#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r8h n SER 282 N 0.00 0.78 -4.38 4.04 3.41 -1.26 -4.94 113.62 111.27 1r8h n SER 282 Ca 0.00 -0.89 -0.32 0.00 -0.26 0.00 0.00 58.87 57.40 1r8h n SER 282 Cb 0.00 0.82 -0.15 0.00 -0.26 0.00 0.00 64.21 64.63 1r8h n SER 282 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1r8h s ALA 283 N -1.84 2.50 -0.23 7.33 0.00 -1.26 -0.45 121.76 127.82 1r8h s ALA 283 Ca 0.06 -0.97 -0.10 0.00 0.00 0.00 0.00 51.96 50.95 1r8h s ALA 283 Cb 0.09 -0.97 -0.05 0.00 0.00 0.00 0.00 23.12 22.19 1r8h s ALA 283 CO 0.39 0.41 0.14 0.99 0.00 0.00 0.00 175.76 177.68 1r8h s THR 284 N -0.18 5.22 0.26 0.00 2.01 0.88 -4.79 115.64 119.04 1r8h s THR 284 Ca -0.01 0.13 -0.29 0.00 0.31 0.00 0.00 61.69 61.82 1r8h s THR 284 Cb -0.13 -3.42 -0.09 0.00 0.01 0.00 0.00 72.50 68.87 1r8h s THR 284 CO 0.03 0.37 1.18 -2.16 -0.69 0.00 0.00 174.62 173.35 1r8h s PRO 285 N 0.92 4.53 0.12 4.92 0.04 -1.26 -1.67 135.00 142.61 1r8h s PRO 285 Ca 0.07 1.91 0.01 0.00 0.04 0.00 0.00 61.00 63.03 1r8h s PRO 285 Cb -0.13 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.18 1r8h s PRO 285 CO 0.03 0.03 -0.03 0.96 0.04 0.00 0.00 177.00 178.03 1r8h s ILE 286 N -0.77 0.58 -0.08 0.56 -4.36 0.04 -1.83 121.20 115.35 1r8h s ILE 286 Ca 0.48 -1.94 0.03 0.00 -0.26 0.00 0.00 60.65 58.96 1r8h s ILE 286 Cb -0.34 -1.86 0.01 0.00 1.25 0.00 0.00 42.46 41.52 1r8h s ILE 286 CO 0.42 -0.70 -0.16 -0.69 0.24 0.00 0.00 174.94 174.05 1r8h s VAL 287 N -3.71 1.45 -0.22 8.37 1.01 -0.21 -2.42 120.40 124.66 1r8h s VAL 287 Ca 0.17 -0.65 -0.06 0.00 0.00 0.00 0.00 61.98 61.44 1r8h s VAL 287 Cb 0.06 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 35.12 1r8h s VAL 287 CO -0.01 0.43 0.03 -1.58 0.00 0.00 0.00 175.10 173.96 1r8h s GLN 288 N 0.65 3.60 -0.00 2.72 0.74 -0.03 -0.80 119.66 126.55 1r8h s GLN 288 Ca -0.14 -0.51 -0.02 0.00 0.05 0.00 0.00 55.36 54.74 1r8h s GLN 288 Cb -0.16 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 30.73 1r8h s GLN 288 CO 0.04 -0.11 0.14 -0.06 -0.55 0.00 0.00 175.29 174.75 1r8h s PHE 289 N 1.34 3.43 0.04 1.67 0.40 0.61 -1.15 117.98 124.31 1r8h s PHE 289 Ca 0.04 0.29 -0.04 0.00 -0.60 0.00 0.00 56.93 56.62 1r8h s PHE 289 Cb -0.15 -1.78 -0.02 0.00 0.51 0.00 0.00 43.02 41.58 1r8h s PHE 289 CO 0.02 0.60 0.06 -1.14 0.70 0.00 0.00 175.22 175.46 1r8h s GLN 290 N -1.87 0.58 0.00 0.44 0.74 0.29 -0.99 119.66 118.85 1r8h s GLN 290 Ca 0.25 -0.85 0.00 0.00 0.05 0.00 0.00 55.36 54.82 1r8h s GLN 290 Cb -0.12 0.22 0.00 0.00 1.10 0.00 0.00 33.01 34.21 1r8h s GLN 290 CO 0.17 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.18 1r8h n GLY 291 N 0.67 0.40 3.67 2.59 0.00 -1.04 -1.58 105.19 109.90 1r8h n GLY 291 Ca -0.18 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 43.86 1r8h n GLY 291 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1r8h s GLU 292 N -2.00 4.27 0.02 1.61 2.56 -1.26 -1.54 118.70 122.36 1r8h s GLU 292 Ca 0.00 1.78 -0.04 0.00 0.00 0.00 0.00 54.97 56.71 1r8h s GLU 292 Cb 0.00 -3.69 -0.01 0.00 2.00 0.00 0.00 34.13 32.43 1r8h s GLU 292 CO 0.00 -0.62 0.40 0.43 -0.56 0.00 0.00 175.26 174.91 1r8h n SER 293 N 6.01 -0.14 -0.05 -1.70 7.64 -1.26 0.50 113.62 124.63 1r8h n SER 293 Ca 0.13 0.43 -0.09 0.00 1.01 0.00 0.00 58.87 60.35 1r8h n SER 293 Cb 0.45 -0.13 -0.03 0.00 -1.01 0.00 0.00 64.21 63.49 1r8h n SER 293 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 1r8h h ASN 294 N 0.00 -0.94 0.00 6.43 2.35 -2.00 -1.18 115.58 120.24 1r8h h ASN 294 Ca 0.02 0.15 -0.07 0.00 -0.55 0.00 0.00 56.30 55.86 1r8h h ASN 294 Cb 0.05 0.42 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 1r8h h ASN 294 CO -0.12 -0.32 -0.18 0.00 -1.65 0.00 0.00 177.43 175.16 1r8h h LEU 296 N 0.31 0.56 -0.47 0.00 5.85 0.25 -2.92 115.31 118.89 1r8h h LEU 296 Ca 0.06 -0.28 -0.14 0.00 0.84 0.00 0.00 57.88 58.35 1r8h h LEU 296 Cb 0.50 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1r8h h LEU 296 CO 0.03 0.96 -0.27 0.11 -0.34 0.00 0.00 178.44 178.93 1r8h h LYS 297 N 0.41 0.97 -0.76 1.25 1.57 -1.04 -2.01 116.57 116.96 1r8h h LYS 297 Ca 0.02 -0.44 0.17 0.00 -1.87 0.00 0.00 60.65 58.52 1r8h h LYS 297 Cb 1.01 -0.02 -0.11 0.00 0.08 0.00 0.00 32.23 33.19 1r8h h LYS 297 CO 0.09 1.11 0.21 0.00 -0.57 0.00 0.00 179.45 180.30 1r8h h PHE 299 N 0.30 -0.24 -0.94 0.00 3.57 -1.27 -2.81 116.94 115.54 1r8h h PHE 299 Ca 0.43 -0.01 0.22 0.00 3.53 0.00 0.00 57.97 62.15 1r8h h PHE 299 Cb 0.75 0.08 -0.18 0.00 2.79 0.00 0.00 35.95 39.39 1r8h h PHE 299 CO -0.24 0.04 -0.10 0.00 -2.23 0.00 0.00 178.31 175.78 1r8h h ARG 300 N -0.51 0.02 -0.45 1.11 3.08 -1.12 -0.05 114.38 116.45 1r8h h ARG 300 Ca -0.03 -0.00 -0.10 0.00 0.07 0.00 0.00 59.98 59.93 1r8h h ARG 300 Cb 0.39 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1r8h h ARG 300 CO 0.04 0.01 -0.11 1.88 -1.07 0.00 0.00 179.97 180.72 1r8h h TYR 301 N 0.02 0.90 -0.55 3.04 0.99 -1.24 -0.74 116.97 119.38 1r8h h TYR 301 Ca 0.51 -0.17 -0.01 0.00 2.00 0.00 0.00 58.73 61.06 1r8h h TYR 301 Cb 0.91 -0.23 -0.03 0.00 1.00 0.00 0.00 36.73 38.39 1r8h h TYR 301 CO -0.60 0.88 0.31 -0.09 -0.00 0.00 0.00 178.16 178.66 1r8h h ARG 302 N 0.73 0.77 -0.40 4.88 2.43 -0.87 -0.13 114.38 121.79 1r8h h ARG 302 Ca 0.12 -0.08 0.06 0.00 -0.81 0.00 0.00 59.98 59.27 1r8h h ARG 302 Cb 0.61 -0.15 -0.05 0.00 -0.42 0.00 0.00 29.97 29.95 1r8h h ARG 302 CO 0.04 0.58 0.10 -0.07 -1.51 0.00 0.00 179.97 179.12 1r8h h LEU 303 N 0.74 0.06 -0.40 3.80 3.38 -0.11 -0.93 115.31 121.85 1r8h h LEU 303 Ca 0.20 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.23 1r8h h LEU 303 Cb 0.03 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1r8h h LEU 303 CO -0.03 0.07 0.00 0.78 0.09 0.00 0.00 178.44 179.35 1r8h h ASN 304 N 0.24 0.00 0.06 -0.43 2.35 -0.96 -0.43 115.58 116.41 1r8h h ASN 304 Ca 0.19 0.00 -0.25 0.00 -0.55 0.00 0.00 56.30 55.69 1r8h h ASN 304 Cb 0.21 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.61 1r8h h ASN 304 CO -0.23 0.00 -1.03 -0.78 -1.65 0.00 0.00 177.43 173.74 1r8h h ASP 304 N 0.00 0.80 0.00 5.81 3.58 0.03 -3.42 116.42 123.22 1r8h h ASP 304 Ca 0.00 -0.79 0.00 0.00 0.42 0.00 0.00 57.03 56.66 1r8h h ASP 304 Cb 0.74 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.54 1r8h h ASP 304 CO 0.00 1.50 -0.97 0.29 -2.88 0.00 0.00 179.24 177.18 1r8h n LYS 305 N -3.92 0.23 -2.24 0.28 5.02 -0.46 -4.93 118.16 112.15 1r8h n LYS 305 Ca -0.12 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 55.96 1r8h n LYS 305 Cb 0.88 -0.99 0.02 0.00 -0.02 0.00 0.00 35.03 34.93 1r8h n LYS 305 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 1r8h n HIS 306 N -1.46 2.60 0.38 2.13 8.25 -0.18 -4.89 115.22 122.05 1r8h n HIS 306 Ca 0.00 -2.39 0.12 0.00 -0.26 0.00 0.00 57.72 55.19 1r8h n HIS 306 Cb 0.01 -0.28 0.07 0.00 1.12 0.00 0.00 29.99 30.90 1r8h n HIS 306 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1r8h n ARG 307 N -0.63 0.42 0.00 -0.41 1.74 -1.26 -3.16 116.66 113.36 1r8h n ARG 307 Ca 0.37 0.07 0.11 0.00 -0.77 0.00 0.00 57.85 57.63 1r8h n ARG 307 Cb 0.89 -1.71 0.52 0.00 -1.02 0.00 0.00 32.46 31.14 1r8h n ARG 307 CO 0.00 0.00 0.00 -2.39 -1.52 0.00 0.00 177.63 173.72 1r8h n HIS 308 N -2.29 0.00 0.76 -1.55 1.44 -1.26 -3.76 115.22 108.56 1r8h n HIS 308 Ca 0.02 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.81 1r8h n HIS 308 Cb 0.48 -0.39 0.01 0.00 0.12 0.00 0.00 29.99 30.21 1r8h n HIS 308 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1r8h n LEU 309 N -1.39 1.78 -4.14 2.39 4.77 -1.19 -4.99 117.00 114.23 1r8h n LEU 309 Ca 0.08 -0.79 -0.13 0.00 -0.03 0.00 0.00 56.01 55.14 1r8h n LEU 309 Cb 0.22 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.23 1r8h n LEU 309 CO 0.19 0.33 -0.04 0.72 -1.33 0.00 0.00 177.39 177.26 1r8h s PHE 310 N -1.93 1.06 0.00 -1.77 -0.12 -1.25 -4.48 117.98 109.49 1r8h s PHE 310 Ca 0.15 -1.26 0.00 0.00 -0.05 0.00 0.00 56.93 55.77 1r8h s PHE 310 Cb 0.14 -0.32 0.00 0.00 -0.63 0.00 0.00 43.02 42.21 1r8h s PHE 310 CO 0.41 -0.86 0.00 -3.47 -0.05 0.00 0.00 175.22 171.24 1r8h n ASP 311 N -0.75 0.00 -4.92 1.98 2.03 0.50 -4.91 116.55 110.48 1r8h n ASP 311 Ca 0.02 0.00 -0.25 0.00 0.52 0.00 0.00 54.79 55.08 1r8h n ASP 311 Cb 0.63 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 41.00 1r8h n ASP 311 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1r8h s LEU 312 N -0.64 4.21 -0.02 -2.67 1.43 -1.20 -4.91 118.68 114.88 1r8h s LEU 312 Ca 0.00 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 1r8h s LEU 312 Cb 0.00 -2.78 0.02 0.00 0.03 0.00 0.00 46.19 43.46 1r8h s LEU 312 CO 0.00 0.03 0.02 -0.51 0.23 0.00 0.00 176.35 176.11 1r8h s ILE 313 N -1.81 0.03 0.60 -0.59 2.07 -1.26 -0.79 121.20 119.45 1r8h s ILE 313 Ca 0.34 0.14 -0.08 0.00 -1.41 0.00 0.00 60.65 59.64 1r8h s ILE 313 Cb -0.10 -0.13 -0.01 0.00 0.13 0.00 0.00 42.46 42.35 1r8h s ILE 313 CO 0.27 0.09 0.94 -0.94 -1.91 0.00 0.00 174.94 173.40 1r8h s SER 314 N 0.88 5.78 1.08 4.50 1.04 -0.19 -5.01 113.70 121.77 1r8h s SER 314 Ca -0.08 0.95 -0.13 0.00 0.48 0.00 0.00 55.95 57.18 1r8h s SER 314 Cb -0.11 -1.97 0.23 0.00 0.10 0.00 0.00 66.02 64.27 1r8h s SER 314 CO -0.02 -1.01 1.07 -0.94 0.98 0.00 0.00 173.24 173.32 1r8h s SER 315 N -4.26 1.88 0.13 7.02 1.04 -1.26 -4.67 113.70 113.58 1r8h s SER 315 Ca 0.54 1.29 -0.28 0.00 0.48 0.00 0.00 55.95 57.98 1r8h s SER 315 Cb -0.11 -2.00 -0.07 0.00 0.10 0.00 0.00 66.02 63.94 1r8h s SER 315 CO 0.48 -3.61 0.87 0.42 0.98 0.00 0.00 173.24 172.38 1r8h s THR 316 N -2.77 4.45 0.25 2.02 -4.23 -1.26 -4.64 115.64 109.47 1r8h s THR 316 Ca 0.67 1.89 -0.00 0.00 -1.18 0.00 0.00 61.69 63.06 1r8h s THR 316 Cb -0.21 -4.23 -0.03 0.00 1.34 0.00 0.00 72.50 69.36 1r8h s THR 316 CO 0.60 0.40 0.23 -1.66 -0.54 0.00 0.00 174.62 173.66 1r8h s TRP 317 N -0.46 1.22 0.22 3.99 1.48 -0.05 -4.91 118.94 120.44 1r8h s TRP 317 Ca 0.41 -1.38 -0.13 0.00 -1.06 0.00 0.00 56.10 53.94 1r8h s TRP 317 Cb -0.23 -0.48 0.00 0.00 -1.16 0.00 0.00 33.47 31.60 1r8h s TRP 317 CO 0.28 -0.78 0.46 -3.38 -4.06 0.00 0.00 176.95 169.47 1r8h s HIS 318 N -3.87 0.27 0.34 1.66 -3.43 -1.26 0.11 115.29 109.11 1r8h s HIS 318 Ca 0.37 -0.63 -0.12 0.00 -0.80 0.00 0.00 55.06 53.89 1r8h s HIS 318 Cb 0.04 0.20 -0.07 0.00 -1.43 0.00 0.00 32.58 31.32 1r8h s HIS 318 CO 0.16 -0.94 0.71 -1.58 -2.00 0.00 0.00 174.74 171.10 1r8h s TRP 319 N -3.98 3.43 -0.89 0.38 0.52 -1.26 -5.05 118.94 112.08 1r8h s TRP 319 Ca 0.19 1.06 -0.00 0.00 0.02 0.00 0.00 56.10 57.36 1r8h s TRP 319 Cb -0.00 -2.43 0.27 0.00 -1.15 0.00 0.00 33.47 30.16 1r8h s TRP 319 CO 0.05 0.03 1.05 0.00 0.02 0.00 0.00 176.95 178.10 1r8h n ALA 320 N -0.79 4.42 -1.87 0.98 0.00 -1.26 -4.97 120.51 117.03 1r8h n ALA 320 Ca 0.02 -4.74 -0.15 0.00 0.00 0.00 0.00 53.44 48.57 1r8h n ALA 320 Cb 0.53 -1.70 0.12 0.00 0.00 0.00 0.00 19.45 18.41 1r8h n ALA 320 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1r8h n SER 321 N 1.46 0.30 -1.05 0.00 2.88 -1.26 -5.26 113.62 110.68 1r8h n SER 321 Ca 0.26 -1.45 0.02 0.00 -1.33 0.00 0.00 58.87 56.37 1r8h n SER 321 Cb 0.37 -0.62 0.16 0.00 -0.75 0.00 0.00 64.21 63.36 1r8h n SER 321 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1r8h n PRO 322 N -2.74 2.50 -1.23 -1.46 -0.04 -1.26 -5.31 135.00 125.47 1r8h n PRO 322 Ca 0.11 -1.23 -0.01 0.00 -0.04 0.00 0.00 63.50 62.34 1r8h n PRO 322 Cb 0.40 -1.79 0.01 0.00 -0.04 0.00 0.00 33.50 32.07 1r8h n PRO 322 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1r8h n LYS 327 N 0.24 0.13 -2.88 0.54 4.76 -1.26 -5.28 118.16 114.41 1r8h n LYS 327 Ca 0.11 -0.19 -0.31 0.00 -2.87 0.00 0.00 58.31 55.05 1r8h n LYS 327 Cb 0.63 0.25 -0.04 0.00 -1.84 0.00 0.00 35.03 34.03 1r8h n LYS 327 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1r8h s HIS 328 N 0.01 3.43 0.63 2.13 3.76 -1.26 -4.96 115.29 119.03 1r8h s HIS 328 Ca 0.01 1.16 -0.15 0.00 -0.15 0.00 0.00 55.06 55.93 1r8h s HIS 328 Cb 0.04 -2.53 -0.02 0.00 1.11 0.00 0.00 32.58 31.19 1r8h s HIS 328 CO -0.01 -0.08 1.08 0.00 -0.85 0.00 0.00 174.74 174.87 1r8h s ALA 329 N -2.29 2.63 0.00 -1.40 0.00 -0.59 -4.66 121.76 115.46 1r8h s ALA 329 Ca 0.53 0.41 0.01 0.00 0.00 0.00 0.00 51.96 52.92 1r8h s ALA 329 Cb -0.10 -3.26 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 1r8h s ALA 329 CO 0.27 -1.03 -0.05 0.42 0.00 0.00 0.00 175.76 175.37 1r8h s ILE 330 N -2.48 0.37 -0.05 0.00 1.01 0.12 -2.50 121.20 117.66 1r8h s ILE 330 Ca 0.64 -0.31 0.03 0.00 0.00 0.00 0.00 60.65 61.01 1r8h s ILE 330 Cb -0.17 -0.34 0.01 0.00 0.01 0.00 0.00 42.46 41.97 1r8h s ILE 330 CO 0.41 0.03 -0.14 -0.69 0.00 0.00 0.00 174.94 174.55 1r8h s VAL 331 N -0.28 1.23 -0.20 2.92 1.01 -0.16 -0.87 120.40 124.04 1r8h s VAL 331 Ca -0.00 -0.57 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 1r8h s VAL 331 Cb -0.03 -1.09 -0.05 0.00 0.00 0.00 0.00 36.38 35.22 1r8h s VAL 331 CO -0.00 0.37 0.21 -0.89 0.00 0.00 0.00 175.10 174.79 1r8h s THR 332 N 0.35 5.35 -0.09 3.92 2.01 -1.26 -0.29 115.64 125.63 1r8h s THR 332 Ca -0.09 0.35 0.03 0.00 0.31 0.00 0.00 61.69 62.29 1r8h s THR 332 Cb -0.13 -3.55 -0.01 0.00 0.01 0.00 0.00 72.50 68.81 1r8h s THR 332 CO 0.03 0.39 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.48 1r8h s VAL 333 N 0.62 2.65 0.33 3.82 1.01 0.02 -1.02 120.40 127.84 1r8h s VAL 333 Ca 0.12 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.35 1r8h s VAL 333 Cb -0.12 -2.05 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1r8h s VAL 333 CO 0.02 0.55 0.16 0.42 0.00 0.00 0.00 175.10 176.25 1r8h s THR 334 N 0.01 3.16 0.06 3.92 -4.23 0.03 -1.04 115.64 117.54 1r8h s THR 334 Ca -0.06 -1.66 0.05 0.00 -1.18 0.00 0.00 61.69 58.84 1r8h s THR 334 Cb -0.15 -3.01 -0.03 0.00 1.34 0.00 0.00 72.50 70.66 1r8h s THR 334 CO 0.05 -0.20 -0.13 -0.31 -0.54 0.00 0.00 174.62 173.49 1r8h s TYR 335 N -2.39 1.15 0.33 3.99 1.51 -0.76 -0.37 117.35 120.81 1r8h s TYR 335 Ca 0.38 -0.44 0.19 0.00 -1.01 0.00 0.00 57.07 56.19 1r8h s TYR 335 Cb -0.03 -0.66 0.97 0.00 -0.11 0.00 0.00 41.96 42.13 1r8h s TYR 335 CO 0.23 0.04 1.89 1.25 -1.11 0.00 0.00 175.55 177.85 1r8h h HIS 336 N 4.47 0.00 -2.63 2.71 -0.00 -1.91 -3.40 115.15 114.39 1r8h h HIS 336 Ca -0.40 0.00 0.08 0.00 -0.00 0.00 0.00 60.37 60.06 1r8h h HIS 336 Cb 1.19 0.00 -0.11 0.00 -0.00 0.00 0.00 27.41 28.49 1r8h h HIS 336 CO 0.61 0.28 0.36 -1.54 -0.00 0.00 0.00 177.93 177.64 1r8h s SER 337 N -6.54 -0.36 0.43 3.26 1.04 -1.26 -5.00 113.70 105.27 1r8h s SER 337 Ca -0.02 -0.21 0.11 0.00 0.48 0.00 0.00 55.95 56.31 1r8h s SER 337 Cb 0.13 0.53 0.95 0.00 0.10 0.00 0.00 66.02 67.73 1r8h s SER 337 CO 0.67 -0.92 2.02 -0.33 0.98 0.00 0.00 173.24 175.66 1r8h h GLU 338 N 2.00 0.24 -0.54 4.02 5.08 -1.96 -1.78 114.58 121.65 1r8h h GLU 338 Ca -0.25 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.03 1r8h h GLU 338 Cb 1.26 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 1r8h h GLU 338 CO 0.30 0.26 0.16 0.93 -1.00 0.00 0.00 179.01 179.65 1r8h h GLU 339 N 0.24 0.84 -0.53 2.33 3.07 -2.00 -1.23 114.58 117.30 1r8h h GLU 339 Ca 0.06 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.64 1r8h h GLU 339 Cb 0.15 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.92 1r8h h GLU 339 CO 0.00 0.78 -0.03 0.37 -1.40 0.00 0.00 179.01 178.73 1r8h h GLN 340 N 0.74 0.96 -0.55 2.33 4.15 -1.75 -1.92 115.11 119.07 1r8h h GLN 340 Ca 0.17 -0.32 0.08 0.00 0.77 0.00 0.00 58.65 59.34 1r8h h GLN 340 Cb 0.30 -0.08 -0.06 0.00 0.21 0.00 0.00 27.48 27.85 1r8h h GLN 340 CO -0.00 0.99 0.21 -0.09 -1.93 0.00 0.00 178.83 178.01 1r8h h ARG 341 N 0.84 0.39 -0.63 1.69 2.43 -1.00 -1.08 114.38 117.01 1r8h h ARG 341 Ca 0.15 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.23 1r8h h ARG 341 Cb 0.58 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.01 1r8h h ARG 341 CO 0.03 0.26 0.15 0.37 -1.51 0.00 0.00 179.97 179.27 1r8h h GLN 342 N 0.40 1.00 -0.94 0.20 5.75 -0.82 -2.10 115.11 118.60 1r8h h GLN 342 Ca 0.27 -0.24 0.03 0.00 -0.15 0.00 0.00 58.65 58.56 1r8h h GLN 342 Cb 0.30 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.66 1r8h h GLN 342 CO -0.27 0.91 0.62 1.96 -2.65 0.00 0.00 178.83 179.40 1r8h h GLN 343 N 0.92 1.18 -0.25 1.69 4.20 -1.00 0.36 115.11 122.21 1r8h h GLN 343 Ca 0.20 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 1r8h h GLN 343 Cb 0.36 -0.27 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1r8h h GLN 343 CO 0.00 0.78 0.16 0.35 -0.67 0.00 0.00 178.83 179.45 1r8h h PHE 344 N 1.21 0.33 -0.03 2.96 3.57 -0.74 -1.42 116.94 122.84 1r8h h PHE 344 Ca 0.37 0.00 -0.16 0.00 3.53 0.00 0.00 57.97 61.71 1r8h h PHE 344 Cb -0.04 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.58 1r8h h PHE 344 CO -0.01 0.25 -0.71 -0.07 -2.23 0.00 0.00 178.31 175.54 1r8h h LEU 345 N 0.32 0.19 -0.81 0.59 3.38 -1.07 0.34 115.31 118.25 1r8h h LEU 345 Ca 0.09 -0.13 0.12 0.00 0.09 0.00 0.00 57.88 58.05 1r8h h LEU 345 Cb 0.01 -0.06 -0.08 0.00 0.09 0.00 0.00 40.66 40.62 1r8h h LEU 345 CO -0.02 0.84 0.42 0.78 0.09 0.00 0.00 178.44 180.55 1r8h h ASN 346 N 0.11 0.53 0.00 -0.43 -0.26 -0.08 -3.38 115.58 112.08 1r8h h ASN 346 Ca -0.02 0.08 -0.31 0.00 -0.56 0.00 0.00 56.30 55.49 1r8h h ASN 346 Cb 1.26 -0.01 -0.05 0.00 -1.06 0.00 0.00 38.32 38.46 1r8h h ASN 346 CO 0.11 0.26 -1.88 0.52 -1.06 0.00 0.00 177.43 175.37 1r8h n VAL 347 N -4.85 1.52 -2.46 2.81 0.31 -0.55 -5.00 118.33 110.12 1r8h n VAL 347 Ca 0.15 -0.18 -0.41 0.00 -0.01 0.00 0.00 64.34 63.89 1r8h n VAL 347 Cb 0.36 -2.03 -0.04 0.00 -0.91 0.00 0.00 33.84 31.23 1r8h n VAL 347 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1r8h s VAL 348 N -2.53 3.64 -0.24 2.52 1.01 0.12 -5.01 120.40 119.90 1r8h s VAL 348 Ca -0.34 1.48 -0.16 0.00 0.00 0.00 0.00 61.98 62.96 1r8h s VAL 348 Cb 0.10 -3.94 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 1r8h s VAL 348 CO 0.48 0.28 0.41 -0.75 0.00 0.00 0.00 175.10 175.53 1r8h s LYS 349 N -0.71 4.09 -0.38 2.72 2.47 -1.26 -4.82 119.74 121.85 1r8h s LYS 349 Ca 0.49 0.16 -0.17 0.00 -1.56 0.00 0.00 55.97 54.89 1r8h s LYS 349 Cb -0.31 -3.61 0.00 0.00 -1.46 0.00 0.00 37.83 32.45 1r8h s LYS 349 CO 0.38 -0.20 0.45 0.42 0.16 0.00 0.00 175.35 176.56 1r8h s ILE 350 N 1.82 5.07 0.63 5.43 1.01 -1.26 -5.03 121.20 128.88 1r8h s ILE 350 Ca 0.18 0.01 -0.17 0.00 0.00 0.00 0.00 60.65 60.67 1r8h s ILE 350 Cb -0.15 -3.97 -0.11 0.00 0.01 0.00 0.00 42.46 38.24 1r8h s ILE 350 CO 0.09 -0.28 0.11 -2.65 0.00 0.00 0.00 174.94 172.21 1r8h n PRO 351 N 5.63 0.19 0.23 2.79 -0.02 -1.26 -4.86 135.00 137.70 1r8h n PRO 351 Ca -0.07 0.08 0.08 0.00 -2.02 0.00 0.00 63.50 61.58 1r8h n PRO 351 Cb 0.48 -1.37 0.56 0.00 -0.02 0.00 0.00 33.50 33.15 1r8h n PRO 351 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1r8h h PRO 352 N -0.17 0.00 0.00 0.52 0.13 -2.02 -2.57 132.00 127.90 1r8h h PRO 352 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1r8h h PRO 352 Cb 1.39 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.52 1r8h h PRO 352 CO 0.41 0.21 0.00 0.25 -0.23 0.00 0.00 178.00 178.64 1r8h n THR 353 N -3.87 0.88 -4.08 1.56 -2.24 -1.26 -4.80 114.28 100.46 1r8h n THR 353 Ca -0.02 0.26 -0.34 0.00 -2.27 0.00 0.00 64.05 61.69 1r8h n THR 353 Cb 0.30 -1.17 -0.15 0.00 -2.10 0.00 0.00 70.33 67.21 1r8h n THR 353 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1r8h s ILE 354 N -3.28 2.59 0.36 2.28 1.01 -0.97 -4.55 121.20 118.64 1r8h s ILE 354 Ca 0.04 -0.76 -0.12 0.00 0.00 0.00 0.00 60.65 59.81 1r8h s ILE 354 Cb 0.09 -2.13 -0.08 0.00 0.01 0.00 0.00 42.46 40.36 1r8h s ILE 354 CO 0.36 0.50 0.74 -0.13 0.00 0.00 0.00 174.94 176.41 1r8h s ARG 355 N 1.32 3.87 0.04 2.79 0.52 -0.62 -4.81 118.95 122.07 1r8h s ARG 355 Ca 0.04 0.54 0.02 0.00 -0.52 0.00 0.00 55.73 55.81 1r8h s ARG 355 Cb -0.14 -2.42 -0.03 0.00 0.52 0.00 0.00 34.95 32.89 1r8h s ARG 355 CO -0.08 0.07 -0.07 -3.38 0.02 0.00 0.00 175.30 171.85 1r8h s HIS 356 N -2.18 0.62 0.09 -0.53 -3.43 -1.26 -0.54 115.29 108.06 1r8h s HIS 356 Ca 0.52 -0.57 0.06 0.00 -0.80 0.00 0.00 55.06 54.28 1r8h s HIS 356 Cb -0.10 -0.38 -0.03 0.00 -1.43 0.00 0.00 32.58 30.63 1r8h s HIS 356 CO 0.25 -0.12 -0.16 0.15 -2.00 0.00 0.00 174.74 172.87 1r8h s LYS 357 N -1.87 0.92 0.03 -0.38 1.02 -0.30 -4.99 119.74 114.17 1r8h s LYS 357 Ca -0.08 -1.05 -0.01 0.00 0.02 0.00 0.00 55.97 54.84 1r8h s LYS 357 Cb -0.08 -0.96 -0.04 0.00 -0.52 0.00 0.00 37.83 36.23 1r8h s LYS 357 CO -0.01 0.21 0.19 -0.51 -0.92 0.00 0.00 175.35 174.31 1r8h s LEU 358 N -1.91 4.33 0.00 3.17 1.43 -1.26 -0.85 118.68 123.59 1r8h s LEU 358 Ca 0.02 0.29 0.00 0.00 -1.03 0.00 0.00 54.13 53.41 1r8h s LEU 358 Cb -0.09 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.37 1r8h s LEU 358 CO 0.03 0.22 0.00 0.61 0.23 0.00 0.00 176.35 177.44 1r8h n GLY 359 N 0.64 1.39 3.15 -3.19 0.00 -1.02 -4.98 105.19 101.17 1r8h n GLY 359 Ca -0.08 -0.79 -0.18 0.00 0.00 0.00 0.00 46.02 44.97 1r8h n GLY 359 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1r8h s PHE 360 N -3.87 1.13 0.12 1.61 -0.12 -1.26 -0.78 117.98 114.81 1r8h s PHE 360 Ca 0.00 -0.44 0.05 0.00 -0.05 0.00 0.00 56.93 56.49 1r8h s PHE 360 Cb 0.00 -0.65 -0.04 0.00 -0.63 0.00 0.00 43.02 41.70 1r8h s PHE 360 CO 0.00 0.03 -0.11 0.00 -0.05 0.00 0.00 175.22 175.09 1r8h s MET 361 N -1.57 0.98 0.28 1.99 0.23 -0.67 -4.93 119.30 115.61 1r8h s MET 361 Ca -0.02 -1.30 -0.30 0.00 -1.03 0.00 0.00 55.69 53.04 1r8h s MET 361 Cb -0.09 -0.67 -0.12 0.00 -1.53 0.00 0.00 34.83 32.42 1r8h s MET 361 CO 0.02 0.10 1.62 0.43 -2.03 0.00 0.00 175.02 175.16 1r8h n SER 362 N 0.25 3.89 0.26 -1.18 7.64 -1.26 -0.08 113.62 123.13 1r8h n SER 362 Ca -0.14 1.13 0.10 0.00 1.01 0.00 0.00 58.87 60.97 1r8h n SER 362 Cb 0.59 -1.59 0.69 0.00 -1.01 0.00 0.00 64.21 62.88 1r8h n SER 362 CO 0.00 0.00 0.00 -0.03 -3.01 0.00 0.00 175.04 172.00 1r8h h MET 363 N 5.10 0.00 0.00 1.43 4.05 -1.07 -1.02 114.93 123.42 1r8h h MET 363 Ca -0.46 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 58.96 1r8h h MET 363 Cb 1.22 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.02 1r8h h MET 363 CO 0.82 0.05 0.00 1.25 0.23 0.00 0.00 176.91 179.26 1r8h h HIS 364 N 0.00 0.00 -0.37 1.39 -0.00 -1.90 -2.33 115.15 111.94 1r8h h HIS 364 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1r8h h HIS 364 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.51 1r8h h HIS 364 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.93 179.21 1r8h n LEU 365 N -3.03 3.87 -0.39 0.26 4.77 -0.39 -5.26 117.00 116.83 1r8h n LEU 365 Ca -0.02 -1.96 0.05 0.00 -0.03 0.00 0.00 56.01 54.05 1r8h n LEU 365 Cb 0.13 -0.59 0.04 0.00 -2.33 0.00 0.00 43.42 40.67 1r8h n LEU 365 CO 0.21 0.50 0.40 0.18 -1.33 0.00 0.00 177.39 177.36