#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h7x h LEU 305 N 0.00 0.64 -0.79 1.09 3.38 -2.04 -2.94 115.31 114.65 3h7x h LEU 305 Ca 0.00 -0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.13 3h7x h LEU 305 Cb 0.00 -0.15 -0.14 0.00 0.09 0.00 0.00 40.66 40.46 3h7x h LEU 305 CO 0.00 0.46 -0.06 0.11 0.09 0.00 0.00 178.44 179.04 3h7x h LYS 306 N 0.76 0.06 -0.04 1.13 1.57 -2.04 1.00 116.57 119.00 3h7x h LYS 306 Ca 0.22 -0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 58.84 3h7x h LYS 306 Cb -0.06 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 3h7x h LYS 306 CO -0.06 0.04 -0.66 1.15 -0.57 0.00 0.00 179.45 179.35 3h7x h THR 307 N 0.06 1.42 -0.02 -0.16 2.02 -1.97 -1.68 112.91 112.59 3h7x h THR 307 Ca 0.42 -2.15 -0.02 0.00 0.77 0.00 0.00 66.41 65.43 3h7x h THR 307 Cb 0.73 2.13 0.00 0.00 -1.74 0.00 0.00 68.15 69.27 3h7x h THR 307 CO -0.74 0.63 -0.08 0.00 0.37 0.00 0.00 175.52 175.70 3h7x h ALA 308 N 1.20 0.03 -0.90 6.16 0.00 -0.98 -2.86 119.26 121.91 3h7x h ALA 308 Ca -0.01 -0.37 0.14 0.00 0.00 0.00 0.00 54.91 54.67 3h7x h ALA 308 Cb 1.18 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.90 3h7x h ALA 308 CO 0.10 -0.07 0.58 -0.91 0.00 0.00 0.00 179.25 178.94 3h7x h ASN 309 N -0.55 0.70 1.68 0.00 4.21 0.92 -1.31 115.58 121.23 3h7x h ASN 309 Ca -0.01 0.04 0.00 0.00 1.21 0.00 0.00 56.30 57.54 3h7x h ASN 309 Cb 0.75 -0.10 0.00 0.00 -1.12 0.00 0.00 38.32 37.85 3h7x h ASN 309 CO 0.02 0.36 -0.21 -1.28 -1.29 0.00 0.00 177.43 175.04 3h7x h SER 310 N 0.75 0.00 0.21 5.81 0.87 -1.35 -1.68 113.55 118.15 3h7x h SER 310 Ca 0.45 -0.01 -0.27 0.00 -1.23 0.00 0.00 61.79 60.72 3h7x h SER 310 Cb 0.66 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.63 3h7x h SER 310 CO -0.21 0.01 -1.14 0.22 -0.53 0.00 0.00 176.83 175.18 3h7x h TYR 311 N 0.00 0.87 0.09 2.24 3.20 -1.14 -3.13 116.97 119.11 3h7x h TYR 311 Ca 0.00 -0.53 0.02 0.00 3.14 0.00 0.00 58.73 61.37 3h7x h TYR 311 Cb 0.94 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 39.10 3h7x h TYR 311 CO 0.00 1.37 -0.25 1.15 -1.64 0.00 0.00 178.16 178.78 3h7x h THR 312 N 0.27 0.44 -0.56 1.81 2.02 -1.14 -1.41 112.91 114.34 3h7x h THR 312 Ca -0.15 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.06 3h7x h THR 312 Cb 1.80 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 68.62 3h7x h THR 312 CO 0.21 0.00 0.37 0.44 0.37 0.00 0.00 175.52 176.91 3h7x h ASP 313 N -0.44 0.59 0.13 4.18 3.32 -1.35 0.20 116.42 123.05 3h7x h ASP 313 Ca 0.04 -0.01 -0.21 0.00 0.02 0.00 0.00 57.03 56.87 3h7x h ASP 313 Cb 0.48 -0.14 0.02 0.00 0.22 0.00 0.00 39.33 39.91 3h7x h ASP 313 CO -0.17 0.41 -0.90 0.58 -1.72 0.00 0.00 179.24 177.45 3h7x h VAL 314 N 0.69 1.45 -0.23 -1.35 2.07 -1.47 -2.45 116.25 114.95 3h7x h VAL 314 Ca 0.22 -2.47 -0.09 0.00 0.82 0.00 0.00 66.70 65.18 3h7x h VAL 314 Cb 0.03 3.04 -0.00 0.00 -1.52 0.00 0.00 31.29 32.84 3h7x h VAL 314 CO -0.06 0.71 -0.20 0.74 0.02 0.00 0.00 177.57 178.79 3h7x h THR 315 N -0.20 1.32 0.03 2.57 2.02 -0.60 -2.19 112.91 115.86 3h7x h THR 315 Ca -0.15 -1.34 -0.00 0.00 0.77 0.00 0.00 66.41 65.69 3h7x h THR 315 Cb 1.68 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 69.77 3h7x h THR 315 CO 0.17 0.42 -0.02 0.58 0.37 0.00 0.00 175.52 177.04 3h7x h VAL 316 N 0.23 1.03 -0.76 3.16 2.07 -0.72 -0.93 116.25 120.33 3h7x h VAL 316 Ca 0.04 -0.18 0.05 0.00 0.82 0.00 0.00 66.70 67.43 3h7x h VAL 316 Cb 0.74 1.14 -0.05 0.00 -1.52 0.00 0.00 31.29 31.61 3h7x h VAL 316 CO 0.05 0.04 0.50 0.28 0.02 0.00 0.00 177.57 178.47 3h7x h SER 317 N -0.12 0.77 0.34 0.57 0.02 -1.46 0.21 113.55 113.88 3h7x h SER 317 Ca -0.00 -0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 3h7x h SER 317 Cb 0.11 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 3h7x h SER 317 CO 0.01 0.52 -0.45 0.78 -1.14 0.00 0.00 176.83 176.54 3h7x h ASN 318 N 0.88 0.14 1.01 3.07 2.35 -1.15 -3.11 115.58 118.78 3h7x h ASN 318 Ca 0.31 -0.06 -0.18 0.00 -0.55 0.00 0.00 56.30 55.82 3h7x h ASN 318 Cb 0.13 -0.04 -0.03 0.00 0.05 0.00 0.00 38.32 38.43 3h7x h ASN 318 CO -0.10 0.58 -0.87 -1.28 -1.65 0.00 0.00 177.43 174.11 3h7x h SER 319 N 0.11 0.00 -0.38 5.81 0.87 0.20 -2.31 113.55 117.86 3h7x h SER 319 Ca 0.01 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.62 3h7x h SER 319 Cb 0.84 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.75 3h7x h SER 319 CO 0.06 0.87 0.10 0.74 -0.53 0.00 0.00 176.83 178.08 3h7x h THR 320 N 0.00 0.84 -0.05 2.23 2.02 -0.59 -1.13 112.91 116.23 3h7x h THR 320 Ca -0.01 -0.08 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 3h7x h THR 320 Cb 1.61 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 68.60 3h7x h THR 320 CO 0.11 0.04 0.01 0.11 0.37 0.00 0.00 175.52 176.16 3h7x h LYS 321 N 0.24 0.08 -0.54 6.66 1.57 -1.56 -1.60 116.57 121.41 3h7x h LYS 321 Ca 0.18 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.97 3h7x h LYS 321 Cb 0.19 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.45 3h7x h LYS 321 CO -0.21 0.32 0.30 -0.22 -0.57 0.00 0.00 179.45 179.07 3h7x h LYS 322 N -0.18 0.58 -0.46 3.15 3.64 -1.22 0.11 116.57 122.19 3h7x h LYS 322 Ca 0.01 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 3h7x h LYS 322 Cb 0.28 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3h7x h LYS 322 CO 0.00 0.38 0.02 0.00 -2.27 0.00 0.00 179.45 177.59 3h7x h ALA 323 N 1.26 0.61 -0.55 5.00 0.00 -1.15 -1.56 119.26 122.88 3h7x h ALA 323 Ca 0.23 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 3h7x h ALA 323 Cb 0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3h7x h ALA 323 CO -0.13 0.38 0.20 0.82 0.00 0.00 0.00 179.25 180.53 3h7x h ILE 324 N 0.64 1.23 -0.38 0.00 2.04 -1.05 -0.48 117.51 119.51 3h7x h ILE 324 Ca 0.13 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.27 3h7x h ILE 324 Cb 0.46 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 3h7x h ILE 324 CO 0.02 0.27 0.24 -0.09 0.00 0.00 0.00 178.15 178.60 3h7x h ARG 325 N 0.75 0.51 -0.09 2.37 2.43 -0.39 0.83 114.38 120.80 3h7x h ARG 325 Ca 0.18 -0.04 -0.05 0.00 -0.81 0.00 0.00 59.98 59.27 3h7x h ARG 325 Cb 0.23 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3h7x h ARG 325 CO -0.01 0.36 -0.12 0.93 -1.51 0.00 0.00 179.97 179.61 3h7x h GLU 326 N 0.51 0.24 -0.32 0.20 5.08 -1.26 -2.30 114.58 116.73 3h7x h GLU 326 Ca 0.14 -0.14 0.07 0.00 -1.00 0.00 0.00 59.36 58.43 3h7x h GLU 326 Cb -0.03 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.15 3h7x h GLU 326 CO -0.03 0.70 -0.19 0.77 -1.00 0.00 0.00 179.01 179.26 3h7x h SER 327 N -0.20 -0.63 -0.20 1.42 0.02 -0.99 -1.21 113.55 111.76 3h7x h SER 327 Ca 0.01 0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 61.06 3h7x h SER 327 Cb 0.67 0.33 -0.02 0.00 0.14 0.00 0.00 62.40 63.52 3h7x h SER 327 CO 0.03 -0.22 0.03 0.78 -1.14 0.00 0.00 176.83 176.30 3h7x h ASN 328 N -0.15 0.41 -0.16 3.07 4.21 -0.82 -0.01 115.58 122.13 3h7x h ASN 328 Ca 0.17 -0.06 -0.18 0.00 1.21 0.00 0.00 56.30 57.44 3h7x h ASN 328 Cb 0.40 -0.11 -0.00 0.00 -1.12 0.00 0.00 38.32 37.49 3h7x h ASN 328 CO -0.41 0.46 -0.54 -0.61 -1.29 0.00 0.00 177.43 175.04 3h7x h GLN 329 N 0.44 0.75 -0.11 0.81 4.15 -1.15 -1.17 115.11 118.83 3h7x h GLN 329 Ca 0.10 -0.47 -0.06 0.00 0.77 0.00 0.00 58.65 58.99 3h7x h GLN 329 Cb 0.25 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.98 3h7x h GLN 329 CO 0.00 1.10 -0.21 -0.92 -1.93 0.00 0.00 178.83 176.87 3h7x h TYR 330 N 0.58 0.20 0.04 3.99 3.20 -0.40 -0.94 116.97 123.63 3h7x h TYR 330 Ca 0.01 -0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.85 3h7x h TYR 330 Cb 1.13 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 39.34 3h7x h TYR 330 CO 0.06 0.39 -0.02 1.15 -1.64 0.00 0.00 178.16 178.11 3h7x h THR 331 N 0.17 1.35 -0.84 1.81 2.02 -0.62 -1.42 112.91 115.38 3h7x h THR 331 Ca 0.03 -1.39 0.19 0.00 0.77 0.00 0.00 66.41 66.01 3h7x h THR 331 Cb 0.48 2.25 -0.11 0.00 -1.74 0.00 0.00 68.15 69.02 3h7x h THR 331 CO 0.03 0.34 0.34 0.44 0.37 0.00 0.00 175.52 177.04 3h7x h ASP 332 N -0.68 0.28 -0.36 4.18 3.32 -1.11 0.14 116.42 122.19 3h7x h ASP 332 Ca -0.01 0.14 0.05 0.00 0.02 0.00 0.00 57.03 57.23 3h7x h ASP 332 Cb 0.60 0.13 -0.04 0.00 0.22 0.00 0.00 39.33 40.24 3h7x h ASP 332 CO 0.01 0.04 0.11 -0.74 -1.72 0.00 0.00 179.24 176.93 3h7x h HIS 333 N 0.41 0.19 -0.36 4.55 -0.00 -0.74 -1.50 115.15 117.70 3h7x h HIS 333 Ca 0.50 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.85 3h7x h HIS 333 Cb 0.87 -0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 28.23 3h7x h HIS 333 CO -0.16 0.07 0.10 0.87 -0.00 0.00 0.00 177.93 178.80 3h7x h LYS 334 N 0.25 0.56 -0.59 5.26 1.79 -0.52 -2.73 116.57 120.60 3h7x h LYS 334 Ca 0.17 -0.13 0.12 0.00 -2.18 0.00 0.00 60.65 58.63 3h7x h LYS 334 Cb 0.16 -0.08 -0.10 0.00 -1.58 0.00 0.00 32.23 30.63 3h7x h LYS 334 CO -0.19 0.59 -0.04 0.35 -1.08 0.00 0.00 179.45 179.09 3h7x h PHE 335 N 0.42 -0.11 -0.42 -1.35 3.57 -0.44 -1.63 116.94 116.98 3h7x h PHE 335 Ca 0.11 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.62 3h7x h PHE 335 Cb 0.28 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3h7x h PHE 335 CO 0.01 -0.18 0.10 0.45 -2.23 0.00 0.00 178.31 176.46 3h7x h HIS 336 N 0.08 0.71 -0.28 0.41 3.86 -1.08 0.50 115.15 119.35 3h7x h HIS 336 Ca 0.30 -0.09 0.07 0.00 -1.16 0.00 0.00 60.37 59.49 3h7x h HIS 336 Cb 0.47 -0.20 -0.07 0.00 1.06 0.00 0.00 27.41 28.67 3h7x h HIS 336 CO -0.39 0.67 -0.22 1.96 0.86 0.00 0.00 177.93 180.81 3h7x h GLN 337 N 0.54 -0.20 -0.62 2.45 4.20 -1.14 -1.09 115.11 119.25 3h7x h GLN 337 Ca 0.13 0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 3h7x h GLN 337 Cb 0.32 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.12 3h7x h GLN 337 CO 0.00 -0.13 0.18 -0.07 -0.67 0.00 0.00 178.83 178.14 3h7x h LEU 338 N -0.21 0.92 -0.38 1.46 3.38 -0.49 -2.09 115.31 117.90 3h7x h LEU 338 Ca 0.15 -0.22 0.05 0.00 0.09 0.00 0.00 57.88 57.95 3h7x h LEU 338 Cb 0.44 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 3h7x h LEU 338 CO -0.40 0.89 0.13 -0.78 0.09 0.00 0.00 178.44 178.37 3h7x h ASP 339 N 0.90 0.13 -0.67 -0.43 3.58 0.07 -1.02 116.42 118.98 3h7x h ASP 339 Ca 0.20 0.04 -0.03 0.00 0.42 0.00 0.00 57.03 57.66 3h7x h ASP 339 Cb 0.31 0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.36 3h7x h ASP 339 CO -0.00 0.11 0.30 0.78 -2.88 0.00 0.00 179.24 177.55 3h7x h ASN 340 N 0.28 0.92 -0.59 2.28 4.21 -1.06 -1.64 115.58 119.98 3h7x h ASN 340 Ca 0.17 -0.12 -0.02 0.00 1.21 0.00 0.00 56.30 57.55 3h7x h ASN 340 Cb 0.15 -0.24 -0.03 0.00 -1.12 0.00 0.00 38.32 37.09 3h7x h ASN 340 CO -0.18 0.80 0.29 0.03 -1.29 0.00 0.00 177.43 177.08 3h7x h ARG 341 N 0.99 0.84 -0.54 0.81 3.08 -1.17 -3.00 114.38 115.39 3h7x h ARG 341 Ca 0.24 -0.12 0.02 0.00 0.07 0.00 0.00 59.98 60.19 3h7x h ARG 341 Cb 0.15 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 3h7x h ARG 341 CO -0.03 0.67 0.34 -0.07 -1.07 0.00 0.00 179.97 179.81 3h7x h LEU 342 N 0.80 0.56 -1.03 3.04 3.38 -1.03 -1.41 115.31 119.61 3h7x h LEU 342 Ca 0.20 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 3h7x h LEU 342 Cb 0.10 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3h7x h LEU 342 CO -0.03 0.40 0.01 0.44 0.09 0.00 0.00 178.44 179.34 3h7x h ASP 343 N 0.67 0.66 0.66 -0.43 3.32 -1.33 0.43 116.42 120.40 3h7x h ASP 343 Ca 0.21 -0.15 -0.15 0.00 0.02 0.00 0.00 57.03 56.97 3h7x h ASP 343 Cb -0.01 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 3h7x h ASP 343 CO -0.08 0.73 -0.69 0.11 -1.72 0.00 0.00 179.24 177.59 3h7x h LYS 344 N 0.66 0.03 0.23 3.56 6.56 -1.37 -2.66 116.57 123.57 3h7x h LYS 344 Ca 0.13 -0.02 -0.31 0.00 -1.06 0.00 0.00 60.65 59.39 3h7x h LYS 344 Cb 0.40 0.01 0.03 0.00 -0.57 0.00 0.00 32.23 32.10 3h7x h LYS 344 CO 0.01 0.71 -1.36 1.25 -2.06 0.00 0.00 179.45 178.01 3h7x h LEU 345 N 0.02 0.75 -0.80 2.94 6.46 -0.34 -3.19 115.31 121.15 3h7x h LEU 345 Ca -0.01 -0.93 0.16 0.00 -0.12 0.00 0.00 57.88 56.99 3h7x h LEU 345 Cb 1.22 -0.25 -0.10 0.00 -0.73 0.00 0.00 40.66 40.80 3h7x h LEU 345 CO 0.09 1.65 0.33 0.44 -0.62 0.00 0.00 178.44 180.33 3h7x h ASP 346 N 0.03 0.30 0.07 1.25 5.19 -0.19 -1.87 116.42 121.20 3h7x h ASP 346 Ca -0.24 0.12 -0.00 0.00 -0.62 0.00 0.00 57.03 56.29 3h7x h ASP 346 Cb 2.05 0.10 0.00 0.00 0.18 0.00 0.00 39.33 41.66 3h7x h ASP 346 CO 0.24 0.08 -0.03 0.00 -3.12 0.00 0.00 179.24 176.41 3h7x h THR 347 N 0.44 1.22 -0.95 0.35 1.03 -1.59 -1.72 112.91 111.69 3h7x h THR 347 Ca 0.46 -1.22 0.10 0.00 -0.01 0.00 0.00 66.41 65.74 3h7x h THR 347 Cb 0.75 1.98 -0.12 0.00 -1.07 0.00 0.00 68.15 69.68 3h7x h THR 347 CO -0.44 0.29 -0.51 0.54 -0.01 0.00 0.00 175.52 175.39 3h7x n ARG 348 N -4.87 -0.37 -0.33 0.00 1.74 -1.08 -0.59 116.66 111.15 3h7x n ARG 348 Ca -0.08 1.44 0.04 0.00 -0.77 0.00 0.00 57.85 58.48 3h7x n ARG 348 Cb 0.28 -2.12 0.22 0.00 -1.02 0.00 0.00 32.46 29.82 3h7x n ARG 348 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3h7x h VAL 349 N 0.00 1.04 0.00 1.55 2.07 -1.29 0.64 116.25 120.26 3h7x h VAL 349 Ca 0.20 -0.36 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 3h7x h VAL 349 Cb 0.43 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 3h7x h VAL 349 CO -0.90 0.19 -0.49 0.44 0.02 0.00 0.00 177.57 176.83 3h7x h ASP 350 N 1.06 0.00 0.00 0.57 3.32 0.12 -1.57 116.42 119.92 3h7x h ASP 350 Ca 0.43 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.45 3h7x h ASP 350 Cb 0.26 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.81 3h7x h ASP 350 CO -0.18 0.49 -0.18 0.11 -1.72 0.00 0.00 179.24 177.76 3h7x h LYS 351 N 0.00 0.00 0.00 3.56 1.57 -1.06 -3.31 116.57 117.33 3h7x h LYS 351 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3h7x h LYS 351 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 3h7x h LYS 351 CO 0.06 0.63 0.00 0.41 -0.57 0.00 0.00 179.45 179.98 3h7x n GLY 352 N 1.64 0.00 0.84 3.86 0.00 0.22 0.17 105.19 111.92 3h7x n GLY 352 Ca -0.09 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.01 3h7x n GLY 352 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3h7x n LEU 353 N -0.70 2.44 0.00 0.99 7.94 -0.59 -4.99 117.00 122.08 3h7x n LEU 353 Ca 0.00 -1.19 0.00 0.00 -1.11 0.00 0.00 56.01 53.71 3h7x n LEU 353 Cb 0.00 -0.28 0.00 0.00 0.53 0.00 0.00 43.42 43.67 3h7x n LEU 353 CO 0.00 0.59 0.00 0.00 -1.11 0.00 0.00 177.39 176.87