0.02 -0.18 -0.42 0.00 -2.02 0.00 0.00 58.31 55.67 2o2r n LYS 733 Cb 0.21 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.69 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 -2.52 4.36 -0.38 1.97 -1.94 -0.91 -4.99 119.30 114.88 2o2r s MET 734 Ca 0.28 1.80 -0.20 0.00 -1.71 0.00 0.00 55.69 55.86 2o2r s MET 734 Cb 0.20 -3.47 0.01 0.00 2.01 0.00 0.00 34.83 33.58 2o2r s MET 734 CO 0.48 -0.41 0.61 0.21 -0.01 0.00 0.00 175.02 175.91 2o2r s LYS 735 N 1.77 3.52 -0.15 2.03 2.36 -1.26 -4.95 119.74 123.05 2o2r s LYS 735 Ca 0.59 -0.15 -0.18 0.00 -2.55 0.00 0.00 55.97 53.69 2o2r s LYS 735 Cb -0.29 -3.86 -0.04 0.00 -1.05 0.00 0.00 37.83 32.60 2o2r s LYS 735 CO 0.26 -0.81 0.48 0.42 1.55 0.00 0.00 175.35 177.25 2o2r s ILE 736 N 2.68 5.16 0.00 5.43 1.01 -1.26 -0.69 121.20 133.53 2o2r s ILE 736 Ca 0.22 0.93 0.00 0.00 0.00 0.00 0.00 60.65 61.80 2o2r s ILE 736 Cb -0.15 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.51 2o2r s ILE 736 CO 0.16 0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.98 2o2r n GLY 737 N 3.54 0.73 3.69 6.18 0.00 -0.95 -4.99 105.19 113.39 2o2r n GLY 737 Ca -0.06 -0.66 -0.43 0.00 0.00 0.00 0.00 46.02 44.87 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 -0.02 4.01 0.27 1.61 2.85 -1.26 -4.39 115.26 118.33 2o2r n ASN 738 Ca 0.00 0.98 0.17 0.00 -0.11 0.00 0.00 54.58 55.62 2o2r n ASN 738 Cb 0.00 -1.53 0.91 0.00 1.24 0.00 0.00 39.78 40.40 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 8.67 0.00 0.00 1.20 0.13 -1.87 -1.54 132.00 138.59 2o2r h PRO 739 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 2o2r h PRO 739 Cb 1.23 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 -0.06 -0.07 -0.23 0.00 0.00 178.00 178.58 2o2r h LEU 740 N 0.00 0.00 -9.58 1.56 3.38 -1.90 -0.49 115.31 108.28 2o2r h LEU 740 Ca 0.04 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.49 2o2r h LEU 740 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 2o2r h LEU 740 CO -0.00 0.06 0.44 -1.61 0.09 0.00 0.00 178.44 177.42 2o2r s GLU 741 N -3.41 4.61 0.50 1.13 0.41 -0.58 -4.92 118.70 116.43 2o2r s GLU 741 Ca 0.04 1.61 0.29 0.00 -0.41 0.00 0.00 54.97 56.49 2o2r s GLU 741 Cb 0.07 -3.34 1.22 0.00 -1.78 0.00 0.00 34.13 30.31 2o2r s GLU 741 CO 0.63 0.07 1.94 0.00 -0.49 0.00 0.00 175.26 177.41 2o2r h ARG 742 N 5.64 0.00 0.00 1.61 2.47 -1.87 -2.44 114.38 119.79 2o2r h ARG 742 Ca -0.43 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.29 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 0.74 0.12 -0.31 -0.40 0.56 0.00 0.00 179.97 180.67 2o2r n ASP 743 N -3.32 0.34 -4.75 7.04 3.85 -1.26 -4.89 116.55 113.56 2o2r n ASP 743 Ca -0.00 0.07 -0.41 0.00 -0.71 0.00 0.00 54.79 53.73 2o2r n ASP 743 Cb 0.34 -0.05 -0.02 0.00 -1.35 0.00 0.00 41.12 40.04 2o2r n ASP 743 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2o2r s THR 744 N -3.01 2.46 0.00 2.12 2.01 -0.92 -4.68 115.64 113.62 2o2r s THR 744 Ca 0.12 0.39 0.00 0.00 0.31 0.00 0.00 61.69 62.51 2o2r s THR 744 Cb 0.18 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.44 2o2r s THR 744 CO 0.64 0.06 0.20 -0.46 -0.69 0.00 0.00 174.62 174.37 2o2r n ASN 745 N 2.33 0.40 -3.74 3.53 6.94 0.13 -4.97 115.26 119.88 2o2r n ASN 745 Ca 0.07 -0.72 -0.27 0.00 -0.02 0.00 0.00 54.58 53.65 2o2r n ASN 745 Cb 0.39 0.30 -0.17 0.00 -2.36 0.00 0.00 39.78 37.95 2o2r n ASN 745 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 2o2r s HIS 746 N -0.30 0.95 0.57 -2.53 5.04 -0.73 -4.92 115.29 113.37 2o2r s HIS 746 Ca 0.00 -0.75 -0.03 0.00 -1.54 0.00 0.00 55.06 52.74 2o2r s HIS 746 Cb 0.00 -0.99 0.12 0.00 0.04 0.00 0.00 32.58 31.75 2o2r s HIS 746 CO 0.00 -0.57 0.78 0.41 -2.34 0.00 0.00 174.74 173.02 2o2r n GLY 747 N 5.07 0.27 3.82 1.59 0.00 -1.26 -2.24 105.19 112.43 2o2r n GLY 747 Ca -0.09 -1.95 -0.31 0.00 0.00 0.00 0.00 46.02 43.67 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 -4.53 3.06 0.83 1.61 0.04 -1.26 -4.76 135.00 130.00 2o2r s PRO 748 Ca 0.50 1.02 -0.10 0.00 0.04 0.00 0.00 61.00 62.45 2o2r s PRO 748 Cb -0.02 -2.00 0.09 0.00 0.04 0.00 0.00 34.50 32.60 2o2r s PRO 748 CO 0.33 -1.00 1.11 -0.65 0.04 0.00 0.00 177.00 176.83 2o2r s GLN 749 N -4.77 1.76 0.15 4.56 -1.52 0.15 -4.71 119.66 115.27 2o2r s GLN 749 Ca 0.59 1.28 -0.12 0.00 -1.95 0.00 0.00 55.36 55.16 2o2r s GLN 749 Cb -0.14 -1.83 0.03 0.00 -0.22 0.00 0.00 33.01 30.85 2o2r s GLN 749 CO 0.50 -2.03 1.64 -0.97 -0.25 0.00 0.00 175.29 174.18 2o2r h ASN 750 N -1.42 0.82 -5.08 5.90 -0.73 -1.85 -3.44 115.58 109.78 2o2r h ASN 750 Ca -0.44 -0.26 0.01 0.00 1.87 0.00 0.00 56.30 57.49 2o2r h ASN 750 Cb 1.25 -0.22 -0.06 0.00 0.27 0.00 0.00 38.32 39.56 2o2r h ASN 750 CO 0.48 0.87 0.13 -1.38 -0.37 0.00 0.00 177.43 177.16 2o2r s HIS 751 N -5.21 0.04 0.03 0.67 -3.43 -1.26 -4.60 115.29 101.54 2o2r s HIS 751 Ca -0.13 -0.49 -0.21 0.00 -0.80 0.00 0.00 55.06 53.43 2o2r s HIS 751 Cb 0.12 0.56 -0.15 0.00 -1.43 0.00 0.00 32.58 31.68 2o2r s HIS 751 CO 0.81 -1.21 1.34 1.49 -2.00 0.00 0.00 174.74 175.17 2o2r h GLU 752 N 2.07 0.32 -0.48 -0.38 4.81 -1.95 -2.45 114.58 116.51 2o2r h GLU 752 Ca -0.23 -0.16 0.05 0.00 -0.13 0.00 0.00 59.36 58.89 2o2r h GLU 752 Cb 1.25 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.61 2o2r h GLU 752 CO 0.29 0.71 0.32 0.00 -0.73 0.00 0.00 179.01 179.60 2o2r h ALA 753 N 0.61 1.89 -0.12 2.92 0.00 -1.99 -0.61 119.26 121.95 2o2r h ALA 753 Ca 0.02 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2o2r h ALA 753 Cb 0.64 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 2o2r h ALA 753 CO 0.03 0.03 -0.21 1.25 0.00 0.00 0.00 179.25 180.36 2o2r h HIS 754 N 0.44 0.44 -0.67 0.00 -0.00 -1.95 -2.24 115.15 111.17 2o2r h HIS 754 Ca 0.21 -0.15 0.14 0.00 -0.00 0.00 0.00 60.37 60.56 2o2r h HIS 754 Cb 0.26 -0.08 -0.11 0.00 -0.00 0.00 0.00 27.41 27.47 2o2r h HIS 754 CO -0.00 0.82 0.05 1.25 -0.00 0.00 0.00 177.93 180.05 2o2r h LEU 755 N -0.06 -0.20 -0.75 0.26 7.12 -0.95 -0.82 115.31 119.91 2o2r h LEU 755 Ca 0.01 0.16 0.05 0.00 0.13 0.00 0.00 57.88 58.22 2o2r h LEU 755 Cb 0.78 0.26 -0.05 0.00 -0.53 0.00 0.00 40.66 41.12 2o2r h LEU 755 CO 0.05 -0.10 0.45 0.03 -0.13 0.00 0.00 178.44 178.74 2o2r h ARG 756 N 0.16 0.83 -0.33 1.25 3.08 -0.99 -1.73 114.38 116.64 2o2r h ARG 756 Ca 0.36 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.37 2o2r h ARG 756 Cb 0.60 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 2o2r h ARG 756 CO -0.54 0.55 0.21 -0.22 -1.07 0.00 0.00 179.97 178.90 2o2r h LYS 757 N 0.86 0.42 -0.99 0.04 3.11 -0.73 -2.22 116.57 117.05 2o2r h LYS 757 Ca 0.32 -0.03 0.03 0.00 -2.81 0.00 0.00 60.65 58.16 2o2r h LYS 757 Cb 0.11 -0.10 -0.05 0.00 -1.00 0.00 0.00 32.23 31.19 2o2r h LYS 757 CO -0.15 0.28 0.65 -0.07 -2.81 0.00 0.00 179.45 177.35 2o2r h LEU 758 N 0.43 1.11 -0.11 5.20 3.38 -0.54 0.57 115.31 125.35 2o2r h LEU 758 Ca 0.12 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 2o2r h LEU 758 Cb -0.04 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2o2r h LEU 758 CO -0.04 0.77 0.05 0.58 0.09 0.00 0.00 178.44 179.90 2o2r h VAL 759 N 1.29 1.13 -0.61 1.22 2.07 -1.06 -2.25 116.25 118.05 2o2r h VAL 759 Ca 0.38 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2o2r h VAL 759 Cb -0.06 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 2o2r h VAL 759 CO -0.11 0.12 0.23 -0.33 0.02 0.00 0.00 177.57 177.51 2o2r h GLU 760 N 0.04 0.89 -0.08 1.57 5.08 -1.11 -1.47 114.58 119.51 2o2r h GLU 760 Ca 0.04 -0.15 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 2o2r h GLU 760 Cb 0.14 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 29.21 2o2r h GLU 760 CO -0.00 0.74 -0.08 -0.92 -1.00 0.00 0.00 179.01 177.75 2o2r h TYR 761 N 0.88 -0.19 -0.11 4.33 5.03 -0.66 -1.08 116.97 125.16 2o2r h TYR 761 Ca 0.21 0.01 -0.13 0.00 2.58 0.00 0.00 58.73 61.40 2o2r h TYR 761 Cb 0.19 0.10 -0.01 0.00 1.55 0.00 0.00 36.73 38.55 2o2r h TYR 761 CO 0.01 -0.12 -0.49 0.00 -1.32 0.00 0.00 178.16 176.24 2o2r h GLN 763 N 0.24 0.29 -0.63 0.00 4.20 -1.04 -1.02 115.11 117.15 2o2r h GLN 763 Ca 0.01 -0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 2o2r h GLN 763 Cb 0.95 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.64 2o2r h GLN 763 CO 0.08 0.19 0.07 -0.09 -0.67 0.00 0.00 178.83 178.41 2o2r h ARG 764 N 0.30 1.07 -0.80 1.46 2.43 -0.94 0.55 114.38 118.44 2o2r h ARG 764 Ca 0.13 -0.30 0.10 0.00 -0.81 0.00 0.00 59.98 59.10 2o2r h ARG 764 Cb 0.07 -0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 29.43 2o2r h ARG 764 CO -0.11 1.01 0.44 0.78 -1.51 0.00 0.00 179.97 180.58 2o2r h GLY 765 N 0.98 1.25 0.80 2.80 0.00 -0.77 -0.85 103.07 107.28 2o2r h GLY 765 Ca 0.19 -0.29 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 2o2r h GLY 765 CO 0.02 0.09 -0.31 -2.08 0.00 0.00 0.00 176.54 174.26 2o2r h VAL 766 N 0.73 1.37 -0.75 4.60 2.07 -0.88 -2.53 116.25 120.85 2o2r h VAL 766 Ca 0.40 -1.58 0.14 0.00 0.82 0.00 0.00 66.70 66.47 2o2r h VAL 766 Cb 0.40 2.03 -0.09 0.00 -1.52 0.00 0.00 31.29 32.11 2o2r h VAL 766 CO -0.27 0.47 0.30 0.50 0.02 0.00 0.00 177.57 178.60 2o2r h LYS 767 N 0.06 0.44 -0.00 1.57 3.64 -0.51 -1.84 116.57 119.93 2o2r h LYS 767 Ca 0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2o2r h LYS 767 Cb 0.91 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.63 2o2r h LYS 767 CO 0.07 0.29 -0.01 -0.85 -2.27 0.00 0.00 179.45 176.68 2o2r n GLU 768 N -4.99 0.21 0.00 1.90 0.28 -0.36 -4.92 120.64 112.76 2o2r n GLU 768 Ca 0.14 -0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.14 2o2r n GLU 768 Cb 0.41 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.78 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 1.40 1.26 3.81 -1.84 0.00 -0.69 -5.04 105.19 104.07 2o2r n GLY 769 Ca 0.10 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 2.93 -0.29 4.61 0.00 -0.96 -4.97 121.76 121.08 2o2r s ALA 770 Ca 0.00 0.52 -0.19 0.00 0.00 0.00 0.00 51.96 52.29 2o2r s ALA 770 Cb 0.00 -3.21 -0.02 0.00 0.00 0.00 0.00 23.12 19.89 2o2r s ALA 770 CO 0.00 -0.17 0.57 -0.08 0.00 0.00 0.00 175.76 176.08 2o2r s THR 771 N -2.07 5.00 -0.46 0.00 -1.32 -0.67 -4.57 115.64 111.55 2o2r s THR 771 Ca 0.65 0.80 -0.29 0.00 -1.21 0.00 0.00 61.69 61.65 2o2r s THR 771 Cb -0.14 -3.92 0.02 0.00 -1.51 0.00 0.00 72.50 66.95 2o2r s THR 771 CO 0.18 -0.05 1.27 -0.22 -2.21 0.00 0.00 174.62 173.59 2o2r s LEU 772 N 2.45 3.59 -0.06 9.08 2.96 -1.26 -1.20 118.68 134.24 2o2r s LEU 772 Ca 0.23 0.58 -0.21 0.00 -0.22 0.00 0.00 54.13 54.51 2o2r s LEU 772 Cb -0.15 -3.50 -0.31 0.00 0.50 0.00 0.00 46.19 42.73 2o2r s LEU 772 CO 0.11 -1.37 0.84 0.58 -1.32 0.00 0.00 176.35 175.19 2o2r h VAL 773 N 6.34 1.45 -3.43 1.68 2.07 -1.21 -3.48 116.25 119.67 2o2r h VAL 773 Ca -0.25 -2.51 -0.05 0.00 0.82 0.00 0.00 66.70 64.71 2o2r h VAL 773 Cb 1.08 3.14 -0.12 0.00 -1.52 0.00 0.00 31.29 33.87 2o2r h VAL 773 CO 1.12 0.71 -0.08 0.00 0.02 0.00 0.00 177.57 179.33 2o2r n GLY 775 N -0.25 0.16 0.00 0.00 0.00 -1.25 -2.04 105.19 101.80 2o2r n GLY 775 Ca -0.14 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 44.95 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 0.48 3.15 -0.02 0.00 -1.25 -4.96 105.19 102.59 2o2r n GLY 776 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.38 1.30 0.22 1.61 4.22 -1.26 -4.72 114.94 113.93 2o2r s ASN 777 Ca 0.00 -0.79 -0.32 0.00 -2.14 0.00 0.00 52.86 49.61 2o2r s ASN 777 Cb 0.00 0.03 -0.12 0.00 1.28 0.00 0.00 41.25 42.44 2o2r s ASN 777 CO 0.00 -0.28 1.71 -1.58 -2.04 0.00 0.00 177.10 174.91 2o2r s GLN 778 N -2.70 4.12 0.21 3.55 0.74 -1.26 -1.02 119.66 123.30 2o2r s GLN 778 Ca 0.03 2.62 -0.30 0.00 0.05 0.00 0.00 55.36 57.75 2o2r s GLN 778 Cb -0.03 -3.06 -0.10 0.00 1.10 0.00 0.00 33.01 30.92 2o2r s GLN 778 CO -0.01 -0.74 1.46 0.08 -0.55 0.00 0.00 175.29 175.53 2o2r s VAL 779 N 0.98 2.75 -0.87 1.34 1.01 -0.75 -4.85 120.40 120.02 2o2r s VAL 779 Ca 0.73 0.60 -0.25 0.00 0.00 0.00 0.00 61.98 63.06 2o2r s VAL 779 Cb -0.50 -3.38 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2o2r s VAL 779 CO 0.35 0.08 1.96 -2.84 0.00 0.00 0.00 175.10 174.65 2o2r s PRO 780 N 0.13 2.51 -0.10 2.72 0.02 -1.26 -4.71 135.00 134.32 2o2r s PRO 780 Ca 0.62 -0.16 -0.32 0.00 0.02 0.00 0.00 61.00 61.16 2o2r s PRO 780 Cb -0.41 -4.98 0.12 0.00 0.02 0.00 0.00 34.50 29.25 2o2r s PRO 780 CO 0.39 -3.37 1.18 -0.98 -0.33 0.00 0.00 177.00 173.89 2o2r s ARG 781 N 7.11 0.45 0.87 5.54 1.70 -1.26 -5.16 118.95 128.19 2o2r s ARG 781 Ca 0.71 -0.20 -0.11 0.00 -0.47 0.00 0.00 55.73 55.66 2o2r s ARG 781 Cb -0.08 0.18 0.11 0.00 -0.57 0.00 0.00 34.95 34.60 2o2r s ARG 781 CO 0.02 -0.20 1.10 -2.14 -1.08 0.00 0.00 175.30 173.00 2o2r s PRO 782 N -2.55 1.48 1.12 3.89 0.02 -1.26 -4.80 135.00 132.90 2o2r s PRO 782 Ca 0.11 1.13 0.00 0.00 0.02 0.00 0.00 61.00 62.26 2o2r s PRO 782 Cb 0.01 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.72 2o2r s PRO 782 CO -0.04 -2.18 0.00 0.41 -0.33 0.00 0.00 177.00 174.86 2o2r n GLY 783 N -0.73 -1.64 2.48 0.52 0.00 -1.23 -4.57 105.19 100.02 2o2r n GLY 783 Ca 0.09 -1.62 -0.24 0.00 0.00 0.00 0.00 46.02 44.25 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 2.05 -3.29 1.61 3.72 -0.36 -4.87 117.46 116.31 2o2r n PHE 784 Ca 0.00 -3.90 -0.36 0.00 -0.05 0.00 0.00 57.45 53.14 2o2r n PHE 784 Cb 0.00 -0.46 -0.06 0.00 -0.94 0.00 0.00 39.48 38.02 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 -2.55 3.65 -0.04 1.38 0.08 -1.26 -0.68 117.98 118.57 2o2r s PHE 785 Ca 0.42 1.17 0.04 0.00 0.12 0.00 0.00 56.93 58.68 2o2r s PHE 785 Cb 0.25 -2.45 -0.00 0.00 -0.57 0.00 0.00 43.02 40.25 2o2r s PHE 785 CO -0.09 0.44 -0.15 0.12 -0.10 0.00 0.00 175.22 175.44 2o2r s PHE 786 N -1.41 1.52 0.04 0.36 5.36 -1.26 -1.81 117.98 120.78 2o2r s PHE 786 Ca 0.37 -0.41 -0.30 0.00 -0.96 0.00 0.00 56.93 55.62 2o2r s PHE 786 Cb -0.16 -1.03 -0.05 0.00 -0.34 0.00 0.00 43.02 41.43 2o2r s PHE 786 CO 0.19 -0.14 1.20 -1.14 -1.46 0.00 0.00 175.22 173.88 2o2r s GLN 787 N 0.04 4.42 -0.13 10.12 2.00 -0.19 -4.82 119.66 131.08 2o2r s GLN 787 Ca -0.03 1.76 -0.38 0.00 -2.00 0.00 0.00 55.36 54.71 2o2r s GLN 787 Cb -0.10 -3.39 -0.15 0.00 0.80 0.00 0.00 33.01 30.16 2o2r s GLN 787 CO 0.02 -0.29 1.64 -2.30 -0.50 0.00 0.00 175.29 173.85 2o2r n PRO 788 N 4.17 1.33 -5.02 1.67 -0.02 -1.26 -3.83 135.00 132.04 2o2r n PRO 788 Ca 0.09 0.48 -0.32 0.00 -2.02 0.00 0.00 63.50 61.73 2o2r n PRO 788 Cb 0.46 -2.18 -0.15 0.00 -0.02 0.00 0.00 33.50 31.62 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 2.64 2.67 -0.11 3.45 2.01 -0.24 -3.92 115.64 122.14 2o2r s THR 789 Ca 0.93 -0.85 0.02 0.00 0.31 0.00 0.00 61.69 62.10 2o2r s THR 789 Cb -0.97 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 69.52 2o2r s THR 789 CO 0.57 0.57 -0.17 -0.69 -0.69 0.00 0.00 174.62 174.22 2o2r s VAL 790 N -0.33 1.60 -0.05 3.82 1.01 -0.87 -0.13 120.40 125.45 2o2r s VAL 790 Ca 0.02 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.32 2o2r s VAL 790 Cb -0.13 -1.44 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 2o2r s VAL 790 CO 0.02 0.46 -0.13 -0.36 0.00 0.00 0.00 175.10 175.10 2o2r s PHE 791 N 0.87 2.76 0.41 5.22 0.08 0.13 -0.57 117.98 126.88 2o2r s PHE 791 Ca -0.08 -0.12 0.01 0.00 0.12 0.00 0.00 56.93 56.86 2o2r s PHE 791 Cb -0.15 -1.64 -0.00 0.00 -0.57 0.00 0.00 43.02 40.65 2o2r s PHE 791 CO -0.00 0.23 0.04 0.25 -0.10 0.00 0.00 175.22 175.63 2o2r n THR 792 N 2.25 0.00 -2.84 0.64 -2.24 -0.34 -1.06 114.28 110.69 2o2r n THR 792 Ca -0.17 -2.06 -0.20 0.00 -2.27 0.00 0.00 64.05 59.35 2o2r n THR 792 Cb 0.52 0.51 0.01 0.00 -2.10 0.00 0.00 70.33 69.27 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 -1.36 -4.91 -4.71 3.42 10.43 -1.19 -1.67 116.55 116.55 2o2r n ASP 793 Ca -0.14 -0.14 -0.42 0.00 2.57 0.00 0.00 54.79 56.66 2o2r n ASP 793 Cb 0.55 -4.06 -0.03 0.00 1.84 0.00 0.00 41.12 39.42 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 -2.95 4.70 0.13 2.53 1.01 -1.05 -4.62 120.40 120.16 2o2r s VAL 794 Ca 0.19 1.96 0.05 0.00 0.00 0.00 0.00 61.98 64.19 2o2r s VAL 794 Cb -0.09 -4.26 -0.04 0.00 0.00 0.00 0.00 36.38 31.99 2o2r s VAL 794 CO 0.24 0.16 0.04 -1.61 0.00 0.00 0.00 175.10 173.93 2o2r s GLU 795 N 0.93 2.62 0.56 2.72 0.41 -1.26 -4.59 118.70 120.09 2o2r s GLU 795 Ca 0.53 -0.92 0.24 0.00 -0.41 0.00 0.00 54.97 54.41 2o2r s GLU 795 Cb -0.23 -2.53 1.58 0.00 -1.78 0.00 0.00 34.13 31.18 2o2r s GLU 795 CO 0.28 0.50 2.21 -0.44 -0.49 0.00 0.00 175.26 177.32 2o2r h ASP 796 N 2.93 0.00 1.12 -0.19 3.45 -1.96 -0.87 116.42 120.90 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 1.19 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.96 2o2r h ASP 796 CO 0.61 0.01 0.00 0.00 -1.57 0.00 0.00 179.24 178.28 2o2r n HIS 797 N -4.13 0.51 -2.33 4.55 1.44 -1.26 -4.72 115.22 109.28 2o2r n HIS 797 Ca -0.03 0.16 -0.40 0.00 -2.01 0.00 0.00 57.72 55.44 2o2r n HIS 797 Cb 0.09 -0.76 -0.03 0.00 0.12 0.00 0.00 29.99 29.41 2o2r n HIS 797 CO 0.00 0.00 0.00 -1.64 -2.81 0.00 0.00 176.34 171.89 2o2r s MET 798 N -3.08 4.49 0.30 -1.40 -1.94 -0.33 -4.93 119.30 112.41 2o2r s MET 798 Ca 0.11 1.96 0.04 0.00 -1.71 0.00 0.00 55.69 56.09 2o2r s MET 798 Cb 0.14 -3.10 0.80 0.00 2.01 0.00 0.00 34.83 34.67 2o2r s MET 798 CO 0.51 0.02 1.63 -0.92 -0.01 0.00 0.00 175.02 176.26 2o2r h TYR 799 N 3.56 0.38 0.00 -0.03 5.03 -1.90 0.38 116.97 124.38 2o2r h TYR 799 Ca -0.48 0.05 0.00 0.00 2.58 0.00 0.00 58.73 60.88 2o2r h TYR 799 Cb 1.22 -0.02 0.00 0.00 1.55 0.00 0.00 36.73 39.48 2o2r h TYR 799 CO 0.57 -0.26 0.00 0.44 -1.32 0.00 0.00 178.16 177.59 2o2r n ILE 800 N -5.25 0.43 0.78 1.81 -5.35 -1.26 -0.93 119.36 109.59 2o2r n ILE 800 Ca 0.24 -0.02 0.13 0.00 -0.27 0.00 0.00 62.75 62.82 2o2r n ILE 800 Cb 0.77 -0.68 0.41 0.00 -1.74 0.00 0.00 39.64 38.40 2o2r n ILE 800 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2o2r n ALA 801 N -1.62 2.57 -0.03 -1.28 0.00 0.11 -4.41 120.51 115.85 2o2r n ALA 801 Ca 0.05 -0.13 -0.03 0.00 0.00 0.00 0.00 53.44 53.33 2o2r n ALA 801 Cb 0.33 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.38 2o2r n ALA 801 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2o2r n LYS 802 N -1.90 1.50 -3.97 0.00 5.02 -0.73 -4.99 118.16 113.09 2o2r n LYS 802 Ca 0.06 0.02 -0.34 0.00 -2.02 0.00 0.00 58.31 56.03 2o2r n LYS 802 Cb 0.39 -1.12 -0.06 0.00 -0.02 0.00 0.00 35.03 34.23 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 -2.11 3.32 -0.03 1.97 2.56 -0.10 -4.87 118.70 119.44 2o2r s GLU 803 Ca -0.05 -0.34 -0.29 0.00 0.00 0.00 0.00 54.97 54.29 2o2r s GLU 803 Cb 0.02 -3.04 -0.03 0.00 2.00 0.00 0.00 34.13 33.08 2o2r s GLU 803 CO 0.16 0.69 0.93 -2.00 -0.56 0.00 0.00 175.26 174.47 2o2r s GLU 804 N -1.70 4.51 -0.07 4.30 2.12 -1.26 -4.81 118.70 121.80 2o2r s GLU 804 Ca 0.24 1.30 -0.12 0.00 0.36 0.00 0.00 54.97 56.74 2o2r s GLU 804 Cb -0.12 -3.47 -0.29 0.00 0.26 0.00 0.00 34.13 30.50 2o2r s GLU 804 CO 0.14 -0.07 0.61 0.66 -0.54 0.00 0.00 175.26 176.06 2o2r h SER 805 N 6.84 0.53 -4.11 -1.70 4.64 -1.95 -3.48 113.55 114.31 2o2r h SER 805 Ca -0.40 -0.91 -0.37 0.00 -0.47 0.00 0.00 61.79 59.64 2o2r h SER 805 Cb 1.20 -0.17 0.06 0.00 -0.31 0.00 0.00 62.40 63.18 2o2r h SER 805 CO 0.76 1.74 -0.55 0.33 -0.87 0.00 0.00 176.83 178.24 2o2r n PHE 806 N -3.70 -1.81 -4.12 4.77 7.35 -1.26 -4.87 117.46 113.82 2o2r n PHE 806 Ca -0.25 0.49 -0.13 0.00 -0.76 0.00 0.00 57.45 56.79 2o2r n PHE 806 Cb 1.02 -4.19 -0.06 0.00 0.35 0.00 0.00 39.48 36.59 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 -2.76 1.38 -1.37 7.13 0.00 -1.16 -3.96 107.32 106.59 2o2r s GLY 807 Ca 0.28 -1.50 -0.13 0.00 0.00 0.00 0.00 44.72 43.38 2o2r s GLY 807 CO 0.35 -1.08 2.01 -1.55 0.00 0.00 0.00 173.10 172.83 2o2r n PRO 808 N -0.46 3.19 -3.83 2.90 -0.04 -1.20 -4.50 135.00 131.06 2o2r n PRO 808 Ca 0.02 -3.07 -0.30 0.00 -0.04 0.00 0.00 63.50 60.10 2o2r n PRO 808 Cb 0.63 -3.16 -0.15 0.00 -0.04 0.00 0.00 33.50 30.77 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 2.17 1.23 -0.26 0.52 1.01 -1.26 -1.08 121.20 123.53 2o2r s ILE 809 Ca 0.45 -1.44 -0.26 0.00 0.00 0.00 0.00 60.65 59.40 2o2r s ILE 809 Cb 0.10 -1.81 0.00 0.00 0.01 0.00 0.00 42.46 40.77 2o2r s ILE 809 CO -0.03 -0.49 0.92 -0.32 0.00 0.00 0.00 174.94 175.02 2o2r s MET 810 N 1.47 4.15 -0.36 2.79 1.75 0.81 -4.96 119.30 124.95 2o2r s MET 810 Ca 0.05 1.01 0.01 0.00 -1.25 0.00 0.00 55.69 55.51 2o2r s MET 810 Cb -0.18 -3.67 0.10 0.00 2.84 0.00 0.00 34.83 33.91 2o2r s MET 810 CO -0.16 -0.64 0.09 0.42 -0.65 0.00 0.00 175.02 174.08 2o2r s ILE 811 N 3.09 2.73 -0.17 10.11 1.01 -1.26 0.17 121.20 136.88 2o2r s ILE 811 Ca 0.38 -2.09 -0.05 0.00 0.00 0.00 0.00 60.65 58.90 2o2r s ILE 811 Cb -0.14 -2.88 -0.03 0.00 0.01 0.00 0.00 42.46 39.41 2o2r s ILE 811 CO 0.09 -0.54 0.00 -0.63 0.00 0.00 0.00 174.94 173.86 2o2r s ILE 812 N 1.04 4.22 0.15 2.92 1.01 -0.22 -0.74 121.20 129.58 2o2r s ILE 812 Ca 0.07 -0.24 0.10 0.00 0.00 0.00 0.00 60.65 60.58 2o2r s ILE 812 Cb -0.21 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 2o2r s ILE 812 CO -0.06 0.48 -0.23 -0.44 0.00 0.00 0.00 174.94 174.69 2o2r s SER 813 N 0.41 3.03 0.27 3.58 0.01 0.25 -2.52 113.70 118.72 2o2r s SER 813 Ca -0.01 -0.78 -0.04 0.00 1.31 0.00 0.00 55.95 56.42 2o2r s SER 813 Cb -0.14 -0.20 -0.05 0.00 0.21 0.00 0.00 66.02 65.85 2o2r s SER 813 CO 0.02 0.09 0.52 -0.13 0.41 0.00 0.00 173.24 174.15 2o2r s ARG 814 N -2.32 3.62 0.05 12.44 0.52 -1.26 -0.54 118.95 131.47 2o2r s ARG 814 Ca 0.14 -0.04 0.03 0.00 -0.52 0.00 0.00 55.73 55.34 2o2r s ARG 814 Cb -0.09 -2.68 -0.03 0.00 0.52 0.00 0.00 34.95 32.67 2o2r s ARG 814 CO 0.07 0.26 -0.09 -0.59 0.02 0.00 0.00 175.30 174.96 2o2r s PHE 815 N -2.02 0.80 0.39 -0.53 -0.71 -0.88 -4.80 117.98 110.22 2o2r s PHE 815 Ca 0.43 -0.51 -0.26 0.00 -1.04 0.00 0.00 56.93 55.55 2o2r s PHE 815 Cb -0.11 -0.47 -0.09 0.00 -1.21 0.00 0.00 43.02 41.15 2o2r s PHE 815 CO 0.29 -0.06 1.23 0.00 -1.34 0.00 0.00 175.22 175.34 2o2r s ALA 816 N -1.45 3.24 0.20 1.99 0.00 -1.26 -0.54 121.76 123.94 2o2r s ALA 816 Ca -0.07 1.09 -0.32 0.00 0.00 0.00 0.00 51.96 52.66 2o2r s ALA 816 Cb -0.09 -3.43 -0.15 0.00 0.00 0.00 0.00 23.12 19.45 2o2r s ALA 816 CO 0.01 -0.62 1.15 -0.25 0.00 0.00 0.00 175.76 176.04 2o2r n ASP 817 N 0.24 1.43 0.00 0.00 8.00 -1.26 -1.73 116.55 123.23 2o2r n ASP 817 Ca 0.03 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.68 2o2r n ASP 817 Cb 0.45 -1.24 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 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 1.89 2.81 3.76 0.44 0.00 -1.26 -5.01 105.19 107.82 2o2r n GLY 818 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2o2r n GLY 818 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2o2r s ASP 819 N -3.89 6.99 0.12 1.61 -0.00 -0.70 -4.90 116.67 115.90 2o2r s ASP 819 Ca 0.00 2.44 0.00 0.00 -0.00 0.00 0.00 52.55 54.99 2o2r s ASP 819 Cb 0.00 -2.63 0.00 0.00 -0.00 0.00 0.00 42.92 40.29 2o2r s ASP 819 CO 0.00 -0.35 0.00 0.52 -0.00 0.00 0.00 175.17 175.34 2o2r n VAL 820 N 0.91 0.20 0.11 -1.27 0.31 -1.26 -4.79 118.33 112.53 2o2r n VAL 820 Ca -0.00 0.07 -0.00 0.00 -0.01 0.00 0.00 64.34 64.39 2o2r n VAL 820 Cb 0.44 -0.82 0.29 0.00 -0.91 0.00 0.00 33.84 32.83 2o2r n VAL 820 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2o2r h ASP 821 N 0.00 0.21 -0.25 4.52 3.32 -1.99 -1.58 116.42 120.65 2o2r h ASP 821 Ca 0.00 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.90 2o2r h ASP 821 Cb 0.15 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 2o2r h ASP 821 CO 0.00 0.53 -0.13 0.00 -1.72 0.00 0.00 179.24 177.92 2o2r h ALA 822 N 1.48 0.35 -0.46 3.45 0.00 -1.97 -1.48 119.26 120.63 2o2r h ALA 822 Ca 0.02 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 2o2r h ALA 822 Cb 0.67 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2o2r h ALA 822 CO 0.05 0.22 -0.25 -0.24 0.00 0.00 0.00 179.25 179.03 2o2r h VAL 823 N 0.26 1.27 -0.55 0.00 3.04 -1.82 -2.69 116.25 115.76 2o2r h VAL 823 Ca 0.06 -1.42 0.08 0.00 -1.01 0.00 0.00 66.70 64.41 2o2r h VAL 823 Cb 0.64 1.18 -0.07 0.00 -2.01 0.00 0.00 31.29 31.03 2o2r h VAL 823 CO 0.04 0.49 0.18 -0.07 -1.01 0.00 0.00 177.57 177.20 2o2r h LEU 824 N 0.84 0.15 -0.61 3.16 3.38 -1.30 0.15 115.31 121.09 2o2r h LEU 824 Ca 0.10 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.20 2o2r h LEU 824 Cb 0.84 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 2o2r h LEU 824 CO 0.07 0.10 0.32 -1.28 0.09 0.00 0.00 178.44 177.74 2o2r h SER 825 N 0.35 0.45 -0.21 -0.43 0.87 -1.14 0.53 113.55 113.97 2o2r h SER 825 Ca 0.27 0.03 -0.14 0.00 -1.23 0.00 0.00 61.79 60.73 2o2r h SER 825 Cb 0.33 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 2o2r h SER 825 CO -0.30 0.30 -0.36 0.03 -0.53 0.00 0.00 176.83 175.97 2o2r h ARG 826 N 0.59 0.74 -0.46 2.24 3.08 -1.01 -2.25 114.38 117.31 2o2r h ARG 826 Ca 0.27 -0.37 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 2o2r h ARG 826 Cb 0.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2o2r h ARG 826 CO -0.19 0.98 0.04 0.00 -1.07 0.00 0.00 179.97 179.74 2o2r h ALA 827 N 0.98 1.22 -0.01 0.04 0.00 -0.33 -2.92 119.26 118.24 2o2r h ALA 827 Ca 0.06 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2o2r h ALA 827 Cb 0.90 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2o2r h ALA 827 CO 0.08 0.52 -0.15 0.09 0.00 0.00 0.00 179.25 179.79 2o2r n ASN 828 N -4.25 0.65 -3.53 0.00 3.02 0.14 -4.56 115.26 106.73 2o2r n ASN 828 Ca 0.03 -0.68 -0.40 0.00 -0.03 0.00 0.00 54.58 53.49 2o2r n ASN 828 Cb 0.26 -0.01 -0.01 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 -0.84 6.62 -3.13 5.41 0.00 -0.86 -4.81 120.51 122.90 2o2r n ALA 829 Ca 0.14 -3.86 -0.12 0.00 0.00 0.00 0.00 53.44 49.59 2o2r n ALA 829 Cb 0.30 -3.20 -0.08 0.00 0.00 0.00 0.00 19.45 16.47 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 1.28 0.07 -1.64 0.00 -1.32 -1.26 -5.03 115.64 107.74 2o2r s THR 830 Ca 0.56 -0.58 0.30 0.00 -1.21 0.00 0.00 61.69 60.76 2o2r s THR 830 Cb 0.16 -0.74 0.55 0.00 -1.51 0.00 0.00 72.50 70.96 2o2r s THR 830 CO -0.07 -0.32 1.98 -0.62 -2.21 0.00 0.00 174.62 173.39 2o2r n GLU 831 N 1.00 0.66 -2.80 7.08 -0.58 -1.26 -4.85 120.64 119.89 2o2r n GLU 831 Ca -0.20 -0.13 -0.22 0.00 -0.42 0.00 0.00 57.16 56.18 2o2r n GLU 831 Cb 0.57 -1.50 0.02 0.00 -0.57 0.00 0.00 31.44 29.97 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 -2.43 3.05 -0.36 -0.32 0.08 -1.26 -0.90 117.98 115.84 2o2r s PHE 832 Ca 0.32 0.12 0.05 0.00 0.12 0.00 0.00 56.93 57.54 2o2r s PHE 832 Cb 0.20 -2.54 0.24 0.00 -0.57 0.00 0.00 43.02 40.36 2o2r s PHE 832 CO 0.45 -0.62 1.22 0.41 -0.10 0.00 0.00 175.22 176.58 2o2r n GLY 833 N -2.22 -0.15 0.07 4.36 0.00 -1.20 -4.82 105.19 101.22 2o2r n GLY 833 Ca 0.05 0.15 -0.05 0.00 0.00 0.00 0.00 46.02 46.16 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 1.86 0.00 0.00 0.99 5.85 -1.82 0.40 115.31 122.58 2o2r h LEU 834 Ca -0.38 -0.04 -0.37 0.00 0.84 0.00 0.00 57.88 57.93 2o2r h LEU 834 Cb 1.23 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 42.16 2o2r h LEU 834 CO -0.08 0.76 -0.36 0.00 -0.34 0.00 0.00 178.44 178.42 2o2r n ALA 835 N -3.49 0.55 -3.58 1.25 0.00 -1.26 -2.31 120.51 111.66 2o2r n ALA 835 Ca -0.08 -1.51 0.02 0.00 0.00 0.00 0.00 53.44 51.88 2o2r n ALA 835 Cb 0.25 1.20 -0.00 0.00 0.00 0.00 0.00 19.45 20.90 2o2r n ALA 835 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2o2r s SER 836 N -2.81 -0.01 0.12 0.00 1.04 -0.63 -4.03 113.70 107.38 2o2r s SER 836 Ca 0.29 -0.01 -0.24 0.00 0.48 0.00 0.00 55.95 56.47 2o2r s SER 836 Cb 0.01 0.02 0.07 0.00 0.10 0.00 0.00 66.02 66.23 2o2r s SER 836 CO 0.21 -0.04 0.64 -0.83 0.98 0.00 0.00 173.24 174.20 2o2r s GLY 837 N -2.78 -0.60 -0.10 7.32 0.00 -0.14 -0.94 107.32 110.08 2o2r s GLY 837 Ca 0.14 0.64 -0.05 0.00 0.00 0.00 0.00 44.72 45.46 2o2r s GLY 837 CO -0.06 0.27 0.23 0.54 0.00 0.00 0.00 173.10 174.08 2o2r s VAL 838 N -3.40 -0.08 -0.20 1.40 0.11 0.01 -0.94 120.40 117.31 2o2r s VAL 838 Ca 0.00 0.17 -0.04 0.00 -2.93 0.00 0.00 61.98 59.18 2o2r s VAL 838 Cb -0.01 -0.36 -0.02 0.00 -1.53 0.00 0.00 36.38 34.46 2o2r s VAL 838 CO -0.10 0.07 -0.02 -0.36 -3.33 0.00 0.00 175.10 171.36 2o2r s PHE 839 N 1.36 3.00 -0.24 1.54 0.08 -0.12 -1.06 117.98 122.55 2o2r s PHE 839 Ca -0.08 -0.56 -0.28 0.00 0.12 0.00 0.00 56.93 56.13 2o2r s PHE 839 Cb -0.11 -2.06 0.15 0.00 -0.57 0.00 0.00 43.02 40.43 2o2r s PHE 839 CO -0.08 -0.29 1.15 -0.08 -0.10 0.00 0.00 175.22 175.82 2o2r s THR 840 N 1.02 0.00 -0.97 0.64 -1.32 -1.26 -1.60 115.64 112.15 2o2r s THR 840 Ca 0.01 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.75 2o2r s THR 840 Cb -0.14 -1.00 0.08 0.00 -1.51 0.00 0.00 72.50 69.93 2o2r s THR 840 CO 0.01 0.00 1.57 0.54 -2.21 0.00 0.00 174.62 174.53 2o2r n ARG 841 N 1.28 0.03 -2.64 7.08 1.74 -1.03 -4.85 116.66 118.27 2o2r n ARG 841 Ca -0.09 0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.57 2o2r n ARG 841 Cb 0.57 -1.52 -0.02 0.00 -1.02 0.00 0.00 32.46 30.47 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 -3.11 6.69 0.27 0.55 3.68 -1.26 -4.94 116.67 118.55 2o2r s ASP 842 Ca 0.12 0.57 -0.01 0.00 2.13 0.00 0.00 52.55 55.36 2o2r s ASP 842 Cb 0.18 -2.54 0.45 0.00 -1.45 0.00 0.00 42.92 39.56 2o2r s ASP 842 CO 0.65 -1.13 1.86 -0.29 0.13 0.00 0.00 175.17 176.38 2o2r h ILE 843 N 6.09 1.02 -0.44 4.11 2.10 -2.00 -1.36 117.51 127.03 2o2r h ILE 843 Ca -0.23 -0.37 -0.13 0.00 1.08 0.00 0.00 64.86 65.22 2o2r h ILE 843 Cb 1.06 -0.16 -0.01 0.00 -1.09 0.00 0.00 36.82 36.62 2o2r h ILE 843 CO 1.09 0.20 -0.21 0.78 -1.08 0.00 0.00 178.15 178.93 2o2r h ASN 844 N 1.09 0.95 -0.29 2.19 2.35 -2.00 -1.97 115.58 117.91 2o2r h ASN 844 Ca 0.45 -0.40 -0.06 0.00 -0.55 0.00 0.00 56.30 55.74 2o2r h ASN 844 Cb 0.29 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 2o2r h ASN 844 CO -0.21 1.14 -0.04 0.11 -1.65 0.00 0.00 177.43 176.79 2o2r h LYS 845 N 0.76 0.53 -0.23 0.81 1.57 -1.90 -2.40 116.57 115.70 2o2r h LYS 845 Ca 0.10 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2o2r h LYS 845 Cb 0.78 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 2o2r h LYS 845 CO 0.06 0.71 0.14 0.00 -0.57 0.00 0.00 179.45 179.80 2o2r h ALA 846 N 0.80 0.29 -0.39 3.86 0.00 -1.15 -0.66 119.26 122.02 2o2r h ALA 846 Ca 0.08 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 2o2r h ALA 846 Cb 0.50 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2o2r h ALA 846 CO 0.02 -0.25 0.03 -0.07 0.00 0.00 0.00 179.25 178.99 2o2r h LEU 847 N 0.30 0.64 -0.19 0.00 3.38 -1.43 -1.52 115.31 116.50 2o2r h LEU 847 Ca 0.09 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2o2r h LEU 847 Cb -0.02 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2o2r h LEU 847 CO -0.03 0.77 0.07 0.22 0.09 0.00 0.00 178.44 179.56 2o2r h TYR 848 N 0.50 0.29 -0.65 1.13 3.20 -1.32 -1.56 116.97 118.56 2o2r h TYR 848 Ca 0.11 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.93 2o2r h TYR 848 Cb 0.42 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 2o2r h TYR 848 CO 0.03 0.35 0.27 0.28 -1.64 0.00 0.00 178.16 177.45 2o2r h VAL 849 N 0.15 1.23 -0.65 1.81 2.07 -1.14 -2.07 116.25 117.66 2o2r h VAL 849 Ca 0.06 -0.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 2o2r h VAL 849 Cb 0.18 0.50 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 2o2r h VAL 849 CO -0.00 0.29 0.12 0.77 0.02 0.00 0.00 177.57 178.76 2o2r h SER 850 N 0.91 1.01 -0.75 0.57 4.64 -1.18 -0.79 113.55 117.96 2o2r h SER 850 Ca 0.22 -0.23 0.10 0.00 -0.47 0.00 0.00 61.79 61.40 2o2r h SER 850 Cb 0.19 -0.27 -0.07 0.00 -0.31 0.00 0.00 62.40 61.94 2o2r h SER 850 CO -0.02 1.00 0.39 0.44 -0.87 0.00 0.00 176.83 177.77 2o2r h ASP 851 N 1.00 0.52 0.97 4.97 3.32 -1.07 -3.24 116.42 122.90 2o2r h ASP 851 Ca 0.20 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.31 2o2r h ASP 851 Cb 0.41 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.93 2o2r h ASP 851 CO 0.01 0.29 -0.56 0.11 -1.72 0.00 0.00 179.24 177.37 2o2r h LYS 852 N 0.66 0.00 -6.52 3.56 1.79 -0.72 -3.46 116.57 111.88 2o2r h LYS 852 Ca 0.37 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 58.31 2o2r h LYS 852 Cb 0.39 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.06 2o2r h LYS 852 CO -0.27 0.00 0.64 -0.51 -1.08 0.00 0.00 179.45 178.23 2o2r s LEU 853 N -4.37 4.37 -1.23 2.94 1.43 -0.36 -4.93 118.68 116.54 2o2r s LEU 853 Ca 0.06 2.18 -0.07 0.00 -1.03 0.00 0.00 54.13 55.28 2o2r s LEU 853 Cb 0.13 -3.58 0.20 0.00 0.03 0.00 0.00 46.19 42.96 2o2r s LEU 853 CO 0.71 -0.56 1.92 0.00 0.23 0.00 0.00 176.35 178.65 2o2r n GLN 854 N 3.90 4.17 -3.84 1.70 1.13 -1.26 -4.93 117.38 118.25 2o2r n GLN 854 Ca 0.10 -3.80 -0.12 0.00 -1.94 0.00 0.00 57.00 51.24 2o2r n GLN 854 Cb 0.44 -2.74 -0.10 0.00 0.11 0.00 0.00 30.24 27.95 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 -0.98 -0.41 0.54 -1.58 0.00 -1.26 -4.49 121.76 113.57 2o2r s ALA 855 Ca 0.41 0.10 0.19 0.00 0.00 0.00 0.00 51.96 52.67 2o2r s ALA 855 Cb 0.12 -0.02 1.40 0.00 0.00 0.00 0.00 23.12 24.62 2o2r s ALA 855 CO -0.01 -0.18 2.17 0.78 0.00 0.00 0.00 175.76 178.53 2o2r h GLY 856 N 4.70 0.00 -5.70 0.00 0.00 -1.12 -3.41 103.07 97.53 2o2r h GLY 856 Ca -0.29 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.67 2o2r h GLY 856 CO 0.40 0.00 -0.76 -1.59 0.00 0.00 0.00 176.54 174.59 2o2r s THR 857 N -4.97 0.49 -0.16 4.70 2.01 -0.98 -4.75 115.64 111.99 2o2r s THR 857 Ca -0.05 -0.20 0.01 0.00 0.31 0.00 0.00 61.69 61.77 2o2r s THR 857 Cb 0.17 -0.46 0.02 0.00 0.01 0.00 0.00 72.50 72.23 2o2r s THR 857 CO 0.64 0.17 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.87 2o2r s VAL 858 N 0.29 1.87 -0.06 3.82 1.01 -1.26 -1.60 120.40 124.47 2o2r s VAL 858 Ca -0.03 -0.83 -0.15 0.00 0.00 0.00 0.00 61.98 60.97 2o2r s VAL 858 Cb -0.07 -1.70 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 2o2r s VAL 858 CO -0.00 0.51 0.38 -0.36 0.00 0.00 0.00 175.10 175.62 2o2r s PHE 859 N 1.21 3.62 -0.25 5.22 0.08 -0.12 -4.96 117.98 122.79 2o2r s PHE 859 Ca 0.01 0.85 0.02 0.00 0.12 0.00 0.00 56.93 57.94 2o2r s PHE 859 Cb -0.14 -2.32 0.05 0.00 -0.57 0.00 0.00 43.02 40.04 2o2r s PHE 859 CO -0.09 0.48 -0.12 0.42 -0.10 0.00 0.00 175.22 175.81 2o2r s ILE 860 N -0.43 2.22 -1.79 0.64 1.01 -1.26 -0.81 121.20 120.78 2o2r s ILE 860 Ca 0.22 -1.46 0.00 0.00 0.00 0.00 0.00 60.65 59.41 2o2r s ILE 860 Cb -0.15 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.09 2o2r s ILE 860 CO 0.10 0.09 0.00 0.59 0.00 0.00 0.00 174.94 175.72 2o2r n ASN 861 N 4.49 -5.64 -2.87 3.58 3.02 -0.22 -4.95 115.26 112.66 2o2r n ASN 861 Ca -0.15 0.08 -0.09 0.00 -0.03 0.00 0.00 54.58 54.39 2o2r n ASN 861 Cb 0.44 -4.71 0.03 0.00 -0.61 0.00 0.00 39.78 34.92 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 -2.94 0.00 0.09 3.41 -1.32 -1.26 -5.07 115.64 108.54 2o2r s THR 862 Ca 0.00 -1.02 -0.25 0.00 -1.21 0.00 0.00 61.69 59.21 2o2r s THR 862 Cb 0.00 -2.93 0.07 0.00 -1.51 0.00 0.00 72.50 68.13 2o2r s THR 862 CO 0.00 0.00 0.64 -0.47 -2.21 0.00 0.00 174.62 172.58 2o2r s TYR 863 N -2.22 -0.56 -1.76 9.09 5.04 -1.26 -4.77 117.35 120.90 2o2r s TYR 863 Ca 0.16 0.54 0.00 0.00 -2.44 0.00 0.00 57.07 55.33 2o2r s TYR 863 Cb -0.05 0.52 0.00 0.00 0.35 0.00 0.00 41.96 42.78 2o2r s TYR 863 CO 0.12 -0.76 0.00 0.09 -1.34 0.00 0.00 175.55 173.66 2o2r n ASN 864 N -0.02 -5.59 -4.19 4.32 3.02 -1.26 -4.90 115.26 106.64 2o2r n ASN 864 Ca -0.17 0.41 -0.43 0.00 -0.03 0.00 0.00 54.58 54.36 2o2r n ASN 864 Cb 0.63 -4.55 0.00 0.00 -0.61 0.00 0.00 39.78 35.24 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 -1.72 3.39 -2.57 3.52 3.00 -1.26 -4.97 118.16 117.55 2o2r n LYS 865 Ca -0.17 -3.55 -0.27 0.00 -0.00 0.00 0.00 58.31 54.32 2o2r n LYS 865 Cb 0.64 -3.08 0.01 0.00 0.00 0.00 0.00 35.03 32.61 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 1.60 4.40 -0.11 3.15 -4.23 -1.26 -5.10 115.64 114.09 2o2r s THR 866 Ca 0.43 0.08 -0.16 0.00 -1.18 0.00 0.00 61.69 60.87 2o2r s THR 866 Cb 0.04 -3.69 0.04 0.00 1.34 0.00 0.00 72.50 70.23 2o2r s THR 866 CO 0.00 -0.68 0.42 -0.62 -0.54 0.00 0.00 174.62 173.20 2o2r s ASP 867 N -4.18 -0.39 0.66 3.99 -1.08 -1.26 -5.03 116.67 109.37 2o2r s ASP 867 Ca 0.50 0.63 0.44 0.00 -0.52 0.00 0.00 52.55 53.59 2o2r s ASP 867 Cb -0.10 0.69 2.38 0.00 -1.46 0.00 0.00 42.92 44.42 2o2r s ASP 867 CO 0.45 -0.27 2.36 -0.37 0.52 0.00 0.00 175.17 177.85 2o2r h VAL 868 N 4.17 0.04 -0.00 1.11 -1.51 -1.94 -1.12 116.25 116.99 2o2r h VAL 868 Ca -0.28 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 65.18 2o2r h VAL 868 Cb 1.18 1.01 0.00 0.00 -2.13 0.00 0.00 31.29 31.35 2o2r h VAL 868 CO 0.30 0.00 -0.41 0.00 -1.23 0.00 0.00 177.57 176.23 2o2r n ALA 869 N -2.10 3.37 -3.32 5.19 0.00 -1.26 -0.63 120.51 121.77 2o2r n ALA 869 Ca -0.03 -0.38 -0.37 0.00 0.00 0.00 0.00 53.44 52.67 2o2r n ALA 869 Cb 0.08 -1.12 -0.13 0.00 0.00 0.00 0.00 19.45 18.28 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 -2.79 2.98 0.46 0.00 0.00 -0.43 -4.01 121.76 117.97 2o2r s ALA 870 Ca 0.17 -1.49 -0.25 0.00 0.00 0.00 0.00 51.96 50.38 2o2r s ALA 870 Cb 0.18 -2.05 -0.08 0.00 0.00 0.00 0.00 23.12 21.17 2o2r s ALA 870 CO 0.63 -0.95 1.41 -1.25 0.00 0.00 0.00 175.76 175.60 2o2r s PRO 871 N 1.44 3.63 -0.09 0.00 0.04 -1.25 -4.38 135.00 134.39 2o2r s PRO 871 Ca 0.01 2.38 -0.00 0.00 0.04 0.00 0.00 61.00 63.43 2o2r s PRO 871 Cb -0.17 -2.61 0.02 0.00 0.04 0.00 0.00 34.50 31.78 2o2r s PRO 871 CO 0.01 -0.85 -0.05 0.12 0.04 0.00 0.00 177.00 176.27 2o2r s PHE 872 N -1.22 1.14 -0.02 0.56 5.36 0.34 -4.97 117.98 119.18 2o2r s PHE 872 Ca 0.62 -0.48 -0.30 0.00 -0.96 0.00 0.00 56.93 55.80 2o2r s PHE 872 Cb -0.43 -1.02 0.12 0.00 -0.34 0.00 0.00 43.02 41.35 2o2r s PHE 872 CO 0.55 -0.40 1.29 0.20 -1.46 0.00 0.00 175.22 175.39 2o2r s GLY 873 N 1.65 -0.41 0.38 13.12 0.00 -1.26 -1.04 107.32 119.76 2o2r s GLY 873 Ca 0.02 0.67 0.08 0.00 0.00 0.00 0.00 44.72 45.49 2o2r s GLY 873 CO -0.06 0.28 0.33 -0.32 0.00 0.00 0.00 173.10 173.34 2o2r s GLY 874 N -3.01 1.98 0.35 0.20 0.00 -1.26 -4.06 107.32 101.51 2o2r s GLY 874 Ca 0.15 -1.78 0.08 0.00 0.00 0.00 0.00 44.72 43.16 2o2r s GLY 874 CO -0.04 -1.65 0.20 -1.36 0.00 0.00 0.00 173.10 170.25 2o2r s PHE 875 N -2.40 2.76 0.00 1.90 0.08 0.04 -4.14 117.98 116.22 2o2r s PHE 875 Ca 0.45 -0.37 0.00 0.00 0.12 0.00 0.00 56.93 57.12 2o2r s PHE 875 Cb -0.04 -1.73 0.00 0.00 -0.57 0.00 0.00 43.02 40.68 2o2r s PHE 875 CO 0.27 0.26 0.00 1.63 -0.10 0.00 0.00 175.22 177.28 2o2r n LYS 876 N -1.24 0.00 0.00 0.44 5.02 -1.26 -1.49 118.16 119.63 2o2r n LYS 876 Ca -0.02 0.00 0.16 0.00 -2.02 0.00 0.00 58.31 56.42 2o2r n LYS 876 Cb 0.61 0.00 0.88 0.00 -0.02 0.00 0.00 35.03 36.50 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 0.78 0.00 1.97 6.02 -0.07 -2.11 117.38 137.97 2o2r n GLN 877 Ca 0.00 -0.00 0.10 0.00 -0.01 0.00 0.00 57.00 57.09 2o2r n GLN 877 Cb 0.00 -1.50 0.59 0.00 1.02 0.00 0.00 30.24 30.35 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 -1.11 0.00 0.00 1.08 7.64 -0.55 -4.74 113.62 115.94 2o2r n SER 878 Ca 0.20 -0.41 0.00 0.00 1.01 0.00 0.00 58.87 59.67 2o2r n SER 878 Cb 0.16 -0.11 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 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 0.37 -0.46 3.40 0.23 0.00 -0.90 -1.13 105.19 106.72 2o2r n GLY 879 Ca 0.14 -1.98 -0.11 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.29 0.00 1.61 -0.12 -0.58 -4.14 117.98 114.46 2o2r s PHE 880 Ca 0.00 -0.00 0.00 0.00 -0.05 0.00 0.00 56.93 56.88 2o2r s PHE 880 Cb 0.00 0.39 0.00 0.00 -0.63 0.00 0.00 43.02 42.78 2o2r s PHE 880 CO 0.00 -0.80 0.00 0.41 -0.05 0.00 0.00 175.22 174.78 2o2r n GLY 881 N -0.30 0.34 3.35 1.99 0.00 -1.26 -1.79 105.19 107.51 2o2r n GLY 881 Ca -0.15 -1.67 -0.31 0.00 0.00 0.00 0.00 46.02 43.89 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 -3.36 1.99 0.12 1.61 -0.14 -1.26 -4.37 119.74 114.33 2o2r s LYS 882 Ca 0.00 -1.01 0.01 0.00 -1.36 0.00 0.00 55.97 53.61 2o2r s LYS 882 Cb 0.00 -2.04 -0.04 0.00 -1.68 0.00 0.00 37.83 34.07 2o2r s LYS 882 CO 0.00 0.54 0.27 -0.51 -0.76 0.00 0.00 175.35 174.89 2o2r s ASP 883 N -0.97 6.36 0.18 2.83 1.01 -0.20 -4.15 116.67 121.72 2o2r s ASP 883 Ca 0.11 0.25 0.00 0.00 0.71 0.00 0.00 52.55 53.62 2o2r s ASP 883 Cb -0.10 -1.95 0.00 0.00 1.01 0.00 0.00 42.92 41.88 2o2r s ASP 883 CO 0.01 0.09 0.00 0.18 0.21 0.00 0.00 175.17 175.66 2o2r n LEU 884 N -0.22 -0.43 -0.18 1.23 4.77 -1.26 -0.50 117.00 120.41 2o2r n LEU 884 Ca -0.06 0.80 0.02 0.00 -0.03 0.00 0.00 56.01 56.74 2o2r n LEU 884 Cb 0.53 -0.46 -0.01 0.00 -2.33 0.00 0.00 43.42 41.15 2o2r n LEU 884 CO 0.50 -0.38 -0.05 0.61 -1.33 0.00 0.00 177.39 176.74 2o2r n GLY 885 N -2.14 -1.94 0.37 -0.72 0.00 0.20 -3.37 105.19 97.60 2o2r n GLY 885 Ca -0.01 -1.46 0.05 0.00 0.00 0.00 0.00 46.02 44.61 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 -0.17 0.99 -0.51 1.61 4.81 -1.88 -2.92 114.58 116.51 2o2r h GLU 886 Ca -0.01 -0.06 0.12 0.00 -0.13 0.00 0.00 59.36 59.28 2o2r h GLU 886 Cb 0.16 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 2o2r h GLU 886 CO 0.01 0.66 0.36 0.00 -0.73 0.00 0.00 179.01 179.30 2o2r h ALA 887 N 1.51 2.29 -0.19 2.92 0.00 -1.94 -1.93 119.26 121.92 2o2r h ALA 887 Ca 0.43 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 2o2r h ALA 887 Cb 0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2o2r h ALA 887 CO -0.19 -0.42 0.09 0.00 0.00 0.00 0.00 179.25 178.73 2o2r h ALA 888 N 1.75 1.80 -0.15 0.00 0.00 -1.52 -2.74 119.26 118.39 2o2r h ALA 888 Ca 0.24 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2o2r h ALA 888 Cb 0.76 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2o2r h ALA 888 CO -0.03 0.17 -0.08 -0.07 0.00 0.00 0.00 179.25 179.23 2o2r h LEU 889 N 0.27 0.21 -2.10 0.00 3.38 -1.51 -2.74 115.31 112.82 2o2r h LEU 889 Ca 0.07 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2o2r h LEU 889 Cb 0.03 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2o2r h LEU 889 CO -0.01 0.33 -0.08 0.78 0.09 0.00 0.00 178.44 179.55 2o2r h ASN 890 N 0.22 0.00 0.95 -0.43 2.35 -1.63 -0.58 115.58 116.46 2o2r h ASN 890 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2o2r h ASN 890 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 2o2r h ASN 890 CO 0.01 0.08 0.00 -0.33 -1.65 0.00 0.00 177.43 175.54 2o2r h GLU 891 N 0.00 0.00 -0.05 0.81 4.39 -1.64 -3.24 114.58 114.85 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 0.23 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2o2r h GLU 891 CO 0.01 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.52 2o2r n TYR 892 N -2.94 0.07 -4.34 4.33 4.01 -0.25 -4.98 117.16 113.05 2o2r n TYR 892 Ca 0.01 -0.50 -0.23 0.00 -0.16 0.00 0.00 57.90 57.02 2o2r n TYR 892 Cb 0.29 -0.05 -0.11 0.00 -0.31 0.00 0.00 39.34 39.16 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 2.42 0.21 7.72 1.43 -1.07 -3.27 118.68 125.11 2o2r s LEU 893 Ca 0.03 -0.84 0.11 0.00 -1.03 0.00 0.00 54.13 52.41 2o2r s LEU 893 Cb 0.02 -0.89 -0.04 0.00 0.03 0.00 0.00 46.19 45.30 2o2r s LEU 893 CO 0.02 0.00 -0.22 0.00 0.23 0.00 0.00 176.35 176.38 2o2r s ARG 894 N -2.64 1.51 -0.21 1.70 1.70 0.34 -4.82 118.95 116.53 2o2r s ARG 894 Ca 0.15 -1.56 -0.04 0.00 -0.47 0.00 0.00 55.73 53.81 2o2r s ARG 894 Cb -0.07 -1.75 -0.02 0.00 -0.57 0.00 0.00 34.95 32.54 2o2r s ARG 894 CO 0.07 0.37 -0.03 0.42 -1.08 0.00 0.00 175.30 175.04 2o2r s ILE 895 N -1.89 3.59 -0.17 4.99 1.01 -1.26 -0.47 121.20 127.00 2o2r s ILE 895 Ca 0.22 -0.43 -0.07 0.00 0.00 0.00 0.00 60.65 60.37 2o2r s ILE 895 Cb -0.07 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.74 2o2r s ILE 895 CO 0.10 0.43 0.08 -0.75 0.00 0.00 0.00 174.94 174.80 2o2r s LYS 896 N 1.21 3.86 -0.24 2.79 2.20 -0.05 -4.95 119.74 124.57 2o2r s LYS 896 Ca 0.03 -0.30 -0.10 0.00 -0.36 0.00 0.00 55.97 55.23 2o2r s LYS 896 Cb -0.14 -3.21 -0.05 0.00 -1.51 0.00 0.00 37.83 32.92 2o2r s LYS 896 CO -0.00 0.38 0.15 0.99 -0.36 0.00 0.00 175.35 176.50 2o2r s THR 897 N 0.09 5.22 -0.20 3.43 2.01 -1.26 -0.15 115.64 124.77 2o2r s THR 897 Ca 0.06 0.13 -0.02 0.00 0.31 0.00 0.00 61.69 62.17 2o2r s THR 897 Cb -0.12 -3.44 -0.00 0.00 0.01 0.00 0.00 72.50 68.95 2o2r s THR 897 CO 0.00 0.34 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.49 2o2r s VAL 898 N 1.18 3.08 -0.20 3.82 1.01 0.96 -4.98 120.40 125.27 2o2r s VAL 898 Ca 0.07 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.45 2o2r s VAL 898 Cb -0.14 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.89 2o2r s VAL 898 CO 0.05 0.46 -0.17 -0.89 0.00 0.00 0.00 175.10 174.56 2o2r s THR 899 N 1.25 2.25 -0.07 3.92 2.01 -1.26 -1.01 115.64 122.73 2o2r s THR 899 Ca 0.03 -0.99 -0.05 0.00 0.31 0.00 0.00 61.69 61.00 2o2r s THR 899 Cb -0.14 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.31 2o2r s THR 899 CO -0.04 0.44 0.13 -0.36 -0.69 0.00 0.00 174.62 174.11 2o2r s PHE 900 N 1.29 3.52 -0.08 4.92 0.40 0.85 -4.96 117.98 123.91 2o2r s PHE 900 Ca 0.03 0.42 0.01 0.00 -0.60 0.00 0.00 56.93 56.79 2o2r s PHE 900 Cb -0.14 -1.87 -0.03 0.00 0.51 0.00 0.00 43.02 41.49 2o2r s PHE 900 CO -0.11 0.67 -0.08 -2.00 0.70 0.00 0.00 175.22 174.40 2o2r s GLU 901 N -1.35 2.85 0.00 0.44 2.12 -1.26 -2.01 118.70 119.49 2o2r s GLU 901 Ca 0.19 -0.58 0.00 0.00 0.36 0.00 0.00 54.97 54.94 2o2r s GLU 901 Cb -0.12 -2.59 0.00 0.00 0.26 0.00 0.00 34.13 31.68 2o2r s GLU 901 CO 0.09 0.58 0.00 2.48 -0.54 0.00 0.00 175.26 177.87