#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s5r s LEU 296 N 0.00 4.14 0.00 -3.43 2.96 -1.26 -4.88 118.68 116.21 1s5r s LEU 296 Ca 0.00 2.35 0.00 0.00 -0.22 0.00 0.00 54.13 56.26 1s5r s LEU 296 Cb 0.00 -4.09 0.00 0.00 0.50 0.00 0.00 46.19 42.60 1s5r s LEU 296 CO 0.00 -0.76 0.00 1.67 -1.32 0.00 0.00 176.35 175.94 1s5r n GLN 297 N -0.10 0.00 -4.14 1.98 7.27 -1.26 -5.15 117.38 115.98 1s5r n GLN 297 Ca 0.05 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 57.00 1s5r n GLN 297 Cb 0.47 -0.14 -0.08 0.00 2.41 0.00 0.00 30.24 32.89 1s5r n GLN 297 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1s5r s ASN 298 N -1.62 0.22 0.00 1.69 4.22 -1.26 -5.06 114.94 113.13 1s5r s ASN 298 Ca 0.00 -1.28 0.10 0.00 -2.14 0.00 0.00 52.86 49.54 1s5r s ASN 298 Cb 0.00 0.47 -0.06 0.00 1.28 0.00 0.00 41.25 42.95 1s5r s ASN 298 CO 0.00 -0.98 0.51 0.59 -2.04 0.00 0.00 177.10 175.18 1s5r n ASN 299 N -0.46 0.80 -3.46 3.54 3.02 -1.26 -4.82 115.26 112.62 1s5r n ASN 299 Ca 0.01 -0.90 -0.28 0.00 -0.03 0.00 0.00 54.58 53.38 1s5r n ASN 299 Cb 0.64 0.76 -0.11 0.00 -0.61 0.00 0.00 39.78 40.46 1s5r n ASN 299 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1s5r s GLN 300 N -1.66 0.80 0.64 3.52 2.00 -1.26 -5.13 119.66 118.57 1s5r s GLN 300 Ca 0.06 -1.77 -0.17 0.00 -2.00 0.00 0.00 55.36 51.48 1s5r s GLN 300 Cb 0.08 -1.48 -0.04 0.00 0.80 0.00 0.00 33.01 32.37 1s5r s GLN 300 CO 0.33 -1.29 0.88 -2.30 -0.50 0.00 0.00 175.29 172.41 1s5r n PRO 301 N 3.43 0.70 0.20 1.67 -0.02 -1.26 -4.91 135.00 134.82 1s5r n PRO 301 Ca 0.20 0.28 0.11 0.00 -2.02 0.00 0.00 63.50 62.08 1s5r n PRO 301 Cb 0.41 -2.10 0.14 0.00 -0.02 0.00 0.00 33.50 31.94 1s5r n PRO 301 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1s5r h VAL 302 N 0.20 0.04 0.00 -1.45 -1.51 -2.00 -3.27 116.25 108.26 1s5r h VAL 302 Ca -0.48 -1.06 0.00 0.00 -1.23 0.00 0.00 66.70 63.93 1s5r h VAL 302 Cb 1.36 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 32.48 1s5r h VAL 302 CO 0.49 0.02 0.00 -0.62 -1.23 0.00 0.00 177.57 176.23 1s5r n GLU 303 N -3.05 0.00 -0.36 5.19 1.02 -1.26 -1.51 120.64 120.67 1s5r n GLU 303 Ca 0.03 0.08 0.02 0.00 -0.02 0.00 0.00 57.16 57.28 1s5r n GLU 303 Cb 0.54 -0.86 0.18 0.00 -0.02 0.00 0.00 31.44 31.29 1s5r n GLU 303 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1s5r h PHE 304 N 0.00 1.18 0.03 -0.32 0.04 -1.98 -1.27 116.94 114.61 1s5r h PHE 304 Ca 0.00 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.80 1s5r h PHE 304 Cb 0.00 -0.39 -0.00 0.00 2.20 0.00 0.00 35.95 37.76 1s5r h PHE 304 CO 0.00 0.63 -0.03 -0.97 -0.60 0.00 0.00 178.31 177.33 1s5r h ASN 305 N 1.17 -0.10 0.37 2.17 -0.73 -1.63 -0.14 115.58 116.69 1s5r h ASN 305 Ca 0.42 0.01 -0.02 0.00 1.87 0.00 0.00 56.30 58.58 1s5r h ASN 305 Cb 0.14 0.03 0.00 0.00 0.27 0.00 0.00 38.32 38.77 1s5r h ASN 305 CO -0.16 -0.04 -0.18 0.45 -0.37 0.00 0.00 177.43 177.13 1s5r h HIS 306 N -0.06 -0.45 0.19 0.67 3.86 -1.26 -1.80 115.15 116.30 1s5r h HIS 306 Ca -0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.20 1s5r h HIS 306 Cb 0.06 0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 1s5r h HIS 306 CO -0.15 -0.22 -0.43 0.00 0.86 0.00 0.00 177.93 177.99 1s5r h ALA 307 N 0.02 -0.97 0.13 2.45 0.00 -1.30 0.15 119.26 119.74 1s5r h ALA 307 Ca -0.05 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1s5r h ALA 307 Cb 0.43 0.76 -0.03 0.00 0.00 0.00 0.00 17.79 18.96 1s5r h ALA 307 CO 0.08 -1.05 -0.26 0.82 0.00 0.00 0.00 179.25 178.84 1s5r h ILE 308 N -0.68 0.42 -0.59 0.00 2.04 -1.09 -1.30 117.51 116.31 1s5r h ILE 308 Ca -0.02 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.01 1s5r h ILE 308 Cb 0.65 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1s5r h ILE 308 CO -0.18 0.00 0.43 -1.13 0.00 0.00 0.00 178.15 177.27 1s5r h ASN 309 N -0.48 0.00 0.38 1.72 -0.73 -1.23 0.51 115.58 115.75 1s5r h ASN 309 Ca 0.03 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.18 1s5r h ASN 309 Cb 0.50 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.10 1s5r h ASN 309 CO -0.15 0.00 -0.18 0.22 -0.37 0.00 0.00 177.43 176.95 1s5r h TYR 310 N 0.00 -0.48 -0.02 0.67 3.20 0.13 -2.01 116.97 118.47 1s5r h TYR 310 Ca 0.28 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 62.14 1s5r h TYR 310 Cb 1.13 0.16 -0.00 0.00 1.54 0.00 0.00 36.73 39.56 1s5r h TYR 310 CO 0.00 -0.30 0.05 0.28 -1.64 0.00 0.00 178.16 176.55 1s5r h VAL 311 N -0.96 0.20 0.24 1.81 2.07 -0.97 -1.76 116.25 116.88 1s5r h VAL 311 Ca -0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.46 1s5r h VAL 311 Cb 0.39 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1s5r h VAL 311 CO 0.09 0.00 -0.12 -1.13 0.02 0.00 0.00 177.57 176.43 1s5r h ASN 312 N 0.00 -0.28 0.15 0.57 -1.24 -0.89 -1.37 115.58 112.53 1s5r h ASN 312 Ca 0.01 -0.17 -0.02 0.00 0.71 0.00 0.00 56.30 56.83 1s5r h ASN 312 Cb 0.11 0.07 -0.00 0.00 0.73 0.00 0.00 38.32 39.23 1s5r h ASN 312 CO -0.00 0.23 -0.10 0.07 -1.29 0.00 0.00 177.43 176.34 1s5r h LYS 313 N -1.00 0.00 0.05 6.67 5.09 -1.04 -0.60 116.57 125.74 1s5r h LYS 313 Ca -0.03 0.00 -0.15 0.00 0.09 0.00 0.00 60.65 60.56 1s5r h LYS 313 Cb 0.43 0.00 0.01 0.00 0.10 0.00 0.00 32.23 32.77 1s5r h LYS 313 CO 0.05 0.10 -0.61 0.82 -2.09 0.00 0.00 179.45 177.72 1s5r h ILE 314 N 0.00 1.49 0.00 0.07 2.04 -1.40 -1.43 117.51 118.28 1s5r h ILE 314 Ca -0.00 -2.23 -0.05 0.00 1.00 0.00 0.00 64.86 63.58 1s5r h ILE 314 Cb 0.20 2.86 -0.01 0.00 -0.74 0.00 0.00 36.82 39.13 1s5r h ILE 314 CO 0.01 0.64 -0.22 0.50 0.00 0.00 0.00 178.15 179.08 1s5r h LYS 315 N -0.28 0.00 0.00 2.37 3.64 -0.92 -0.60 116.57 120.78 1s5r h LYS 315 Ca -0.09 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 1s5r h LYS 315 Cb 1.38 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.19 1s5r h LYS 315 CO 0.12 0.22 -0.40 -0.97 -2.27 0.00 0.00 179.45 176.15 1s5r h ASN 316 N 0.00 0.00 0.72 4.20 -1.24 -1.17 -3.26 115.58 114.82 1s5r h ASN 316 Ca -0.00 -0.17 -0.04 0.00 0.71 0.00 0.00 56.30 56.80 1s5r h ASN 316 Cb 0.63 0.00 0.01 0.00 0.73 0.00 0.00 38.32 39.69 1s5r h ASN 316 CO 0.03 0.80 -0.34 -0.09 -1.29 0.00 0.00 177.43 176.54 1s5r h ARG 317 N -1.00 -0.93 -1.83 6.67 9.65 -1.33 -3.12 114.38 122.50 1s5r h ARG 317 Ca -0.05 0.06 -0.12 0.00 -1.10 0.00 0.00 59.98 58.77 1s5r h ARG 317 Cb 0.50 0.21 -0.05 0.00 -1.39 0.00 0.00 29.97 29.24 1s5r h ARG 317 CO -0.03 -0.61 0.15 1.19 2.80 0.00 0.00 179.97 183.47 1s5r n PHE 318 N -5.42 0.56 0.74 2.20 3.01 -0.23 -4.34 117.46 113.99 1s5r n PHE 318 Ca -0.12 -1.36 0.09 0.00 1.01 0.00 0.00 57.45 57.06 1s5r n PHE 318 Cb 0.39 -0.69 0.42 0.00 -0.01 0.00 0.00 39.48 39.58 1s5r n PHE 318 CO 0.00 0.00 0.00 0.94 1.01 0.00 0.00 176.76 178.71 1s5r n GLN 319 N 1.10 0.15 -0.03 -1.08 7.27 -1.18 -2.25 117.38 121.37 1s5r n GLN 319 Ca 0.12 0.15 0.08 0.00 0.07 0.00 0.00 57.00 57.42 1s5r n GLN 319 Cb 0.53 -1.50 0.08 0.00 2.41 0.00 0.00 30.24 31.77 1s5r n GLN 319 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1s5r n GLY 320 N 0.24 0.39 3.09 1.69 0.00 -1.26 -4.80 105.19 104.54 1s5r n GLY 320 Ca 0.07 -0.45 -0.36 0.00 0.00 0.00 0.00 46.02 45.28 1s5r n GLY 320 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1s5r s GLN 321 N -1.25 2.67 0.25 1.61 -1.52 -0.95 -4.91 119.66 115.56 1s5r s GLN 321 Ca 0.19 -2.68 0.11 0.00 -1.95 0.00 0.00 55.36 51.03 1s5r s GLN 321 Cb 0.13 -3.75 0.26 0.00 -0.22 0.00 0.00 33.01 29.43 1s5r s GLN 321 CO 0.19 -1.19 1.55 -1.00 -0.25 0.00 0.00 175.29 174.59 1s5r h PRO 322 N 6.80 0.00 0.06 2.91 0.13 -1.87 -2.22 132.00 137.81 1s5r h PRO 322 Ca 0.02 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1s5r h PRO 322 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1s5r h PRO 322 CO 0.73 0.67 -0.03 0.22 -0.23 0.00 0.00 178.00 179.36 1s5r h ASP 323 N 0.00 -0.07 -0.28 1.44 1.82 -1.97 -1.47 116.42 115.89 1s5r h ASP 323 Ca -0.01 -0.40 -0.08 0.00 -0.39 0.00 0.00 57.03 56.16 1s5r h ASP 323 Cb 1.22 0.02 -0.01 0.00 0.68 0.00 0.00 39.33 41.24 1s5r h ASP 323 CO 0.09 0.37 -0.13 0.40 -1.61 0.00 0.00 179.24 178.36 1s5r h ILE 324 N -0.52 1.29 0.22 2.25 2.04 -1.96 -1.69 117.51 119.14 1s5r h ILE 324 Ca -0.01 -1.21 0.00 0.00 1.00 0.00 0.00 64.86 64.64 1s5r h ILE 324 Cb 0.46 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.01 1s5r h ILE 324 CO 0.01 0.38 -0.19 0.22 0.00 0.00 0.00 178.15 178.58 1s5r h TYR 325 N 0.34 -0.49 0.86 1.37 3.20 -1.47 -1.47 116.97 119.30 1s5r h TYR 325 Ca 0.06 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 1s5r h TYR 325 Cb 0.64 0.19 0.01 0.00 1.54 0.00 0.00 36.73 39.11 1s5r h TYR 325 CO 0.06 -0.29 -0.41 -0.22 -1.64 0.00 0.00 178.16 175.66 1s5r h LYS 326 N -0.42 -1.11 -0.63 1.82 3.64 -1.30 -2.14 116.57 116.43 1s5r h LYS 326 Ca -0.01 0.08 0.11 0.00 -1.27 0.00 0.00 60.65 59.56 1s5r h LYS 326 Cb 0.39 0.25 -0.12 0.00 -0.41 0.00 0.00 32.23 32.34 1s5r h LYS 326 CO -0.03 -0.74 -0.30 0.00 -2.27 0.00 0.00 179.45 176.12 1s5r h ALA 327 N -1.00 0.09 -0.05 5.00 0.00 -1.29 0.24 119.26 122.25 1s5r h ALA 327 Ca -0.12 0.19 0.04 0.00 0.00 0.00 0.00 54.91 55.02 1s5r h ALA 327 Cb 0.88 0.73 -0.05 0.00 0.00 0.00 0.00 17.79 19.35 1s5r h ALA 327 CO 0.19 -0.61 -0.23 0.35 0.00 0.00 0.00 179.25 178.95 1s5r h PHE 328 N -0.12 -0.62 0.00 0.00 3.57 -1.22 0.29 116.94 118.84 1s5r h PHE 328 Ca 0.26 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.78 1s5r h PHE 328 Cb 0.54 0.28 -0.00 0.00 2.79 0.00 0.00 35.95 39.56 1s5r h PHE 328 CO -0.62 -0.32 -0.01 -0.07 -2.23 0.00 0.00 178.31 175.06 1s5r h LEU 329 N -0.34 0.00 -0.25 0.59 3.38 -0.50 -0.76 115.31 117.43 1s5r h LEU 329 Ca 0.08 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.84 1s5r h LEU 329 Cb 0.44 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1s5r h LEU 329 CO -0.24 0.01 -0.90 -0.33 0.09 0.00 0.00 178.44 177.07 1s5r h GLU 330 N 0.00 0.24 -0.18 1.13 5.08 0.14 -1.14 114.58 119.85 1s5r h GLU 330 Ca -0.00 -0.26 -0.10 0.00 -1.00 0.00 0.00 59.36 58.00 1s5r h GLU 330 Cb 0.03 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 1s5r h GLU 330 CO 0.00 0.99 -0.27 0.82 -1.00 0.00 0.00 179.01 179.55 1s5r h ILE 331 N 0.13 1.34 -0.41 3.13 2.04 0.23 -1.30 117.51 122.66 1s5r h ILE 331 Ca -0.05 -1.49 -0.15 0.00 1.00 0.00 0.00 64.86 64.17 1s5r h ILE 331 Cb 1.53 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 39.48 1s5r h ILE 331 CO 0.14 0.45 -0.34 -0.07 0.00 0.00 0.00 178.15 178.33 1s5r h LEU 332 N 0.15 1.01 0.35 1.44 3.38 -1.46 -0.86 115.31 119.32 1s5r h LEU 332 Ca 0.02 -0.44 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 1s5r h LEU 332 Cb 0.85 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1s5r h LEU 332 CO 0.06 1.24 -0.17 -0.74 0.09 0.00 0.00 178.44 178.93 1s5r h HIS 333 N 0.79 -0.44 -0.37 1.13 2.76 -1.22 -1.68 115.15 116.12 1s5r h HIS 333 Ca 0.07 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1s5r h HIS 333 Cb 0.93 0.15 -0.02 0.00 1.55 0.00 0.00 27.41 30.02 1s5r h HIS 333 CO 0.06 -0.19 0.25 1.15 -1.30 0.00 0.00 177.93 177.90 1s5r h THR 334 N -0.62 1.10 -0.17 6.26 2.02 -1.27 -2.02 112.91 118.22 1s5r h THR 334 Ca -0.05 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 1s5r h THR 334 Cb 0.45 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 1s5r h THR 334 CO 0.08 0.09 0.10 0.22 0.37 0.00 0.00 175.52 176.38 1s5r h TYR 335 N 0.51 0.23 -0.34 3.16 3.20 -0.85 -1.10 116.97 121.77 1s5r h TYR 335 Ca 0.14 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.00 1s5r h TYR 335 Cb -0.06 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 1s5r h TYR 335 CO -0.00 0.21 0.21 0.37 -1.64 0.00 0.00 178.16 177.31 1s5r h GLN 336 N 0.18 0.46 -0.74 1.82 4.15 -0.72 -0.85 115.11 119.41 1s5r h GLN 336 Ca 0.06 -0.04 0.05 0.00 0.77 0.00 0.00 58.65 59.49 1s5r h GLN 336 Cb 0.05 -0.10 -0.05 0.00 0.21 0.00 0.00 27.48 27.59 1s5r h GLN 336 CO -0.01 0.34 0.44 -0.22 -1.93 0.00 0.00 178.83 177.45 1s5r h LYS 337 N 0.44 0.80 -0.34 1.69 3.64 -1.21 -0.75 116.57 120.84 1s5r h LYS 337 Ca 0.12 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.34 1s5r h LYS 337 Cb -0.00 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.63 1s5r h LYS 337 CO -0.02 0.53 -0.26 0.93 -2.27 0.00 0.00 179.45 178.35 1s5r h GLU 338 N 0.82 0.69 -0.34 1.90 4.39 -0.87 -2.01 114.58 119.17 1s5r h GLU 338 Ca 0.32 -0.29 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 1s5r h GLU 338 Cb 0.14 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1s5r h GLU 338 CO -0.16 0.89 -0.01 1.96 -1.16 0.00 0.00 179.01 180.52 1s5r h GLN 339 N 0.60 0.61 0.36 2.33 1.08 -0.48 -0.31 115.11 119.30 1s5r h GLN 339 Ca 0.08 -0.20 -0.02 0.00 -1.45 0.00 0.00 58.65 57.06 1s5r h GLN 339 Cb 0.76 -0.05 0.00 0.00 -0.05 0.00 0.00 27.48 28.14 1s5r h GLN 339 CO 0.06 0.74 -0.17 0.00 -0.95 0.00 0.00 178.83 178.51 1s5r h ARG 340 N 0.42 -0.47 -0.57 1.46 3.08 -1.09 -0.05 114.38 117.15 1s5r h ARG 340 Ca 0.10 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.22 1s5r h ARG 340 Cb 0.47 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.58 1s5r h ARG 340 CO 0.02 -0.23 0.32 -0.91 -1.07 0.00 0.00 179.97 178.09 1s5r h ASN 341 N -0.62 0.48 0.17 7.04 4.21 -1.39 -0.10 115.58 125.36 1s5r h ASN 341 Ca -0.05 0.02 -0.04 0.00 1.21 0.00 0.00 56.30 57.44 1s5r h ASN 341 Cb 0.45 -0.07 -0.01 0.00 -1.12 0.00 0.00 38.32 37.57 1s5r h ASN 341 CO 0.08 0.32 -0.18 0.00 -1.29 0.00 0.00 177.43 176.37 1s5r h ALA 342 N 1.29 1.67 0.00 -0.83 0.00 -0.96 -1.90 119.26 118.52 1s5r h ALA 342 Ca 0.25 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 1s5r h ALA 342 Cb 0.11 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1s5r h ALA 342 CO -0.15 0.25 -0.84 -0.22 0.00 0.00 0.00 179.25 178.29 1s5r h LYS 343 N 0.02 0.09 0.28 0.00 3.64 0.27 0.12 116.57 120.99 1s5r h LYS 343 Ca 0.00 -0.10 -0.01 0.00 -1.27 0.00 0.00 60.65 59.27 1s5r h LYS 343 Cb 0.34 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1s5r h LYS 343 CO 0.02 0.87 -0.13 0.93 -2.27 0.00 0.00 179.45 178.87 1s5r h GLU 344 N 0.05 -0.36 -0.09 1.90 4.39 -0.33 -3.33 114.58 116.82 1s5r h GLU 344 Ca -0.02 0.02 -0.18 0.00 0.34 0.00 0.00 59.36 59.52 1s5r h GLU 344 Cb 1.46 0.08 0.01 0.00 -0.10 0.00 0.00 28.75 30.20 1s5r h GLU 344 CO 0.12 -0.01 -0.65 0.00 -1.16 0.00 0.00 179.01 177.31 1s5r h ALA 345 N -0.38 0.20 -6.75 3.43 0.00 -1.49 -3.48 119.26 110.80 1s5r h ALA 345 Ca -0.04 -0.56 -0.55 0.00 0.00 0.00 0.00 54.91 53.76 1s5r h ALA 345 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1s5r h ALA 345 CO 0.06 0.49 -0.97 0.41 0.00 0.00 0.00 179.25 179.24 1s5r n GLY 346 N 0.79 -0.62 0.00 0.00 0.00 0.43 -4.74 105.19 101.05 1s5r n GLY 346 Ca -0.08 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.23 1s5r n GLY 346 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1s5r n GLY 347 N -2.09 -0.34 0.34 -0.02 0.00 -1.26 -4.97 105.19 96.83 1s5r n GLY 347 Ca -0.18 0.59 0.15 0.00 0.00 0.00 0.00 46.02 46.57 1s5r n GLY 347 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1s5r h ASN 348 N 0.00 0.06 -3.71 1.61 -0.73 -1.99 -3.42 115.58 107.41 1s5r h ASN 348 Ca 0.00 0.00 -0.53 0.00 1.87 0.00 0.00 56.30 57.64 1s5r h ASN 348 Cb 0.00 -0.01 0.08 0.00 0.27 0.00 0.00 38.32 38.66 1s5r h ASN 348 CO 0.00 0.04 0.77 -0.47 -0.37 0.00 0.00 177.43 177.40 1s5r s TYR 349 N -5.10 2.79 -0.10 0.67 6.14 -1.26 -5.02 117.35 115.48 1s5r s TYR 349 Ca -0.05 1.12 0.01 0.00 0.64 0.00 0.00 57.07 58.78 1s5r s TYR 349 Cb 0.19 -3.93 0.02 0.00 0.42 0.00 0.00 41.96 38.66 1s5r s TYR 349 CO 0.71 -2.82 -0.11 0.99 0.64 0.00 0.00 175.55 174.96 1s5r s THR 350 N -0.71 1.20 1.01 4.34 2.01 -1.26 -4.86 115.64 117.37 1s5r s THR 350 Ca 0.55 -0.46 -0.13 0.00 0.31 0.00 0.00 61.69 61.96 1s5r s THR 350 Cb -0.45 -1.13 0.11 0.00 0.01 0.00 0.00 72.50 71.04 1s5r s THR 350 CO 0.55 0.38 0.57 -2.65 -0.69 0.00 0.00 174.62 172.78 1s5r n PRO 351 N 4.33 -0.92 0.03 4.92 -0.02 -1.26 -4.95 135.00 137.13 1s5r n PRO 351 Ca -0.18 -0.23 0.05 0.00 -2.02 0.00 0.00 63.50 61.12 1s5r n PRO 351 Cb 0.51 -1.98 -0.09 0.00 -0.02 0.00 0.00 33.50 31.92 1s5r n PRO 351 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s5r n ALA 352 N -4.12 2.28 -3.59 3.55 0.00 -1.26 -4.95 120.51 112.41 1s5r n ALA 352 Ca 0.06 -0.52 -0.14 0.00 0.00 0.00 0.00 53.44 52.84 1s5r n ALA 352 Cb 0.55 -0.88 -0.07 0.00 0.00 0.00 0.00 19.45 19.05 1s5r n ALA 352 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1s5r s LEU 353 N -5.32 -0.63 0.00 0.00 0.05 -1.26 -5.06 118.68 106.46 1s5r s LEU 353 Ca -0.04 1.37 0.00 0.00 0.05 0.00 0.00 54.13 55.51 1s5r s LEU 353 Cb 0.10 2.37 0.00 0.00 -2.05 0.00 0.00 46.19 46.61 1s5r s LEU 353 CO 0.83 -0.25 0.00 0.35 -0.55 0.00 0.00 176.35 176.73 1s5r n THR 354 N 2.65 0.00 0.16 5.48 -2.24 -1.26 -4.89 114.28 114.18 1s5r n THR 354 Ca -0.14 0.00 0.16 0.00 -2.27 0.00 0.00 64.05 61.80 1s5r n THR 354 Cb 0.55 -0.27 0.76 0.00 -2.10 0.00 0.00 70.33 69.27 1s5r n THR 354 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1s5r h GLU 355 N 0.00 0.00 -0.02 -0.78 5.08 -2.02 -1.59 114.58 115.26 1s5r h GLU 355 Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 1s5r h GLU 355 Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1s5r h GLU 355 CO 0.00 0.00 -0.02 1.96 -1.00 0.00 0.00 179.01 179.95 1s5r h GLN 356 N 0.00 0.04 -0.50 2.33 4.20 -1.98 -1.81 115.11 117.40 1s5r h GLN 356 Ca 0.12 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.78 1s5r h GLN 356 Cb 0.54 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.30 1s5r h GLN 356 CO -0.00 0.56 0.22 1.49 -0.67 0.00 0.00 178.83 180.43 1s5r h GLU 357 N -0.47 0.73 0.73 1.46 4.57 -1.72 -0.30 114.58 119.57 1s5r h GLU 357 Ca 0.00 -0.12 -0.04 0.00 -1.18 0.00 0.00 59.36 58.03 1s5r h GLU 357 Cb 0.55 -0.13 0.01 0.00 -0.16 0.00 0.00 28.75 29.02 1s5r h GLU 357 CO 0.01 0.62 -0.35 0.28 -1.18 0.00 0.00 179.01 178.39 1s5r h VAL 358 N 0.66 0.21 -0.26 0.32 2.07 -1.38 -0.33 116.25 117.54 1s5r h VAL 358 Ca 0.17 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.58 1s5r h VAL 358 Cb 0.15 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.15 1s5r h VAL 358 CO -0.02 0.01 0.18 0.22 0.02 0.00 0.00 177.57 177.98 1s5r h TYR 359 N -1.09 0.19 0.36 1.57 3.20 -1.32 0.44 116.97 120.32 1s5r h TYR 359 Ca -0.10 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 1s5r h TYR 359 Cb 0.77 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.98 1s5r h TYR 359 CO -0.01 0.11 -0.17 0.00 -1.64 0.00 0.00 178.16 176.45 1s5r h ALA 360 N 1.86 -0.52 -0.77 1.82 0.00 -0.90 -0.08 119.26 120.66 1s5r h ALA 360 Ca 0.11 -0.11 0.12 0.00 0.00 0.00 0.00 54.91 55.03 1s5r h ALA 360 Cb 0.19 0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.11 1s5r h ALA 360 CO -0.02 -0.49 0.51 1.96 0.00 0.00 0.00 179.25 181.21 1s5r h GLN 361 N -1.04 0.58 -0.22 0.00 4.20 -0.95 0.42 115.11 118.10 1s5r h GLN 361 Ca -0.05 -0.04 -0.16 0.00 0.06 0.00 0.00 58.65 58.47 1s5r h GLN 361 Cb 0.37 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 1s5r h GLN 361 CO 0.08 0.39 -0.51 0.28 -0.67 0.00 0.00 178.83 178.40 1s5r h VAL 362 N 0.60 1.31 -0.68 -0.54 2.07 -0.96 0.28 116.25 118.33 1s5r h VAL 362 Ca 0.37 -1.73 -0.04 0.00 0.82 0.00 0.00 66.70 66.11 1s5r h VAL 362 Cb 0.61 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1s5r h VAL 362 CO -0.14 0.55 0.25 0.00 0.02 0.00 0.00 177.57 178.25 1s5r h ALA 363 N 0.95 1.17 0.00 1.67 0.00 0.10 -2.43 119.26 120.72 1s5r h ALA 363 Ca 0.02 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1s5r h ALA 363 Cb 1.06 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1s5r h ALA 363 CO 0.10 0.59 -0.79 -0.09 0.00 0.00 0.00 179.25 179.06 1s5r h ARG 364 N 0.98 0.00 0.33 0.00 2.43 -1.21 -3.39 114.38 113.52 1s5r h ARG 364 Ca 0.23 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 1s5r h ARG 364 Cb 0.22 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.76 1s5r h ARG 364 CO -0.02 0.00 -0.26 1.25 -1.51 0.00 0.00 179.97 179.43 1s5r h LEU 365 N 0.00 -0.69-10.39 3.80 5.85 0.08 -3.44 115.31 110.51 1s5r h LEU 365 Ca 0.00 0.05 -0.47 0.00 0.84 0.00 0.00 57.88 58.30 1s5r h LEU 365 Cb 0.91 0.22 0.14 0.00 0.37 0.00 0.00 40.66 42.30 1s5r h LEU 365 CO 0.00 -0.37 0.25 -0.36 -0.34 0.00 0.00 178.44 177.62 1s5r s PHE 366 N -4.49 2.34 -1.35 1.25 0.08 -1.20 -4.91 117.98 109.70 1s5r s PHE 366 Ca -0.10 1.05 -0.15 0.00 0.12 0.00 0.00 56.93 57.85 1s5r s PHE 366 Cb 0.02 -3.24 0.08 0.00 -0.57 0.00 0.00 43.02 39.31 1s5r s PHE 366 CO 0.31 -2.51 1.90 1.63 -0.10 0.00 0.00 175.22 176.44 1s5r n LYS 367 N -3.92 3.14 -0.97 0.44 4.76 -1.26 -4.36 118.16 115.99 1s5r n LYS 367 Ca 0.06 -3.13 -0.01 0.00 -2.87 0.00 0.00 58.31 52.36 1s5r n LYS 367 Cb 0.57 -3.31 -0.00 0.00 -1.84 0.00 0.00 35.03 30.45 1s5r n LYS 367 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1s5r n ASN 368 N 6.75 -5.66 -4.62 4.39 3.02 -1.26 -4.87 115.26 113.01 1s5r n ASN 368 Ca 0.48 0.02 -0.43 0.00 -0.03 0.00 0.00 54.58 54.62 1s5r n ASN 368 Cb 0.42 -3.39 -0.03 0.00 -0.61 0.00 0.00 39.78 36.17 1s5r n ASN 368 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1s5r s GLN 369 N -1.97 3.47 0.02 3.52 -1.52 -1.26 -4.83 119.66 117.08 1s5r s GLN 369 Ca 0.00 2.15 0.16 0.00 -1.95 0.00 0.00 55.36 55.72 1s5r s GLN 369 Cb 0.00 -4.29 -0.17 0.00 -0.22 0.00 0.00 33.01 28.33 1s5r s GLN 369 CO 0.00 -1.72 0.72 -1.91 -0.25 0.00 0.00 175.29 172.13 1s5r n GLU 370 N 8.33 0.63 0.16 2.91 4.07 -1.26 -3.60 120.64 131.87 1s5r n GLU 370 Ca 0.26 0.21 -0.14 0.00 -0.06 0.00 0.00 57.16 57.43 1s5r n GLU 370 Cb 0.44 -1.77 -0.06 0.00 -0.06 0.00 0.00 31.44 29.98 1s5r n GLU 370 CO 0.00 0.00 0.00 0.22 -0.06 0.00 0.00 177.13 177.29 1s5r h ASP 371 N 0.00 -0.70 -0.46 4.31 1.82 -2.00 0.68 116.42 120.08 1s5r h ASP 371 Ca -0.21 0.07 -0.05 0.00 -0.39 0.00 0.00 57.03 56.44 1s5r h ASP 371 Cb 1.70 0.25 -0.02 0.00 0.68 0.00 0.00 39.33 41.94 1s5r h ASP 371 CO 0.05 -0.36 0.07 -0.07 -1.61 0.00 0.00 179.24 177.32 1s5r h LEU 372 N -0.52 0.73 -1.55 2.28 4.07 -1.99 -1.52 115.31 116.81 1s5r h LEU 372 Ca 0.00 -0.26 0.09 0.00 0.08 0.00 0.00 57.88 57.79 1s5r h LEU 372 Cb 0.50 -0.19 -0.04 0.00 1.08 0.00 0.00 40.66 42.01 1s5r h LEU 372 CO -0.08 0.80 0.42 -0.07 -1.08 0.00 0.00 178.44 178.44 1s5r h LEU 373 N 0.63 0.46 0.13 1.67 4.07 -1.56 -0.19 115.31 120.52 1s5r h LEU 373 Ca 0.14 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.10 1s5r h LEU 373 Cb 0.38 -0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.04 1s5r h LEU 373 CO 0.01 0.28 -0.06 0.28 -1.08 0.00 0.00 178.44 177.87 1s5r h SER 374 N 0.52 -0.15 -0.94 -0.43 0.02 -0.53 -0.41 113.55 111.63 1s5r h SER 374 Ca 0.29 -0.29 0.24 0.00 -0.84 0.00 0.00 61.79 61.19 1s5r h SER 374 Cb 0.45 0.04 -0.06 0.00 0.14 0.00 0.00 62.40 62.97 1s5r h SER 374 CO -0.09 0.44 0.64 -0.33 -1.14 0.00 0.00 176.83 176.35 1s5r h GLU 375 N -0.97 0.26 0.22 3.45 4.39 -1.06 0.15 114.58 121.01 1s5r h GLU 375 Ca -0.02 -0.02 -0.33 0.00 0.34 0.00 0.00 59.36 59.34 1s5r h GLU 375 Cb 0.43 -0.06 0.03 0.00 -0.10 0.00 0.00 28.75 29.05 1s5r h GLU 375 CO 0.03 0.17 -1.47 0.35 -1.16 0.00 0.00 179.01 176.93 1s5r h PHE 376 N 0.26 0.84 -0.12 4.33 3.57 -1.09 -3.27 116.94 121.47 1s5r h PHE 376 Ca 0.49 -0.62 0.03 0.00 3.53 0.00 0.00 57.97 61.41 1s5r h PHE 376 Cb 1.45 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 40.16 1s5r h PHE 376 CO -0.00 1.51 0.10 0.78 -2.23 0.00 0.00 178.31 178.47 1s5r h GLY 377 N 0.57 0.00 1.45 2.40 0.00 0.10 -1.02 103.07 106.57 1s5r h GLY 377 Ca -0.24 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1s5r h GLY 377 CO 0.25 0.00 0.27 1.46 0.00 0.00 0.00 176.54 178.52 1s5r h GLN 378 N 0.00 0.72 -0.97 4.80 4.20 -1.29 -2.27 115.11 120.30 1s5r h GLN 378 Ca 0.06 -0.08 0.03 0.00 0.06 0.00 0.00 58.65 58.72 1s5r h GLN 378 Cb 0.25 -0.14 -0.05 0.00 0.30 0.00 0.00 27.48 27.83 1s5r h GLN 378 CO -0.00 0.54 0.64 0.74 -0.67 0.00 0.00 178.83 180.08 1s5r h PHE 379 N 0.73 1.20 -2.08 2.96 -1.00 -1.33 -3.43 116.94 113.98 1s5r h PHE 379 Ca 0.18 0.03 -0.63 0.00 2.81 0.00 0.00 57.97 60.36 1s5r h PHE 379 Cb 0.05 -0.40 0.07 0.00 3.61 0.00 0.00 35.95 39.27 1s5r h PHE 379 CO 0.00 0.70 0.53 1.28 -1.61 0.00 0.00 178.31 179.22 1s5r n LEU 380 N -4.45 2.26 -4.44 1.54 4.77 -0.85 -4.75 117.00 111.08 1s5r n LEU 380 Ca 0.13 1.12 -0.49 0.00 -0.03 0.00 0.00 56.01 56.73 1s5r n LEU 380 Cb 0.08 -1.30 -0.08 0.00 -2.33 0.00 0.00 43.42 39.78 1s5r n LEU 380 CO 0.35 -0.81 1.86 -2.65 -1.33 0.00 0.00 177.39 174.81 1s5r n PRO 381 N 2.48 0.85 -2.26 3.23 -0.02 -1.26 -4.91 135.00 133.12 1s5r n PRO 381 Ca 0.16 0.20 -0.34 0.00 -2.02 0.00 0.00 63.50 61.50 1s5r n PRO 381 Cb 0.25 -2.36 -0.00 0.00 -0.02 0.00 0.00 33.50 31.37 1s5r n PRO 381 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1s5r s ASP 382 N 7.82 5.90 0.00 2.55 1.11 -1.26 -5.18 116.67 127.61 1s5r s ASP 382 Ca 1.12 1.97 0.32 0.00 0.18 0.00 0.00 52.55 56.14 1s5r s ASP 382 Cb -0.90 -2.56 1.89 0.00 1.07 0.00 0.00 42.92 42.42 1s5r s ASP 382 CO 0.49 -1.09 2.22 0.00 1.18 0.00 0.00 175.17 177.97