#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bj4 n LEU 306 N 0.00 -0.42 -0.34 2.46 0.00 -1.26 -1.80 117.00 115.64 2bj4 n LEU 306 Ca 0.00 1.06 0.10 0.00 0.00 0.00 0.00 56.01 57.17 2bj4 n LEU 306 Cb 0.00 -0.23 0.28 0.00 0.00 0.00 0.00 43.42 43.47 2bj4 n LEU 306 CO 0.00 -0.94 1.17 0.00 0.00 0.00 0.00 177.39 177.62 2bj4 h ALA 307 N 0.77 1.52 0.00 1.96 0.00 -1.98 -2.41 119.26 119.12 2bj4 h ALA 307 Ca 0.20 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2bj4 h ALA 307 Cb 0.35 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.05 2bj4 h ALA 307 CO -0.60 -0.01 -0.26 1.28 0.00 0.00 0.00 179.25 179.66 2bj4 n LEU 308 N -4.77 0.65 -0.57 0.00 4.77 -0.74 -3.13 117.00 113.20 2bj4 n LEU 308 Ca 0.21 0.40 0.12 0.00 -0.03 0.00 0.00 56.01 56.71 2bj4 n LEU 308 Cb 0.49 -0.29 0.22 0.00 -2.33 0.00 0.00 43.42 41.51 2bj4 n LEU 308 CO 0.22 -0.09 0.59 -1.54 -1.33 0.00 0.00 177.39 175.24 2bj4 n SER 309 N -2.05 1.97 -4.74 -1.43 3.41 -0.91 -4.93 113.62 104.93 2bj4 n SER 309 Ca 0.05 -1.51 -0.41 0.00 -0.26 0.00 0.00 58.87 56.74 2bj4 n SER 309 Cb 0.41 0.17 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 2bj4 n SER 309 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2bj4 s LEU 310 N -2.25 4.46 0.83 1.04 1.43 -1.18 -5.04 118.68 117.96 2bj4 s LEU 310 Ca 0.26 2.27 -0.11 0.00 -1.03 0.00 0.00 54.13 55.52 2bj4 s LEU 310 Cb 0.19 -3.61 0.09 0.00 0.03 0.00 0.00 46.19 42.89 2bj4 s LEU 310 CO 0.44 -0.36 1.09 0.42 0.23 0.00 0.00 176.35 178.18 2bj4 s THR 311 N -0.26 2.96 0.17 5.49 -4.23 -1.26 -4.81 115.64 113.69 2bj4 s THR 311 Ca 0.52 0.31 -0.15 0.00 -1.18 0.00 0.00 61.69 61.18 2bj4 s THR 311 Cb -0.33 -2.95 0.07 0.00 1.34 0.00 0.00 72.50 70.63 2bj4 s THR 311 CO 0.38 -0.41 1.71 0.00 -0.54 0.00 0.00 174.62 175.77 2bj4 h ALA 312 N -1.24 0.42 -0.95 3.99 0.00 -1.94 0.77 119.26 120.31 2bj4 h ALA 312 Ca -0.48 0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.56 2bj4 h ALA 312 Cb 1.27 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.15 2bj4 h ALA 312 CO 0.57 -0.35 0.62 -0.44 0.00 0.00 0.00 179.25 179.65 2bj4 h ASP 313 N 0.17 1.05 0.22 0.00 3.32 -1.95 -1.63 116.42 117.59 2bj4 h ASP 313 Ca 0.20 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 57.09 2bj4 h ASP 313 Cb 0.26 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 2bj4 h ASP 313 CO -0.29 0.74 -0.56 1.56 -1.72 0.00 0.00 179.24 178.96 2bj4 h GLN 314 N 1.23 0.36 -0.10 3.56 4.20 -1.65 -1.64 115.11 121.06 2bj4 h GLN 314 Ca 0.36 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 2bj4 h GLN 314 Cb -0.05 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 2bj4 h GLN 314 CO -0.10 0.83 0.05 1.98 -0.67 0.00 0.00 178.83 180.92 2bj4 h MET 315 N 0.28 0.15 -0.37 1.46 4.05 -0.50 -1.20 114.93 118.80 2bj4 h MET 315 Ca 0.00 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.46 2bj4 h MET 315 Cb 1.07 -0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 31.79 2bj4 h MET 315 CO 0.09 0.23 0.02 0.28 0.23 0.00 0.00 176.91 177.76 2bj4 h VAL 316 N 0.04 0.75 -0.49 -5.77 2.07 -1.23 -0.86 116.25 110.76 2bj4 h VAL 316 Ca 0.04 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.53 2bj4 h VAL 316 Cb 0.13 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.48 2bj4 h VAL 316 CO -0.00 0.02 0.30 0.28 0.02 0.00 0.00 177.57 178.19 2bj4 h SER 317 N 0.13 0.48 -0.55 0.57 0.02 -1.15 -0.69 113.55 112.35 2bj4 h SER 317 Ca 0.18 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 61.15 2bj4 h SER 317 Cb 0.24 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 2bj4 h SER 317 CO -0.28 0.34 0.34 0.00 -1.14 0.00 0.00 176.83 176.10 2bj4 h ALA 318 N 1.21 0.71 -0.35 3.77 0.00 -0.97 0.74 119.26 124.38 2bj4 h ALA 318 Ca 0.19 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2bj4 h ALA 318 Cb 0.01 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2bj4 h ALA 318 CO -0.08 0.07 -0.43 -0.07 0.00 0.00 0.00 179.25 178.74 2bj4 h LEU 319 N 0.68 0.96 -0.21 0.00 3.38 -0.74 -2.43 115.31 116.95 2bj4 h LEU 319 Ca 0.22 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 2bj4 h LEU 319 Cb 0.00 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 2bj4 h LEU 319 CO -0.09 1.25 0.11 -0.07 0.09 0.00 0.00 178.44 179.73 2bj4 h LEU 320 N 0.71 0.26 -1.25 1.67 3.38 -1.03 -2.81 115.31 116.24 2bj4 h LEU 320 Ca 0.05 -0.09 0.15 0.00 0.09 0.00 0.00 57.88 58.08 2bj4 h LEU 320 Cb 1.02 -0.07 -0.07 0.00 0.09 0.00 0.00 40.66 41.63 2bj4 h LEU 320 CO 0.10 0.27 0.59 0.44 0.09 0.00 0.00 178.44 179.93 2bj4 h ASP 321 N 0.22 0.67 0.66 -0.43 3.32 -0.79 -2.53 116.42 117.55 2bj4 h ASP 321 Ca 0.07 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.17 2bj4 h ASP 321 Cb 0.07 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.54 2bj4 h ASP 321 CO -0.01 0.33 0.00 0.00 -1.72 0.00 0.00 179.24 177.84 2bj4 n ALA 322 N -2.42 2.26 -1.77 3.45 0.00 -0.92 -4.94 120.51 116.17 2bj4 n ALA 322 Ca 0.18 -0.11 -0.42 0.00 0.00 0.00 0.00 53.44 53.09 2bj4 n ALA 322 Cb 0.48 -1.42 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 2bj4 n ALA 322 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2bj4 s GLU 323 N -2.76 4.14 0.83 0.00 0.41 -0.95 -4.65 118.70 115.72 2bj4 s GLU 323 Ca 0.20 2.56 -0.12 0.00 -0.41 0.00 0.00 54.97 57.20 2bj4 s GLU 323 Cb 0.17 -3.06 0.09 0.00 -1.78 0.00 0.00 34.13 29.55 2bj4 s GLU 323 CO 0.43 -0.68 1.10 -1.25 -0.49 0.00 0.00 175.26 174.37 2bj4 s PRO 324 N 0.49 1.80 0.49 0.39 0.04 -1.26 -5.01 135.00 131.95 2bj4 s PRO 324 Ca 0.69 0.60 -0.23 0.00 0.04 0.00 0.00 61.00 62.11 2bj4 s PRO 324 Cb -0.48 -1.89 -0.06 0.00 0.04 0.00 0.00 34.50 32.11 2bj4 s PRO 324 CO 0.38 -1.81 1.32 -2.14 0.04 0.00 0.00 177.00 174.80 2bj4 s PRO 325 N -5.14 3.46 -0.23 0.56 0.02 -1.26 -5.00 135.00 127.41 2bj4 s PRO 325 Ca 0.62 2.16 -0.18 0.00 0.02 0.00 0.00 61.00 63.62 2bj4 s PRO 325 Cb -0.15 -2.42 -0.03 0.00 0.02 0.00 0.00 34.50 31.92 2bj4 s PRO 325 CO 0.54 -0.91 0.49 0.42 -0.33 0.00 0.00 177.00 177.21 2bj4 s ILE 326 N -1.33 5.11 0.21 2.83 1.01 -1.26 -5.05 121.20 122.72 2bj4 s ILE 326 Ca 0.66 0.87 -0.06 0.00 0.00 0.00 0.00 60.65 62.12 2bj4 s ILE 326 Cb -0.38 -3.81 -0.06 0.00 0.01 0.00 0.00 42.46 38.22 2bj4 s ILE 326 CO 0.47 0.15 0.48 -0.76 0.00 0.00 0.00 174.94 175.28 2bj4 s LEU 327 N 1.88 4.18 0.07 2.97 1.43 -1.26 -5.02 118.68 122.92 2bj4 s LEU 327 Ca 0.22 0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 53.90 2bj4 s LEU 327 Cb -0.15 -3.47 -0.06 0.00 0.03 0.00 0.00 46.19 42.53 2bj4 s LEU 327 CO 0.09 -0.06 0.44 -0.31 0.23 0.00 0.00 176.35 176.74 2bj4 s TYR 328 N -1.84 3.64 0.29 0.29 1.51 -1.26 -4.35 117.35 115.63 2bj4 s TYR 328 Ca 0.44 0.92 -0.29 0.00 -1.01 0.00 0.00 57.07 57.12 2bj4 s TYR 328 Cb -0.11 -2.25 -0.10 0.00 -0.11 0.00 0.00 41.96 39.39 2bj4 s TYR 328 CO 0.25 0.54 1.19 0.45 -1.11 0.00 0.00 175.55 176.87 2bj4 s SER 329 N -1.52 7.07 -0.91 2.29 0.15 -1.26 -5.04 113.70 114.48 2bj4 s SER 329 Ca 0.31 2.42 -0.00 0.00 0.70 0.00 0.00 55.95 59.38 2bj4 s SER 329 Cb -0.15 -2.63 0.29 0.00 -1.71 0.00 0.00 66.02 61.81 2bj4 s SER 329 CO 0.17 -0.31 1.20 -0.62 1.20 0.00 0.00 173.24 174.88 2bj4 n GLU 330 N 1.17 3.73 0.00 5.44 1.02 -1.26 -5.00 120.64 125.74 2bj4 n GLU 330 Ca -0.00 -4.60 0.00 0.00 -0.02 0.00 0.00 57.16 52.54 2bj4 n GLU 330 Cb 0.44 -2.41 0.00 0.00 -0.02 0.00 0.00 31.44 29.44 2bj4 n GLU 330 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 2bj4 n PRO 336 N 1.15 1.28 -2.21 3.49 -0.02 -1.26 -5.10 135.00 132.34 2bj4 n PRO 336 Ca 0.27 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.37 2bj4 n PRO 336 Cb 0.36 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.83 2bj4 n PRO 336 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2bj4 s PHE 337 N 0.00 2.90 0.28 6.00 0.08 -1.26 -4.97 117.98 121.01 2bj4 s PHE 337 Ca 0.00 1.51 0.03 0.00 0.12 0.00 0.00 56.93 58.59 2bj4 s PHE 337 Cb 0.00 -3.46 -0.06 0.00 -0.57 0.00 0.00 43.02 38.94 2bj4 s PHE 337 CO 0.00 -1.62 0.06 -1.54 -0.10 0.00 0.00 175.22 172.03 2bj4 s SER 338 N -1.15 1.78 0.19 1.36 1.04 -1.26 -5.00 113.70 110.65 2bj4 s SER 338 Ca 0.61 -1.35 -0.14 0.00 0.48 0.00 0.00 55.95 55.54 2bj4 s SER 338 Cb -0.32 0.04 0.18 0.00 0.10 0.00 0.00 66.02 66.02 2bj4 s SER 338 CO 0.39 -0.64 1.66 -0.08 0.98 0.00 0.00 173.24 175.55 2bj4 h GLU 339 N 2.29 0.04 0.05 4.02 4.81 -1.97 -1.15 114.58 122.67 2bj4 h GLU 339 Ca -0.39 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2bj4 h GLU 339 Cb 1.24 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.60 2bj4 h GLU 339 CO 0.65 0.03 -0.06 0.00 -0.73 0.00 0.00 179.01 178.90 2bj4 h ALA 340 N 1.50 -0.10 -0.50 2.92 0.00 -1.96 -1.31 119.26 119.79 2bj4 h ALA 340 Ca 0.25 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.04 2bj4 h ALA 340 Cb 0.39 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2bj4 h ALA 340 CO -0.49 -0.57 -0.13 0.66 0.00 0.00 0.00 179.25 178.72 2bj4 h SER 341 N -0.13 0.96 -0.21 0.00 4.64 -1.91 -0.66 113.55 116.24 2bj4 h SER 341 Ca 0.01 -0.32 -0.08 0.00 -0.47 0.00 0.00 61.79 60.93 2bj4 h SER 341 Cb 0.13 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 61.96 2bj4 h SER 341 CO -0.03 1.09 -0.19 -0.03 -0.87 0.00 0.00 176.83 176.81 2bj4 h MET 342 N 0.85 0.50 -0.52 4.77 -1.53 -1.07 0.86 114.93 118.79 2bj4 h MET 342 Ca 0.13 -0.26 -0.03 0.00 -3.44 0.00 0.00 59.70 56.10 2bj4 h MET 342 Cb 0.68 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.71 2bj4 h MET 342 CO 0.05 0.83 0.19 0.52 0.14 0.00 0.00 176.91 178.64 2bj4 h MET 343 N 0.19 0.76 0.06 0.39 2.07 -1.23 -0.80 114.93 116.38 2bj4 h MET 343 Ca 0.04 -0.12 0.02 0.00 -2.07 0.00 0.00 59.70 57.56 2bj4 h MET 343 Cb 0.72 -0.13 -0.03 0.00 -1.87 0.00 0.00 31.60 30.29 2bj4 h MET 343 CO 0.05 0.65 -0.18 0.78 1.07 0.00 0.00 176.91 179.28 2bj4 h GLY 344 N 0.90 -0.29 0.92 8.32 0.00 -0.67 0.23 103.07 112.48 2bj4 h GLY 344 Ca 0.18 0.21 0.01 0.00 0.00 0.00 0.00 47.33 47.73 2bj4 h GLY 344 CO -0.01 -0.17 0.13 1.41 0.00 0.00 0.00 176.54 177.89 2bj4 h LEU 345 N -0.32 0.20 -0.41 3.11 3.38 -0.52 -0.56 115.31 120.17 2bj4 h LEU 345 Ca 0.04 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2bj4 h LEU 345 Cb 0.36 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2bj4 h LEU 345 CO -0.12 0.15 0.18 -0.07 0.09 0.00 0.00 178.44 178.67 2bj4 h LEU 346 N 0.26 0.56 -0.44 1.67 3.38 -1.07 -1.81 115.31 117.86 2bj4 h LEU 346 Ca 0.09 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.93 2bj4 h LEU 346 Cb 0.01 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 2bj4 h LEU 346 CO -0.06 0.55 0.27 0.74 0.09 0.00 0.00 178.44 180.04 2bj4 h THR 347 N 0.53 1.07 -0.35 0.22 2.02 -0.44 -0.57 112.91 115.39 2bj4 h THR 347 Ca 0.14 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.14 2bj4 h THR 347 Cb 0.16 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 2bj4 h THR 347 CO -0.01 0.10 0.21 -1.13 0.37 0.00 0.00 175.52 175.06 2bj4 h ASN 348 N 0.56 0.36 0.14 4.18 -1.24 -0.96 -0.86 115.58 117.74 2bj4 h ASN 348 Ca 0.17 -0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.17 2bj4 h ASN 348 Cb -0.02 -0.08 0.00 0.00 0.73 0.00 0.00 38.32 38.95 2bj4 h ASN 348 CO -0.06 0.26 -0.07 0.25 -1.29 0.00 0.00 177.43 176.52 2bj4 h LEU 349 N 0.44 -0.16 -0.62 0.34 5.85 -1.26 -1.95 115.31 117.95 2bj4 h LEU 349 Ca 0.13 -0.09 0.10 0.00 0.84 0.00 0.00 57.88 58.87 2bj4 h LEU 349 Cb -0.02 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 40.98 2bj4 h LEU 349 CO -0.05 -0.01 0.22 0.00 -0.34 0.00 0.00 178.44 178.25 2bj4 h ALA 350 N 0.55 0.80 -0.57 1.25 0.00 -1.01 0.32 119.26 120.61 2bj4 h ALA 350 Ca -0.02 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 2bj4 h ALA 350 Cb 0.24 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2bj4 h ALA 350 CO 0.03 -0.21 0.11 -0.44 0.00 0.00 0.00 179.25 178.74 2bj4 h ASP 351 N 0.39 0.85 -0.37 0.00 3.32 -0.97 0.67 116.42 120.30 2bj4 h ASP 351 Ca 0.32 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 57.13 2bj4 h ASP 351 Cb 0.42 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 2bj4 h ASP 351 CO -0.34 0.85 -0.04 0.03 -1.72 0.00 0.00 179.24 178.02 2bj4 h ARG 352 N 0.86 0.68 -0.17 3.56 3.08 -0.83 -3.11 114.38 118.46 2bj4 h ARG 352 Ca 0.18 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 2bj4 h ARG 352 Cb 0.35 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 2bj4 h ARG 352 CO 0.00 0.81 -0.09 0.93 -1.07 0.00 0.00 179.97 180.55 2bj4 h GLU 353 N 0.49 0.25 -0.44 0.04 5.08 -0.47 -2.75 114.58 116.79 2bj4 h GLU 353 Ca 0.10 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2bj4 h GLU 353 Cb 0.53 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 2bj4 h GLU 353 CO 0.03 0.36 0.17 -0.07 -1.00 0.00 0.00 179.01 178.49 2bj4 h LEU 354 N 0.25 0.56 -0.38 1.33 3.38 -0.81 0.45 115.31 120.09 2bj4 h LEU 354 Ca 0.05 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.00 2bj4 h LEU 354 Cb 0.32 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2bj4 h LEU 354 CO 0.02 0.52 0.17 0.58 0.09 0.00 0.00 178.44 179.81 2bj4 h VAL 355 N 0.62 0.95 -0.06 1.22 2.07 -1.46 -2.71 116.25 116.87 2bj4 h VAL 355 Ca 0.15 -0.12 -0.16 0.00 0.82 0.00 0.00 66.70 67.40 2bj4 h VAL 355 Cb 0.14 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 2bj4 h VAL 355 CO -0.01 0.06 -0.65 0.45 0.02 0.00 0.00 177.57 177.44 2bj4 h HIS 356 N 0.35 0.32 -0.54 1.57 3.86 -1.51 -3.05 115.15 116.16 2bj4 h HIS 356 Ca 0.16 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2bj4 h HIS 356 Cb 0.10 -0.05 -0.03 0.00 1.06 0.00 0.00 27.41 28.49 2bj4 h HIS 356 CO -0.12 0.82 0.34 1.98 0.86 0.00 0.00 177.93 181.82 2bj4 h MET 357 N 0.18 0.71 -0.54 2.45 -1.53 -0.69 -1.03 114.93 114.48 2bj4 h MET 357 Ca -0.01 -0.05 -0.07 0.00 -3.44 0.00 0.00 59.70 56.13 2bj4 h MET 357 Cb 1.18 -0.16 -0.02 0.00 -0.55 0.00 0.00 31.60 32.04 2bj4 h MET 357 CO 0.10 0.48 0.06 0.82 0.14 0.00 0.00 176.91 178.51 2bj4 h ILE 358 N 0.73 1.24 0.23 1.77 2.04 -1.37 -0.37 117.51 121.78 2bj4 h ILE 358 Ca 0.20 -0.95 -0.33 0.00 1.00 0.00 0.00 64.86 64.77 2bj4 h ILE 358 Cb -0.07 0.76 0.03 0.00 -0.74 0.00 0.00 36.82 36.80 2bj4 h ILE 358 CO -0.04 0.35 -1.45 0.78 0.00 0.00 0.00 178.15 177.78 2bj4 h ASN 359 N 0.82 0.77 -0.43 1.72 2.35 -1.51 -2.84 115.58 116.45 2bj4 h ASN 359 Ca 0.17 -0.83 0.09 0.00 -0.55 0.00 0.00 56.30 55.18 2bj4 h ASN 359 Cb 0.40 -0.25 -0.09 0.00 0.05 0.00 0.00 38.32 38.43 2bj4 h ASN 359 CO 0.01 1.65 -0.19 -0.25 -1.65 0.00 0.00 177.43 177.01 2bj4 h TRP 360 N 0.13 -0.46 -0.62 1.19 7.01 -1.06 -2.83 115.95 119.31 2bj4 h TRP 360 Ca -0.24 0.05 -0.02 0.00 2.11 0.00 0.00 58.89 60.79 2bj4 h TRP 360 Cb 2.14 0.27 -0.03 0.00 -2.10 0.00 0.00 29.16 29.44 2bj4 h TRP 360 CO 0.12 -0.27 0.31 0.00 -2.79 0.00 0.00 178.44 175.81 2bj4 h ALA 361 N 1.22 1.39 0.00 2.65 0.00 -0.90 0.53 119.26 124.15 2bj4 h ALA 361 Ca 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2bj4 h ALA 361 Cb 0.42 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2bj4 h ALA 361 CO -0.50 0.49 0.00 0.87 0.00 0.00 0.00 179.25 180.11 2bj4 h LYS 362 N 0.87 0.00 -0.01 0.00 1.57 -1.27 -2.14 116.57 115.59 2bj4 h LYS 362 Ca 0.22 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 2bj4 h LYS 362 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.37 2bj4 h LYS 362 CO -0.03 0.00 -0.27 0.54 -0.57 0.00 0.00 179.45 179.11 2bj4 n ARG 363 N -2.74 1.13 -2.48 3.15 1.74 0.16 -4.51 116.66 113.11 2bj4 n ARG 363 Ca 0.00 -0.78 -0.43 0.00 -0.77 0.00 0.00 57.85 55.88 2bj4 n ARG 363 Cb 0.21 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.14 2bj4 n ARG 363 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2bj4 s VAL 364 N -2.40 4.37 0.00 1.55 1.01 -0.81 -4.84 120.40 119.29 2bj4 s VAL 364 Ca 0.25 1.65 -0.38 0.00 0.00 0.00 0.00 61.98 63.50 2bj4 s VAL 364 Cb 0.19 -4.08 -0.17 0.00 0.00 0.00 0.00 36.38 32.33 2bj4 s VAL 364 CO 0.50 -0.16 1.42 -2.65 0.00 0.00 0.00 175.10 174.21 2bj4 n PRO 365 N 6.57 1.10 0.00 2.72 -0.02 -1.26 -1.51 135.00 142.60 2bj4 n PRO 365 Ca 0.13 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 2bj4 n PRO 365 Cb 0.45 -2.05 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 2bj4 n PRO 365 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bj4 n GLY 366 N 2.85 2.71 0.30 -1.23 0.00 -1.26 -4.91 105.19 103.64 2bj4 n GLY 366 Ca 0.20 -0.16 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 2bj4 n GLY 366 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2bj4 h PHE 367 N 0.00 1.12 0.00 1.61 3.57 -1.54 -2.39 116.94 119.31 2bj4 h PHE 367 Ca 0.00 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.32 2bj4 h PHE 367 Cb 0.00 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.43 2bj4 h PHE 367 CO 0.00 0.97 -0.08 -0.24 -2.23 0.00 0.00 178.31 176.73 2bj4 h VAL 368 N 0.96 0.22 0.00 1.41 3.04 -1.79 -2.38 116.25 117.71 2bj4 h VAL 368 Ca 0.19 -0.70 0.00 0.00 -1.01 0.00 0.00 66.70 65.18 2bj4 h VAL 368 Cb 0.47 1.57 0.00 0.00 -2.01 0.00 0.00 31.29 31.32 2bj4 h VAL 368 CO 0.02 0.08 0.00 0.47 -1.01 0.00 0.00 177.57 177.13 2bj4 n ASP 369 N -3.23 0.53 -4.92 3.17 8.00 -0.90 -4.78 116.55 114.43 2bj4 n ASP 369 Ca 0.00 0.65 -0.26 0.00 0.71 0.00 0.00 54.79 55.88 2bj4 n ASP 369 Cb 0.34 -0.75 -0.01 0.00 -0.02 0.00 0.00 41.12 40.67 2bj4 n ASP 369 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 2bj4 s LEU 370 N -4.20 3.82 0.88 0.64 1.43 -0.90 -5.06 118.68 115.30 2bj4 s LEU 370 Ca 0.04 0.75 -0.11 0.00 -1.03 0.00 0.00 54.13 53.78 2bj4 s LEU 370 Cb 0.09 -3.65 0.13 0.00 0.03 0.00 0.00 46.19 42.78 2bj4 s LEU 370 CO 0.34 -0.43 1.16 0.42 0.23 0.00 0.00 176.35 178.07 2bj4 s THR 371 N -2.50 2.13 0.32 5.49 -4.23 -1.26 -4.73 115.64 110.85 2bj4 s THR 371 Ca 0.45 0.04 0.02 0.00 -1.18 0.00 0.00 61.69 61.02 2bj4 s THR 371 Cb -0.10 -2.18 0.16 0.00 1.34 0.00 0.00 72.50 71.72 2bj4 s THR 371 CO 0.39 -0.05 1.86 -0.07 -0.54 0.00 0.00 174.62 176.22 2bj4 h LEU 372 N -1.59 0.62 -0.50 4.79 3.38 -1.96 -0.65 115.31 119.40 2bj4 h LEU 372 Ca -0.44 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2bj4 h LEU 372 Cb 1.27 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 2bj4 h LEU 372 CO 0.43 0.64 0.33 -0.74 0.09 0.00 0.00 178.44 179.18 2bj4 h HIS 373 N 0.64 0.63 -0.34 1.13 2.76 -2.00 -1.40 115.15 116.58 2bj4 h HIS 373 Ca 0.14 0.01 -0.14 0.00 -2.20 0.00 0.00 60.37 58.18 2bj4 h HIS 373 Cb 0.29 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 2bj4 h HIS 373 CO 0.01 0.41 -0.37 -0.44 -1.30 0.00 0.00 177.93 176.24 2bj4 h ASP 374 N 0.67 0.83 -0.35 3.26 3.32 -1.82 -1.93 116.42 120.41 2bj4 h ASP 374 Ca 0.18 -0.36 0.05 0.00 0.02 0.00 0.00 57.03 56.92 2bj4 h ASP 374 Cb -0.07 -0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.21 2bj4 h ASP 374 CO -0.04 1.11 0.08 1.56 -1.72 0.00 0.00 179.24 180.23 2bj4 h GLN 375 N 0.65 0.20 -0.30 3.56 4.20 -0.90 -0.75 115.11 121.76 2bj4 h GLN 375 Ca 0.06 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 58.75 2bj4 h GLN 375 Cb 0.92 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.64 2bj4 h GLN 375 CO 0.08 0.13 0.17 0.28 -0.67 0.00 0.00 178.83 178.82 2bj4 h VAL 376 N 0.21 1.13 -0.39 -0.54 2.07 -1.19 -2.10 116.25 115.44 2bj4 h VAL 376 Ca 0.16 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.37 2bj4 h VAL 376 Cb 0.18 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 2bj4 h VAL 376 CO -0.21 0.13 0.21 -0.74 0.02 0.00 0.00 177.57 176.98 2bj4 h HIS 377 N 0.38 0.39 -0.47 1.57 -0.00 -1.17 0.12 115.15 115.97 2bj4 h HIS 377 Ca 0.11 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.50 2bj4 h HIS 377 Cb 0.06 -0.12 -0.02 0.00 -0.00 0.00 0.00 27.41 27.32 2bj4 h HIS 377 CO -0.03 0.22 0.31 -0.07 -0.00 0.00 0.00 177.93 178.36 2bj4 h LEU 378 N 0.43 0.54 -0.49 0.26 3.38 -0.91 -1.46 115.31 117.07 2bj4 h LEU 378 Ca 0.16 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 58.02 2bj4 h LEU 378 Cb 0.04 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 2bj4 h LEU 378 CO -0.09 0.40 -0.04 -0.07 0.09 0.00 0.00 178.44 178.74 2bj4 h LEU 379 N 0.63 0.87 -1.07 1.67 3.38 -1.02 -1.39 115.31 118.39 2bj4 h LEU 379 Ca 0.17 -0.33 0.10 0.00 0.09 0.00 0.00 57.88 57.92 2bj4 h LEU 379 Cb -0.06 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.38 2bj4 h LEU 379 CO -0.04 0.99 0.62 -0.33 0.09 0.00 0.00 178.44 179.78 2bj4 h GLU 380 N 0.74 0.98 -0.03 1.13 4.39 -0.58 -1.09 114.58 120.12 2bj4 h GLU 380 Ca 0.13 -0.06 -0.18 0.00 0.34 0.00 0.00 59.36 59.59 2bj4 h GLU 380 Cb 0.56 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.98 2bj4 h GLU 380 CO 0.03 0.65 -0.78 0.00 -1.16 0.00 0.00 179.01 177.75 2bj4 n ALA 382 N -2.48 3.03 -0.25 0.00 0.00 -0.56 -4.68 120.51 115.57 2bj4 n ALA 382 Ca -0.04 -0.52 0.05 0.00 0.00 0.00 0.00 53.44 52.93 2bj4 n ALA 382 Cb 0.74 -0.76 0.28 0.00 0.00 0.00 0.00 19.45 19.71 2bj4 n ALA 382 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.50 177.61 2bj4 h TRP 383 N 0.00 0.93 0.02 0.00 5.08 -1.40 -0.56 115.95 120.01 2bj4 h TRP 383 Ca 0.00 0.02 -0.23 0.00 1.08 0.00 0.00 58.89 59.76 2bj4 h TRP 383 Cb 0.94 -0.31 0.00 0.00 -3.00 0.00 0.00 29.16 26.80 2bj4 h TRP 383 CO 0.00 0.49 -0.98 1.25 -1.28 0.00 0.00 178.44 177.93 2bj4 h LEU 384 N 0.92 0.52 -0.99 0.11 5.85 -1.86 -1.64 115.31 118.23 2bj4 h LEU 384 Ca 0.36 -0.43 0.04 0.00 0.84 0.00 0.00 57.88 58.68 2bj4 h LEU 384 Cb 0.21 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 2bj4 h LEU 384 CO -0.13 1.24 0.65 -0.33 -0.34 0.00 0.00 178.44 179.53 2bj4 h GLU 385 N 0.21 1.21 -0.25 1.25 5.08 -1.56 -0.34 114.58 120.19 2bj4 h GLU 385 Ca -0.09 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.07 2bj4 h GLU 385 Cb 1.62 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 30.60 2bj4 h GLU 385 CO 0.17 0.80 -0.34 0.82 -1.00 0.00 0.00 179.01 179.46 2bj4 h ILE 386 N 1.24 1.31 -0.70 3.13 2.04 -0.93 -0.60 117.51 123.01 2bj4 h ILE 386 Ca 0.40 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.73 2bj4 h ILE 386 Cb 0.01 1.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 2bj4 h ILE 386 CO -0.13 0.48 0.44 -0.07 0.00 0.00 0.00 178.15 178.88 2bj4 h LEU 387 N 0.39 0.82 -0.33 1.44 3.38 -1.07 -2.45 115.31 117.48 2bj4 h LEU 387 Ca 0.03 -0.04 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 2bj4 h LEU 387 Cb 0.92 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 2bj4 h LEU 387 CO 0.08 0.62 -0.20 0.24 0.09 0.00 0.00 178.44 179.27 2bj4 h MET 388 N 0.94 0.71 -0.44 1.13 2.86 -0.90 -1.58 114.93 117.65 2bj4 h MET 388 Ca 0.25 -0.33 -0.10 0.00 -2.06 0.00 0.00 59.70 57.47 2bj4 h MET 388 Cb -0.07 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2bj4 h MET 388 CO -0.05 0.93 -0.12 0.97 1.06 0.00 0.00 176.91 179.70 2bj4 h ILE 389 N 0.48 1.26 -0.42 -1.22 2.10 -1.07 0.14 117.51 118.78 2bj4 h ILE 389 Ca 0.07 -1.20 0.08 0.00 1.08 0.00 0.00 64.86 64.88 2bj4 h ILE 389 Cb 0.74 1.05 -0.07 0.00 -1.09 0.00 0.00 36.82 37.46 2bj4 h ILE 389 CO 0.06 0.41 0.01 1.23 -1.08 0.00 0.00 178.15 178.78 2bj4 h GLY 390 N 0.97 0.43 0.98 8.18 0.00 -1.37 -0.42 103.07 111.85 2bj4 h GLY 390 Ca 0.12 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.49 2bj4 h GLY 390 CO 0.04 -0.10 0.19 -2.00 0.00 0.00 0.00 176.54 174.68 2bj4 h LEU 391 N 0.12 0.37 -0.29 3.11 5.85 -0.82 -1.69 115.31 121.96 2bj4 h LEU 391 Ca 0.21 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2bj4 h LEU 391 Cb 0.29 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 2bj4 h LEU 391 CO -0.33 0.30 0.19 0.58 -0.34 0.00 0.00 178.44 178.83 2bj4 h VAL 392 N 0.40 1.07 -0.07 1.05 2.07 -0.55 -1.08 116.25 119.13 2bj4 h VAL 392 Ca 0.11 -0.13 0.04 0.00 0.82 0.00 0.00 66.70 67.54 2bj4 h VAL 392 Cb -0.00 0.65 -0.05 0.00 -1.52 0.00 0.00 31.29 30.36 2bj4 h VAL 392 CO -0.02 0.07 -0.26 -0.25 0.02 0.00 0.00 177.57 177.13 2bj4 h TRP 393 N 0.39 -0.69 0.00 1.57 2.91 -0.88 -1.63 115.95 117.62 2bj4 h TRP 393 Ca 0.11 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.16 2bj4 h TRP 393 Cb -0.04 0.32 0.00 0.00 -0.51 0.00 0.00 29.16 28.93 2bj4 h TRP 393 CO -0.06 -0.34 0.00 2.89 -1.03 0.00 0.00 178.44 179.90 2bj4 n ARG 394 N -5.38 0.05 0.00 2.65 1.85 -0.65 -2.53 116.66 112.65 2bj4 n ARG 394 Ca -0.04 0.17 0.12 0.00 -1.00 0.00 0.00 57.85 57.10 2bj4 n ARG 394 Cb 0.29 -1.58 0.17 0.00 -1.05 0.00 0.00 32.46 30.29 2bj4 n ARG 394 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2bj4 n SER 395 N -1.67 0.61 -0.27 2.89 7.64 -0.42 -4.60 113.62 117.80 2bj4 n SER 395 Ca 0.05 -0.39 0.08 0.00 1.01 0.00 0.00 58.87 59.62 2bj4 n SER 395 Cb 0.27 0.42 0.22 0.00 -1.01 0.00 0.00 64.21 64.11 2bj4 n SER 395 CO 0.00 0.00 0.00 0.24 -3.01 0.00 0.00 175.04 172.27 2bj4 h MET 396 N 0.00 0.28 -0.44 1.43 2.86 -1.03 0.20 114.93 118.23 2bj4 h MET 396 Ca 0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 2bj4 h MET 396 Cb 0.51 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.11 2bj4 h MET 396 CO 0.00 0.19 0.00 0.39 1.06 0.00 0.00 176.91 178.55 2bj4 n GLU 397 N -5.14 1.64 -3.44 1.72 1.02 -1.26 -4.42 120.64 110.76 2bj4 n GLU 397 Ca 0.17 -0.73 -0.26 0.00 -0.02 0.00 0.00 57.16 56.31 2bj4 n GLU 397 Cb 0.53 -1.34 -0.09 0.00 -0.02 0.00 0.00 31.44 30.52 2bj4 n GLU 397 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2bj4 n HIS 398 N 0.10 1.65 -1.58 -0.32 8.25 0.06 -5.09 115.22 118.28 2bj4 n HIS 398 Ca 0.07 -3.87 -0.56 0.00 -0.26 0.00 0.00 57.72 53.09 2bj4 n HIS 398 Cb 0.28 -0.38 -0.07 0.00 1.12 0.00 0.00 29.99 30.94 2bj4 n HIS 398 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2bj4 n PRO 399 N 1.55 0.66 -0.49 -0.41 -0.02 -1.26 -1.47 135.00 133.56 2bj4 n PRO 399 Ca 0.25 0.24 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2bj4 n PRO 399 Cb 0.44 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2bj4 n PRO 399 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bj4 n GLY 400 N 2.40 1.04 3.16 -1.23 0.00 -1.26 -5.02 105.19 104.28 2bj4 n GLY 400 Ca 0.20 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 2bj4 n GLY 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2bj4 s LYS 401 N -0.38 0.81 -0.23 1.61 1.02 -0.54 -3.90 119.74 118.13 2bj4 s LYS 401 Ca 0.00 -1.13 -0.03 0.00 0.02 0.00 0.00 55.97 54.83 2bj4 s LYS 401 Cb 0.00 -0.48 0.00 0.00 -0.52 0.00 0.00 37.83 36.83 2bj4 s LYS 401 CO 0.00 0.07 -0.05 -0.51 -0.92 0.00 0.00 175.35 173.94 2bj4 s LEU 402 N -2.40 2.96 -1.22 3.17 1.43 0.70 -4.84 118.68 118.48 2bj4 s LEU 402 Ca 0.04 -0.51 -0.14 0.00 -1.03 0.00 0.00 54.13 52.50 2bj4 s LEU 402 Cb -0.03 -1.72 0.16 0.00 0.03 0.00 0.00 46.19 44.63 2bj4 s LEU 402 CO -0.00 -0.05 1.48 -0.11 0.23 0.00 0.00 176.35 177.90 2bj4 n LEU 403 N 4.77 5.25 -0.34 1.79 0.00 -1.26 -0.86 117.00 126.34 2bj4 n LEU 403 Ca -0.18 -4.42 -0.03 0.00 0.00 0.00 0.00 56.01 51.38 2bj4 n LEU 403 Cb 0.50 -1.63 0.09 0.00 0.00 0.00 0.00 43.42 42.39 2bj4 n LEU 403 CO 0.29 0.70 1.24 -0.26 0.00 0.00 0.00 177.39 179.35 2bj4 h PHE 404 N 7.12 1.19 -3.52 1.96 0.04 -1.43 -3.44 116.94 118.85 2bj4 h PHE 404 Ca 0.33 0.01 -0.06 0.00 2.80 0.00 0.00 57.97 61.06 2bj4 h PHE 404 Cb 0.86 -0.39 -0.12 0.00 2.20 0.00 0.00 35.95 38.50 2bj4 h PHE 404 CO 1.14 0.77 -0.13 0.00 -0.60 0.00 0.00 178.31 179.48 2bj4 s ALA 405 N -6.04 -0.65 0.52 2.45 0.00 -0.94 -4.92 121.76 112.18 2bj4 s ALA 405 Ca -0.13 -0.34 0.23 0.00 0.00 0.00 0.00 51.96 51.72 2bj4 s ALA 405 Cb 0.17 0.74 1.34 0.00 0.00 0.00 0.00 23.12 25.37 2bj4 s ALA 405 CO 0.81 -0.67 2.01 -1.35 0.00 0.00 0.00 175.76 176.56 2bj4 h PRO 406 N 2.40 0.05 -0.66 0.00 0.11 -1.86 0.48 132.00 132.53 2bj4 h PRO 406 Ca -0.32 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2bj4 h PRO 406 Cb 1.24 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2bj4 h PRO 406 CO 0.46 0.03 0.00 0.27 -0.21 0.00 0.00 178.00 178.55 2bj4 n ASN 407 N -4.41 4.22 -3.35 -2.05 6.94 -1.26 -4.63 115.26 110.72 2bj4 n ASN 407 Ca 0.09 -2.29 -0.25 0.00 -0.02 0.00 0.00 54.58 52.11 2bj4 n ASN 407 Cb 0.53 -0.53 -0.09 0.00 -2.36 0.00 0.00 39.78 37.33 2bj4 n ASN 407 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2bj4 s LEU 408 N -1.51 1.03 -0.28 -4.53 2.96 0.17 -4.91 118.68 111.60 2bj4 s LEU 408 Ca 0.47 -2.76 -0.05 0.00 -0.22 0.00 0.00 54.13 51.57 2bj4 s LEU 408 Cb 0.29 -0.19 0.01 0.00 0.50 0.00 0.00 46.19 46.80 2bj4 s LEU 408 CO 0.26 -0.18 0.04 -0.22 -1.32 0.00 0.00 176.35 174.92 2bj4 s LEU 409 N 0.34 3.66 0.08 -0.68 0.20 -1.24 -0.99 118.68 120.03 2bj4 s LEU 409 Ca 0.30 -0.76 0.09 0.00 0.69 0.00 0.00 54.13 54.45 2bj4 s LEU 409 Cb -0.01 -1.82 -0.03 0.00 -0.43 0.00 0.00 46.19 43.90 2bj4 s LEU 409 CO -0.15 -0.17 -0.21 -0.76 -0.29 0.00 0.00 176.35 174.77 2bj4 s LEU 410 N 1.45 2.52 0.53 -0.68 1.43 -0.04 -4.93 118.68 118.95 2bj4 s LEU 410 Ca 0.02 -0.54 0.09 0.00 -1.03 0.00 0.00 54.13 52.66 2bj4 s LEU 410 Cb -0.17 -1.44 0.06 0.00 0.03 0.00 0.00 46.19 44.66 2bj4 s LEU 410 CO 0.00 0.22 0.67 1.51 0.23 0.00 0.00 176.35 178.98 2bj4 s ASP 411 N -1.70 5.16 0.35 2.29 1.47 -1.26 -0.21 116.67 122.77 2bj4 s ASP 411 Ca 0.15 -0.80 0.09 0.00 1.18 0.00 0.00 52.55 53.17 2bj4 s ASP 411 Cb -0.10 0.04 0.63 0.00 -0.34 0.00 0.00 42.92 43.15 2bj4 s ASP 411 CO 0.06 -1.14 1.81 0.08 0.68 0.00 0.00 175.17 176.67 2bj4 h ARG 412 N 0.41 0.21 -0.59 2.11 0.11 -1.97 -2.29 114.38 112.37 2bj4 h ARG 412 Ca -0.34 -0.07 0.12 0.00 0.10 0.00 0.00 59.98 59.79 2bj4 h ARG 412 Cb 1.29 -0.02 -0.10 0.00 1.11 0.00 0.00 29.97 32.25 2bj4 h ARG 412 CO 0.45 0.48 -0.03 -0.91 0.10 0.00 0.00 179.97 180.06 2bj4 h ASN 413 N 0.19 -0.32 0.51 0.08 2.35 -1.95 -0.32 115.58 116.11 2bj4 h ASN 413 Ca 0.03 0.15 -0.05 0.00 -0.55 0.00 0.00 56.30 55.88 2bj4 h ASN 413 Cb 0.60 0.28 -0.01 0.00 0.05 0.00 0.00 38.32 39.24 2bj4 h ASN 413 CO 0.04 -0.13 -0.22 1.56 -1.65 0.00 0.00 177.43 177.04 2bj4 h GLN 414 N 0.09 0.00 -0.78 0.81 4.20 -1.82 -2.76 115.11 114.86 2bj4 h GLN 414 Ca 0.30 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.10 2bj4 h GLN 414 Cb 0.49 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.20 2bj4 h GLN 414 CO -0.53 0.22 0.44 0.78 -0.67 0.00 0.00 178.83 179.07 2bj4 h GLY 415 N 1.24 1.18 1.72 3.46 0.00 -0.86 -2.12 103.07 107.68 2bj4 h GLY 415 Ca -0.00 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2bj4 h GLY 415 CO 0.03 0.14 0.07 1.17 0.00 0.00 0.00 176.54 177.95 2bj4 n LYS 416 N -4.76 0.00 -0.13 4.80 4.81 -1.04 -1.78 118.16 120.06 2bj4 n LYS 416 Ca 0.12 0.43 -0.05 0.00 -0.87 0.00 0.00 58.31 57.94 2bj4 n LYS 416 Cb 0.24 -1.58 0.01 0.00 0.02 0.00 0.00 35.03 33.73 2bj4 n LYS 416 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2bj4 s VAL 418 N -6.12 4.82 -0.17 0.00 1.01 -0.73 -3.98 120.40 115.22 2bj4 s VAL 418 Ca -0.14 -0.14 -0.38 0.00 0.00 0.00 0.00 61.98 61.32 2bj4 s VAL 418 Cb 0.15 -4.26 -0.15 0.00 0.00 0.00 0.00 36.38 32.12 2bj4 s VAL 418 CO 0.70 -0.72 1.71 -1.84 0.00 0.00 0.00 175.10 174.96 2bj4 n GLU 419 N 6.30 1.41 0.00 2.72 0.00 -1.26 0.16 120.64 129.97 2bj4 n GLU 419 Ca -0.04 0.52 0.00 0.00 0.00 0.00 0.00 57.16 57.64 2bj4 n GLU 419 Cb 0.47 -2.23 0.00 0.00 0.00 0.00 0.00 31.44 29.68 2bj4 n GLU 419 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2bj4 n GLY 420 N 3.99 2.95 0.12 -1.84 0.00 -1.26 -4.95 105.19 104.20 2bj4 n GLY 420 Ca 0.24 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.29 2bj4 n GLY 420 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2bj4 h MET 421 N 3.13 0.00 -0.57 1.61 -1.53 -0.52 -3.34 114.93 113.72 2bj4 h MET 421 Ca 0.00 0.00 -0.01 0.00 -3.44 0.00 0.00 59.70 56.25 2bj4 h MET 421 Cb 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.02 2bj4 h MET 421 CO 0.00 0.33 0.33 -0.24 0.14 0.00 0.00 176.91 177.47 2bj4 h VAL 422 N 0.00 1.17 -0.15 -5.77 3.04 -1.71 0.85 116.25 113.68 2bj4 h VAL 422 Ca -0.08 -0.39 0.05 0.00 -1.01 0.00 0.00 66.70 65.28 2bj4 h VAL 422 Cb 1.42 0.38 -0.06 0.00 -2.01 0.00 0.00 31.29 31.02 2bj4 h VAL 422 CO 0.05 0.18 -0.27 -0.08 -1.01 0.00 0.00 177.57 176.43 2bj4 h GLU 423 N 0.78 -0.32 -0.21 4.17 4.81 -1.95 -0.11 114.58 121.75 2bj4 h GLU 423 Ca 0.20 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.45 2bj4 h GLU 423 Cb -0.01 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2bj4 h GLU 423 CO -0.04 -0.21 0.09 0.82 -0.73 0.00 0.00 179.01 178.94 2bj4 h ILE 424 N -0.33 1.15 -0.68 2.32 2.04 -1.58 -2.31 117.51 118.12 2bj4 h ILE 424 Ca 0.11 -0.44 0.07 0.00 1.00 0.00 0.00 64.86 65.60 2bj4 h ILE 424 Cb 0.49 1.05 -0.06 0.00 -0.74 0.00 0.00 36.82 37.56 2bj4 h ILE 424 CO -0.34 0.15 0.36 -0.26 0.00 0.00 0.00 178.15 178.05 2bj4 h PHE 425 N 0.20 0.65 -0.54 1.37 -1.00 -0.64 -0.06 116.94 116.93 2bj4 h PHE 425 Ca 0.07 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.87 2bj4 h PHE 425 Cb 0.14 -0.19 -0.03 0.00 3.61 0.00 0.00 35.95 39.49 2bj4 h PHE 425 CO -0.02 0.28 0.29 -0.44 -1.61 0.00 0.00 178.31 176.81 2bj4 h ASP 426 N 0.64 0.68 -0.81 2.17 3.32 -0.91 -1.21 116.42 120.30 2bj4 h ASP 426 Ca 0.32 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 2bj4 h ASP 426 Cb 0.27 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 2bj4 h ASP 426 CO -0.22 0.58 0.46 0.24 -1.72 0.00 0.00 179.24 178.57 2bj4 h MET 427 N 0.72 1.12 -0.36 3.56 2.86 -0.83 -0.78 114.93 121.21 2bj4 h MET 427 Ca 0.19 -0.12 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 2bj4 h MET 427 Cb 0.05 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.47 2bj4 h MET 427 CO -0.03 0.82 0.14 -0.07 1.06 0.00 0.00 176.91 178.83 2bj4 h LEU 428 N 1.12 0.51 -0.94 1.22 3.38 -0.62 -2.09 115.31 117.89 2bj4 h LEU 428 Ca 0.29 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 58.11 2bj4 h LEU 428 Cb 0.01 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.58 2bj4 h LEU 428 CO -0.05 0.55 0.61 -0.07 0.09 0.00 0.00 178.44 179.57 2bj4 h LEU 429 N 0.44 1.02 -1.18 1.67 3.38 -1.03 -0.62 115.31 118.99 2bj4 h LEU 429 Ca 0.12 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2bj4 h LEU 429 Cb 0.21 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2bj4 h LEU 429 CO -0.01 0.71 0.24 0.00 0.09 0.00 0.00 178.44 179.47 2bj4 h ALA 430 N 1.38 1.36 -0.28 1.53 0.00 -1.03 0.55 119.26 122.77 2bj4 h ALA 430 Ca 0.37 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 2bj4 h ALA 430 Cb -0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2bj4 h ALA 430 CO -0.11 0.49 -0.19 1.15 0.00 0.00 0.00 179.25 180.59 2bj4 h THR 431 N 0.81 1.30 -0.65 0.00 2.02 -0.65 -1.06 112.91 114.68 2bj4 h THR 431 Ca 0.20 -1.32 0.04 0.00 0.77 0.00 0.00 66.41 66.09 2bj4 h THR 431 Cb 0.13 1.54 -0.04 0.00 -1.74 0.00 0.00 68.15 68.04 2bj4 h THR 431 CO -0.02 0.42 0.39 -1.28 0.37 0.00 0.00 175.52 175.40 2bj4 h SER 432 N 0.37 0.62 -0.83 4.18 0.87 -0.85 0.03 113.55 117.94 2bj4 h SER 432 Ca 0.06 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 2bj4 h SER 432 Cb 0.73 -0.12 -0.04 0.00 -0.44 0.00 0.00 62.40 62.53 2bj4 h SER 432 CO 0.05 0.43 0.39 -1.28 -0.53 0.00 0.00 176.83 175.89 2bj4 h SER 433 N 0.76 1.11 -0.40 6.23 0.87 -0.84 -1.52 113.55 119.76 2bj4 h SER 433 Ca 0.27 -0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.68 2bj4 h SER 433 Cb 0.06 -0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 2bj4 h SER 433 CO -0.12 0.94 0.23 -0.09 -0.53 0.00 0.00 176.83 177.26 2bj4 h ARG 434 N 1.20 0.55 -0.43 2.24 9.65 -0.43 0.18 114.38 127.34 2bj4 h ARG 434 Ca 0.29 -0.05 0.05 0.00 -1.10 0.00 0.00 59.98 59.16 2bj4 h ARG 434 Cb 0.14 -0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 28.56 2bj4 h ARG 434 CO -0.03 0.42 0.15 0.74 2.80 0.00 0.00 179.97 184.05 2bj4 h PHE 435 N 0.52 0.27 -0.57 2.20 -1.00 -0.84 -0.78 116.94 116.75 2bj4 h PHE 435 Ca 0.14 0.02 -0.03 0.00 2.81 0.00 0.00 57.97 60.91 2bj4 h PHE 435 Cb 0.02 -0.06 -0.03 0.00 3.61 0.00 0.00 35.95 39.50 2bj4 h PHE 435 CO -0.03 0.10 0.24 -0.09 -1.61 0.00 0.00 178.31 176.93 2bj4 h ARG 436 N 0.32 0.84 -0.19 1.51 2.43 -1.06 -0.65 114.38 117.58 2bj4 h ARG 436 Ca 0.20 -0.14 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 2bj4 h ARG 436 Cb 0.18 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2bj4 h ARG 436 CO -0.20 0.71 -0.09 1.98 -1.51 0.00 0.00 179.97 180.87 2bj4 h MET 437 N 0.78 0.30 -0.00 0.20 4.05 -0.38 -1.66 114.93 118.22 2bj4 h MET 437 Ca 0.19 -0.07 0.00 0.00 -0.28 0.00 0.00 59.70 59.55 2bj4 h MET 437 Cb 0.17 -0.04 0.00 0.00 -0.80 0.00 0.00 31.60 30.93 2bj4 h MET 437 CO -0.02 0.41 -0.22 -1.33 0.23 0.00 0.00 176.91 175.97 2bj4 n MET 438 N -4.29 0.55 -3.82 0.39 2.81 -0.35 -4.96 117.12 107.45 2bj4 n MET 438 Ca -0.00 -0.26 -0.24 0.00 -1.81 0.00 0.00 57.70 55.39 2bj4 n MET 438 Cb 0.25 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.28 2bj4 n MET 438 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2bj4 n ASN 439 N -1.00 -1.31 -4.65 7.83 5.15 -0.36 -4.88 115.26 116.04 2bj4 n ASN 439 Ca 0.11 -0.88 -0.47 0.00 -0.60 0.00 0.00 54.58 52.74 2bj4 n ASN 439 Cb 0.32 -3.67 -0.04 0.00 -0.53 0.00 0.00 39.78 35.86 2bj4 n ASN 439 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2bj4 n LEU 440 N -4.36 2.68 -4.96 1.20 7.94 -0.55 -4.98 117.00 113.96 2bj4 n LEU 440 Ca -0.26 1.12 -0.22 0.00 -1.11 0.00 0.00 56.01 55.55 2bj4 n LEU 440 Cb 0.66 -1.36 -0.02 0.00 0.53 0.00 0.00 43.42 43.22 2bj4 n LEU 440 CO 0.72 -0.61 -0.05 -1.10 -1.11 0.00 0.00 177.39 175.25 2bj4 s GLN 441 N 0.19 3.43 0.26 1.96 -1.52 -1.26 -4.99 119.66 117.74 2bj4 s GLN 441 Ca 0.75 -0.75 -0.04 0.00 -1.95 0.00 0.00 55.36 53.37 2bj4 s GLN 441 Cb -0.73 -2.89 0.33 0.00 -0.22 0.00 0.00 33.01 29.50 2bj4 s GLN 441 CO 0.45 0.44 1.87 0.78 -0.25 0.00 0.00 175.29 178.58 2bj4 h GLY 442 N 1.27 1.14 1.32 3.09 0.00 -1.99 -1.41 103.07 106.49 2bj4 h GLY 442 Ca -0.52 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.27 2bj4 h GLY 442 CO 0.62 0.52 0.43 0.83 0.00 0.00 0.00 176.54 178.94 2bj4 h GLU 443 N 1.06 0.91 -0.23 4.80 3.07 -1.99 -0.44 114.58 121.75 2bj4 h GLU 443 Ca 0.26 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 58.98 2bj4 h GLU 443 Cb 0.10 -0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 2bj4 h GLU 443 CO -0.03 0.62 -0.16 0.93 -1.40 0.00 0.00 179.01 178.96 2bj4 h GLU 444 N 0.93 0.52 -0.51 2.33 5.08 -1.80 -2.50 114.58 118.63 2bj4 h GLU 444 Ca 0.25 -0.25 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 2bj4 h GLU 444 Cb -0.08 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.12 2bj4 h GLU 444 CO -0.05 0.82 0.22 0.35 -1.00 0.00 0.00 179.01 179.35 2bj4 h PHE 445 N 0.23 0.40 -0.60 4.33 3.57 -0.81 -0.48 116.94 123.58 2bj4 h PHE 445 Ca 0.05 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.49 2bj4 h PHE 445 Cb 0.69 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.30 2bj4 h PHE 445 CO 0.07 0.16 0.05 0.28 -2.23 0.00 0.00 178.31 176.65 2bj4 h VAL 446 N 0.43 1.26 -0.03 1.41 2.07 -1.09 -0.09 116.25 120.20 2bj4 h VAL 446 Ca 0.24 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.71 2bj4 h VAL 446 Cb 0.21 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.71 2bj4 h VAL 446 CO -0.21 0.39 0.02 0.00 0.02 0.00 0.00 177.57 177.79 2bj4 h LEU 448 N 0.04 0.83 -0.78 0.00 3.38 -0.63 -0.72 115.31 117.43 2bj4 h LEU 448 Ca 0.01 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.01 2bj4 h LEU 448 Cb -0.00 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 40.53 2bj4 h LEU 448 CO -0.00 0.56 0.50 0.50 0.09 0.00 0.00 178.44 180.09 2bj4 h LYS 449 N 0.97 0.96 -0.29 1.13 3.64 -0.84 -1.59 116.57 120.55 2bj4 h LYS 449 Ca 0.33 -0.06 -0.11 0.00 -1.27 0.00 0.00 60.65 59.55 2bj4 h LYS 449 Cb 0.06 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.65 2bj4 h LYS 449 CO -0.13 0.64 -0.27 0.77 -2.27 0.00 0.00 179.45 178.18 2bj4 h SER 450 N 0.99 0.59 -0.46 4.20 0.02 -0.81 -2.36 113.55 115.72 2bj4 h SER 450 Ca 0.31 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2bj4 h SER 450 Cb -0.01 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.33 2bj4 h SER 450 CO -0.10 0.85 0.25 0.40 -1.14 0.00 0.00 176.83 177.08 2bj4 h ILE 451 N 0.51 0.99 -0.41 3.27 2.04 -0.68 -2.25 117.51 120.98 2bj4 h ILE 451 Ca 0.07 -0.17 0.02 0.00 1.00 0.00 0.00 64.86 65.78 2bj4 h ILE 451 Cb 0.74 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 2bj4 h ILE 451 CO 0.06 0.09 0.23 0.40 0.00 0.00 0.00 178.15 178.93 2bj4 h ILE 452 N 0.49 1.02 -0.35 -0.67 2.04 -1.03 0.13 117.51 119.15 2bj4 h ILE 452 Ca 0.20 -0.16 0.07 0.00 1.00 0.00 0.00 64.86 65.96 2bj4 h ILE 452 Cb 0.07 0.51 -0.06 0.00 -0.74 0.00 0.00 36.82 36.61 2bj4 h ILE 452 CO -0.12 0.08 -0.05 0.25 0.00 0.00 0.00 178.15 178.31 2bj4 h LEU 453 N 0.46 -0.25 0.03 1.44 5.85 -1.24 -1.70 115.31 119.92 2bj4 h LEU 453 Ca 0.17 0.09 -0.23 0.00 0.84 0.00 0.00 57.88 58.75 2bj4 h LEU 453 Cb 0.03 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2bj4 h LEU 453 CO -0.09 -0.08 -1.07 -0.07 -0.34 0.00 0.00 178.44 176.79 2bj4 h LEU 454 N 0.04 0.12 0.13 2.25 3.38 -1.03 -3.39 115.31 116.79 2bj4 h LEU 454 Ca 0.17 -0.12 -0.35 0.00 0.09 0.00 0.00 57.88 57.66 2bj4 h LEU 454 Cb 0.25 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2bj4 h LEU 454 CO -0.33 1.10 -1.89 -1.13 0.09 0.00 0.00 178.44 176.28 2bj4 h ASN 455 N 0.02 0.42 -0.80 -0.43 -0.73 -0.64 -3.37 115.58 110.04 2bj4 h ASN 455 Ca -0.04 -0.83 -0.04 0.00 1.87 0.00 0.00 56.30 57.25 2bj4 h ASN 455 Cb 1.83 -0.14 -0.04 0.00 0.27 0.00 0.00 38.32 40.24 2bj4 h ASN 455 CO 0.15 1.73 0.33 0.28 -0.37 0.00 0.00 177.43 179.56 2bj4 h SER 456 N 0.07 1.10 -0.47 1.15 0.02 -1.50 -2.70 113.55 111.22 2bj4 h SER 456 Ca -0.38 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.41 2bj4 h SER 456 Cb 2.05 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 64.30 2bj4 h SER 456 CO 0.11 0.96 0.00 0.61 -1.14 0.00 0.00 176.83 177.37 2bj4 n GLY 457 N -0.91 1.73 0.19 -3.77 0.00 -1.26 -4.55 105.19 96.62 2bj4 n GLY 457 Ca 0.07 -0.70 0.05 0.00 0.00 0.00 0.00 46.02 45.44 2bj4 n GLY 457 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2bj4 h VAL 458 N 4.04 0.99 -0.00 1.61 3.04 -1.64 -2.90 116.25 121.39 2bj4 h VAL 458 Ca 0.00 -1.41 0.00 0.00 -1.01 0.00 0.00 66.70 64.28 2bj4 h VAL 458 Cb 0.90 1.83 0.00 0.00 -2.01 0.00 0.00 31.29 32.01 2bj4 h VAL 458 CO 0.00 0.36 -0.18 -1.22 -1.01 0.00 0.00 177.57 175.52 2bj4 n TYR 459 N -3.70 0.00 -1.11 3.17 4.02 -1.26 -3.73 117.16 114.55 2bj4 n TYR 459 Ca -0.01 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.97 2bj4 n TYR 459 Cb 0.46 -0.18 0.12 0.00 -0.02 0.00 0.00 39.34 39.72 2bj4 n TYR 459 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2bj4 n THR 460 N -0.91 1.64 0.00 -0.72 -2.24 -1.10 -4.89 114.28 106.07 2bj4 n THR 460 Ca 0.13 -1.97 0.00 0.00 -2.27 0.00 0.00 64.05 59.94 2bj4 n THR 460 Cb 0.31 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 2bj4 n THR 460 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2bj4 n PHE 461 N -1.24 0.00 0.00 4.78 3.01 -1.20 -5.11 117.46 117.70 2bj4 n PHE 461 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.60 2bj4 n PHE 461 Cb 0.63 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.10 2bj4 n PHE 461 CO 0.00 0.00 0.00 1.47 1.01 0.00 0.00 176.76 179.24 2bj4 n LEU 462 N -0.23 0.00 0.00 4.37 -0.00 -1.26 -5.16 117.00 114.72 2bj4 n LEU 462 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2bj4 n LEU 462 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2bj4 n LEU 462 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 177.39 176.19 2bj4 n SER 464 N 0.00 0.00 -4.19 1.45 7.64 -1.26 -4.87 113.62 112.39 2bj4 n SER 464 Ca 0.00 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.71 2bj4 n SER 464 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 2bj4 n SER 464 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2bj4 s THR 465 N -2.12 1.08 0.17 0.44 -4.23 -1.26 -5.04 115.64 104.68 2bj4 s THR 465 Ca 0.00 -1.53 -0.14 0.00 -1.18 0.00 0.00 61.69 58.84 2bj4 s THR 465 Cb 0.00 -1.28 0.06 0.00 1.34 0.00 0.00 72.50 72.63 2bj4 s THR 465 CO 0.00 -0.40 1.82 0.25 -0.54 0.00 0.00 174.62 175.74 2bj4 h LEU 466 N 3.83 0.63 -0.39 4.79 5.85 -2.00 -2.57 115.31 125.45 2bj4 h LEU 466 Ca -0.39 -0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.37 2bj4 h LEU 466 Cb 1.19 -0.16 -0.09 0.00 0.37 0.00 0.00 40.66 41.97 2bj4 h LEU 466 CO 0.48 0.49 -0.32 0.50 -0.34 0.00 0.00 178.44 179.24 2bj4 h LYS 467 N 0.72 -0.24 -0.90 1.25 3.64 -1.98 0.41 116.57 119.46 2bj4 h LYS 467 Ca 0.19 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.67 2bj4 h LYS 467 Cb -0.04 0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 31.77 2bj4 h LYS 467 CO -0.04 -0.16 0.55 1.03 -2.27 0.00 0.00 179.45 178.56 2bj4 h SER 468 N -0.25 0.84 -0.71 4.20 0.87 -1.86 -0.11 113.55 116.53 2bj4 h SER 468 Ca 0.17 0.03 -0.05 0.00 -1.23 0.00 0.00 61.79 60.71 2bj4 h SER 468 Cb 0.53 -0.14 -0.03 0.00 -0.44 0.00 0.00 62.40 62.33 2bj4 h SER 468 CO -0.53 0.50 0.24 -0.07 -0.53 0.00 0.00 176.83 176.43 2bj4 h LEU 469 N 0.95 1.02 -1.65 2.23 3.38 -0.90 -1.98 115.31 118.36 2bj4 h LEU 469 Ca 0.41 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 2bj4 h LEU 469 Cb 0.29 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2bj4 h LEU 469 CO -0.21 0.94 0.05 -0.33 0.09 0.00 0.00 178.44 178.98 2bj4 h GLU 470 N 1.03 0.27 -0.07 1.13 5.08 0.52 -1.51 114.58 121.03 2bj4 h GLU 470 Ca 0.23 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 2bj4 h GLU 470 Cb 0.28 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 2bj4 h GLU 470 CO -0.01 0.25 -0.03 0.93 -1.00 0.00 0.00 179.01 179.15 2bj4 h GLU 471 N 0.28 0.15 -0.41 2.33 4.39 -0.49 -2.14 114.58 118.69 2bj4 h GLU 471 Ca 0.07 -0.06 0.03 0.00 0.34 0.00 0.00 59.36 59.73 2bj4 h GLU 471 Cb 0.10 -0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.72 2bj4 h GLU 471 CO -0.00 0.51 0.22 0.87 -1.16 0.00 0.00 179.01 179.45 2bj4 h LYS 472 N -0.22 0.43 -0.86 2.33 1.57 -1.13 -1.31 116.57 117.38 2bj4 h LYS 472 Ca 0.02 -0.03 0.11 0.00 -1.87 0.00 0.00 60.65 58.88 2bj4 h LYS 472 Cb 0.46 -0.10 -0.08 0.00 0.08 0.00 0.00 32.23 32.60 2bj4 h LYS 472 CO 0.01 0.28 0.49 -0.44 -0.57 0.00 0.00 179.45 179.23 2bj4 h ASP 473 N 0.44 0.69 0.24 0.86 3.32 -1.18 -1.09 116.42 119.71 2bj4 h ASP 473 Ca 0.17 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 2bj4 h ASP 473 Cb 0.05 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2bj4 h ASP 473 CO -0.10 0.37 -0.16 -0.74 -1.72 0.00 0.00 179.24 176.89 2bj4 h HIS 474 N 0.80 -0.41 -0.58 4.55 2.76 -0.96 -0.97 115.15 120.33 2bj4 h HIS 474 Ca 0.43 -0.00 0.09 0.00 -2.20 0.00 0.00 60.37 58.69 2bj4 h HIS 474 Cb 0.44 0.15 -0.07 0.00 1.55 0.00 0.00 27.41 29.48 2bj4 h HIS 474 CO -0.06 -0.25 0.20 0.82 -1.30 0.00 0.00 177.93 177.35 2bj4 h ILE 475 N -0.39 0.77 -0.45 6.26 2.04 -0.73 -0.10 117.51 124.91 2bj4 h ILE 475 Ca -0.02 -0.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.66 2bj4 h ILE 475 Cb 0.33 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 2bj4 h ILE 475 CO 0.02 0.07 0.08 0.45 0.00 0.00 0.00 178.15 178.77 2bj4 h HIS 476 N 0.38 0.70 -0.42 1.37 3.86 -1.00 0.37 115.15 120.40 2bj4 h HIS 476 Ca 0.29 -0.06 -0.04 0.00 -1.16 0.00 0.00 60.37 59.40 2bj4 h HIS 476 Cb 0.36 -0.21 -0.02 0.00 1.06 0.00 0.00 27.41 28.61 2bj4 h HIS 476 CO -0.18 0.61 0.10 0.00 0.86 0.00 0.00 177.93 179.33 2bj4 h ARG 477 N 0.66 0.68 -0.46 2.45 3.08 -0.06 -1.06 114.38 119.67 2bj4 h ARG 477 Ca 0.15 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 2bj4 h ARG 477 Cb 0.28 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 2bj4 h ARG 477 CO 0.00 0.69 0.11 0.28 -1.07 0.00 0.00 179.97 179.99 2bj4 h VAL 478 N 0.55 1.23 -0.98 2.04 2.07 -0.79 -2.33 116.25 118.04 2bj4 h VAL 478 Ca 0.13 -0.82 0.09 0.00 0.82 0.00 0.00 66.70 66.92 2bj4 h VAL 478 Cb 0.32 0.90 -0.07 0.00 -1.52 0.00 0.00 31.29 30.91 2bj4 h VAL 478 CO 0.00 0.29 0.62 -0.07 0.02 0.00 0.00 177.57 178.43 2bj4 h LEU 479 N 0.61 0.96 -0.99 2.57 3.38 -0.72 -0.72 115.31 120.40 2bj4 h LEU 479 Ca 0.14 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 2bj4 h LEU 479 Cb 0.32 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2bj4 h LEU 479 CO 0.00 0.57 0.54 0.44 0.09 0.00 0.00 178.44 180.09 2bj4 h ASP 480 N 1.07 1.10 -0.26 -0.43 3.32 -0.96 -1.19 116.42 119.07 2bj4 h ASP 480 Ca 0.45 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.36 2bj4 h ASP 480 Cb 0.29 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 2bj4 h ASP 480 CO -0.21 0.85 -0.07 0.11 -1.72 0.00 0.00 179.24 178.20 2bj4 h LYS 481 N 1.26 0.63 -0.30 3.56 1.57 -0.63 -1.00 116.57 121.66 2bj4 h LYS 481 Ca 0.33 -0.17 -0.13 0.00 -1.87 0.00 0.00 60.65 58.80 2bj4 h LYS 481 Cb -0.04 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2bj4 h LYS 481 CO -0.06 0.70 -0.35 0.82 -0.57 0.00 0.00 179.45 179.98 2bj4 h ILE 482 N 0.58 1.29 -0.16 1.86 2.04 -0.63 -1.08 117.51 121.41 2bj4 h ILE 482 Ca 0.11 -1.50 0.01 0.00 1.00 0.00 0.00 64.86 64.48 2bj4 h ILE 482 Cb 0.47 1.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.97 2bj4 h ILE 482 CO 0.02 0.48 0.06 0.74 0.00 0.00 0.00 178.15 179.46 2bj4 h THR 483 N 0.56 0.96 -0.94 -0.27 2.02 -0.80 -0.81 112.91 113.64 2bj4 h THR 483 Ca 0.06 -0.05 0.08 0.00 0.77 0.00 0.00 66.41 67.27 2bj4 h THR 483 Cb 0.87 0.82 -0.07 0.00 -1.74 0.00 0.00 68.15 68.03 2bj4 h THR 483 CO 0.08 0.03 0.61 0.44 0.37 0.00 0.00 175.52 177.04 2bj4 h ASP 484 N 0.14 0.91 -0.43 4.18 3.32 -0.96 -1.50 116.42 122.08 2bj4 h ASP 484 Ca 0.07 0.02 -0.08 0.00 0.02 0.00 0.00 57.03 57.06 2bj4 h ASP 484 Cb 0.04 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 2bj4 h ASP 484 CO -0.07 0.56 -0.03 0.74 -1.72 0.00 0.00 179.24 178.72 2bj4 h THR 485 N 1.02 1.27 -0.38 0.35 2.02 -0.65 -0.55 112.91 115.99 2bj4 h THR 485 Ca 0.42 -1.10 0.00 0.00 0.77 0.00 0.00 66.41 66.51 2bj4 h THR 485 Cb 0.29 1.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.78 2bj4 h THR 485 CO -0.18 0.37 0.25 -0.07 0.37 0.00 0.00 175.52 176.27 2bj4 h LEU 486 N 0.62 0.43 -0.57 2.58 3.38 -0.81 -1.15 115.31 119.80 2bj4 h LEU 486 Ca 0.12 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2bj4 h LEU 486 Cb 0.54 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 2bj4 h LEU 486 CO 0.03 0.31 0.24 0.40 0.09 0.00 0.00 178.44 179.50 2bj4 h ILE 487 N 0.51 1.22 -0.18 1.22 1.08 -1.12 -1.68 117.51 118.56 2bj4 h ILE 487 Ca 0.14 -0.67 0.04 0.00 -0.39 0.00 0.00 64.86 63.98 2bj4 h ILE 487 Cb -0.05 0.61 -0.04 0.00 -3.07 0.00 0.00 36.82 34.26 2bj4 h ILE 487 CO -0.03 0.26 -0.08 -0.74 -0.69 0.00 0.00 178.15 176.87 2bj4 h HIS 488 N 0.78 -0.18 -0.81 1.37 2.76 -0.93 0.25 115.15 118.39 2bj4 h HIS 488 Ca 0.19 0.02 0.07 0.00 -2.20 0.00 0.00 60.37 58.45 2bj4 h HIS 488 Cb 0.18 0.11 -0.06 0.00 1.55 0.00 0.00 27.41 29.19 2bj4 h HIS 488 CO 0.01 -0.12 0.48 -0.07 -1.30 0.00 0.00 177.93 176.93 2bj4 h LEU 489 N -0.06 0.74 -0.17 0.26 3.38 -0.83 0.03 115.31 118.67 2bj4 h LEU 489 Ca 0.09 0.03 -0.10 0.00 0.09 0.00 0.00 57.88 58.00 2bj4 h LEU 489 Cb 0.20 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2bj4 h LEU 489 CO -0.21 0.46 -0.27 0.24 0.09 0.00 0.00 178.44 178.74 2bj4 h MET 490 N 0.86 0.48 -0.67 1.13 2.86 -0.85 -1.79 114.93 116.96 2bj4 h MET 490 Ca 0.37 -0.29 0.07 0.00 -2.06 0.00 0.00 59.70 57.79 2bj4 h MET 490 Cb 0.23 0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.86 2bj4 h MET 490 CO -0.20 0.89 0.35 0.00 1.06 0.00 0.00 176.91 179.01 2bj4 h ALA 491 N 0.58 0.90 0.00 6.32 0.00 -0.68 -1.95 119.26 124.43 2bj4 h ALA 491 Ca 0.01 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2bj4 h ALA 491 Cb 0.86 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2bj4 h ALA 491 CO 0.06 -0.02 -0.20 0.87 0.00 0.00 0.00 179.25 179.96 2bj4 h LYS 492 N 0.62 0.00 -0.05 0.00 1.57 -0.91 -1.71 116.57 116.08 2bj4 h LYS 492 Ca 0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 2bj4 h LYS 492 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.57 2bj4 h LYS 492 CO -0.22 0.20 0.00 0.00 -0.57 0.00 0.00 179.45 178.86 2bj4 n ALA 493 N -2.45 2.59 -0.80 3.86 0.00 -0.68 -4.90 120.51 118.12 2bj4 n ALA 493 Ca -0.02 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.17 2bj4 n ALA 493 Cb 0.27 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.48 2bj4 n ALA 493 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2bj4 n GLY 494 N 0.91 0.55 3.75 0.00 0.00 -0.64 -5.03 105.19 104.72 2bj4 n GLY 494 Ca 0.15 -0.49 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 2bj4 n GLY 494 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2bj4 s LEU 495 N 0.00 4.51 0.73 0.99 1.43 -0.83 -5.03 118.68 120.48 2bj4 s LEU 495 Ca 0.00 2.24 -0.16 0.00 -1.03 0.00 0.00 54.13 55.18 2bj4 s LEU 495 Cb 0.00 -3.62 -0.01 0.00 0.03 0.00 0.00 46.19 42.59 2bj4 s LEU 495 CO 0.00 -0.22 0.76 0.41 0.23 0.00 0.00 176.35 177.52 2bj4 n THR 496 N 1.72 2.21 -0.15 5.49 -1.04 -1.26 -4.56 114.28 116.68 2bj4 n THR 496 Ca 0.01 -0.37 -0.03 0.00 -2.04 0.00 0.00 64.05 61.62 2bj4 n THR 496 Cb 0.45 -0.92 0.06 0.00 -1.82 0.00 0.00 70.33 68.10 2bj4 n THR 496 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 2bj4 h LEU 497 N -0.37 0.00 -0.66 -4.42 3.38 -1.99 0.18 115.31 111.43 2bj4 h LEU 497 Ca -0.46 0.09 0.08 0.00 0.09 0.00 0.00 57.88 57.67 2bj4 h LEU 497 Cb 1.34 0.12 -0.06 0.00 0.09 0.00 0.00 40.66 42.14 2bj4 h LEU 497 CO 0.44 0.03 0.33 -0.61 0.09 0.00 0.00 178.44 178.73 2bj4 h GLN 498 N 0.23 0.57 -0.15 1.13 4.15 -2.00 -2.06 115.11 116.98 2bj4 h GLN 498 Ca 0.24 -0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.52 2bj4 h GLN 498 Cb 0.32 -0.13 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 2bj4 h GLN 498 CO -0.32 0.38 -0.39 1.96 -1.93 0.00 0.00 178.83 178.52 2bj4 h GLN 499 N 0.59 0.33 0.09 1.69 4.20 -1.50 -1.99 115.11 118.51 2bj4 h GLN 499 Ca 0.32 -0.16 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 2bj4 h GLN 499 Cb 0.29 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.07 2bj4 h GLN 499 CO -0.24 0.68 -0.04 1.96 -0.67 0.00 0.00 178.83 180.52 2bj4 h GLN 500 N 0.28 -0.11 -0.58 1.46 4.20 -0.22 -0.57 115.11 119.58 2bj4 h GLN 500 Ca 0.03 0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.64 2bj4 h GLN 500 Cb 0.82 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.61 2bj4 h GLN 500 CO 0.07 0.10 -0.07 0.45 -0.67 0.00 0.00 178.83 178.71 2bj4 h HIS 501 N -0.31 1.18 -0.68 2.96 3.86 -1.29 -0.72 115.15 120.14 2bj4 h HIS 501 Ca -0.01 -0.23 0.02 0.00 -1.16 0.00 0.00 60.37 58.99 2bj4 h HIS 501 Cb 0.26 -0.30 -0.04 0.00 1.06 0.00 0.00 27.41 28.40 2bj4 h HIS 501 CO -0.01 1.06 0.44 1.96 0.86 0.00 0.00 177.93 182.24 2bj4 h GLN 502 N 0.95 0.85 -0.19 2.45 4.20 -1.34 -1.85 115.11 120.18 2bj4 h GLN 502 Ca 0.15 -0.05 -0.21 0.00 0.06 0.00 0.00 58.65 58.60 2bj4 h GLN 502 Cb 0.64 -0.19 0.01 0.00 0.30 0.00 0.00 27.48 28.23 2bj4 h GLN 502 CO 0.04 0.56 -0.72 -0.09 -0.67 0.00 0.00 178.83 177.96 2bj4 h ARG 503 N 0.87 0.81 -0.58 1.46 2.43 -0.88 -1.16 114.38 117.33 2bj4 h ARG 503 Ca 0.27 -0.62 0.11 0.00 -0.81 0.00 0.00 59.98 58.93 2bj4 h ARG 503 Cb -0.03 0.11 -0.08 0.00 -0.42 0.00 0.00 29.97 29.55 2bj4 h ARG 503 CO -0.09 1.23 0.12 1.25 -1.51 0.00 0.00 179.97 180.98 2bj4 h LEU 504 N 0.57 0.00 -0.09 3.80 5.85 -1.00 -0.94 115.31 123.50 2bj4 h LEU 504 Ca -0.03 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2bj4 h LEU 504 Cb 1.34 0.15 -0.00 0.00 0.37 0.00 0.00 40.66 42.51 2bj4 h LEU 504 CO 0.15 0.01 0.04 0.00 -0.34 0.00 0.00 178.44 178.31 2bj4 h ALA 505 N 1.46 0.11 -0.45 1.25 0.00 -1.14 -1.66 119.26 118.83 2bj4 h ALA 505 Ca 0.30 -0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.23 2bj4 h ALA 505 Cb 0.44 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 2bj4 h ALA 505 CO -0.39 -0.33 0.02 1.96 0.00 0.00 0.00 179.25 180.52 2bj4 h GLN 506 N 0.02 0.14 -0.15 0.00 4.20 -0.88 -0.40 115.11 118.03 2bj4 h GLN 506 Ca 0.03 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.73 2bj4 h GLN 506 Cb 0.11 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2bj4 h GLN 506 CO -0.00 0.09 0.09 -0.07 -0.67 0.00 0.00 178.83 178.26 2bj4 h LEU 507 N 0.14 0.19 -0.89 1.46 3.38 -1.04 -3.01 115.31 115.53 2bj4 h LEU 507 Ca 0.23 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 58.01 2bj4 h LEU 507 Cb 0.32 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2bj4 h LEU 507 CO -0.36 0.20 -0.51 -0.07 0.09 0.00 0.00 178.44 177.80 2bj4 h LEU 508 N 0.16 0.13 -1.81 1.67 3.38 -0.96 -2.39 115.31 115.50 2bj4 h LEU 508 Ca 0.05 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2bj4 h LEU 508 Cb 0.05 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 2bj4 h LEU 508 CO -0.01 0.62 -0.15 -0.07 0.09 0.00 0.00 178.44 178.92 2bj4 h LEU 509 N 0.10 0.00 -1.57 1.67 3.38 -1.04 -2.00 115.31 115.85 2bj4 h LEU 509 Ca 0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2bj4 h LEU 509 Cb 0.93 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 2bj4 h LEU 509 CO 0.07 0.15 -0.23 0.40 0.09 0.00 0.00 178.44 178.92 2bj4 h ILE 510 N 0.00 1.07 0.00 1.22 2.04 -1.29 -2.77 117.51 117.78 2bj4 h ILE 510 Ca -0.00 -0.80 -0.03 0.00 1.00 0.00 0.00 64.86 65.03 2bj4 h ILE 510 Cb 0.32 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.83 2bj4 h ILE 510 CO 0.02 0.22 -0.12 -0.07 0.00 0.00 0.00 178.15 178.20 2bj4 h LEU 511 N 0.00 0.00 -0.61 1.44 3.38 -1.42 -0.98 115.31 117.11 2bj4 h LEU 511 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2bj4 h LEU 511 Cb 0.42 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2bj4 h LEU 511 CO 0.03 0.12 0.27 0.28 0.09 0.00 0.00 178.44 179.23 2bj4 h SER 512 N 0.00 0.81 -0.35 -0.43 0.02 -1.61 -1.30 113.55 110.69 2bj4 h SER 512 Ca -0.00 -0.15 -0.10 0.00 -0.84 0.00 0.00 61.79 60.70 2bj4 h SER 512 Cb 0.23 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.55 2bj4 h SER 512 CO 0.02 0.73 -0.12 -0.74 -1.14 0.00 0.00 176.83 175.58 2bj4 h HIS 513 N 0.84 0.88 -0.37 3.45 -0.00 -1.30 -1.88 115.15 116.77 2bj4 h HIS 513 Ca 0.21 -0.17 -0.09 0.00 -0.00 0.00 0.00 60.37 60.32 2bj4 h HIS 513 Cb 0.15 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.32 2bj4 h HIS 513 CO 0.00 0.87 -0.16 0.82 -0.00 0.00 0.00 177.93 179.47 2bj4 h ILE 514 N 0.72 1.26 0.12 6.26 2.04 -1.08 -1.66 117.51 125.17 2bj4 h ILE 514 Ca 0.12 -1.19 0.00 0.00 1.00 0.00 0.00 64.86 64.79 2bj4 h ILE 514 Cb 0.61 1.15 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 2bj4 h ILE 514 CO 0.04 0.40 -0.11 -0.09 0.00 0.00 0.00 178.15 178.39 2bj4 h ARG 515 N 0.60 -0.24 -0.50 2.37 9.65 -1.10 -1.56 114.38 123.61 2bj4 h ARG 515 Ca 0.10 0.02 0.08 0.00 -1.10 0.00 0.00 59.98 59.08 2bj4 h ARG 515 Cb 0.61 0.05 -0.07 0.00 -1.39 0.00 0.00 29.97 29.18 2bj4 h ARG 515 CO 0.04 -0.16 0.11 1.25 2.80 0.00 0.00 179.97 184.02 2bj4 h HIS 516 N -0.25 0.18 -0.63 2.20 2.76 -0.94 -0.17 115.15 118.30 2bj4 h HIS 516 Ca 0.00 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.17 2bj4 h HIS 516 Cb 0.23 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 29.16 2bj4 h HIS 516 CO -0.11 0.01 0.27 0.52 -1.30 0.00 0.00 177.93 177.32 2bj4 h MET 517 N 0.25 0.93 -0.50 5.26 2.86 -1.16 -1.28 114.93 121.30 2bj4 h MET 517 Ca 0.25 -0.16 -0.03 0.00 -2.06 0.00 0.00 59.70 57.70 2bj4 h MET 517 Cb 0.32 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 2bj4 h MET 517 CO -0.31 0.77 0.20 1.03 1.06 0.00 0.00 176.91 179.66 2bj4 h SER 518 N 0.88 0.70 -0.61 1.22 0.87 -0.89 0.86 113.55 116.58 2bj4 h SER 518 Ca 0.21 -0.17 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2bj4 h SER 518 Cb 0.17 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 2bj4 h SER 518 CO -0.02 0.68 0.39 0.78 -0.53 0.00 0.00 176.83 178.13 2bj4 h ASN 519 N 0.67 0.66 -0.72 6.23 -0.26 -0.78 0.12 115.58 121.50 2bj4 h ASN 519 Ca 0.17 -0.01 -0.07 0.00 -0.56 0.00 0.00 56.30 55.83 2bj4 h ASN 519 Cb 0.20 -0.15 -0.03 0.00 -1.06 0.00 0.00 38.32 37.28 2bj4 h ASN 519 CO -0.01 0.47 0.18 0.11 -1.06 0.00 0.00 177.43 177.12 2bj4 h LYS 520 N 0.79 1.14 -0.16 0.81 1.79 -1.00 -1.88 116.57 118.07 2bj4 h LYS 520 Ca 0.23 -0.27 0.01 0.00 -2.18 0.00 0.00 60.65 58.45 2bj4 h LYS 520 Cb -0.05 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.43 2bj4 h LYS 520 CO -0.07 1.00 0.06 0.78 -1.08 0.00 0.00 179.45 180.14 2bj4 h GLY 521 N 1.09 0.20 0.89 3.86 0.00 -0.33 -2.16 103.07 106.62 2bj4 h GLY 521 Ca 0.23 -0.04 0.03 0.00 0.00 0.00 0.00 47.33 47.54 2bj4 h GLY 521 CO 0.00 0.03 0.51 -0.33 0.00 0.00 0.00 176.54 176.76 2bj4 h MET 522 N 0.15 0.98 -0.36 4.80 2.86 -0.71 0.10 114.93 122.74 2bj4 h MET 522 Ca 0.07 -0.06 0.02 0.00 -2.06 0.00 0.00 59.70 57.67 2bj4 h MET 522 Cb 0.03 -0.22 -0.03 0.00 0.06 0.00 0.00 31.60 31.44 2bj4 h MET 522 CO -0.06 0.65 0.19 0.93 1.06 0.00 0.00 176.91 179.68 2bj4 h GLU 523 N 1.00 0.39 -0.01 1.72 5.08 -1.22 -1.37 114.58 120.18 2bj4 h GLU 523 Ca 0.32 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.65 2bj4 h GLU 523 Cb -0.00 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 2bj4 h GLU 523 CO -0.11 0.26 0.00 1.25 -1.00 0.00 0.00 179.01 179.41 2bj4 h HIS 524 N 0.40 0.01 -0.76 4.33 2.76 -0.97 -1.54 115.15 119.37 2bj4 h HIS 524 Ca 0.15 0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.39 2bj4 h HIS 524 Cb 0.03 -0.00 -0.06 0.00 1.55 0.00 0.00 27.41 28.93 2bj4 h HIS 524 CO -0.09 0.04 0.43 -0.07 -1.30 0.00 0.00 177.93 176.95 2bj4 h LEU 525 N -0.03 0.64 -0.00 0.26 3.38 -0.84 -2.19 115.31 116.52 2bj4 h LEU 525 Ca 0.00 0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2bj4 h LEU 525 Cb 0.04 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2bj4 h LEU 525 CO -0.00 0.39 0.00 0.22 0.09 0.00 0.00 178.44 179.14 2bj4 h TYR 526 N 0.77 0.00 -0.79 1.13 5.03 -1.20 -3.09 116.97 118.82 2bj4 h TYR 526 Ca 0.35 -0.00 0.17 0.00 2.58 0.00 0.00 58.73 61.84 2bj4 h TYR 526 Cb 0.27 -0.00 -0.11 0.00 1.55 0.00 0.00 36.73 38.44 2bj4 h TYR 526 CO -0.07 0.24 0.26 0.66 -1.32 0.00 0.00 178.16 177.94 2bj4 h SER 527 N -0.24 0.16 -0.02 -2.11 4.64 -0.94 -3.51 113.55 111.53 2bj4 h SER 527 Ca 0.00 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2bj4 h SER 527 Cb 0.24 0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2bj4 h SER 527 CO 0.00 0.00 0.00 1.15 -0.87 0.00 0.00 176.83 177.11