#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jj4 s THR 287 N 0.00 4.72 0.17 2.03 2.01 -1.14 -4.83 115.64 118.61 1jj4 s THR 287 Ca 0.00 1.48 -0.31 0.00 0.31 0.00 0.00 61.69 63.17 1jj4 s THR 287 Cb 0.00 -4.04 -0.09 0.00 0.01 0.00 0.00 72.50 68.38 1jj4 s THR 287 CO 0.00 0.43 1.44 -2.16 -0.69 0.00 0.00 174.62 173.64 1jj4 s PRO 288 N -0.39 4.29 0.32 4.92 0.04 -1.26 -2.65 135.00 140.26 1jj4 s PRO 288 Ca 0.35 2.20 0.03 0.00 0.04 0.00 0.00 61.00 63.62 1jj4 s PRO 288 Cb -0.20 -3.18 -0.01 0.00 0.04 0.00 0.00 34.50 31.14 1jj4 s PRO 288 CO 0.21 -0.46 0.35 0.44 0.04 0.00 0.00 177.00 177.58 1jj4 n ILE 289 N 3.42 0.00 -3.76 0.56 -6.64 0.53 -0.76 119.36 112.70 1jj4 n ILE 289 Ca 0.10 -2.00 -0.13 0.00 -1.77 0.00 0.00 62.75 58.95 1jj4 n ILE 289 Cb 0.41 1.08 -0.10 0.00 -1.44 0.00 0.00 39.64 39.59 1jj4 n ILE 289 CO 0.00 0.00 0.00 0.27 -1.77 0.00 0.00 176.55 175.05 1jj4 s ILE 290 N -3.05 0.02 -0.14 7.28 -4.36 -0.06 -1.97 121.20 118.91 1jj4 s ILE 290 Ca 0.33 -0.13 -0.02 0.00 -0.26 0.00 0.00 60.65 60.56 1jj4 s ILE 290 Cb 0.01 -0.51 -0.02 0.00 1.25 0.00 0.00 42.46 43.18 1jj4 s ILE 290 CO 0.23 -0.07 -0.06 -1.00 0.24 0.00 0.00 174.94 174.28 1jj4 s HIS 291 N -0.23 2.96 -0.32 1.37 3.76 0.15 -1.05 115.29 121.93 1jj4 s HIS 291 Ca -0.04 -0.38 -0.04 0.00 -0.15 0.00 0.00 55.06 54.45 1jj4 s HIS 291 Cb -0.03 -1.91 0.04 0.00 1.11 0.00 0.00 32.58 31.79 1jj4 s HIS 291 CO 0.01 -0.07 0.05 -0.51 -0.85 0.00 0.00 174.74 173.38 1jj4 s LEU 292 N 0.30 4.08 -0.04 0.89 1.43 0.16 -0.34 118.68 125.16 1jj4 s LEU 292 Ca -0.05 -1.16 -0.03 0.00 -1.03 0.00 0.00 54.13 51.85 1jj4 s LEU 292 Cb -0.15 -1.80 -0.04 0.00 0.03 0.00 0.00 46.19 44.24 1jj4 s LEU 292 CO 0.04 -0.29 0.13 -0.54 0.23 0.00 0.00 176.35 175.92 1jj4 s LYS 293 N 1.34 3.31 0.00 1.70 1.02 -0.53 -1.32 119.74 125.27 1jj4 s LYS 293 Ca -0.03 -0.32 0.00 0.00 0.02 0.00 0.00 55.97 55.64 1jj4 s LYS 293 Cb -0.19 -3.04 0.00 0.00 -0.52 0.00 0.00 37.83 34.08 1jj4 s LYS 293 CO 0.01 0.70 0.00 0.41 -0.92 0.00 0.00 175.35 175.55 1jj4 n GLY 294 N 1.35 -1.31 3.67 -3.33 0.00 -0.93 -0.80 105.19 103.84 1jj4 n GLY 294 Ca -0.14 -1.17 -0.45 0.00 0.00 0.00 0.00 46.02 44.25 1jj4 n GLY 294 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1jj4 n ASP 295 N 2.49 2.70 -0.31 1.61 2.03 -1.26 0.76 116.55 124.56 1jj4 n ASP 295 Ca 0.00 1.15 -0.04 0.00 0.52 0.00 0.00 54.79 56.41 1jj4 n ASP 295 Cb 0.00 -1.42 0.08 0.00 -0.72 0.00 0.00 41.12 39.05 1jj4 n ASP 295 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 1jj4 h ARG 296 N 4.10 1.18 -0.06 -0.67 3.08 -1.89 0.80 114.38 120.92 1jj4 h ARG 296 Ca -0.45 -0.14 -0.16 0.00 0.07 0.00 0.00 59.98 59.30 1jj4 h ARG 296 Cb 1.28 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 1jj4 h ARG 296 CO 0.75 0.87 -0.67 -0.97 -1.07 0.00 0.00 179.97 178.88 1jj4 h ASN 297 N 1.18 0.28 -0.79 7.04 -1.24 -1.97 -1.90 115.58 118.18 1jj4 h ASN 297 Ca 0.30 -0.18 -0.05 0.00 0.71 0.00 0.00 56.30 57.08 1jj4 h ASN 297 Cb 0.04 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 38.97 1jj4 h ASN 297 CO -0.05 0.87 0.30 -1.28 -1.29 0.00 0.00 177.43 175.98 1jj4 h SER 298 N 0.17 1.11 -0.17 1.15 0.87 -1.79 -1.98 113.55 112.90 1jj4 h SER 298 Ca -0.02 -0.18 -0.06 0.00 -1.23 0.00 0.00 61.79 60.30 1jj4 h SER 298 Cb 1.20 -0.29 -0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1jj4 h SER 298 CO 0.10 0.99 -0.14 -0.07 -0.53 0.00 0.00 176.83 177.18 1jj4 h LEU 299 N 1.16 0.42 -0.39 2.23 3.38 -0.68 -2.09 115.31 119.34 1jj4 h LEU 299 Ca 0.26 -0.46 0.08 0.00 0.09 0.00 0.00 57.88 57.85 1jj4 h LEU 299 Cb 0.24 -0.12 -0.07 0.00 0.09 0.00 0.00 40.66 40.80 1jj4 h LEU 299 CO -0.02 0.79 -0.07 0.50 0.09 0.00 0.00 178.44 179.73 1jj4 h LYS 300 N 0.06 0.02 -0.15 1.13 3.64 -1.16 0.10 116.57 120.21 1jj4 h LYS 300 Ca 0.03 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 1jj4 h LYS 300 Cb 0.66 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 1jj4 h LYS 300 CO 0.04 0.02 -0.15 0.00 -2.27 0.00 0.00 179.45 177.08 1jj4 h LEU 302 N 0.23 0.58 -0.91 0.00 5.85 -0.30 -2.55 115.31 118.20 1jj4 h LEU 302 Ca 0.04 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.44 1jj4 h LEU 302 Cb 0.41 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1jj4 h LEU 302 CO 0.02 0.77 0.60 -0.09 -0.34 0.00 0.00 178.44 179.41 1jj4 h ARG 303 N 0.37 1.20 -0.55 1.25 2.43 -0.48 0.37 114.38 118.96 1jj4 h ARG 303 Ca 0.09 -0.07 0.10 0.00 -0.81 0.00 0.00 59.98 59.28 1jj4 h ARG 303 Cb 0.49 -0.27 -0.07 0.00 -0.42 0.00 0.00 29.97 29.69 1jj4 h ARG 303 CO 0.02 0.79 0.14 -0.92 -1.51 0.00 0.00 179.97 178.49 1jj4 h TYR 304 N 1.23 0.22 -0.20 2.20 3.20 -1.23 -1.66 116.97 120.73 1jj4 h TYR 304 Ca 0.34 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 62.15 1jj4 h TYR 304 Cb -0.14 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.11 1jj4 h TYR 304 CO -0.01 0.01 -0.21 0.00 -1.64 0.00 0.00 178.16 176.31 1jj4 h ARG 305 N 0.28 0.50 -0.72 1.82 3.08 -0.81 -3.01 114.38 115.52 1jj4 h ARG 305 Ca 0.28 -0.27 0.21 0.00 0.07 0.00 0.00 59.98 60.28 1jj4 h ARG 305 Cb 0.38 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 1jj4 h ARG 305 CO -0.34 0.84 0.54 -0.07 -1.07 0.00 0.00 179.97 179.87 1jj4 h LEU 306 N 0.17 0.00 0.00 3.04 3.38 0.32 0.34 115.31 122.57 1jj4 h LEU 306 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1jj4 h LEU 306 Cb 0.76 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.51 1jj4 h LEU 306 CO 0.05 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.12 1jj4 n ARG 307 N -4.24 0.03 0.18 1.13 1.74 -0.69 -1.94 116.66 112.87 1jj4 n ARG 307 Ca 0.14 0.29 0.12 0.00 -0.77 0.00 0.00 57.85 57.63 1jj4 n ARG 307 Cb 0.81 -1.50 0.24 0.00 -1.02 0.00 0.00 32.46 30.99 1jj4 n ARG 307 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 1jj4 h LYS 308 N 0.00 0.00 -0.91 5.56 1.57 -0.46 -3.30 116.57 119.03 1jj4 h LYS 308 Ca 0.00 0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.39 1jj4 h LYS 308 Cb 0.17 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 32.08 1jj4 h LYS 308 CO 0.00 0.00 -1.05 1.58 -0.57 0.00 0.00 179.45 179.41 1jj4 n HIS 309 N -2.81 1.79 0.82 -1.35 -0.00 -0.82 -4.89 115.22 107.97 1jj4 n HIS 309 Ca 0.04 -2.60 0.01 0.00 -0.00 0.00 0.00 57.72 55.17 1jj4 n HIS 309 Cb 0.50 -0.28 0.05 0.00 -0.00 0.00 0.00 29.99 30.26 1jj4 n HIS 309 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.34 175.21 1jj4 n SER 310 N -0.36 0.00 -0.18 0.26 3.41 -1.17 -2.76 113.62 112.83 1jj4 n SER 310 Ca 0.18 -0.77 0.15 0.00 -0.26 0.00 0.00 58.87 58.17 1jj4 n SER 310 Cb 0.80 0.00 0.74 0.00 -0.26 0.00 0.00 64.21 65.49 1jj4 n SER 310 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1jj4 n ASP 311 N -0.56 0.58 -0.98 4.04 5.68 -1.26 -3.83 116.55 120.21 1jj4 n ASP 311 Ca 0.01 -1.05 0.03 0.00 -0.50 0.00 0.00 54.79 53.28 1jj4 n ASP 311 Cb 0.01 -0.02 0.15 0.00 -1.14 0.00 0.00 41.12 40.11 1jj4 n ASP 311 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 1jj4 n HIS 312 N -0.62 0.27 -3.48 2.11 -0.00 -1.11 -5.04 115.22 107.35 1jj4 n HIS 312 Ca 0.20 -1.36 -0.13 0.00 -0.00 0.00 0.00 57.72 56.44 1jj4 n HIS 312 Cb 0.23 -0.23 -0.03 0.00 -0.00 0.00 0.00 29.99 29.95 1jj4 n HIS 312 CO 0.00 0.00 0.00 1.52 -0.00 0.00 0.00 176.34 177.86 1jj4 s TYR 313 N -2.57 -0.51 -0.04 4.41 -0.85 -1.25 -4.51 117.35 112.03 1jj4 s TYR 313 Ca 0.38 0.52 -0.01 0.00 -0.52 0.00 0.00 57.07 57.44 1jj4 s TYR 313 Cb 0.38 0.51 -0.00 0.00 0.38 0.00 0.00 41.96 43.22 1jj4 s TYR 313 CO -0.08 -0.68 -0.02 -0.09 -1.52 0.00 0.00 175.55 173.16 1jj4 h ARG 314 N 2.29 0.00 -3.36 -3.49 2.43 -1.21 -3.46 114.38 107.57 1jj4 h ARG 314 Ca -0.28 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 58.77 1jj4 h ARG 314 Cb 1.24 0.00 -0.18 0.00 -0.42 0.00 0.00 29.97 30.61 1jj4 h ARG 314 CO 0.36 0.00 -0.34 0.34 -1.51 0.00 0.00 179.97 178.82 1jj4 s ASP 315 N -4.07 -0.06 -0.04 -3.80 3.68 -1.22 -5.00 116.67 106.16 1jj4 s ASP 315 Ca -0.01 -0.19 0.07 0.00 2.13 0.00 0.00 52.55 54.54 1jj4 s ASP 315 Cb 0.00 0.30 -0.01 0.00 -1.45 0.00 0.00 42.92 41.76 1jj4 s ASP 315 CO 0.02 -0.52 -0.25 -0.63 0.13 0.00 0.00 175.17 173.93 1jj4 s ILE 316 N -2.09 1.98 0.74 4.11 1.01 -1.26 -1.43 121.20 124.25 1jj4 s ILE 316 Ca -0.09 -1.04 -0.08 0.00 0.00 0.00 0.00 60.65 59.44 1jj4 s ILE 316 Cb -0.03 -1.66 0.07 0.00 0.01 0.00 0.00 42.46 40.85 1jj4 s ILE 316 CO -0.01 0.56 1.06 -0.94 0.00 0.00 0.00 174.94 175.61 1jj4 s SER 317 N -0.31 4.67 1.00 3.58 1.04 -0.33 -4.98 113.70 118.36 1jj4 s SER 317 Ca 0.01 0.50 -0.15 0.00 0.48 0.00 0.00 55.95 56.79 1jj4 s SER 317 Cb -0.12 -1.08 0.19 0.00 0.10 0.00 0.00 66.02 65.11 1jj4 s SER 317 CO 0.02 -1.72 1.18 -0.94 0.98 0.00 0.00 173.24 172.76 1jj4 s SER 318 N -4.55 2.74 -0.59 7.02 1.04 -1.26 -4.66 113.70 113.44 1jj4 s SER 318 Ca 0.61 0.70 -0.27 0.00 0.48 0.00 0.00 55.95 57.48 1jj4 s SER 318 Cb -0.10 -1.06 0.03 0.00 0.10 0.00 0.00 66.02 64.99 1jj4 s SER 318 CO 0.46 -3.00 1.13 -0.89 0.98 0.00 0.00 173.24 171.92 1jj4 s THR 319 N -3.36 4.09 0.37 2.02 2.01 -1.26 -4.64 115.64 114.88 1jj4 s THR 319 Ca 0.68 0.68 0.01 0.00 0.31 0.00 0.00 61.69 63.38 1jj4 s THR 319 Cb -0.11 -4.69 0.01 0.00 0.01 0.00 0.00 72.50 67.72 1jj4 s THR 319 CO 0.54 -1.33 0.12 -2.67 -0.69 0.00 0.00 174.62 170.59 1jj4 n TRP 320 N 8.25 0.14 -3.60 4.92 4.27 -0.37 -4.86 117.44 126.19 1jj4 n TRP 320 Ca 0.06 -1.71 -0.08 0.00 -3.89 0.00 0.00 57.50 51.88 1jj4 n TRP 320 Cb 0.49 -0.27 -0.02 0.00 -1.36 0.00 0.00 31.31 30.15 1jj4 n TRP 320 CO 0.00 0.00 0.00 -3.38 -2.29 0.00 0.00 177.69 172.02 1jj4 s HIS 321 N -2.14 -0.32 0.15 -2.67 -3.43 -1.26 0.42 115.29 106.05 1jj4 s HIS 321 Ca 0.09 0.07 -0.20 0.00 -0.80 0.00 0.00 55.06 54.22 1jj4 s HIS 321 Cb -0.01 0.60 -0.08 0.00 -1.43 0.00 0.00 32.58 31.67 1jj4 s HIS 321 CO 0.06 -0.82 0.66 -1.58 -2.00 0.00 0.00 174.74 171.06 1jj4 s TRP 322 N -3.47 3.75 -0.91 0.38 0.52 -1.26 -5.05 118.94 112.90 1jj4 s TRP 322 Ca 0.07 1.37 -0.19 0.00 0.02 0.00 0.00 56.10 57.36 1jj4 s TRP 322 Cb -0.02 -2.58 0.13 0.00 -1.15 0.00 0.00 33.47 29.85 1jj4 s TRP 322 CO -0.05 0.47 1.10 0.95 0.02 0.00 0.00 176.95 179.45 1jj4 s THR 323 N -1.30 4.72 0.16 2.01 -4.23 -1.26 -5.12 115.64 110.61 1jj4 s THR 323 Ca 0.36 -1.51 0.11 0.00 -1.18 0.00 0.00 61.69 59.47 1jj4 s THR 323 Cb -0.19 -4.76 -0.05 0.00 1.34 0.00 0.00 72.50 68.84 1jj4 s THR 323 CO 0.21 -1.49 1.51 0.11 -0.54 0.00 0.00 174.62 174.42 1jj4 h LYS 329 N 8.87 0.00 -6.28 3.99 6.56 -2.03 -3.58 116.57 124.11 1jj4 h LYS 329 Ca 0.12 0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 59.26 1jj4 h LYS 329 Cb 1.03 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.69 1jj4 h LYS 329 CO 1.11 0.69 -0.37 -0.08 -2.06 0.00 0.00 179.45 178.74 1jj4 s THR 330 N -3.25 4.75 0.45 -0.16 -1.32 -1.26 -4.53 115.64 110.32 1jj4 s THR 330 Ca 0.00 -0.94 0.03 0.00 -1.21 0.00 0.00 61.69 59.57 1jj4 s THR 330 Cb 0.11 -3.67 -0.04 0.00 -1.51 0.00 0.00 72.50 67.39 1jj4 s THR 330 CO 0.77 -0.28 0.03 -0.83 -2.21 0.00 0.00 174.62 172.10 1jj4 s GLY 331 N -4.07 2.75 -0.02 6.08 0.00 0.23 -4.83 107.32 107.47 1jj4 s GLY 331 Ca 0.39 -1.13 -0.01 0.00 0.00 0.00 0.00 44.72 43.97 1jj4 s GLY 331 CO 0.31 -2.08 0.05 -0.42 0.00 0.00 0.00 173.10 170.95 1jj4 s ILE 332 N -2.93 -0.02 -0.09 0.90 1.01 0.17 -2.18 121.20 118.06 1jj4 s ILE 332 Ca 0.18 0.06 0.04 0.00 0.00 0.00 0.00 60.65 60.93 1jj4 s ILE 332 Cb 0.04 -0.08 0.00 0.00 0.01 0.00 0.00 42.46 42.43 1jj4 s ILE 332 CO 0.10 0.02 -0.21 -0.76 0.00 0.00 0.00 174.94 174.09 1jj4 s LEU 333 N 0.31 1.97 -0.21 2.97 1.43 -0.43 -1.24 118.68 123.49 1jj4 s LEU 333 Ca -0.02 -0.48 -0.05 0.00 -1.03 0.00 0.00 54.13 52.54 1jj4 s LEU 333 Cb -0.04 -1.25 -0.02 0.00 0.03 0.00 0.00 46.19 44.92 1jj4 s LEU 333 CO -0.01 0.13 -0.01 -0.89 0.23 0.00 0.00 176.35 175.81 1jj4 s THR 334 N 0.37 3.82 -0.21 5.49 2.01 -1.26 -0.67 115.64 125.19 1jj4 s THR 334 Ca -0.16 -0.35 -0.01 0.00 0.31 0.00 0.00 61.69 61.47 1jj4 s THR 334 Cb -0.17 -2.73 0.01 0.00 0.01 0.00 0.00 72.50 69.62 1jj4 s THR 334 CO 0.07 0.42 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.63 1jj4 s VAL 335 N 1.13 2.75 0.31 3.82 1.01 -0.22 -1.18 120.40 128.01 1jj4 s VAL 335 Ca 0.02 -0.79 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1jj4 s VAL 335 Cb -0.14 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.96 1jj4 s VAL 335 CO 0.01 0.42 0.47 0.42 0.00 0.00 0.00 175.10 176.41 1jj4 s THR 336 N 1.37 4.97 0.04 3.92 -4.23 -0.52 -0.88 115.64 120.31 1jj4 s THR 336 Ca 0.04 -0.76 0.03 0.00 -1.18 0.00 0.00 61.69 59.82 1jj4 s THR 336 Cb -0.14 -3.78 -0.02 0.00 1.34 0.00 0.00 72.50 69.89 1jj4 s THR 336 CO -0.07 -0.39 -0.09 -0.31 -0.54 0.00 0.00 174.62 173.21 1jj4 s TYR 337 N -2.17 0.80 0.37 3.99 1.51 0.06 -0.66 117.35 121.24 1jj4 s TYR 337 Ca 0.39 -0.43 0.08 0.00 -1.01 0.00 0.00 57.07 56.09 1jj4 s TYR 337 Cb -0.09 -0.47 0.72 0.00 -0.11 0.00 0.00 41.96 42.00 1jj4 s TYR 337 CO 0.32 -0.04 1.89 1.25 -1.11 0.00 0.00 175.55 177.87 1jj4 h HIS 338 N 4.66 0.32 -3.51 2.71 -0.00 -1.89 -3.39 115.15 114.06 1jj4 h HIS 338 Ca -0.36 -0.04 -0.06 0.00 -0.00 0.00 0.00 60.37 59.92 1jj4 h HIS 338 Cb 1.20 -0.09 -0.07 0.00 -0.00 0.00 0.00 27.41 28.45 1jj4 h HIS 338 CO 0.61 0.43 -0.01 -1.54 -0.00 0.00 0.00 177.93 177.41 1jj4 s SER 339 N -6.85 0.02 0.11 3.26 1.04 -1.26 -5.00 113.70 105.02 1jj4 s SER 339 Ca -0.06 -0.96 -0.16 0.00 0.48 0.00 0.00 55.95 55.25 1jj4 s SER 339 Cb 0.15 0.66 -0.04 0.00 0.10 0.00 0.00 66.02 66.88 1jj4 s SER 339 CO 0.74 -1.27 1.54 -0.08 0.98 0.00 0.00 173.24 175.16 1jj4 h GLU 340 N 2.16 0.63 -0.27 4.02 4.57 -1.96 -2.64 114.58 121.08 1jj4 h GLU 340 Ca -0.26 -0.21 -0.10 0.00 -1.18 0.00 0.00 59.36 57.62 1jj4 h GLU 340 Cb 1.25 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 1jj4 h GLU 340 CO 0.34 0.76 -0.25 1.79 -1.18 0.00 0.00 179.01 180.46 1jj4 h THR 341 N 0.43 1.27 -0.56 0.32 1.35 -2.00 -2.75 112.91 110.97 1jj4 h THR 341 Ca 0.10 -1.29 -0.00 0.00 -0.55 0.00 0.00 66.41 64.67 1jj4 h THR 341 Cb 0.49 1.34 -0.03 0.00 -1.73 0.00 0.00 68.15 68.22 1jj4 h THR 341 CO 0.02 0.41 0.35 -0.61 -0.25 0.00 0.00 175.52 175.44 1jj4 h GLN 342 N 0.46 0.75 -0.68 4.72 4.15 -1.89 -1.13 115.11 121.49 1jj4 h GLN 342 Ca 0.07 -0.06 0.03 0.00 0.77 0.00 0.00 58.65 59.46 1jj4 h GLN 342 Cb 0.68 -0.16 -0.04 0.00 0.21 0.00 0.00 27.48 28.17 1jj4 h GLN 342 CO 0.05 0.53 0.42 -0.09 -1.93 0.00 0.00 178.83 177.81 1jj4 h ARG 343 N 0.75 0.79 -0.45 1.69 2.43 -1.26 -1.07 114.38 117.26 1jj4 h ARG 343 Ca 0.20 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 1jj4 h ARG 343 Cb -0.04 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 1jj4 h ARG 343 CO -0.04 0.52 0.27 0.00 -1.51 0.00 0.00 179.97 179.21 1jj4 h THR 344 N 0.81 1.14 0.00 0.20 1.03 -1.12 -0.73 112.91 114.24 1jj4 h THR 344 Ca 0.28 -0.31 -0.04 0.00 -0.01 0.00 0.00 66.41 66.33 1jj4 h THR 344 Cb 0.05 0.54 -0.01 0.00 -1.07 0.00 0.00 68.15 67.67 1jj4 h THR 344 CO -0.12 0.14 -0.17 0.50 -0.01 0.00 0.00 175.52 175.86 1jj4 h LYS 345 N 0.59 0.00 0.37 0.00 3.64 -0.80 -2.00 116.57 118.37 1jj4 h LYS 345 Ca 0.16 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 1jj4 h LYS 345 Cb -0.01 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1jj4 h LYS 345 CO -0.03 0.17 -0.18 0.35 -2.27 0.00 0.00 179.45 177.49 1jj4 h PHE 346 N 0.00 -0.47 -0.30 1.91 3.57 -0.45 -2.74 116.94 118.46 1jj4 h PHE 346 Ca -0.00 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.58 1jj4 h PHE 346 Cb 0.31 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 39.19 1jj4 h PHE 346 CO 0.00 -0.14 0.28 -0.07 -2.23 0.00 0.00 178.31 176.15 1jj4 h LEU 347 N -0.93 0.00 -3.18 0.59 3.38 -0.86 0.11 115.31 114.42 1jj4 h LEU 347 Ca -0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.92 1jj4 h LEU 347 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1jj4 h LEU 347 CO 0.08 0.00 0.00 0.59 0.09 0.00 0.00 178.44 179.20 1jj4 n ASN 348 N -4.00 4.62 0.00 -0.43 5.03 -0.78 -4.53 115.26 115.17 1jj4 n ASN 348 Ca 0.04 -2.53 0.00 0.00 0.87 0.00 0.00 54.58 52.97 1jj4 n ASN 348 Cb 0.44 -0.56 0.00 0.00 -1.02 0.00 0.00 39.78 38.64 1jj4 n ASN 348 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 1jj4 n THR 349 N 0.82 0.00 -2.69 3.41 -1.04 -0.43 -5.03 114.28 109.32 1jj4 n THR 349 Ca 0.24 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.91 1jj4 n THR 349 Cb 0.89 -0.34 -0.05 0.00 -1.82 0.00 0.00 70.33 69.01 1jj4 n THR 349 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1jj4 s VAL 350 N -1.50 4.10 -0.34 12.58 1.01 0.24 -5.04 120.40 131.45 1jj4 s VAL 350 Ca 0.00 1.36 -0.14 0.00 0.00 0.00 0.00 61.98 63.20 1jj4 s VAL 350 Cb 0.00 -3.58 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 1jj4 s VAL 350 CO 0.00 -0.23 0.33 0.00 0.00 0.00 0.00 175.10 175.20 1jj4 s ALA 351 N -2.02 3.50 -0.23 5.51 0.00 -1.26 -4.88 121.76 122.38 1jj4 s ALA 351 Ca 0.63 -1.24 -0.05 0.00 0.00 0.00 0.00 51.96 51.30 1jj4 s ALA 351 Cb -0.14 -2.77 -0.02 0.00 0.00 0.00 0.00 23.12 20.20 1jj4 s ALA 351 CO 0.18 -1.02 0.01 0.42 0.00 0.00 0.00 175.76 175.34 1jj4 s ILE 352 N 1.94 3.77 0.17 0.00 -1.09 -1.26 -5.03 121.20 119.70 1jj4 s ILE 352 Ca 0.10 -0.37 -0.33 0.00 -2.23 0.00 0.00 60.65 57.82 1jj4 s ILE 352 Cb -0.17 -2.75 -0.15 0.00 -1.58 0.00 0.00 42.46 37.82 1jj4 s ILE 352 CO 0.11 0.38 1.30 -2.65 -1.23 0.00 0.00 174.94 172.85 1jj4 n PRO 353 N 4.85 1.48 0.24 2.79 -0.02 -1.26 -4.82 135.00 138.26 1jj4 n PRO 353 Ca -0.17 0.53 0.13 0.00 -2.02 0.00 0.00 63.50 61.96 1jj4 n PRO 353 Cb 0.51 -2.12 0.67 0.00 -0.02 0.00 0.00 33.50 32.54 1jj4 n PRO 353 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1jj4 h ASP 354 N 4.07 0.00 -0.04 2.55 3.32 -2.02 0.52 116.42 124.82 1jj4 h ASP 354 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1jj4 h ASP 354 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1jj4 h ASP 354 CO 0.75 0.00 0.00 -1.54 -1.72 0.00 0.00 179.24 176.73 1jj4 n SER 355 N -2.50 0.84 -4.09 6.45 3.41 -1.26 -4.71 113.62 111.75 1jj4 n SER 355 Ca -0.02 -1.40 -0.33 0.00 -0.26 0.00 0.00 58.87 56.87 1jj4 n SER 355 Cb 0.25 -0.02 -0.15 0.00 -0.26 0.00 0.00 64.21 64.02 1jj4 n SER 355 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1jj4 s VAL 356 N -1.95 2.33 0.32 -3.33 1.01 0.18 -4.57 120.40 114.38 1jj4 s VAL 356 Ca 0.37 -1.57 -0.29 0.00 0.00 0.00 0.00 61.98 60.50 1jj4 s VAL 356 Cb 0.19 -2.35 -0.10 0.00 0.00 0.00 0.00 36.38 34.12 1jj4 s VAL 356 CO 0.30 -0.03 1.22 -1.58 0.00 0.00 0.00 175.10 175.01 1jj4 s GLN 357 N 1.14 4.44 -0.18 2.72 0.74 0.02 -4.77 119.66 123.76 1jj4 s GLN 357 Ca -0.08 2.03 -0.04 0.00 0.05 0.00 0.00 55.36 57.32 1jj4 s GLN 357 Cb -0.20 -3.08 -0.02 0.00 1.10 0.00 0.00 33.01 30.81 1jj4 s GLN 357 CO -0.04 -0.05 -0.02 0.42 -0.55 0.00 0.00 175.29 175.04 1jj4 s ILE 358 N -1.17 3.83 -0.14 -2.34 1.01 -1.26 -1.45 121.20 119.68 1jj4 s ILE 358 Ca 0.48 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.76 1jj4 s ILE 358 Cb -0.36 -2.71 0.02 0.00 0.01 0.00 0.00 42.46 39.43 1jj4 s ILE 358 CO 0.47 0.46 -0.12 -0.76 0.00 0.00 0.00 174.94 174.99 1jj4 s LEU 359 N 0.78 1.51 0.21 2.97 1.43 0.54 -4.96 118.68 121.18 1jj4 s LEU 359 Ca -0.01 -0.43 -0.19 0.00 -1.03 0.00 0.00 54.13 52.47 1jj4 s LEU 359 Cb -0.14 -1.05 -0.08 0.00 0.03 0.00 0.00 46.19 44.94 1jj4 s LEU 359 CO 0.02 -0.08 0.71 -0.69 0.23 0.00 0.00 176.35 176.53 1jj4 s VAL 360 N 1.57 4.60 -0.43 -1.59 1.01 -1.26 0.30 120.40 124.59 1jj4 s VAL 360 Ca 0.05 1.24 0.00 0.00 0.00 0.00 0.00 61.98 63.27 1jj4 s VAL 360 Cb -0.13 -3.85 0.00 0.00 0.00 0.00 0.00 36.38 32.41 1jj4 s VAL 360 CO -0.10 0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.82 1jj4 n GLY 361 N 0.73 -1.19 3.34 4.51 0.00 -0.83 -4.94 105.19 106.81 1jj4 n GLY 361 Ca -0.03 -0.82 -0.18 0.00 0.00 0.00 0.00 46.02 45.00 1jj4 n GLY 361 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1jj4 s TYR 362 N -3.00 1.61 0.15 1.61 1.51 -1.26 -0.35 117.35 117.63 1jj4 s TYR 362 Ca 0.00 -0.83 -0.16 0.00 -1.01 0.00 0.00 57.07 55.07 1jj4 s TYR 362 Cb 0.00 -0.91 0.03 0.00 -0.11 0.00 0.00 41.96 40.97 1jj4 s TYR 362 CO 0.00 0.07 0.43 1.41 -1.11 0.00 0.00 175.55 176.35 1jj4 s MET 363 N -3.81 1.19 0.00 -0.62 1.75 -1.09 -4.92 119.30 111.81 1jj4 s MET 363 Ca 0.27 -0.81 0.00 0.00 -1.25 0.00 0.00 55.69 53.90 1jj4 s MET 363 Cb 0.04 0.48 0.00 0.00 2.84 0.00 0.00 34.83 38.19 1jj4 s MET 363 CO 0.08 -0.48 0.00 0.25 -0.65 0.00 0.00 175.02 174.22