#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i88 h LYS 346 N 0.00 -0.28 0.42 0.38 6.56 -2.03 -2.27 116.57 119.36 2i88 h LYS 346 Ca 0.00 0.02 -0.02 0.00 -1.06 0.00 0.00 60.65 59.59 2i88 h LYS 346 Cb 0.00 0.06 -0.00 0.00 -0.57 0.00 0.00 32.23 31.72 2i88 h LYS 346 CO 0.00 -0.18 -0.25 -0.44 -2.06 0.00 0.00 179.45 176.52 2i88 h ASP 347 N -0.29 -0.62 -0.87 0.86 3.32 -2.03 -2.21 116.42 114.58 2i88 h ASP 347 Ca 0.15 0.04 0.18 0.00 0.02 0.00 0.00 57.03 57.42 2i88 h ASP 347 Cb 0.57 0.18 -0.16 0.00 0.22 0.00 0.00 39.33 40.14 2i88 h ASP 347 CO -0.61 -0.40 -0.20 0.00 -1.72 0.00 0.00 179.24 176.31 2i88 h ALA 348 N -0.08 0.61 -0.28 3.45 0.00 -1.75 0.83 119.26 122.04 2i88 h ALA 348 Ca -0.05 0.34 -0.09 0.00 0.00 0.00 0.00 54.91 55.11 2i88 h ALA 348 Cb 0.52 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2i88 h ALA 348 CO 0.05 -0.40 -0.16 0.28 0.00 0.00 0.00 179.25 179.02 2i88 h VAL 349 N 0.00 1.30 -0.56 0.00 2.07 -1.34 -0.02 116.25 117.70 2i88 h VAL 349 Ca 0.43 -1.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 2i88 h VAL 349 Cb 0.67 1.51 -0.03 0.00 -1.52 0.00 0.00 31.29 31.92 2i88 h VAL 349 CO -0.89 0.40 0.34 0.44 0.02 0.00 0.00 177.57 177.89 2i88 h ASP 350 N 0.35 0.68 -0.27 0.57 5.19 -0.01 -1.96 116.42 120.97 2i88 h ASP 350 Ca 0.06 -0.06 -0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2i88 h ASP 350 Cb 0.69 -0.17 -0.01 0.00 0.18 0.00 0.00 39.33 40.02 2i88 h ASP 350 CO 0.05 0.53 0.15 0.00 -3.12 0.00 0.00 179.24 176.85 2i88 h ALA 351 N 1.17 0.35 -0.72 3.45 0.00 0.72 -2.26 119.26 121.98 2i88 h ALA 351 Ca 0.20 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.12 2i88 h ALA 351 Cb -0.02 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.60 2i88 h ALA 351 CO -0.04 -0.13 0.39 1.15 0.00 0.00 0.00 179.25 180.62 2i88 h THR 352 N 0.33 0.92 -0.79 0.00 2.02 -0.69 -0.52 112.91 114.17 2i88 h THR 352 Ca 0.10 -0.23 -0.00 0.00 0.77 0.00 0.00 66.41 67.04 2i88 h THR 352 Cb 0.06 0.17 -0.04 0.00 -1.74 0.00 0.00 68.15 66.60 2i88 h THR 352 CO -0.02 0.12 0.48 0.58 0.37 0.00 0.00 175.52 177.06 2i88 h VAL 353 N 0.68 1.22 -0.63 3.16 2.07 -1.00 -1.34 116.25 120.41 2i88 h VAL 353 Ca 0.34 -0.48 -0.03 0.00 0.82 0.00 0.00 66.70 67.35 2i88 h VAL 353 Cb 0.28 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 2i88 h VAL 353 CO -0.22 0.23 0.29 0.28 0.02 0.00 0.00 177.57 178.16 2i88 h SER 354 N 1.09 0.84 -0.36 0.57 0.02 -0.57 -1.78 113.55 113.36 2i88 h SER 354 Ca 0.28 -0.14 0.07 0.00 -0.84 0.00 0.00 61.79 61.16 2i88 h SER 354 Cb -0.05 -0.22 -0.06 0.00 0.14 0.00 0.00 62.40 62.21 2i88 h SER 354 CO -0.05 0.75 -0.06 0.15 -1.14 0.00 0.00 176.83 176.48 2i88 h PHE 355 N 0.87 -0.13 -0.76 3.45 3.57 -0.21 -1.16 116.94 122.57 2i88 h PHE 355 Ca 0.22 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.78 2i88 h PHE 355 Cb 0.14 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.95 2i88 h PHE 355 CO 0.00 -0.13 0.48 1.88 -2.23 0.00 0.00 178.31 178.32 2i88 h TYR 356 N 0.03 0.89 -0.11 0.41 0.99 -0.76 0.67 116.97 119.08 2i88 h TYR 356 Ca 0.17 0.02 -0.09 0.00 2.00 0.00 0.00 58.73 60.84 2i88 h TYR 356 Cb 0.26 -0.29 -0.01 0.00 1.00 0.00 0.00 36.73 37.68 2i88 h TYR 356 CO -0.30 0.50 -0.35 1.96 -0.00 0.00 0.00 178.16 179.97 2i88 h GLN 357 N 0.92 0.23 -0.04 4.88 1.08 -0.46 -1.87 115.11 119.85 2i88 h GLN 357 Ca 0.31 -0.09 -0.14 0.00 -1.45 0.00 0.00 58.65 57.27 2i88 h GLN 357 Cb 0.04 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.45 2i88 h GLN 357 CO -0.12 0.55 -0.63 1.15 -0.95 0.00 0.00 178.83 178.83 2i88 h THR 358 N 0.20 1.41 -0.76 -0.54 2.02 -0.25 -0.72 112.91 114.27 2i88 h THR 358 Ca 0.02 -2.06 -0.01 0.00 0.77 0.00 0.00 66.41 65.13 2i88 h THR 358 Cb 0.71 2.07 -0.04 0.00 -1.74 0.00 0.00 68.15 69.16 2i88 h THR 358 CO 0.05 0.60 0.42 -0.07 0.37 0.00 0.00 175.52 176.90 2i88 h LEU 359 N 0.12 0.94 -0.62 2.58 3.38 -0.33 0.31 115.31 121.69 2i88 h LEU 359 Ca -0.01 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 2i88 h LEU 359 Cb 1.13 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 2i88 h LEU 359 CO 0.09 0.76 0.12 0.74 0.09 0.00 0.00 178.44 180.24 2i88 h THR 360 N 1.04 1.26 -0.26 0.22 2.02 -0.98 0.11 112.91 116.33 2i88 h THR 360 Ca 0.27 -0.99 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 2i88 h THR 360 Cb 0.02 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 2i88 h THR 360 CO -0.04 0.37 0.14 -0.33 0.37 0.00 0.00 175.52 176.02 2i88 h GLU 361 N 0.93 0.36 -0.07 6.66 5.08 -0.52 -3.29 114.58 123.74 2i88 h GLU 361 Ca 0.19 -0.04 -0.25 0.00 -1.00 0.00 0.00 59.36 58.26 2i88 h GLU 361 Cb 0.41 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.61 2i88 h GLU 361 CO 0.01 0.32 -0.93 0.87 -1.00 0.00 0.00 179.01 178.28 2i88 h LYS 362 N 0.30 0.74 0.00 2.33 1.57 -0.77 -3.48 116.57 117.26 2i88 h LYS 362 Ca 0.09 -0.71 0.00 0.00 -1.87 0.00 0.00 60.65 58.16 2i88 h LYS 362 Cb 0.07 0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2i88 h LYS 362 CO -0.01 1.30 0.00 0.66 -0.57 0.00 0.00 179.45 180.82 2i88 n TYR 363 N -3.89 0.00 -0.77 -1.35 4.02 0.37 -5.09 117.16 110.45 2i88 n TYR 363 Ca -0.09 0.00 -0.32 0.00 -0.01 0.00 0.00 57.90 57.47 2i88 n TYR 363 Cb 0.83 0.00 0.14 0.00 -0.02 0.00 0.00 39.34 40.28 2i88 n TYR 363 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2i88 n GLY 364 N 2.45 -1.47 0.19 2.72 0.00 -1.26 -4.48 105.19 103.33 2i88 n GLY 364 Ca 0.00 -0.73 -0.15 0.00 0.00 0.00 0.00 46.02 45.14 2i88 n GLY 364 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2i88 h GLU 365 N -1.65 0.58 -0.88 1.61 4.22 -1.90 -2.67 114.58 113.90 2i88 h GLU 365 Ca -0.43 -0.53 -0.01 0.00 0.08 0.00 0.00 59.36 58.46 2i88 h GLU 365 Cb 1.28 0.13 -0.04 0.00 0.50 0.00 0.00 28.75 30.62 2i88 h GLU 365 CO 0.37 1.15 0.49 0.87 -2.18 0.00 0.00 179.01 179.71 2i88 h LYS 366 N 0.37 1.21 0.49 1.92 1.57 -1.89 -2.57 116.57 117.68 2i88 h LYS 366 Ca -0.07 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 2i88 h LYS 366 Cb 1.47 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.54 2i88 h LYS 366 CO 0.16 0.88 -0.26 -0.92 -0.57 0.00 0.00 179.45 178.74 2i88 h TYR 367 N 1.22 -0.68 -0.86 -1.35 3.20 -1.69 -2.28 116.97 114.54 2i88 h TYR 367 Ca 0.31 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.34 2i88 h TYR 367 Cb 0.01 0.23 -0.10 0.00 1.54 0.00 0.00 36.73 38.41 2i88 h TYR 367 CO 0.01 -0.41 0.42 1.03 -1.64 0.00 0.00 178.16 177.57 2i88 h SER 368 N -0.70 0.46 0.15 -2.11 0.87 -1.13 -1.25 113.55 109.85 2i88 h SER 368 Ca -0.06 0.11 -0.15 0.00 -1.23 0.00 0.00 61.79 60.46 2i88 h SER 368 Cb 0.55 0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.55 2i88 h SER 368 CO 0.09 0.15 -0.56 0.11 -0.53 0.00 0.00 176.83 176.09 2i88 h LYS 369 N 0.55 0.43 -0.59 2.24 1.57 -1.40 -2.45 116.57 116.92 2i88 h LYS 369 Ca 0.49 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.99 2i88 h LYS 369 Cb 0.78 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 33.10 2i88 h LYS 369 CO -0.42 0.87 0.33 1.98 -0.57 0.00 0.00 179.45 181.65 2i88 h MET 370 N 0.33 0.82 -0.41 3.15 4.05 -0.66 0.16 114.93 122.37 2i88 h MET 370 Ca 0.00 -0.09 0.03 0.00 -0.28 0.00 0.00 59.70 59.36 2i88 h MET 370 Cb 1.08 -0.16 -0.04 0.00 -0.80 0.00 0.00 31.60 31.68 2i88 h MET 370 CO 0.10 0.62 0.20 0.00 0.23 0.00 0.00 176.91 178.06 2i88 h ALA 371 N 1.16 0.50 -0.25 0.39 0.00 -0.95 -1.66 119.26 118.45 2i88 h ALA 371 Ca 0.21 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 2i88 h ALA 371 Cb 0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2i88 h ALA 371 CO -0.03 -0.16 0.16 1.96 0.00 0.00 0.00 179.25 181.17 2i88 h GLN 372 N 0.40 0.34 -0.70 0.00 4.20 -1.12 0.30 115.11 118.54 2i88 h GLN 372 Ca 0.17 -0.03 0.12 0.00 0.06 0.00 0.00 58.65 58.97 2i88 h GLN 372 Cb 0.09 -0.07 -0.08 0.00 0.30 0.00 0.00 27.48 27.71 2i88 h GLN 372 CO -0.13 0.27 0.28 0.93 -0.67 0.00 0.00 178.83 179.51 2i88 h GLU 373 N 0.32 0.44 -0.45 1.46 5.08 -0.48 0.11 114.58 121.06 2i88 h GLU 373 Ca 0.09 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.34 2i88 h GLU 373 Cb 0.01 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 2i88 h GLU 373 CO -0.02 0.29 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.17 2i88 h LEU 374 N 0.45 0.81 0.01 1.33 3.38 -0.57 0.12 115.31 120.83 2i88 h LEU 374 Ca 0.37 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2i88 h LEU 374 Cb 0.50 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2i88 h LEU 374 CO -0.35 0.94 -0.08 0.00 0.09 0.00 0.00 178.44 179.04 2i88 h ALA 375 N 0.89 -0.09 0.44 1.53 0.00 0.47 -2.50 119.26 120.00 2i88 h ALA 375 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2i88 h ALA 375 Cb 0.55 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2i88 h ALA 375 CO 0.03 -0.57 -0.33 -0.44 0.00 0.00 0.00 179.25 177.94 2i88 h ASP 376 N -0.14 -0.86 -0.99 0.00 3.45 -0.66 -3.07 116.42 114.16 2i88 h ASP 376 Ca 0.03 0.06 0.35 0.00 0.43 0.00 0.00 57.03 57.89 2i88 h ASP 376 Cb 0.17 0.26 -0.17 0.00 -0.56 0.00 0.00 39.33 39.03 2i88 h ASP 376 CO -0.07 -0.47 0.39 0.11 -1.57 0.00 0.00 179.24 177.62 2i88 h LYS 377 N -0.74 0.07 -0.11 3.56 1.79 -0.95 -1.66 116.57 118.53 2i88 h LYS 377 Ca -0.06 -0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.31 2i88 h LYS 377 Cb 0.61 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.23 2i88 h LYS 377 CO 0.02 0.04 -0.36 0.66 -1.08 0.00 0.00 179.45 178.74 2i88 h SER 378 N 0.07 0.23 -1.21 0.86 4.64 -1.34 -3.43 113.55 113.37 2i88 h SER 378 Ca 0.74 -0.09 -0.75 0.00 -0.47 0.00 0.00 61.79 61.22 2i88 h SER 378 Cb 1.80 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.83 2i88 h SER 378 CO -0.78 0.58 1.01 0.29 -0.87 0.00 0.00 176.83 177.06 2i88 n LYS 379 N -4.07 0.83 0.00 4.77 5.02 -0.63 -0.84 118.16 123.25 2i88 n LYS 379 Ca -0.01 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.57 2i88 n LYS 379 Cb 0.44 -2.00 0.00 0.00 -0.02 0.00 0.00 35.03 33.44 2i88 n LYS 379 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2i88 n GLY 380 N 4.96 2.86 3.76 0.72 0.00 -1.26 -5.03 105.19 111.20 2i88 n GLY 380 Ca 0.33 -0.40 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 2i88 n GLY 380 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2i88 s LYS 381 N 0.00 3.65 0.39 1.61 1.02 -0.02 -4.97 119.74 121.42 2i88 s LYS 381 Ca 0.00 2.15 0.08 0.00 0.02 0.00 0.00 55.97 58.21 2i88 s LYS 381 Cb 0.00 -2.53 -0.01 0.00 -0.52 0.00 0.00 37.83 34.76 2i88 s LYS 381 CO 0.00 -0.75 0.42 0.15 -0.92 0.00 0.00 175.35 174.25 2i88 s LYS 382 N -2.55 2.73 -0.20 1.68 -0.14 -1.26 -2.25 119.74 117.76 2i88 s LYS 382 Ca 0.63 -1.33 -0.27 0.00 -1.36 0.00 0.00 55.97 53.64 2i88 s LYS 382 Cb -0.38 -2.56 -0.01 0.00 -1.68 0.00 0.00 37.83 33.21 2i88 s LYS 382 CO 0.47 -0.11 0.91 0.42 -0.76 0.00 0.00 175.35 176.28 2i88 s ILE 383 N -2.36 4.80 0.00 2.17 1.01 -1.26 -4.47 121.20 121.10 2i88 s ILE 383 Ca 0.48 1.77 0.00 0.00 0.00 0.00 0.00 60.65 62.90 2i88 s ILE 383 Cb -0.06 -4.20 0.00 0.00 0.01 0.00 0.00 42.46 38.21 2i88 s ILE 383 CO 0.29 -0.06 0.00 0.61 0.00 0.00 0.00 174.94 175.79 2i88 n GLY 384 N 3.46 0.85 3.53 6.18 0.00 -1.26 -4.90 105.19 113.04 2i88 n GLY 384 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 2i88 n GLY 384 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2i88 s ASN 385 N -1.00 6.35 0.60 1.61 2.47 -1.26 -4.87 114.94 118.84 2i88 s ASN 385 Ca 0.00 -0.27 0.30 0.00 0.42 0.00 0.00 52.86 53.31 2i88 s ASN 385 Cb 0.00 -2.47 1.72 0.00 -1.45 0.00 0.00 41.25 39.06 2i88 s ASN 385 CO 0.00 -1.31 2.14 1.62 -3.72 0.00 0.00 177.10 175.82 2i88 h VAL 386 N 6.05 0.45 -0.27 -5.21 3.04 -1.97 -2.15 116.25 116.18 2i88 h VAL 386 Ca -0.26 0.00 -0.15 0.00 -1.01 0.00 0.00 66.70 65.28 2i88 h VAL 386 Cb 1.07 0.87 -0.00 0.00 -2.01 0.00 0.00 31.29 31.22 2i88 h VAL 386 CO 1.12 0.00 -0.40 0.78 -1.01 0.00 0.00 177.57 178.06 2i88 h ASN 387 N 0.00 0.82 -0.52 3.17 2.35 -1.99 -0.32 115.58 119.10 2i88 h ASN 387 Ca 0.06 -0.51 -0.02 0.00 -0.55 0.00 0.00 56.30 55.28 2i88 h ASN 387 Cb 0.38 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 2i88 h ASN 387 CO -0.00 1.17 0.24 -0.33 -1.65 0.00 0.00 177.43 176.86 2i88 h GLU 388 N 0.50 0.75 -0.08 0.81 5.08 -1.81 -0.43 114.58 119.40 2i88 h GLU 388 Ca 0.03 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2i88 h GLU 388 Cb 0.99 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.11 2i88 h GLU 388 CO 0.09 0.64 0.05 0.00 -1.00 0.00 0.00 179.01 178.79 2i88 h ALA 389 N 1.08 0.10 0.22 3.43 0.00 -1.30 -1.15 119.26 121.63 2i88 h ALA 389 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2i88 h ALA 389 Cb 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2i88 h ALA 389 CO -0.02 -0.40 -0.21 1.25 0.00 0.00 0.00 179.25 179.87 2i88 h LEU 390 N 0.09 -0.56 -0.83 0.00 6.46 -0.93 -0.96 115.31 118.59 2i88 h LEU 390 Ca 0.03 0.05 0.19 0.00 -0.12 0.00 0.00 57.88 58.03 2i88 h LEU 390 Cb 0.00 0.19 -0.12 0.00 -0.73 0.00 0.00 40.66 40.00 2i88 h LEU 390 CO -0.01 -0.31 0.29 0.00 -0.62 0.00 0.00 178.44 177.79 2i88 h ALA 391 N 0.26 1.21 -0.10 1.25 0.00 -0.86 0.43 119.26 121.45 2i88 h ALA 391 Ca -0.00 0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 2i88 h ALA 391 Cb 0.43 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 2i88 h ALA 391 CO -0.05 -0.34 -0.69 0.00 0.00 0.00 0.00 179.25 178.17 2i88 h ALA 392 N 1.67 0.61 -0.00 0.00 0.00 -0.75 -2.91 119.26 117.89 2i88 h ALA 392 Ca 0.50 -0.59 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 2i88 h ALA 392 Cb 0.91 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2i88 h ALA 392 CO -0.53 0.74 -0.00 0.35 0.00 0.00 0.00 179.25 179.81 2i88 h PHE 393 N 0.31 0.01 -0.35 0.00 3.57 0.25 -2.25 116.94 118.49 2i88 h PHE 393 Ca -0.02 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.55 2i88 h PHE 393 Cb 1.26 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.98 2i88 h PHE 393 CO 0.05 0.48 0.25 0.93 -2.23 0.00 0.00 178.31 177.78 2i88 h GLU 394 N -0.46 0.11 -0.29 1.11 4.39 -0.27 0.14 114.58 119.30 2i88 h GLU 394 Ca 0.00 -0.01 -0.19 0.00 0.34 0.00 0.00 59.36 59.51 2i88 h GLU 394 Cb 0.48 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2i88 h GLU 394 CO 0.00 0.07 -0.54 -0.22 -1.16 0.00 0.00 179.01 177.16 2i88 h LYS 395 N 0.11 0.88 -0.10 2.33 3.11 -1.37 -2.86 116.57 118.68 2i88 h LYS 395 Ca 0.16 -0.56 -0.20 0.00 -2.81 0.00 0.00 60.65 57.25 2i88 h LYS 395 Cb 0.51 0.06 0.00 0.00 -1.00 0.00 0.00 32.23 31.80 2i88 h LYS 395 CO -0.02 1.19 -0.76 -0.92 -2.81 0.00 0.00 179.45 176.14 2i88 h TYR 396 N 0.68 0.76 -0.48 1.91 3.20 -0.38 -3.29 116.97 119.37 2i88 h TYR 396 Ca 0.02 -0.34 0.05 0.00 3.14 0.00 0.00 58.73 61.60 2i88 h TYR 396 Cb 1.15 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.26 2i88 h TYR 396 CO 0.07 1.13 0.22 -0.22 -1.64 0.00 0.00 178.16 177.71 2i88 h LYS 397 N 0.38 0.41 -0.87 1.82 3.64 -0.76 -1.04 116.57 120.15 2i88 h LYS 397 Ca -0.04 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.37 2i88 h LYS 397 Cb 1.36 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 33.03 2i88 h LYS 397 CO 0.14 0.27 0.57 -0.44 -2.27 0.00 0.00 179.45 177.72 2i88 h ASP 398 N 0.43 0.87 0.35 4.20 3.32 -1.57 0.25 116.42 124.27 2i88 h ASP 398 Ca 0.21 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.25 2i88 h ASP 398 Cb 0.16 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.53 2i88 h ASP 398 CO -0.17 0.57 -0.17 0.58 -1.72 0.00 0.00 179.24 178.32 2i88 h VAL 399 N 0.99 0.59 -0.39 -1.35 2.07 -1.51 -3.08 116.25 113.57 2i88 h VAL 399 Ca 0.37 -0.61 0.08 0.00 0.82 0.00 0.00 66.70 67.36 2i88 h VAL 399 Cb 0.18 0.86 -0.08 0.00 -1.52 0.00 0.00 31.29 30.74 2i88 h VAL 399 CO -0.13 0.10 -0.12 0.25 0.02 0.00 0.00 177.57 177.69 2i88 h LEU 400 N -0.84 -0.44 -1.34 2.57 5.85 -0.74 -1.08 115.31 119.28 2i88 h LEU 400 Ca -0.05 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2i88 h LEU 400 Cb 0.53 0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.83 2i88 h LEU 400 CO 0.08 -0.16 0.00 0.59 -0.34 0.00 0.00 178.44 178.61 2i88 n ASN 401 N -5.32 0.56 0.13 1.25 3.02 0.85 -0.97 115.26 114.78 2i88 n ASN 401 Ca 0.02 0.75 0.13 0.00 -0.03 0.00 0.00 54.58 55.45 2i88 n ASN 401 Cb 0.24 -0.83 0.29 0.00 -0.61 0.00 0.00 39.78 38.87 2i88 n ASN 401 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2i88 h LYS 402 N 0.00 0.00 -0.02 3.52 1.57 -1.09 -3.20 116.57 117.34 2i88 h LYS 402 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2i88 h LYS 402 Cb 0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2i88 h LYS 402 CO 0.00 0.00 -0.20 1.63 -0.57 0.00 0.00 179.45 180.31 2i88 n LYS 403 N -2.51 1.55 -4.02 3.15 5.02 -0.14 -4.93 118.16 116.28 2i88 n LYS 403 Ca 0.05 -1.16 -0.13 0.00 -2.02 0.00 0.00 58.31 55.05 2i88 n LYS 403 Cb 0.47 -1.48 -0.14 0.00 -0.02 0.00 0.00 35.03 33.87 2i88 n LYS 403 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2i88 s PHE 404 N -2.25 0.29 0.70 2.13 0.40 -1.21 -5.15 117.98 112.89 2i88 s PHE 404 Ca 0.26 -0.15 -0.08 0.00 -0.60 0.00 0.00 56.93 56.36 2i88 s PHE 404 Cb 0.19 -0.18 0.05 0.00 0.51 0.00 0.00 43.02 43.59 2i88 s PHE 404 CO 0.44 -0.03 1.04 -1.54 0.70 0.00 0.00 175.22 175.82 2i88 s SER 405 N -0.39 5.03 0.14 1.36 1.04 -1.26 -4.81 113.70 114.80 2i88 s SER 405 Ca -0.02 0.70 -0.20 0.00 0.48 0.00 0.00 55.95 56.91 2i88 s SER 405 Cb -0.03 -1.42 -0.00 0.00 0.10 0.00 0.00 66.02 64.67 2i88 s SER 405 CO -0.00 -1.50 1.69 0.50 0.98 0.00 0.00 173.24 174.91 2i88 h LYS 406 N -0.62 -0.02 -0.93 4.02 3.11 -2.00 -0.53 116.57 119.61 2i88 h LYS 406 Ca -0.45 0.00 0.09 0.00 -2.81 0.00 0.00 60.65 57.48 2i88 h LYS 406 Cb 1.29 0.01 -0.07 0.00 -1.00 0.00 0.00 32.23 32.46 2i88 h LYS 406 CO 0.62 -0.02 0.60 0.00 -2.81 0.00 0.00 179.45 177.85 2i88 h ALA 407 N 1.20 1.55 -0.38 5.00 0.00 -1.99 -0.46 119.26 124.18 2i88 h ALA 407 Ca 0.12 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 2i88 h ALA 407 Cb 0.20 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2i88 h ALA 407 CO -0.25 0.28 0.23 -0.44 0.00 0.00 0.00 179.25 179.07 2i88 h ASP 408 N 0.99 0.46 -0.01 0.00 3.32 -1.49 -2.41 116.42 117.28 2i88 h ASP 408 Ca 0.42 -0.05 -0.00 0.00 0.02 0.00 0.00 57.03 57.42 2i88 h ASP 408 Cb 0.32 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 2i88 h ASP 408 CO -0.18 0.37 0.00 0.03 -1.72 0.00 0.00 179.24 177.75 2i88 h ARG 409 N 0.50 0.02 -1.04 3.56 3.08 -0.51 -3.10 114.38 116.89 2i88 h ARG 409 Ca 0.14 -0.01 0.26 0.00 0.07 0.00 0.00 59.98 60.45 2i88 h ARG 409 Cb -0.00 -0.00 -0.11 0.00 0.08 0.00 0.00 29.97 29.94 2i88 h ARG 409 CO -0.03 0.29 0.65 -0.44 -1.07 0.00 0.00 179.97 179.37 2i88 h ASP 410 N -0.26 0.52 -0.87 7.04 3.45 -0.96 0.48 116.42 125.82 2i88 h ASP 410 Ca 0.00 0.10 0.06 0.00 0.43 0.00 0.00 57.03 57.62 2i88 h ASP 410 Cb 0.28 0.02 -0.05 0.00 -0.56 0.00 0.00 39.33 39.02 2i88 h ASP 410 CO 0.00 0.08 0.57 0.00 -1.57 0.00 0.00 179.24 178.32 2i88 h ALA 411 N 1.66 1.52 -0.18 3.45 0.00 -1.35 0.23 119.26 124.59 2i88 h ALA 411 Ca 0.62 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.47 2i88 h ALA 411 Cb 1.44 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 2i88 h ALA 411 CO -0.36 0.36 0.00 0.82 0.00 0.00 0.00 179.25 180.07 2i88 h ILE 412 N 1.00 1.25 -0.50 0.00 1.08 -0.09 -1.81 117.51 118.44 2i88 h ILE 412 Ca 0.37 -0.85 -0.04 0.00 -0.39 0.00 0.00 64.86 63.94 2i88 h ILE 412 Cb 0.16 1.46 -0.02 0.00 -3.07 0.00 0.00 36.82 35.34 2i88 h ILE 412 CO -0.13 0.26 0.14 -0.26 -0.69 0.00 0.00 178.15 177.47 2i88 h PHE 413 N 0.08 0.76 -0.56 1.37 -1.00 -1.16 -0.99 116.94 115.44 2i88 h PHE 413 Ca 0.05 -0.06 -0.09 0.00 2.81 0.00 0.00 57.97 60.68 2i88 h PHE 413 Cb 0.38 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 39.69 2i88 h PHE 413 CO 0.03 0.63 -0.02 -0.91 -1.61 0.00 0.00 178.31 176.44 2i88 h ASN 414 N 0.73 0.95 -0.51 2.17 2.35 -0.89 -1.82 115.58 118.56 2i88 h ASN 414 Ca 0.17 -0.27 -0.07 0.00 -0.55 0.00 0.00 56.30 55.58 2i88 h ASN 414 Cb 0.24 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2i88 h ASN 414 CO -0.01 1.02 0.05 0.00 -1.65 0.00 0.00 177.43 176.84 2i88 h ALA 415 N 1.08 0.68 0.00 -0.83 0.00 -0.61 -2.74 119.26 116.83 2i88 h ALA 415 Ca 0.16 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2i88 h ALA 415 Cb 0.54 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2i88 h ALA 415 CO 0.03 0.45 -0.08 -0.07 0.00 0.00 0.00 179.25 179.58 2i88 h LEU 416 N 0.74 0.00 -1.19 0.00 3.38 -0.80 -1.90 115.31 115.53 2i88 h LEU 416 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2i88 h LEU 416 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2i88 h LEU 416 CO 0.02 0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.63 2i88 h ALA 417 N 1.92 1.00 -0.17 1.53 0.00 -1.02 -2.67 119.26 119.85 2i88 h ALA 417 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2i88 h ALA 417 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2i88 h ALA 417 CO 0.01 0.00 0.00 0.43 0.00 0.00 0.00 179.25 179.69 2i88 n SER 418 N -2.48 3.17 -4.75 0.00 7.64 -0.71 -4.93 113.62 111.55 2i88 n SER 418 Ca 0.01 -1.99 -0.39 0.00 1.01 0.00 0.00 58.87 57.51 2i88 n SER 418 Cb 0.19 -0.10 -0.05 0.00 -1.01 0.00 0.00 64.21 63.24 2i88 n SER 418 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2i88 s VAL 419 N -1.77 4.96 -0.08 0.44 1.01 -1.01 -5.06 120.40 118.88 2i88 s VAL 419 Ca 0.32 1.26 -0.01 0.00 0.00 0.00 0.00 61.98 63.55 2i88 s VAL 419 Cb 0.21 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 2i88 s VAL 419 CO 0.30 0.38 -0.04 -1.59 0.00 0.00 0.00 175.10 174.15 2i88 s LYS 420 N 0.08 2.94 0.27 2.72 -2.85 -1.26 -5.02 119.74 116.62 2i88 s LYS 420 Ca 0.32 -0.50 -0.06 0.00 -1.00 0.00 0.00 55.97 54.73 2i88 s LYS 420 Cb -0.18 -2.70 0.51 0.00 -2.06 0.00 0.00 37.83 33.40 2i88 s LYS 420 CO 0.17 0.63 1.58 -0.92 0.10 0.00 0.00 175.35 176.91 2i88 h TYR 421 N 5.39 -0.29 -0.98 1.78 3.20 -2.00 -0.39 116.97 123.69 2i88 h TYR 421 Ca -0.47 0.07 0.24 0.00 3.14 0.00 0.00 58.73 61.71 2i88 h TYR 421 Cb 1.18 0.27 -0.08 0.00 1.54 0.00 0.00 36.73 39.64 2i88 h TYR 421 CO 0.58 -0.38 0.65 -0.44 -1.64 0.00 0.00 178.16 176.93 2i88 h ASP 422 N 0.02 0.39 -0.59 -2.11 3.32 -1.97 -0.26 116.42 115.22 2i88 h ASP 422 Ca 0.48 0.06 0.01 0.00 0.02 0.00 0.00 57.03 57.60 2i88 h ASP 422 Cb 0.84 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.34 2i88 h ASP 422 CO -0.89 0.12 0.39 0.44 -1.72 0.00 0.00 179.24 177.58 2i88 h ASP 423 N 0.37 0.66 0.00 6.45 3.32 -1.46 -3.20 116.42 122.56 2i88 h ASP 423 Ca 0.53 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.52 2i88 h ASP 423 Cb 1.39 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.77 2i88 h ASP 423 CO -0.22 0.47 -1.21 -2.67 -1.72 0.00 0.00 179.24 173.90 2i88 n TRP 424 N -4.45 0.00 0.32 4.55 4.27 -0.82 -4.56 117.44 116.75 2i88 n TRP 424 Ca 0.06 0.00 0.19 0.00 -3.89 0.00 0.00 57.50 53.86 2i88 n TRP 424 Cb 0.06 -0.14 1.07 0.00 -1.36 0.00 0.00 31.31 30.94 2i88 n TRP 424 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 2i88 h ALA 425 N 0.21 1.24 -0.34 -1.67 0.00 -1.16 -1.87 119.26 115.67 2i88 h ALA 425 Ca -0.06 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.94 2i88 h ALA 425 Cb 0.91 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2i88 h ALA 425 CO 0.00 0.00 0.34 1.57 0.00 0.00 0.00 179.25 181.16 2i88 h LYS 426 N 0.00 0.00 -0.00 0.00 2.10 -1.76 -1.82 116.57 115.09 2i88 h LYS 426 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2i88 h LYS 426 Cb 0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 2i88 h LYS 426 CO 0.00 0.00 -0.46 0.72 -2.00 0.00 0.00 179.45 177.71 2i88 n HIS 427 N -3.87 0.00 -0.18 0.07 8.25 -0.70 -4.55 115.22 114.23 2i88 n HIS 427 Ca 0.05 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.40 2i88 n HIS 427 Cb 0.50 -0.26 -0.09 0.00 1.12 0.00 0.00 29.99 31.26 2i88 n HIS 427 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2i88 h LEU 428 N 0.02 -1.73 -0.83 2.41 -0.00 -1.50 -2.58 115.31 111.09 2i88 h LEU 428 Ca 0.00 0.24 0.11 0.00 -0.00 0.00 0.00 57.88 58.23 2i88 h LEU 428 Cb 0.50 0.72 -0.08 0.00 -0.00 0.00 0.00 40.66 41.80 2i88 h LEU 428 CO 0.00 -0.33 0.46 -0.78 -0.00 0.00 0.00 178.44 177.79 2i88 h ASP 429 N -0.28 0.62 -0.34 -0.43 -0.00 -1.82 -1.34 116.42 112.82 2i88 h ASP 429 Ca 0.08 0.06 0.07 0.00 -0.00 0.00 0.00 57.03 57.24 2i88 h ASP 429 Cb 0.50 -0.05 -0.06 0.00 -0.00 0.00 0.00 39.33 39.72 2i88 h ASP 429 CO -0.60 0.32 -0.04 -0.61 -0.00 0.00 0.00 179.24 178.31 2i88 h GLN 430 N 0.72 0.04 -0.44 0.28 4.15 -1.77 0.67 115.11 118.77 2i88 h GLN 430 Ca 0.42 -0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.72 2i88 h GLN 430 Cb 0.47 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.14 2i88 h GLN 430 CO -0.29 0.03 -0.20 0.74 -1.93 0.00 0.00 178.83 177.18 2i88 h PHE 431 N 0.05 0.98 -0.77 3.99 -1.00 -1.17 -0.25 116.94 118.77 2i88 h PHE 431 Ca 0.17 -0.22 0.03 0.00 2.81 0.00 0.00 57.97 60.76 2i88 h PHE 431 Cb 0.24 -0.24 -0.05 0.00 3.61 0.00 0.00 35.95 39.52 2i88 h PHE 431 CO -0.28 0.98 0.49 0.00 -1.61 0.00 0.00 178.31 177.89 2i88 h ALA 432 N 1.02 1.02 -0.12 2.45 0.00 -0.51 0.27 119.26 123.38 2i88 h ALA 432 Ca 0.11 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 2i88 h ALA 432 Cb 0.73 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2i88 h ALA 432 CO 0.06 0.29 0.01 0.87 0.00 0.00 0.00 179.25 180.47 2i88 h LYS 433 N 0.95 0.21 -0.24 0.00 6.56 -0.44 -0.64 116.57 122.98 2i88 h LYS 433 Ca 0.31 -0.06 -0.04 0.00 -1.06 0.00 0.00 60.65 59.80 2i88 h LYS 433 Cb 0.02 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 2i88 h LYS 433 CO -0.12 0.44 -0.03 -0.92 -2.06 0.00 0.00 179.45 176.76 2i88 h TYR 434 N -0.05 0.37 -0.01 -1.35 3.20 -0.59 -2.06 116.97 116.47 2i88 h TYR 434 Ca 0.03 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2i88 h TYR 434 Cb 0.34 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.50 2i88 h TYR 434 CO 0.03 0.40 -0.13 1.28 -1.64 0.00 0.00 178.16 178.10 2i88 n LEU 435 N -4.31 0.78 -2.16 2.82 4.77 0.04 -4.93 117.00 114.00 2i88 n LEU 435 Ca 0.00 -0.16 -0.19 0.00 -0.03 0.00 0.00 56.01 55.64 2i88 n LEU 435 Cb 0.23 -0.12 -0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2i88 n LEU 435 CO 0.38 0.14 -0.21 0.29 -1.33 0.00 0.00 177.39 176.65 2i88 n LYS 436 N -0.68 -1.76 -1.70 3.23 4.76 -0.38 -4.83 118.16 116.79 2i88 n LYS 436 Ca 0.15 0.89 -0.42 0.00 -2.87 0.00 0.00 58.31 56.05 2i88 n LYS 436 Cb 0.30 -5.42 -0.03 0.00 -1.84 0.00 0.00 35.03 28.04 2i88 n LYS 436 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2i88 s ILE 437 N -2.94 3.08 -0.23 -0.18 1.01 -0.40 -4.79 121.20 116.74 2i88 s ILE 437 Ca 0.03 0.09 0.09 0.00 0.00 0.00 0.00 60.65 60.86 2i88 s ILE 437 Cb -0.01 -3.06 -0.20 0.00 0.01 0.00 0.00 42.46 39.20 2i88 s ILE 437 CO 0.03 -0.01 -0.10 0.35 0.00 0.00 0.00 174.94 175.21 2i88 n THR 438 N 5.64 1.44 -0.14 2.92 -2.24 -1.26 -4.86 114.28 115.77 2i88 n THR 438 Ca 0.20 -0.69 -0.10 0.00 -2.27 0.00 0.00 64.05 61.20 2i88 n THR 438 Cb 0.41 -1.01 0.09 0.00 -2.10 0.00 0.00 70.33 67.72 2i88 n THR 438 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2i88 n GLY 439 N 2.05 -3.66 3.76 3.38 0.00 -1.26 -4.95 105.19 104.52 2i88 n GLY 439 Ca -0.40 -1.27 -0.33 0.00 0.00 0.00 0.00 46.02 44.01 2i88 n GLY 439 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2i88 s HIS 440 N -1.38 2.47 -0.18 1.61 5.65 -1.26 -4.89 115.29 117.30 2i88 s HIS 440 Ca 0.21 1.57 0.00 0.00 0.25 0.00 0.00 55.06 57.09 2i88 s HIS 440 Cb -0.04 -3.25 0.04 0.00 -1.18 0.00 0.00 32.58 28.16 2i88 s HIS 440 CO 0.18 -1.93 -0.07 0.14 -0.65 0.00 0.00 174.74 172.41 2i88 s VAL 441 N -2.23 1.32 -1.05 0.89 -7.23 -1.26 -4.17 120.40 106.67 2i88 s VAL 441 Ca 0.69 -0.82 -0.22 0.00 -1.81 0.00 0.00 61.98 59.82 2i88 s VAL 441 Cb -0.23 -1.48 0.05 0.00 0.56 0.00 0.00 36.38 35.28 2i88 s VAL 441 CO 0.42 0.11 1.51 -0.44 -0.31 0.00 0.00 175.10 176.39 2i88 s SER 442 N 1.53 6.47 0.14 4.85 0.01 -1.26 -4.83 113.70 120.60 2i88 s SER 442 Ca -0.01 -1.55 -0.13 0.00 1.31 0.00 0.00 55.95 55.58 2i88 s SER 442 Cb -0.16 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.49 2i88 s SER 442 CO -0.08 -1.53 1.55 -0.26 0.41 0.00 0.00 173.24 173.33 2i88 h PHE 443 N 9.58 0.91 -0.20 2.43 -1.00 -1.97 -3.34 116.94 123.35 2i88 h PHE 443 Ca 0.23 -0.19 -0.07 0.00 2.81 0.00 0.00 57.97 60.75 2i88 h PHE 443 Cb 0.99 -0.23 -0.04 0.00 3.61 0.00 0.00 35.95 40.28 2i88 h PHE 443 CO 1.30 0.92 0.09 0.41 -1.61 0.00 0.00 178.31 179.41 2i88 n GLY 444 N -0.24 2.28 3.66 -1.45 0.00 -1.26 -4.89 105.19 103.28 2i88 n GLY 444 Ca -0.01 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 2i88 n GLY 444 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2i88 s TYR 445 N -1.14 3.35 -0.85 1.61 5.04 -1.26 -5.02 117.35 119.09 2i88 s TYR 445 Ca 0.14 0.69 -0.13 0.00 -2.44 0.00 0.00 57.07 55.32 2i88 s TYR 445 Cb 0.12 -2.63 0.22 0.00 0.35 0.00 0.00 41.96 40.02 2i88 s TYR 445 CO 0.03 -0.11 0.79 0.34 -1.34 0.00 0.00 175.55 175.27 2i88 s ASP 446 N 1.20 6.78 0.26 4.32 3.68 -1.26 -4.91 116.67 126.73 2i88 s ASP 446 Ca 0.22 -2.77 -0.02 0.00 2.13 0.00 0.00 52.55 52.10 2i88 s ASP 446 Cb -0.15 -2.20 0.47 0.00 -1.45 0.00 0.00 42.92 39.58 2i88 s ASP 446 CO 0.09 -0.54 1.80 0.58 0.13 0.00 0.00 175.17 177.23 2i88 h VAL 447 N 4.70 0.86 -1.00 1.11 2.07 -1.99 -2.86 116.25 119.13 2i88 h VAL 447 Ca 0.11 -0.27 0.25 0.00 0.82 0.00 0.00 66.70 67.61 2i88 h VAL 447 Cb 1.03 0.01 -0.08 0.00 -1.52 0.00 0.00 31.29 30.72 2i88 h VAL 447 CO 0.77 0.14 0.65 0.58 0.02 0.00 0.00 177.57 179.74 2i88 h VAL 448 N 0.79 0.58 -0.07 2.57 2.07 -1.98 0.12 116.25 120.31 2i88 h VAL 448 Ca 0.44 -0.13 -0.12 0.00 0.82 0.00 0.00 66.70 67.70 2i88 h VAL 448 Cb 0.47 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 2i88 h VAL 448 CO -0.28 0.07 -0.50 0.77 0.02 0.00 0.00 177.57 177.65 2i88 h SER 449 N 0.39 0.21 -0.19 0.57 4.64 -1.91 -1.69 113.55 115.57 2i88 h SER 449 Ca 0.55 -0.10 -0.10 0.00 -0.47 0.00 0.00 61.79 61.67 2i88 h SER 449 Cb 1.41 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.44 2i88 h SER 449 CO -0.24 0.67 -0.28 0.44 -0.87 0.00 0.00 176.83 176.55 2i88 h ASP 450 N 0.15 0.58 -0.49 4.97 3.45 -0.93 -2.85 116.42 121.30 2i88 h ASP 450 Ca 0.01 -0.52 -0.07 0.00 0.43 0.00 0.00 57.03 56.88 2i88 h ASP 450 Cb 0.94 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.52 2i88 h ASP 450 CO 0.07 0.98 0.06 0.40 -1.57 0.00 0.00 179.24 179.19 2i88 h ILE 451 N 0.19 1.25 -0.78 0.35 2.04 -1.18 -2.86 117.51 116.51 2i88 h ILE 451 Ca 0.02 -0.97 0.04 0.00 1.00 0.00 0.00 64.86 64.94 2i88 h ILE 451 Cb 0.85 0.76 -0.05 0.00 -0.74 0.00 0.00 36.82 37.65 2i88 h ILE 451 CO 0.06 0.35 0.49 -0.07 0.00 0.00 0.00 178.15 178.99 2i88 h LEU 452 N 0.84 0.80 -1.84 1.44 3.38 -1.25 -1.09 115.31 117.59 2i88 h LEU 452 Ca 0.17 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.30 2i88 h LEU 452 Cb 0.41 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 2i88 h LEU 452 CO 0.01 0.54 0.44 0.11 0.09 0.00 0.00 178.44 179.64 2i88 h LYS 453 N 0.94 0.15 0.00 1.13 1.57 -1.26 -1.15 116.57 117.95 2i88 h LYS 453 Ca 0.32 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 59.07 2i88 h LYS 453 Cb 0.05 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.32 2i88 h LYS 453 CO -0.12 0.10 -0.09 0.82 -0.57 0.00 0.00 179.45 179.59 2i88 h ILE 454 N 0.16 0.80 -0.92 1.86 2.04 -1.24 -2.52 117.51 117.69 2i88 h ILE 454 Ca 0.31 -0.34 0.20 0.00 1.00 0.00 0.00 64.86 66.03 2i88 h ILE 454 Cb 0.99 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.19 2i88 h ILE 454 CO -0.05 0.09 0.60 0.50 0.00 0.00 0.00 178.15 179.29 2i88 h LYS 455 N 0.00 0.49 0.09 2.37 3.64 -1.29 0.99 116.57 122.85 2i88 h LYS 455 Ca -0.00 -0.03 -0.32 0.00 -1.27 0.00 0.00 60.65 59.03 2i88 h LYS 455 Cb 0.19 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2i88 h LYS 455 CO 0.01 0.32 -1.74 -0.44 -2.27 0.00 0.00 179.45 175.33 2i88 h ASP 456 N 0.50 0.29 0.19 4.20 3.32 -1.63 -3.41 116.42 119.88 2i88 h ASP 456 Ca 0.49 -0.81 -0.25 0.00 0.02 0.00 0.00 57.03 56.47 2i88 h ASP 456 Cb 1.08 -0.10 0.03 0.00 0.22 0.00 0.00 39.33 40.56 2i88 h ASP 456 CO -0.22 1.74 -1.11 0.71 -1.72 0.00 0.00 179.24 178.64 2i88 h THR 457 N -0.28 1.41 0.00 0.35 1.35 -1.47 -3.48 112.91 110.79 2i88 h THR 457 Ca -0.39 -2.59 0.00 0.00 -0.55 0.00 0.00 66.41 62.87 2i88 h THR 457 Cb 1.80 3.11 0.00 0.00 -1.73 0.00 0.00 68.15 71.32 2i88 h THR 457 CO -0.00 0.76 0.00 0.61 -0.25 0.00 0.00 175.52 176.63 2i88 n GLY 458 N 1.66 0.69 3.54 5.82 0.00 0.32 -5.02 105.19 112.20 2i88 n GLY 458 Ca -0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.48 2i88 n GLY 458 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i88 s ASP 459 N -2.34 5.96 0.01 1.61 2.15 -1.26 -4.97 116.67 117.83 2i88 s ASP 459 Ca 0.00 -0.28 0.22 0.00 0.43 0.00 0.00 52.55 52.92 2i88 s ASP 459 Cb 0.00 -2.11 0.01 0.00 -0.30 0.00 0.00 42.92 40.52 2i88 s ASP 459 CO 0.00 -0.16 1.03 0.79 -0.17 0.00 0.00 175.17 176.66 2i88 n TRP 460 N 5.07 0.07 0.08 -5.34 7.02 -1.26 -4.47 117.44 118.60 2i88 n TRP 460 Ca -0.13 0.02 -0.14 0.00 -1.02 0.00 0.00 57.50 56.22 2i88 n TRP 460 Cb 0.50 -0.20 -0.08 0.00 -2.42 0.00 0.00 31.31 29.12 2i88 n TRP 460 CO 0.00 0.00 0.00 -0.22 -2.02 0.00 0.00 177.69 175.45 2i88 h LYS 461 N 0.00 -0.61 -0.49 -0.99 3.64 -2.00 -2.60 116.57 113.51 2i88 h LYS 461 Ca 0.00 0.04 0.10 0.00 -1.27 0.00 0.00 60.65 59.52 2i88 h LYS 461 Cb 0.59 0.14 -0.10 0.00 -0.41 0.00 0.00 32.23 32.45 2i88 h LYS 461 CO 0.00 -0.41 -0.29 -1.35 -2.27 0.00 0.00 179.45 175.13 2i88 h PRO 462 N -0.64 -0.17 -0.70 1.90 0.11 -2.00 -1.28 132.00 129.23 2i88 h PRO 462 Ca 0.03 0.01 0.15 0.00 0.11 0.00 0.00 66.00 66.30 2i88 h PRO 462 Cb 0.69 0.04 -0.10 0.00 0.11 0.00 0.00 31.00 31.73 2i88 h PRO 462 CO -0.31 -0.11 0.15 1.25 -0.21 0.00 0.00 178.00 178.77 2i88 h LEU 463 N -0.17 -0.02 -0.32 2.35 5.85 -1.76 0.14 115.31 121.38 2i88 h LEU 463 Ca 0.21 0.14 -0.05 0.00 0.84 0.00 0.00 57.88 59.02 2i88 h LEU 463 Cb 0.52 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 2i88 h LEU 463 CO -0.59 -0.03 0.00 -0.26 -0.34 0.00 0.00 178.44 177.22 2i88 h PHE 464 N 0.25 0.62 -0.66 1.25 -1.00 -0.93 0.15 116.94 116.62 2i88 h PHE 464 Ca 0.38 -0.11 -0.01 0.00 2.81 0.00 0.00 57.97 61.04 2i88 h PHE 464 Cb 0.63 -0.16 -0.03 0.00 3.61 0.00 0.00 35.95 40.00 2i88 h PHE 464 CO -0.27 0.69 0.36 -0.07 -1.61 0.00 0.00 178.31 177.41 2i88 h LEU 465 N 0.37 0.83 -0.75 1.54 3.38 -0.17 -1.79 115.31 118.73 2i88 h LEU 465 Ca 0.09 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.83 2i88 h LEU 465 Cb 0.44 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2i88 h LEU 465 CO 0.02 0.69 -0.60 0.00 0.09 0.00 0.00 178.44 178.64 2i88 h THR 466 N 0.91 1.42 -0.59 0.22 1.03 -0.43 -1.90 112.91 113.57 2i88 h THR 466 Ca 0.23 -2.03 -0.01 0.00 -0.01 0.00 0.00 66.41 64.59 2i88 h THR 466 Cb 0.05 2.07 -0.03 0.00 -1.07 0.00 0.00 68.15 69.17 2i88 h THR 466 CO -0.04 0.59 0.31 -0.07 -0.01 0.00 0.00 175.52 176.30 2i88 h LEU 467 N 0.06 0.73 0.11 0.00 3.38 -0.30 -0.55 115.31 118.73 2i88 h LEU 467 Ca -0.01 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2i88 h LEU 467 Cb 1.08 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2i88 h LEU 467 CO 0.08 0.60 -0.05 -0.08 0.09 0.00 0.00 178.44 179.09 2i88 h GLU 468 N 0.83 -0.14 -0.66 1.13 4.81 -0.63 -2.62 114.58 117.30 2i88 h GLU 468 Ca 0.21 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.50 2i88 h GLU 468 Cb 0.04 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 29.40 2i88 h GLU 468 CO -0.03 0.09 0.37 0.87 -0.73 0.00 0.00 179.01 179.58 2i88 h LYS 469 N -0.35 0.67 0.00 1.92 6.56 -0.75 -2.53 116.57 122.09 2i88 h LYS 469 Ca -0.01 -0.04 -0.11 0.00 -1.06 0.00 0.00 60.65 59.43 2i88 h LYS 469 Cb 0.29 -0.15 -0.02 0.00 -0.57 0.00 0.00 32.23 31.78 2i88 h LYS 469 CO 0.02 0.45 -0.51 0.87 -2.06 0.00 0.00 179.45 178.22 2i88 h LYS 470 N 0.69 0.00 -0.26 3.15 1.79 -1.15 -2.90 116.57 117.90 2i88 h LYS 470 Ca 0.29 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.68 2i88 h LYS 470 Cb 0.16 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 2i88 h LYS 470 CO -0.17 0.51 -0.18 0.00 -1.08 0.00 0.00 179.45 178.54 2i88 h ALA 471 N 1.49 1.21 -0.38 3.86 0.00 -1.06 -3.38 119.26 121.01 2i88 h ALA 471 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2i88 h ALA 471 Cb 1.04 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.71 2i88 h ALA 471 CO 0.07 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.82 2i88 n ALA 472 N -2.48 0.00 0.83 0.00 0.00 -1.05 -0.39 120.51 117.41 2i88 n ALA 472 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 2i88 n ALA 472 Cb 0.35 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.26 2i88 n ALA 472 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2i88 n ASP 473 N 1.29 0.00 0.17 0.00 5.68 -1.26 -3.31 116.55 119.12 2i88 n ASP 473 Ca 0.00 0.14 0.13 0.00 -0.50 0.00 0.00 54.79 54.56 2i88 n ASP 473 Cb 0.00 -0.34 0.39 0.00 -1.14 0.00 0.00 41.12 40.03 2i88 n ASP 473 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2i88 h ALA 474 N 2.83 1.00 -0.01 2.12 0.00 -0.89 -3.45 119.26 120.86 2i88 h ALA 474 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2i88 h ALA 474 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2i88 h ALA 474 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 2i88 n GLY 475 N 0.84 -0.89 0.18 0.00 0.00 -1.21 -4.28 105.19 99.83 2i88 n GLY 475 Ca 0.04 -1.20 0.05 0.00 0.00 0.00 0.00 46.02 44.90 2i88 n GLY 475 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2i88 h VAL 476 N 0.00 0.92 0.00 1.61 2.07 -1.67 -3.17 116.25 116.01 2i88 h VAL 476 Ca 0.00 -1.67 -0.01 0.00 0.82 0.00 0.00 66.70 65.84 2i88 h VAL 476 Cb 0.00 2.02 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 2i88 h VAL 476 CO 0.00 0.41 -0.03 0.77 0.02 0.00 0.00 177.57 178.74 2i88 h SER 477 N 0.00 0.00 -0.19 0.57 4.64 -1.76 -2.00 113.55 114.81 2i88 h SER 477 Ca -0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.19 2i88 h SER 477 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2i88 h SER 477 CO 0.05 0.03 -0.36 0.22 -0.87 0.00 0.00 176.83 175.90 2i88 h TYR 478 N 0.00 0.74 -0.94 4.77 3.20 -1.76 -1.91 116.97 121.07 2i88 h TYR 478 Ca -0.00 -0.26 0.09 0.00 3.14 0.00 0.00 58.73 61.70 2i88 h TYR 478 Cb 0.29 -0.14 -0.07 0.00 1.54 0.00 0.00 36.73 38.36 2i88 h TYR 478 CO 0.00 1.00 0.60 0.28 -1.64 0.00 0.00 178.16 178.41 2i88 h VAL 479 N 0.26 1.00 -0.16 1.81 2.07 -1.53 -0.30 116.25 119.40 2i88 h VAL 479 Ca 0.01 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.13 2i88 h VAL 479 Cb 0.95 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2i88 h VAL 479 CO 0.08 0.18 -0.13 0.58 0.02 0.00 0.00 177.57 178.30 2i88 h VAL 480 N 0.99 1.33 -0.30 2.57 2.07 -1.41 -1.66 116.25 119.85 2i88 h VAL 480 Ca 0.43 -1.25 0.02 0.00 0.82 0.00 0.00 66.70 66.72 2i88 h VAL 480 Cb 0.33 1.81 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 2i88 h VAL 480 CO -0.19 0.37 0.14 0.00 0.02 0.00 0.00 177.57 177.92 2i88 h ALA 481 N 0.63 0.36 0.29 1.67 0.00 -0.84 -0.05 119.26 121.31 2i88 h ALA 481 Ca 0.03 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2i88 h ALA 481 Cb 0.64 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 2i88 h ALA 481 CO 0.03 -0.25 -0.25 1.25 0.00 0.00 0.00 179.25 180.04 2i88 h LEU 482 N 0.30 -0.68 -1.51 0.00 6.46 -1.02 -1.22 115.31 117.64 2i88 h LEU 482 Ca 0.12 0.05 -0.05 0.00 -0.12 0.00 0.00 57.88 57.89 2i88 h LEU 482 Cb 0.05 0.22 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 2i88 h LEU 482 CO -0.09 -0.34 -0.21 -0.07 -0.62 0.00 0.00 178.44 177.11 2i88 h LEU 483 N -0.53 0.05 -0.70 2.25 4.07 -1.32 -1.99 115.31 117.15 2i88 h LEU 483 Ca -0.04 -0.01 -0.14 0.00 0.08 0.00 0.00 57.88 57.77 2i88 h LEU 483 Cb 0.45 -0.01 -0.01 0.00 1.08 0.00 0.00 40.66 42.16 2i88 h LEU 483 CO -0.01 0.26 -0.52 -0.26 -1.08 0.00 0.00 178.44 176.83 2i88 h PHE 484 N 0.05 0.42 -0.67 1.13 -1.00 -0.95 -1.05 116.94 114.87 2i88 h PHE 484 Ca 0.01 -0.14 -0.07 0.00 2.81 0.00 0.00 57.97 60.58 2i88 h PHE 484 Cb 0.40 -0.08 -0.03 0.00 3.61 0.00 0.00 35.95 39.85 2i88 h PHE 484 CO 0.00 0.79 0.14 0.77 -1.61 0.00 0.00 178.31 178.40 2i88 h SER 485 N 0.26 1.02 -0.00 2.17 0.02 -0.50 0.70 113.55 117.22 2i88 h SER 485 Ca 0.01 -0.22 -0.00 0.00 -0.84 0.00 0.00 61.79 60.74 2i88 h SER 485 Cb 1.01 -0.27 -0.00 0.00 0.14 0.00 0.00 62.40 63.28 2i88 h SER 485 CO 0.09 0.99 0.00 0.25 -1.14 0.00 0.00 176.83 177.02 2i88 h LEU 486 N 1.01 0.00 -1.21 5.07 5.85 -0.96 -2.08 115.31 123.00 2i88 h LEU 486 Ca 0.21 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.79 2i88 h LEU 486 Cb 0.39 -0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 2i88 h LEU 486 CO 0.01 0.14 0.49 -0.07 -0.34 0.00 0.00 178.44 178.67 2i88 h LEU 487 N -0.14 0.89 -1.21 2.25 3.38 -1.09 -2.60 115.31 116.79 2i88 h LEU 487 Ca 0.00 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2i88 h LEU 487 Cb 0.14 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2i88 h LEU 487 CO -0.00 0.66 0.38 0.00 0.09 0.00 0.00 178.44 179.58 2i88 h ALA 488 N 1.50 1.40 -0.53 1.53 0.00 -0.49 -3.18 119.26 119.48 2i88 h ALA 488 Ca 0.28 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2i88 h ALA 488 Cb -0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 2i88 h ALA 488 CO -0.06 0.50 0.02 0.41 0.00 0.00 0.00 179.25 180.13 2i88 n GLY 489 N -1.26 3.27 3.52 0.00 0.00 -0.81 -5.00 105.19 104.91 2i88 n GLY 489 Ca 0.07 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 2i88 n GLY 489 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2i88 s THR 490 N -2.81 0.00 -0.32 2.61 -4.23 -1.12 -4.75 115.64 105.02 2i88 s THR 490 Ca 0.53 -1.50 -0.01 0.00 -1.18 0.00 0.00 61.69 59.52 2i88 s THR 490 Cb 0.41 -2.24 0.10 0.00 1.34 0.00 0.00 72.50 72.11 2i88 s THR 490 CO 0.14 -0.00 0.12 -0.89 -0.54 0.00 0.00 174.62 173.45 2i88 s THR 491 N -4.04 0.69 0.32 3.99 2.01 -1.26 -4.87 115.64 112.48 2i88 s THR 491 Ca 0.25 -1.36 0.06 0.00 0.31 0.00 0.00 61.69 60.95 2i88 s THR 491 Cb 0.01 -1.53 -0.02 0.00 0.01 0.00 0.00 72.50 70.97 2i88 s THR 491 CO 0.09 -0.72 0.42 -0.76 -0.69 0.00 0.00 174.62 172.97 2i88 s LEU 492 N 1.61 3.97 0.62 4.42 1.43 -1.26 -5.11 118.68 124.36 2i88 s LEU 492 Ca 0.11 -0.19 -0.11 0.00 -1.03 0.00 0.00 54.13 52.90 2i88 s LEU 492 Cb -0.18 -2.68 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 2i88 s LEU 492 CO -0.25 -0.36 1.03 -0.83 0.23 0.00 0.00 176.35 176.18 2i88 s GLY 493 N -4.11 1.67 0.28 -3.19 0.00 -1.26 -4.81 107.32 95.90 2i88 s GLY 493 Ca 0.42 -0.07 -0.00 0.00 0.00 0.00 0.00 44.72 45.07 2i88 s GLY 493 CO 0.30 0.20 1.63 -2.22 0.00 0.00 0.00 173.10 173.01 2i88 h ILE 494 N -0.34 0.26 -0.81 0.90 1.08 -1.99 0.00 117.51 116.61 2i88 h ILE 494 Ca -0.44 -0.05 0.10 0.00 -0.39 0.00 0.00 64.86 64.08 2i88 h ILE 494 Cb 1.19 0.11 -0.07 0.00 -3.07 0.00 0.00 36.82 34.98 2i88 h ILE 494 CO 0.62 0.02 0.45 -0.25 -0.69 0.00 0.00 178.15 178.30 2i88 h TRP 495 N 0.13 0.82 -0.29 1.37 7.01 -1.95 0.78 115.95 123.82 2i88 h TRP 495 Ca 0.53 0.03 -0.13 0.00 2.11 0.00 0.00 58.89 61.43 2i88 h TRP 495 Cb 1.05 -0.25 -0.01 0.00 -2.10 0.00 0.00 29.16 27.85 2i88 h TRP 495 CO -0.35 0.32 -0.34 0.78 -2.79 0.00 0.00 178.44 176.05 2i88 h GLY 496 N 0.75 0.69 0.98 2.65 0.00 -1.36 -1.07 103.07 105.71 2i88 h GLY 496 Ca 0.39 -0.65 -0.07 0.00 0.00 0.00 0.00 47.33 47.00 2i88 h GLY 496 CO -0.26 0.59 0.02 -2.22 0.00 0.00 0.00 176.54 174.67 2i88 h ILE 497 N 0.54 1.26 -0.46 2.60 1.08 -0.82 -1.29 117.51 120.40 2i88 h ILE 497 Ca 0.06 -1.02 -0.02 0.00 -0.39 0.00 0.00 64.86 63.49 2i88 h ILE 497 Cb 0.85 1.01 -0.02 0.00 -3.07 0.00 0.00 36.82 35.59 2i88 h ILE 497 CO 0.07 0.36 0.23 0.00 -0.69 0.00 0.00 178.15 178.11 2i88 h ALA 498 N 0.92 0.60 -0.09 1.87 0.00 -0.73 0.53 119.26 122.36 2i88 h ALA 498 Ca 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2i88 h ALA 498 Cb 0.48 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 2i88 h ALA 498 CO 0.02 0.16 0.02 0.82 0.00 0.00 0.00 179.25 180.27 2i88 h ILE 499 N 0.61 1.20 -0.91 0.00 1.08 -1.10 0.84 117.51 119.24 2i88 h ILE 499 Ca 0.16 -0.62 0.00 0.00 -0.39 0.00 0.00 64.86 64.01 2i88 h ILE 499 Cb 0.11 1.44 -0.04 0.00 -3.07 0.00 0.00 36.82 35.26 2i88 h ILE 499 CO -0.02 0.18 0.57 0.58 -0.69 0.00 0.00 178.15 178.77 2i88 h VAL 500 N -0.07 1.24 -0.48 1.67 2.07 -0.97 -1.24 116.25 118.48 2i88 h VAL 500 Ca 0.03 -0.50 -0.13 0.00 0.82 0.00 0.00 66.70 66.92 2i88 h VAL 500 Cb 0.26 -0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 2i88 h VAL 500 CO 0.00 0.25 -0.22 0.74 0.02 0.00 0.00 177.57 178.36 2i88 h THR 501 N 1.24 1.27 -0.93 2.57 2.02 -0.82 -2.97 112.91 115.29 2i88 h THR 501 Ca 0.33 -1.38 0.07 0.00 0.77 0.00 0.00 66.41 66.20 2i88 h THR 501 Cb -0.09 1.13 -0.06 0.00 -1.74 0.00 0.00 68.15 67.38 2i88 h THR 501 CO -0.07 0.48 0.60 1.23 0.37 0.00 0.00 175.52 178.13 2i88 h GLY 502 N 0.88 1.38 1.14 2.16 0.00 0.32 -0.01 103.07 108.94 2i88 h GLY 502 Ca 0.11 -0.42 -0.09 0.00 0.00 0.00 0.00 47.33 46.93 2i88 h GLY 502 CO 0.07 0.29 0.03 -2.22 0.00 0.00 0.00 176.54 174.70 2i88 h ILE 503 N 1.05 1.26 0.31 2.60 2.04 -1.21 -1.32 117.51 122.24 2i88 h ILE 503 Ca 0.41 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 2i88 h ILE 503 Cb 0.23 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2i88 h ILE 503 CO -0.16 0.40 -0.15 -0.07 0.00 0.00 0.00 178.15 178.17 2i88 h LEU 504 N 0.96 -0.35 -0.84 1.44 3.38 -1.12 -2.68 115.31 116.10 2i88 h LEU 504 Ca 0.18 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.09 2i88 h LEU 504 Cb 0.52 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.31 2i88 h LEU 504 CO 0.02 -0.12 0.54 0.00 0.09 0.00 0.00 178.44 178.97 2i88 h SER 506 N 1.07 0.63 0.26 0.00 4.64 -1.13 -3.00 113.55 116.03 2i88 h SER 506 Ca 0.33 -0.02 -0.34 0.00 -0.47 0.00 0.00 61.79 61.29 2i88 h SER 506 Cb -0.03 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 61.92 2i88 h SER 506 CO -0.10 0.46 -1.65 1.88 -0.87 0.00 0.00 176.83 176.55 2i88 h TYR 507 N 0.74 0.74 -2.67 4.77 -1.99 -1.20 -3.40 116.97 113.96 2i88 h TYR 507 Ca 0.20 -0.54 -0.71 0.00 2.00 0.00 0.00 58.73 59.68 2i88 h TYR 507 Cb -0.08 -0.03 -0.19 0.00 2.00 0.00 0.00 36.73 38.43 2i88 h TYR 507 CO 0.00 1.60 0.71 0.42 -0.00 0.00 0.00 178.16 180.89 2i88 s ILE 508 N -2.59 4.92 0.00 -2.88 1.01 -0.52 -4.80 121.20 116.34 2i88 s ILE 508 Ca -0.13 -1.80 0.00 0.00 0.00 0.00 0.00 60.65 58.72 2i88 s ILE 508 Cb 0.05 -4.73 0.00 0.00 0.01 0.00 0.00 42.46 37.80 2i88 s ILE 508 CO 0.88 -1.42 0.00 0.47 0.00 0.00 0.00 174.94 174.87 2i88 n ASP 509 N 6.00 0.00 -4.55 3.58 8.00 -1.26 -4.35 116.55 123.98 2i88 n ASP 509 Ca 0.23 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.32 2i88 n ASP 509 Cb 0.48 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.55 2i88 n ASP 509 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2i88 s LYS 510 N -1.16 3.19 -1.30 -1.24 2.20 -1.26 -4.83 119.74 115.33 2i88 s LYS 510 Ca 0.00 -0.27 -0.16 0.00 -0.36 0.00 0.00 55.97 55.18 2i88 s LYS 510 Cb 0.00 -4.29 0.09 0.00 -1.51 0.00 0.00 37.83 32.12 2i88 s LYS 510 CO 0.00 -2.19 1.76 0.09 -0.36 0.00 0.00 175.35 174.64 2i88 n ASN 511 N 9.55 4.85 -1.99 1.43 3.02 -1.26 -4.55 115.26 126.31 2i88 n ASN 511 Ca 0.07 -2.93 -0.14 0.00 -0.03 0.00 0.00 54.58 51.54 2i88 n ASN 511 Cb 0.49 -1.68 0.21 0.00 -0.61 0.00 0.00 39.78 38.19 2i88 n ASN 511 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2i88 n LYS 512 N 7.16 2.66 -0.28 3.52 2.85 -1.26 -4.55 118.16 128.25 2i88 n LYS 512 Ca 0.46 -2.66 0.08 0.00 -1.05 0.00 0.00 58.31 55.15 2i88 n LYS 512 Cb 0.44 -2.06 0.32 0.00 -0.65 0.00 0.00 35.03 33.07 2i88 n LYS 512 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 2i88 h LEU 513 N 1.61 0.76 -0.25 -5.58 3.38 -1.94 -0.38 115.31 112.91 2i88 h LEU 513 Ca 0.42 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.42 2i88 h LEU 513 Cb 2.44 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 43.06 2i88 h LEU 513 CO 0.84 0.43 0.00 0.59 0.09 0.00 0.00 178.44 180.39 2i88 n ASN 514 N -4.54 0.20 -0.01 -0.43 3.02 -1.26 -2.58 115.26 109.66 2i88 n ASN 514 Ca 0.16 0.56 0.11 0.00 -0.03 0.00 0.00 54.58 55.37 2i88 n ASN 514 Cb 0.34 -0.59 -0.15 0.00 -0.61 0.00 0.00 39.78 38.77 2i88 n ASN 514 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2i88 n THR 515 N -1.72 0.00 0.08 3.41 -1.04 -0.16 -4.54 114.28 110.30 2i88 n THR 515 Ca 0.02 -0.38 -0.12 0.00 -2.04 0.00 0.00 64.05 61.54 2i88 n THR 515 Cb 0.16 0.24 -0.05 0.00 -1.82 0.00 0.00 70.33 68.86 2i88 n THR 515 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2i88 h ILE 516 N 0.00 0.37 -0.66 12.58 2.04 -1.38 0.25 117.51 130.70 2i88 h ILE 516 Ca 0.00 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.97 2i88 h ILE 516 Cb 0.86 0.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 2i88 h ILE 516 CO 0.00 0.00 0.44 0.78 0.00 0.00 0.00 178.15 179.37 2i88 h ASN 517 N -0.45 0.42 -0.05 1.72 2.35 -1.80 -0.15 115.58 117.61 2i88 h ASN 517 Ca 0.05 0.01 -0.06 0.00 -0.55 0.00 0.00 56.30 55.76 2i88 h ASN 517 Cb 0.52 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2i88 h ASN 517 CO -0.22 0.25 -0.19 -0.33 -1.65 0.00 0.00 177.43 175.29 2i88 h GLU 518 N 0.46 0.22 0.00 0.81 5.08 -1.65 0.50 114.58 120.00 2i88 h GLU 518 Ca 0.31 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.49 2i88 h GLU 518 Cb 0.58 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.86 2i88 h GLU 518 CO -0.09 0.80 -0.07 0.28 -1.00 0.00 0.00 179.01 178.92 2i88 h VAL 519 N -0.31 1.03 0.00 3.13 2.07 -0.19 -3.10 116.25 118.88 2i88 h VAL 519 Ca -0.01 -0.25 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 2i88 h VAL 519 Cb 0.82 1.14 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 2i88 h VAL 519 CO 0.04 0.07 -1.74 0.18 0.02 0.00 0.00 177.57 176.14 2i88 n LEU 520 N -4.42 0.23 -0.57 2.57 4.77 -0.14 -4.30 117.00 115.14 2i88 n LEU 520 Ca -0.03 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2i88 n LEU 520 Cb 0.15 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2i88 n LEU 520 CO 0.35 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 2i88 n GLY 521 N 1.24 0.78 0.00 -0.72 0.00 0.16 -4.95 105.19 101.69 2i88 n GLY 521 Ca -0.03 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2i88 n GLY 521 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61