#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ckr h GLU 384 N 0.00 -0.58 -4.66 1.43 4.39 -2.13 -3.31 114.58 109.72 1ckr h GLU 384 Ca 0.00 0.04 -0.71 0.00 0.34 0.00 0.00 59.36 59.03 1ckr h GLU 384 Cb 0.00 0.13 -0.08 0.00 -0.10 0.00 0.00 28.75 28.70 1ckr h GLU 384 CO 0.00 -0.33 2.50 0.09 -1.16 0.00 0.00 179.01 180.12 1ckr n ASN 385 N -5.30 4.53 -3.99 1.42 4.13 -1.26 -4.90 115.26 109.89 1ckr n ASN 385 Ca -0.11 -2.92 -0.43 0.00 1.68 0.00 0.00 54.58 52.81 1ckr n ASN 385 Cb 0.28 -1.66 0.00 0.00 -1.54 0.00 0.00 39.78 36.86 1ckr n ASN 385 CO 0.00 0.00 0.00 0.55 0.28 0.00 0.00 177.26 178.09 1ckr n VAL 386 N 5.28 3.90 -3.45 2.41 3.14 -1.25 -4.89 118.33 123.47 1ckr n VAL 386 Ca 0.48 -3.81 -0.37 0.00 -2.96 0.00 0.00 64.34 57.68 1ckr n VAL 386 Cb 0.41 -2.47 -0.04 0.00 -1.06 0.00 0.00 33.84 30.68 1ckr n VAL 386 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1ckr n GLN 387 N 5.72 3.10 0.00 1.45 6.02 -1.26 -4.99 117.38 127.41 1ckr n GLN 387 Ca 0.46 -4.52 0.00 0.00 -0.01 0.00 0.00 57.00 52.93 1ckr n GLN 387 Cb 0.40 -2.42 0.00 0.00 1.02 0.00 0.00 30.24 29.23 1ckr n GLN 387 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1ckr n ASP 388 N 1.91 0.00 -4.51 1.08 -0.08 -1.26 -4.99 116.55 108.71 1ckr n ASP 388 Ca 0.24 0.00 -0.43 0.00 -1.51 0.00 0.00 54.79 53.09 1ckr n ASP 388 Cb 0.37 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.82 1ckr n ASP 388 CO 0.00 0.00 0.00 -0.22 0.12 0.00 0.00 177.20 177.10 1ckr s LEU 389 N 0.00 4.44 -1.08 -2.67 1.98 -1.26 -4.95 118.68 115.13 1ckr s LEU 389 Ca 0.00 -2.30 -0.17 0.00 -2.89 0.00 0.00 54.13 48.76 1ckr s LEU 389 Cb 0.00 -2.48 0.13 0.00 0.66 0.00 0.00 46.19 44.50 1ckr s LEU 389 CO 0.00 -1.09 1.34 -0.76 -1.89 0.00 0.00 176.35 173.95 1ckr s LEU 390 N 3.20 4.75 0.41 -0.68 1.02 -1.26 -5.02 118.68 121.09 1ckr s LEU 390 Ca 0.44 -2.36 -0.14 0.00 0.02 0.00 0.00 54.13 52.09 1ckr s LEU 390 Cb -0.01 -2.44 -0.08 0.00 0.02 0.00 0.00 46.19 43.68 1ckr s LEU 390 CO -0.02 -1.01 0.83 -1.48 0.02 0.00 0.00 176.35 174.68 1ckr s LEU 391 N 2.72 3.86 -0.10 1.79 0.05 -1.26 -5.11 118.68 120.63 1ckr s LEU 391 Ca 0.40 1.33 -0.14 0.00 0.05 0.00 0.00 54.13 55.77 1ckr s LEU 391 Cb -0.03 -4.20 0.03 0.00 -2.05 0.00 0.00 46.19 39.94 1ckr s LEU 391 CO -0.04 -0.38 0.36 -1.48 -0.55 0.00 0.00 176.35 174.26 1ckr s LEU 392 N -3.57 0.62 -0.42 1.48 -0.00 -1.26 -5.12 118.68 110.41 1ckr s LEU 392 Ca 0.55 0.53 -0.07 0.00 -0.00 0.00 0.00 54.13 55.14 1ckr s LEU 392 Cb -0.10 1.32 0.10 0.00 -0.00 0.00 0.00 46.19 47.50 1ckr s LEU 392 CO 0.25 -0.25 0.25 -0.62 -0.00 0.00 0.00 176.35 175.98 1ckr s ASP 393 N -0.35 5.50 -0.01 1.48 -1.08 -1.26 -5.10 116.67 115.85 1ckr s ASP 393 Ca -0.05 -1.73 0.00 0.00 -0.52 0.00 0.00 52.55 50.26 1ckr s ASP 393 Cb -0.03 -1.93 -0.04 0.00 -1.46 0.00 0.00 42.92 39.46 1ckr s ASP 393 CO 0.02 -0.56 0.03 0.68 0.52 0.00 0.00 175.17 175.86 1ckr s VAL 394 N 1.32 4.35 -0.06 1.11 -7.23 -1.26 -1.77 120.40 116.86 1ckr s VAL 394 Ca 0.04 -0.50 -0.19 0.00 -1.81 0.00 0.00 61.98 59.53 1ckr s VAL 394 Cb -0.24 -2.94 -0.05 0.00 0.56 0.00 0.00 36.38 33.72 1ckr s VAL 394 CO -0.01 0.40 0.53 0.28 -0.31 0.00 0.00 175.10 175.99 1ckr s THR 395 N -1.09 5.06 0.52 5.32 -1.32 -0.97 -4.88 115.64 118.28 1ckr s THR 395 Ca 0.20 1.08 0.21 0.00 -1.21 0.00 0.00 61.69 61.97 1ckr s THR 395 Cb -0.12 -3.86 0.35 0.00 -1.51 0.00 0.00 72.50 67.36 1ckr s THR 395 CO 0.10 0.38 2.05 1.55 -2.21 0.00 0.00 174.62 176.49 1ckr h PRO 396 N 6.14 0.02 -6.09 7.08 0.13 -1.94 -2.84 132.00 134.49 1ckr h PRO 396 Ca -0.44 -0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.14 1ckr h PRO 396 Cb 1.19 -0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 1ckr h PRO 396 CO 0.72 0.01 -0.57 -1.17 -0.23 0.00 0.00 178.00 176.76 1ckr s LEU 397 N -8.89 3.19 -0.23 1.56 2.96 -1.26 -2.53 118.68 113.47 1ckr s LEU 397 Ca -0.05 -0.80 -0.19 0.00 -0.22 0.00 0.00 54.13 52.87 1ckr s LEU 397 Cb 0.19 -1.65 -0.03 0.00 0.50 0.00 0.00 46.19 45.20 1ckr s LEU 397 CO 0.71 -0.24 0.54 -0.55 -1.32 0.00 0.00 176.35 175.49 1ckr s SER 398 N -3.79 6.51 -0.26 3.68 0.15 -1.22 -4.56 113.70 114.21 1ckr s SER 398 Ca 0.36 0.62 -0.09 0.00 0.70 0.00 0.00 55.95 57.54 1ckr s SER 398 Cb -0.02 -2.29 -0.03 0.00 -1.71 0.00 0.00 66.02 61.96 1ckr s SER 398 CO 0.21 -0.26 0.11 -0.76 1.20 0.00 0.00 173.24 173.75 1ckr s LEU 399 N 2.07 3.64 0.00 3.45 1.43 -1.26 -2.77 118.68 125.23 1ckr s LEU 399 Ca 0.23 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.17 1ckr s LEU 399 Cb -0.16 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.08 1ckr s LEU 399 CO 0.09 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.24 1ckr n GLY 400 N 4.97 5.46 3.05 -3.19 0.00 -1.08 -4.47 105.19 109.93 1ckr n GLY 400 Ca -0.15 -1.22 -0.10 0.00 0.00 0.00 0.00 46.02 44.55 1ckr n GLY 400 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ckr s ILE 401 N 2.17 0.11 -0.46 -0.61 -4.36 -1.08 -2.54 121.20 114.44 1ckr s ILE 401 Ca 0.00 -0.91 -0.20 0.00 -0.26 0.00 0.00 60.65 59.28 1ckr s ILE 401 Cb 0.00 -0.49 0.03 0.00 1.25 0.00 0.00 42.46 43.25 1ckr s ILE 401 CO 0.00 -0.50 0.65 -0.70 0.24 0.00 0.00 174.94 174.63 1ckr s GLU 402 N -1.75 3.24 0.00 0.37 -6.30 0.27 -2.53 118.70 112.00 1ckr s GLU 402 Ca -0.13 -0.50 0.00 0.00 -2.50 0.00 0.00 54.97 51.85 1ckr s GLU 402 Cb -0.07 -3.99 0.00 0.00 0.00 0.00 0.00 34.13 30.07 1ckr s GLU 402 CO -0.01 -1.08 0.00 0.25 0.02 0.00 0.00 175.26 174.44 1ckr n THR 403 N 5.80 0.00 -2.15 -1.70 -2.24 -0.79 -3.22 114.28 109.99 1ckr n THR 403 Ca -0.03 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.32 1ckr n THR 403 Cb 0.47 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.68 1ckr n THR 403 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ckr s ALA 404 N -2.43 3.11 0.00 6.98 0.00 -1.20 -1.03 121.76 127.19 1ckr s ALA 404 Ca 0.00 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.22 1ckr s ALA 404 Cb 0.00 -3.91 0.00 0.00 0.00 0.00 0.00 23.12 19.21 1ckr s ALA 404 CO 0.00 -2.23 0.00 0.41 0.00 0.00 0.00 175.76 173.94 1ckr n GLY 405 N 4.95 0.50 1.47 0.00 0.00 -1.26 -4.32 105.19 106.53 1ckr n GLY 405 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1ckr n GLY 405 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ckr n GLY 406 N -2.09 0.77 3.79 -0.02 0.00 -0.19 -4.99 105.19 102.46 1ckr n GLY 406 Ca 0.00 -0.67 -0.22 0.00 0.00 0.00 0.00 46.02 45.13 1ckr n GLY 406 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ckr s VAL 407 N -2.00 4.19 -0.13 1.61 -7.23 -1.25 -4.16 120.40 111.43 1ckr s VAL 407 Ca 0.00 -1.50 -0.29 0.00 -1.81 0.00 0.00 61.98 58.38 1ckr s VAL 407 Cb 0.00 -3.28 -0.02 0.00 0.56 0.00 0.00 36.38 33.64 1ckr s VAL 407 CO 0.00 -0.34 1.16 -0.32 -0.31 0.00 0.00 175.10 175.29 1ckr s MET 408 N -3.82 4.30 -0.10 4.82 1.75 -1.22 -1.88 119.30 123.15 1ckr s MET 408 Ca 0.33 1.57 0.03 0.00 -1.25 0.00 0.00 55.69 56.37 1ckr s MET 408 Cb -0.07 -3.64 0.01 0.00 2.84 0.00 0.00 34.83 33.96 1ckr s MET 408 CO 0.24 -0.55 -0.20 0.99 -0.65 0.00 0.00 175.02 174.84 1ckr s THR 409 N 2.81 1.82 -0.15 10.11 2.01 -1.05 -4.16 115.64 127.03 1ckr s THR 409 Ca 0.52 -0.87 0.00 0.00 0.31 0.00 0.00 61.69 61.65 1ckr s THR 409 Cb -0.21 -1.60 0.03 0.00 0.01 0.00 0.00 72.50 70.72 1ckr s THR 409 CO 0.16 0.51 -0.11 0.54 -0.69 0.00 0.00 174.62 175.02 1ckr s VAL 410 N 0.56 1.41 -1.60 3.82 0.11 -1.26 -2.64 120.40 120.80 1ckr s VAL 410 Ca -0.15 -0.59 0.24 0.00 -2.93 0.00 0.00 61.98 58.56 1ckr s VAL 410 Cb -0.17 -1.38 0.06 0.00 -1.53 0.00 0.00 36.38 33.36 1ckr s VAL 410 CO 0.05 0.38 1.29 0.00 -3.33 0.00 0.00 175.10 173.49 1ckr n LEU 411 N 4.81 1.24 0.00 2.54 -0.00 -1.26 -4.89 117.00 119.45 1ckr n LEU 411 Ca -0.15 -0.41 0.00 0.00 -0.00 0.00 0.00 56.01 55.45 1ckr n LEU 411 Cb 0.49 -0.09 0.00 0.00 -0.00 0.00 0.00 43.42 43.83 1ckr n LEU 411 CO 0.20 0.25 0.00 -0.38 -0.00 0.00 0.00 177.39 177.45 1ckr n ILE 412 N -0.73 0.00 -3.61 1.47 2.08 -1.26 -4.94 119.36 112.37 1ckr n ILE 412 Ca 0.09 0.00 -0.10 0.00 0.56 0.00 0.00 62.75 63.29 1ckr n ILE 412 Cb 0.38 -0.99 -0.03 0.00 -0.75 0.00 0.00 39.64 38.25 1ckr n ILE 412 CO 0.00 0.00 0.00 -1.59 0.56 0.00 0.00 176.55 175.52 1ckr s LYS 413 N 0.76 1.27 0.24 0.38 0.00 -1.26 -4.93 119.74 116.21 1ckr s LYS 413 Ca 0.00 -0.70 -0.30 0.00 0.00 0.00 0.00 55.97 54.98 1ckr s LYS 413 Cb 0.00 0.53 -0.09 0.00 0.00 0.00 0.00 37.83 38.27 1ckr s LYS 413 CO 0.00 -0.54 1.24 0.50 0.00 0.00 0.00 175.35 176.55 1ckr s ARG 414 N -3.82 4.45 -1.22 1.78 3.52 -1.26 -3.26 118.95 119.15 1ckr s ARG 414 Ca 0.05 2.00 -0.07 0.00 -0.13 0.00 0.00 55.73 57.58 1ckr s ARG 414 Cb -0.00 -3.17 -0.01 0.00 -1.56 0.00 0.00 34.95 30.20 1ckr s ARG 414 CO -0.08 -0.11 0.75 0.09 -0.81 0.00 0.00 175.30 175.14 1ckr n ASN 415 N 1.89 -3.30 -4.71 -2.12 3.02 -1.05 -4.96 115.26 104.04 1ckr n ASN 415 Ca 0.03 -0.87 -0.41 0.00 -0.03 0.00 0.00 54.58 53.30 1ckr n ASN 415 Cb 0.43 -4.00 -0.04 0.00 -0.61 0.00 0.00 39.78 35.57 1ckr n ASN 415 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1ckr s THR 416 N -3.57 4.94 -0.93 3.41 -1.32 -1.08 -4.84 115.64 112.24 1ckr s THR 416 Ca 0.22 1.78 -0.24 0.00 -1.21 0.00 0.00 61.69 62.24 1ckr s THR 416 Cb -0.06 -4.19 -0.04 0.00 -1.51 0.00 0.00 72.50 66.69 1ckr s THR 416 CO 0.82 0.18 1.92 -0.89 -2.21 0.00 0.00 174.62 174.43 1ckr s THR 417 N 1.08 3.48 0.48 5.08 2.01 -1.26 -2.30 115.64 124.21 1ckr s THR 417 Ca 0.45 -0.44 -0.14 0.00 0.31 0.00 0.00 61.69 61.87 1ckr s THR 417 Cb -0.19 -4.11 -0.07 0.00 0.01 0.00 0.00 72.50 68.14 1ckr s THR 417 CO 0.22 -1.01 0.90 0.27 -0.69 0.00 0.00 174.62 174.31 1ckr s ILE 418 N 9.85 4.65 0.42 1.82 -4.36 -0.73 -4.48 121.20 128.37 1ckr s ILE 418 Ca 0.69 0.95 -0.25 0.00 -0.26 0.00 0.00 60.65 61.78 1ckr s ILE 418 Cb -0.06 -3.73 -0.08 0.00 1.25 0.00 0.00 42.46 39.84 1ckr s ILE 418 CO -0.00 -0.65 1.24 -2.16 0.24 0.00 0.00 174.94 173.62 1ckr s PRO 419 N -4.04 3.92 -0.14 0.37 0.04 -1.26 -4.42 135.00 129.47 1ckr s PRO 419 Ca 0.56 2.01 -0.08 0.00 0.04 0.00 0.00 61.00 63.53 1ckr s PRO 419 Cb -0.10 -2.66 0.05 0.00 0.04 0.00 0.00 34.50 31.84 1ckr s PRO 419 CO 0.32 -0.48 0.34 -0.08 0.04 0.00 0.00 177.00 177.14 1ckr s THR 420 N -1.35 -0.03 -0.32 1.26 -1.32 -0.98 -4.94 115.64 107.97 1ckr s THR 420 Ca 0.59 0.12 -0.09 0.00 -1.21 0.00 0.00 61.69 61.10 1ckr s THR 420 Cb -0.35 -0.51 0.01 0.00 -1.51 0.00 0.00 72.50 70.14 1ckr s THR 420 CO 0.44 0.05 0.13 -0.75 -2.21 0.00 0.00 174.62 172.27 1ckr s LYS 421 N 1.33 3.12 -0.08 7.08 2.20 -1.25 -0.90 119.74 131.25 1ckr s LYS 421 Ca -0.09 -0.86 0.04 0.00 -0.36 0.00 0.00 55.97 54.70 1ckr s LYS 421 Cb -0.09 -3.51 -0.00 0.00 -1.51 0.00 0.00 37.83 32.72 1ckr s LYS 421 CO -0.11 -0.48 -0.22 -0.65 -0.36 0.00 0.00 175.35 173.53 1ckr s GLN 422 N 1.55 2.56 -0.42 4.03 1.11 -0.53 -4.96 119.66 123.00 1ckr s GLN 422 Ca 0.03 -0.78 -0.05 0.00 0.01 0.00 0.00 55.36 54.57 1ckr s GLN 422 Cb -0.18 -2.04 0.10 0.00 -1.01 0.00 0.00 33.01 29.89 1ckr s GLN 422 CO 0.05 0.22 0.23 0.95 0.01 0.00 0.00 175.29 176.74 1ckr s THR 423 N 0.22 3.58 -0.36 -0.19 -4.23 -1.26 -0.42 115.64 112.97 1ckr s THR 423 Ca -0.13 -1.88 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 1ckr s THR 423 Cb -0.16 -3.37 0.00 0.00 1.34 0.00 0.00 72.50 70.31 1ckr s THR 423 CO 0.06 -0.65 0.24 -1.58 -0.54 0.00 0.00 174.62 172.15 1ckr s GLN 424 N 1.23 3.23 -0.31 3.99 2.00 -1.07 -4.98 119.66 123.76 1ckr s GLN 424 Ca 0.06 -0.82 -0.26 0.00 -2.00 0.00 0.00 55.36 52.34 1ckr s GLN 424 Cb -0.23 -3.82 0.01 0.00 0.80 0.00 0.00 33.01 29.77 1ckr s GLN 424 CO -0.03 -0.56 0.92 0.99 -0.50 0.00 0.00 175.29 176.11 1ckr s THR 425 N 1.67 4.67 0.09 -0.34 2.01 -1.26 -1.57 115.64 120.91 1ckr s THR 425 Ca 0.05 1.46 0.00 0.00 0.31 0.00 0.00 61.69 63.51 1ckr s THR 425 Cb -0.18 -4.26 -0.04 0.00 0.01 0.00 0.00 72.50 68.03 1ckr s THR 425 CO 0.09 -0.33 0.24 -0.36 -0.69 0.00 0.00 174.62 173.57 1ckr s PHE 426 N 3.24 3.51 0.00 4.92 0.40 0.60 -4.92 117.98 125.74 1ckr s PHE 426 Ca 0.38 0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.96 1ckr s PHE 426 Cb -0.13 -1.76 0.00 0.00 0.51 0.00 0.00 43.02 41.63 1ckr s PHE 426 CO 0.13 0.56 0.00 -2.37 0.70 0.00 0.00 175.22 174.24 1ckr n THR 427 N 0.10 0.00 -4.09 0.64 5.66 0.14 -0.04 114.28 116.69 1ckr n THR 427 Ca -0.05 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.88 1ckr n THR 427 Cb 0.52 -0.07 -0.10 0.00 -1.55 0.00 0.00 70.33 69.13 1ckr n THR 427 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1ckr s THR 428 N 2.35 0.22 -0.05 1.09 -4.23 -0.95 -4.08 115.64 109.98 1ckr s THR 428 Ca 0.00 -1.76 -0.03 0.00 -1.18 0.00 0.00 61.69 58.72 1ckr s THR 428 Cb 0.00 -1.45 -0.01 0.00 1.34 0.00 0.00 72.50 72.38 1ckr s THR 428 CO 0.00 -0.97 -0.06 0.22 -0.54 0.00 0.00 174.62 173.27 1ckr h TYR 429 N 3.23 0.00 -4.12 3.99 3.20 -1.96 -2.07 116.97 119.24 1ckr h TYR 429 Ca -0.34 0.00 -0.55 0.00 3.14 0.00 0.00 58.73 60.98 1ckr h TYR 429 Cb 1.14 0.00 0.15 0.00 1.54 0.00 0.00 36.73 39.57 1ckr h TYR 429 CO 0.54 0.00 0.49 -1.12 -1.64 0.00 0.00 178.16 176.42 1ckr s SER 430 N -4.35 4.59 -0.26 -2.11 0.01 -1.26 -4.09 113.70 106.24 1ckr s SER 430 Ca -0.05 2.54 -0.29 0.00 1.31 0.00 0.00 55.95 59.46 1ckr s SER 430 Cb 0.01 -2.61 -0.01 0.00 0.21 0.00 0.00 66.02 63.62 1ckr s SER 430 CO 0.07 -2.01 1.35 1.51 0.41 0.00 0.00 173.24 174.58 1ckr s ASP 431 N -1.54 6.68 -0.07 2.44 -4.77 -1.26 -3.96 116.67 114.19 1ckr s ASP 431 Ca 0.80 1.39 -0.05 0.00 -3.30 0.00 0.00 52.55 51.39 1ckr s ASP 431 Cb -0.35 -2.54 0.02 0.00 -1.09 0.00 0.00 42.92 38.96 1ckr s ASP 431 CO 0.40 -1.04 0.10 -0.46 0.70 0.00 0.00 175.17 174.86 1ckr n ASN 432 N 7.55 -2.32 -2.51 2.11 0.23 -0.20 -4.88 115.26 115.23 1ckr n ASN 432 Ca 0.15 0.76 -0.03 0.00 -0.53 0.00 0.00 54.58 54.94 1ckr n ASN 432 Cb 0.46 -3.20 -0.02 0.00 -2.08 0.00 0.00 39.78 34.94 1ckr n ASN 432 CO 0.00 0.00 0.00 1.67 -0.93 0.00 0.00 177.26 178.00 1ckr n GLN 433 N 0.90 -4.36 -0.07 -3.83 7.27 -1.26 -4.95 117.38 111.07 1ckr n GLN 433 Ca -0.17 3.24 -0.06 0.00 0.07 0.00 0.00 57.00 60.08 1ckr n GLN 433 Cb 0.26 -4.37 -0.02 0.00 2.41 0.00 0.00 30.24 28.52 1ckr n GLN 433 CO 0.00 0.00 0.00 -2.30 0.07 0.00 0.00 177.06 174.83 1ckr n PRO 434 N 1.86 0.46 -0.06 3.69 -0.02 -1.26 -4.98 135.00 134.70 1ckr n PRO 434 Ca -0.20 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1ckr n PRO 434 Cb 0.31 -1.66 0.00 0.00 -0.02 0.00 0.00 33.50 32.13 1ckr n PRO 434 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ckr n GLY 435 N 1.59 -0.08 3.09 -1.23 0.00 -1.26 -4.99 105.19 102.31 1ckr n GLY 435 Ca -0.09 -1.18 -0.24 0.00 0.00 0.00 0.00 46.02 44.51 1ckr n GLY 435 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ckr s VAL 436 N -0.21 1.21 -0.34 1.61 -7.23 0.79 -4.93 120.40 111.29 1ckr s VAL 436 Ca 0.00 -0.60 -0.21 0.00 -1.81 0.00 0.00 61.98 59.36 1ckr s VAL 436 Cb 0.00 -1.04 0.00 0.00 0.56 0.00 0.00 36.38 35.90 1ckr s VAL 436 CO 0.00 0.35 0.67 -0.22 -0.31 0.00 0.00 175.10 175.59 1ckr s LEU 437 N 0.02 4.20 -0.27 1.32 2.96 -1.25 -0.56 118.68 125.09 1ckr s LEU 437 Ca -0.02 0.28 -0.08 0.00 -0.22 0.00 0.00 54.13 54.09 1ckr s LEU 437 Cb -0.10 -2.85 -0.02 0.00 0.50 0.00 0.00 46.19 43.72 1ckr s LEU 437 CO 0.01 -0.59 0.10 -0.63 -1.32 0.00 0.00 176.35 173.92 1ckr s ILE 438 N 2.76 4.47 -0.21 6.68 -1.09 0.28 -4.79 121.20 129.31 1ckr s ILE 438 Ca 0.26 -0.21 -0.06 0.00 -2.23 0.00 0.00 60.65 58.42 1ckr s ILE 438 Cb -0.14 -3.14 -0.03 0.00 -1.58 0.00 0.00 42.46 37.57 1ckr s ILE 438 CO 0.14 0.26 0.02 -1.10 -1.23 0.00 0.00 174.94 173.03 1ckr s GLN 439 N 1.63 3.65 -0.07 2.79 -0.21 -1.20 -1.06 119.66 125.19 1ckr s GLN 439 Ca 0.06 -0.50 -0.25 0.00 0.02 0.00 0.00 55.36 54.69 1ckr s GLN 439 Cb -0.16 -3.14 -0.03 0.00 1.00 0.00 0.00 33.01 30.68 1ckr s GLN 439 CO 0.05 -0.01 0.76 0.08 -2.12 0.00 0.00 175.29 174.04 1ckr s VAL 440 N 1.08 5.00 -0.21 1.09 1.01 -1.17 -0.57 120.40 126.64 1ckr s VAL 440 Ca 0.03 1.55 -0.00 0.00 0.00 0.00 0.00 61.98 63.56 1ckr s VAL 440 Cb -0.14 -4.09 0.02 0.00 0.00 0.00 0.00 36.38 32.16 1ckr s VAL 440 CO 0.02 0.21 -0.14 -0.31 0.00 0.00 0.00 175.10 174.88 1ckr s TYR 441 N 1.01 2.91 -0.58 5.22 1.51 -1.05 -1.91 117.35 124.45 1ckr s TYR 441 Ca 0.40 -1.57 -0.21 0.00 -1.01 0.00 0.00 57.07 54.67 1ckr s TYR 441 Cb -0.18 -1.98 0.07 0.00 -0.11 0.00 0.00 41.96 39.76 1ckr s TYR 441 CO 0.19 -0.76 0.83 -2.00 -1.11 0.00 0.00 175.55 172.70 1ckr s GLU 442 N 1.31 3.15 0.00 -0.62 2.12 -1.08 -2.63 118.70 120.95 1ckr s GLU 442 Ca 0.03 -0.81 0.00 0.00 0.36 0.00 0.00 54.97 54.55 1ckr s GLU 442 Cb -0.14 -4.16 0.00 0.00 0.26 0.00 0.00 34.13 30.08 1ckr s GLU 442 CO -0.09 -1.54 0.00 0.41 -0.54 0.00 0.00 175.26 173.50 1ckr n GLY 443 N 5.23 0.06 0.19 -1.50 0.00 -1.12 -1.46 105.19 106.60 1ckr n GLY 443 Ca -0.04 -2.29 0.00 0.00 0.00 0.00 0.00 46.02 43.69 1ckr n GLY 443 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ckr n GLU 444 N -0.02 -0.55 -1.87 1.61 1.02 -1.26 -4.82 120.64 114.74 1ckr n GLU 444 Ca 0.00 0.41 -0.22 0.00 -0.02 0.00 0.00 57.16 57.33 1ckr n GLU 444 Cb 0.00 -0.46 -0.07 0.00 -0.02 0.00 0.00 31.44 30.89 1ckr n GLU 444 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1ckr s ARG 445 N -5.11 2.08 -1.02 3.49 1.81 -1.26 -4.62 118.95 114.32 1ckr s ARG 445 Ca 0.00 -0.35 -0.16 0.00 -1.72 0.00 0.00 55.73 53.50 1ckr s ARG 445 Cb 0.00 -5.03 0.00 0.00 -0.45 0.00 0.00 34.95 29.48 1ckr s ARG 445 CO 0.00 -4.15 0.71 0.00 -0.68 0.00 0.00 175.30 171.19 1ckr n ALA 446 N 16.17 -2.63 -3.00 2.13 0.00 -1.26 -4.87 120.51 127.05 1ckr n ALA 446 Ca 0.43 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1ckr n ALA 446 Cb 0.46 -2.66 0.00 0.00 0.00 0.00 0.00 19.45 17.25 1ckr n ALA 446 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ckr n MET 447 N -3.64 0.00 -2.95 0.00 3.85 -1.26 -4.55 117.12 108.57 1ckr n MET 447 Ca -0.14 0.00 -0.19 0.00 -1.00 0.00 0.00 57.70 56.37 1ckr n MET 447 Cb 0.60 0.00 -0.02 0.00 -1.05 0.00 0.00 33.22 32.75 1ckr n MET 447 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1ckr n THR 448 N 0.00 1.01 0.00 3.17 -2.24 -1.26 -3.62 114.28 111.34 1ckr n THR 448 Ca 0.00 -4.50 0.00 0.00 -2.27 0.00 0.00 64.05 57.28 1ckr n THR 448 Cb 0.00 -0.40 0.00 0.00 -2.10 0.00 0.00 70.33 67.83 1ckr n THR 448 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1ckr n LYS 449 N 0.02 0.00 -2.70 -0.78 4.81 -1.26 -5.05 118.16 113.21 1ckr n LYS 449 Ca 0.24 0.00 -0.05 0.00 -0.87 0.00 0.00 58.31 57.63 1ckr n LYS 449 Cb 0.64 -0.23 0.06 0.00 0.02 0.00 0.00 35.03 35.51 1ckr n LYS 449 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1ckr n ASP 450 N -0.26 -1.95 -3.65 3.14 -0.08 -1.26 -5.15 116.55 107.35 1ckr n ASP 450 Ca 0.00 -2.24 -0.12 0.00 -1.51 0.00 0.00 54.79 50.92 1ckr n ASP 450 Cb 0.00 1.13 0.05 0.00 2.34 0.00 0.00 41.12 44.64 1ckr n ASP 450 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1ckr n ASN 451 N 1.75 1.08 -4.45 1.67 0.23 -1.26 -4.62 115.26 109.67 1ckr n ASN 451 Ca 0.06 -1.82 -0.43 0.00 -0.53 0.00 0.00 54.58 51.85 1ckr n ASN 451 Cb 0.67 -0.30 -0.09 0.00 -2.08 0.00 0.00 39.78 37.98 1ckr n ASN 451 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 1ckr s ASN 452 N -3.23 6.16 -0.15 0.53 2.47 -0.54 -4.91 114.94 115.26 1ckr s ASN 452 Ca 0.37 -0.95 -0.29 0.00 0.42 0.00 0.00 52.86 52.41 1ckr s ASN 452 Cb -0.03 -2.20 -0.04 0.00 -1.45 0.00 0.00 41.25 37.54 1ckr s ASN 452 CO 0.24 -0.58 1.67 -0.22 -3.72 0.00 0.00 177.10 174.49 1ckr s LEU 453 N 1.89 4.05 -0.27 3.21 0.20 -1.26 -2.63 118.68 123.86 1ckr s LEU 453 Ca 0.08 1.90 0.02 0.00 0.69 0.00 0.00 54.13 56.81 1ckr s LEU 453 Cb -0.20 -3.53 0.06 0.00 -0.43 0.00 0.00 46.19 42.09 1ckr s LEU 453 CO 0.10 -1.17 -0.08 -0.76 -0.29 0.00 0.00 176.35 174.16 1ckr s LEU 454 N 4.92 3.59 0.00 -0.68 1.43 -0.80 -4.99 118.68 122.15 1ckr s LEU 454 Ca 0.74 -1.39 0.00 0.00 -1.03 0.00 0.00 54.13 52.45 1ckr s LEU 454 Cb -0.29 -1.59 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1ckr s LEU 454 CO 0.30 -0.21 0.00 0.61 0.23 0.00 0.00 176.35 177.28 1ckr n GLY 455 N 4.47 2.08 0.00 -3.19 0.00 -1.26 -3.03 105.19 104.25 1ckr n GLY 455 Ca -0.13 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.44 1ckr n GLY 455 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ckr n LYS 456 N 13.15 0.00 -3.78 1.61 2.85 -1.26 -4.73 118.16 126.00 1ckr n LYS 456 Ca 0.00 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.13 1ckr n LYS 456 Cb 0.00 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.30 1ckr n LYS 456 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 177.40 176.76 1ckr s PHE 457 N -0.89 -0.13 -0.28 5.58 -0.71 -0.23 -5.01 117.98 116.33 1ckr s PHE 457 Ca 0.00 0.13 -0.10 0.00 -1.04 0.00 0.00 56.93 55.92 1ckr s PHE 457 Cb 0.00 0.07 -0.04 0.00 -1.21 0.00 0.00 43.02 41.85 1ckr s PHE 457 CO 0.00 -0.40 0.15 -2.00 -1.34 0.00 0.00 175.22 171.63 1ckr s GLU 458 N -1.65 3.74 -0.17 1.99 2.12 -1.26 -0.55 118.70 122.92 1ckr s GLU 458 Ca -0.12 -0.45 -0.05 0.00 0.36 0.00 0.00 54.97 54.72 1ckr s GLU 458 Cb -0.04 -3.55 -0.03 0.00 0.26 0.00 0.00 34.13 30.76 1ckr s GLU 458 CO 0.02 -0.23 -0.01 -1.17 -0.54 0.00 0.00 175.26 173.33 1ckr s LEU 459 N 1.69 3.37 -0.01 2.70 1.98 0.27 -4.98 118.68 123.71 1ckr s LEU 459 Ca 0.06 -0.10 -0.13 0.00 -2.89 0.00 0.00 54.13 51.07 1ckr s LEU 459 Cb -0.16 -1.83 0.02 0.00 0.66 0.00 0.00 46.19 44.88 1ckr s LEU 459 CO 0.08 0.15 0.27 0.42 -1.89 0.00 0.00 176.35 175.38 1ckr s THR 460 N 0.51 0.06 0.00 3.68 -4.23 -1.26 -0.15 115.64 114.25 1ckr s THR 460 Ca -0.01 -0.52 0.00 0.00 -1.18 0.00 0.00 61.69 59.98 1ckr s THR 460 Cb -0.14 -0.57 0.00 0.00 1.34 0.00 0.00 72.50 73.13 1ckr s THR 460 CO 0.02 -0.28 0.00 0.61 -0.54 0.00 0.00 174.62 174.43 1ckr n GLY 461 N 1.32 0.39 3.86 3.99 0.00 -1.26 -5.07 105.19 108.43 1ckr n GLY 461 Ca -0.22 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 1ckr n GLY 461 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ckr s ILE 462 N 0.00 4.87 0.03 -0.61 -1.09 -1.26 -4.89 121.20 118.25 1ckr s ILE 462 Ca 0.00 0.67 -0.30 0.00 -2.23 0.00 0.00 60.65 58.79 1ckr s ILE 462 Cb 0.00 -3.67 -0.07 0.00 -1.58 0.00 0.00 42.46 37.14 1ckr s ILE 462 CO 0.00 0.04 1.66 -2.16 -1.23 0.00 0.00 174.94 173.25 1ckr s PRO 463 N -2.50 4.19 -1.47 2.79 0.04 -1.26 -4.62 135.00 132.17 1ckr s PRO 463 Ca 0.44 2.29 -0.12 0.00 0.04 0.00 0.00 61.00 63.66 1ckr s PRO 463 Cb -0.13 -3.73 -0.03 0.00 0.04 0.00 0.00 34.50 30.65 1ckr s PRO 463 CO 0.20 -0.77 2.53 -0.35 0.04 0.00 0.00 177.00 178.65 1ckr n PRO 464 N 6.08 3.12 -2.39 0.56 -0.04 -1.26 -4.27 135.00 136.80 1ckr n PRO 464 Ca 0.16 -2.33 -0.25 0.00 -0.04 0.00 0.00 63.50 61.04 1ckr n PRO 464 Cb 0.41 -3.02 0.12 0.00 -0.04 0.00 0.00 33.50 30.97 1ckr n PRO 464 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ckr s ALA 465 N 2.85 3.31 -0.63 0.55 0.00 -1.26 -4.65 121.76 121.93 1ckr s ALA 465 Ca 0.57 -1.48 -0.14 0.00 0.00 0.00 0.00 51.96 50.91 1ckr s ALA 465 Cb 0.16 -2.26 0.16 0.00 0.00 0.00 0.00 23.12 21.17 1ckr s ALA 465 CO -0.06 -1.62 0.58 -1.25 0.00 0.00 0.00 175.76 173.41 1ckr s PRO 466 N -5.30 3.15 -0.04 0.00 0.04 -1.26 -1.03 135.00 130.55 1ckr s PRO 466 Ca 0.67 -1.99 -0.04 0.00 0.04 0.00 0.00 61.00 59.68 1ckr s PRO 466 Cb -0.06 -4.30 0.01 0.00 0.04 0.00 0.00 34.50 30.20 1ckr s PRO 466 CO 0.46 -1.30 0.07 -2.13 0.04 0.00 0.00 177.00 174.14 1ckr n ARG 467 N 4.74 -4.78 -0.22 4.56 3.00 -1.25 -4.34 116.66 118.36 1ckr n ARG 467 Ca -0.03 3.53 0.00 0.00 -0.00 0.00 0.00 57.85 61.34 1ckr n ARG 467 Cb 0.42 -4.62 0.00 0.00 0.00 0.00 0.00 32.46 28.26 1ckr n ARG 467 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1ckr n GLY 468 N 1.70 1.49 0.13 5.14 0.00 -0.78 -4.85 105.19 108.02 1ckr n GLY 468 Ca -0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.69 1ckr n GLY 468 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ckr n VAL 469 N -2.00 1.55 -1.77 1.61 0.31 -1.26 -4.71 118.33 112.05 1ckr n VAL 469 Ca 0.00 -0.53 -0.41 0.00 -0.01 0.00 0.00 64.34 63.39 1ckr n VAL 469 Cb 0.00 -1.59 -0.00 0.00 -0.91 0.00 0.00 33.84 31.34 1ckr n VAL 469 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 1ckr n PRO 470 N -3.54 2.70 -3.65 5.55 -0.02 -1.26 -4.89 135.00 129.89 1ckr n PRO 470 Ca -0.45 0.95 -0.11 0.00 -2.02 0.00 0.00 63.50 61.88 1ckr n PRO 470 Cb 0.97 -2.70 -0.05 0.00 -0.02 0.00 0.00 33.50 31.70 1ckr n PRO 470 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1ckr s GLN 471 N -1.79 1.02 -0.04 -0.52 -2.07 -1.26 -2.25 119.66 112.74 1ckr s GLN 471 Ca 0.55 -0.63 -0.01 0.00 -1.82 0.00 0.00 55.36 53.45 1ckr s GLN 471 Cb -0.48 0.45 0.03 0.00 -1.09 0.00 0.00 33.01 31.93 1ckr s GLN 471 CO 0.61 -0.38 0.07 0.96 -1.32 0.00 0.00 175.29 175.22 1ckr s ILE 472 N -3.45 -0.09 -0.58 3.63 -0.00 0.94 -4.46 121.20 117.18 1ckr s ILE 472 Ca 0.01 0.29 -0.21 0.00 -0.00 0.00 0.00 60.65 60.74 1ckr s ILE 472 Cb 0.01 -0.14 0.07 0.00 -0.00 0.00 0.00 42.46 42.40 1ckr s ILE 472 CO -0.09 0.12 0.79 -0.70 -0.00 0.00 0.00 174.94 175.05 1ckr s GLU 473 N 1.53 3.13 -0.88 0.37 2.12 0.11 -0.29 118.70 124.79 1ckr s GLU 473 Ca -0.04 -0.91 -0.25 0.00 0.36 0.00 0.00 54.97 54.14 1ckr s GLU 473 Cb -0.12 -4.18 0.04 0.00 0.26 0.00 0.00 34.13 30.13 1ckr s GLU 473 CO -0.04 -1.52 1.40 0.08 -0.54 0.00 0.00 175.26 174.65 1ckr s VAL 474 N 3.23 3.81 -0.17 3.70 1.01 -0.61 -1.08 120.40 130.28 1ckr s VAL 474 Ca 0.18 -0.21 -0.15 0.00 0.00 0.00 0.00 61.98 61.80 1ckr s VAL 474 Cb -0.19 -4.94 -0.04 0.00 0.00 0.00 0.00 36.38 31.20 1ckr s VAL 474 CO 0.11 -1.85 0.35 -0.89 0.00 0.00 0.00 175.10 172.82 1ckr s THR 475 N 5.54 5.25 -0.45 3.92 2.01 0.60 -2.59 115.64 129.93 1ckr s THR 475 Ca 0.42 0.65 -0.03 0.00 0.31 0.00 0.00 61.69 63.04 1ckr s THR 475 Cb -0.04 -3.69 0.12 0.00 0.01 0.00 0.00 72.50 68.90 1ckr s THR 475 CO 0.02 0.32 0.24 -0.36 -0.69 0.00 0.00 174.62 174.16 1ckr s PHE 476 N 0.85 3.56 -0.58 4.92 0.40 0.44 0.14 117.98 127.70 1ckr s PHE 476 Ca 0.18 -2.49 -0.12 0.00 -0.60 0.00 0.00 56.93 53.90 1ckr s PHE 476 Cb -0.14 -3.21 0.15 0.00 0.51 0.00 0.00 43.02 40.32 1ckr s PHE 476 CO 0.06 -0.95 0.50 0.34 0.70 0.00 0.00 175.22 175.88 1ckr s ASP 477 N 1.59 6.08 0.04 1.36 2.15 -0.72 -1.46 116.67 125.72 1ckr s ASP 477 Ca 0.10 -2.10 -0.22 0.00 0.43 0.00 0.00 52.55 50.77 1ckr s ASP 477 Cb -0.22 -2.12 -0.06 0.00 -0.30 0.00 0.00 42.92 40.22 1ckr s ASP 477 CO -0.04 -0.71 0.64 -0.63 -0.17 0.00 0.00 175.17 174.26 1ckr s ILE 478 N 1.10 4.78 0.26 4.11 1.01 -0.08 -1.00 121.20 131.38 1ckr s ILE 478 Ca 0.08 1.36 -0.07 0.00 0.00 0.00 0.00 60.65 62.02 1ckr s ILE 478 Cb -0.24 -3.98 -0.06 0.00 0.01 0.00 0.00 42.46 38.19 1ckr s ILE 478 CO -0.01 0.45 0.56 -1.81 0.00 0.00 0.00 174.94 174.12 1ckr s ASP 479 N -0.48 6.53 0.52 3.58 1.01 0.14 -2.31 116.67 125.66 1ckr s ASP 479 Ca 0.32 0.82 0.32 0.00 0.71 0.00 0.00 52.55 54.72 1ckr s ASP 479 Cb -0.19 -2.19 1.45 0.00 1.01 0.00 0.00 42.92 43.00 1ckr s ASP 479 CO 0.20 -0.14 1.84 0.00 0.21 0.00 0.00 175.17 177.27 1ckr h ALA 480 N 2.09 2.86 -0.18 5.23 0.00 -1.87 -1.80 119.26 125.59 1ckr h ALA 480 Ca -0.47 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.31 1ckr h ALA 480 Cb 1.18 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.98 1ckr h ALA 480 CO 0.68 -1.18 0.14 0.09 0.00 0.00 0.00 179.25 178.98 1ckr n ASN 481 N -4.28 4.49 -2.99 0.00 3.02 -1.26 -4.84 115.26 109.38 1ckr n ASN 481 Ca 0.22 -2.48 -0.21 0.00 -0.03 0.00 0.00 54.58 52.08 1ckr n ASN 481 Cb 1.06 -0.84 0.01 0.00 -0.61 0.00 0.00 39.78 39.41 1ckr n ASN 481 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ckr n GLY 482 N 0.63 -0.51 3.53 7.41 0.00 -0.70 -3.81 105.19 111.74 1ckr n GLY 482 Ca 0.11 0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1ckr n GLY 482 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ckr s ILE 483 N -3.01 4.82 -0.45 -0.61 1.01 -1.04 -4.29 121.20 117.63 1ckr s ILE 483 Ca 0.27 0.00 -0.19 0.00 0.00 0.00 0.00 60.65 60.73 1ckr s ILE 483 Cb -0.13 -3.27 0.03 0.00 0.01 0.00 0.00 42.46 39.10 1ckr s ILE 483 CO 0.33 0.30 0.54 -0.22 0.00 0.00 0.00 174.94 175.89 1ckr s LEU 484 N 1.61 4.83 -0.93 2.97 2.96 -0.94 0.23 118.68 129.42 1ckr s LEU 484 Ca 0.07 -0.68 -0.21 0.00 -0.22 0.00 0.00 54.13 53.08 1ckr s LEU 484 Cb -0.15 -2.48 0.09 0.00 0.50 0.00 0.00 46.19 44.14 1ckr s LEU 484 CO 0.07 -0.72 1.25 0.20 -1.32 0.00 0.00 176.35 175.83 1ckr s ASN 485 N 2.12 6.51 -0.22 3.68 0.01 -0.17 -0.86 114.94 126.01 1ckr s ASN 485 Ca 0.15 -1.61 -0.20 0.00 -0.71 0.00 0.00 52.86 50.49 1ckr s ASN 485 Cb -0.17 -2.48 -0.02 0.00 0.41 0.00 0.00 41.25 38.99 1ckr s ASN 485 CO 0.14 -1.32 0.62 -0.69 -1.51 0.00 0.00 177.10 174.34 1ckr s VAL 486 N 3.91 5.02 -0.22 1.60 1.01 -0.03 -1.75 120.40 129.94 1ckr s VAL 486 Ca 0.37 1.14 0.01 0.00 0.00 0.00 0.00 61.98 63.50 1ckr s VAL 486 Cb -0.04 -3.93 0.05 0.00 0.00 0.00 0.00 36.38 32.46 1ckr s VAL 486 CO -0.06 0.09 -0.08 -0.55 0.00 0.00 0.00 175.10 174.49 1ckr s SER 487 N 1.30 3.61 -0.24 3.32 0.15 0.12 -1.61 113.70 120.36 1ckr s SER 487 Ca 0.27 -1.03 -0.20 0.00 0.70 0.00 0.00 55.95 55.69 1ckr s SER 487 Cb -0.16 -1.20 -0.02 0.00 -1.71 0.00 0.00 66.02 62.93 1ckr s SER 487 CO 0.10 -0.19 0.63 0.00 1.20 0.00 0.00 173.24 174.97 1ckr s ALA 488 N 1.40 3.60 -0.18 5.45 0.00 -0.97 -0.30 121.76 130.76 1ckr s ALA 488 Ca -0.04 -0.41 -0.01 0.00 0.00 0.00 0.00 51.96 51.51 1ckr s ALA 488 Cb -0.18 -3.01 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1ckr s ALA 488 CO -0.07 -0.75 -0.14 0.08 0.00 0.00 0.00 175.76 174.88 1ckr s VAL 489 N 2.37 2.67 -1.21 0.00 1.01 -0.24 -2.68 120.40 122.32 1ckr s VAL 489 Ca 0.26 -0.75 -0.17 0.00 0.00 0.00 0.00 61.98 61.32 1ckr s VAL 489 Cb -0.16 -2.15 0.11 0.00 0.00 0.00 0.00 36.38 34.19 1ckr s VAL 489 CO 0.09 0.50 1.55 -1.81 0.00 0.00 0.00 175.10 175.43 1ckr s ASP 490 N 1.11 6.87 0.22 3.32 1.01 0.73 0.09 116.67 130.03 1ckr s ASP 490 Ca 0.00 -2.52 0.00 0.00 0.71 0.00 0.00 52.55 50.75 1ckr s ASP 490 Cb -0.14 -2.50 0.22 0.00 1.01 0.00 0.00 42.92 41.51 1ckr s ASP 490 CO -0.05 -1.04 1.57 0.07 0.21 0.00 0.00 175.17 175.94 1ckr h LYS 491 N 7.74 0.47 0.00 8.23 5.09 -1.81 -0.71 116.57 135.57 1ckr h LYS 491 Ca 0.35 -0.26 -0.01 0.00 0.09 0.00 0.00 60.65 60.82 1ckr h LYS 491 Cb 0.90 0.02 -0.00 0.00 0.10 0.00 0.00 32.23 33.24 1ckr h LYS 491 CO 1.35 0.85 -0.04 0.77 -2.09 0.00 0.00 179.45 180.29 1ckr h SER 492 N 0.37 0.00 0.53 7.07 0.02 -1.90 -2.37 113.55 117.27 1ckr h SER 492 Ca 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 1ckr h SER 492 Cb 0.98 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.52 1ckr h SER 492 CO 0.09 0.04 -0.23 0.41 -1.14 0.00 0.00 176.83 176.00 1ckr n THR 493 N -4.44 0.00 -3.78 -2.27 -1.04 -0.90 -5.02 114.28 96.82 1ckr n THR 493 Ca -0.03 -0.04 -0.35 0.00 -2.04 0.00 0.00 64.05 61.60 1ckr n THR 493 Cb 0.12 -0.01 0.04 0.00 -1.82 0.00 0.00 70.33 68.66 1ckr n THR 493 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ckr n GLY 494 N 1.41 -0.97 2.71 3.41 0.00 -0.32 -5.01 105.19 106.40 1ckr n GLY 494 Ca 0.10 0.43 -0.21 0.00 0.00 0.00 0.00 46.02 46.34 1ckr n GLY 494 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ckr s LYS 495 N -6.26 0.18 0.11 1.61 2.47 -1.01 -5.02 119.74 111.82 1ckr s LYS 495 Ca 0.46 0.05 0.07 0.00 -1.56 0.00 0.00 55.97 54.99 1ckr s LYS 495 Cb -0.19 -1.27 -0.04 0.00 -1.46 0.00 0.00 37.83 34.88 1ckr s LYS 495 CO 0.89 -0.73 -0.18 -1.83 0.16 0.00 0.00 175.35 173.67 1ckr s GLU 496 N 2.27 1.06 -0.01 4.03 -1.05 -1.26 -0.19 118.70 123.55 1ckr s GLU 496 Ca 0.06 -1.17 0.01 0.00 -0.15 0.00 0.00 54.97 53.73 1ckr s GLU 496 Cb -0.16 -1.16 0.00 0.00 -0.44 0.00 0.00 34.13 32.38 1ckr s GLU 496 CO -0.16 0.25 -0.05 1.21 0.95 0.00 0.00 175.26 177.47 1ckr s ASN 497 N -2.11 0.68 0.04 0.83 2.47 -1.09 -5.01 114.94 110.75 1ckr s ASN 497 Ca 0.07 -0.10 0.04 0.00 0.42 0.00 0.00 52.86 53.29 1ckr s ASN 497 Cb -0.08 -0.15 -0.02 0.00 -1.45 0.00 0.00 41.25 39.55 1ckr s ASN 497 CO 0.04 0.03 -0.11 -1.59 -3.72 0.00 0.00 177.10 171.75 1ckr s LYS 498 N 0.15 0.75 -0.12 0.43 -2.85 -1.26 -2.30 119.74 114.54 1ckr s LYS 498 Ca -0.01 -0.71 0.01 0.00 -1.00 0.00 0.00 55.97 54.26 1ckr s LYS 498 Cb -0.05 -0.69 -0.01 0.00 -2.06 0.00 0.00 37.83 35.01 1ckr s LYS 498 CO -0.00 0.16 -0.15 -1.50 0.10 0.00 0.00 175.35 173.96 1ckr s ILE 499 N -0.94 2.88 -0.46 3.79 2.07 -0.63 -4.95 121.20 122.95 1ckr s ILE 499 Ca -0.02 -0.73 -0.16 0.00 -1.41 0.00 0.00 60.65 58.33 1ckr s ILE 499 Cb -0.08 -2.19 0.06 0.00 0.13 0.00 0.00 42.46 40.39 1ckr s ILE 499 CO 0.01 0.54 0.40 -0.89 -1.91 0.00 0.00 174.94 173.09 1ckr s THR 500 N 0.24 5.20 -0.37 4.00 2.01 -1.26 -0.85 115.64 124.60 1ckr s THR 500 Ca -0.10 -0.92 -0.21 0.00 0.31 0.00 0.00 61.69 60.77 1ckr s THR 500 Cb -0.16 -4.11 0.01 0.00 0.01 0.00 0.00 72.50 68.25 1ckr s THR 500 CO 0.06 -0.55 0.66 -0.63 -0.69 0.00 0.00 174.62 173.47 1ckr s ILE 501 N 1.76 4.85 -1.34 1.82 1.01 -0.04 -4.94 121.20 124.32 1ckr s ILE 501 Ca 0.06 0.54 -0.15 0.00 0.00 0.00 0.00 60.65 61.09 1ckr s ILE 501 Cb -0.23 -4.12 0.08 0.00 0.01 0.00 0.00 42.46 38.20 1ckr s ILE 501 CO 0.08 -0.39 1.88 0.35 0.00 0.00 0.00 174.94 176.85 1ckr n THR 502 N 5.68 3.86 -2.93 2.92 -2.24 -1.26 -2.22 114.28 118.09 1ckr n THR 502 Ca -0.01 -3.85 -0.44 0.00 -2.27 0.00 0.00 64.05 57.48 1ckr n THR 502 Cb 0.48 -2.45 -0.01 0.00 -2.10 0.00 0.00 70.33 66.25 1ckr n THR 502 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1ckr s ASN 503 N 3.38 6.86 0.06 3.42 2.47 -1.26 -5.03 114.94 124.84 1ckr s ASN 503 Ca 0.49 -2.53 -0.33 0.00 0.42 0.00 0.00 52.86 50.91 1ckr s ASN 503 Cb 0.07 -2.40 -0.12 0.00 -1.45 0.00 0.00 41.25 37.35 1ckr s ASN 503 CO 0.01 -0.90 1.80 0.47 -3.72 0.00 0.00 177.10 174.75 1ckr n ASP 504 N 6.13 3.65 -4.56 -4.21 9.92 -1.26 -4.32 116.55 121.90 1ckr n ASP 504 Ca 0.31 1.00 -0.24 0.00 -0.53 0.00 0.00 54.79 55.32 1ckr n ASP 504 Cb 0.46 -1.46 -0.06 0.00 -0.64 0.00 0.00 41.12 39.42 1ckr n ASP 504 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1ckr s LYS 505 N 2.86 2.36 0.00 -1.24 1.02 -1.25 -4.59 119.74 118.90 1ckr s LYS 505 Ca 0.85 -0.24 0.00 0.00 0.02 0.00 0.00 55.97 56.60 1ckr s LYS 505 Cb -0.59 -5.03 0.00 0.00 -0.52 0.00 0.00 37.83 31.69 1ckr s LYS 505 CO 0.42 -3.66 0.00 0.41 -0.92 0.00 0.00 175.35 171.61 1ckr n GLY 506 N 6.74 -0.03 0.00 -3.33 0.00 -1.26 -5.10 105.19 102.21 1ckr n GLY 506 Ca 0.42 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.80 1ckr n GLY 506 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ckr n ARG 506 N 0.00 0.00 -0.19 1.61 1.74 -1.26 -4.97 116.66 113.59 1ckr n ARG 506 Ca 0.00 0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.05 1ckr n ARG 506 Cb 0.00 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.42 1ckr n ARG 506 CO 0.00 0.00 0.00 1.47 -1.52 0.00 0.00 177.63 177.58 1ckr n LEU 507 N 0.00 -0.42 0.00 0.55 -0.00 -1.26 -4.82 117.00 111.05 1ckr n LEU 507 Ca 0.00 0.81 0.00 0.00 -0.00 0.00 0.00 56.01 56.82 1ckr n LEU 507 Cb 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 43.42 43.29 1ckr n LEU 507 CO 0.00 -0.68 0.00 -1.20 -0.00 0.00 0.00 177.39 175.51 1ckr n SER 508 N -4.61 0.00 -0.17 1.45 7.64 -1.26 -2.68 113.62 113.99 1ckr n SER 508 Ca 0.02 0.00 -0.09 0.00 1.01 0.00 0.00 58.87 59.81 1ckr n SER 508 Cb 0.14 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.35 1ckr n SER 508 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 1ckr h LYS 509 N 0.00 0.78 0.38 1.43 -0.00 -1.99 -2.29 116.57 114.88 1ckr h LYS 509 Ca 0.00 -0.18 -0.02 0.00 -0.00 0.00 0.00 60.65 60.45 1ckr h LYS 509 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 32.23 32.13 1ckr h LYS 509 CO 0.00 0.75 -0.18 1.05 -0.00 0.00 0.00 179.45 181.07 1ckr h GLU 510 N 0.67 -0.49 -0.07 0.07 4.11 -1.95 -2.57 114.58 114.34 1ckr h GLU 510 Ca 0.15 0.03 -0.12 0.00 0.07 0.00 0.00 59.36 59.50 1ckr h GLU 510 Cb 0.32 0.11 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1ckr h GLU 510 CO 0.00 -0.26 -0.43 -0.44 0.07 0.00 0.00 179.01 177.96 1ckr h ASP 511 N -0.63 0.49 0.07 3.06 3.32 -1.60 -2.73 116.42 118.40 1ckr h ASP 511 Ca -0.05 -0.67 -0.00 0.00 0.02 0.00 0.00 57.03 56.32 1ckr h ASP 511 Cb 0.46 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1ckr h ASP 511 CO 0.09 1.08 -0.04 0.40 -1.72 0.00 0.00 179.24 179.05 1ckr h ILE 512 N -0.07 1.07 -0.85 0.35 5.03 -1.56 -0.13 117.51 121.34 1ckr h ILE 512 Ca -0.03 -0.49 0.01 0.00 -0.12 0.00 0.00 64.86 64.23 1ckr h ILE 512 Cb 1.09 1.39 -0.04 0.00 -3.03 0.00 0.00 36.82 36.22 1ckr h ILE 512 CO 0.09 0.12 0.56 -0.08 -0.68 0.00 0.00 178.15 178.16 1ckr h GLU 513 N -0.32 1.11 -0.00 2.37 4.57 -1.60 -2.29 114.58 118.42 1ckr h GLU 513 Ca -0.01 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1ckr h GLU 513 Cb 0.28 -0.25 -0.00 0.00 -0.16 0.00 0.00 28.75 28.62 1ckr h GLU 513 CO 0.02 0.73 -0.00 0.07 -1.18 0.00 0.00 179.01 178.65 1ckr h ARG 514 N 1.14 0.00 0.00 1.92 0.11 -1.52 -3.38 114.38 112.65 1ckr h ARG 514 Ca 0.32 -0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.35 1ckr h ARG 514 Cb -0.11 -0.00 -0.01 0.00 1.11 0.00 0.00 29.97 30.97 1ckr h ARG 514 CO -0.08 0.46 -0.36 0.52 0.10 0.00 0.00 179.97 180.61 1ckr h MET 515 N -0.45 0.00 0.00 0.08 2.86 -1.03 -3.39 114.93 113.00 1ckr h MET 515 Ca 0.00 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 1ckr h MET 515 Cb 0.46 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.11 1ckr h MET 515 CO 0.00 0.43 -0.28 -0.24 1.06 0.00 0.00 176.91 177.89 1ckr h VAL 516 N -1.00 0.75 -0.88 -2.22 3.04 -1.56 0.28 116.25 114.66 1ckr h VAL 516 Ca -0.07 -1.17 -0.01 0.00 -1.01 0.00 0.00 66.70 64.45 1ckr h VAL 516 Cb 0.61 1.73 -0.04 0.00 -2.01 0.00 0.00 31.29 31.58 1ckr h VAL 516 CO -0.04 0.27 0.52 1.56 -1.01 0.00 0.00 177.57 178.87 1ckr h GLN 517 N 0.00 1.20 0.00 4.17 4.20 -1.74 -2.86 115.11 120.07 1ckr h GLN 517 Ca -0.00 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1ckr h GLN 517 Cb 0.71 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1ckr h GLN 517 CO 0.04 0.85 -0.93 -0.85 -0.67 0.00 0.00 178.83 177.26 1ckr n GLU 518 N -4.40 0.23 0.00 1.46 -0.00 -1.15 -4.19 120.64 112.58 1ckr n GLU 518 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.26 1ckr n GLU 518 Cb 0.06 -1.58 0.00 0.00 -0.00 0.00 0.00 31.44 29.92 1ckr n GLU 518 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ckr n ALA 519 N -1.76 0.00 -0.27 -1.84 0.00 0.98 -4.38 120.51 113.24 1ckr n ALA 519 Ca 0.03 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.54 1ckr n ALA 519 Cb 0.42 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.08 1ckr n ALA 519 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ckr h GLU 520 N 0.00 0.38 0.01 0.00 4.39 -1.76 0.22 114.58 117.82 1ckr h GLU 520 Ca 0.00 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.69 1ckr h GLU 520 Cb 0.00 -0.09 -0.03 0.00 -0.10 0.00 0.00 28.75 28.53 1ckr h GLU 520 CO 0.00 0.25 -0.31 -0.22 -1.16 0.00 0.00 179.01 177.57 1ckr h LYS 521 N 0.39 -0.39 0.00 2.33 3.11 -1.77 -2.86 116.57 117.38 1ckr h LYS 521 Ca 0.45 0.03 0.00 0.00 -2.81 0.00 0.00 60.65 58.31 1ckr h LYS 521 Cb 0.74 0.09 0.00 0.00 -1.00 0.00 0.00 32.23 32.06 1ckr h LYS 521 CO -0.46 -0.26 0.00 0.98 -2.81 0.00 0.00 179.45 176.90 1ckr n TYR 522 N -4.22 0.00 -0.01 1.91 4.19 0.51 -2.84 117.16 116.70 1ckr n TYR 522 Ca -0.04 0.00 -0.05 0.00 3.31 0.00 0.00 57.90 61.12 1ckr n TYR 522 Cb 0.23 0.00 -0.02 0.00 0.49 0.00 0.00 39.34 40.05 1ckr n TYR 522 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94 1ckr n LYS 523 N -0.50 0.13 0.26 2.98 4.81 0.32 -0.71 118.16 125.43 1ckr n LYS 523 Ca 0.00 0.05 0.17 0.00 -0.87 0.00 0.00 58.31 57.66 1ckr n LYS 523 Cb 0.00 -0.72 0.89 0.00 0.02 0.00 0.00 35.03 35.22 1ckr n LYS 523 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ckr h ALA 524 N -0.22 1.63 0.00 3.14 0.00 -1.62 -0.60 119.26 121.58 1ckr h ALA 524 Ca -0.10 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.60 1ckr h ALA 524 Cb 0.79 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1ckr h ALA 524 CO -0.06 -0.15 -1.04 1.49 0.00 0.00 0.00 179.25 179.49 1ckr h GLU 525 N 0.00 0.00 0.00 0.00 4.81 -1.71 -2.91 114.58 114.76 1ckr h GLU 525 Ca 0.04 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1ckr h GLU 525 Cb 0.26 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.64 1ckr h GLU 525 CO -0.00 0.92 0.22 0.22 -0.73 0.00 0.00 179.01 179.63 1ckr h ASP 526 N 0.00 0.00 -2.04 1.04 1.82 0.67 -3.46 116.42 114.45 1ckr h ASP 526 Ca -0.04 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.60 1ckr h ASP 526 Cb 1.77 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.78 1ckr h ASP 526 CO 0.12 0.00 0.00 -0.62 -1.61 0.00 0.00 179.24 177.13 1ckr n GLU 527 N -2.33 0.00 -3.92 0.28 -0.58 -0.91 -4.20 120.64 108.98 1ckr n GLU 527 Ca -0.01 0.25 -0.29 0.00 -0.42 0.00 0.00 57.16 56.69 1ckr n GLU 527 Cb 0.25 -1.02 -0.01 0.00 -0.57 0.00 0.00 31.44 30.09 1ckr n GLU 527 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1ckr n LYS 528 N -0.77 -2.42 0.00 3.49 4.01 -1.15 -4.88 118.16 116.43 1ckr n LYS 528 Ca 0.00 0.37 0.00 0.00 -0.51 0.00 0.00 58.31 58.17 1ckr n LYS 528 Cb 0.34 -4.22 0.00 0.00 -0.51 0.00 0.00 35.03 30.64 1ckr n LYS 528 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ckr n GLN 529 N -4.41 0.00 -0.15 1.97 0.00 -1.25 -0.95 117.38 112.59 1ckr n GLN 529 Ca -0.25 0.07 0.11 0.00 0.00 0.00 0.00 57.00 56.93 1ckr n GLN 529 Cb 0.66 -0.14 0.28 0.00 0.00 0.00 0.00 30.24 31.04 1ckr n GLN 529 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1ckr n ARG 530 N -0.86 2.09 0.02 2.61 5.12 -1.26 -4.36 116.66 120.04 1ckr n ARG 530 Ca 0.00 -1.66 -0.13 0.00 -1.93 0.00 0.00 57.85 54.13 1ckr n ARG 530 Cb 0.00 -1.44 -0.09 0.00 -1.16 0.00 0.00 32.46 29.78 1ckr n ARG 530 CO 0.00 0.00 0.00 0.22 -1.93 0.00 0.00 177.63 175.92 1ckr h ASP 531 N 3.18 -0.04 -3.17 0.55 3.58 -1.31 -3.39 116.42 115.80 1ckr h ASP 531 Ca 0.00 -0.30 -0.69 0.00 0.42 0.00 0.00 57.03 56.47 1ckr h ASP 531 Cb 0.70 0.01 -0.18 0.00 1.72 0.00 0.00 39.33 41.58 1ckr h ASP 531 CO 0.00 0.27 0.08 -0.54 -2.88 0.00 0.00 179.24 176.17 1ckr s LYS 532 N -4.92 3.11 0.00 0.28 -0.14 -1.20 -4.15 119.74 112.72 1ckr s LYS 532 Ca -0.15 -0.96 0.00 0.00 -1.36 0.00 0.00 55.97 53.50 1ckr s LYS 532 Cb 0.03 -4.13 0.00 0.00 -1.68 0.00 0.00 37.83 32.05 1ckr s LYS 532 CO 0.66 -1.30 0.00 1.55 -0.76 0.00 0.00 175.35 175.50 1ckr n VAL 533 N 5.62 0.00 0.06 3.17 3.14 -0.55 -5.00 118.33 124.78 1ckr n VAL 533 Ca -0.07 0.00 -0.02 0.00 -2.96 0.00 0.00 64.34 61.29 1ckr n VAL 533 Cb 0.45 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.22 1ckr n VAL 533 CO 0.00 0.00 0.00 -1.28 -6.46 0.00 0.00 176.83 169.09 1ckr h SER 534 N 0.00 -0.14 0.00 6.55 0.87 -1.89 -3.42 113.55 115.52 1ckr h SER 534 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1ckr h SER 534 Cb 0.00 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1ckr h SER 534 CO 0.00 -0.10 -0.09 -1.28 -0.53 0.00 0.00 176.83 174.83 1ckr h SER 535 N -0.16 0.00 0.00 6.23 0.87 -1.90 -3.50 113.55 115.09 1ckr h SER 535 Ca -0.02 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1ckr h SER 535 Cb 0.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1ckr h SER 535 CO 0.03 0.17 0.00 1.17 -0.53 0.00 0.00 176.83 177.67 1ckr n LYS 536 N -2.81 0.00 -3.05 2.24 0.00 -1.26 -4.97 118.16 108.31 1ckr n LYS 536 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 58.31 58.05 1ckr n LYS 536 Cb 0.05 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 35.04 1ckr n LYS 536 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1ckr n ASN 537 N -1.79 3.38 -4.89 3.14 4.13 -1.26 -1.48 115.26 116.49 1ckr n ASN 537 Ca 0.00 -3.47 -0.21 0.00 1.68 0.00 0.00 54.58 52.58 1ckr n ASN 537 Cb 0.00 -0.59 -0.03 0.00 -1.54 0.00 0.00 39.78 37.63 1ckr n ASN 537 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1ckr s SER 538 N -3.07 5.63 -0.41 6.41 1.04 -1.26 0.27 113.70 122.31 1ckr s SER 538 Ca 0.46 -0.30 0.05 0.00 0.48 0.00 0.00 55.95 56.64 1ckr s SER 538 Cb 0.29 -1.25 0.19 0.00 0.10 0.00 0.00 66.02 65.35 1ckr s SER 538 CO -0.11 -0.26 0.42 0.00 0.98 0.00 0.00 173.24 174.26 1ckr n LEU 539 N -1.39 -0.53 0.00 2.42 -0.00 -1.26 -3.27 117.00 112.96 1ckr n LEU 539 Ca -0.04 -4.35 0.00 0.00 -0.00 0.00 0.00 56.01 51.62 1ckr n LEU 539 Cb 0.59 0.59 0.00 0.00 -0.00 0.00 0.00 43.42 44.60 1ckr n LEU 539 CO 0.43 1.92 0.00 -1.84 -0.00 0.00 0.00 177.39 177.90