#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 0.59 -5.86 0.03 4.81 -2.05 -3.41 114.58 108.69 2jqe h GLU 312 Ca 0.00 -0.04 -0.62 0.00 -0.13 0.00 0.00 59.36 58.58 2jqe h GLU 312 Cb 0.00 -0.13 -0.06 0.00 0.63 0.00 0.00 28.75 29.18 2jqe h GLU 312 CO 0.00 0.39 -0.27 0.15 -0.73 0.00 0.00 179.01 178.54 2jqe s LYS 313 N -5.54 3.86 -0.44 1.92 1.02 -1.26 -4.91 119.74 114.39 2jqe s LYS 313 Ca -0.09 0.26 0.09 0.00 0.02 0.00 0.00 55.97 56.25 2jqe s LYS 313 Cb 0.19 -3.24 0.40 0.00 -0.52 0.00 0.00 37.83 34.65 2jqe s LYS 313 CO 0.75 0.64 0.98 0.41 -0.92 0.00 0.00 175.35 177.22 2jqe n GLY 314 N 2.08 4.54 2.67 -3.33 0.00 -1.26 -5.03 105.19 104.86 2jqe n GLY 314 Ca -0.15 -2.28 0.00 0.00 0.00 0.00 0.00 46.02 43.59 2jqe n GLY 314 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2jqe n THR 315 N -0.22 -0.86 -3.40 2.61 5.66 -1.26 -3.85 114.28 112.96 2jqe n THR 315 Ca 0.28 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.96 2jqe n THR 315 Cb 0.63 -2.17 0.03 0.00 -1.55 0.00 0.00 70.33 67.28 2jqe n THR 315 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2jqe n PHE 316 N 2.34 -2.81 -0.41 1.09 3.72 -1.26 -4.89 117.46 115.24 2jqe n PHE 316 Ca 0.00 1.17 -0.18 0.00 -0.05 0.00 0.00 57.45 58.38 2jqe n PHE 316 Cb 0.00 -2.32 0.18 0.00 -0.94 0.00 0.00 39.48 36.40 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 -0.40 0.00 0.77 4.37 -2.24 -1.25 -4.87 114.28 110.66 2jqe n THR 317 Ca -0.06 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.84 2jqe n THR 317 Cb 0.64 -0.60 0.29 0.00 -2.10 0.00 0.00 70.33 68.57 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 0.55 0.31 3.22 4.32 -1.26 -3.44 117.00 120.70 2jqe n LEU 318 Ca 0.08 0.24 0.19 0.00 -0.02 0.00 0.00 56.01 56.51 2jqe n LEU 318 Cb 0.36 -0.27 1.02 0.00 -1.62 0.00 0.00 43.42 42.92 2jqe n LEU 318 CO 0.24 -0.01 1.12 0.50 -1.22 0.00 0.00 177.39 178.02 2jqe h LYS 319 N 0.00 0.00 0.00 3.23 3.64 -1.89 0.29 116.57 121.84 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 0.63 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 2jqe h LYS 319 CO 0.00 0.02 0.00 -0.44 -2.27 0.00 0.00 179.45 176.76 2jqe h ASP 320 N 0.00 0.00 0.16 4.20 3.32 -1.89 -3.31 116.42 118.90 2jqe h ASP 320 Ca -0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 2jqe h ASP 320 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2jqe h ASP 320 CO 0.00 0.00 -1.72 0.40 -1.72 0.00 0.00 179.24 176.20 2jqe h ILE 321 N 0.00 0.91 -0.72 0.35 2.04 -0.62 -3.37 117.51 116.11 2jqe h ILE 321 Ca 0.00 -2.46 -0.04 0.00 1.00 0.00 0.00 64.86 63.36 2jqe h ILE 321 Cb 0.75 2.71 -0.03 0.00 -0.74 0.00 0.00 36.82 39.51 2jqe h ILE 321 CO 0.00 0.83 0.27 1.88 0.00 0.00 0.00 178.15 181.13 2jqe h TYR 322 N 0.01 1.09 -0.49 1.37 0.05 -1.60 -2.74 116.97 114.66 2jqe h TYR 322 Ca -0.35 -0.08 0.02 0.00 0.05 0.00 0.00 58.73 58.37 2jqe h TYR 322 Cb 2.02 -0.33 -0.03 0.00 1.01 0.00 0.00 36.73 39.41 2jqe h TYR 322 CO 0.10 0.84 0.33 0.87 -1.05 0.00 0.00 178.16 179.25 2jqe h LYS 323 N 1.04 0.59 0.00 4.88 1.57 -1.73 -1.52 116.57 121.40 2jqe h LYS 323 Ca 0.24 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2jqe h LYS 323 Cb 0.22 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.40 2jqe h LYS 323 CO -0.02 0.39 -0.01 1.96 -0.57 0.00 0.00 179.45 181.21 2jqe h GLN 324 N 0.61 0.00 0.00 3.15 4.20 -1.64 -0.72 115.11 120.71 2jqe h GLN 324 Ca 0.19 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.90 2jqe h GLN 324 Cb 0.01 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.79 2jqe h GLN 324 CO -0.05 0.01 -0.11 0.82 -0.67 0.00 0.00 178.83 178.84 2jqe h ILE 325 N 0.00 0.00 -0.41 2.54 1.08 -1.38 -3.28 117.51 116.06 2jqe h ILE 325 Ca -0.00 -0.79 0.12 0.00 -0.39 0.00 0.00 64.86 63.80 2jqe h ILE 325 Cb 0.02 1.73 -0.02 0.00 -3.07 0.00 0.00 36.82 35.48 2jqe h ILE 325 CO 0.00 0.00 0.60 -0.08 -0.69 0.00 0.00 178.15 177.98 2jqe h GLU 326 N 0.00 0.00 -1.23 2.37 4.81 -1.17 -2.16 114.58 117.20 2jqe h GLU 326 Ca 0.00 0.00 0.37 0.00 -0.13 0.00 0.00 59.36 59.60 2jqe h GLU 326 Cb 0.89 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.17 2jqe h GLU 326 CO 0.00 0.00 0.81 0.00 -0.73 0.00 0.00 179.01 179.09 2jqe h ALA 327 N 1.19 2.65 -3.98 2.92 0.00 -1.75 -3.38 119.26 116.90 2jqe h ALA 327 Ca 0.20 0.07 -0.69 0.00 0.00 0.00 0.00 54.91 54.48 2jqe h ALA 327 Cb 1.39 0.12 -0.23 0.00 0.00 0.00 0.00 17.79 19.07 2jqe h ALA 327 CO -0.00 -1.16 -0.76 -1.64 0.00 0.00 0.00 179.25 175.68 2jqe s MET 328 N -5.30 2.55 0.00 0.00 -1.94 -0.81 -4.89 119.30 108.91 2jqe s MET 328 Ca -0.08 -0.68 0.00 0.00 -1.71 0.00 0.00 55.69 53.22 2jqe s MET 328 Cb 0.27 -2.40 0.00 0.00 2.01 0.00 0.00 34.83 34.71 2jqe s MET 328 CO 0.81 0.61 0.00 0.27 -0.01 0.00 0.00 175.02 176.71 2jqe n ASN 329 N 2.35 0.00 -3.83 3.03 6.94 -1.26 -4.94 115.26 117.54 2jqe n ASN 329 Ca -0.17 0.00 -0.28 0.00 -0.02 0.00 0.00 54.58 54.11 2jqe n ASN 329 Cb 0.52 0.01 0.04 0.00 -2.36 0.00 0.00 39.78 37.99 2jqe n ASN 329 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 2jqe n LYS 330 N -0.90 -5.79 -3.35 -3.83 5.02 -1.26 -4.93 118.16 103.12 2jqe n LYS 330 Ca 0.00 0.64 -0.41 0.00 -2.02 0.00 0.00 58.31 56.52 2jqe n LYS 330 Cb 0.00 -5.50 -0.09 0.00 -0.02 0.00 0.00 35.03 29.42 2jqe n LYS 330 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 2jqe s MET 331 N -6.46 3.57 0.00 1.97 -1.94 -1.26 -4.82 119.30 110.36 2jqe s MET 331 Ca 0.53 -0.34 0.00 0.00 -1.71 0.00 0.00 55.69 54.17 2jqe s MET 331 Cb -0.26 -3.81 0.00 0.00 2.01 0.00 0.00 34.83 32.77 2jqe s MET 331 CO 0.81 -0.57 0.00 0.41 -0.01 0.00 0.00 175.02 175.66 2jqe n GLY 332 N 4.90 -1.80 3.19 -0.03 0.00 -1.26 -5.06 105.19 105.14 2jqe n GLY 332 Ca -0.08 0.69 -0.41 0.00 0.00 0.00 0.00 46.02 46.23 2jqe n GLY 332 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jqe n PRO 333 N 0.00 2.59 0.00 1.61 -0.04 -1.26 -4.79 135.00 133.11 2jqe n PRO 333 Ca 0.00 -2.70 0.00 0.00 -0.04 0.00 0.00 63.50 60.76 2jqe n PRO 333 Cb 0.00 -3.36 0.00 0.00 -0.04 0.00 0.00 33.50 30.10 2jqe n PRO 333 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2jqe n VAL 334 N 6.05 0.00 -3.87 0.52 0.31 -1.26 -4.99 118.33 115.09 2jqe n VAL 334 Ca 0.50 0.33 -0.11 0.00 -0.01 0.00 0.00 64.34 65.05 2jqe n VAL 334 Cb 0.43 -0.67 -0.11 0.00 -0.91 0.00 0.00 33.84 32.57 2jqe n VAL 334 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 2jqe s ARG 335 N -0.36 0.30 -1.00 5.55 0.52 -1.26 -4.93 118.95 117.76 2jqe s ARG 335 Ca 0.00 -0.20 -0.09 0.00 -0.52 0.00 0.00 55.73 54.93 2jqe s ARG 335 Cb 0.00 0.12 -0.04 0.00 0.52 0.00 0.00 34.95 35.56 2jqe s ARG 335 CO 0.00 -0.06 0.83 1.63 0.02 0.00 0.00 175.30 177.72 2jqe n LYS 336 N 2.17 -1.74 -0.24 3.54 4.76 -1.26 -4.86 118.16 120.52 2jqe n LYS 336 Ca -0.18 0.87 0.03 0.00 -2.87 0.00 0.00 58.31 56.16 2jqe n LYS 336 Cb 0.57 -5.18 0.16 0.00 -1.84 0.00 0.00 35.03 28.74 2jqe n LYS 336 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2jqe h ILE 337 N -0.97 0.72 -2.92 -0.18 1.08 -1.95 -3.42 117.51 109.87 2jqe h ILE 337 Ca -0.51 -0.16 -0.58 0.00 -0.39 0.00 0.00 64.86 63.22 2jqe h ILE 337 Cb 1.27 0.21 -0.17 0.00 -3.07 0.00 0.00 36.82 35.06 2jqe h ILE 337 CO 0.42 0.08 -0.78 -0.36 -0.69 0.00 0.00 178.15 176.82 2jqe s PHE 338 N -6.05 2.10 -0.71 1.37 0.08 -1.26 -5.09 117.98 108.42 2jqe s PHE 338 Ca -0.13 -0.40 -0.06 0.00 0.12 0.00 0.00 56.93 56.46 2jqe s PHE 338 Cb 0.19 -1.00 0.18 0.00 -0.57 0.00 0.00 43.02 41.83 2jqe s PHE 338 CO 0.76 0.50 0.56 -1.21 -0.10 0.00 0.00 175.22 175.72 2jqe s GLU 339 N -3.03 2.91 0.61 0.44 0.41 -1.26 -5.00 118.70 113.77 2jqe s GLU 339 Ca 0.22 -2.60 0.00 0.00 -0.41 0.00 0.00 54.97 52.18 2jqe s GLU 339 Cb -0.06 -3.93 0.00 0.00 -1.78 0.00 0.00 34.13 28.36 2jqe s GLU 339 CO 0.10 -1.21 0.00 -0.12 -0.49 0.00 0.00 175.26 173.54 2jqe n MET 340 N 3.48 -4.01 -3.70 1.61 1.56 -1.26 -5.03 117.12 109.78 2jqe n MET 340 Ca 0.11 3.14 -0.14 0.00 -0.27 0.00 0.00 57.70 60.54 2jqe n MET 340 Cb 0.40 -4.04 -0.08 0.00 2.15 0.00 0.00 33.22 31.64 2jqe n MET 340 CO 0.00 0.00 0.00 -0.48 -0.73 0.00 0.00 175.97 174.76 2jqe s LEU 341 N -5.84 0.41 0.25 -0.89 0.05 -1.26 -5.14 118.68 106.25 2jqe s LEU 341 Ca 0.00 0.41 -0.30 0.00 0.05 0.00 0.00 54.13 54.30 2jqe s LEU 341 Cb 0.00 1.59 -0.09 0.00 -2.05 0.00 0.00 46.19 45.64 2jqe s LEU 341 CO 0.00 -0.41 1.24 -2.16 -0.55 0.00 0.00 176.35 174.47 2jqe s PRO 342 N -0.92 4.46 0.00 1.48 0.04 -1.26 -4.92 135.00 133.88 2jqe s PRO 342 Ca -0.10 2.00 0.29 0.00 0.04 0.00 0.00 61.00 63.24 2jqe s PRO 342 Cb -0.04 -3.17 1.25 0.00 0.04 0.00 0.00 34.50 32.58 2jqe s PRO 342 CO 0.05 -0.10 1.93 1.97 0.04 0.00 0.00 177.00 180.89 2jqe n PHE 343 N 1.84 0.00 -2.95 0.56 1.16 -1.26 -4.17 117.46 112.63 2jqe n PHE 343 Ca 0.03 0.00 -0.41 0.00 -1.87 0.00 0.00 57.45 55.20 2jqe n PHE 343 Cb 0.43 -0.49 0.00 0.00 -1.61 0.00 0.00 39.48 37.82 2jqe n PHE 343 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2jqe n GLY 344 N 1.49 5.38 3.78 4.97 0.00 -1.26 -5.03 105.19 114.52 2jqe n GLY 344 Ca 0.07 -2.66 -0.35 0.00 0.00 0.00 0.00 46.02 43.08 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 -3.14 3.77 0.00 0.99 1.43 -1.26 -5.04 118.68 115.44 2jqe s LEU 345 Ca 0.34 2.09 0.00 0.00 -1.03 0.00 0.00 54.13 55.53 2jqe s LEU 345 Cb 0.09 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.74 2jqe s LEU 345 CO 0.04 -1.08 0.00 0.61 0.23 0.00 0.00 176.35 176.15 2jqe n GLY 346 N 0.01 1.61 1.08 -3.19 0.00 -1.26 -4.94 105.19 98.50 2jqe n GLY 346 Ca 0.11 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.17 2jqe n GLY 346 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2jqe n LEU 347 N 0.00 3.05 -0.15 0.99 4.77 -1.26 -4.46 117.00 119.94 2jqe n LEU 347 Ca 0.00 -1.54 -0.03 0.00 -0.03 0.00 0.00 56.01 54.41 2jqe n LEU 347 Cb 0.00 -0.53 0.06 0.00 -2.33 0.00 0.00 43.42 40.62 2jqe n LEU 347 CO 0.00 0.44 0.88 0.50 -1.33 0.00 0.00 177.39 177.88 2jqe h LYS 348 N 1.95 0.18 0.00 3.23 3.64 -2.00 -3.44 116.57 120.13 2jqe h LYS 348 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2jqe h LYS 348 Cb 1.09 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.87 2jqe h LYS 348 CO 0.20 0.12 0.00 0.28 -2.27 0.00 0.00 179.45 177.78 2jqe n VAL 349 N -5.15 0.00 -3.29 2.00 0.31 -1.26 -5.03 118.33 105.90 2jqe n VAL 349 Ca 0.05 0.00 -0.24 0.00 -0.01 0.00 0.00 64.34 64.14 2jqe n VAL 349 Cb 0.24 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.21 2jqe n VAL 349 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2jqe n ASP 350 N -2.60 -5.72 -4.58 4.52 8.00 -1.26 -4.88 116.55 110.04 2jqe n ASP 350 Ca 0.00 -0.41 -0.47 0.00 0.71 0.00 0.00 54.79 54.62 2jqe n ASP 350 Cb 0.00 -4.60 -0.03 0.00 -0.02 0.00 0.00 41.12 36.47 2jqe n ASP 350 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2jqe n ASN 351 N -2.64 1.22 -2.88 -2.24 5.15 -1.26 -4.97 115.26 107.64 2jqe n ASN 351 Ca -0.06 1.16 -0.15 0.00 -0.60 0.00 0.00 54.58 54.94 2jqe n ASN 351 Cb 0.59 -1.24 -0.04 0.00 -0.53 0.00 0.00 39.78 38.56 2jqe n ASN 351 CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2jqe n ASP 352 N 1.69 1.26 -0.04 1.20 5.68 -1.26 -5.02 116.55 120.07 2jqe n ASP 352 Ca 0.13 -2.21 0.15 0.00 -0.50 0.00 0.00 54.79 52.35 2jqe n ASP 352 Cb 0.28 0.54 0.58 0.00 -1.14 0.00 0.00 41.12 41.37 2jqe n ASP 352 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 2jqe h VAL 353 N 1.35 0.84 -3.03 2.12 3.04 -2.06 -3.41 116.25 115.11 2jqe h VAL 353 Ca -0.18 -0.08 -0.54 0.00 -1.01 0.00 0.00 66.70 64.88 2jqe h VAL 353 Cb 0.68 0.58 -0.00 0.00 -2.01 0.00 0.00 31.29 30.54 2jqe h VAL 353 CO 0.29 0.04 0.72 -0.04 -1.01 0.00 0.00 177.57 177.58 2jqe s MET 354 N -5.24 4.34 0.49 4.17 -1.94 -1.26 -4.97 119.30 114.89 2jqe s MET 354 Ca -0.07 1.88 -0.24 0.00 -1.71 0.00 0.00 55.69 55.55 2jqe s MET 354 Cb 0.20 -3.46 -0.07 0.00 2.01 0.00 0.00 34.83 33.50 2jqe s MET 354 CO 0.74 -0.45 1.42 0.39 -0.01 0.00 0.00 175.02 177.11 2jqe n GLU 355 N 4.76 2.08 -4.28 2.03 1.02 -1.26 -5.02 120.64 119.97 2jqe n GLU 355 Ca 0.11 0.75 -0.16 0.00 -0.02 0.00 0.00 57.16 57.84 2jqe n GLU 355 Cb 0.45 -2.63 -0.10 0.00 -0.02 0.00 0.00 31.44 29.13 2jqe n GLU 355 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2jqe s MET 356 N -2.61 1.14 0.29 3.49 -1.94 -1.26 -5.09 119.30 113.31 2jqe s MET 356 Ca 0.65 -1.45 0.11 0.00 -1.71 0.00 0.00 55.69 53.28 2jqe s MET 356 Cb -0.43 -0.84 -0.05 0.00 2.01 0.00 0.00 34.83 35.52 2jqe s MET 356 CO 0.55 0.13 -0.17 0.95 -0.01 0.00 0.00 175.02 176.46 2jqe s THR 357 N -2.99 2.36 0.00 2.05 -4.23 -1.26 -5.05 115.64 106.53 2jqe s THR 357 Ca 0.17 -2.35 0.00 0.00 -1.18 0.00 0.00 61.69 58.33 2jqe s THR 357 Cb 0.00 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.49 2jqe s THR 357 CO 0.03 -0.37 0.00 0.00 -0.54 0.00 0.00 174.62 173.74 2jqe n GLN 358 N -0.64 0.00 -2.64 3.99 1.13 -1.26 -5.09 117.38 112.88 2jqe n GLN 358 Ca -0.05 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.58 2jqe n GLN 358 Cb 0.61 0.00 -0.02 0.00 0.11 0.00 0.00 30.24 30.94 2jqe n GLN 358 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 2jqe s GLU 359 N -0.15 4.04 0.37 -1.09 2.02 -1.26 -4.90 118.70 117.73 2jqe s GLU 359 Ca 0.00 1.03 0.07 0.00 0.02 0.00 0.00 54.97 56.09 2jqe s GLU 359 Cb 0.00 -3.75 0.71 0.00 0.10 0.00 0.00 34.13 31.19 2jqe s GLU 359 CO 0.00 -0.94 1.91 0.87 0.02 0.00 0.00 175.26 177.13 2jqe h LYS 360 N 8.17 0.41 -0.03 1.61 1.57 -2.00 -2.38 116.57 123.91 2jqe h LYS 360 Ca -0.21 -0.08 -0.06 0.00 -1.87 0.00 0.00 60.65 58.43 2jqe h LYS 360 Cb 1.06 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 2jqe h LYS 360 CO 1.04 0.46 -0.27 0.00 -0.57 0.00 0.00 179.45 180.11 2jqe h MET 361 N 0.39 0.05 -0.42 3.15 -0.00 -1.99 -2.41 114.93 113.70 2jqe h MET 361 Ca 0.09 -0.01 0.01 0.00 -0.00 0.00 0.00 59.70 59.78 2jqe h MET 361 Cb 0.30 -0.01 -0.02 0.00 -0.00 0.00 0.00 31.60 31.87 2jqe h MET 361 CO 0.01 0.32 0.26 -0.22 -0.00 0.00 0.00 176.91 177.28 2jqe h LYS 362 N 0.05 0.52 -0.01 -0.10 3.64 -1.79 -1.73 116.57 117.15 2jqe h LYS 362 Ca 0.01 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2jqe h LYS 362 Cb 0.50 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 2jqe h LYS 362 CO 0.04 0.34 -0.07 1.63 -2.27 0.00 0.00 179.45 179.12 2jqe n LYS 363 N -4.82 0.98 0.10 1.90 5.02 -1.13 -3.97 118.16 116.23 2jqe n LYS 363 Ca 0.01 -0.37 -0.12 0.00 -2.02 0.00 0.00 58.31 55.82 2jqe n LYS 363 Cb 0.04 -1.49 -0.08 0.00 -0.02 0.00 0.00 35.03 33.48 2jqe n LYS 363 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2jqe h PHE 364 N 0.89 -0.27 -0.48 2.13 3.57 -0.80 -3.25 116.94 118.73 2jqe h PHE 364 Ca 0.00 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2jqe h PHE 364 Cb 0.33 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 2jqe h PHE 364 CO 0.00 0.12 0.23 -0.09 -2.23 0.00 0.00 178.31 176.34 2jqe h ARG 365 N -0.79 0.66 -0.19 1.11 2.43 -1.68 -3.01 114.38 112.91 2jqe h ARG 365 Ca -0.03 -0.07 0.04 0.00 -0.81 0.00 0.00 59.98 59.11 2jqe h ARG 365 Cb 0.51 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.89 2jqe h ARG 365 CO 0.05 0.51 -0.05 0.28 -1.51 0.00 0.00 179.97 179.25 2jqe h VAL 366 N 0.67 0.81 0.00 0.20 2.07 -1.70 -0.17 116.25 118.13 2jqe h VAL 366 Ca 0.17 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.69 2jqe h VAL 366 Cb 0.06 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2jqe h VAL 366 CO -0.02 0.00 0.00 0.40 0.02 0.00 0.00 177.57 177.97 2jqe h ILE 367 N -0.00 0.00 -0.79 4.57 2.04 -1.58 -2.87 117.51 118.89 2jqe h ILE 367 Ca 0.09 -0.25 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 2jqe h ILE 367 Cb 0.14 1.09 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 2jqe h ILE 367 CO -0.20 0.00 0.37 -0.03 0.00 0.00 0.00 178.15 178.29 2jqe h MET 368 N 0.00 1.13 0.00 2.37 4.05 -0.93 -1.89 114.93 119.66 2jqe h MET 368 Ca 0.00 -0.17 0.00 0.00 -0.28 0.00 0.00 59.70 59.25 2jqe h MET 368 Cb 0.29 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 30.88 2jqe h MET 368 CO 0.00 0.88 -0.53 -0.40 0.23 0.00 0.00 176.91 177.08 2jqe n ASP 369 N -4.31 0.68 0.00 1.39 5.68 -1.09 -4.45 116.55 114.45 2jqe n ASP 369 Ca 0.08 0.15 0.00 0.00 -0.50 0.00 0.00 54.79 54.51 2jqe n ASP 369 Cb 0.14 0.05 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 2jqe n ASP 369 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 2jqe n SER 370 N -2.06 0.00 -2.37 -1.12 7.64 -0.75 -4.89 113.62 110.07 2jqe n SER 370 Ca 0.04 0.05 -0.21 0.00 1.01 0.00 0.00 58.87 59.75 2jqe n SER 370 Cb 0.43 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.65 2jqe n SER 370 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2jqe n MET 371 N -0.15 0.00 -3.25 1.43 2.81 -0.95 -4.87 117.12 112.13 2jqe n MET 371 Ca 0.00 0.00 -0.38 0.00 -1.81 0.00 0.00 57.70 55.51 2jqe n MET 371 Cb 0.00 -0.59 -0.06 0.00 -0.71 0.00 0.00 33.22 31.87 2jqe n MET 371 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2jqe s THR 372 N -1.18 5.05 0.27 2.03 2.01 -1.26 -4.95 115.64 117.62 2jqe s THR 372 Ca 0.24 1.13 0.00 0.00 0.31 0.00 0.00 61.69 63.38 2jqe s THR 372 Cb -0.12 -3.88 0.26 0.00 0.01 0.00 0.00 72.50 68.76 2jqe s THR 372 CO 0.48 0.37 1.71 -0.33 -0.69 0.00 0.00 174.62 176.16 2jqe h GLU 373 N 6.17 0.41 -0.93 4.92 5.08 -1.92 0.58 114.58 128.90 2jqe h GLU 373 Ca -0.43 -0.02 0.15 0.00 -1.00 0.00 0.00 59.36 58.05 2jqe h GLU 373 Cb 1.19 -0.09 -0.08 0.00 0.50 0.00 0.00 28.75 30.27 2jqe h GLU 373 CO 0.72 0.27 0.59 1.49 -1.00 0.00 0.00 179.01 181.09 2jqe h GLU 374 N 0.42 0.72 -0.37 2.33 4.81 -2.00 0.74 114.58 121.23 2jqe h GLU 374 Ca 0.50 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.63 2jqe h GLU 374 Cb 0.88 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.08 2jqe h GLU 374 CO -0.48 0.48 0.01 1.49 -0.73 0.00 0.00 179.01 179.78 2jqe h GLU 375 N 0.74 0.65 -1.00 1.92 4.81 -0.18 -2.93 114.58 118.59 2jqe h GLU 375 Ca 0.47 -0.20 0.02 0.00 -0.13 0.00 0.00 59.36 59.52 2jqe h GLU 375 Cb 0.72 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 29.98 2jqe h GLU 375 CO -0.23 0.75 0.66 -0.07 -0.73 0.00 0.00 179.01 179.39 2jqe h LEU 376 N 0.47 1.13 -1.36 1.64 3.38 -0.02 -1.74 115.31 118.82 2jqe h LEU 376 Ca 0.11 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 2jqe h LEU 376 Cb 0.45 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2jqe h LEU 376 CO 0.02 0.81 0.23 -0.07 0.09 0.00 0.00 178.44 179.52 2jqe h LEU 377 N 1.33 0.60 -7.24 1.67 -0.00 -1.16 -3.34 115.31 107.17 2jqe h LEU 377 Ca 0.38 -0.05 -0.63 0.00 -0.00 0.00 0.00 57.88 57.58 2jqe h LEU 377 Cb -0.11 -0.15 -0.41 0.00 -0.00 0.00 0.00 40.66 39.99 2jqe h LEU 377 CO -0.09 0.51 -0.64 0.20 -0.00 0.00 0.00 178.44 178.41 2jqe s ASN 378 N -6.62 4.26 0.25 -0.43 0.01 -0.66 -4.65 114.94 107.11 2jqe s ASN 378 Ca -0.09 -3.13 -0.01 0.00 -0.71 0.00 0.00 52.86 48.92 2jqe s ASN 378 Cb 0.17 -1.52 0.31 0.00 0.41 0.00 0.00 41.25 40.61 2jqe s ASN 378 CO 0.76 -0.20 1.68 1.55 -1.51 0.00 0.00 177.10 179.38 2jqe h PRO 379 N 6.29 0.62 -0.07 -0.60 0.13 -1.67 -2.62 132.00 134.08 2jqe h PRO 379 Ca -0.02 -0.24 0.02 0.00 -0.87 0.00 0.00 66.00 64.89 2jqe h PRO 379 Cb 0.87 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.96 2jqe h PRO 379 CO 0.66 0.80 0.31 0.87 -0.23 0.00 0.00 178.00 180.41 2jqe h LYS 380 N 0.55 0.00 -1.01 0.86 1.79 -1.91 -1.58 116.57 115.27 2jqe h LYS 380 Ca 0.08 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.54 2jqe h LYS 380 Cb 0.69 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.34 2jqe h LYS 380 CO 0.05 0.00 0.01 -0.89 -1.08 0.00 0.00 179.45 177.54 2jqe n ILE 381 N -3.08 1.03 -1.52 1.86 5.41 -0.99 -4.89 119.36 117.19 2jqe n ILE 381 Ca -0.01 -0.02 -0.40 0.00 1.00 0.00 0.00 62.75 63.32 2jqe n ILE 381 Cb 0.38 -1.00 -0.09 0.00 -0.71 0.00 0.00 39.64 38.21 2jqe n ILE 381 CO 0.00 0.00 0.00 -0.38 0.00 0.00 0.00 176.55 176.17 2jqe n ILE 382 N 0.50 -0.03 -3.03 1.39 2.08 -0.60 -4.86 119.36 114.81 2jqe n ILE 382 Ca 0.01 -0.37 -0.43 0.00 0.56 0.00 0.00 62.75 62.52 2jqe n ILE 382 Cb 0.51 -1.57 -0.05 0.00 -0.75 0.00 0.00 39.64 37.77 2jqe n ILE 382 CO 0.00 0.00 0.00 -0.62 0.56 0.00 0.00 176.55 176.49 2jqe s ASP 383 N 10.29 6.26 0.40 4.38 -1.08 -1.26 -4.92 116.67 130.75 2jqe s ASP 383 Ca 1.18 -0.73 0.12 0.00 -0.52 0.00 0.00 52.55 52.59 2jqe s ASP 383 Cb -0.77 -2.35 0.93 0.00 -1.46 0.00 0.00 42.92 39.28 2jqe s ASP 383 CO 0.39 -1.03 1.93 0.77 0.52 0.00 0.00 175.17 177.75 2jqe h SER 384 N 9.13 0.49 -0.06 -0.34 4.64 -2.00 -1.62 113.55 123.79 2jqe h SER 384 Ca -0.27 0.02 -0.09 0.00 -0.47 0.00 0.00 61.79 60.98 2jqe h SER 384 Cb 1.09 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 2jqe h SER 384 CO 1.02 0.28 -0.31 -1.28 -0.87 0.00 0.00 176.83 175.67 2jqe h SER 385 N 0.54 0.38 -0.30 4.97 0.87 -2.00 -2.67 113.55 115.34 2jqe h SER 385 Ca 0.35 -0.65 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 2jqe h SER 385 Cb 0.62 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.45 2jqe h SER 385 CO -0.12 0.97 0.20 -0.09 -0.53 0.00 0.00 176.83 177.25 2jqe h ARG 386 N -0.19 0.41 -0.08 2.24 2.43 -1.84 -2.33 114.38 115.02 2jqe h ARG 386 Ca -0.02 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.06 2jqe h ARG 386 Cb 0.96 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.41 2jqe h ARG 386 CO 0.06 0.28 -0.23 0.97 -1.51 0.00 0.00 179.97 179.55 2jqe h ILE 387 N 0.41 1.20 0.24 1.20 6.09 -1.40 -2.07 117.51 123.18 2jqe h ILE 387 Ca 0.11 -0.95 -0.00 0.00 -1.37 0.00 0.00 64.86 62.65 2jqe h ILE 387 Cb -0.03 1.40 -0.02 0.00 0.47 0.00 0.00 36.82 38.64 2jqe h ILE 387 CO -0.02 0.28 -0.36 -0.09 -3.07 0.00 0.00 178.15 174.89 2jqe h ARG 388 N 0.13 -0.61 -0.85 2.19 2.43 -1.05 0.48 114.38 117.10 2jqe h ARG 388 Ca 0.02 0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.31 2jqe h ARG 388 Cb 0.48 0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 30.10 2jqe h ARG 388 CO 0.03 -0.41 0.51 -0.09 -1.51 0.00 0.00 179.97 178.50 2jqe h ARG 389 N -0.64 0.86 -0.25 0.20 2.43 -1.47 -2.37 114.38 113.15 2jqe h ARG 389 Ca -0.03 -0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.10 2jqe h ARG 389 Cb 0.58 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 29.92 2jqe h ARG 389 CO -0.11 0.57 0.14 0.82 -1.51 0.00 0.00 179.97 179.89 2jqe h ILE 390 N 0.89 1.03 -0.94 1.20 2.04 -0.62 -2.06 117.51 119.06 2jqe h ILE 390 Ca 0.39 -0.10 0.15 0.00 1.00 0.00 0.00 64.86 66.30 2jqe h ILE 390 Cb 0.27 0.71 -0.10 0.00 -0.74 0.00 0.00 36.82 36.96 2jqe h ILE 390 CO -0.21 0.05 0.54 0.00 0.00 0.00 0.00 178.15 178.54 2jqe h ALA 391 N 1.11 1.47 -0.81 1.87 0.00 0.46 0.23 119.26 123.58 2jqe h ALA 391 Ca 0.09 0.07 0.01 0.00 0.00 0.00 0.00 54.91 55.08 2jqe h ALA 391 Cb -0.01 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 2jqe h ALA 391 CO -0.04 0.00 0.54 0.82 0.00 0.00 0.00 179.25 180.57 2jqe h ILE 392 N 0.76 1.21 -0.82 0.00 1.08 -1.20 1.37 117.51 119.91 2jqe h ILE 392 Ca 0.51 -0.39 -0.03 0.00 -0.39 0.00 0.00 64.86 64.56 2jqe h ILE 392 Cb 0.69 0.01 -0.04 0.00 -3.07 0.00 0.00 36.82 34.42 2jqe h ILE 392 CO -0.34 0.20 0.38 1.23 -0.69 0.00 0.00 178.15 178.93 2jqe h GLY 393 N 1.11 1.28 2.00 5.37 0.00 -0.09 -2.13 103.07 110.60 2jqe h GLY 393 Ca 0.30 -0.64 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 2jqe h GLY 393 CO -0.06 0.61 -0.52 1.48 0.00 0.00 0.00 176.54 178.05 2jqe h SER 394 N 1.18 0.00 0.00 0.19 4.64 -0.18 -3.47 113.55 115.90 2jqe h SER 394 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2jqe h SER 394 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 2jqe h SER 394 CO -0.03 0.52 0.00 0.61 -0.87 0.00 0.00 176.83 177.05 2jqe n GLY 395 N 1.20 0.74 0.00 -0.77 0.00 0.46 -4.91 105.19 101.92 2jqe n GLY 395 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2jqe n GLY 395 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jqe n THR 396 N -2.00 0.00 -3.61 2.61 -2.24 -0.92 -4.92 114.28 103.20 2jqe n THR 396 Ca 0.00 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.79 2jqe n THR 396 Cb 0.00 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.22 2jqe n THR 396 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2jqe s SER 397 N -1.00 -0.06 0.26 3.42 0.01 -1.26 -4.72 113.70 110.36 2jqe s SER 397 Ca 0.00 -0.08 -0.03 0.00 1.31 0.00 0.00 55.95 57.14 2jqe s SER 397 Cb 0.00 0.12 0.34 0.00 0.21 0.00 0.00 66.02 66.69 2jqe s SER 397 CO 0.00 -0.22 1.84 1.55 0.41 0.00 0.00 173.24 176.82 2jqe h PRO 398 N 2.00 0.99 -0.80 12.44 0.13 -1.90 -2.71 132.00 142.15 2jqe h PRO 398 Ca -0.26 -0.16 0.10 0.00 -0.87 0.00 0.00 66.00 64.81 2jqe h PRO 398 Cb 1.19 -0.17 -0.08 0.00 0.13 0.00 0.00 31.00 32.08 2jqe h PRO 398 CO 0.27 0.81 0.43 1.96 -0.23 0.00 0.00 178.00 181.24 2jqe h GLN 399 N 0.97 0.68 0.00 0.86 4.20 -1.99 0.29 115.11 120.12 2jqe h GLN 399 Ca 0.23 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.85 2jqe h GLN 399 Cb 0.19 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 2jqe h GLN 399 CO -0.02 0.45 -0.23 0.93 -0.67 0.00 0.00 178.83 179.29 2jqe h GLU 400 N 0.70 0.00 0.04 1.46 5.08 -1.88 -2.28 114.58 117.70 2jqe h GLU 400 Ca 0.40 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.50 2jqe h GLU 400 Cb 0.42 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.64 2jqe h GLU 400 CO -0.28 0.23 -1.30 0.28 -1.00 0.00 0.00 179.01 176.94 2jqe h VAL 401 N 0.00 1.37 -0.61 3.13 2.07 -0.91 -2.87 116.25 118.43 2jqe h VAL 401 Ca -0.00 -3.09 -0.01 0.00 0.82 0.00 0.00 66.70 64.42 2jqe h VAL 401 Cb 0.61 2.74 -0.03 0.00 -1.52 0.00 0.00 31.29 33.09 2jqe h VAL 401 CO 0.03 0.82 0.34 0.50 0.02 0.00 0.00 177.57 179.28 2jqe h LYS 402 N 0.02 0.85 -0.52 1.57 1.63 0.00 -1.55 116.57 118.57 2jqe h LYS 402 Ca -0.14 -0.10 -0.05 0.00 -0.85 0.00 0.00 60.65 59.52 2jqe h LYS 402 Cb 1.90 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 33.34 2jqe h LYS 402 CO 0.13 0.64 0.14 0.93 -3.45 0.00 0.00 179.45 177.84 2jqe h GLU 403 N 0.83 0.83 -0.79 1.90 5.08 -1.49 0.19 114.58 121.12 2jqe h GLU 403 Ca 0.22 -0.19 0.16 0.00 -1.00 0.00 0.00 59.36 58.54 2jqe h GLU 403 Cb 0.04 -0.11 -0.10 0.00 0.50 0.00 0.00 28.75 29.07 2jqe h GLU 403 CO -0.04 0.78 0.31 1.25 -1.00 0.00 0.00 179.01 180.32 2jqe h LEU 404 N 0.72 0.27 -0.40 1.33 5.85 -1.12 0.71 115.31 122.68 2jqe h LEU 404 Ca 0.17 0.12 -0.16 0.00 0.84 0.00 0.00 57.88 58.85 2jqe h LEU 404 Cb 0.32 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2jqe h LEU 404 CO -0.00 0.07 -0.37 -0.07 -0.34 0.00 0.00 178.44 177.73 2jqe h LEU 405 N 0.43 1.01 -2.12 2.25 -0.00 -0.85 -1.32 115.31 114.72 2jqe h LEU 405 Ca 0.45 -0.46 0.06 0.00 -0.00 0.00 0.00 57.88 57.93 2jqe h LEU 405 Cb 0.73 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 41.10 2jqe h LEU 405 CO -0.44 1.26 0.32 -1.13 -0.00 0.00 0.00 178.44 178.45 2jqe h ASN 406 N 0.78 0.00 0.17 -0.43 -0.73 0.22 0.93 115.58 116.52 2jqe h ASN 406 Ca 0.07 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.23 2jqe h ASN 406 Cb 0.97 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.56 2jqe h ASN 406 CO 0.09 0.00 -0.09 0.22 -0.37 0.00 0.00 177.43 177.28 2jqe h TYR 407 N 0.00 -0.24 -0.01 0.67 3.20 0.13 0.28 116.97 120.99 2jqe h TYR 407 Ca 0.10 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.97 2jqe h TYR 407 Cb 0.73 0.08 -0.00 0.00 1.54 0.00 0.00 36.73 39.08 2jqe h TYR 407 CO 0.00 -0.15 0.13 1.88 -1.64 0.00 0.00 178.16 178.38 2jqe h TYR 408 N -0.25 0.00 -0.16 -3.82 -1.99 -0.90 0.42 116.97 110.27 2jqe h TYR 408 Ca -0.02 0.00 0.05 0.00 2.00 0.00 0.00 58.73 60.76 2jqe h TYR 408 Cb 0.20 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.88 2jqe h TYR 408 CO -0.08 0.00 -0.17 -0.22 -0.00 0.00 0.00 178.16 177.69 2jqe h LYS 409 N 0.00 -0.20 -1.03 4.88 3.64 -0.29 0.48 116.57 124.06 2jqe h LYS 409 Ca 0.01 0.01 0.31 0.00 -1.27 0.00 0.00 60.65 59.71 2jqe h LYS 409 Cb 0.27 0.04 -0.14 0.00 -0.41 0.00 0.00 32.23 32.00 2jqe h LYS 409 CO -0.00 -0.13 0.60 1.15 -2.27 0.00 0.00 179.45 178.80 2jqe h THR 410 N -0.20 0.37 -0.96 1.00 2.02 0.01 1.38 112.91 116.51 2jqe h THR 410 Ca 0.11 -0.13 0.18 0.00 0.77 0.00 0.00 66.41 67.34 2jqe h THR 410 Cb 0.36 -0.05 -0.09 0.00 -1.74 0.00 0.00 68.15 66.64 2jqe h THR 410 CO -0.28 0.07 0.61 -0.03 0.37 0.00 0.00 175.52 176.26 2jqe h MET 411 N 0.38 0.64 -0.76 6.66 1.85 0.08 1.35 114.93 125.13 2jqe h MET 411 Ca 0.71 -0.04 0.16 0.00 -0.61 0.00 0.00 59.70 59.91 2jqe h MET 411 Cb 1.61 -0.14 -0.05 0.00 0.43 0.00 0.00 31.60 33.44 2jqe h MET 411 CO -0.53 0.42 0.51 0.87 -0.40 0.00 0.00 176.91 177.78 2jqe h LYS 412 N 0.66 0.37 -0.77 0.39 1.57 0.21 1.38 116.57 120.38 2jqe h LYS 412 Ca 0.52 -0.02 0.21 0.00 -1.87 0.00 0.00 60.65 59.49 2jqe h LYS 412 Cb 0.94 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 33.13 2jqe h LYS 412 CO -0.28 0.25 0.54 -0.97 -0.57 0.00 0.00 179.45 178.42 2jqe h ASN 413 N 0.38 0.09 -1.08 0.86 -0.73 0.18 1.12 115.58 116.42 2jqe h ASN 413 Ca 0.37 0.01 0.29 0.00 1.87 0.00 0.00 56.30 58.84 2jqe h ASN 413 Cb 0.90 -0.01 -0.10 0.00 0.27 0.00 0.00 38.32 39.39 2jqe h ASN 413 CO -0.12 0.04 0.70 0.25 -0.37 0.00 0.00 177.43 177.93 2jqe h LEU 414 N 0.10 0.41 -1.85 0.34 5.85 0.19 1.18 115.31 121.53 2jqe h LEU 414 Ca 0.37 0.09 0.13 0.00 0.84 0.00 0.00 57.88 59.32 2jqe h LEU 414 Cb 1.34 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 2jqe h LEU 414 CO -0.04 0.05 0.54 0.24 -0.34 0.00 0.00 178.44 178.89 2jqe h MET 415 N 0.34 0.00 -0.30 1.25 2.86 0.12 1.49 114.93 120.68 2jqe h MET 415 Ca 0.62 0.00 0.06 0.00 -2.06 0.00 0.00 59.70 58.33 2jqe h MET 415 Cb 1.66 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.31 2jqe h MET 415 CO -0.31 0.00 0.21 0.87 1.06 0.00 0.00 176.91 178.75 2jqe h LYS 416 N 0.00 0.13 0.00 1.72 1.57 0.13 -2.81 116.57 117.31 2jqe h LYS 416 Ca 0.22 -0.01 -0.35 0.00 -1.87 0.00 0.00 60.65 58.64 2jqe h LYS 416 Cb 1.30 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 33.52 2jqe h LYS 416 CO -0.00 0.08 -2.31 1.63 -0.57 0.00 0.00 179.45 178.28 2jqe n LYS 417 N -4.47 0.69 -2.89 3.15 4.76 0.46 -5.00 118.16 114.86 2jqe n LYS 417 Ca 0.04 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.58 2jqe n LYS 417 Cb 0.29 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 2jqe n LYS 417 CO 0.00 0.00 0.00 -0.12 -1.37 0.00 0.00 177.40 175.91 2jqe n MET 418 N -3.06 -0.53 0.07 1.97 1.56 0.15 -4.79 117.12 112.50 2jqe n MET 418 Ca -0.38 -0.26 -0.13 0.00 -0.27 0.00 0.00 57.70 56.65 2jqe n MET 418 Cb 0.98 0.47 -0.08 0.00 2.15 0.00 0.00 33.22 36.74 2jqe n MET 418 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 2jqe h LYS 419 N 1.97 -0.55 0.00 2.12 3.64 -1.91 -3.44 116.57 118.40 2jqe h LYS 419 Ca 0.00 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 2jqe h LYS 419 Cb 0.00 0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 2jqe h LYS 419 CO 0.00 -0.37 0.00 1.17 -2.27 0.00 0.00 179.45 177.98 2jqe n LYS 420 N -4.85 0.00 0.00 1.90 4.81 -1.26 -4.55 118.16 114.21 2jqe n LYS 420 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.38 2jqe n LYS 420 Cb 0.32 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.37 2jqe n LYS 420 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2jqe n ASN 421 N 1.92 0.00 -2.99 3.14 2.85 -1.26 -5.04 115.26 113.88 2jqe n ASN 421 Ca 0.00 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.25 2jqe n ASN 421 Cb 0.00 0.04 0.02 0.00 1.24 0.00 0.00 39.78 41.08 2jqe n ASN 421 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 2jqe n LYS 422 N -1.90 -3.96 -2.75 1.20 5.02 -1.26 -4.90 118.16 109.60 2jqe n LYS 422 Ca 0.00 0.78 -0.04 0.00 -2.02 0.00 0.00 58.31 57.03 2jqe n LYS 422 Cb 0.00 -5.57 0.02 0.00 -0.02 0.00 0.00 35.03 29.46 2jqe n LYS 422 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2jqe n LEU 423 N -3.75 -3.26 0.16 -0.35 0.00 -1.26 -4.99 117.00 103.54 2jqe n LEU 423 Ca -0.11 -2.81 0.00 0.00 0.00 0.00 0.00 56.01 53.10 2jqe n LEU 423 Cb 0.61 0.75 0.27 0.00 0.00 0.00 0.00 43.42 45.05 2jqe n LEU 423 CO 0.44 1.89 0.63 1.55 0.00 0.00 0.00 177.39 181.90 2jqe h PRO 424 N 4.84 0.03 0.00 1.96 0.13 -2.05 -3.56 132.00 133.35 2jqe h PRO 424 Ca 0.03 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.15 2jqe h PRO 424 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2jqe h PRO 424 CO 0.03 0.49 0.00 0.44 -0.23 0.00 0.00 178.00 178.73