#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jqe h GLU 312 N 0.00 0.31 -6.48 0.03 4.81 -2.06 -3.42 114.58 107.77 2jqe h GLU 312 Ca 0.00 -0.02 -0.53 0.00 -0.13 0.00 0.00 59.36 58.68 2jqe h GLU 312 Cb 0.00 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 2jqe h GLU 312 CO 0.00 0.21 -0.09 0.15 -0.73 0.00 0.00 179.01 178.55 2jqe s LYS 313 N -5.31 3.81 0.00 1.92 1.02 -1.26 -4.17 119.74 115.74 2jqe s LYS 313 Ca -0.07 0.30 0.00 0.00 0.02 0.00 0.00 55.97 56.22 2jqe s LYS 313 Cb 0.19 -2.62 0.00 0.00 -0.52 0.00 0.00 37.83 34.88 2jqe s LYS 313 CO 0.73 0.28 0.00 0.41 -0.92 0.00 0.00 175.35 175.85 2jqe n GLY 314 N -0.25 2.72 3.58 -3.33 0.00 -1.26 -4.99 105.19 101.66 2jqe n GLY 314 Ca 0.01 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 2jqe n GLY 314 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2jqe s THR 315 N -2.52 3.37 -0.95 2.61 -1.32 -1.26 -4.15 115.64 111.42 2jqe s THR 315 Ca 0.00 -0.63 -0.11 0.00 -1.21 0.00 0.00 61.69 59.73 2jqe s THR 315 Cb 0.00 -4.39 0.01 0.00 -1.51 0.00 0.00 72.50 66.61 2jqe s THR 315 CO 0.00 -0.67 0.63 0.49 -2.21 0.00 0.00 174.62 172.86 2jqe n PHE 316 N 16.25 -1.85 0.00 9.09 3.72 -1.26 -4.92 117.46 138.49 2jqe n PHE 316 Ca 0.44 0.59 0.00 0.00 -0.05 0.00 0.00 57.45 58.43 2jqe n PHE 316 Cb 0.47 -2.82 0.00 0.00 -0.94 0.00 0.00 39.48 36.19 2jqe n PHE 316 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2jqe n THR 317 N -3.41 0.00 0.00 4.37 -2.24 -1.26 -4.87 114.28 106.88 2jqe n THR 317 Ca -0.24 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 2jqe n THR 317 Cb 0.65 -0.83 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 2jqe n THR 317 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2jqe n LEU 318 N 0.00 0.00 0.21 3.22 4.77 -1.25 -4.78 117.00 119.17 2jqe n LEU 318 Ca 0.00 -0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.12 2jqe n LEU 318 Cb 0.00 0.00 0.75 0.00 -2.33 0.00 0.00 43.42 41.84 2jqe n LEU 318 CO 0.00 0.00 0.92 0.50 -1.33 0.00 0.00 177.39 177.48 2jqe h LYS 319 N 0.00 0.00 0.00 3.23 3.64 -1.89 0.11 116.57 121.66 2jqe h LYS 319 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jqe h LYS 319 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2jqe h LYS 319 CO 0.00 0.00 0.00 0.22 -2.27 0.00 0.00 179.45 177.40 2jqe h ASP 320 N 0.00 0.00 0.51 4.20 3.58 -1.89 -3.14 116.42 119.67 2jqe h ASP 320 Ca 0.00 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.16 2jqe h ASP 320 Cb 0.01 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.08 2jqe h ASP 320 CO 0.00 0.00 -1.27 0.40 -2.88 0.00 0.00 179.24 175.49 2jqe h ILE 321 N 0.00 1.44 -0.64 2.25 2.04 -1.12 -3.33 117.51 118.14 2jqe h ILE 321 Ca 0.00 -2.91 0.01 0.00 1.00 0.00 0.00 64.86 62.96 2jqe h ILE 321 Cb 0.74 2.92 -0.03 0.00 -0.74 0.00 0.00 36.82 39.70 2jqe h ILE 321 CO 0.00 0.86 0.42 0.22 0.00 0.00 0.00 178.15 179.65 2jqe h TYR 322 N 0.11 0.80 -0.81 1.37 3.20 -1.60 -2.31 116.97 117.73 2jqe h TYR 322 Ca -0.16 0.02 0.17 0.00 3.14 0.00 0.00 58.73 61.90 2jqe h TYR 322 Cb 1.98 -0.27 -0.06 0.00 1.54 0.00 0.00 36.73 39.93 2jqe h TYR 322 CO 0.08 0.50 0.54 -0.22 -1.64 0.00 0.00 178.16 177.42 2jqe h LYS 323 N 0.86 0.40 -0.33 1.82 3.64 -1.67 -0.35 116.57 120.94 2jqe h LYS 323 Ca 0.24 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.53 2jqe h LYS 323 Cb -0.09 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 2jqe h LYS 323 CO -0.06 0.27 -0.05 0.37 -2.27 0.00 0.00 179.45 177.71 2jqe h GLN 324 N 0.41 0.54 0.00 1.90 5.75 -1.56 -2.66 115.11 119.49 2jqe h GLN 324 Ca 0.41 -0.13 0.00 0.00 -0.15 0.00 0.00 58.65 58.77 2jqe h GLN 324 Cb 0.97 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.45 2jqe h GLN 324 CO -0.14 0.60 -0.42 0.82 -2.65 0.00 0.00 178.83 177.05 2jqe h ILE 325 N 0.51 0.00 -1.00 2.39 2.04 -1.12 -3.33 117.51 116.99 2jqe h ILE 325 Ca 0.10 -0.62 0.24 0.00 1.00 0.00 0.00 64.86 65.59 2jqe h ILE 325 Cb 0.41 1.36 -0.09 0.00 -0.74 0.00 0.00 36.82 37.76 2jqe h ILE 325 CO 0.02 0.00 0.65 -0.08 0.00 0.00 0.00 178.15 178.74 2jqe h GLU 326 N 0.00 0.41 0.00 2.37 4.81 -1.03 0.53 114.58 121.67 2jqe h GLU 326 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2jqe h GLU 326 Cb 0.81 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.10 2jqe h GLU 326 CO 0.00 0.27 0.00 0.00 -0.73 0.00 0.00 179.01 178.55 2jqe n ALA 327 N -2.48 1.56 -3.78 2.92 0.00 -1.25 -4.87 120.51 112.60 2jqe n ALA 327 Ca 0.23 0.03 -0.25 0.00 0.00 0.00 0.00 53.44 53.45 2jqe n ALA 327 Cb 0.81 -1.28 0.03 0.00 0.00 0.00 0.00 19.45 19.01 2jqe n ALA 327 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2jqe n MET 328 N -1.84 -5.46 -1.52 0.00 2.81 0.18 -4.57 117.12 106.72 2jqe n MET 328 Ca 0.02 0.63 0.10 0.00 -1.81 0.00 0.00 57.70 56.65 2jqe n MET 328 Cb 0.17 -5.39 -0.06 0.00 -0.71 0.00 0.00 33.22 27.23 2jqe n MET 328 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2jqe n ASN 329 N -2.96 -8.22 -4.27 7.83 4.13 -1.26 -4.91 115.26 105.61 2jqe n ASN 329 Ca -0.13 1.67 -0.30 0.00 1.68 0.00 0.00 54.58 57.50 2jqe n ASN 329 Cb 0.60 -5.10 0.17 0.00 -1.54 0.00 0.00 39.78 33.91 2jqe n ASN 329 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2jqe s LYS 330 N -4.80 0.75 0.30 3.52 -0.14 -1.26 -4.90 119.74 113.20 2jqe s LYS 330 Ca 0.00 -0.27 0.00 0.00 -1.36 0.00 0.00 55.97 54.34 2jqe s LYS 330 Cb 0.00 -1.85 0.00 0.00 -1.68 0.00 0.00 37.83 34.30 2jqe s LYS 330 CO 0.00 -2.36 0.00 -1.33 -0.76 0.00 0.00 175.35 170.90 2jqe n MET 331 N -3.76 -2.26 -2.91 1.68 2.81 -1.26 -4.89 117.12 106.53 2jqe n MET 331 Ca 0.13 1.57 -0.21 0.00 -1.81 0.00 0.00 57.70 57.39 2jqe n MET 331 Cb 0.60 -2.78 0.07 0.00 -0.71 0.00 0.00 33.22 30.39 2jqe n MET 331 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2jqe s GLY 332 N -5.84 1.75 0.54 3.03 0.00 -1.26 -4.98 107.32 100.56 2jqe s GLY 332 Ca 0.00 -2.00 0.32 0.00 0.00 0.00 0.00 44.72 43.03 2jqe s GLY 332 CO 0.00 -1.53 2.05 -0.56 0.00 0.00 0.00 173.10 173.07 2jqe h PRO 333 N 0.00 0.00 -4.79 2.90 0.13 -1.96 -3.42 132.00 124.86 2jqe h PRO 333 Ca -0.32 0.00 -0.40 0.00 -0.87 0.00 0.00 66.00 64.41 2jqe h PRO 333 Cb 1.28 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.13 2jqe h PRO 333 CO 0.41 0.08 -0.78 0.54 -0.23 0.00 0.00 178.00 178.02 2jqe s VAL 334 N -3.93 0.76 -0.02 1.56 0.11 -1.26 -5.05 120.40 112.57 2jqe s VAL 334 Ca -0.01 -0.43 -0.01 0.00 -2.93 0.00 0.00 61.98 58.60 2jqe s VAL 334 Cb 0.11 -0.64 -0.01 0.00 -1.53 0.00 0.00 36.38 34.31 2jqe s VAL 334 CO 0.55 0.20 -0.04 -1.14 -3.33 0.00 0.00 175.10 171.35 2jqe n ARG 335 N 2.81 0.06 -3.15 1.54 3.00 -1.26 -5.08 116.66 114.58 2jqe n ARG 335 Ca -0.14 0.03 -0.03 0.00 -0.00 0.00 0.00 57.85 57.71 2jqe n ARG 335 Cb 0.57 -0.60 0.00 0.00 0.00 0.00 0.00 32.46 32.43 2jqe n ARG 335 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2jqe n LYS 336 N -3.19 -1.35 -0.04 -0.14 5.02 -1.26 -4.83 118.16 112.36 2jqe n LYS 336 Ca -0.05 1.40 0.20 0.00 -2.02 0.00 0.00 58.31 57.84 2jqe n LYS 336 Cb 0.47 -5.35 0.66 0.00 -0.02 0.00 0.00 35.03 30.80 2jqe n LYS 336 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2jqe h ILE 337 N 0.35 0.73 -3.01 -0.18 2.04 -2.06 -3.40 117.51 111.97 2jqe h ILE 337 Ca -0.08 -0.02 -0.62 0.00 1.00 0.00 0.00 64.86 65.14 2jqe h ILE 337 Cb 1.05 0.66 -0.12 0.00 -0.74 0.00 0.00 36.82 37.68 2jqe h ILE 337 CO 0.31 0.01 -0.66 0.72 0.00 0.00 0.00 178.15 178.53 2jqe s PHE 338 N -5.07 2.87 -0.00 1.37 -0.71 -1.26 -5.12 117.98 110.05 2jqe s PHE 338 Ca -0.05 -0.12 0.00 0.00 -1.04 0.00 0.00 56.93 55.72 2jqe s PHE 338 Cb 0.20 -1.41 -0.04 0.00 -1.21 0.00 0.00 43.02 40.56 2jqe s PHE 338 CO 0.74 0.50 0.06 -2.00 -1.34 0.00 0.00 175.22 173.18 2jqe s GLU 339 N -2.77 2.99 -0.09 1.99 2.56 -1.26 -5.11 118.70 117.00 2jqe s GLU 339 Ca 0.27 -0.52 -0.02 0.00 0.00 0.00 0.00 54.97 54.70 2jqe s GLU 339 Cb -0.10 -2.81 -0.03 0.00 2.00 0.00 0.00 34.13 33.19 2jqe s GLU 339 CO 0.18 0.64 0.00 0.00 -0.56 0.00 0.00 175.26 175.53 2jqe s MET 340 N -1.69 3.07 -0.07 4.30 0.23 -1.26 -5.02 119.30 118.86 2jqe s MET 340 Ca 0.22 -0.41 -0.06 0.00 -1.03 0.00 0.00 55.69 54.41 2jqe s MET 340 Cb -0.12 -2.82 -0.04 0.00 -1.53 0.00 0.00 34.83 30.32 2jqe s MET 340 CO 0.13 0.65 -0.14 1.28 -2.03 0.00 0.00 175.02 174.92 2jqe n LEU 341 N 2.29 0.97 0.12 0.18 4.77 -1.26 -4.75 117.00 119.33 2jqe n LEU 341 Ca -0.18 0.16 0.10 0.00 -0.03 0.00 0.00 56.01 56.05 2jqe n LEU 341 Cb 0.53 -0.37 0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2jqe n LEU 341 CO 0.29 -0.03 0.17 1.55 -1.33 0.00 0.00 177.39 178.03 2jqe h PRO 342 N -0.38 0.00 -6.02 3.23 0.13 -2.07 -3.45 132.00 123.44 2jqe h PRO 342 Ca -0.18 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.36 2jqe h PRO 342 Cb 0.96 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.02 2jqe h PRO 342 CO -0.11 0.05 0.69 -0.06 -0.23 0.00 0.00 178.00 178.33 2jqe s PHE 343 N -3.28 3.28 -0.21 1.56 0.08 -1.26 -4.88 117.98 113.27 2jqe s PHE 343 Ca 0.01 1.26 0.14 0.00 0.12 0.00 0.00 56.93 58.46 2jqe s PHE 343 Cb 0.08 -3.30 0.45 0.00 -0.57 0.00 0.00 43.02 39.69 2jqe s PHE 343 CO 0.77 -0.53 1.34 0.41 -0.10 0.00 0.00 175.22 177.11 2jqe n GLY 344 N 3.64 4.68 3.78 4.36 0.00 -1.26 -4.92 105.19 115.46 2jqe n GLY 344 Ca 0.10 -1.16 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 2jqe n GLY 344 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jqe s LEU 345 N -3.04 3.90 0.00 0.99 2.01 -1.26 -5.04 118.68 116.24 2jqe s LEU 345 Ca 0.40 2.10 0.00 0.00 0.01 0.00 0.00 54.13 56.64 2jqe s LEU 345 Cb 0.35 -4.44 0.00 0.00 0.01 0.00 0.00 46.19 42.11 2jqe s LEU 345 CO 0.02 -0.89 0.00 0.61 1.01 0.00 0.00 176.35 177.10 2jqe n GLY 346 N 0.11 -2.02 3.47 -3.19 0.00 -1.26 -4.87 105.19 97.43 2jqe n GLY 346 Ca 0.09 -0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 2jqe n GLY 346 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jqe s LEU 347 N 0.00 3.30 0.00 0.99 1.43 -1.26 -4.84 118.68 118.30 2jqe s LEU 347 Ca 0.00 -0.17 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 2jqe s LEU 347 Cb 0.00 -1.83 0.00 0.00 0.03 0.00 0.00 46.19 44.39 2jqe s LEU 347 CO 0.00 0.09 0.00 2.29 0.23 0.00 0.00 176.35 178.96 2jqe n LYS 348 N 4.08 0.00 -2.77 1.70 0.00 -1.26 -2.24 118.16 117.68 2jqe n LYS 348 Ca -0.17 0.00 -0.20 0.00 -0.00 0.00 0.00 58.31 57.94 2jqe n LYS 348 Cb 0.52 0.00 0.02 0.00 -0.00 0.00 0.00 35.03 35.57 2jqe n LYS 348 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.40 178.95 2jqe n VAL 349 N -0.01 -2.43 0.00 0.58 3.14 -1.26 -3.54 118.33 114.80 2jqe n VAL 349 Ca 0.00 0.16 0.00 0.00 -2.96 0.00 0.00 64.34 61.54 2jqe n VAL 349 Cb 0.00 -2.51 0.00 0.00 -1.06 0.00 0.00 33.84 30.27 2jqe n VAL 349 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2jqe n ASP 350 N 0.52 0.00 -3.99 6.55 2.03 -0.95 -4.57 116.55 116.14 2jqe n ASP 350 Ca -0.05 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.19 2jqe n ASP 350 Cb 0.47 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.78 2jqe n ASP 350 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2jqe s ASN 351 N -4.00 0.31 0.00 1.67 2.47 -1.23 -4.61 114.94 109.55 2jqe s ASN 351 Ca 0.00 -0.85 0.00 0.00 0.42 0.00 0.00 52.86 52.43 2jqe s ASN 351 Cb 0.00 0.27 0.00 0.00 -1.45 0.00 0.00 41.25 40.07 2jqe s ASN 351 CO 0.00 -0.67 0.00 -0.67 -3.72 0.00 0.00 177.10 172.04 2jqe n ASP 352 N 0.02 0.00 0.19 -4.21 2.03 -1.26 -4.95 116.55 108.37 2jqe n ASP 352 Ca -0.14 0.00 0.06 0.00 0.52 0.00 0.00 54.79 55.23 2jqe n ASP 352 Cb 0.62 0.05 0.32 0.00 -0.72 0.00 0.00 41.12 41.39 2jqe n ASP 352 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 2jqe h VAL 353 N 0.00 0.78 -1.65 5.18 -1.51 -1.96 -3.43 116.25 113.66 2jqe h VAL 353 Ca 0.00 -1.51 0.09 0.00 -1.23 0.00 0.00 66.70 64.05 2jqe h VAL 353 Cb 0.00 1.96 -0.21 0.00 -2.13 0.00 0.00 31.29 30.91 2jqe h VAL 353 CO 0.00 0.34 -0.14 0.00 -1.23 0.00 0.00 177.57 176.55 2jqe s MET 354 N -3.52 0.55 0.31 5.19 0.23 -1.26 -5.03 119.30 115.77 2jqe s MET 354 Ca 0.01 1.28 0.01 0.00 -1.03 0.00 0.00 55.69 55.95 2jqe s MET 354 Cb 0.10 0.76 0.52 0.00 -1.53 0.00 0.00 34.83 34.68 2jqe s MET 354 CO 0.68 -0.30 1.89 1.49 -2.03 0.00 0.00 175.02 176.75 2jqe h GLU 355 N 7.97 0.76 -5.41 3.16 4.81 -1.97 -3.42 114.58 120.49 2jqe h GLU 355 Ca -0.19 -0.12 -0.64 0.00 -0.13 0.00 0.00 59.36 58.28 2jqe h GLU 355 Cb 1.12 -0.13 -0.32 0.00 0.63 0.00 0.00 28.75 30.04 2jqe h GLU 355 CO 0.14 0.64 -0.87 1.41 -0.73 0.00 0.00 179.01 179.60 2jqe s MET 356 N -5.32 2.51 -0.07 1.92 1.75 -1.26 -5.07 119.30 113.77 2jqe s MET 356 Ca -0.09 -0.78 0.03 0.00 -1.25 0.00 0.00 55.69 53.60 2jqe s MET 356 Cb 0.16 -2.01 0.01 0.00 2.84 0.00 0.00 34.83 35.83 2jqe s MET 356 CO 0.78 0.22 -0.16 0.99 -0.65 0.00 0.00 175.02 176.20 2jqe s THR 357 N 0.20 1.44 0.05 10.11 2.01 -1.26 -5.13 115.64 123.05 2jqe s THR 357 Ca -0.12 -0.67 -0.01 0.00 0.31 0.00 0.00 61.69 61.20 2jqe s THR 357 Cb -0.15 -1.27 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 2jqe s THR 357 CO 0.06 0.42 -0.03 -1.10 -0.69 0.00 0.00 174.62 173.28 2jqe s GLN 358 N 0.46 0.59 -0.18 4.92 -0.21 -1.26 -5.14 119.66 118.82 2jqe s GLN 358 Ca -0.14 -1.17 -0.08 0.00 0.02 0.00 0.00 55.36 54.00 2jqe s GLN 358 Cb -0.16 0.20 -0.04 0.00 1.00 0.00 0.00 33.01 34.01 2jqe s GLN 358 CO 0.05 -0.10 0.07 -1.21 -2.12 0.00 0.00 175.29 171.98 2jqe s GLU 359 N -3.70 4.01 -0.10 2.91 8.01 -1.26 -5.02 118.70 123.55 2jqe s GLU 359 Ca 0.05 -0.32 -0.06 0.00 0.01 0.00 0.00 54.97 54.65 2jqe s GLU 359 Cb 0.06 -3.24 -0.02 0.00 -4.31 0.00 0.00 34.13 26.62 2jqe s GLU 359 CO -0.09 0.29 -0.12 -0.22 0.01 0.00 0.00 175.26 175.12 2jqe h LYS 360 N 6.66 0.00 0.00 1.61 1.63 -2.01 -3.36 116.57 121.11 2jqe h LYS 360 Ca -0.38 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.36 2jqe h LYS 360 Cb 1.16 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.79 2jqe h LYS 360 CO 0.71 0.00 -0.29 0.00 -3.45 0.00 0.00 179.45 176.43 2jqe h MET 361 N -0.70 0.00 0.13 1.90 -0.00 -1.99 -3.05 114.93 111.22 2jqe h MET 361 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2jqe h MET 361 Cb 0.34 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.94 2jqe h MET 361 CO 0.00 0.29 -0.09 -0.22 -0.00 0.00 0.00 176.91 176.89 2jqe h LYS 362 N 0.00 -0.21 -0.13 -0.10 3.64 -1.94 -2.49 116.57 115.34 2jqe h LYS 362 Ca -0.00 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 2jqe h LYS 362 Cb 0.52 0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 2jqe h LYS 362 CO 0.04 -0.14 -0.19 0.87 -2.27 0.00 0.00 179.45 177.76 2jqe h LYS 363 N -0.22 0.22 -0.61 1.90 1.57 -1.69 -3.02 116.57 114.71 2jqe h LYS 363 Ca -0.01 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.73 2jqe h LYS 363 Cb 0.19 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 2jqe h LYS 363 CO 0.00 0.41 0.39 0.74 -0.57 0.00 0.00 179.45 180.42 2jqe h PHE 364 N 0.20 0.74 -0.93 -1.35 0.04 -1.34 -1.29 116.94 113.01 2jqe h PHE 364 Ca 0.04 0.02 0.10 0.00 2.80 0.00 0.00 57.97 60.93 2jqe h PHE 364 Cb 0.46 -0.25 -0.07 0.00 2.20 0.00 0.00 35.95 38.29 2jqe h PHE 364 CO 0.01 0.45 0.59 -0.09 -0.60 0.00 0.00 178.31 178.67 2jqe h ARG 365 N 0.79 0.89 -0.06 1.51 2.43 -1.38 -2.08 114.38 116.48 2jqe h ARG 365 Ca 0.24 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 2jqe h ARG 365 Cb -0.04 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.31 2jqe h ARG 365 CO -0.07 0.59 0.00 0.28 -1.51 0.00 0.00 179.97 179.26 2jqe h VAL 366 N 0.92 1.25 -0.20 0.20 2.07 -1.35 -2.99 116.25 116.14 2jqe h VAL 366 Ca 0.44 -0.76 0.06 0.00 0.82 0.00 0.00 66.70 67.26 2jqe h VAL 366 Cb 0.43 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.83 2jqe h VAL 366 CO -0.20 0.21 0.75 0.40 0.02 0.00 0.00 177.57 178.76 2jqe h ILE 367 N -0.17 0.04 -0.76 4.57 2.04 -0.57 -2.59 117.51 120.08 2jqe h ILE 367 Ca 0.02 0.00 0.15 0.00 1.00 0.00 0.00 64.86 66.03 2jqe h ILE 367 Cb 0.33 0.29 -0.14 0.00 -0.74 0.00 0.00 36.82 36.56 2jqe h ILE 367 CO 0.00 0.00 -0.19 -0.03 0.00 0.00 0.00 178.15 177.93 2jqe h MET 368 N 0.00 -0.00 0.03 2.37 4.05 -1.53 0.18 114.93 120.02 2jqe h MET 368 Ca 0.10 0.00 -0.21 0.00 -0.28 0.00 0.00 59.70 59.30 2jqe h MET 368 Cb 1.60 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.39 2jqe h MET 368 CO -0.00 -0.00 -0.96 0.38 0.23 0.00 0.00 176.91 176.56 2jqe h ASP 369 N -0.00 0.26 -0.63 1.39 3.04 -1.72 -3.18 116.42 115.58 2jqe h ASP 369 Ca 0.36 -0.23 0.04 0.00 -3.24 0.00 0.00 57.03 53.96 2jqe h ASP 369 Cb 0.55 -0.08 -0.04 0.00 -1.04 0.00 0.00 39.33 38.73 2jqe h ASP 369 CO -0.78 1.08 0.42 0.28 -2.04 0.00 0.00 179.24 178.19 2jqe h SER 370 N 0.09 0.63 -1.83 4.15 0.02 -0.90 -3.42 113.55 112.29 2jqe h SER 370 Ca -0.06 -0.01 -0.49 0.00 -0.84 0.00 0.00 61.79 60.39 2jqe h SER 370 Cb 1.62 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 63.99 2jqe h SER 370 CO 0.15 0.43 -0.44 -0.32 -1.14 0.00 0.00 176.83 175.50 2jqe s MET 371 N -5.64 2.72 0.02 3.45 -2.45 0.30 -4.67 119.30 113.04 2jqe s MET 371 Ca -0.09 -1.30 0.04 0.00 -1.25 0.00 0.00 55.69 53.08 2jqe s MET 371 Cb 0.18 -2.48 -0.03 0.00 1.25 0.00 0.00 34.83 33.75 2jqe s MET 371 CO 0.76 0.08 -0.07 -0.08 1.05 0.00 0.00 175.02 176.76 2jqe s THR 372 N -2.31 3.61 0.27 10.11 -1.32 -1.26 -4.82 115.64 119.92 2jqe s THR 372 Ca 0.41 -0.85 -0.00 0.00 -1.21 0.00 0.00 61.69 60.04 2jqe s THR 372 Cb -0.06 -2.59 0.26 0.00 -1.51 0.00 0.00 72.50 68.61 2jqe s THR 372 CO 0.27 0.35 1.70 1.05 -2.21 0.00 0.00 174.62 175.77 2jqe h GLU 373 N 4.37 0.36 -0.89 7.08 4.11 -1.97 0.46 114.58 128.10 2jqe h GLU 373 Ca -0.48 -0.02 0.18 0.00 0.07 0.00 0.00 59.36 59.11 2jqe h GLU 373 Cb 1.17 -0.08 -0.07 0.00 0.50 0.00 0.00 28.75 30.27 2jqe h GLU 373 CO 0.54 0.24 0.58 0.93 0.07 0.00 0.00 179.01 181.36 2jqe h GLU 374 N 0.37 0.48 -0.51 1.06 5.08 -1.97 0.29 114.58 119.37 2jqe h GLU 374 Ca 0.49 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.70 2jqe h GLU 374 Cb 0.88 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 2jqe h GLU 374 CO -0.51 0.32 -0.17 0.93 -1.00 0.00 0.00 179.01 178.58 2jqe h GLU 375 N 0.50 1.02 -0.22 2.33 5.08 -0.33 -1.90 114.58 121.06 2jqe h GLU 375 Ca 0.46 -0.41 -0.04 0.00 -1.00 0.00 0.00 59.36 58.36 2jqe h GLU 375 Cb 1.01 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.20 2jqe h GLU 375 CO -0.19 1.10 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.82 2jqe h LEU 376 N 0.89 0.41 -1.29 1.33 3.38 -0.11 -2.94 115.31 116.98 2jqe h LEU 376 Ca 0.12 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 2jqe h LEU 376 Cb 0.75 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2jqe h LEU 376 CO 0.06 0.66 -0.06 -0.07 0.09 0.00 0.00 178.44 179.11 2jqe h LEU 377 N 0.16 0.38 -7.15 1.67 4.07 -1.11 -3.32 115.31 110.01 2jqe h LEU 377 Ca 0.06 -0.08 -0.62 0.00 0.08 0.00 0.00 57.88 57.32 2jqe h LEU 377 Cb 0.46 -0.10 -0.41 0.00 1.08 0.00 0.00 40.66 41.70 2jqe h LEU 377 CO 0.02 0.49 -0.69 0.20 -1.08 0.00 0.00 178.44 177.38 2jqe s ASN 378 N -6.80 3.95 0.28 -0.43 -0.87 -0.72 -4.85 114.94 105.51 2jqe s ASN 378 Ca -0.07 -2.86 0.00 0.00 -1.57 0.00 0.00 52.86 48.37 2jqe s ASN 378 Cb 0.15 -1.31 0.39 0.00 -0.02 0.00 0.00 41.25 40.46 2jqe s ASN 378 CO 0.75 -0.24 1.75 1.55 -2.57 0.00 0.00 177.10 178.34 2jqe h PRO 379 N 6.54 0.63 -0.12 -0.60 0.13 -1.67 -2.14 132.00 134.78 2jqe h PRO 379 Ca -0.03 -0.19 0.04 0.00 -0.87 0.00 0.00 66.00 64.94 2jqe h PRO 379 Cb 0.90 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 31.97 2jqe h PRO 379 CO 0.58 0.73 0.15 0.87 -0.23 0.00 0.00 178.00 180.10 2jqe h LYS 380 N 0.58 0.00 -0.86 0.86 1.79 -1.92 0.00 116.57 117.02 2jqe h LYS 380 Ca 0.10 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 2jqe h LYS 380 Cb 0.54 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.19 2jqe h LYS 380 CO 0.03 0.00 0.00 -0.89 -1.08 0.00 0.00 179.45 177.51 2jqe n ILE 381 N -3.77 0.64 -3.41 1.86 5.41 -0.80 -4.86 119.36 114.41 2jqe n ILE 381 Ca 0.00 -0.33 -0.31 0.00 1.00 0.00 0.00 62.75 63.11 2jqe n ILE 381 Cb 0.25 -0.42 -0.05 0.00 -0.71 0.00 0.00 39.64 38.72 2jqe n ILE 381 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 2jqe s ILE 382 N -1.44 4.98 0.05 1.39 2.07 -0.02 -4.98 121.20 123.25 2jqe s ILE 382 Ca 0.13 0.33 0.04 0.00 -1.41 0.00 0.00 60.65 59.74 2jqe s ILE 382 Cb 0.10 -3.65 -0.02 0.00 0.13 0.00 0.00 42.46 39.02 2jqe s ILE 382 CO 0.04 -0.13 -0.11 -0.62 -1.91 0.00 0.00 174.94 172.22 2jqe s ASP 383 N -2.57 1.23 0.33 4.50 2.15 -1.26 -5.02 116.67 116.04 2jqe s ASP 383 Ca 0.46 -0.54 0.06 0.00 0.43 0.00 0.00 52.55 52.96 2jqe s ASP 383 Cb -0.11 -0.02 0.71 0.00 -0.30 0.00 0.00 42.92 43.20 2jqe s ASP 383 CO 0.24 -0.12 1.87 -1.28 -0.17 0.00 0.00 175.17 175.71 2jqe h SER 384 N 4.56 0.76 -0.35 -0.34 0.87 -1.99 -0.76 113.55 116.29 2jqe h SER 384 Ca -0.37 0.04 -0.11 0.00 -1.23 0.00 0.00 61.79 60.11 2jqe h SER 384 Cb 1.20 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 63.03 2jqe h SER 384 CO 0.41 0.41 -0.22 0.28 -0.53 0.00 0.00 176.83 177.18 2jqe h SER 385 N 0.82 0.80 -0.11 6.23 0.02 -2.00 -2.17 113.55 117.15 2jqe h SER 385 Ca 0.44 -0.43 0.00 0.00 -0.84 0.00 0.00 61.79 60.97 2jqe h SER 385 Cb 0.56 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 2jqe h SER 385 CO -0.21 1.06 0.07 -0.09 -1.14 0.00 0.00 176.83 176.52 2jqe h ARG 386 N 0.55 0.14 0.00 3.45 9.65 -1.57 -2.26 114.38 124.34 2jqe h ARG 386 Ca 0.07 -0.01 -0.05 0.00 -1.10 0.00 0.00 59.98 58.89 2jqe h ARG 386 Cb 0.78 -0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.32 2jqe h ARG 386 CO 0.06 0.12 -0.23 0.97 2.80 0.00 0.00 179.97 183.69 2jqe h ILE 387 N 0.12 1.14 0.43 1.20 2.10 -1.32 -2.03 117.51 119.15 2jqe h ILE 387 Ca 0.04 -0.81 -0.01 0.00 1.08 0.00 0.00 64.86 65.16 2jqe h ILE 387 Cb 0.01 1.44 -0.02 0.00 -1.09 0.00 0.00 36.82 37.16 2jqe h ILE 387 CO -0.01 0.23 -0.44 -0.09 -1.08 0.00 0.00 178.15 176.76 2jqe h ARG 388 N 0.00 -0.83 -0.72 2.19 2.43 -0.79 0.54 114.38 117.20 2jqe h ARG 388 Ca -0.00 0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.29 2jqe h ARG 388 Cb 0.42 0.19 -0.06 0.00 -0.42 0.00 0.00 29.97 30.10 2jqe h ARG 388 CO 0.03 -0.56 0.41 -0.09 -1.51 0.00 0.00 179.97 178.25 2jqe h ARG 389 N -0.86 0.72 -0.21 0.20 2.43 -1.40 -0.59 114.38 114.67 2jqe h ARG 389 Ca -0.05 -0.04 0.03 0.00 -0.81 0.00 0.00 59.98 59.11 2jqe h ARG 389 Cb 0.75 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 2jqe h ARG 389 CO -0.06 0.48 0.01 0.82 -1.51 0.00 0.00 179.97 179.71 2jqe h ILE 390 N 0.74 0.87 -0.81 1.20 2.04 -0.82 1.26 117.51 121.99 2jqe h ILE 390 Ca 0.32 -0.03 0.10 0.00 1.00 0.00 0.00 64.86 66.26 2jqe h ILE 390 Cb 0.20 0.78 -0.08 0.00 -0.74 0.00 0.00 36.82 36.98 2jqe h ILE 390 CO -0.19 0.02 0.44 0.00 0.00 0.00 0.00 178.15 178.42 2jqe h ALA 391 N 1.17 1.15 -0.42 1.87 0.00 0.94 0.29 119.26 124.27 2jqe h ALA 391 Ca 0.10 0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.94 2jqe h ALA 391 Cb 0.11 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2jqe h ALA 391 CO -0.15 0.04 -0.20 0.82 0.00 0.00 0.00 179.25 179.75 2jqe h ILE 392 N 0.73 1.27 -0.15 0.00 2.04 0.48 1.83 117.51 123.70 2jqe h ILE 392 Ca 0.40 -1.32 -0.05 0.00 1.00 0.00 0.00 64.86 64.89 2jqe h ILE 392 Cb 0.41 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 2jqe h ILE 392 CO -0.27 0.45 -0.11 1.23 0.00 0.00 0.00 178.15 179.45 2jqe h GLY 393 N 0.95 0.37 1.52 5.37 0.00 0.32 -2.97 103.07 108.63 2jqe h GLY 393 Ca 0.10 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.07 2jqe h GLY 393 CO 0.06 0.32 -0.33 -1.14 0.00 0.00 0.00 176.54 175.45 2jqe n SER 394 N -4.59 0.65 -0.87 0.19 3.41 0.84 -4.90 113.62 108.33 2jqe n SER 394 Ca -0.06 0.28 -0.11 0.00 -0.26 0.00 0.00 58.87 58.71 2jqe n SER 394 Cb 0.33 -0.23 -0.05 0.00 -0.26 0.00 0.00 64.21 64.01 2jqe n SER 394 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jqe n GLY 395 N 1.36 1.23 0.02 5.00 0.00 0.61 -4.87 105.19 108.54 2jqe n GLY 395 Ca 0.05 -0.34 0.11 0.00 0.00 0.00 0.00 46.02 45.84 2jqe n GLY 395 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jqe n THR 396 N -2.58 0.00 0.00 2.61 -1.04 -0.55 -4.96 114.28 107.76 2jqe n THR 396 Ca -0.11 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 61.89 2jqe n THR 396 Cb 0.42 0.54 0.00 0.00 -1.82 0.00 0.00 70.33 69.47 2jqe n THR 396 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2jqe n SER 397 N -1.43 -0.85 0.14 8.00 7.64 -1.21 -3.98 113.62 121.93 2jqe n SER 397 Ca 0.05 0.00 0.09 0.00 1.01 0.00 0.00 58.87 60.02 2jqe n SER 397 Cb 0.34 0.78 0.59 0.00 -1.01 0.00 0.00 64.21 64.91 2jqe n SER 397 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2jqe h PRO 398 N 0.00 0.15 -1.00 1.43 0.13 -1.87 -1.04 132.00 129.81 2jqe h PRO 398 Ca 0.00 -0.01 0.08 0.00 -0.87 0.00 0.00 66.00 65.20 2jqe h PRO 398 Cb 0.00 -0.03 -0.07 0.00 0.13 0.00 0.00 31.00 31.02 2jqe h PRO 398 CO 0.00 0.10 0.64 1.96 -0.23 0.00 0.00 178.00 180.47 2jqe h GLN 399 N 0.16 1.09 -0.24 0.86 4.20 -1.95 0.46 115.11 119.70 2jqe h GLN 399 Ca 0.09 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.63 2jqe h GLN 399 Cb 0.16 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 2jqe h GLN 399 CO -0.01 0.72 -0.27 0.93 -0.67 0.00 0.00 178.83 179.52 2jqe h GLU 400 N 1.13 0.46 0.03 1.46 4.39 -1.31 0.44 114.58 121.17 2jqe h GLU 400 Ca 0.45 -0.18 -0.25 0.00 0.34 0.00 0.00 59.36 59.72 2jqe h GLU 400 Cb 0.25 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.85 2jqe h GLU 400 CO -0.20 0.70 -1.25 0.28 -1.16 0.00 0.00 179.01 177.38 2jqe h VAL 401 N 0.40 1.43 -0.55 3.13 2.07 -1.39 -2.03 116.25 119.31 2jqe h VAL 401 Ca 0.06 -3.15 -0.03 0.00 0.82 0.00 0.00 66.70 64.40 2jqe h VAL 401 Cb 0.69 2.75 -0.02 0.00 -1.52 0.00 0.00 31.29 33.19 2jqe h VAL 401 CO 0.05 0.84 0.22 0.50 0.02 0.00 0.00 177.57 179.20 2jqe h LYS 402 N 0.02 0.83 -0.28 1.57 3.64 0.21 -0.50 116.57 122.05 2jqe h LYS 402 Ca -0.11 -0.15 -0.07 0.00 -1.27 0.00 0.00 60.65 59.05 2jqe h LYS 402 Cb 1.88 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 33.55 2jqe h LYS 402 CO 0.13 0.72 -0.08 0.93 -2.27 0.00 0.00 179.45 178.87 2jqe h GLU 403 N 0.75 0.56 -0.73 1.90 5.08 -0.95 0.55 114.58 121.74 2jqe h GLU 403 Ca 0.18 -0.22 0.13 0.00 -1.00 0.00 0.00 59.36 58.45 2jqe h GLU 403 Cb 0.20 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.33 2jqe h GLU 403 CO -0.02 0.77 0.30 1.25 -1.00 0.00 0.00 179.01 180.31 2jqe h LEU 404 N 0.31 0.29 -0.39 1.33 5.85 -0.93 0.89 115.31 122.67 2jqe h LEU 404 Ca 0.07 0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.77 2jqe h LEU 404 Cb 0.57 0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.66 2jqe h LEU 404 CO 0.03 0.13 -0.21 0.25 -0.34 0.00 0.00 178.44 178.30 2jqe h LEU 405 N 0.46 0.86 -2.11 2.25 6.46 -0.90 -0.67 115.31 121.66 2jqe h LEU 405 Ca 0.39 -0.41 0.05 0.00 -0.12 0.00 0.00 57.88 57.79 2jqe h LEU 405 Cb 0.57 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.25 2jqe h LEU 405 CO -0.38 1.08 0.32 -1.13 -0.62 0.00 0.00 178.44 177.72 2jqe h ASN 406 N 0.64 0.00 0.22 1.25 -1.24 0.19 0.67 115.58 117.32 2jqe h ASN 406 Ca 0.09 0.00 -0.01 0.00 0.71 0.00 0.00 56.30 57.09 2jqe h ASN 406 Cb 0.77 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.81 2jqe h ASN 406 CO 0.06 0.00 -0.13 0.22 -1.29 0.00 0.00 177.43 176.30 2jqe h TYR 407 N 0.00 -0.32 -0.12 0.67 3.20 0.22 0.22 116.97 120.84 2jqe h TYR 407 Ca 0.08 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.98 2jqe h TYR 407 Cb 0.72 0.11 -0.00 0.00 1.54 0.00 0.00 36.73 39.10 2jqe h TYR 407 CO 0.00 -0.20 0.20 -0.92 -1.64 0.00 0.00 178.16 175.60 2jqe h TYR 408 N -0.33 0.00 -0.20 -3.82 3.20 -0.93 0.58 116.97 115.47 2jqe h TYR 408 Ca -0.03 0.00 0.05 0.00 3.14 0.00 0.00 58.73 61.90 2jqe h TYR 408 Cb 0.27 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 38.48 2jqe h TYR 408 CO -0.08 0.00 -0.17 -0.22 -1.64 0.00 0.00 178.16 176.05 2jqe h LYS 409 N 0.00 -0.18 -1.04 1.82 3.64 -0.42 0.53 116.57 120.93 2jqe h LYS 409 Ca 0.06 0.01 0.30 0.00 -1.27 0.00 0.00 60.65 59.75 2jqe h LYS 409 Cb 0.46 0.04 -0.13 0.00 -0.41 0.00 0.00 32.23 32.19 2jqe h LYS 409 CO -0.00 -0.12 0.62 1.15 -2.27 0.00 0.00 179.45 178.83 2jqe h THR 410 N -0.19 0.39 -0.94 1.00 2.02 0.46 1.43 112.91 117.09 2jqe h THR 410 Ca 0.12 -0.13 0.19 0.00 0.77 0.00 0.00 66.41 67.36 2jqe h THR 410 Cb 0.37 -0.04 -0.08 0.00 -1.74 0.00 0.00 68.15 66.66 2jqe h THR 410 CO -0.31 0.07 0.60 -0.03 0.37 0.00 0.00 175.52 176.23 2jqe h MET 411 N 0.39 0.54 -0.76 6.66 1.85 0.30 1.54 114.93 125.44 2jqe h MET 411 Ca 0.69 -0.03 0.16 0.00 -0.61 0.00 0.00 59.70 59.91 2jqe h MET 411 Cb 1.59 -0.12 -0.05 0.00 0.43 0.00 0.00 31.60 33.45 2jqe h MET 411 CO -0.50 0.36 0.51 0.87 -0.40 0.00 0.00 176.91 177.75 2jqe h LYS 412 N 0.55 0.38 -0.64 0.39 1.79 0.22 1.44 116.57 120.70 2jqe h LYS 412 Ca 0.50 -0.02 0.16 0.00 -2.18 0.00 0.00 60.65 59.11 2jqe h LYS 412 Cb 1.04 -0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 31.57 2jqe h LYS 412 CO -0.24 0.25 0.45 -0.97 -1.08 0.00 0.00 179.45 177.86 2jqe h ASN 413 N 0.39 0.12 -1.10 0.86 -1.24 0.22 0.75 115.58 115.58 2jqe h ASN 413 Ca 0.38 0.01 0.30 0.00 0.71 0.00 0.00 56.30 57.70 2jqe h ASN 413 Cb 0.91 -0.02 -0.08 0.00 0.73 0.00 0.00 38.32 39.86 2jqe h ASN 413 CO -0.12 0.06 0.73 0.25 -1.29 0.00 0.00 177.43 177.07 2jqe h LEU 414 N 0.13 0.31 -1.88 0.34 5.85 0.20 1.68 115.31 121.94 2jqe h LEU 414 Ca 0.31 0.07 0.08 0.00 0.84 0.00 0.00 57.88 59.18 2jqe h LEU 414 Cb 1.04 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 2jqe h LEU 414 CO -0.04 0.04 0.46 0.24 -0.34 0.00 0.00 178.44 178.79 2jqe h MET 415 N 0.26 0.00 -0.31 1.25 2.86 0.44 1.55 114.93 120.99 2jqe h MET 415 Ca 0.61 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 58.34 2jqe h MET 415 Cb 1.80 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.45 2jqe h MET 415 CO -0.23 0.00 0.27 -0.22 1.06 0.00 0.00 176.91 177.79 2jqe h LYS 416 N 0.00 0.00 -0.09 1.72 3.64 0.24 0.28 116.57 122.35 2jqe h LYS 416 Ca 0.13 0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.54 2jqe h LYS 416 Cb 1.04 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 2jqe h LYS 416 CO -0.00 0.00 0.38 -0.22 -2.27 0.00 0.00 179.45 177.34 2jqe h LYS 417 N 0.00 0.00 0.00 1.90 3.64 0.21 -3.39 116.57 118.93 2jqe h LYS 417 Ca 0.15 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 2jqe h LYS 417 Cb 0.69 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.51 2jqe h LYS 417 CO -0.00 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.18 2jqe n MET 418 N -3.06 2.08 -3.35 1.90 0.00 0.98 -4.76 117.12 110.90 2jqe n MET 418 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 57.70 57.53 2jqe n MET 418 Cb 0.45 0.00 0.07 0.00 0.00 0.00 0.00 33.22 33.75 2jqe n MET 418 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 2jqe n LYS 419 N 0.00 -3.61 -4.28 3.17 4.81 -1.26 -4.99 118.16 111.99 2jqe n LYS 419 Ca 0.00 0.82 -0.34 0.00 -0.87 0.00 0.00 58.31 57.92 2jqe n LYS 419 Cb 0.00 -5.70 -0.11 0.00 0.02 0.00 0.00 35.03 29.24 2jqe n LYS 419 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 2jqe s LYS 420 N -4.86 3.64 -0.36 1.64 1.02 -1.26 -5.08 119.74 114.47 2jqe s LYS 420 Ca 0.30 -0.45 -0.05 0.00 0.02 0.00 0.00 55.97 55.80 2jqe s LYS 420 Cb -0.05 -2.98 0.07 0.00 -0.52 0.00 0.00 37.83 34.35 2jqe s LYS 420 CO 0.75 0.34 0.13 -0.80 -0.92 0.00 0.00 175.35 174.85 2jqe s ASN 421 N 0.13 5.24 0.20 2.83 0.02 -1.26 -4.96 114.94 117.13 2jqe s ASN 421 Ca 0.01 -1.51 -0.11 0.00 -1.02 0.00 0.00 52.86 50.23 2jqe s ASN 421 Cb -0.13 -1.84 0.13 0.00 0.02 0.00 0.00 41.25 39.43 2jqe s ASN 421 CO 0.02 -0.41 1.83 0.50 0.02 0.00 0.00 177.10 179.05 2jqe h LYS 422 N 8.14 0.97 -0.87 -0.60 3.11 -2.06 -3.40 116.57 121.87 2jqe h LYS 422 Ca -0.19 -0.10 -0.14 0.00 -2.81 0.00 0.00 60.65 57.41 2jqe h LYS 422 Cb 1.07 -0.20 -0.16 0.00 -1.00 0.00 0.00 32.23 31.94 2jqe h LYS 422 CO 0.64 0.71 -0.45 -0.11 -2.81 0.00 0.00 179.45 177.43 2jqe n LEU 423 N -4.51 -3.25 0.00 5.20 0.00 -1.26 -5.05 117.00 108.13 2jqe n LEU 423 Ca 0.06 -2.75 -0.01 0.00 0.00 0.00 0.00 56.01 53.31 2jqe n LEU 423 Cb 0.07 0.74 -0.00 0.00 0.00 0.00 0.00 43.42 44.23 2jqe n LEU 423 CO 0.37 1.87 0.04 1.55 0.00 0.00 0.00 177.39 181.23 2jqe h PRO 424 N 4.87 -0.03 -0.02 1.96 0.13 -1.99 -3.57 132.00 133.35 2jqe h PRO 424 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 2jqe h PRO 424 Cb 1.11 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2jqe h PRO 424 CO 0.01 -0.02 0.00 -0.89 -0.23 0.00 0.00 178.00 176.87