#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w4s h THR 388 N 0.00 1.08 -0.25 5.18 2.02 -2.05 -1.82 112.91 117.07 2w4s h THR 388 Ca 0.00 -2.63 0.02 0.00 0.77 0.00 0.00 66.41 64.57 2w4s h THR 388 Cb 0.00 2.85 -0.02 0.00 -1.74 0.00 0.00 68.15 69.23 2w4s h THR 388 CO 0.00 0.84 0.12 -0.03 0.37 0.00 0.00 175.52 176.82 2w4s h MET 389 N 0.11 0.26 0.00 6.66 1.85 -2.05 -0.34 114.93 121.42 2w4s h MET 389 Ca -0.30 -0.02 -0.06 0.00 -0.61 0.00 0.00 59.70 58.72 2w4s h MET 389 Cb 2.10 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 34.07 2w4s h MET 389 CO 0.20 0.17 -0.28 1.05 -0.40 0.00 0.00 176.91 177.66 2w4s h GLU 390 N 0.26 0.00 0.00 0.39 4.11 -1.99 0.30 114.58 117.65 2w4s h GLU 390 Ca 0.10 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.48 2w4s h GLU 390 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2w4s h GLU 390 CO -0.07 0.28 -0.26 1.03 0.07 0.00 0.00 179.01 180.05 2w4s h SER 391 N 0.00 0.00 0.27 3.06 0.87 -1.01 -1.25 113.55 115.49 2w4s h SER 391 Ca -0.00 0.00 -0.34 0.00 -1.23 0.00 0.00 61.79 60.22 2w4s h SER 391 Cb 0.80 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.74 2w4s h SER 391 CO 0.04 0.26 -1.83 0.40 -0.53 0.00 0.00 176.83 175.16 2w4s h ILE 392 N 0.00 0.78 -0.21 2.23 2.04 0.48 -3.08 117.51 119.75 2w4s h ILE 392 Ca -0.00 -2.51 -0.00 0.00 1.00 0.00 0.00 64.86 63.34 2w4s h ILE 392 Cb 0.74 2.55 -0.01 0.00 -0.74 0.00 0.00 36.82 39.36 2w4s h ILE 392 CO 0.03 0.79 0.13 0.58 0.00 0.00 0.00 178.15 179.68 2w4s h VAL 393 N 0.06 1.09 -0.72 1.67 2.07 -0.50 0.12 116.25 120.03 2w4s h VAL 393 Ca -0.36 -0.22 0.11 0.00 0.82 0.00 0.00 66.70 67.05 2w4s h VAL 393 Cb 2.03 0.85 -0.12 0.00 -1.52 0.00 0.00 31.29 32.53 2w4s h VAL 393 CO 0.11 0.09 -0.41 0.25 0.02 0.00 0.00 177.57 177.63 2w4s h LEU 394 N 0.26 -1.44 -0.41 2.57 5.85 -1.34 -0.68 115.31 120.12 2w4s h LEU 394 Ca 0.08 0.26 -0.18 0.00 0.84 0.00 0.00 57.88 58.88 2w4s h LEU 394 Cb 0.03 0.69 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2w4s h LEU 394 CO -0.01 -0.31 -0.72 0.78 -0.34 0.00 0.00 178.44 177.83 2w4s h ASN 395 N -0.13 0.47 0.48 1.25 2.35 -1.39 -1.20 115.58 117.40 2w4s h ASN 395 Ca 0.24 -0.31 -0.02 0.00 -0.55 0.00 0.00 56.30 55.66 2w4s h ASN 395 Cb 0.56 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.79 2w4s h ASN 395 CO -0.78 1.05 -0.24 0.74 -1.65 0.00 0.00 177.43 176.54 2w4s h THR 396 N 0.27 0.51 -0.56 2.81 2.02 -0.44 -0.27 112.91 117.24 2w4s h THR 396 Ca -0.03 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 2w4s h THR 396 Cb 1.30 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.19 2w4s h THR 396 CO 0.12 0.00 0.23 0.40 0.37 0.00 0.00 175.52 176.64 2w4s h ILE 397 N -0.66 1.22 -0.04 3.11 2.04 -1.10 -0.21 117.51 121.88 2w4s h ILE 397 Ca -0.06 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.11 2w4s h ILE 397 Cb 0.51 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2w4s h ILE 397 CO 0.10 0.27 0.00 0.58 0.00 0.00 0.00 178.15 179.10 2w4s h VAL 398 N 0.77 0.98 -0.68 1.67 2.07 -1.20 0.35 116.25 120.21 2w4s h VAL 398 Ca 0.19 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.78 2w4s h VAL 398 Cb 0.20 0.96 -0.06 0.00 -1.52 0.00 0.00 31.29 30.87 2w4s h VAL 398 CO -0.02 0.00 0.35 0.74 0.02 0.00 0.00 177.57 178.67 2w4s h THR 399 N 0.02 0.89 -0.00 2.57 2.02 -0.74 -0.10 112.91 117.58 2w4s h THR 399 Ca 0.02 -0.21 -0.17 0.00 0.77 0.00 0.00 66.41 66.81 2w4s h THR 399 Cb 0.02 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 66.62 2w4s h THR 399 CO -0.03 0.11 -0.81 1.23 0.37 0.00 0.00 175.52 176.40 2w4s h GLY 400 N 0.62 0.07 2.00 2.16 0.00 -0.71 -2.53 103.07 104.69 2w4s h GLY 400 Ca 0.32 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.53 2w4s h GLY 400 CO -0.23 0.11 0.00 1.41 0.00 0.00 0.00 176.54 177.83 2w4s h LEU 401 N 0.04 0.00 -2.80 3.11 4.07 -0.82 -3.48 115.31 115.43 2w4s h LEU 401 Ca -0.02 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.79 2w4s h LEU 401 Cb 1.42 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.16 2w4s h LEU 401 CO 0.11 0.00 -0.41 0.00 -1.08 0.00 0.00 178.44 177.06 2w4s n GLN 402 N -2.73 -1.52 0.07 1.13 6.02 -0.06 -4.52 117.38 115.76 2w4s n GLN 402 Ca 0.04 1.36 0.00 0.00 -0.01 0.00 0.00 57.00 58.39 2w4s n GLN 402 Cb 0.47 -4.62 0.00 0.00 1.02 0.00 0.00 30.24 27.11 2w4s n GLN 402 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2w4s n LYS 406 N -1.77 0.00 -0.27 -1.09 5.02 -1.26 -5.04 118.16 113.74 2w4s n LYS 406 Ca -0.08 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.29 2w4s n LYS 406 Cb 0.56 -0.21 0.23 0.00 -0.02 0.00 0.00 35.03 35.58 2w4s n LYS 406 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2w4s h GLU 407 N 0.00 0.35 0.06 1.97 4.39 -2.01 0.68 114.58 120.02 2w4s h GLU 407 Ca 0.00 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 2w4s h GLU 407 Cb 0.17 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2w4s h GLU 407 CO 0.00 0.23 -0.03 0.35 -1.16 0.00 0.00 179.01 178.41 2w4s h PHE 408 N 0.36 -0.07 -0.17 4.33 3.57 -2.01 -2.56 116.94 120.39 2w4s h PHE 408 Ca 0.47 -0.00 -0.07 0.00 3.53 0.00 0.00 57.97 61.89 2w4s h PHE 408 Cb 0.81 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.56 2w4s h PHE 408 CO -0.20 -0.03 -0.21 0.82 -2.23 0.00 0.00 178.31 176.47 2w4s h ILE 409 N -0.10 1.23 -0.34 1.41 1.08 -1.67 -2.74 117.51 116.39 2w4s h ILE 409 Ca -0.01 -1.05 0.03 0.00 -0.39 0.00 0.00 64.86 63.44 2w4s h ILE 409 Cb 0.08 1.33 -0.03 0.00 -3.07 0.00 0.00 36.82 35.13 2w4s h ILE 409 CO 0.01 0.33 0.16 0.00 -0.69 0.00 0.00 178.15 177.96 2w4s h ALA 410 N 1.51 0.42 -0.50 1.87 0.00 -0.73 -2.45 119.26 119.38 2w4s h ALA 410 Ca 0.05 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 2w4s h ALA 410 Cb 0.53 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2w4s h ALA 410 CO 0.04 -0.22 0.08 0.00 0.00 0.00 0.00 179.25 179.14 2w4s h ARG 411 N 0.33 0.79 -0.49 0.00 3.08 -1.17 -0.40 114.38 116.52 2w4s h ARG 411 Ca 0.15 -0.18 0.08 0.00 0.07 0.00 0.00 59.98 60.09 2w4s h ARG 411 Cb 0.07 -0.11 -0.06 0.00 0.08 0.00 0.00 29.97 29.95 2w4s h ARG 411 CO -0.11 0.75 0.13 0.28 -1.07 0.00 0.00 179.97 179.95 2w4s h VAL 412 N 0.76 0.78 -0.15 2.04 2.07 -1.31 0.09 116.25 120.54 2w4s h VAL 412 Ca 0.16 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 2w4s h VAL 412 Cb 0.35 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 2w4s h VAL 412 CO 0.01 0.05 -0.04 0.40 0.02 0.00 0.00 177.57 178.01 2w4s h ILE 413 N 0.28 1.30 0.00 4.57 2.04 -0.90 0.30 117.51 125.10 2w4s h ILE 413 Ca 0.24 -1.02 0.00 0.00 1.00 0.00 0.00 64.86 65.08 2w4s h ILE 413 Cb 0.29 1.67 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 2w4s h ILE 413 CO -0.28 0.30 0.00 0.11 0.00 0.00 0.00 178.15 178.27 2w4s h LYS 414 N -0.03 0.00 0.02 2.37 1.79 -1.01 -0.36 116.57 119.35 2w4s h LYS 414 Ca 0.04 0.00 -0.32 0.00 -2.18 0.00 0.00 60.65 58.19 2w4s h LYS 414 Cb 0.48 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.09 2w4s h LYS 414 CO 0.02 0.00 -1.74 2.41 -1.08 0.00 0.00 179.45 179.06 2w4s n THR 415 N -2.96 1.57 0.62 -0.16 -1.04 0.01 -4.70 114.28 107.63 2w4s n THR 415 Ca -0.02 -0.23 0.06 0.00 -2.04 0.00 0.00 64.05 61.83 2w4s n THR 415 Cb 0.13 -1.93 -0.06 0.00 -1.82 0.00 0.00 70.33 66.65 2w4s n THR 415 CO 0.00 0.00 0.00 2.30 -0.64 0.00 0.00 175.07 176.73 2w4s n ILE 416 N -4.20 0.00 0.00 12.58 -5.35 0.99 -5.08 119.36 118.30 2w4s n ILE 416 Ca -0.38 -0.22 0.00 0.00 -0.27 0.00 0.00 62.75 61.88 2w4s n ILE 416 Cb 0.80 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.73 2w4s n ILE 416 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2w4s n GLY 417 N 1.27 0.82 0.30 3.28 0.00 -0.15 -4.35 105.19 106.37 2w4s n GLY 417 Ca 0.03 -1.59 0.06 0.00 0.00 0.00 0.00 46.02 44.52 2w4s n GLY 417 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2w4s h SER 418 N 0.00 0.51 -0.09 1.61 0.02 -1.94 -1.69 113.55 111.98 2w4s h SER 418 Ca 0.00 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.04 2w4s h SER 418 Cb 0.00 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2w4s h SER 418 CO 0.00 0.23 0.05 -0.61 -1.14 0.00 0.00 176.83 175.36 2w4s h GLN 419 N 0.62 0.12 -0.01 3.45 4.15 -1.95 -2.04 115.11 119.45 2w4s h GLN 419 Ca 0.44 -0.01 -0.15 0.00 0.77 0.00 0.00 58.65 59.70 2w4s h GLN 419 Cb 0.60 -0.03 -0.02 0.00 0.21 0.00 0.00 27.48 28.24 2w4s h GLN 419 CO -0.35 0.13 -0.72 -0.09 -1.93 0.00 0.00 178.83 175.88 2w4s h ARG 420 N 0.08 0.05 -0.46 1.69 1.12 -1.70 -2.61 114.38 112.55 2w4s h ARG 420 Ca 0.03 -0.04 -0.08 0.00 -1.11 0.00 0.00 59.98 58.78 2w4s h ARG 420 Cb 0.04 0.01 -0.02 0.00 -0.01 0.00 0.00 29.97 29.99 2w4s h ARG 420 CO -0.01 0.74 -0.04 0.77 -3.11 0.00 0.00 179.97 178.33 2w4s h SER 421 N 0.03 0.83 -0.48 -3.80 0.02 -1.14 -1.28 113.55 107.73 2w4s h SER 421 Ca -0.01 -0.33 -0.08 0.00 -0.84 0.00 0.00 61.79 60.53 2w4s h SER 421 Cb 1.27 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 63.57 2w4s h SER 421 CO 0.10 0.95 -0.01 -0.07 -1.14 0.00 0.00 176.83 176.67 2w4s h LEU 422 N 0.68 0.83 -1.00 5.07 3.38 -1.31 -0.16 115.31 122.80 2w4s h LEU 422 Ca 0.13 -0.31 0.11 0.00 0.09 0.00 0.00 57.88 57.89 2w4s h LEU 422 Cb 0.55 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.00 2w4s h LEU 422 CO 0.03 0.94 0.63 1.56 0.09 0.00 0.00 178.44 181.70 2w4s h GLN 423 N 0.70 1.00 -0.14 1.13 4.20 -1.33 0.78 115.11 121.46 2w4s h GLN 423 Ca 0.13 -0.06 -0.07 0.00 0.06 0.00 0.00 58.65 58.72 2w4s h GLN 423 Cb 0.52 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 2w4s h GLN 423 CO 0.03 0.66 -0.18 1.25 -0.67 0.00 0.00 178.83 179.92 2w4s h LEU 424 N 1.03 0.39 -0.29 1.46 5.85 -0.95 0.37 115.31 123.17 2w4s h LEU 424 Ca 0.48 -0.51 0.04 0.00 0.84 0.00 0.00 57.88 58.73 2w4s h LEU 424 Cb 0.42 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 2w4s h LEU 424 CO -0.25 0.82 0.08 0.22 -0.34 0.00 0.00 178.44 178.98 2w4s h TYR 425 N -0.03 0.15 -0.64 1.25 3.20 -0.34 0.13 116.97 120.68 2w4s h TYR 425 Ca 0.02 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.95 2w4s h TYR 425 Cb 0.73 -0.02 -0.05 0.00 1.54 0.00 0.00 36.73 38.93 2w4s h TYR 425 CO 0.09 0.06 0.36 1.49 -1.64 0.00 0.00 178.16 178.52 2w4s h GLU 426 N 0.20 0.66 -0.24 1.82 4.81 0.62 -2.11 114.58 120.33 2w4s h GLU 426 Ca 0.13 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.22 2w4s h GLU 426 Cb 0.12 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 2w4s h GLU 426 CO -0.15 0.43 -0.28 -0.97 -0.73 0.00 0.00 179.01 177.31 2w4s h ASN 427 N 0.68 0.49 -0.97 1.04 -1.24 -0.25 -1.87 115.58 113.45 2w4s h ASN 427 Ca 0.28 -0.17 0.05 0.00 0.71 0.00 0.00 56.30 57.17 2w4s h ASN 427 Cb 0.15 -0.13 -0.06 0.00 0.73 0.00 0.00 38.32 39.00 2w4s h ASN 427 CO -0.16 0.76 0.63 0.00 -1.29 0.00 0.00 177.43 177.36 2w4s h ALA 428 N 1.28 1.32 -0.14 1.57 0.00 -0.51 -1.10 119.26 121.68 2w4s h ALA 428 Ca 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2w4s h ALA 428 Cb 0.71 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2w4s h ALA 428 CO 0.05 0.45 0.04 0.52 0.00 0.00 0.00 179.25 180.32 2w4s h MET 429 N 1.17 0.21 -0.35 0.00 2.86 -0.77 0.18 114.93 118.23 2w4s h MET 429 Ca 0.41 -0.05 -0.03 0.00 -2.06 0.00 0.00 59.70 57.96 2w4s h MET 429 Cb 0.10 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 2w4s h MET 429 CO -0.15 0.36 0.09 0.87 1.06 0.00 0.00 176.91 179.14 2w4s h LYS 430 N 0.03 0.56 -0.08 1.72 1.57 -1.10 -1.01 116.57 118.26 2w4s h LYS 430 Ca 0.04 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2w4s h LYS 430 Cb 0.24 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 2w4s h LYS 430 CO -0.00 0.61 0.04 0.28 -0.57 0.00 0.00 179.45 179.81 2w4s h VAL 431 N 0.42 1.00 -0.67 0.50 2.07 -1.13 -2.34 116.25 116.09 2w4s h VAL 431 Ca 0.11 -0.03 0.13 0.00 0.82 0.00 0.00 66.70 67.73 2w4s h VAL 431 Cb 0.29 0.90 -0.09 0.00 -1.52 0.00 0.00 31.29 30.88 2w4s h VAL 431 CO 0.00 0.02 0.19 -0.08 0.02 0.00 0.00 177.57 177.71 2w4s h GLU 432 N 0.09 0.31 -0.77 1.57 4.81 -0.48 -0.59 114.58 119.51 2w4s h GLU 432 Ca 0.03 -0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.36 2w4s h GLU 432 Cb 0.00 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.26 2w4s h GLU 432 CO -0.02 0.20 0.51 -0.91 -0.73 0.00 0.00 179.01 178.06 2w4s h ASN 433 N 0.32 0.55 -0.35 1.04 -0.26 -0.64 -0.85 115.58 115.38 2w4s h ASN 433 Ca 0.36 0.02 0.00 0.00 -0.56 0.00 0.00 56.30 56.13 2w4s h ASN 433 Cb 0.56 -0.09 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 2w4s h ASN 433 CO -0.43 0.31 0.00 -1.20 -1.06 0.00 0.00 177.43 175.05 2w4s n SER 434 N -4.50 3.65 0.00 5.81 7.64 -0.88 -4.87 113.62 120.46 2w4s n SER 434 Ca 0.14 -2.49 0.00 0.00 1.01 0.00 0.00 58.87 57.53 2w4s n SER 434 Cb 0.41 -0.58 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 2w4s n SER 434 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2w4s n GLY 435 N 0.46 0.95 6.48 0.23 0.00 -0.33 -4.96 105.19 108.01 2w4s n GLY 435 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2w4s n GLY 435 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2w4s n GLY 436 N -2.08 -0.16 3.38 -0.02 0.00 -0.28 -4.60 105.19 101.43 2w4s n GLY 436 Ca 0.00 -1.12 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 2w4s n GLY 436 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 2w4s s LEU 437 N 0.00 1.01 -0.20 0.99 0.05 0.19 -4.81 118.68 115.92 2w4s s LEU 437 Ca 0.00 -1.37 -0.03 0.00 0.05 0.00 0.00 54.13 52.78 2w4s s LEU 437 Cb 0.00 1.02 -0.01 0.00 -2.05 0.00 0.00 46.19 45.15 2w4s s LEU 437 CO 0.00 -1.07 -0.05 -0.22 -0.55 0.00 0.00 176.35 174.46 2w4s s LEU 438 N -3.18 2.94 1.06 1.48 2.96 -1.26 -0.47 118.68 122.20 2w4s s LEU 438 Ca 0.33 -0.34 -0.16 0.00 -0.22 0.00 0.00 54.13 53.74 2w4s s LEU 438 Cb 0.02 -1.74 0.22 0.00 0.50 0.00 0.00 46.19 45.20 2w4s s LEU 438 CO 0.16 0.03 1.14 0.42 -1.32 0.00 0.00 176.35 176.78 2w4s s THR 439 N 1.20 1.83 0.56 3.68 -4.23 -0.49 -4.91 115.64 113.29 2w4s s THR 439 Ca 0.02 0.00 0.26 0.00 -1.18 0.00 0.00 61.69 60.79 2w4s s THR 439 Cb -0.14 -2.62 0.35 0.00 1.34 0.00 0.00 72.50 71.43 2w4s s THR 439 CO -0.01 0.00 2.10 0.00 -0.54 0.00 0.00 174.62 176.16 2w4s h ALA 440 N -2.08 1.97 -0.45 3.99 0.00 -2.00 -2.22 119.26 118.48 2w4s h ALA 440 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2w4s h ALA 440 Cb 1.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2w4s h ALA 440 CO 0.46 -0.30 0.00 -0.25 0.00 0.00 0.00 179.25 179.16 2w4s n ASP 441 N -4.05 2.66 -2.37 0.00 8.00 -1.26 -4.91 116.55 114.61 2w4s n ASP 441 Ca 0.02 -2.08 -0.19 0.00 0.71 0.00 0.00 54.79 53.26 2w4s n ASP 441 Cb 0.33 -0.35 0.01 0.00 -0.02 0.00 0.00 41.12 41.09 2w4s n ASP 441 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2w4s n MET 442 N 0.78 -2.91 -3.64 -1.24 2.81 -0.83 -5.00 117.12 107.09 2w4s n MET 442 Ca 0.16 0.84 -0.37 0.00 -1.81 0.00 0.00 57.70 56.52 2w4s n MET 442 Cb 0.45 -5.41 -0.10 0.00 -0.71 0.00 0.00 33.22 27.45 2w4s n MET 442 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2w4s s SER 443 N -2.47 6.12 0.18 7.83 0.15 -1.26 -4.87 113.70 119.37 2w4s s SER 443 Ca 0.14 0.11 -0.30 0.00 0.70 0.00 0.00 55.95 56.60 2w4s s SER 443 Cb -0.06 -2.11 -0.08 0.00 -1.71 0.00 0.00 66.02 62.06 2w4s s SER 443 CO 0.17 0.04 1.09 -0.13 1.20 0.00 0.00 173.24 175.61 2w4s s ARG 444 N 1.17 4.61 -0.32 5.44 1.81 -1.26 -1.39 118.95 129.00 2w4s s ARG 444 Ca 0.08 1.70 0.01 0.00 -1.72 0.00 0.00 55.73 55.80 2w4s s ARG 444 Cb -0.14 -3.28 0.08 0.00 -0.45 0.00 0.00 34.95 31.16 2w4s s ARG 444 CO 0.05 0.10 0.03 1.03 -0.68 0.00 0.00 175.30 175.83 2w4s s ARG 445 N -0.42 2.02 -0.02 3.54 1.81 0.38 -4.96 118.95 121.30 2w4s s ARG 445 Ca 0.49 -1.57 0.11 0.00 -1.72 0.00 0.00 55.73 53.03 2w4s s ARG 445 Cb -0.29 -3.19 -0.17 0.00 -0.45 0.00 0.00 34.95 30.85 2w4s s ARG 445 CO 0.35 -0.79 0.22 0.36 -0.68 0.00 0.00 175.30 174.76 2w4s n LYS 446 N 4.46 0.49 -3.15 3.54 2.85 -1.26 -0.63 118.16 124.45 2w4s n LYS 446 Ca -0.06 -0.09 -0.31 0.00 -1.05 0.00 0.00 58.31 56.80 2w4s n LYS 446 Cb 0.42 -1.26 -0.04 0.00 -0.65 0.00 0.00 35.03 33.50 2w4s n LYS 446 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 2w4s s THR 447 N -2.72 4.85 0.23 0.58 -4.23 -1.26 -4.63 115.64 108.46 2w4s s THR 447 Ca -0.04 0.52 -0.06 0.00 -1.18 0.00 0.00 61.69 60.93 2w4s s THR 447 Cb 0.07 -3.68 0.19 0.00 1.34 0.00 0.00 72.50 70.41 2w4s s THR 447 CO 0.45 -0.31 1.79 -0.29 -0.54 0.00 0.00 174.62 175.72 2w4s h ILE 448 N 1.53 0.87 0.08 2.99 6.09 -1.92 0.75 117.51 127.90 2w4s h ILE 448 Ca -0.47 -0.23 -0.00 0.00 -1.37 0.00 0.00 64.86 62.78 2w4s h ILE 448 Cb 1.18 0.14 0.00 0.00 0.47 0.00 0.00 36.82 38.62 2w4s h ILE 448 CO 0.66 0.12 -0.04 1.23 -3.07 0.00 0.00 178.15 177.05 2w4s h GLY 449 N 0.67 -0.11 0.40 8.18 0.00 -1.92 0.31 103.07 110.60 2w4s h GLY 449 Ca 0.37 0.04 0.09 0.00 0.00 0.00 0.00 47.33 47.83 2w4s h GLY 449 CO -0.26 -0.04 0.19 -1.33 0.00 0.00 0.00 176.54 175.10 2w4s h GLY 450 N -0.39 0.78 0.99 4.60 0.00 -1.90 0.22 103.07 107.37 2w4s h GLY 450 Ca -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.21 2w4s h GLY 450 CO 0.02 -0.03 -0.14 -2.08 0.00 0.00 0.00 176.54 174.31 2w4s h VAL 451 N 0.37 0.71 -0.44 4.60 2.07 -0.52 -1.62 116.25 121.43 2w4s h VAL 451 Ca 0.29 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.88 2w4s h VAL 451 Cb 0.35 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 30.78 2w4s h VAL 451 CO -0.30 0.00 0.08 0.15 0.02 0.00 0.00 177.57 177.52 2w4s h PHE 452 N -0.38 0.13 -0.73 1.57 3.57 0.00 0.16 116.94 121.25 2w4s h PHE 452 Ca -0.04 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.59 2w4s h PHE 452 Cb 0.30 0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.97 2w4s h PHE 452 CO -0.06 -0.00 0.37 0.00 -2.23 0.00 0.00 178.31 176.38 2w4s h TYR 454 N 0.61 1.04 -0.03 0.00 3.20 -0.02 -2.29 116.97 119.48 2w4s h TYR 454 Ca 0.37 -0.23 -0.07 0.00 3.14 0.00 0.00 58.73 61.94 2w4s h TYR 454 Cb 0.41 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 2w4s h TYR 454 CO -0.11 1.02 -0.31 -0.07 -1.64 0.00 0.00 178.16 177.05 2w4s h LEU 455 N 0.77 0.05 -0.13 2.82 3.38 -0.95 -2.19 115.31 119.06 2w4s h LEU 455 Ca 0.12 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2w4s h LEU 455 Cb 0.69 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.42 2w4s h LEU 455 CO 0.05 0.36 -0.02 0.25 0.09 0.00 0.00 178.44 179.17 2w4s h LEU 456 N 0.04 0.24 -1.81 1.67 5.85 -1.08 -2.95 115.31 117.27 2w4s h LEU 456 Ca 0.00 -0.36 0.03 0.00 0.84 0.00 0.00 57.88 58.40 2w4s h LEU 456 Cb 0.57 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 2w4s h LEU 456 CO 0.04 0.54 0.18 0.11 -0.34 0.00 0.00 178.44 178.98 2w4s h LYS 457 N -0.06 0.24 -0.10 1.25 1.57 -1.16 -2.39 116.57 115.92 2w4s h LYS 457 Ca 0.03 -0.01 -0.11 0.00 -1.87 0.00 0.00 60.65 58.69 2w4s h LYS 457 Cb 0.43 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 2w4s h LYS 457 CO 0.01 0.16 -0.41 1.96 -0.57 0.00 0.00 179.45 180.59 2w4s h GLN 458 N 0.24 0.21 -0.72 3.15 4.20 -1.23 -2.40 115.11 118.56 2w4s h GLN 458 Ca 0.11 -0.10 0.04 0.00 0.06 0.00 0.00 58.65 58.77 2w4s h GLN 458 Cb 0.15 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 2w4s h GLN 458 CO -0.02 0.60 0.47 -0.07 -0.67 0.00 0.00 178.83 179.14 2w4s h LEU 459 N 0.18 0.72 0.35 1.46 3.38 -1.29 0.47 115.31 120.58 2w4s h LEU 459 Ca 0.02 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2w4s h LEU 459 Cb 0.81 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.40 2w4s h LEU 459 CO 0.06 0.48 -0.17 0.58 0.09 0.00 0.00 178.44 179.49 2w4s h VAL 460 N 0.83 0.64 -0.19 1.22 2.07 -1.50 0.53 116.25 119.85 2w4s h VAL 460 Ca 0.30 -0.48 0.06 0.00 0.82 0.00 0.00 66.70 67.39 2w4s h VAL 460 Cb 0.13 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.76 2w4s h VAL 460 CO -0.09 0.09 0.16 0.00 0.02 0.00 0.00 177.57 177.75 2w4s h ALA 461 N -0.24 2.00 -0.42 1.67 0.00 -1.02 0.29 119.26 121.54 2w4s h ALA 461 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2w4s h ALA 461 Cb 0.51 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2w4s h ALA 461 CO 0.08 -0.26 0.00 0.39 0.00 0.00 0.00 179.25 179.46 2w4s n GLU 462 N -4.17 2.07 -2.77 0.00 -0.58 0.16 -4.95 120.64 110.40 2w4s n GLU 462 Ca 0.02 -1.65 -0.21 0.00 -0.42 0.00 0.00 57.16 54.89 2w4s n GLU 462 Cb 0.29 -1.38 0.01 0.00 -0.57 0.00 0.00 31.44 29.79 2w4s n GLU 462 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2w4s n ASP 463 N 0.85 -5.87 -0.03 1.62 8.00 0.09 -4.88 116.55 116.32 2w4s n ASP 463 Ca 0.16 -0.17 0.03 0.00 0.71 0.00 0.00 54.79 55.53 2w4s n ASP 463 Cb 0.41 -4.81 -0.16 0.00 -0.02 0.00 0.00 41.12 36.54 2w4s n ASP 463 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2w4s n GLN 464 N -3.59 0.67 -4.85 -1.24 1.13 0.18 -4.75 117.38 104.93 2w4s n GLN 464 Ca -0.16 -0.10 -0.32 0.00 -1.94 0.00 0.00 57.00 54.47 2w4s n GLN 464 Cb 0.64 -1.55 -0.16 0.00 0.11 0.00 0.00 30.24 29.28 2w4s n GLN 464 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2w4s s ILE 465 N -3.14 2.22 0.70 5.09 1.01 -0.99 -4.95 121.20 121.14 2w4s s ILE 465 Ca -0.08 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 59.51 2w4s s ILE 465 Cb 0.11 -1.89 0.02 0.00 0.01 0.00 0.00 42.46 40.71 2w4s s ILE 465 CO 0.87 0.55 1.08 0.42 0.00 0.00 0.00 174.94 177.86 2w4s s THR 466 N 0.61 3.59 0.26 2.92 -4.23 -1.26 -4.14 115.64 113.39 2w4s s THR 466 Ca -0.11 0.60 -0.01 0.00 -1.18 0.00 0.00 61.69 60.98 2w4s s THR 466 Cb -0.16 -3.16 0.24 0.00 1.34 0.00 0.00 72.50 70.76 2w4s s THR 466 CO 0.03 -0.59 1.80 0.40 -0.54 0.00 0.00 174.62 175.72 2w4s h ILE 467 N -0.52 0.85 -0.43 2.99 1.08 -1.99 -0.61 117.51 118.88 2w4s h ILE 467 Ca -0.45 -0.27 -0.02 0.00 -0.39 0.00 0.00 64.86 63.72 2w4s h ILE 467 Cb 1.23 -0.02 -0.02 0.00 -3.07 0.00 0.00 36.82 34.94 2w4s h ILE 467 CO 0.54 0.15 0.17 1.56 -0.69 0.00 0.00 178.15 179.88 2w4s h GLN 468 N 0.80 0.65 -0.20 2.37 4.20 -1.99 -0.64 115.11 120.30 2w4s h GLN 468 Ca 0.45 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 59.03 2w4s h GLN 468 Cb 0.50 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.17 2w4s h GLN 468 CO -0.29 0.59 0.07 0.93 -0.67 0.00 0.00 178.83 179.47 2w4s h GLU 469 N 0.56 0.30 -0.63 1.46 5.08 -1.77 -1.80 114.58 117.78 2w4s h GLU 469 Ca 0.14 -0.06 0.09 0.00 -1.00 0.00 0.00 59.36 58.54 2w4s h GLU 469 Cb 0.19 -0.05 -0.07 0.00 0.50 0.00 0.00 28.75 29.32 2w4s h GLU 469 CO -0.01 0.38 0.25 2.35 -1.00 0.00 0.00 179.01 180.98 2w4s h TRP 470 N 0.16 0.44 -0.77 4.33 2.91 -0.75 -0.77 115.95 121.49 2w4s h TRP 470 Ca 0.06 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.09 2w4s h TRP 470 Cb 0.20 -0.10 -0.04 0.00 -0.51 0.00 0.00 29.16 28.71 2w4s h TRP 470 CO -0.01 0.12 0.39 -0.91 -1.03 0.00 0.00 178.44 177.00 2w4s h ASN 471 N 0.44 0.99 -0.98 2.65 2.35 -0.94 -0.83 115.58 119.27 2w4s h ASN 471 Ca 0.32 -0.10 0.05 0.00 -0.55 0.00 0.00 56.30 56.02 2w4s h ASN 471 Cb 0.38 -0.25 -0.06 0.00 0.05 0.00 0.00 38.32 38.44 2w4s h ASN 471 CO -0.30 0.82 0.63 0.22 -1.65 0.00 0.00 177.43 177.15 2w4s h TYR 472 N 1.09 1.18 0.09 1.19 3.20 -0.30 -3.08 116.97 120.34 2w4s h TYR 472 Ca 0.27 0.03 -0.21 0.00 3.14 0.00 0.00 58.73 61.96 2w4s h TYR 472 Cb 0.08 -0.39 0.02 0.00 1.54 0.00 0.00 36.73 37.99 2w4s h TYR 472 CO 0.01 0.63 -0.86 0.82 -1.64 0.00 0.00 178.16 177.12 2w4s h ILE 473 N 1.18 1.42 0.00 1.81 2.04 -0.23 -3.26 117.51 120.46 2w4s h ILE 473 Ca 0.41 -2.36 -0.01 0.00 1.00 0.00 0.00 64.86 63.90 2w4s h ILE 473 Cb 0.11 2.87 -0.00 0.00 -0.74 0.00 0.00 36.82 39.05 2w4s h ILE 473 CO -0.15 0.69 -0.04 -0.09 0.00 0.00 0.00 178.15 178.56 2w4s h ARG 474 N -0.11 0.00 0.00 2.37 2.43 -1.24 -3.47 114.38 114.36 2w4s h ARG 474 Ca -0.13 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2w4s h ARG 474 Cb 1.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.16 2w4s h ARG 474 CO 0.17 0.04 0.00 1.04 -1.51 0.00 0.00 179.97 179.70