#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hb1 s ARG 269 N 0.00 0.61 -0.16 5.31 1.70 -1.13 -2.74 118.95 122.54 3hb1 s ARG 269 Ca 0.00 -0.95 0.00 0.00 -0.47 0.00 0.00 55.73 54.31 3hb1 s ARG 269 Cb 0.00 -0.20 0.00 0.00 -0.57 0.00 0.00 34.95 34.18 3hb1 s ARG 269 CO 0.00 0.01 -0.15 0.08 -1.08 0.00 0.00 175.30 174.16 3hb1 s VAL 270 N -2.24 2.61 -0.26 4.99 1.01 0.11 -2.90 120.40 123.72 3hb1 s VAL 270 Ca -0.03 -0.78 -0.14 0.00 0.00 0.00 0.00 61.98 61.03 3hb1 s VAL 270 Cb -0.04 -2.11 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 3hb1 s VAL 270 CO -0.02 0.51 0.34 -0.36 0.00 0.00 0.00 175.10 175.57 3hb1 s PHE 271 N 0.91 3.27 -0.45 5.22 0.40 -0.76 -0.29 117.98 126.28 3hb1 s PHE 271 Ca -0.03 0.39 -0.12 0.00 -0.60 0.00 0.00 56.93 56.57 3hb1 s PHE 271 Cb -0.15 -2.51 0.09 0.00 0.51 0.00 0.00 43.02 40.95 3hb1 s PHE 271 CO -0.02 -0.16 0.33 0.08 0.70 0.00 0.00 175.22 176.16 3hb1 s VAL 272 N 1.81 4.61 0.17 -0.44 1.01 0.14 -1.17 120.40 126.52 3hb1 s VAL 272 Ca 0.14 -1.36 -0.16 0.00 0.00 0.00 0.00 61.98 60.59 3hb1 s VAL 272 Cb -0.15 -3.84 -0.07 0.00 0.00 0.00 0.00 36.38 32.31 3hb1 s VAL 272 CO 0.09 -0.60 0.61 0.26 0.00 0.00 0.00 175.10 175.46 3hb1 s TRP 273 N 1.49 3.63 0.22 5.22 0.52 0.27 -0.98 118.94 129.30 3hb1 s TRP 273 Ca 0.04 1.17 -0.05 0.00 0.02 0.00 0.00 56.10 57.28 3hb1 s TRP 273 Cb -0.24 -2.45 -0.05 0.00 -1.15 0.00 0.00 33.47 29.57 3hb1 s TRP 273 CO 0.03 0.41 0.47 0.34 0.02 0.00 0.00 176.95 178.21 3hb1 s ASP 274 N -1.67 6.47 0.00 2.95 2.15 -0.41 -0.92 116.67 125.24 3hb1 s ASP 274 Ca 0.39 0.64 0.00 0.00 0.43 0.00 0.00 52.55 54.01 3hb1 s ASP 274 Cb -0.16 -2.11 0.00 0.00 -0.30 0.00 0.00 42.92 40.35 3hb1 s ASP 274 CO 0.20 -0.08 0.00 -0.11 -0.17 0.00 0.00 175.17 175.01 3hb1 n LEU 275 N -0.49 0.53 -4.67 -1.34 7.94 -1.26 -3.81 117.00 113.90 3hb1 n LEU 275 Ca -0.02 0.13 -0.48 0.00 -1.11 0.00 0.00 56.01 54.53 3hb1 n LEU 275 Cb 0.53 -0.30 -0.05 0.00 0.53 0.00 0.00 43.42 44.13 3hb1 n LEU 275 CO 0.48 -0.30 1.33 0.47 -1.11 0.00 0.00 177.39 178.26 3hb1 n ASP 276 N -1.79 3.14 -1.87 1.96 9.92 -1.26 -1.46 116.55 125.18 3hb1 n ASP 276 Ca 0.00 1.03 -0.20 0.00 -0.53 0.00 0.00 54.79 55.09 3hb1 n ASP 276 Cb 0.00 -1.37 -0.06 0.00 -0.64 0.00 0.00 41.12 39.05 3hb1 n ASP 276 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 3hb1 n GLU 277 N 5.08 -1.54 0.04 -1.24 4.71 0.38 -4.76 120.64 123.30 3hb1 n GLU 277 Ca 0.20 1.13 0.00 0.00 -0.01 0.00 0.00 57.16 58.48 3hb1 n GLU 277 Cb 0.28 -5.61 0.00 0.00 -1.01 0.00 0.00 31.44 25.10 3hb1 n GLU 277 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3hb1 n THR 278 N -2.92 0.46 0.00 2.62 -1.04 -0.82 -4.67 114.28 107.91 3hb1 n THR 278 Ca -0.22 0.15 -0.16 0.00 -2.04 0.00 0.00 64.05 61.78 3hb1 n THR 278 Cb 0.67 -1.00 -0.14 0.00 -1.82 0.00 0.00 70.33 68.04 3hb1 n THR 278 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3hb1 h ILE 279 N 0.00 0.74 -2.68 12.58 2.04 -1.35 -3.48 117.51 125.36 3hb1 h ILE 279 Ca 0.00 -2.50 -0.49 0.00 1.00 0.00 0.00 64.86 62.87 3hb1 h ILE 279 Cb 0.00 2.50 -0.14 0.00 -0.74 0.00 0.00 36.82 38.44 3hb1 h ILE 279 CO 0.00 0.75 -0.70 0.27 0.00 0.00 0.00 178.15 178.46 3hb1 s ILE 280 N -2.58 1.76 -0.22 -0.67 -4.36 -1.14 -4.46 121.20 109.53 3hb1 s ILE 280 Ca -0.15 -2.18 -0.01 0.00 -0.26 0.00 0.00 60.65 58.05 3hb1 s ILE 280 Cb 0.07 -2.29 0.02 0.00 1.25 0.00 0.00 42.46 41.51 3hb1 s ILE 280 CO 0.80 -0.41 -0.12 -0.63 0.24 0.00 0.00 174.94 174.82 3hb1 s ILE 281 N -2.95 2.58 0.28 8.37 -1.09 -1.26 -0.47 121.20 126.67 3hb1 s ILE 281 Ca 0.27 -0.95 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 3hb1 s ILE 281 Cb 0.01 -2.23 0.00 0.00 -1.58 0.00 0.00 42.46 38.67 3hb1 s ILE 281 CO 0.10 0.35 0.00 0.33 -1.23 0.00 0.00 174.94 174.49 3hb1 n PHE 282 N 4.65 -2.93 -0.09 3.97 7.35 -1.26 -4.92 117.46 124.23 3hb1 n PHE 282 Ca -0.18 0.74 -0.07 0.00 -0.76 0.00 0.00 57.45 57.17 3hb1 n PHE 282 Cb 0.48 1.73 0.01 0.00 0.35 0.00 0.00 39.48 42.05 3hb1 n PHE 282 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 3hb1 h HIS 283 N 0.00 0.20 0.00 -5.13 3.86 -1.97 -1.85 115.15 110.26 3hb1 h HIS 283 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 3hb1 h HIS 283 Cb 0.00 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.43 3hb1 h HIS 283 CO 0.00 0.08 0.06 -1.13 0.86 0.00 0.00 177.93 177.80 3hb1 n SER 284 N -5.03 0.52 0.08 2.45 3.41 -1.26 -0.08 113.62 113.71 3hb1 n SER 284 Ca 0.00 0.72 -0.09 0.00 -0.26 0.00 0.00 58.87 59.25 3hb1 n SER 284 Cb 0.12 -0.77 -0.07 0.00 -0.26 0.00 0.00 64.21 63.22 3hb1 n SER 284 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3hb1 h LEU 285 N 0.00 0.14 0.11 1.04 3.38 -1.65 -2.11 115.31 116.21 3hb1 h LEU 285 Ca 0.00 -0.14 -0.29 0.00 0.09 0.00 0.00 57.88 57.54 3hb1 h LEU 285 Cb 0.11 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3hb1 h LEU 285 CO 0.00 1.04 -1.45 -0.07 0.09 0.00 0.00 178.44 178.05 3hb1 h LEU 286 N 0.04 0.36 -0.00 1.67 3.38 -0.51 -3.24 115.31 117.01 3hb1 h LEU 286 Ca -0.04 -0.47 0.00 0.00 0.09 0.00 0.00 57.88 57.45 3hb1 h LEU 286 Cb 1.69 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.33 3hb1 h LEU 286 CO 0.14 1.39 -0.02 0.35 0.09 0.00 0.00 178.44 180.39 3hb1 n THR 287 N -3.45 0.00 -0.19 0.22 -2.24 -0.62 -4.91 114.28 103.09 3hb1 n THR 287 Ca -0.14 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3hb1 n THR 287 Cb 1.03 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.80 3hb1 n THR 287 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hb1 n GLY 288 N 1.48 2.27 0.21 3.38 0.00 -1.02 -4.85 105.19 106.67 3hb1 n GLY 288 Ca 0.07 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.12 3hb1 n GLY 288 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3hb1 h THR 289 N 0.00 1.22 0.59 2.61 1.35 -1.88 -2.66 112.91 114.13 3hb1 h THR 289 Ca 0.00 -1.02 -0.03 0.00 -0.55 0.00 0.00 66.41 64.81 3hb1 h THR 289 Cb 0.00 1.46 0.01 0.00 -1.73 0.00 0.00 68.15 67.88 3hb1 h THR 289 CO 0.00 0.30 -0.28 0.15 -0.25 0.00 0.00 175.52 175.44 3hb1 h PHE 290 N 0.11 -0.73 -0.93 4.73 3.57 -1.72 -0.61 116.94 121.36 3hb1 h PHE 290 Ca 0.02 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.61 3hb1 h PHE 290 Cb 0.52 0.24 -0.07 0.00 2.79 0.00 0.00 35.95 39.43 3hb1 h PHE 290 CO 0.00 -0.41 0.60 0.00 -2.23 0.00 0.00 178.31 176.27 3hb1 h ALA 291 N -0.56 1.62 0.04 2.41 0.00 -1.76 -0.35 119.26 120.65 3hb1 h ALA 291 Ca -0.08 0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.63 3hb1 h ALA 291 Cb 0.64 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.25 3hb1 h ALA 291 CO 0.13 0.17 -0.83 0.66 0.00 0.00 0.00 179.25 179.38 3hb1 h SER 292 N 0.90 0.67 -0.72 0.00 4.64 -1.41 0.11 113.55 117.75 3hb1 h SER 292 Ca 0.45 -0.79 -0.06 0.00 -0.47 0.00 0.00 61.79 60.92 3hb1 h SER 292 Cb 0.48 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 3hb1 h SER 292 CO -0.21 1.38 0.20 0.03 -0.87 0.00 0.00 176.83 177.36 3hb1 h ARG 293 N 0.04 1.13 -0.64 4.77 3.08 -0.74 -3.14 114.38 118.89 3hb1 h ARG 293 Ca -0.11 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.68 3hb1 h ARG 293 Cb 1.54 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.43 3hb1 h ARG 293 CO 0.16 0.98 0.00 0.66 -1.07 0.00 0.00 179.97 180.70 3hb1 n TYR 294 N -4.24 0.87 -2.76 3.04 4.02 -0.17 -4.97 117.16 112.94 3hb1 n TYR 294 Ca 0.06 -0.51 -0.20 0.00 -0.01 0.00 0.00 57.90 57.24 3hb1 n TYR 294 Cb 0.24 -0.02 0.02 0.00 -0.02 0.00 0.00 39.34 39.56 3hb1 n TYR 294 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3hb1 n GLY 295 N 1.34 -0.41 3.99 2.72 0.00 -0.46 -5.01 105.19 107.35 3hb1 n GLY 295 Ca 0.21 0.01 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 3hb1 n GLY 295 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hb1 s LYS 296 N -5.39 2.72 -0.17 1.61 3.01 0.26 -5.02 119.74 116.76 3hb1 s LYS 296 Ca 0.19 -0.94 -0.29 0.00 -1.01 0.00 0.00 55.97 53.91 3hb1 s LYS 296 Cb -0.08 -2.61 -0.02 0.00 -1.01 0.00 0.00 37.83 34.10 3hb1 s LYS 296 CO 0.23 -0.47 1.43 0.34 0.51 0.00 0.00 175.35 177.39 3hb1 s ASP 297 N -4.37 6.73 0.30 2.83 2.15 -1.26 -4.62 116.67 118.42 3hb1 s ASP 297 Ca 0.55 1.73 -0.02 0.00 0.43 0.00 0.00 52.55 55.25 3hb1 s ASP 297 Cb -0.10 -2.54 0.44 0.00 -0.30 0.00 0.00 42.92 40.43 3hb1 s ASP 297 CO 0.36 -0.95 1.95 0.71 -0.17 0.00 0.00 175.17 177.07 3hb1 h THR 298 N 5.71 1.21 -0.44 1.71 1.35 -1.96 -1.90 112.91 118.59 3hb1 h THR 298 Ca -0.31 -0.44 -0.13 0.00 -0.55 0.00 0.00 66.41 64.99 3hb1 h THR 298 Cb 1.13 0.09 -0.01 0.00 -1.73 0.00 0.00 68.15 67.63 3hb1 h THR 298 CO 0.98 0.22 -0.22 0.74 -0.25 0.00 0.00 175.52 176.98 3hb1 h THR 299 N 1.07 1.27 -0.31 6.82 2.02 -1.99 -2.50 112.91 119.28 3hb1 h THR 299 Ca 0.28 -1.37 -0.05 0.00 0.77 0.00 0.00 66.41 66.04 3hb1 h THR 299 Cb -0.07 1.16 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 3hb1 h THR 299 CO -0.06 0.47 -0.00 0.74 0.37 0.00 0.00 175.52 177.04 3hb1 h THR 300 N 0.78 1.26 -0.16 3.16 2.02 -1.91 -1.59 112.91 116.47 3hb1 h THR 300 Ca 0.10 -0.96 0.03 0.00 0.77 0.00 0.00 66.41 66.35 3hb1 h THR 300 Cb 0.78 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 3hb1 h THR 300 CO 0.06 0.31 -0.01 0.28 0.37 0.00 0.00 175.52 176.53 3hb1 h SER 301 N 0.35 -0.09 -0.26 4.18 0.02 -1.28 -1.32 113.55 115.15 3hb1 h SER 301 Ca 0.09 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 3hb1 h SER 301 Cb 0.45 0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 3hb1 h SER 301 CO 0.02 -0.02 0.12 0.58 -1.14 0.00 0.00 176.83 176.38 3hb1 h VAL 302 N 0.04 1.16 -0.48 2.27 2.07 -1.43 0.65 116.25 120.53 3hb1 h VAL 302 Ca 0.08 -0.47 0.08 0.00 0.82 0.00 0.00 66.70 67.21 3hb1 h VAL 302 Cb 0.10 0.98 -0.06 0.00 -1.52 0.00 0.00 31.29 30.79 3hb1 h VAL 302 CO -0.14 0.16 0.12 -0.09 0.02 0.00 0.00 177.57 177.64 3hb1 h ARG 303 N 0.29 0.25 -0.32 1.57 2.43 -1.00 0.21 114.38 117.81 3hb1 h ARG 303 Ca 0.09 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 3hb1 h ARG 303 Cb 0.15 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 3hb1 h ARG 303 CO -0.01 0.17 -0.07 0.82 -1.51 0.00 0.00 179.97 179.37 3hb1 h ILE 304 N 0.26 1.28 -0.71 1.20 2.04 -1.07 -1.11 117.51 119.40 3hb1 h ILE 304 Ca 0.24 -1.11 0.03 0.00 1.00 0.00 0.00 64.86 65.02 3hb1 h ILE 304 Cb 0.30 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 3hb1 h ILE 304 CO -0.29 0.36 0.45 1.23 0.00 0.00 0.00 178.15 179.89 3hb1 h GLY 305 N 0.40 1.02 1.24 5.37 0.00 -0.11 0.14 103.07 111.13 3hb1 h GLY 305 Ca 0.08 -0.34 -0.13 0.00 0.00 0.00 0.00 47.33 46.95 3hb1 h GLY 305 CO 0.03 0.29 -0.24 1.41 0.00 0.00 0.00 176.54 178.03 3hb1 h LEU 306 N 0.88 0.89 -0.40 3.11 3.38 -0.53 0.79 115.31 123.43 3hb1 h LEU 306 Ca 0.28 -0.34 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 3hb1 h LEU 306 Cb 0.01 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3hb1 h LEU 306 CO -0.10 1.09 -0.02 0.24 0.09 0.00 0.00 178.44 179.73 3hb1 h MET 307 N 0.75 0.72 -0.52 1.13 2.86 -0.71 -2.09 114.93 117.06 3hb1 h MET 307 Ca 0.10 -0.24 -0.11 0.00 -2.06 0.00 0.00 59.70 57.38 3hb1 h MET 307 Cb 0.78 -0.06 -0.02 0.00 0.06 0.00 0.00 31.60 32.37 3hb1 h MET 307 CO 0.06 0.82 -0.12 1.98 1.06 0.00 0.00 176.91 180.72 3hb1 h MET 308 N 0.54 1.01 -0.55 1.72 1.85 -0.63 -2.52 114.93 116.36 3hb1 h MET 308 Ca 0.11 -0.38 0.03 0.00 -0.61 0.00 0.00 59.70 58.85 3hb1 h MET 308 Cb 0.51 -0.06 -0.04 0.00 0.43 0.00 0.00 31.60 32.44 3hb1 h MET 308 CO 0.03 1.07 0.32 1.49 -0.40 0.00 0.00 176.91 179.41 3hb1 h GLU 309 N 0.88 0.61 -0.94 0.39 4.81 -0.75 -1.08 114.58 118.50 3hb1 h GLU 309 Ca 0.13 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3hb1 h GLU 309 Cb 0.69 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.89 3hb1 h GLU 309 CO 0.05 0.40 0.59 1.49 -0.73 0.00 0.00 179.01 180.82 3hb1 h GLU 310 N 0.62 1.26 -0.14 1.92 4.81 -1.18 -1.87 114.58 120.01 3hb1 h GLU 310 Ca 0.23 -0.10 -0.11 0.00 -0.13 0.00 0.00 59.36 59.25 3hb1 h GLU 310 Cb 0.06 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 3hb1 h GLU 310 CO -0.12 0.86 -0.42 0.52 -0.73 0.00 0.00 179.01 179.12 3hb1 h MET 311 N 1.28 0.32 0.08 1.92 2.86 -0.99 0.87 114.93 121.28 3hb1 h MET 311 Ca 0.34 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.82 3hb1 h MET 311 Cb -0.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.56 3hb1 h MET 311 CO -0.07 0.68 -0.04 0.82 1.06 0.00 0.00 176.91 179.37 3hb1 h ILE 312 N 0.26 1.07 0.00 -1.22 2.04 -0.66 -1.47 117.51 117.54 3hb1 h ILE 312 Ca 0.02 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.32 3hb1 h ILE 312 Cb 0.85 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 38.36 3hb1 h ILE 312 CO 0.07 0.14 0.00 -0.26 0.00 0.00 0.00 178.15 178.10 3hb1 h PHE 313 N -0.37 0.00 -0.21 1.37 -1.00 -1.34 -2.06 116.94 113.34 3hb1 h PHE 313 Ca -0.01 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.66 3hb1 h PHE 313 Cb 0.31 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.87 3hb1 h PHE 313 CO 0.01 0.00 -0.30 -0.97 -1.61 0.00 0.00 178.31 175.44 3hb1 h ASN 314 N 0.00 0.62 -0.04 2.17 -0.73 -0.74 -1.90 115.58 114.97 3hb1 h ASN 314 Ca 0.00 -0.52 -0.01 0.00 1.87 0.00 0.00 56.30 57.65 3hb1 h ASN 314 Cb 0.85 -0.18 -0.00 0.00 0.27 0.00 0.00 38.32 39.26 3hb1 h ASN 314 CO 0.00 1.02 0.00 0.25 -0.37 0.00 0.00 177.43 178.33 3hb1 h LEU 315 N 0.25 0.06 -0.20 0.34 6.46 -1.14 -2.06 115.31 119.02 3hb1 h LEU 315 Ca 0.02 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.48 3hb1 h LEU 315 Cb 0.88 -0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.78 3hb1 h LEU 315 CO 0.07 0.35 0.13 0.00 -0.62 0.00 0.00 178.44 178.36 3hb1 h ALA 316 N 0.72 0.26 0.17 1.25 0.00 -1.41 0.10 119.26 120.36 3hb1 h ALA 316 Ca 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3hb1 h ALA 316 Cb 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3hb1 h ALA 316 CO 0.00 -0.25 -0.08 -0.44 0.00 0.00 0.00 179.25 178.48 3hb1 h ASP 317 N 0.26 -0.20 -0.19 0.00 3.32 -1.39 0.84 116.42 119.06 3hb1 h ASP 317 Ca 0.07 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.96 3hb1 h ASP 317 Cb -0.00 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 3hb1 h ASP 317 CO -0.01 0.01 -0.01 0.74 -1.72 0.00 0.00 179.24 178.25 3hb1 h THR 318 N -0.41 1.26 0.00 0.35 2.02 -1.35 -3.35 112.91 111.43 3hb1 h THR 318 Ca -0.02 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.24 3hb1 h THR 318 Cb 0.32 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 3hb1 h THR 318 CO 0.04 0.28 -1.41 1.41 0.37 0.00 0.00 175.52 176.21 3hb1 n HIS 319 N -4.69 0.00 -1.23 3.16 8.25 0.35 -4.67 115.22 116.38 3hb1 n HIS 319 Ca -0.05 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.36 3hb1 n HIS 319 Cb 0.24 -0.23 0.23 0.00 1.12 0.00 0.00 29.99 31.36 3hb1 n HIS 319 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hb1 n LEU 320 N -1.82 4.93 -4.10 2.41 4.77 0.25 -4.92 117.00 118.51 3hb1 n LEU 320 Ca -0.02 -3.47 -0.39 0.00 -0.03 0.00 0.00 56.01 52.10 3hb1 n LEU 320 Cb 0.27 -0.67 -0.01 0.00 -2.33 0.00 0.00 43.42 40.68 3hb1 n LEU 320 CO 0.23 1.00 -0.25 0.49 -1.33 0.00 0.00 177.39 177.53 3hb1 n PHE 321 N -0.80 -1.42 0.02 -1.77 3.01 -1.09 -4.85 117.46 110.55 3hb1 n PHE 321 Ca 0.37 0.31 -0.18 0.00 1.01 0.00 0.00 57.45 58.95 3hb1 n PHE 321 Cb 1.19 -2.93 -0.12 0.00 -0.01 0.00 0.00 39.48 37.61 3hb1 n PHE 321 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 3hb1 h PHE 322 N -2.28 0.62 -0.18 1.38 3.57 -1.58 -2.11 116.94 116.37 3hb1 h PHE 322 Ca -0.69 -0.37 0.05 0.00 3.53 0.00 0.00 57.97 60.49 3hb1 h PHE 322 Cb 1.40 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 3hb1 h PHE 322 CO 0.42 1.21 0.30 -0.91 -2.23 0.00 0.00 178.31 177.10 3hb1 h ASN 323 N -0.14 0.00 0.00 0.41 2.35 -1.86 0.37 115.58 116.71 3hb1 h ASN 323 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 3hb1 h ASN 323 Cb 1.43 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.80 3hb1 h ASN 323 CO 0.14 0.00 -0.17 0.44 -1.65 0.00 0.00 177.43 176.18 3hb1 h ASP 324 N 0.00 0.00 0.26 5.81 3.45 -1.86 -3.38 116.42 120.69 3hb1 h ASP 324 Ca 0.09 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.55 3hb1 h ASP 324 Cb 0.69 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.46 3hb1 h ASP 324 CO -0.00 0.34 0.00 0.18 -1.57 0.00 0.00 179.24 178.19 3hb1 n LEU 325 N -3.44 0.00 -0.34 1.55 4.77 -0.80 -3.66 117.00 115.08 3hb1 n LEU 325 Ca -0.02 0.42 0.30 0.00 -0.03 0.00 0.00 56.01 56.68 3hb1 n LEU 325 Cb 0.09 -0.42 0.56 0.00 -2.33 0.00 0.00 43.42 41.32 3hb1 n LEU 325 CO 0.04 -0.29 1.09 -0.08 -1.33 0.00 0.00 177.39 176.82 3hb1 h GLU 326 N 0.00 0.10 -0.01 3.23 4.57 -0.44 -0.39 114.58 121.64 3hb1 h GLU 326 Ca 0.00 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 3hb1 h GLU 326 Cb 0.13 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 3hb1 h GLU 326 CO 0.00 0.07 -0.59 -0.25 -1.18 0.00 0.00 179.01 177.06 3hb1 n ASP 327 N -5.14 1.16 -4.46 1.04 8.00 -1.24 -4.80 116.55 111.11 3hb1 n ASP 327 Ca 0.36 -1.08 -0.44 0.00 0.71 0.00 0.00 54.79 54.35 3hb1 n ASP 327 Cb 1.21 0.77 -0.05 0.00 -0.02 0.00 0.00 41.12 43.03 3hb1 n ASP 327 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hb1 s ASP 329 N 2.95 6.65 0.06 0.00 1.01 -1.26 -4.89 116.67 121.19 3hb1 s ASP 329 Ca 0.19 -2.34 -0.25 0.00 0.71 0.00 0.00 52.55 50.86 3hb1 s ASP 329 Cb -0.18 -2.28 -0.06 0.00 1.01 0.00 0.00 42.92 41.41 3hb1 s ASP 329 CO 0.13 -0.79 0.77 -1.10 0.21 0.00 0.00 175.17 174.40 3hb1 s GLN 330 N 1.23 4.51 0.25 8.23 -1.52 -1.26 -4.95 119.66 126.15 3hb1 s GLN 330 Ca 0.21 1.09 0.09 0.00 -1.95 0.00 0.00 55.36 54.81 3hb1 s GLN 330 Cb -0.11 -3.35 0.27 0.00 -0.22 0.00 0.00 33.01 29.61 3hb1 s GLN 330 CO -0.07 0.32 1.56 0.82 -0.25 0.00 0.00 175.29 177.67 3hb1 h ILE 331 N 4.00 1.47 -4.38 1.08 5.03 -1.97 -3.40 117.51 119.33 3hb1 h ILE 331 Ca -0.44 -2.25 -0.24 0.00 -0.12 0.00 0.00 64.86 61.81 3hb1 h ILE 331 Cb 1.21 2.21 -0.13 0.00 -3.03 0.00 0.00 36.82 37.08 3hb1 h ILE 331 CO 0.70 0.65 -0.45 -2.28 -0.68 0.00 0.00 178.15 176.09 3hb1 s HIS 332 N -3.52 1.07 0.10 1.37 5.04 -1.26 -1.08 115.29 116.99 3hb1 s HIS 332 Ca -0.01 -1.27 -0.09 0.00 -1.54 0.00 0.00 55.06 52.15 3hb1 s HIS 332 Cb 0.12 -0.37 -0.18 0.00 0.04 0.00 0.00 32.58 32.19 3hb1 s HIS 332 CO 0.78 -0.80 1.22 0.28 -2.34 0.00 0.00 174.74 173.88 3hb1 h VAL 333 N 2.42 1.36 -0.38 0.89 2.07 -1.85 -3.29 116.25 117.47 3hb1 h VAL 333 Ca -0.31 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 64.74 3hb1 h VAL 333 Cb 1.25 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 33.53 3hb1 h VAL 333 CO 0.45 0.74 0.00 0.47 0.02 0.00 0.00 177.57 179.26 3hb1 n ASP 334 N -3.76 3.04 0.00 0.57 8.00 -1.26 -4.36 116.55 118.78 3hb1 n ASP 334 Ca -0.09 -2.28 0.10 0.00 0.71 0.00 0.00 54.79 53.24 3hb1 n ASP 334 Cb 0.90 -0.45 0.62 0.00 -0.02 0.00 0.00 41.12 42.16 3hb1 n ASP 334 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3hb1 n ASP 335 N 0.56 0.00 0.00 -2.24 9.92 -1.24 -2.15 116.55 121.39 3hb1 n ASP 335 Ca 0.15 -0.77 0.00 0.00 -0.53 0.00 0.00 54.79 53.64 3hb1 n ASP 335 Cb 0.59 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.07 3hb1 n ASP 335 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 3hb1 n VAL 336 N -0.96 0.34 -0.44 2.53 0.31 -1.26 -4.84 118.33 114.01 3hb1 n VAL 336 Ca 0.16 -0.51 0.38 0.00 -0.01 0.00 0.00 64.34 64.35 3hb1 n VAL 336 Cb 0.07 0.99 0.66 0.00 -0.91 0.00 0.00 33.84 34.64 3hb1 n VAL 336 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 3hb1 h SER 337 N 0.00 0.24 0.79 4.52 0.87 -1.72 -0.81 113.55 117.43 3hb1 h SER 337 Ca 0.00 0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.69 3hb1 h SER 337 Cb 0.40 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 3hb1 h SER 337 CO 0.00 -0.25 -0.44 0.28 -0.53 0.00 0.00 176.83 175.89 3hb1 h SER 338 N 0.04 -1.10 0.00 6.23 0.02 -1.88 -3.20 113.55 113.67 3hb1 h SER 338 Ca 0.85 0.05 -0.00 0.00 -0.84 0.00 0.00 61.79 61.86 3hb1 h SER 338 Cb 2.66 0.31 -0.00 0.00 0.14 0.00 0.00 62.40 65.50 3hb1 h SER 338 CO -0.48 -0.71 0.01 0.47 -1.14 0.00 0.00 176.83 174.98 3hb1 n ASP 339 N -5.60 1.04 -0.77 3.07 9.92 -0.31 -4.70 116.55 119.21 3hb1 n ASP 339 Ca -0.15 -1.29 0.00 0.00 -0.53 0.00 0.00 54.79 52.83 3hb1 n ASP 339 Cb 0.47 -0.22 0.00 0.00 -0.64 0.00 0.00 41.12 40.73 3hb1 n ASP 339 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3hb1 n ASP 340 N 1.93 1.03 0.00 -2.24 -0.08 -1.21 -3.27 116.55 112.71 3hb1 n ASP 340 Ca 0.00 -0.51 0.00 0.00 -1.51 0.00 0.00 54.79 52.77 3hb1 n ASP 340 Cb 0.10 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.56 3hb1 n ASP 340 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 3hb1 n ASN 341 N -1.00 0.00 0.00 1.67 0.23 -1.26 -5.05 115.26 109.85 3hb1 n ASN 341 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 3hb1 n ASN 341 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 3hb1 n ASN 341 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3hb1 n GLY 342 N 0.00 0.00 3.31 4.83 0.00 -1.26 -4.95 105.19 107.12 3hb1 n GLY 342 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 3hb1 n GLY 342 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3hb1 s GLN 343 N 0.00 1.54 -1.45 1.61 -0.21 -1.26 -5.02 119.66 114.87 3hb1 s GLN 343 Ca 0.00 -1.08 -0.11 0.00 0.02 0.00 0.00 55.36 54.20 3hb1 s GLN 343 Cb 0.00 -1.74 0.04 0.00 1.00 0.00 0.00 33.01 32.31 3hb1 s GLN 343 CO 0.00 0.44 2.39 -0.25 -2.12 0.00 0.00 175.29 175.75 3hb1 n ASP 344 N 1.65 6.12 -1.72 5.90 8.00 -1.26 -4.73 116.55 130.52 3hb1 n ASP 344 Ca -0.17 -2.86 0.00 0.00 0.71 0.00 0.00 54.79 52.46 3hb1 n ASP 344 Cb 0.53 -1.55 0.00 0.00 -0.02 0.00 0.00 41.12 40.08 3hb1 n ASP 344 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3hb1 n LEU 345 N 4.29 2.72 -0.01 0.64 -0.00 -1.26 -3.62 117.00 119.75 3hb1 n LEU 345 Ca 0.59 -1.23 0.15 0.00 -0.00 0.00 0.00 56.01 55.52 3hb1 n LEU 345 Cb 0.32 -0.57 0.73 0.00 -0.00 0.00 0.00 43.42 43.90 3hb1 n LEU 345 CO 0.84 0.51 1.00 -1.20 -0.00 0.00 0.00 177.39 178.54 3hb1 n SER 346 N 1.71 0.06 0.00 1.45 7.64 -1.26 -3.18 113.62 120.03 3hb1 n SER 346 Ca 0.00 -0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.72 3hb1 n SER 346 Cb 0.26 -0.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.19 3hb1 n SER 346 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3hb1 n THR 347 N -1.26 0.19 -2.00 0.44 -2.24 -1.24 -5.09 114.28 103.09 3hb1 n THR 347 Ca 0.14 -0.30 -0.39 0.00 -2.27 0.00 0.00 64.05 61.23 3hb1 n THR 347 Cb 0.25 1.21 0.01 0.00 -2.10 0.00 0.00 70.33 69.70 3hb1 n THR 347 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3hb1 s TYR 348 N -0.19 2.64 -0.58 4.78 6.04 -1.19 -4.99 117.35 123.86 3hb1 s TYR 348 Ca 0.00 1.41 -0.09 0.00 0.04 0.00 0.00 57.07 58.43 3hb1 s TYR 348 Cb 0.00 -3.67 0.15 0.00 -1.04 0.00 0.00 41.96 37.40 3hb1 s TYR 348 CO 0.00 -2.28 0.46 1.21 -1.54 0.00 0.00 175.55 173.40 3hb1 s ASN 349 N -0.91 5.84 0.40 4.32 3.84 -1.26 -4.93 114.94 122.25 3hb1 s ASN 349 Ca 0.63 -2.28 0.19 0.00 0.21 0.00 0.00 52.86 51.61 3hb1 s ASN 349 Cb -0.37 -2.03 0.84 0.00 -0.55 0.00 0.00 41.25 39.15 3hb1 s ASN 349 CO 0.46 -0.61 1.82 -0.26 -2.79 0.00 0.00 177.10 175.73 3hb1 h PHE 350 N 8.02 0.00 0.00 0.43 -1.00 -1.94 -2.35 116.94 120.10 3hb1 h PHE 350 Ca -0.11 0.00 -0.12 0.00 2.81 0.00 0.00 57.97 60.56 3hb1 h PHE 350 Cb 1.04 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.58 3hb1 h PHE 350 CO 0.74 0.32 -0.56 0.66 -1.61 0.00 0.00 178.31 177.87 3hb1 h SER 351 N 0.00 0.00 0.22 2.17 4.64 -2.04 -3.31 113.55 115.23 3hb1 h SER 351 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3hb1 h SER 351 Cb 0.73 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.82 3hb1 h SER 351 CO 0.04 0.56 -0.11 0.00 -0.87 0.00 0.00 176.83 176.45 3hb1 h ALA 352 N 1.44 -0.70 -2.26 5.18 0.00 -1.85 -3.46 119.26 117.62 3hb1 h ALA 352 Ca -0.01 -0.06 -0.57 0.00 0.00 0.00 0.00 54.91 54.27 3hb1 h ALA 352 Cb 1.00 0.11 0.19 0.00 0.00 0.00 0.00 17.79 19.09 3hb1 h ALA 352 CO 0.07 -0.68 -0.82 -0.40 0.00 0.00 0.00 179.25 177.42 3hb1 n ASP 353 N -3.17 -2.60 -4.38 0.00 5.75 -1.11 -4.89 116.55 106.16 3hb1 n ASP 353 Ca -0.04 0.54 -0.45 0.00 -0.01 0.00 0.00 54.79 54.84 3hb1 n ASP 353 Cb 0.12 -1.05 -0.04 0.00 -1.03 0.00 0.00 41.12 39.12 3hb1 n ASP 353 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3hb1 s GLY 354 N -1.28 1.87 0.11 6.12 0.00 -1.26 -4.98 107.32 107.89 3hb1 s GLY 354 Ca 0.59 -2.40 0.08 0.00 0.00 0.00 0.00 44.72 42.99 3hb1 s GLY 354 CO 0.64 1.62 -0.16 -0.12 0.00 0.00 0.00 173.10 175.08 3hb1 s PHE 355 N 2.47 2.59 0.00 1.90 5.36 -1.26 -5.06 117.98 123.97 3hb1 s PHE 355 Ca 0.15 -0.24 0.00 0.00 -0.96 0.00 0.00 56.93 55.89 3hb1 s PHE 355 Cb -0.20 -1.38 0.00 0.00 -0.34 0.00 0.00 43.02 41.10 3hb1 s PHE 355 CO 0.03 0.38 0.00 -2.39 -1.46 0.00 0.00 175.22 171.78 3hb1 n HIS 356 N 0.85 0.00 0.00 10.12 -0.00 -1.26 -5.10 115.22 119.82 3hb1 n HIS 356 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.57 3hb1 n HIS 356 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.52 3hb1 n HIS 356 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 3hb1 n ASP 375 N -1.33 0.00 0.07 4.39 5.75 -1.26 -4.80 116.55 119.37 3hb1 n ASP 375 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 54.79 54.85 3hb1 n ASP 375 Cb 0.12 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.18 3hb1 n ASP 375 CO 0.00 0.00 0.00 1.87 -0.11 0.00 0.00 177.20 178.96 3hb1 n TRP 376 N 0.00 0.98 0.10 2.11 -0.00 -1.26 -3.79 117.44 115.57 3hb1 n TRP 376 Ca 0.00 0.30 -0.04 0.00 -0.00 0.00 0.00 57.50 57.76 3hb1 n TRP 376 Cb 0.00 -1.01 0.02 0.00 -0.00 0.00 0.00 31.31 30.32 3hb1 n TRP 376 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 177.69 178.21 3hb1 h MET 377 N 0.00 0.00 0.00 5.87 2.86 -2.00 -2.95 114.93 118.71 3hb1 h MET 377 Ca -0.07 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.41 3hb1 h MET 377 Cb 1.24 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.88 3hb1 h MET 377 CO 0.02 0.79 -0.77 0.00 1.06 0.00 0.00 176.91 178.02 3hb1 h ARG 378 N 0.00 0.00 0.00 1.72 -0.00 -1.69 -1.96 114.38 112.45 3hb1 h ARG 378 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.47 3hb1 h ARG 378 Cb 1.46 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.43 3hb1 h ARG 378 CO 0.10 0.77 0.00 1.63 0.00 0.00 0.00 179.97 182.47 3hb1 n LYS 379 N -3.46 0.03 -0.12 0.04 5.02 -1.21 -2.86 118.16 115.62 3hb1 n LYS 379 Ca 0.00 0.03 -0.25 0.00 -2.02 0.00 0.00 58.31 56.07 3hb1 n LYS 379 Cb 0.79 -1.54 -0.11 0.00 -0.02 0.00 0.00 35.03 34.15 3hb1 n LYS 379 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 3hb1 n LEU 380 N -1.59 1.98 0.21 -0.35 -0.00 -1.12 -3.99 117.00 112.14 3hb1 n LEU 380 Ca 0.07 0.35 0.15 0.00 -0.00 0.00 0.00 56.01 56.58 3hb1 n LEU 380 Cb 0.35 -0.91 0.72 0.00 -0.00 0.00 0.00 43.42 43.58 3hb1 n LEU 380 CO 0.27 0.46 0.94 0.00 -0.00 0.00 0.00 177.39 179.06 3hb1 h ALA 381 N -0.68 1.00 -0.01 1.96 0.00 -1.43 -2.36 119.26 117.75 3hb1 h ALA 381 Ca -0.52 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 3hb1 h ALA 381 Cb 1.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.29 3hb1 h ALA 381 CO -0.29 0.00 -0.18 0.74 0.00 0.00 0.00 179.25 179.52 3hb1 h PHE 382 N 0.00 0.20 -0.98 0.00 0.05 -1.69 -2.07 116.94 112.45 3hb1 h PHE 382 Ca 0.00 -0.10 0.05 0.00 3.82 0.00 0.00 57.97 61.74 3hb1 h PHE 382 Cb 0.14 -0.03 -0.06 0.00 2.00 0.00 0.00 35.95 38.00 3hb1 h PHE 382 CO 0.00 0.88 0.64 0.00 -0.18 0.00 0.00 178.31 179.65 3hb1 h ARG 383 N -0.53 1.14 -0.23 1.51 3.08 -1.56 0.45 114.38 118.24 3hb1 h ARG 383 Ca -0.02 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.82 3hb1 h ARG 383 Cb 0.92 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 30.71 3hb1 h ARG 383 CO 0.04 0.75 -0.46 1.88 -1.07 0.00 0.00 179.97 181.12 3hb1 h TYR 384 N 1.18 0.70 -0.01 3.04 -1.99 -1.54 -0.83 116.97 117.52 3hb1 h TYR 384 Ca 0.41 -0.22 -0.15 0.00 2.00 0.00 0.00 58.73 60.77 3hb1 h TYR 384 Cb 0.11 -0.14 -0.02 0.00 2.00 0.00 0.00 36.73 38.68 3hb1 h TYR 384 CO -0.00 0.93 -0.68 -0.09 -0.00 0.00 0.00 178.16 178.32 3hb1 h ARG 385 N 0.47 0.06 -0.29 4.88 2.43 -0.81 -1.66 114.38 119.46 3hb1 h ARG 385 Ca 0.03 -0.05 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 3hb1 h ARG 385 Cb 0.98 0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.53 3hb1 h ARG 385 CO 0.09 0.71 -0.30 -0.09 -1.51 0.00 0.00 179.97 178.87 3hb1 h ARG 386 N 0.04 0.71 0.36 0.20 9.65 -0.73 -1.85 114.38 122.76 3hb1 h ARG 386 Ca -0.01 -0.38 -0.02 0.00 -1.10 0.00 0.00 59.98 58.47 3hb1 h ARG 386 Cb 1.20 0.02 0.00 0.00 -1.39 0.00 0.00 29.97 29.80 3hb1 h ARG 386 CO 0.09 1.00 -0.17 0.28 2.80 0.00 0.00 179.97 183.97 3hb1 h VAL 387 N 0.45 0.65 -1.00 0.20 2.07 -1.06 -2.19 116.25 115.38 3hb1 h VAL 387 Ca 0.04 -0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.76 3hb1 h VAL 387 Cb 0.87 0.65 -0.11 0.00 -1.52 0.00 0.00 31.29 31.19 3hb1 h VAL 387 CO 0.07 0.00 0.60 0.50 0.02 0.00 0.00 177.57 178.77 3hb1 h LYS 388 N -0.48 0.70 -0.42 1.57 3.64 -1.26 -0.29 116.57 120.02 3hb1 h LYS 388 Ca -0.05 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 3hb1 h LYS 388 Cb 0.37 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 3hb1 h LYS 388 CO 0.08 0.46 0.22 0.93 -2.27 0.00 0.00 179.45 178.87 3hb1 h GLU 389 N 0.72 0.60 -0.25 1.90 5.08 -0.80 -2.80 114.58 119.03 3hb1 h GLU 389 Ca 0.59 -0.08 -0.16 0.00 -1.00 0.00 0.00 59.36 58.72 3hb1 h GLU 389 Cb 0.97 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 3hb1 h GLU 389 CO -0.41 0.50 -0.48 0.52 -1.00 0.00 0.00 179.01 178.15 3hb1 h MET 390 N 0.55 0.67 -0.43 2.33 2.86 -0.58 -1.67 114.93 118.66 3hb1 h MET 390 Ca 0.15 -0.39 0.06 0.00 -2.06 0.00 0.00 59.70 57.46 3hb1 h MET 390 Cb 0.09 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 3hb1 h MET 390 CO -0.02 1.00 0.13 -0.92 1.06 0.00 0.00 176.91 178.16 3hb1 h TYR 391 N 0.53 0.22 -0.14 -0.22 3.20 -1.01 0.10 116.97 119.66 3hb1 h TYR 391 Ca 0.03 0.02 -0.18 0.00 3.14 0.00 0.00 58.73 61.74 3hb1 h TYR 391 Cb 1.03 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.26 3hb1 h TYR 391 CO 0.05 0.06 -0.67 -0.91 -1.64 0.00 0.00 178.16 175.05 3hb1 h ASN 392 N 0.28 0.64 0.20 -2.11 2.35 -1.45 0.33 115.58 115.82 3hb1 h ASN 392 Ca 0.21 -0.39 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 3hb1 h ASN 392 Cb 0.22 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.40 3hb1 h ASN 392 CO -0.23 1.14 -0.01 0.35 -1.65 0.00 0.00 177.43 177.02 3hb1 n THR 393 N -3.90 0.00 -0.22 2.81 -2.24 -0.63 -4.01 114.28 106.08 3hb1 n THR 393 Ca -0.05 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.71 3hb1 n THR 393 Cb 0.68 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 3hb1 n THR 393 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 3hb1 n TYR 394 N -0.99 0.00 0.00 4.78 4.02 0.31 -4.76 117.16 120.52 3hb1 n TYR 394 Ca 0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 3hb1 n TYR 394 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 3hb1 n TYR 394 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 176.86 176.21 3hb1 n LYS 395 N -0.15 0.00 -0.41 -0.72 2.85 0.11 0.22 118.16 120.07 3hb1 n LYS 395 Ca 0.00 0.27 0.01 0.00 -1.05 0.00 0.00 58.31 57.55 3hb1 n LYS 395 Cb 0.06 -1.61 0.02 0.00 -0.65 0.00 0.00 35.03 32.85 3hb1 n LYS 395 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 3hb1 n ASN 396 N -1.24 0.33 -2.72 -5.58 3.02 -1.26 -3.66 115.26 104.15 3hb1 n ASN 396 Ca 0.00 -2.08 -0.04 0.00 -0.03 0.00 0.00 54.58 52.42 3hb1 n ASN 396 Cb 0.11 -0.22 0.09 0.00 -0.61 0.00 0.00 39.78 39.15 3hb1 n ASN 396 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3hb1 n ASN 397 N -0.19 -0.20 -0.31 6.41 5.15 0.13 -4.97 115.26 121.28 3hb1 n ASN 397 Ca 0.02 -2.33 0.21 0.00 -0.60 0.00 0.00 54.58 51.89 3hb1 n ASN 397 Cb 0.68 0.22 0.50 0.00 -0.53 0.00 0.00 39.78 40.64 3hb1 n ASN 397 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 3hb1 h VAL 398 N 3.72 0.57 -0.20 3.44 2.07 -1.68 0.11 116.25 124.27 3hb1 h VAL 398 Ca -0.26 -0.14 -0.07 0.00 0.82 0.00 0.00 66.70 67.05 3hb1 h VAL 398 Cb 1.27 0.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.13 3hb1 h VAL 398 CO 0.08 0.08 -0.18 1.23 0.02 0.00 0.00 177.57 178.79 3hb1 h GLY 399 N 0.42 0.38 2.00 2.17 0.00 -1.90 -1.83 103.07 104.30 3hb1 h GLY 399 Ca 0.57 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.63 3hb1 h GLY 399 CO -0.27 0.24 0.00 -1.33 0.00 0.00 0.00 176.54 175.18 3hb1 h GLY 400 N 0.91 0.00 0.72 4.60 0.00 -1.10 -1.71 103.07 106.49 3hb1 h GLY 400 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 47.07 3hb1 h GLY 400 CO 0.03 0.00 -1.90 -0.10 0.00 0.00 0.00 176.54 174.57 3hb1 n LEU 401 N -2.75 1.05 -0.56 3.11 7.94 -0.73 -4.42 117.00 120.63 3hb1 n LEU 401 Ca 0.01 0.29 0.09 0.00 -1.11 0.00 0.00 56.01 55.29 3hb1 n LEU 401 Cb 0.27 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.27 3hb1 n LEU 401 CO 0.24 0.50 0.42 2.30 -1.11 0.00 0.00 177.39 179.73 3hb1 n ILE 402 N -3.06 0.00 0.00 1.96 -5.35 -0.95 -5.05 119.36 106.91 3hb1 n ILE 402 Ca -0.23 -0.43 0.00 0.00 -0.27 0.00 0.00 62.75 61.82 3hb1 n ILE 402 Cb 1.07 1.29 0.00 0.00 -1.74 0.00 0.00 39.64 40.26 3hb1 n ILE 402 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hb1 n GLY 403 N 1.07 0.51 0.23 3.28 0.00 -0.65 -4.32 105.19 105.31 3hb1 n GLY 403 Ca 0.09 -1.72 -0.15 0.00 0.00 0.00 0.00 46.02 44.24 3hb1 n GLY 403 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3hb1 h THR 404 N 0.00 0.61 -0.35 2.61 2.02 -1.96 0.34 112.91 116.18 3hb1 h THR 404 Ca 0.00 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.22 3hb1 h THR 404 Cb 0.00 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 66.98 3hb1 h THR 404 CO 0.00 0.00 0.13 1.55 0.37 0.00 0.00 175.52 177.57 3hb1 h PRO 405 N -0.47 0.28 -0.33 6.66 0.13 -1.96 -2.13 132.00 134.18 3hb1 h PRO 405 Ca -0.03 -0.02 -0.12 0.00 -0.87 0.00 0.00 66.00 64.96 3hb1 h PRO 405 Cb 0.39 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 31.44 3hb1 h PRO 405 CO 0.03 0.19 -0.28 0.87 -0.23 0.00 0.00 178.00 178.58 3hb1 h LYS 406 N 0.29 0.69 -0.69 0.86 1.57 -1.74 -2.72 116.57 114.84 3hb1 h LYS 406 Ca 0.15 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 3hb1 h LYS 406 Cb 0.11 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 3hb1 h LYS 406 CO -0.15 0.89 0.38 -0.09 -0.57 0.00 0.00 179.45 179.91 3hb1 h ARG 407 N 0.60 0.96 -0.57 3.15 2.43 -0.73 0.10 114.38 120.31 3hb1 h ARG 407 Ca 0.08 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.09 3hb1 h ARG 407 Cb 0.78 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 3hb1 h ARG 407 CO 0.06 0.72 0.18 1.49 -1.51 0.00 0.00 179.97 180.91 3hb1 h GLU 408 N 0.94 0.89 -0.02 0.20 4.81 -1.23 -0.05 114.58 120.12 3hb1 h GLU 408 Ca 0.24 -0.19 -0.15 0.00 -0.13 0.00 0.00 59.36 59.13 3hb1 h GLU 408 Cb 0.04 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 3hb1 h GLU 408 CO -0.04 0.81 -0.66 1.79 -0.73 0.00 0.00 179.01 180.18 3hb1 h THR 409 N 0.81 1.45 -0.74 0.32 1.35 -1.30 -2.42 112.91 112.38 3hb1 h THR 409 Ca 0.18 -2.20 -0.03 0.00 -0.55 0.00 0.00 66.41 63.82 3hb1 h THR 409 Cb 0.29 2.17 -0.03 0.00 -1.73 0.00 0.00 68.15 68.84 3hb1 h THR 409 CO -0.01 0.63 0.36 -0.25 -0.25 0.00 0.00 175.52 176.01 3hb1 h TRP 410 N 0.07 1.04 -0.23 4.73 7.01 -0.25 -1.75 115.95 126.57 3hb1 h TRP 410 Ca -0.01 -0.04 -0.20 0.00 2.11 0.00 0.00 58.89 60.75 3hb1 h TRP 410 Cb 1.17 -0.33 0.00 0.00 -2.10 0.00 0.00 29.16 27.91 3hb1 h TRP 410 CO 0.01 0.75 -0.65 -0.07 -2.79 0.00 0.00 178.44 175.70 3hb1 h LEU 411 N 1.04 0.97 -1.08 0.65 3.38 -0.80 -2.09 115.31 117.39 3hb1 h LEU 411 Ca 0.26 -0.57 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 3hb1 h LEU 411 Cb 0.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3hb1 h LEU 411 CO -0.03 1.37 -0.30 -0.61 0.09 0.00 0.00 178.44 178.96 3hb1 h GLN 412 N 0.62 0.28 -0.20 1.13 4.15 -1.19 -1.79 115.11 118.11 3hb1 h GLN 412 Ca -0.01 -0.10 -0.12 0.00 0.77 0.00 0.00 58.65 59.18 3hb1 h GLN 412 Cb 1.27 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.94 3hb1 h GLN 412 CO 0.14 0.56 -0.36 1.25 -1.93 0.00 0.00 178.83 178.49 3hb1 h LEU 413 N 0.25 0.66 -1.18 -2.39 5.85 -1.30 -2.14 115.31 115.06 3hb1 h LEU 413 Ca 0.03 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 3hb1 h LEU 413 Cb 0.66 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 3hb1 h LEU 413 CO 0.05 1.08 0.36 0.03 -0.34 0.00 0.00 178.44 179.62 3hb1 h ARG 414 N 0.28 0.93 -0.42 1.25 2.47 -1.19 -0.75 114.38 116.94 3hb1 h ARG 414 Ca 0.01 -0.10 -0.15 0.00 -1.26 0.00 0.00 59.98 58.48 3hb1 h ARG 414 Cb 0.95 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 3hb1 h ARG 414 CO 0.08 0.69 -0.31 0.00 0.56 0.00 0.00 179.97 180.98 3hb1 h ALA 415 N 1.46 0.65 -0.58 0.04 0.00 -1.22 -1.22 119.26 118.39 3hb1 h ALA 415 Ca 0.24 -0.43 -0.05 0.00 0.00 0.00 0.00 54.91 54.67 3hb1 h ALA 415 Cb 0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3hb1 h ALA 415 CO -0.04 0.67 0.17 0.93 0.00 0.00 0.00 179.25 180.99 3hb1 h GLU 416 N 0.79 0.91 -0.08 0.00 5.08 -1.02 -2.47 114.58 117.78 3hb1 h GLU 416 Ca 0.08 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3hb1 h GLU 416 Cb 0.90 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 3hb1 h GLU 416 CO 0.08 0.82 0.05 1.25 -1.00 0.00 0.00 179.01 180.21 3hb1 h LEU 417 N 0.82 0.09 -1.55 1.33 5.85 -0.99 0.17 115.31 121.02 3hb1 h LEU 417 Ca 0.19 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.95 3hb1 h LEU 417 Cb 0.30 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3hb1 h LEU 417 CO -0.00 0.06 0.36 -0.33 -0.34 0.00 0.00 178.44 178.19 3hb1 h GLU 418 N 0.11 0.55 -0.05 1.25 4.39 -1.06 0.36 114.58 120.13 3hb1 h GLU 418 Ca 0.03 -0.03 -0.06 0.00 0.34 0.00 0.00 59.36 59.64 3hb1 h GLU 418 Cb -0.01 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 3hb1 h GLU 418 CO -0.01 0.36 -0.20 0.00 -1.16 0.00 0.00 179.01 178.00 3hb1 h ALA 419 N 1.70 0.10 -0.07 3.43 0.00 -1.02 0.18 119.26 123.57 3hb1 h ALA 419 Ca 0.22 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.76 3hb1 h ALA 419 Cb 0.18 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3hb1 h ALA 419 CO -0.06 0.06 -0.03 1.25 0.00 0.00 0.00 179.25 180.47 3hb1 h LEU 420 N -0.30 -0.11 -1.23 0.00 5.85 0.30 -2.30 115.31 117.51 3hb1 h LEU 420 Ca -0.01 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3hb1 h LEU 420 Cb 0.84 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.93 3hb1 h LEU 420 CO 0.04 -0.05 0.00 0.35 -0.34 0.00 0.00 178.44 178.44 3hb1 n THR 421 N -5.15 0.51 -3.98 1.05 -2.24 0.12 -4.93 114.28 99.65 3hb1 n THR 421 Ca -0.05 -0.31 -0.40 0.00 -2.27 0.00 0.00 64.05 61.02 3hb1 n THR 421 Cb 0.08 -0.19 0.01 0.00 -2.10 0.00 0.00 70.33 68.14 3hb1 n THR 421 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3hb1 n ASP 422 N 0.11 -3.72 -1.85 3.42 8.00 -0.87 -2.26 116.55 119.38 3hb1 n ASP 422 Ca 0.07 -1.20 -0.19 0.00 0.71 0.00 0.00 54.79 54.18 3hb1 n ASP 422 Cb 0.35 -2.22 -0.04 0.00 -0.02 0.00 0.00 41.12 39.18 3hb1 n ASP 422 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3hb1 n LEU 423 N -4.74 -1.65 0.19 0.64 4.77 0.59 -4.94 117.00 111.86 3hb1 n LEU 423 Ca -0.14 0.18 -0.15 0.00 -0.03 0.00 0.00 56.01 55.87 3hb1 n LEU 423 Cb 0.59 -2.67 -0.08 0.00 -2.33 0.00 0.00 43.42 38.93 3hb1 n LEU 423 CO 0.74 -0.52 0.52 -0.25 -1.33 0.00 0.00 177.39 176.54 3hb1 h TRP 424 N 0.00 -1.25 -0.98 -1.77 2.91 -1.70 -1.35 115.95 111.80 3hb1 h TRP 424 Ca -0.42 0.02 0.12 0.00 1.13 0.00 0.00 58.89 59.73 3hb1 h TRP 424 Cb 1.29 0.51 -0.08 0.00 -0.51 0.00 0.00 29.16 30.36 3hb1 h TRP 424 CO 0.51 -0.55 0.62 1.25 -1.03 0.00 0.00 178.44 179.24 3hb1 h LEU 425 N -0.78 0.90 -0.71 0.65 5.85 -1.88 0.11 115.31 119.45 3hb1 h LEU 425 Ca -0.04 0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.79 3hb1 h LEU 425 Cb 0.71 -0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.54 3hb1 h LEU 425 CO -0.13 0.49 0.41 0.74 -0.34 0.00 0.00 178.44 179.61 3hb1 h THR 426 N 0.97 0.98 -0.27 1.05 2.02 -1.84 0.82 112.91 116.64 3hb1 h THR 426 Ca 0.48 -0.26 -0.09 0.00 0.77 0.00 0.00 66.41 67.32 3hb1 h THR 426 Cb 0.47 0.17 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 3hb1 h THR 426 CO -0.24 0.14 -0.17 0.45 0.37 0.00 0.00 175.52 176.06 3hb1 h HIS 427 N 0.75 0.70 -0.53 3.16 3.86 0.28 -2.26 115.15 121.11 3hb1 h HIS 427 Ca 0.32 -0.19 -0.03 0.00 -1.16 0.00 0.00 60.37 59.31 3hb1 h HIS 427 Cb 0.19 -0.16 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 3hb1 h HIS 427 CO -0.07 0.87 0.21 0.66 0.86 0.00 0.00 177.93 180.46 3hb1 h SER 428 N 0.33 0.74 -0.90 2.45 4.64 -0.69 -2.50 113.55 117.62 3hb1 h SER 428 Ca 0.06 -0.17 0.07 0.00 -0.47 0.00 0.00 61.79 61.27 3hb1 h SER 428 Cb 0.71 -0.19 -0.06 0.00 -0.31 0.00 0.00 62.40 62.54 3hb1 h SER 428 CO 0.05 0.71 0.56 -0.07 -0.87 0.00 0.00 176.83 177.21 3hb1 h LEU 429 N 0.72 0.89 -0.41 5.97 3.38 -0.81 -0.08 115.31 124.95 3hb1 h LEU 429 Ca 0.18 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.21 3hb1 h LEU 429 Cb 0.21 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 3hb1 h LEU 429 CO -0.01 0.56 0.16 0.11 0.09 0.00 0.00 178.44 179.35 3hb1 h LYS 430 N 1.02 0.33 0.19 1.13 1.79 -0.98 0.49 116.57 120.54 3hb1 h LYS 430 Ca 0.40 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.84 3hb1 h LYS 430 Cb 0.19 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 3hb1 h LYS 430 CO -0.18 0.22 -0.09 0.00 -1.08 0.00 0.00 179.45 178.31 3hb1 h ALA 431 N 1.25 -0.26 -0.01 3.86 0.00 -0.97 0.49 119.26 123.62 3hb1 h ALA 431 Ca 0.19 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.05 3hb1 h ALA 431 Cb 0.15 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3hb1 h ALA 431 CO -0.17 -0.64 -0.13 -0.07 0.00 0.00 0.00 179.25 178.24 3hb1 h LEU 432 N -0.28 -0.38 -1.63 0.00 3.38 -0.63 -1.13 115.31 114.64 3hb1 h LEU 432 Ca -0.03 0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.04 3hb1 h LEU 432 Cb 0.22 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3hb1 h LEU 432 CO 0.04 -0.18 0.31 0.78 0.09 0.00 0.00 178.44 179.48 3hb1 h ASN 433 N -0.22 0.41 -0.51 -0.43 2.35 0.09 0.86 115.58 118.13 3hb1 h ASN 433 Ca 0.05 -0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.67 3hb1 h ASN 433 Cb 0.28 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 3hb1 h ASN 433 CO -0.13 0.28 -0.17 0.25 -1.65 0.00 0.00 177.43 176.01 3hb1 h LEU 434 N 0.48 1.03 -0.49 1.61 5.85 -0.03 -1.48 115.31 122.27 3hb1 h LEU 434 Ca 0.19 -0.38 -0.17 0.00 0.84 0.00 0.00 57.88 58.37 3hb1 h LEU 434 Cb 0.18 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 3hb1 h LEU 434 CO -0.05 1.17 -0.63 0.40 -0.34 0.00 0.00 178.44 179.00 3hb1 h ILE 435 N 0.88 1.35 -0.81 4.05 2.04 -0.43 -2.93 117.51 121.66 3hb1 h ILE 435 Ca 0.12 -1.95 -0.04 0.00 1.00 0.00 0.00 64.86 63.99 3hb1 h ILE 435 Cb 0.74 1.94 -0.04 0.00 -0.74 0.00 0.00 36.82 38.73 3hb1 h ILE 435 CO 0.06 0.59 0.33 -1.13 0.00 0.00 0.00 178.15 178.00 3hb1 h ASN 436 N 0.33 1.11 1.39 1.72 -0.73 -0.60 -2.39 115.58 116.41 3hb1 h ASN 436 Ca -0.01 -0.17 -0.00 0.00 1.87 0.00 0.00 56.30 57.99 3hb1 h ASN 436 Cb 1.18 -0.29 -0.00 0.00 0.27 0.00 0.00 38.32 39.48 3hb1 h ASN 436 CO 0.11 0.97 -0.00 0.77 -0.37 0.00 0.00 177.43 178.91 3hb1 h SER 437 N 1.17 0.00 -2.97 1.15 4.64 -1.22 -3.43 113.55 112.89 3hb1 h SER 437 Ca 0.27 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.06 3hb1 h SER 437 Cb 0.20 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.31 3hb1 h SER 437 CO -0.02 0.00 0.75 -0.13 -0.87 0.00 0.00 176.83 176.56 3hb1 s ARG 438 N -3.50 4.31 0.18 4.77 0.52 -0.90 -4.94 118.95 119.40 3hb1 s ARG 438 Ca 0.03 2.06 -0.14 0.00 -0.52 0.00 0.00 55.73 57.17 3hb1 s ARG 438 Cb 0.07 -3.32 0.15 0.00 0.52 0.00 0.00 34.95 32.37 3hb1 s ARG 438 CO 0.59 -0.47 1.75 -1.00 0.02 0.00 0.00 175.30 176.19 3hb1 h PRO 439 N 7.05 0.32 -0.37 3.54 0.13 -1.85 -3.24 132.00 137.58 3hb1 h PRO 439 Ca -0.41 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.61 3hb1 h PRO 439 Cb 1.20 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 3hb1 h PRO 439 CO 0.87 0.21 0.03 0.09 -0.23 0.00 0.00 178.00 178.98 3hb1 n ASN 440 N -5.01 3.74 -4.35 1.44 3.02 -1.26 -4.97 115.26 107.86 3hb1 n ASN 440 Ca 0.04 -3.24 -0.29 0.00 -0.03 0.00 0.00 54.58 51.06 3hb1 n ASN 440 Cb 0.18 -0.61 -0.14 0.00 -0.61 0.00 0.00 39.78 38.61 3hb1 n ASN 440 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hb1 s VAL 442 N -0.91 0.18 -0.14 0.00 0.11 -1.14 -4.69 120.40 113.80 3hb1 s VAL 442 Ca 0.12 -1.48 -0.06 0.00 -2.93 0.00 0.00 61.98 57.63 3hb1 s VAL 442 Cb -0.10 -1.19 -0.04 0.00 -1.53 0.00 0.00 36.38 33.52 3hb1 s VAL 442 CO 0.04 -0.82 0.05 0.20 -3.33 0.00 0.00 175.10 171.24 3hb1 s ASN 443 N -2.54 5.62 0.04 3.54 0.01 -1.26 -1.83 114.94 118.51 3hb1 s ASN 443 Ca 0.01 0.16 0.05 0.00 -0.71 0.00 0.00 52.86 52.36 3hb1 s ASN 443 Cb 0.03 -1.85 -0.02 0.00 0.41 0.00 0.00 41.25 39.82 3hb1 s ASN 443 CO -0.08 0.27 -0.14 -0.69 -1.51 0.00 0.00 177.10 174.95 3hb1 s VAL 444 N -0.21 1.08 -0.09 1.60 1.01 -0.32 -4.83 120.40 118.64 3hb1 s VAL 444 Ca 0.07 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 61.05 3hb1 s VAL 444 Cb -0.12 -0.99 -0.01 0.00 0.00 0.00 0.00 36.38 35.26 3hb1 s VAL 444 CO 0.01 -0.05 -0.19 -0.22 0.00 0.00 0.00 175.10 174.66 3hb1 s LEU 445 N -1.24 2.39 -0.23 3.92 2.96 0.71 -0.57 118.68 126.62 3hb1 s LEU 445 Ca 0.01 -0.41 -0.02 0.00 -0.22 0.00 0.00 54.13 53.49 3hb1 s LEU 445 Cb -0.08 -1.49 0.07 0.00 0.50 0.00 0.00 46.19 45.19 3hb1 s LEU 445 CO 0.01 0.22 0.04 -0.69 -1.32 0.00 0.00 176.35 174.61 3hb1 s VAL 446 N 0.01 0.76 0.02 1.68 1.01 -0.09 0.20 120.40 123.98 3hb1 s VAL 446 Ca -0.07 -0.86 0.05 0.00 0.00 0.00 0.00 61.98 61.11 3hb1 s VAL 446 Cb -0.15 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.91 3hb1 s VAL 446 CO 0.05 -0.31 -0.16 0.28 0.00 0.00 0.00 175.10 174.96 3hb1 s THR 447 N 1.73 1.31 0.56 3.92 -1.32 -0.82 -4.21 115.64 116.81 3hb1 s THR 447 Ca 0.01 -0.93 0.24 0.00 -1.21 0.00 0.00 61.69 59.80 3hb1 s THR 447 Cb -0.17 -1.13 0.32 0.00 -1.51 0.00 0.00 72.50 70.01 3hb1 s THR 447 CO -0.12 0.19 2.17 0.74 -2.21 0.00 0.00 174.62 175.39 3hb1 h THR 448 N 4.56 0.73 -3.78 5.08 2.02 -1.88 -1.98 112.91 117.66 3hb1 h THR 448 Ca -0.38 0.00 -0.55 0.00 0.77 0.00 0.00 66.41 66.25 3hb1 h THR 448 Cb 1.17 0.96 0.12 0.00 -1.74 0.00 0.00 68.15 68.66 3hb1 h THR 448 CO 0.46 0.00 0.64 0.41 0.37 0.00 0.00 175.52 177.40 3hb1 n THR 449 N -4.17 2.51 -1.66 3.16 -1.04 -1.26 -3.53 114.28 108.30 3hb1 n THR 449 Ca -0.02 -0.50 -0.37 0.00 -2.04 0.00 0.00 64.05 61.13 3hb1 n THR 449 Cb 0.15 -1.77 0.08 0.00 -1.82 0.00 0.00 70.33 66.97 3hb1 n THR 449 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hb1 n GLN 450 N 0.05 1.01 0.08 -2.82 6.02 -1.26 -4.53 117.38 115.94 3hb1 n GLN 450 Ca 0.05 0.40 -0.15 0.00 -0.01 0.00 0.00 57.00 57.30 3hb1 n GLN 450 Cb 0.40 -2.52 -0.08 0.00 1.02 0.00 0.00 30.24 29.06 3hb1 n GLN 450 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3hb1 h LEU 451 N 0.36 -1.39 -0.07 1.08 5.85 -1.90 -0.27 115.31 118.99 3hb1 h LEU 451 Ca -0.50 0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.41 3hb1 h LEU 451 Cb 1.34 0.53 -0.04 0.00 0.37 0.00 0.00 40.66 42.85 3hb1 h LEU 451 CO 0.52 -0.50 -0.16 0.40 -0.34 0.00 0.00 178.44 178.36 3hb1 h ILE 452 N -0.65 0.60 -0.42 4.05 1.08 -1.92 -1.32 117.51 118.92 3hb1 h ILE 452 Ca 0.03 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.45 3hb1 h ILE 452 Cb 0.70 0.60 -0.02 0.00 -3.07 0.00 0.00 36.82 35.02 3hb1 h ILE 452 CO -0.30 0.00 0.06 -0.65 -0.69 0.00 0.00 178.15 176.57 3hb1 h PRO 453 N -0.23 0.64 -0.76 2.37 0.11 -1.93 -2.41 132.00 129.80 3hb1 h PRO 453 Ca 0.07 -0.13 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 3hb1 h PRO 453 Cb 0.33 -0.10 -0.04 0.00 0.11 0.00 0.00 31.00 31.31 3hb1 h PRO 453 CO -0.20 0.62 0.43 0.00 -0.21 0.00 0.00 178.00 178.64 3hb1 h ALA 454 N 1.45 1.33 -0.49 -0.75 0.00 -0.46 -0.90 119.26 119.44 3hb1 h ALA 454 Ca 0.14 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.82 3hb1 h ALA 454 Cb 0.30 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hb1 h ALA 454 CO 0.00 0.56 -0.19 -0.07 0.00 0.00 0.00 179.25 179.55 3hb1 h LEU 455 N 1.05 1.01 -0.96 0.00 3.38 -0.79 -0.63 115.31 118.38 3hb1 h LEU 455 Ca 0.27 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.90 3hb1 h LEU 455 Cb -0.00 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.42 3hb1 h LEU 455 CO -0.05 1.17 0.63 0.00 0.09 0.00 0.00 178.44 180.28 3hb1 h ALA 456 N 0.91 1.25 0.68 1.53 0.00 -0.96 0.19 119.26 122.87 3hb1 h ALA 456 Ca 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3hb1 h ALA 456 Cb 0.76 -0.35 0.01 0.00 0.00 0.00 0.00 17.79 18.21 3hb1 h ALA 456 CO 0.06 0.53 -0.33 0.87 0.00 0.00 0.00 179.25 180.38 3hb1 h LYS 457 N 1.23 -0.88 -0.89 0.00 1.57 -0.89 -1.60 116.57 115.11 3hb1 h LYS 457 Ca 0.37 0.06 0.22 0.00 -1.87 0.00 0.00 60.65 59.44 3hb1 h LYS 457 Cb -0.03 0.20 -0.16 0.00 0.08 0.00 0.00 32.23 32.32 3hb1 h LYS 457 CO -0.11 -0.59 -0.00 0.28 -0.57 0.00 0.00 179.45 178.46 3hb1 h VAL 458 N -1.19 0.16 -0.17 0.50 2.07 -0.84 0.16 116.25 116.94 3hb1 h VAL 458 Ca -0.09 -0.02 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 3hb1 h VAL 458 Cb 0.70 0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 3hb1 h VAL 458 CO 0.15 0.01 0.01 -0.07 0.02 0.00 0.00 177.57 177.70 3hb1 h LEU 459 N 0.06 0.28 -1.73 2.57 3.38 -0.91 -0.26 115.31 118.70 3hb1 h LEU 459 Ca 0.51 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 58.20 3hb1 h LEU 459 Cb 0.97 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.64 3hb1 h LEU 459 CO -0.82 0.49 0.00 -0.07 0.09 0.00 0.00 178.44 178.13 3hb1 h LEU 460 N 0.06 0.00 -3.34 1.67 3.38 -0.11 -2.88 115.31 114.09 3hb1 h LEU 460 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3hb1 h LEU 460 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3hb1 h LEU 460 CO 0.01 0.00 0.00 -1.22 0.09 0.00 0.00 178.44 177.32 3hb1 n TYR 461 N -2.98 1.55 -1.14 1.13 4.02 -0.11 -4.94 117.16 114.70 3hb1 n TYR 461 Ca -0.00 -0.72 -0.05 0.00 -0.01 0.00 0.00 57.90 57.12 3hb1 n TYR 461 Cb 0.24 -0.36 -0.02 0.00 -0.02 0.00 0.00 39.34 39.17 3hb1 n TYR 461 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3hb1 n GLY 462 N 0.48 0.63 0.02 2.72 0.00 -1.09 -4.87 105.19 103.09 3hb1 n GLY 462 Ca 0.25 -0.17 0.12 0.00 0.00 0.00 0.00 46.02 46.23 3hb1 n GLY 462 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hb1 n LEU 463 N -0.54 0.50 -0.32 0.99 4.77 -0.13 -4.04 117.00 118.23 3hb1 n LEU 463 Ca -0.05 0.16 0.06 0.00 -0.03 0.00 0.00 56.01 56.16 3hb1 n LEU 463 Cb 0.34 -0.27 0.22 0.00 -2.33 0.00 0.00 43.42 41.38 3hb1 n LEU 463 CO 0.07 0.04 1.17 1.23 -1.33 0.00 0.00 177.39 178.57 3hb1 h GLY 464 N 4.83 1.46 2.00 -0.72 0.00 -1.72 -0.44 103.07 108.48 3hb1 h GLY 464 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 46.99 3hb1 h GLY 464 CO 0.00 0.09 0.00 0.23 0.00 0.00 0.00 176.54 176.86 3hb1 h SER 465 N 0.82 0.00 0.00 0.19 0.87 -1.70 -3.07 113.55 110.67 3hb1 h SER 465 Ca 0.46 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.02 3hb1 h SER 465 Cb 0.51 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.47 3hb1 h SER 465 CO -0.29 0.00 -1.24 1.33 -0.53 0.00 0.00 176.83 176.10 3hb1 n VAL 466 N -3.08 0.00 -4.02 2.23 0.24 -0.27 -4.90 118.33 108.53 3hb1 n VAL 466 Ca -0.01 -0.25 -0.33 0.00 -2.04 0.00 0.00 64.34 61.72 3hb1 n VAL 466 Cb 0.22 0.58 -0.15 0.00 -1.47 0.00 0.00 33.84 33.02 3hb1 n VAL 466 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3hb1 s PHE 467 N -2.83 3.34 0.09 6.34 0.40 -0.62 -4.85 117.98 119.85 3hb1 s PHE 467 Ca 0.00 -2.32 -0.31 0.00 -0.60 0.00 0.00 56.93 53.71 3hb1 s PHE 467 Cb 0.11 -2.14 -0.07 0.00 0.51 0.00 0.00 43.02 41.43 3hb1 s PHE 467 CO 0.68 -0.87 1.38 -1.25 0.70 0.00 0.00 175.22 175.85 3hb1 s PRO 468 N 1.11 4.32 0.60 0.24 0.04 -1.26 -4.79 135.00 135.26 3hb1 s PRO 468 Ca -0.05 2.03 0.31 0.00 0.04 0.00 0.00 61.00 63.33 3hb1 s PRO 468 Cb -0.20 -3.33 1.16 0.00 0.04 0.00 0.00 34.50 32.17 3hb1 s PRO 468 CO -0.04 -0.45 1.46 0.97 0.04 0.00 0.00 177.00 178.97 3hb1 h ILE 469 N 4.43 0.07 -0.14 0.56 2.10 -1.98 0.78 117.51 123.33 3hb1 h ILE 469 Ca -0.41 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.53 3hb1 h ILE 469 Cb 1.20 0.12 0.00 0.00 -1.09 0.00 0.00 36.82 37.05 3hb1 h ILE 469 CO 0.87 0.00 0.00 -0.62 -1.08 0.00 0.00 178.15 177.32 3hb1 n GLU 470 N -3.46 1.41 -0.31 2.19 4.71 -1.26 -3.16 120.64 120.76 3hb1 n GLU 470 Ca 0.24 -0.63 0.08 0.00 -0.01 0.00 0.00 57.16 56.85 3hb1 n GLU 470 Cb 1.46 -1.23 0.20 0.00 -1.01 0.00 0.00 31.44 30.86 3hb1 n GLU 470 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 3hb1 n ASN 471 N -0.06 3.10 -4.14 1.62 4.13 0.27 -4.97 115.26 115.21 3hb1 n ASN 471 Ca 0.10 -3.12 -0.32 0.00 1.68 0.00 0.00 54.58 52.92 3hb1 n ASN 471 Cb 0.18 -0.50 -0.17 0.00 -1.54 0.00 0.00 39.78 37.75 3hb1 n ASN 471 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3hb1 s ILE 472 N -2.89 1.94 -0.08 2.41 1.01 -1.19 -0.21 121.20 122.19 3hb1 s ILE 472 Ca 0.38 -0.90 0.04 0.00 0.00 0.00 0.00 60.65 60.16 3hb1 s ILE 472 Cb 0.32 -1.73 0.00 0.00 0.01 0.00 0.00 42.46 41.07 3hb1 s ILE 472 CO 0.05 0.53 -0.21 -0.31 0.00 0.00 0.00 174.94 175.00 3hb1 s TYR 473 N 0.89 2.22 -0.49 3.97 1.51 0.13 -4.63 117.35 120.95 3hb1 s TYR 473 Ca -0.06 -0.84 -0.14 0.00 -1.01 0.00 0.00 57.07 55.02 3hb1 s TYR 473 Cb -0.15 -1.50 0.10 0.00 -0.11 0.00 0.00 41.96 40.30 3hb1 s TYR 473 CO -0.03 -0.34 0.41 0.45 -1.11 0.00 0.00 175.55 174.93 3hb1 s SER 474 N 0.32 6.04 -0.20 2.29 0.15 -0.24 -1.94 113.70 120.11 3hb1 s SER 474 Ca -0.15 -1.59 0.02 0.00 0.70 0.00 0.00 55.95 54.93 3hb1 s SER 474 Cb -0.16 -2.15 0.32 0.00 -1.71 0.00 0.00 66.02 62.32 3hb1 s SER 474 CO 0.07 -0.72 1.40 0.00 1.20 0.00 0.00 173.24 175.19 3hb1 n ALA 475 N 5.14 3.88 -0.13 5.45 0.00 -0.74 -4.41 120.51 129.70 3hb1 n ALA 475 Ca -0.12 -1.31 -0.05 0.00 0.00 0.00 0.00 53.44 51.95 3hb1 n ALA 475 Cb 0.42 -1.20 0.03 0.00 0.00 0.00 0.00 19.45 18.70 3hb1 n ALA 475 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3hb1 h THR 476 N 0.57 0.93 0.00 0.00 2.02 -1.72 -2.71 112.91 112.00 3hb1 h THR 476 Ca 0.27 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.32 3hb1 h THR 476 Cb 1.82 0.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.75 3hb1 h THR 476 CO 0.49 0.07 -0.11 0.29 0.37 0.00 0.00 175.52 176.63 3hb1 n LYS 477 N -4.95 0.08 0.03 6.66 5.02 -1.26 -4.58 118.16 119.16 3hb1 n LYS 477 Ca 0.03 0.23 0.20 0.00 -2.02 0.00 0.00 58.31 56.74 3hb1 n LYS 477 Cb 0.13 -0.85 0.70 0.00 -0.02 0.00 0.00 35.03 34.99 3hb1 n LYS 477 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 3hb1 h THR 478 N -0.18 0.69 0.00 -0.18 1.35 -1.86 -3.48 112.91 109.25 3hb1 h THR 478 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3hb1 h THR 478 Cb 0.11 0.74 0.00 0.00 -1.73 0.00 0.00 68.15 67.28 3hb1 h THR 478 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 3hb1 n GLY 479 N -1.61 1.71 0.32 5.82 0.00 -1.02 -4.44 105.19 105.96 3hb1 n GLY 479 Ca 0.09 -1.82 -0.04 0.00 0.00 0.00 0.00 46.02 44.25 3hb1 n GLY 479 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hb1 h LYS 480 N 0.00 0.98 -0.77 1.61 1.57 -1.93 -2.87 116.57 115.17 3hb1 h LYS 480 Ca 0.00 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.56 3hb1 h LYS 480 Cb 0.00 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.13 3hb1 h LYS 480 CO 0.00 0.85 0.42 1.49 -0.57 0.00 0.00 179.45 181.64 3hb1 h GLU 481 N 0.95 1.06 -0.31 3.15 4.81 -1.88 -0.83 114.58 121.53 3hb1 h GLU 481 Ca 0.21 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.35 3hb1 h GLU 481 Cb 0.29 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 3hb1 h GLU 481 CO -0.01 0.78 0.12 0.77 -0.73 0.00 0.00 179.01 179.95 3hb1 h SER 482 N 1.07 0.15 -0.26 1.04 0.02 -1.72 -1.88 113.55 111.97 3hb1 h SER 482 Ca 0.27 0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 61.15 3hb1 h SER 482 Cb 0.03 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 3hb1 h SER 482 CO -0.04 0.12 -0.16 0.00 -1.14 0.00 0.00 176.83 175.61 3hb1 h PHE 484 N 0.63 0.85 0.75 0.00 0.05 -0.78 -0.66 116.94 117.78 3hb1 h PHE 484 Ca 0.10 0.00 -0.04 0.00 3.82 0.00 0.00 57.97 61.86 3hb1 h PHE 484 Cb 0.62 -0.28 0.01 0.00 2.00 0.00 0.00 35.95 38.30 3hb1 h PHE 484 CO 0.03 0.57 -0.38 0.93 -0.18 0.00 0.00 178.31 179.28 3hb1 h GLU 485 N 0.89 -0.99 -0.93 1.51 4.39 -0.75 -0.91 114.58 117.79 3hb1 h GLU 485 Ca 0.23 0.07 0.25 0.00 0.34 0.00 0.00 59.36 60.25 3hb1 h GLU 485 Cb -0.03 0.23 -0.17 0.00 -0.10 0.00 0.00 28.75 28.68 3hb1 h GLU 485 CO -0.04 -0.66 0.07 0.00 -1.16 0.00 0.00 179.01 177.21 3hb1 h ARG 486 N -1.03 0.06 -0.35 2.33 3.08 -0.93 0.55 114.38 118.09 3hb1 h ARG 486 Ca -0.10 -0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.86 3hb1 h ARG 486 Cb 0.80 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.82 3hb1 h ARG 486 CO 0.15 0.04 -0.14 0.82 -1.07 0.00 0.00 179.97 179.78 3hb1 h ILE 487 N 0.06 1.25 -0.05 2.04 2.04 -0.91 0.46 117.51 122.40 3hb1 h ILE 487 Ca 0.57 -1.12 -0.23 0.00 1.00 0.00 0.00 64.86 65.08 3hb1 h ILE 487 Cb 1.15 1.13 0.01 0.00 -0.74 0.00 0.00 36.82 38.37 3hb1 h ILE 487 CO -0.83 0.37 -0.89 0.24 0.00 0.00 0.00 178.15 177.04 3hb1 h MET 488 N 0.56 0.57 -0.63 2.37 2.86 0.13 -2.00 114.93 118.79 3hb1 h MET 488 Ca 0.10 -0.55 -0.09 0.00 -2.06 0.00 0.00 59.70 57.10 3hb1 h MET 488 Cb 0.56 0.14 -0.02 0.00 0.06 0.00 0.00 31.60 32.33 3hb1 h MET 488 CO 0.04 1.17 0.03 1.96 1.06 0.00 0.00 176.91 181.17 3hb1 h GLN 489 N 0.35 1.08 -0.14 1.72 4.20 -0.14 0.63 115.11 122.81 3hb1 h GLN 489 Ca -0.08 -0.33 -0.06 0.00 0.06 0.00 0.00 58.65 58.25 3hb1 h GLN 489 Cb 1.52 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 29.18 3hb1 h GLN 489 CO 0.17 1.04 -0.18 -0.09 -0.67 0.00 0.00 178.83 179.09 3hb1 h ARG 490 N 0.99 0.22 -0.01 1.46 2.43 0.03 -3.23 114.38 116.27 3hb1 h ARG 490 Ca 0.18 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 3hb1 h ARG 490 Cb 0.53 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.05 3hb1 h ARG 490 CO 0.03 0.41 -0.06 1.19 -1.51 0.00 0.00 179.97 180.02 3hb1 n PHE 491 N -4.23 0.00 -0.60 2.20 3.01 -0.76 -5.07 117.46 112.01 3hb1 n PHE 491 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3hb1 n PHE 491 Cb 0.30 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.77 3hb1 n PHE 491 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3hb1 n GLY 492 N 0.61 0.68 0.00 1.37 0.00 0.22 -4.42 105.19 103.64 3hb1 n GLY 492 Ca 0.04 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.93 3hb1 n GLY 492 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3hb1 n ARG 493 N 5.70 0.00 0.20 1.61 0.63 -1.26 -4.56 116.66 118.97 3hb1 n ARG 493 Ca 0.00 0.00 0.08 0.00 -0.92 0.00 0.00 57.85 57.01 3hb1 n ARG 493 Cb 0.00 -0.35 0.31 0.00 0.45 0.00 0.00 32.46 32.86 3hb1 n ARG 493 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 3hb1 h LYS 494 N 0.00 0.00 -6.42 -0.14 3.64 -1.96 -3.45 116.57 108.24 3hb1 h LYS 494 Ca 0.00 0.00 -0.51 0.00 -1.27 0.00 0.00 60.65 58.87 3hb1 h LYS 494 Cb 0.48 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3hb1 h LYS 494 CO 0.00 0.28 -0.21 0.00 -2.27 0.00 0.00 179.45 177.25 3hb1 s ALA 495 N -3.41 3.71 -0.23 5.00 0.00 -1.26 -4.92 121.76 120.65 3hb1 s ALA 495 Ca 0.02 -0.75 -0.10 0.00 0.00 0.00 0.00 51.96 51.13 3hb1 s ALA 495 Cb 0.09 -2.15 -0.05 0.00 0.00 0.00 0.00 23.12 21.01 3hb1 s ALA 495 CO 0.67 0.22 0.14 0.08 0.00 0.00 0.00 175.76 176.87 3hb1 s VAL 496 N -2.09 5.31 -0.44 0.00 1.01 -1.11 -4.93 120.40 118.15 3hb1 s VAL 496 Ca 0.41 0.16 -0.14 0.00 0.00 0.00 0.00 61.98 62.41 3hb1 s VAL 496 Cb -0.10 -3.46 0.06 0.00 0.00 0.00 0.00 36.38 32.88 3hb1 s VAL 496 CO 0.32 0.38 0.34 -0.31 0.00 0.00 0.00 175.10 175.82 3hb1 s TYR 497 N 0.84 3.26 -0.34 5.22 1.51 -1.26 0.06 117.35 126.63 3hb1 s TYR 497 Ca 0.07 -0.98 -0.18 0.00 -1.01 0.00 0.00 57.07 54.97 3hb1 s TYR 497 Cb -0.13 -2.96 -0.00 0.00 -0.11 0.00 0.00 41.96 38.76 3hb1 s TYR 497 CO 0.02 -0.76 0.53 0.08 -1.11 0.00 0.00 175.55 174.32 3hb1 s VAL 498 N 1.60 5.00 -0.11 0.71 1.01 0.61 -3.47 120.40 125.75 3hb1 s VAL 498 Ca 0.04 0.40 -0.15 0.00 0.00 0.00 0.00 61.98 62.27 3hb1 s VAL 498 Cb -0.23 -3.97 -0.05 0.00 0.00 0.00 0.00 36.38 32.14 3hb1 s VAL 498 CO 0.06 -0.21 0.37 -0.69 0.00 0.00 0.00 175.10 174.63 3hb1 s VAL 499 N 2.42 5.22 -0.10 2.92 1.01 0.14 0.23 120.40 132.25 3hb1 s VAL 499 Ca 0.19 0.72 0.02 0.00 0.00 0.00 0.00 61.98 62.91 3hb1 s VAL 499 Cb -0.15 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.54 3hb1 s VAL 499 CO 0.13 0.42 -0.14 -0.63 0.00 0.00 0.00 175.10 174.87 3hb1 s ILE 500 N 0.16 1.40 0.00 2.22 1.01 -0.16 -1.02 121.20 124.80 3hb1 s ILE 500 Ca 0.21 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.26 3hb1 s ILE 500 Cb -0.14 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.05 3hb1 s ILE 500 CO 0.08 0.42 0.00 0.61 0.00 0.00 0.00 174.94 176.05 3hb1 n GLY 501 N 4.10 0.23 0.01 6.18 0.00 -0.97 -1.28 105.19 113.45 3hb1 n GLY 501 Ca -0.20 -0.84 0.09 0.00 0.00 0.00 0.00 46.02 45.07 3hb1 n GLY 501 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3hb1 n ASP 502 N 0.00 0.87 -4.95 1.61 5.75 -1.24 -1.43 116.55 117.16 3hb1 n ASP 502 Ca 0.00 -0.14 -0.23 0.00 -0.01 0.00 0.00 54.79 54.41 3hb1 n ASP 502 Cb 0.00 1.70 0.03 0.00 -1.03 0.00 0.00 41.12 41.82 3hb1 n ASP 502 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 3hb1 s GLY 503 N -3.87 1.68 0.07 6.12 0.00 -1.26 -4.89 107.32 105.17 3hb1 s GLY 503 Ca -0.05 -1.05 -0.12 0.00 0.00 0.00 0.00 44.72 43.50 3hb1 s GLY 503 CO 0.75 -0.79 1.14 -2.08 0.00 0.00 0.00 173.10 172.12 3hb1 h VAL 504 N 0.04 1.32 -0.49 1.40 2.07 -1.99 -3.15 116.25 115.44 3hb1 h VAL 504 Ca -0.44 -2.50 0.08 0.00 0.82 0.00 0.00 66.70 64.65 3hb1 h VAL 504 Cb 1.28 2.65 -0.06 0.00 -1.52 0.00 0.00 31.29 33.64 3hb1 h VAL 504 CO 0.57 0.76 0.14 -0.08 0.02 0.00 0.00 177.57 178.97 3hb1 h GLU 505 N 0.26 0.28 -0.65 1.57 4.81 -1.99 0.31 114.58 119.17 3hb1 h GLU 505 Ca -0.16 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.05 3hb1 h GLU 505 Cb 1.86 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 31.14 3hb1 h GLU 505 CO 0.22 0.19 0.41 0.93 -0.73 0.00 0.00 179.01 180.03 3hb1 h GLU 506 N 0.29 0.86 -0.04 1.92 3.07 -1.99 -1.78 114.58 116.91 3hb1 h GLU 506 Ca 0.24 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 59.04 3hb1 h GLU 506 Cb 0.29 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.01 3hb1 h GLU 506 CO -0.28 0.59 0.02 1.49 -1.40 0.00 0.00 179.01 179.43 3hb1 h GLU 507 N 0.88 0.06 -0.26 2.33 4.81 -1.21 -2.30 114.58 118.89 3hb1 h GLU 507 Ca 0.23 -0.01 -0.16 0.00 -0.13 0.00 0.00 59.36 59.30 3hb1 h GLU 507 Cb -0.07 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.29 3hb1 h GLU 507 CO -0.05 0.18 -0.48 1.96 -0.73 0.00 0.00 179.01 179.90 3hb1 h GLN 508 N -0.07 0.69 -0.59 1.92 4.20 -0.97 -2.18 115.11 118.11 3hb1 h GLN 508 Ca 0.01 -0.40 0.03 0.00 0.06 0.00 0.00 58.65 58.36 3hb1 h GLN 508 Cb 0.14 0.03 -0.04 0.00 0.30 0.00 0.00 27.48 27.91 3hb1 h GLN 508 CO -0.00 1.01 0.35 0.78 -0.67 0.00 0.00 178.83 180.31 3hb1 h GLY 509 N 0.94 0.84 1.00 3.46 0.00 -1.32 -1.51 103.07 106.49 3hb1 h GLY 509 Ca 0.03 -0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 3hb1 h GLY 509 CO 0.10 0.22 0.30 0.00 0.00 0.00 0.00 176.54 177.16 3hb1 h ALA 510 N 1.27 0.81 -0.79 3.60 0.00 -1.25 -3.04 119.26 119.86 3hb1 h ALA 510 Ca 0.24 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 3hb1 h ALA 510 Cb 0.04 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 3hb1 h ALA 510 CO -0.11 0.37 0.33 0.87 0.00 0.00 0.00 179.25 180.71 3hb1 h LYS 511 N 0.86 1.16 0.08 0.00 1.57 -0.93 0.64 116.57 119.96 3hb1 h LYS 511 Ca 0.22 -0.20 0.02 0.00 -1.87 0.00 0.00 60.65 58.81 3hb1 h LYS 511 Cb 0.12 -0.19 -0.05 0.00 0.08 0.00 0.00 32.23 32.18 3hb1 h LYS 511 CO -0.03 0.93 -0.47 0.87 -0.57 0.00 0.00 179.45 180.18 3hb1 h LYS 512 N 1.13 -0.65 -0.87 3.15 1.57 -1.17 -1.21 116.57 118.53 3hb1 h LYS 512 Ca 0.26 0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.09 3hb1 h LYS 512 Cb 0.19 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 3hb1 h LYS 512 CO -0.03 -0.44 0.00 0.72 -0.57 0.00 0.00 179.45 179.14 3hb1 n HIS 513 N -5.47 0.69 -4.03 -1.35 8.25 -1.14 -4.89 115.22 107.27 3hb1 n HIS 513 Ca -0.07 -0.25 -0.29 0.00 -0.26 0.00 0.00 57.72 56.84 3hb1 n HIS 513 Cb 0.39 -0.24 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 3hb1 n HIS 513 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3hb1 n ASN 514 N 0.20 -0.84 -4.68 0.41 5.03 -0.46 -4.95 115.26 109.97 3hb1 n ASN 514 Ca 0.09 -1.10 -0.36 0.00 0.87 0.00 0.00 54.58 54.08 3hb1 n ASN 514 Cb 0.57 -2.59 -0.09 0.00 -1.02 0.00 0.00 39.78 36.65 3hb1 n ASN 514 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 3hb1 s MET 515 N -6.78 4.11 0.01 3.52 -1.94 0.21 -4.99 119.30 113.44 3hb1 s MET 515 Ca 0.09 -0.22 -0.35 0.00 -1.71 0.00 0.00 55.69 53.51 3hb1 s MET 515 Cb -0.04 -3.51 -0.13 0.00 2.01 0.00 0.00 34.83 33.16 3hb1 s MET 515 CO 0.92 0.12 1.71 -0.35 -0.01 0.00 0.00 175.02 177.41 3hb1 n PRO 516 N 4.09 2.02 -4.81 2.03 -0.04 -1.23 -4.43 135.00 132.63 3hb1 n PRO 516 Ca -0.15 0.74 -0.32 0.00 -0.04 0.00 0.00 63.50 63.73 3hb1 n PRO 516 Cb 0.52 -2.52 -0.13 0.00 -0.04 0.00 0.00 33.50 31.33 3hb1 n PRO 516 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3hb1 s PHE 517 N 2.49 2.67 -0.20 0.54 5.36 -1.26 -0.68 117.98 126.90 3hb1 s PHE 517 Ca 0.87 -0.18 0.01 0.00 -0.96 0.00 0.00 56.93 56.67 3hb1 s PHE 517 Cb -0.73 -1.58 0.03 0.00 -0.34 0.00 0.00 43.02 40.40 3hb1 s PHE 517 CO 0.47 0.21 -0.17 -1.58 -1.46 0.00 0.00 175.22 172.68 3hb1 s TRP 518 N -0.80 2.83 -0.44 10.12 0.52 -0.19 -4.97 118.94 126.01 3hb1 s TRP 518 Ca 0.13 -1.77 -0.22 0.00 0.02 0.00 0.00 56.10 54.26 3hb1 s TRP 518 Cb -0.11 -1.89 0.02 0.00 -1.15 0.00 0.00 33.47 30.35 3hb1 s TRP 518 CO 0.02 -0.81 0.70 0.50 0.02 0.00 0.00 176.95 177.38 3hb1 s ARG 519 N 1.27 3.35 -0.61 4.98 3.52 -1.26 -2.28 118.95 127.92 3hb1 s ARG 519 Ca 0.02 -0.23 -0.17 0.00 -0.13 0.00 0.00 55.73 55.21 3hb1 s ARG 519 Cb -0.15 -3.94 0.13 0.00 -1.56 0.00 0.00 34.95 29.44 3hb1 s ARG 519 CO -0.11 -1.04 0.62 0.42 -0.81 0.00 0.00 175.30 174.38 3hb1 s ILE 520 N 3.02 5.12 -1.32 4.11 1.09 -0.51 -4.87 121.20 127.84 3hb1 s ILE 520 Ca 0.26 -1.47 0.20 0.00 -1.10 0.00 0.00 60.65 58.54 3hb1 s ILE 520 Cb -0.13 -4.42 -0.13 0.00 -1.06 0.00 0.00 42.46 36.72 3hb1 s ILE 520 CO 0.20 -1.00 0.91 -1.54 -0.10 0.00 0.00 174.94 173.41 3hb1 n SER 521 N 5.47 1.33 -3.84 3.58 3.41 -1.26 -3.71 113.62 118.61 3hb1 n SER 521 Ca -0.07 -1.17 -0.07 0.00 -0.26 0.00 0.00 58.87 57.29 3hb1 n SER 521 Cb 0.42 0.78 -0.02 0.00 -0.26 0.00 0.00 64.21 65.13 3hb1 n SER 521 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3hb1 h HIS 523 N 2.04 0.83 -0.82 0.00 2.76 -1.97 -1.22 115.15 116.76 3hb1 h HIS 523 Ca -0.21 0.03 0.14 0.00 -2.20 0.00 0.00 60.37 58.14 3hb1 h HIS 523 Cb 1.25 -0.25 -0.06 0.00 1.55 0.00 0.00 27.41 29.90 3hb1 h HIS 523 CO 0.47 0.36 0.54 0.00 -1.30 0.00 0.00 177.93 178.00 3hb1 h ALA 524 N 1.42 1.98 -0.22 5.26 0.00 -1.99 -0.36 119.26 125.35 3hb1 h ALA 524 Ca 0.37 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.16 3hb1 h ALA 524 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3hb1 h ALA 524 CO -0.22 -0.19 -0.41 -0.44 0.00 0.00 0.00 179.25 177.98 3hb1 h ASP 525 N 0.55 0.54 -0.48 0.00 3.32 -1.61 -1.39 116.42 117.36 3hb1 h ASP 525 Ca 0.40 -0.24 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 3hb1 h ASP 525 Cb 0.78 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 40.15 3hb1 h ASP 525 CO -0.16 0.89 0.29 0.25 -1.72 0.00 0.00 179.24 178.80 3hb1 h LEU 526 N 0.42 0.56 -0.89 1.55 6.46 -0.92 -0.86 115.31 121.65 3hb1 h LEU 526 Ca 0.04 -0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 57.73 3hb1 h LEU 526 Cb 0.90 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 40.65 3hb1 h LEU 526 CO 0.08 0.44 0.46 -0.33 -0.62 0.00 0.00 178.44 178.47 3hb1 h GLU 527 N 0.64 1.25 -0.22 1.25 4.39 -1.02 -0.81 114.58 120.05 3hb1 h GLU 527 Ca 0.17 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 3hb1 h GLU 527 Cb -0.03 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.38 3hb1 h GLU 527 CO -0.03 0.93 -0.01 0.00 -1.16 0.00 0.00 179.01 178.73 3hb1 h ALA 528 N 1.25 0.30 -0.28 3.43 0.00 -0.81 -1.79 119.26 121.36 3hb1 h ALA 528 Ca 0.31 -0.23 0.05 0.00 0.00 0.00 0.00 54.91 55.04 3hb1 h ALA 528 Cb 0.06 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3hb1 h ALA 528 CO -0.05 0.04 -0.00 1.25 0.00 0.00 0.00 179.25 180.50 3hb1 h LEU 529 N 0.16 -0.11 -1.41 0.00 5.85 -0.95 0.52 115.31 119.38 3hb1 h LEU 529 Ca 0.06 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3hb1 h LEU 529 Cb 0.43 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 3hb1 h LEU 529 CO 0.01 -0.02 0.14 -0.09 -0.34 0.00 0.00 178.44 178.14 3hb1 h ARG 530 N 0.08 0.54 -0.05 1.25 1.12 -1.08 -1.10 114.38 115.15 3hb1 h ARG 530 Ca 0.13 -0.07 -0.17 0.00 -1.11 0.00 0.00 59.98 58.77 3hb1 h ARG 530 Cb 0.18 -0.10 -0.01 0.00 -0.01 0.00 0.00 29.97 30.02 3hb1 h ARG 530 CO -0.23 0.46 -0.70 1.25 -3.11 0.00 0.00 179.97 177.64 3hb1 h HIS 531 N 0.54 0.33 -0.44 2.20 2.76 -0.67 -2.26 115.15 117.60 3hb1 h HIS 531 Ca 0.13 -0.14 -0.04 0.00 -2.20 0.00 0.00 60.37 58.12 3hb1 h HIS 531 Cb 0.13 -0.05 -0.02 0.00 1.55 0.00 0.00 27.41 29.02 3hb1 h HIS 531 CO 0.01 0.86 0.13 0.00 -1.30 0.00 0.00 177.93 177.63 3hb1 h ALA 532 N 1.10 0.58 -0.42 5.26 0.00 0.12 -2.39 119.26 123.51 3hb1 h ALA 532 Ca -0.02 -0.18 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 3hb1 h ALA 532 Cb 1.25 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.85 3hb1 h ALA 532 CO 0.11 0.25 0.09 -0.07 0.00 0.00 0.00 179.25 179.63 3hb1 h LEU 533 N 0.58 0.58 0.17 0.00 3.38 -1.18 -0.23 115.31 118.62 3hb1 h LEU 533 Ca 0.14 -0.09 0.01 0.00 0.09 0.00 0.00 57.88 58.03 3hb1 h LEU 533 Cb 0.29 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3hb1 h LEU 533 CO -0.00 0.59 -0.23 -0.33 0.09 0.00 0.00 178.44 178.56 3hb1 h GLU 534 N 0.61 -0.44 0.00 1.13 4.39 -0.93 -2.33 114.58 117.02 3hb1 h GLU 534 Ca 0.14 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.87 3hb1 h GLU 534 Cb 0.25 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 3hb1 h GLU 534 CO -0.00 -0.29 0.00 1.28 -1.16 0.00 0.00 179.01 178.83 3hb1 n LEU 535 N -5.35 0.00 -0.18 1.33 4.77 -0.96 -4.89 117.00 111.72 3hb1 n LEU 535 Ca -0.07 0.44 -0.02 0.00 -0.03 0.00 0.00 56.01 56.33 3hb1 n LEU 535 Cb 0.26 -0.44 -0.01 0.00 -2.33 0.00 0.00 43.42 40.90 3hb1 n LEU 535 CO 0.28 -0.03 -0.02 -0.62 -1.33 0.00 0.00 177.39 175.67 3hb1 n GLU 536 N -1.44 -0.42 0.23 3.23 1.02 -0.26 -4.82 120.64 118.18 3hb1 n GLU 536 Ca 0.08 0.38 0.16 0.00 -0.02 0.00 0.00 57.16 57.76 3hb1 n GLU 536 Cb 0.29 -3.90 0.81 0.00 -0.02 0.00 0.00 31.44 28.63 3hb1 n GLU 536 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 3hb1 h TYR 537 N 0.00 0.00 0.00 -0.32 3.20 -1.39 -3.48 116.97 114.98 3hb1 h TYR 537 Ca -0.05 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.82 3hb1 h TYR 537 Cb 0.28 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.55 3hb1 h TYR 537 CO 0.15 0.00 0.00 -0.11 -1.64 0.00 0.00 178.16 176.56