#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fqj s ILE 287 N 0.00 3.14 0.35 5.18 1.10 -1.26 -5.06 121.20 124.66 1fqj s ILE 287 Ca 0.00 -1.52 -0.28 0.00 -0.51 0.00 0.00 60.65 58.34 1fqj s ILE 287 Cb 0.00 -2.89 -0.12 0.00 0.15 0.00 0.00 42.46 39.60 1fqj s ILE 287 CO 0.00 -0.26 1.39 -2.65 -2.11 0.00 0.00 174.94 171.31 1fqj n PRO 288 N 4.63 2.38 -1.67 3.50 -0.02 -1.26 -4.80 135.00 137.77 1fqj n PRO 288 Ca -0.10 0.84 -0.31 0.00 -2.02 0.00 0.00 63.50 61.91 1fqj n PRO 288 Cb 0.43 -2.49 0.05 0.00 -0.02 0.00 0.00 33.50 31.47 1fqj n PRO 288 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1fqj s THR 289 N -1.07 3.98 0.21 3.45 -4.23 -1.26 -3.07 115.64 113.66 1fqj s THR 289 Ca 0.55 0.64 -0.09 0.00 -1.18 0.00 0.00 61.69 61.62 1fqj s THR 289 Cb -0.53 -3.47 0.15 0.00 1.34 0.00 0.00 72.50 70.00 1fqj s THR 289 CO 0.63 -0.84 1.76 0.50 -0.54 0.00 0.00 174.62 176.13 1fqj h LYS 290 N -0.68 0.49 -0.83 3.99 3.64 -1.78 -1.90 116.57 119.50 1fqj h LYS 290 Ca -0.44 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 1fqj h LYS 290 Cb 1.22 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.89 1fqj h LYS 290 CO 0.59 0.32 0.45 1.98 -2.27 0.00 0.00 179.45 180.52 1fqj h MET 291 N 0.50 1.16 -0.25 1.90 4.05 -1.93 -1.52 114.93 118.85 1fqj h MET 291 Ca 0.32 -0.14 -0.02 0.00 -0.28 0.00 0.00 59.70 59.58 1fqj h MET 291 Cb 0.36 -0.23 -0.01 0.00 -0.80 0.00 0.00 31.60 30.92 1fqj h MET 291 CO -0.28 0.85 0.07 -0.09 0.23 0.00 0.00 176.91 177.69 1fqj h ARG 292 N 1.16 0.39 -0.40 0.39 2.43 -1.74 -2.14 114.38 114.47 1fqj h ARG 292 Ca 0.29 -0.09 -0.10 0.00 -0.81 0.00 0.00 59.98 59.27 1fqj h ARG 292 Cb 0.04 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.52 1fqj h ARG 292 CO -0.05 0.48 -0.16 0.28 -1.51 0.00 0.00 179.97 179.01 1fqj h VAL 293 N 0.23 1.26 0.00 0.20 2.07 -1.18 -2.40 116.25 116.43 1fqj h VAL 293 Ca 0.08 -1.23 -0.06 0.00 0.82 0.00 0.00 66.70 66.30 1fqj h VAL 293 Cb 0.26 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 1fqj h VAL 293 CO -0.00 0.41 -0.29 -0.33 0.02 0.00 0.00 177.57 177.38 1fqj h GLU 294 N 0.67 0.00 0.00 1.57 5.08 -1.21 -2.06 114.58 118.62 1fqj h GLU 294 Ca 0.10 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.42 1fqj h GLU 294 Cb 0.64 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 1fqj h GLU 294 CO 0.05 0.29 -0.24 -0.09 -1.00 0.00 0.00 179.01 178.02 1fqj h ARG 295 N 0.00 0.00 0.00 2.33 2.43 -0.86 -2.14 114.38 116.14 1fqj h ARG 295 Ca -0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1fqj h ARG 295 Cb 0.56 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1fqj h ARG 295 CO 0.04 0.24 -0.03 -1.49 -1.51 0.00 0.00 179.97 177.22 1fqj h TRP 296 N 0.00 0.00 0.00 2.20 6.55 -1.24 -0.88 115.95 122.58 1fqj h TRP 296 Ca -0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1fqj h TRP 296 Cb 0.58 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.88 1fqj h TRP 296 CO 0.00 0.03 -0.41 0.00 -1.05 0.00 0.00 178.44 177.01 1fqj n ALA 297 N -2.16 3.19 -0.21 1.49 0.00 -0.80 -4.06 120.51 117.96 1fqj n ALA 297 Ca -0.02 -0.28 -0.06 0.00 0.00 0.00 0.00 53.44 53.08 1fqj n ALA 297 Cb 0.16 -1.20 0.04 0.00 0.00 0.00 0.00 19.45 18.44 1fqj n ALA 297 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1fqj h PHE 298 N 0.00 0.76 -1.93 0.00 -0.00 -1.23 -3.46 116.94 111.08 1fqj h PHE 298 Ca 0.00 0.01 0.19 0.00 -0.00 0.00 0.00 57.97 58.17 1fqj h PHE 298 Cb 0.54 -0.26 -0.15 0.00 -0.00 0.00 0.00 35.95 36.08 1fqj h PHE 298 CO 0.00 0.49 0.63 0.54 -0.00 0.00 0.00 178.31 179.98 1fqj s ASN 299 N -5.77 -0.23 0.29 0.41 2.20 -1.26 -5.04 114.94 105.54 1fqj s ASN 299 Ca -0.13 -0.06 -0.02 0.00 -0.94 0.00 0.00 52.86 51.71 1fqj s ASN 299 Cb 0.13 0.29 0.42 0.00 -2.00 0.00 0.00 41.25 40.10 1fqj s ASN 299 CO 0.76 -0.49 1.94 0.15 -2.94 0.00 0.00 177.10 176.52 1fqj h PHE 300 N 2.00 1.10 -0.91 1.54 3.57 -1.90 -2.70 116.94 119.65 1fqj h PHE 300 Ca -0.19 0.03 0.14 0.00 3.53 0.00 0.00 57.97 61.48 1fqj h PHE 300 Cb 1.21 -0.37 -0.07 0.00 2.79 0.00 0.00 35.95 39.51 1fqj h PHE 300 CO 0.29 0.66 0.58 1.03 -2.23 0.00 0.00 178.31 178.64 1fqj h SER 301 N 1.16 0.71 -0.22 0.41 0.87 -1.96 -1.62 113.55 112.90 1fqj h SER 301 Ca 0.35 0.04 -0.18 0.00 -1.23 0.00 0.00 61.79 60.77 1fqj h SER 301 Cb -0.03 -0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 1fqj h SER 301 CO -0.10 0.36 -0.56 -0.33 -0.53 0.00 0.00 176.83 175.67 1fqj h GLU 302 N 0.75 0.81 0.46 2.24 4.39 -1.79 -2.30 114.58 119.15 1fqj h GLU 302 Ca 0.46 -0.52 -0.02 0.00 0.34 0.00 0.00 59.36 59.61 1fqj h GLU 302 Cb 0.67 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.39 1fqj h GLU 302 CO -0.22 1.15 -0.22 1.25 -1.16 0.00 0.00 179.01 179.81 1fqj h LEU 303 N 0.62 -0.53 -1.81 1.33 5.85 -1.38 -3.18 115.31 116.21 1fqj h LEU 303 Ca 0.01 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1fqj h LEU 303 Cb 1.16 0.14 0.00 0.00 0.37 0.00 0.00 40.66 42.33 1fqj h LEU 303 CO 0.12 -0.18 0.00 -0.29 -0.34 0.00 0.00 178.44 177.75 1fqj h ILE 304 N -0.91 0.00 -0.04 4.05 2.10 -1.42 -2.22 117.51 119.08 1fqj h ILE 304 Ca -0.06 -0.40 0.00 0.00 1.08 0.00 0.00 64.86 65.48 1fqj h ILE 304 Cb 0.58 1.40 0.00 0.00 -1.09 0.00 0.00 36.82 37.71 1fqj h ILE 304 CO 0.10 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.71 1fqj n ARG 305 N -3.09 1.45 -4.22 2.19 5.12 -0.86 -4.75 116.66 112.51 1fqj n ARG 305 Ca -0.00 -0.66 -0.34 0.00 -1.93 0.00 0.00 57.85 54.92 1fqj n ARG 305 Cb 0.25 -1.44 -0.14 0.00 -1.16 0.00 0.00 32.46 29.97 1fqj n ARG 305 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1fqj s ASP 306 N -1.85 4.29 0.17 0.55 -1.08 -0.83 -5.03 116.67 112.88 1fqj s ASP 306 Ca 0.38 -0.33 -0.22 0.00 -0.52 0.00 0.00 52.55 51.86 1fqj s ASP 306 Cb 0.19 -1.71 0.07 0.00 -1.46 0.00 0.00 42.92 40.02 1fqj s ASP 306 CO 0.31 0.06 1.61 -0.65 0.52 0.00 0.00 175.17 177.02 1fqj h PRO 307 N 7.51 -0.21 -0.14 4.34 0.11 -1.86 0.12 132.00 141.87 1fqj h PRO 307 Ca -0.36 0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.68 1fqj h PRO 307 Cb 1.18 0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 1fqj h PRO 307 CO 0.60 -0.14 -0.31 -0.22 -0.21 0.00 0.00 178.00 177.72 1fqj h LYS 308 N -0.22 0.27 -0.31 1.05 1.63 -1.96 -2.36 116.57 114.66 1fqj h LYS 308 Ca 0.18 -0.10 -0.02 0.00 -0.85 0.00 0.00 60.65 59.86 1fqj h LYS 308 Cb 0.51 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 32.11 1fqj h LYS 308 CO -0.52 0.56 0.13 0.78 -3.45 0.00 0.00 179.45 176.94 1fqj h GLY 309 N 1.06 0.50 1.63 5.01 0.00 -1.25 -0.75 103.07 109.26 1fqj h GLY 309 Ca 0.03 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 47.03 1fqj h GLY 309 CO 0.05 0.26 -0.08 3.21 0.00 0.00 0.00 176.54 179.97 1fqj h ARG 310 N 0.36 0.46 -0.36 4.80 3.08 -0.69 0.12 114.38 122.15 1fqj h ARG 310 Ca 0.10 -0.12 -0.10 0.00 0.07 0.00 0.00 59.98 59.94 1fqj h ARG 310 Cb 0.18 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 1fqj h ARG 310 CO -0.01 0.55 -0.17 0.37 -1.07 0.00 0.00 179.97 179.64 1fqj h GLN 311 N 0.43 0.75 -0.43 0.04 4.15 -1.14 -0.33 115.11 118.58 1fqj h GLN 311 Ca 0.09 -0.33 -0.12 0.00 0.77 0.00 0.00 58.65 59.06 1fqj h GLN 311 Cb 0.42 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1fqj h GLN 311 CO 0.02 0.94 -0.20 1.03 -1.93 0.00 0.00 178.83 178.69 1fqj h SER 312 N 0.54 0.92 -0.70 -0.69 0.87 -0.73 -2.87 113.55 110.89 1fqj h SER 312 Ca 0.08 -0.40 -0.04 0.00 -1.23 0.00 0.00 61.79 60.20 1fqj h SER 312 Cb 0.71 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 62.39 1fqj h SER 312 CO 0.05 1.12 0.28 0.15 -0.53 0.00 0.00 176.83 177.90 1fqj h PHE 313 N 0.72 1.09 -0.71 2.24 3.57 -0.69 -2.76 116.94 120.39 1fqj h PHE 313 Ca 0.10 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1fqj h PHE 313 Cb 0.77 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1fqj h PHE 313 CO 0.06 0.83 0.39 0.37 -2.23 0.00 0.00 178.31 177.73 1fqj h GLN 314 N 1.05 1.00 -0.75 1.11 4.15 -0.89 0.48 115.11 121.25 1fqj h GLN 314 Ca 0.24 -0.12 0.07 0.00 0.77 0.00 0.00 58.65 59.62 1fqj h GLN 314 Cb 0.21 -0.19 -0.05 0.00 0.21 0.00 0.00 27.48 27.66 1fqj h GLN 314 CO -0.02 0.74 0.49 0.45 -1.93 0.00 0.00 178.83 178.57 1fqj h HIS 315 N 0.98 0.78 -0.07 3.99 3.86 -1.28 0.35 115.15 123.77 1fqj h HIS 315 Ca 0.25 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.43 1fqj h HIS 315 Cb 0.04 -0.26 0.00 0.00 1.06 0.00 0.00 27.41 28.25 1fqj h HIS 315 CO -0.00 0.40 -0.16 0.35 0.86 0.00 0.00 177.93 179.37 1fqj h PHE 316 N 0.76 0.30 -0.43 2.45 3.57 -1.21 -2.93 116.94 119.44 1fqj h PHE 316 Ca 0.33 -0.11 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 1fqj h PHE 316 Cb 0.30 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 1fqj h PHE 316 CO -0.00 0.77 0.22 -0.07 -2.23 0.00 0.00 178.31 177.00 1fqj h LEU 317 N -0.26 0.53 -0.96 0.59 3.38 -0.24 -0.96 115.31 117.38 1fqj h LEU 317 Ca -0.00 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1fqj h LEU 317 Cb 0.76 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 1fqj h LEU 317 CO 0.04 0.44 0.21 0.03 0.09 0.00 0.00 178.44 179.25 1fqj h ARG 318 N 0.60 0.97 -0.72 1.13 3.08 -0.96 0.24 114.38 118.71 1fqj h ARG 318 Ca 0.15 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1fqj h ARG 318 Cb 0.05 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.91 1fqj h ARG 318 CO -0.02 0.82 0.47 -0.22 -1.07 0.00 0.00 179.97 179.94 1fqj h LYS 319 N 0.94 0.96 -0.47 0.04 3.64 -1.00 -1.86 116.57 118.82 1fqj h LYS 319 Ca 0.21 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 1fqj h LYS 319 Cb 0.25 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1fqj h LYS 319 CO -0.01 0.65 0.00 0.39 -2.27 0.00 0.00 179.45 178.21 1fqj n GLU 320 N -4.41 2.20 -3.77 1.90 1.02 -0.71 -4.96 120.64 111.92 1fqj n GLU 320 Ca 0.08 -1.86 -0.25 0.00 -0.02 0.00 0.00 57.16 55.11 1fqj n GLU 320 Cb 0.04 -1.42 0.04 0.00 -0.02 0.00 0.00 31.44 30.08 1fqj n GLU 320 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 1fqj n PHE 321 N 1.02 -2.24 -2.28 -0.32 3.01 -0.10 -4.89 117.46 111.67 1fqj n PHE 321 Ca 0.18 0.90 0.04 0.00 1.01 0.00 0.00 57.45 59.58 1fqj n PHE 321 Cb 0.45 -4.34 0.06 0.00 -0.01 0.00 0.00 39.48 35.65 1fqj n PHE 321 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1fqj n SER 322 N -2.96 1.15 0.30 4.37 3.41 -0.21 -4.86 113.62 114.82 1fqj n SER 322 Ca -0.11 -2.44 0.20 0.00 -0.26 0.00 0.00 58.87 56.27 1fqj n SER 322 Cb 0.59 -0.35 0.96 0.00 -0.26 0.00 0.00 64.21 65.15 1fqj n SER 322 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1fqj h GLY 323 N 0.98 0.00 2.00 5.00 0.00 -1.90 -2.97 103.07 106.18 1fqj h GLY 323 Ca -0.17 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 1fqj h GLY 323 CO 0.08 0.00 -0.09 1.05 0.00 0.00 0.00 176.54 177.58 1fqj h GLU 324 N 0.00 0.00 -0.53 4.80 9.09 -1.90 -2.35 114.58 123.69 1fqj h GLU 324 Ca 0.00 0.00 -0.12 0.00 0.05 0.00 0.00 59.36 59.29 1fqj h GLU 324 Cb 0.23 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.31 1fqj h GLU 324 CO 0.00 0.09 -0.14 -0.91 0.05 0.00 0.00 179.01 178.10 1fqj h ASN 325 N 0.00 1.03 0.32 3.06 2.35 -1.88 0.86 115.58 121.33 1fqj h ASN 325 Ca -0.00 -0.36 -0.24 0.00 -0.55 0.00 0.00 56.30 55.15 1fqj h ASN 325 Cb 0.28 -0.28 0.01 0.00 0.05 0.00 0.00 38.32 38.37 1fqj h ASN 325 CO 0.01 1.16 -0.98 0.25 -1.65 0.00 0.00 177.43 176.22 1fqj h LEU 326 N 0.89 0.57 -0.70 1.61 5.85 -1.70 -2.21 115.31 119.63 1fqj h LEU 326 Ca 0.13 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.37 1fqj h LEU 326 Cb 0.71 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 1fqj h LEU 326 CO 0.05 1.27 0.36 1.23 -0.34 0.00 0.00 178.44 181.02 1fqj h GLY 327 N 1.16 1.05 1.34 3.75 0.00 -1.30 -2.10 103.07 106.97 1fqj h GLY 327 Ca -0.09 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.63 1fqj h GLY 327 CO 0.17 0.48 -0.21 -2.75 0.00 0.00 0.00 176.54 174.22 1fqj h PHE 328 N 0.96 0.86 -0.63 5.60 3.57 -0.77 -2.01 116.94 124.53 1fqj h PHE 328 Ca 0.24 -0.19 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 1fqj h PHE 328 Cb 0.07 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 1fqj h PHE 328 CO 0.00 0.91 0.11 2.35 -2.23 0.00 0.00 178.31 179.45 1fqj h TRP 329 N 0.67 1.10 -0.16 0.41 7.01 -1.04 -1.74 115.95 122.21 1fqj h TRP 329 Ca 0.09 -0.15 -0.16 0.00 2.11 0.00 0.00 58.89 60.79 1fqj h TRP 329 Cb 0.72 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 27.47 1fqj h TRP 329 CO 0.04 0.94 -0.56 0.93 -2.79 0.00 0.00 178.44 176.99 1fqj h GLU 330 N 0.96 0.50 -0.41 2.65 5.08 -1.34 -1.83 114.58 120.19 1fqj h GLU 330 Ca 0.19 -0.32 -0.05 0.00 -1.00 0.00 0.00 59.36 58.19 1fqj h GLU 330 Cb 0.42 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1fqj h GLU 330 CO 0.01 0.93 0.05 0.00 -1.00 0.00 0.00 179.01 179.00 1fqj h ALA 331 N 1.01 1.33 -0.12 3.43 0.00 -1.10 0.36 119.26 124.17 1fqj h ALA 331 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 1fqj h ALA 331 Cb 1.10 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1fqj h ALA 331 CO 0.10 0.46 -0.11 0.00 0.00 0.00 0.00 179.25 179.71 1fqj h GLU 333 N -0.10 0.98 -0.36 0.00 4.57 -0.98 -1.22 114.58 117.47 1fqj h GLU 333 Ca 0.02 -0.06 -0.08 0.00 -1.18 0.00 0.00 59.36 58.07 1fqj h GLU 333 Cb 0.62 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.97 1fqj h GLU 333 CO 0.03 0.65 -0.07 0.22 -1.18 0.00 0.00 179.01 178.65 1fqj h ASP 334 N 1.01 0.69 -0.48 1.04 3.58 -0.85 -1.82 116.42 119.59 1fqj h ASP 334 Ca 0.28 -0.36 0.02 0.00 0.42 0.00 0.00 57.03 57.39 1fqj h ASP 334 Cb -0.11 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 40.73 1fqj h ASP 334 CO -0.06 0.89 0.30 0.25 -2.88 0.00 0.00 179.24 177.73 1fqj h LEU 335 N 0.49 0.49 -0.11 2.28 5.85 -0.56 0.27 115.31 124.02 1fqj h LEU 335 Ca 0.09 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.79 1fqj h LEU 335 Cb 0.58 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.50 1fqj h LEU 335 CO 0.03 0.35 -0.02 0.11 -0.34 0.00 0.00 178.44 178.57 1fqj h LYS 336 N 0.59 0.21 -0.37 1.25 1.57 -1.16 -3.34 116.57 115.33 1fqj h LYS 336 Ca 0.19 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 1fqj h LYS 336 Cb -0.01 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1fqj h LYS 336 CO -0.07 0.50 0.00 0.66 -0.57 0.00 0.00 179.45 179.97 1fqj n TYR 337 N -4.77 0.48 -0.36 -1.35 0.53 -0.69 -4.95 117.16 106.06 1fqj n TYR 337 Ca -0.06 -0.33 0.00 0.00 -1.02 0.00 0.00 57.90 56.49 1fqj n TYR 337 Cb 0.23 -0.01 0.00 0.00 -1.03 0.00 0.00 39.34 38.53 1fqj n TYR 337 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1fqj n GLY 338 N 1.07 0.32 3.58 2.72 0.00 0.96 -4.93 105.19 108.92 1fqj n GLY 338 Ca 0.16 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 44.09 1fqj n GLY 338 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1fqj s ASP 339 N -1.00 6.03 0.00 1.61 2.15 -1.26 -4.86 116.67 119.34 1fqj s ASP 339 Ca 0.00 0.68 0.00 0.00 0.43 0.00 0.00 52.55 53.66 1fqj s ASP 339 Cb 0.00 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.08 1fqj s ASP 339 CO 0.00 -1.71 0.36 0.00 -0.17 0.00 0.00 175.17 173.65 1fqj n GLN 340 N 8.50 0.00 0.00 4.34 1.13 -1.26 -0.94 117.38 129.15 1fqj n GLN 340 Ca 0.17 0.00 0.11 0.00 -1.94 0.00 0.00 57.00 55.34 1fqj n GLN 340 Cb 0.49 -1.37 -0.06 0.00 0.11 0.00 0.00 30.24 29.40 1fqj n GLN 340 CO 0.00 0.00 0.00 -1.13 -1.44 0.00 0.00 177.06 174.49 1fqj n SER 341 N -0.86 0.69 -0.90 1.08 3.41 -1.26 -4.07 113.62 111.71 1fqj n SER 341 Ca 0.00 -0.57 0.12 0.00 -0.26 0.00 0.00 58.87 58.16 1fqj n SER 341 Cb 0.00 1.07 0.22 0.00 -0.26 0.00 0.00 64.21 65.24 1fqj n SER 341 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1fqj n LYS 342 N -1.75 2.23 -0.26 4.33 5.02 -0.12 -4.58 118.16 123.03 1fqj n LYS 342 Ca 0.02 -1.81 0.02 0.00 -2.02 0.00 0.00 58.31 54.52 1fqj n LYS 342 Cb 0.40 -1.47 0.09 0.00 -0.02 0.00 0.00 35.03 34.03 1fqj n LYS 342 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1fqj h VAL 343 N 4.10 0.25 -0.06 -0.18 2.07 -1.71 -0.04 116.25 120.68 1fqj h VAL 343 Ca 0.00 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 1fqj h VAL 343 Cb 0.88 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1fqj h VAL 343 CO 0.00 0.00 -0.02 0.50 0.02 0.00 0.00 177.57 178.07 1fqj h LYS 344 N 0.00 -0.01 0.62 1.57 3.64 -1.91 0.52 116.57 121.00 1fqj h LYS 344 Ca 0.36 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.71 1fqj h LYS 344 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1fqj h LYS 344 CO -0.77 -0.01 -0.33 0.93 -2.27 0.00 0.00 179.45 177.00 1fqj h GLU 345 N -0.01 -0.85 -0.82 1.90 4.39 -1.64 -1.84 114.58 115.71 1fqj h GLU 345 Ca 0.03 0.06 0.15 0.00 0.34 0.00 0.00 59.36 59.94 1fqj h GLU 345 Cb 0.06 0.19 -0.10 0.00 -0.10 0.00 0.00 28.75 28.80 1fqj h GLU 345 CO -0.07 -0.56 0.39 0.87 -1.16 0.00 0.00 179.01 178.48 1fqj h LYS 346 N -0.88 0.53 -0.56 2.33 1.57 -0.95 -0.13 116.57 118.48 1fqj h LYS 346 Ca -0.08 -0.03 -0.09 0.00 -1.87 0.00 0.00 60.65 58.58 1fqj h LYS 346 Cb 0.69 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 1fqj h LYS 346 CO 0.11 0.35 0.02 0.00 -0.57 0.00 0.00 179.45 179.36 1fqj h ALA 347 N 1.57 0.76 -0.62 3.86 0.00 -0.71 -0.12 119.26 124.00 1fqj h ALA 347 Ca 0.46 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 1fqj h ALA 347 Cb 0.69 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1fqj h ALA 347 CO -0.39 0.57 0.18 0.93 0.00 0.00 0.00 179.25 180.54 1fqj h GLU 348 N 0.87 0.97 -0.27 0.00 5.08 -0.39 -1.17 114.58 119.67 1fqj h GLU 348 Ca 0.16 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1fqj h GLU 348 Cb 0.52 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 1fqj h GLU 348 CO 0.03 0.87 0.06 1.49 -1.00 0.00 0.00 179.01 180.46 1fqj h GLU 349 N 0.89 0.44 -0.74 2.33 4.57 -0.84 -1.82 114.58 119.42 1fqj h GLU 349 Ca 0.20 -0.11 0.03 0.00 -1.18 0.00 0.00 59.36 58.30 1fqj h GLU 349 Cb 0.32 -0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.80 1fqj h GLU 349 CO -0.00 0.53 0.47 0.82 -1.18 0.00 0.00 179.01 179.65 1fqj h ILE 350 N 0.27 1.11 -0.39 2.32 2.04 -0.86 -0.73 117.51 121.28 1fqj h ILE 350 Ca 0.08 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.63 1fqj h ILE 350 Cb 0.30 0.12 -0.02 0.00 -0.74 0.00 0.00 36.82 36.47 1fqj h ILE 350 CO 0.00 0.17 0.24 0.22 0.00 0.00 0.00 178.15 178.78 1fqj h TYR 351 N 0.92 0.50 -0.53 1.37 3.20 -1.02 0.23 116.97 121.64 1fqj h TYR 351 Ca 0.29 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.12 1fqj h TYR 351 Cb 0.00 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.08 1fqj h TYR 351 CO -0.04 0.35 0.15 -0.22 -1.64 0.00 0.00 178.16 176.76 1fqj h LYS 352 N 0.51 0.80 0.06 1.82 3.64 -0.89 0.18 116.57 122.69 1fqj h LYS 352 Ca 0.14 -0.15 -0.32 0.00 -1.27 0.00 0.00 60.65 59.05 1fqj h LYS 352 Cb -0.02 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 31.65 1fqj h LYS 352 CO -0.03 0.71 -1.76 1.25 -2.27 0.00 0.00 179.45 177.35 1fqj h LEU 353 N 0.78 0.20 0.00 5.20 5.85 -0.81 -3.42 115.31 123.11 1fqj h LEU 353 Ca 0.18 -0.41 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 1fqj h LEU 353 Cb 0.26 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.22 1fqj h LEU 353 CO -0.01 1.36 -1.11 0.49 -0.34 0.00 0.00 178.44 178.84 1fqj n PHE 354 N -3.26 0.00 -0.07 1.25 3.01 0.77 -1.43 117.46 117.72 1fqj n PHE 354 Ca -0.21 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.16 1fqj n PHE 354 Cb 1.05 -0.06 -0.09 0.00 -0.01 0.00 0.00 39.48 40.36 1fqj n PHE 354 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1fqj n LEU 355 N -1.71 1.45 -4.67 4.37 4.77 -0.70 -1.72 117.00 118.79 1fqj n LEU 355 Ca -0.01 -0.04 -0.41 0.00 -0.03 0.00 0.00 56.01 55.51 1fqj n LEU 355 Cb 0.19 -0.12 0.01 0.00 -2.33 0.00 0.00 43.42 41.17 1fqj n LEU 355 CO 0.04 0.55 0.78 0.00 -1.33 0.00 0.00 177.39 177.43 1fqj n ALA 356 N -2.73 0.90 -1.67 -1.18 0.00 0.54 -4.83 120.51 111.55 1fqj n ALA 356 Ca -0.25 0.26 -0.48 0.00 0.00 0.00 0.00 53.44 52.97 1fqj n ALA 356 Cb 0.87 -2.20 -0.05 0.00 0.00 0.00 0.00 19.45 18.07 1fqj n ALA 356 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1fqj n PRO 357 N 0.11 2.03 -1.02 0.00 -0.02 -1.26 -0.60 135.00 134.24 1fqj n PRO 357 Ca 0.07 0.74 -0.01 0.00 -2.02 0.00 0.00 63.50 62.28 1fqj n PRO 357 Cb 0.39 -2.51 -0.00 0.00 -0.02 0.00 0.00 33.50 31.35 1fqj n PRO 357 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fqj n GLY 358 N 3.68 0.48 3.62 -1.23 0.00 -1.26 -5.00 105.19 105.48 1fqj n GLY 358 Ca 0.19 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.50 1fqj n GLY 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fqj n ALA 359 N 1.01 0.30 -0.18 4.61 0.00 0.23 -4.87 120.51 121.61 1fqj n ALA 359 Ca -0.01 0.05 0.17 0.00 0.00 0.00 0.00 53.44 53.66 1fqj n ALA 359 Cb 0.04 -2.12 0.52 0.00 0.00 0.00 0.00 19.45 17.89 1fqj n ALA 359 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fqj h ARG 360 N 0.75 0.37 -0.73 0.00 2.47 -1.80 -1.69 114.38 113.75 1fqj h ARG 360 Ca -0.48 -0.02 -0.47 0.00 -1.26 0.00 0.00 59.98 57.75 1fqj h ARG 360 Cb 1.35 -0.08 -0.42 0.00 -1.65 0.00 0.00 29.97 29.17 1fqj h ARG 360 CO 0.52 0.25 -0.90 0.54 0.56 0.00 0.00 179.97 180.94 1fqj n ARG 361 N -4.47 3.09 -1.67 0.04 1.74 -0.52 -5.07 116.66 109.79 1fqj n ARG 361 Ca 0.15 -4.01 -0.52 0.00 -0.77 0.00 0.00 57.85 52.70 1fqj n ARG 361 Cb 0.58 -2.09 -0.06 0.00 -1.02 0.00 0.00 32.46 29.88 1fqj n ARG 361 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98 1fqj n TRP 362 N -0.65 2.04 -3.06 -1.55 -0.00 -0.64 -4.42 117.44 109.16 1fqj n TRP 362 Ca 0.34 0.38 -0.26 0.00 -0.00 0.00 0.00 57.50 57.96 1fqj n TRP 362 Cb 0.90 -2.50 -0.01 0.00 -0.00 0.00 0.00 31.31 29.71 1fqj n TRP 362 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 177.69 178.65 1fqj s ILE 363 N 2.69 5.02 -1.14 5.87 -4.36 -0.70 -5.02 121.20 123.56 1fqj s ILE 363 Ca 0.91 -0.14 -0.13 0.00 -0.26 0.00 0.00 60.65 61.03 1fqj s ILE 363 Cb -0.90 -3.85 0.20 0.00 1.25 0.00 0.00 42.46 39.16 1fqj s ILE 363 CO 0.54 -0.66 1.29 0.21 0.24 0.00 0.00 174.94 176.57 1fqj s ASN 364 N -3.99 7.09 0.25 4.36 3.84 -1.26 -5.00 114.94 120.23 1fqj s ASN 364 Ca 0.43 -3.07 0.10 0.00 0.21 0.00 0.00 52.86 50.54 1fqj s ASN 364 Cb -0.10 -2.34 -0.05 0.00 -0.55 0.00 0.00 41.25 38.21 1fqj s ASN 364 CO 0.39 -0.64 -0.18 0.27 -2.79 0.00 0.00 177.10 174.15 1fqj s ILE 365 N 0.84 2.18 0.83 -5.21 -4.36 -1.26 -4.89 121.20 109.32 1fqj s ILE 365 Ca 0.38 -2.32 -0.12 0.00 -0.26 0.00 0.00 60.65 58.33 1fqj s ILE 365 Cb -0.05 -2.19 0.09 0.00 1.25 0.00 0.00 42.46 41.56 1fqj s ILE 365 CO -0.03 -0.47 1.12 1.51 0.24 0.00 0.00 174.94 177.30 1fqj s ASP 366 N -3.40 4.23 0.18 4.36 -4.77 -1.26 -4.85 116.67 111.15 1fqj s ASP 366 Ca 0.27 1.15 -0.13 0.00 -3.30 0.00 0.00 52.55 50.54 1fqj s ASP 366 Cb -0.03 -1.82 0.15 0.00 -1.09 0.00 0.00 42.92 40.13 1fqj s ASP 366 CO 0.12 -2.12 1.79 1.23 0.70 0.00 0.00 175.17 176.88 1fqj h GLY 367 N -1.19 0.74 0.94 2.12 0.00 -2.00 -1.48 103.07 102.19 1fqj h GLY 367 Ca -0.48 -0.18 -0.03 0.00 0.00 0.00 0.00 47.33 46.64 1fqj h GLY 367 CO 0.61 0.12 -0.30 0.50 0.00 0.00 0.00 176.54 177.47 1fqj h LYS 368 N 0.52 -0.80 -0.64 4.80 1.57 -1.99 0.12 116.57 120.16 1fqj h LYS 368 Ca 0.23 0.05 0.13 0.00 -1.87 0.00 0.00 60.65 59.20 1fqj h LYS 368 Cb 0.14 0.18 -0.10 0.00 0.08 0.00 0.00 32.23 32.54 1fqj h LYS 368 CO -0.16 -0.51 0.11 1.15 -0.57 0.00 0.00 179.45 179.47 1fqj h THR 369 N -0.90 0.57 -0.04 -0.16 2.02 -1.93 0.13 112.91 112.59 1fqj h THR 369 Ca -0.08 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1fqj h THR 369 Cb 0.66 0.33 -0.00 0.00 -1.74 0.00 0.00 68.15 67.39 1fqj h THR 369 CO 0.14 0.04 0.03 -0.03 0.37 0.00 0.00 175.52 176.07 1fqj h MET 370 N 0.22 0.06 -0.39 6.66 1.85 -1.09 -0.78 114.93 121.46 1fqj h MET 370 Ca 0.34 -0.01 0.07 0.00 -0.61 0.00 0.00 59.70 59.50 1fqj h MET 370 Cb 0.54 -0.01 -0.07 0.00 0.43 0.00 0.00 31.60 32.49 1fqj h MET 370 CO -0.46 0.09 -0.03 -0.44 -0.40 0.00 0.00 176.91 175.67 1fqj h ASP 371 N 0.02 -0.23 -0.56 1.39 3.32 0.61 0.24 116.42 121.21 1fqj h ASP 371 Ca 0.02 0.10 0.06 0.00 0.02 0.00 0.00 57.03 57.23 1fqj h ASP 371 Cb 0.04 0.19 -0.05 0.00 0.22 0.00 0.00 39.33 39.73 1fqj h ASP 371 CO -0.00 -0.07 0.26 0.40 -1.72 0.00 0.00 179.24 178.10 1fqj h ILE 372 N 0.07 0.89 -0.22 0.35 2.04 -0.49 -1.40 117.51 118.75 1fqj h ILE 372 Ca 0.19 -0.17 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1fqj h ILE 372 Cb 0.28 0.36 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 1fqj h ILE 372 CO -0.35 0.09 0.01 0.74 0.00 0.00 0.00 178.15 178.64 1fqj h THR 373 N 0.49 1.25 -0.32 -0.27 2.02 0.02 -1.69 112.91 114.41 1fqj h THR 373 Ca 0.26 -0.85 -0.03 0.00 0.77 0.00 0.00 66.41 66.56 1fqj h THR 373 Cb 0.22 1.37 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 1fqj h THR 373 CO -0.21 0.26 0.07 0.58 0.37 0.00 0.00 175.52 176.59 1fqj h VAL 374 N 0.16 1.16 -0.04 3.16 2.07 -0.34 0.35 116.25 122.76 1fqj h VAL 374 Ca 0.06 -0.56 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1fqj h VAL 374 Cb 0.38 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1fqj h VAL 374 CO 0.01 0.20 -0.07 0.50 0.02 0.00 0.00 177.57 178.23 1fqj h LYS 375 N 0.46 0.11 -0.93 1.57 3.64 -1.17 -3.18 116.57 117.07 1fqj h LYS 375 Ca 0.11 -0.07 0.06 0.00 -1.27 0.00 0.00 60.65 59.47 1fqj h LYS 375 Cb 0.20 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.97 1fqj h LYS 375 CO -0.00 0.66 0.60 0.78 -2.27 0.00 0.00 179.45 179.22 1fqj h GLY 376 N -0.41 1.37 2.00 5.01 0.00 -0.93 -1.01 103.07 109.09 1fqj h GLY 376 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1fqj h GLY 376 CO 0.02 0.32 0.00 1.41 0.00 0.00 0.00 176.54 178.29 1fqj h LEU 377 N 1.08 0.00 -1.64 3.11 3.38 -0.92 -1.01 115.31 119.31 1fqj h LEU 377 Ca 0.40 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.34 1fqj h LEU 377 Cb 0.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1fqj h LEU 377 CO -0.15 0.00 0.01 0.11 0.09 0.00 0.00 178.44 178.50 1fqj h LYS 378 N 0.00 0.23 -2.31 1.13 1.79 -1.19 -3.25 116.57 112.98 1fqj h LYS 378 Ca 0.00 -0.03 -0.58 0.00 -2.18 0.00 0.00 60.65 57.86 1fqj h LYS 378 Cb 0.07 -0.04 -0.39 0.00 -1.58 0.00 0.00 32.23 30.29 1fqj h LYS 378 CO 0.00 0.25 -0.96 0.72 -1.08 0.00 0.00 179.45 178.38 1fqj n HIS 379 N -4.41 -0.07 -1.08 -1.35 8.25 -0.39 -5.14 115.22 111.04 1fqj n HIS 379 Ca -0.00 -3.53 -0.36 0.00 -0.26 0.00 0.00 57.72 53.56 1fqj n HIS 379 Cb 0.16 -0.06 0.05 0.00 1.12 0.00 0.00 29.99 31.25 1fqj n HIS 379 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1fqj n PRO 380 N 2.18 0.01 -3.61 -0.41 -0.02 -1.20 -4.96 135.00 126.99 1fqj n PRO 380 Ca 0.26 0.02 -0.04 0.00 -2.02 0.00 0.00 63.50 61.72 1fqj n PRO 380 Cb 0.48 -1.26 -0.02 0.00 -0.02 0.00 0.00 33.50 32.67 1fqj n PRO 380 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1fqj s HIS 381 N -2.04 -0.09 0.14 6.00 -3.43 -1.26 -4.99 115.29 109.61 1fqj s HIS 381 Ca 0.51 0.06 -0.13 0.00 -0.80 0.00 0.00 55.06 54.70 1fqj s HIS 381 Cb -0.29 0.51 0.12 0.00 -1.43 0.00 0.00 32.58 31.49 1fqj s HIS 381 CO 0.73 -0.14 1.00 -2.13 -2.00 0.00 0.00 174.74 172.19 1fqj n ARG 382 N -0.04 -0.18 -0.95 -0.38 0.63 -1.26 -1.01 116.66 113.48 1fqj n ARG 382 Ca 0.02 0.99 -0.08 0.00 -0.92 0.00 0.00 57.85 57.85 1fqj n ARG 382 Cb 0.58 -1.46 0.24 0.00 0.45 0.00 0.00 32.46 32.26 1fqj n ARG 382 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1fqj n TYR 383 N -4.92 2.07 0.30 -0.14 4.01 -1.26 -4.08 117.16 113.14 1fqj n TYR 383 Ca 0.06 -1.43 0.18 0.00 -0.16 0.00 0.00 57.90 56.54 1fqj n TYR 383 Cb 0.24 -0.66 0.80 0.00 -0.31 0.00 0.00 39.34 39.42 1fqj n TYR 383 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 1fqj h VAL 384 N 1.69 0.00 -0.53 -0.72 3.04 -1.47 -2.60 116.25 115.66 1fqj h VAL 384 Ca 0.32 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.73 1fqj h VAL 384 Cb 2.19 1.19 0.00 0.00 -2.01 0.00 0.00 31.29 32.66 1fqj h VAL 384 CO 0.68 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 177.42 1fqj n LEU 385 N -2.89 3.44 -0.26 3.16 4.77 -1.26 -4.68 117.00 119.29 1fqj n LEU 385 Ca -0.00 -1.96 0.04 0.00 -0.03 0.00 0.00 56.01 54.05 1fqj n LEU 385 Cb 0.20 -0.36 0.17 0.00 -2.33 0.00 0.00 43.42 41.11 1fqj n LEU 385 CO 0.22 0.85 1.06 0.44 -1.33 0.00 0.00 177.39 178.64 1fqj h ASP 386 N 3.25 0.44 0.04 -1.43 5.19 -1.82 0.78 116.42 122.87 1fqj h ASP 386 Ca 0.00 0.08 -0.00 0.00 -0.62 0.00 0.00 57.03 56.49 1fqj h ASP 386 Cb 0.87 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.39 1fqj h ASP 386 CO 0.00 0.22 -0.02 0.00 -3.12 0.00 0.00 179.24 176.32 1fqj h ALA 387 N 1.49 -0.06 -0.53 3.45 0.00 -1.84 -1.49 119.26 120.28 1fqj h ALA 387 Ca 0.39 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1fqj h ALA 387 Cb 0.49 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1fqj h ALA 387 CO -0.32 -0.49 0.21 0.00 0.00 0.00 0.00 179.25 178.65 1fqj h ALA 388 N 0.82 0.69 -0.89 0.00 0.00 -1.80 -2.53 119.26 115.55 1fqj h ALA 388 Ca -0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.73 1fqj h ALA 388 Cb 0.12 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 1fqj h ALA 388 CO 0.01 0.30 0.49 0.37 0.00 0.00 0.00 179.25 180.42 1fqj h GLN 389 N 0.72 1.24 -0.52 0.00 4.15 -0.72 -1.21 115.11 118.78 1fqj h GLN 389 Ca 0.18 -0.14 -0.08 0.00 0.77 0.00 0.00 58.65 59.37 1fqj h GLN 389 Cb 0.20 -0.24 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 1fqj h GLN 389 CO -0.01 0.91 0.01 1.15 -1.93 0.00 0.00 178.83 178.95 1fqj h THR 390 N 1.25 1.26 -0.14 2.39 2.02 -1.14 0.39 112.91 118.94 1fqj h THR 390 Ca 0.31 -1.08 -0.00 0.00 0.77 0.00 0.00 66.41 66.41 1fqj h THR 390 Cb 0.03 0.94 -0.01 0.00 -1.74 0.00 0.00 68.15 67.37 1fqj h THR 390 CO -0.05 0.38 0.08 -0.74 0.37 0.00 0.00 175.52 175.56 1fqj h HIS 391 N 0.78 0.18 -0.25 3.16 -0.00 -1.10 -1.27 115.15 116.64 1fqj h HIS 391 Ca 0.15 -0.00 -0.08 0.00 -0.00 0.00 0.00 60.37 60.44 1fqj h HIS 391 Cb 0.51 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.85 1fqj h HIS 391 CO 0.04 0.16 -0.18 0.82 -0.00 0.00 0.00 177.93 178.77 1fqj h ILE 392 N 0.15 1.24 0.09 6.26 1.08 -1.11 -0.84 117.51 124.37 1fqj h ILE 392 Ca 0.05 -1.09 -0.00 0.00 -0.39 0.00 0.00 64.86 63.42 1fqj h ILE 392 Cb 0.03 1.24 0.00 0.00 -3.07 0.00 0.00 36.82 35.03 1fqj h ILE 392 CO -0.01 0.35 -0.04 0.22 -0.69 0.00 0.00 178.15 177.98 1fqj h TYR 393 N 0.41 -0.12 -0.08 1.37 3.20 -0.52 -2.41 116.97 118.83 1fqj h TYR 393 Ca 0.07 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 1fqj h TYR 393 Cb 0.55 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1fqj h TYR 393 CO 0.02 -0.01 -0.16 0.52 -1.64 0.00 0.00 178.16 176.88 1fqj h MET 394 N -0.19 0.12 -0.20 1.82 2.86 -1.01 -1.61 114.93 116.72 1fqj h MET 394 Ca -0.01 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1fqj h MET 394 Cb 0.15 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.78 1fqj h MET 394 CO 0.02 0.28 0.12 1.25 1.06 0.00 0.00 176.91 179.65 1fqj h LEU 395 N 0.11 0.20 -0.32 1.22 5.85 -0.72 -1.58 115.31 120.07 1fqj h LEU 395 Ca 0.02 -0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.64 1fqj h LEU 395 Cb 0.36 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 1fqj h LEU 395 CO 0.02 0.15 -0.20 0.24 -0.34 0.00 0.00 178.44 178.31 1fqj h MET 396 N 0.25 0.70 -0.06 1.25 2.86 -1.10 -2.36 114.93 116.47 1fqj h MET 396 Ca 0.08 -0.32 0.02 0.00 -2.06 0.00 0.00 59.70 57.41 1fqj h MET 396 Cb -0.01 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 1fqj h MET 396 CO -0.03 0.93 -0.03 -0.22 1.06 0.00 0.00 176.91 178.61 1fqj h LYS 397 N 0.47 -0.03 -0.00 1.72 3.64 -1.20 0.31 116.57 121.48 1fqj h LYS 397 Ca 0.07 0.00 -0.20 0.00 -1.27 0.00 0.00 60.65 59.25 1fqj h LYS 397 Cb 0.74 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 1fqj h LYS 397 CO 0.06 -0.02 -0.88 0.87 -2.27 0.00 0.00 179.45 177.20 1fqj h LYS 398 N -0.04 0.26 0.00 1.90 1.79 -1.35 -3.37 116.57 115.76 1fqj h LYS 398 Ca 0.04 -0.28 0.00 0.00 -2.18 0.00 0.00 60.65 58.23 1fqj h LYS 398 Cb 0.09 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 30.81 1fqj h LYS 398 CO -0.08 0.99 -0.11 -3.47 -1.08 0.00 0.00 179.45 175.70 1fqj n ASP 399 N -3.69 0.24 -0.17 0.86 2.03 -0.89 -4.70 116.55 110.23 1fqj n ASP 399 Ca -0.04 0.04 -0.09 0.00 0.52 0.00 0.00 54.79 55.21 1fqj n ASP 399 Cb 0.80 -0.44 0.00 0.00 -0.72 0.00 0.00 41.12 40.77 1fqj n ASP 399 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1fqj h SER 400 N -0.11 0.74 -0.33 1.67 0.02 -1.54 -3.30 113.55 110.71 1fqj h SER 400 Ca 0.00 -0.25 0.05 0.00 -0.84 0.00 0.00 61.79 60.76 1fqj h SER 400 Cb 0.11 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.40 1fqj h SER 400 CO 0.00 0.80 0.03 0.22 -1.14 0.00 0.00 176.83 176.74 1fqj h TYR 401 N 0.65 0.03 -0.53 3.45 3.20 -0.57 -0.32 116.97 122.89 1fqj h TYR 401 Ca 0.15 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.10 1fqj h TYR 401 Cb 0.36 0.03 -0.05 0.00 1.54 0.00 0.00 36.73 38.61 1fqj h TYR 401 CO 0.02 -0.03 0.23 0.00 -1.64 0.00 0.00 178.16 176.75 1fqj h ALA 402 N 1.27 0.68 -0.10 1.82 0.00 -1.72 -1.44 119.26 119.76 1fqj h ALA 402 Ca 0.16 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 1fqj h ALA 402 Cb 0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1fqj h ALA 402 CO -0.24 -0.15 -0.44 0.00 0.00 0.00 0.00 179.25 178.42 1fqj h ARG 403 N 0.44 0.24 -0.15 0.00 3.08 -1.55 -3.13 114.38 113.32 1fqj h ARG 403 Ca 0.25 -0.12 0.03 0.00 0.07 0.00 0.00 59.98 60.21 1fqj h ARG 403 Cb 0.23 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.25 1fqj h ARG 403 CO -0.22 0.64 -0.04 -0.92 -1.07 0.00 0.00 179.97 178.37 1fqj h TYR 404 N 0.20 -0.08 -0.03 3.04 3.20 -0.01 -1.53 116.97 121.76 1fqj h TYR 404 Ca 0.01 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.91 1fqj h TYR 404 Cb 0.86 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 39.19 1fqj h TYR 404 CO 0.02 -0.07 0.05 -0.07 -1.64 0.00 0.00 178.16 176.45 1fqj h LEU 405 N 0.00 0.00 -1.77 2.82 3.38 -1.36 -0.98 115.31 117.41 1fqj h LEU 405 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1fqj h LEU 405 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1fqj h LEU 405 CO -0.16 0.00 -0.07 0.29 0.09 0.00 0.00 178.44 178.59 1fqj n LYS 406 N -3.61 2.15 -1.92 1.13 5.02 -0.73 -4.76 118.16 115.43 1fqj n LYS 406 Ca -0.02 -1.77 -0.31 0.00 -2.02 0.00 0.00 58.31 54.19 1fqj n LYS 406 Cb 0.14 -1.46 0.02 0.00 -0.02 0.00 0.00 35.03 33.70 1fqj n LYS 406 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1fqj s SER 407 N -2.07 6.10 0.34 4.39 1.04 -0.37 -4.95 113.70 118.18 1fqj s SER 407 Ca 0.27 1.34 0.05 0.00 0.48 0.00 0.00 55.95 58.09 1fqj s SER 407 Cb 0.20 -2.36 0.62 0.00 0.10 0.00 0.00 66.02 64.58 1fqj s SER 407 CO 0.34 -0.93 1.86 -0.65 0.98 0.00 0.00 173.24 174.84 1fqj h PRO 408 N -0.34 0.45 -0.22 4.02 0.11 -1.92 -2.31 132.00 131.79 1fqj h PRO 408 Ca -0.44 -0.11 0.03 0.00 0.11 0.00 0.00 66.00 65.59 1fqj h PRO 408 Cb 1.20 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 1fqj h PRO 408 CO 0.62 0.53 0.03 0.82 -0.21 0.00 0.00 178.00 179.79 1fqj h ILE 409 N 0.42 0.88 -0.29 4.15 2.04 -1.93 0.11 117.51 122.90 1fqj h ILE 409 Ca 0.09 -0.04 -0.19 0.00 1.00 0.00 0.00 64.86 65.72 1fqj h ILE 409 Cb 0.39 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 37.22 1fqj h ILE 409 CO 0.02 0.02 -0.55 0.22 0.00 0.00 0.00 178.15 177.86 1fqj h TYR 410 N 0.12 1.09 -0.35 1.37 3.20 -1.69 -2.08 116.97 118.63 1fqj h TYR 410 Ca 0.10 -0.39 -0.02 0.00 3.14 0.00 0.00 58.73 61.57 1fqj h TYR 410 Cb 0.11 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 1fqj h TYR 410 CO -0.16 1.22 0.14 0.87 -1.64 0.00 0.00 178.16 178.59 1fqj h LYS 411 N 0.67 0.48 -0.21 1.82 1.57 -1.19 -1.29 116.57 118.42 1fqj h LYS 411 Ca 0.01 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.56 1fqj h LYS 411 Cb 1.16 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.37 1fqj h LYS 411 CO 0.12 0.40 -0.58 1.49 -0.57 0.00 0.00 179.45 180.31 1fqj h GLU 412 N 0.48 0.67 -0.75 3.15 4.81 -0.81 -1.74 114.58 120.39 1fqj h GLU 412 Ca 0.12 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1fqj h GLU 412 Cb 0.10 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 1fqj h GLU 412 CO -0.01 1.06 0.48 0.52 -0.73 0.00 0.00 179.01 180.33 1fqj h MET 413 N 0.51 1.00 -0.51 1.92 2.86 -0.55 -0.68 114.93 119.48 1fqj h MET 413 Ca 0.00 -0.07 -0.11 0.00 -2.06 0.00 0.00 59.70 57.46 1fqj h MET 413 Cb 1.16 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 32.58 1fqj h MET 413 CO 0.12 0.68 -0.11 -0.07 1.06 0.00 0.00 176.91 178.58 1fqj h LEU 414 N 1.03 0.95 0.60 1.22 3.38 -1.11 -2.40 115.31 118.99 1fqj h LEU 414 Ca 0.27 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1fqj h LEU 414 Cb -0.09 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 40.41 1fqj h LEU 414 CO -0.06 1.07 -0.29 0.00 0.09 0.00 0.00 178.44 179.25 1fqj h ALA 415 N 1.02 -1.11 0.00 1.53 0.00 -0.31 -2.82 119.26 117.57 1fqj h ALA 415 Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1fqj h ALA 415 Cb 0.65 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1fqj h ALA 415 CO 0.05 -1.05 0.00 1.63 0.00 0.00 0.00 179.25 179.88 1fqj n LYS 416 N -4.39 0.07 -1.69 0.00 4.01 -0.38 -4.75 118.16 111.04 1fqj n LYS 416 Ca -0.10 0.25 -0.45 0.00 -0.51 0.00 0.00 58.31 57.50 1fqj n LYS 416 Cb 0.32 -1.50 -0.04 0.00 -0.51 0.00 0.00 35.03 33.30 1fqj n LYS 416 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1fqj n ALA 417 N -1.30 1.79 0.40 7.82 0.00 -0.90 -4.99 120.51 123.32 1fqj n ALA 417 Ca 0.02 0.38 0.03 0.00 0.00 0.00 0.00 53.44 53.88 1fqj n ALA 417 Cb 0.04 -2.47 0.19 0.00 0.00 0.00 0.00 19.45 17.22 1fqj n ALA 417 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01