#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3geb s ARG 269 N 0.00 1.46 -0.23 5.31 0.52 -0.52 -2.37 118.95 123.11 3geb s ARG 269 Ca 0.00 -1.18 0.00 0.00 -0.52 0.00 0.00 55.73 54.03 3geb s ARG 269 Cb 0.00 -1.76 0.06 0.00 0.52 0.00 0.00 34.95 33.77 3geb s ARG 269 CO 0.00 0.43 -0.04 0.08 0.02 0.00 0.00 175.30 175.79 3geb s VAL 270 N -0.97 1.41 -0.32 3.52 1.01 -0.40 -2.02 120.40 122.64 3geb s VAL 270 Ca 0.11 -1.14 -0.19 0.00 0.00 0.00 0.00 61.98 60.75 3geb s VAL 270 Cb -0.10 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 3geb s VAL 270 CO 0.04 -0.11 0.58 -0.36 0.00 0.00 0.00 175.10 175.25 3geb s PHE 271 N 1.45 3.20 -0.44 5.22 0.40 -0.31 -0.77 117.98 126.73 3geb s PHE 271 Ca -0.05 0.43 -0.15 0.00 -0.60 0.00 0.00 56.93 56.56 3geb s PHE 271 Cb -0.19 -2.96 0.04 0.00 0.51 0.00 0.00 43.02 40.43 3geb s PHE 271 CO -0.06 -0.49 0.34 0.08 0.70 0.00 0.00 175.22 175.79 3geb s VAL 272 N 2.52 5.25 0.31 -0.44 1.01 0.42 -0.75 120.40 128.72 3geb s VAL 272 Ca 0.23 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.37 3geb s VAL 272 Cb -0.15 -4.02 -0.04 0.00 0.00 0.00 0.00 36.38 32.17 3geb s VAL 272 CO 0.12 -0.43 0.53 0.26 0.00 0.00 0.00 175.10 175.58 3geb s TRP 273 N 1.67 3.49 0.23 5.22 0.52 0.40 -1.36 118.94 129.13 3geb s TRP 273 Ca 0.05 0.43 0.06 0.00 0.02 0.00 0.00 56.10 56.66 3geb s TRP 273 Cb -0.21 -1.95 -0.03 0.00 -1.15 0.00 0.00 33.47 30.12 3geb s TRP 273 CO 0.09 0.17 0.25 0.34 0.02 0.00 0.00 176.95 177.82 3geb s ASP 274 N -3.66 5.83 0.00 2.95 2.15 -0.94 -0.96 116.67 122.05 3geb s ASP 274 Ca 0.41 -0.11 0.00 0.00 0.43 0.00 0.00 52.55 53.28 3geb s ASP 274 Cb -0.10 -1.59 0.00 0.00 -0.30 0.00 0.00 42.92 40.93 3geb s ASP 274 CO 0.33 -0.03 0.00 -0.11 -0.17 0.00 0.00 175.17 175.19 3geb n LEU 275 N -1.14 0.72 -4.74 -1.34 7.94 -1.26 -3.93 117.00 113.26 3geb n LEU 275 Ca -0.08 0.05 -0.42 0.00 -1.11 0.00 0.00 56.01 54.45 3geb n LEU 275 Cb 0.57 -0.14 -0.02 0.00 0.53 0.00 0.00 43.42 44.36 3geb n LEU 275 CO 0.44 -0.14 1.29 -1.81 -1.11 0.00 0.00 177.39 176.06 3geb s ASP 276 N -1.76 6.35 -1.93 1.96 1.11 -1.26 -0.92 116.67 120.21 3geb s ASP 276 Ca 0.00 2.95 0.00 0.00 0.18 0.00 0.00 52.55 55.68 3geb s ASP 276 Cb 0.00 -2.63 0.00 0.00 1.07 0.00 0.00 42.92 41.36 3geb s ASP 276 CO 0.00 -0.95 0.00 -0.62 1.18 0.00 0.00 175.17 174.78 3geb n GLU 277 N 2.66 -1.57 0.02 8.23 4.71 0.17 -4.69 120.64 130.17 3geb n GLU 277 Ca 0.10 1.08 0.00 0.00 -0.01 0.00 0.00 57.16 58.34 3geb n GLU 277 Cb 0.37 -5.57 0.00 0.00 -1.01 0.00 0.00 31.44 25.22 3geb n GLU 277 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3geb n THR 278 N -2.98 0.05 0.03 2.62 -1.04 -1.11 -4.69 114.28 107.16 3geb n THR 278 Ca -0.21 0.02 -0.22 0.00 -2.04 0.00 0.00 64.05 61.60 3geb n THR 278 Cb 0.66 -0.39 -0.14 0.00 -1.82 0.00 0.00 70.33 68.64 3geb n THR 278 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 3geb h ILE 279 N 0.00 0.74 -2.91 12.58 2.04 -1.15 -3.48 117.51 125.33 3geb h ILE 279 Ca 0.00 -2.41 -0.46 0.00 1.00 0.00 0.00 64.86 62.99 3geb h ILE 279 Cb 0.00 2.60 -0.14 0.00 -0.74 0.00 0.00 36.82 38.54 3geb h ILE 279 CO 0.00 0.88 -0.63 0.27 0.00 0.00 0.00 178.15 178.68 3geb s ILE 280 N -2.57 1.23 -0.19 -0.67 -4.36 -1.01 -4.36 121.20 109.28 3geb s ILE 280 Ca -0.20 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.17 3geb s ILE 280 Cb 0.06 -2.65 0.01 0.00 1.25 0.00 0.00 42.46 41.13 3geb s ILE 280 CO 0.80 -0.11 -0.17 -0.63 0.24 0.00 0.00 174.94 175.07 3geb s ILE 281 N -3.28 2.33 0.00 8.37 -1.09 -1.26 0.42 121.20 126.69 3geb s ILE 281 Ca 0.34 -0.85 0.00 0.00 -2.23 0.00 0.00 60.65 57.91 3geb s ILE 281 Cb 0.07 -2.00 0.00 0.00 -1.58 0.00 0.00 42.46 38.96 3geb s ILE 281 CO 0.14 0.52 0.00 0.33 -1.23 0.00 0.00 174.94 174.69 3geb n PHE 282 N 4.63 -0.55 -0.29 3.97 7.35 -1.26 -4.91 117.46 126.39 3geb n PHE 282 Ca -0.20 0.00 0.07 0.00 -0.76 0.00 0.00 57.45 56.56 3geb n PHE 282 Cb 0.50 0.29 0.23 0.00 0.35 0.00 0.00 39.48 40.85 3geb n PHE 282 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 3geb h HIS 283 N 0.00 0.74 0.00 -5.13 3.86 -1.97 0.11 115.15 112.75 3geb h HIS 283 Ca 0.00 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 3geb h HIS 283 Cb 0.00 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.27 3geb h HIS 283 CO 0.00 0.15 0.00 -1.13 0.86 0.00 0.00 177.93 177.81 3geb n SER 284 N -4.89 0.47 0.10 2.45 3.41 -1.26 -0.87 113.62 113.02 3geb n SER 284 Ca 0.17 0.66 -0.15 0.00 -0.26 0.00 0.00 58.87 59.30 3geb n SER 284 Cb 0.45 -0.74 -0.12 0.00 -0.26 0.00 0.00 64.21 63.54 3geb n SER 284 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3geb h LEU 285 N 0.00 0.41 -0.10 1.04 3.38 -1.10 -2.59 115.31 116.34 3geb h LEU 285 Ca 0.00 -0.42 -0.20 0.00 0.09 0.00 0.00 57.88 57.35 3geb h LEU 285 Cb 0.17 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 3geb h LEU 285 CO 0.00 1.30 -0.95 -0.07 0.09 0.00 0.00 178.44 178.81 3geb h LEU 286 N 0.09 0.01 0.00 1.67 3.38 -0.93 -3.25 115.31 116.28 3geb h LEU 286 Ca -0.12 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 3geb h LEU 286 Cb 1.88 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.62 3geb h LEU 286 CO 0.19 0.96 -1.18 0.35 0.09 0.00 0.00 178.44 178.85 3geb n THR 287 N -3.42 0.65 0.00 0.22 -2.24 -0.76 -4.98 114.28 103.75 3geb n THR 287 Ca -0.00 -0.57 0.00 0.00 -2.27 0.00 0.00 64.05 61.21 3geb n THR 287 Cb 0.90 -0.36 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 3geb n THR 287 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3geb n GLY 288 N 1.23 3.27 0.37 3.38 0.00 -1.07 -4.94 105.19 107.42 3geb n GLY 288 Ca -0.02 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.12 3geb n GLY 288 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3geb h THR 289 N 0.00 0.87 0.35 2.61 1.35 -1.92 -2.14 112.91 114.04 3geb h THR 289 Ca 0.00 -0.20 -0.02 0.00 -0.55 0.00 0.00 66.41 65.65 3geb h THR 289 Cb 0.00 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 66.68 3geb h THR 289 CO 0.00 0.10 -0.17 0.15 -0.25 0.00 0.00 175.52 175.36 3geb h PHE 290 N 0.57 -0.44 -0.67 4.73 3.57 -1.83 -0.32 116.94 122.54 3geb h PHE 290 Ca 0.36 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.94 3geb h PHE 290 Cb 0.63 0.14 -0.07 0.00 2.79 0.00 0.00 35.95 39.45 3geb h PHE 290 CO -0.00 -0.18 0.32 0.00 -2.23 0.00 0.00 178.31 176.21 3geb h ALA 291 N -0.02 0.91 -0.04 2.41 0.00 -1.65 -1.79 119.26 119.08 3geb h ALA 291 Ca -0.05 0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 3geb h ALA 291 Cb 0.45 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3geb h ALA 291 CO 0.08 -0.09 -0.80 0.66 0.00 0.00 0.00 179.25 179.10 3geb h SER 292 N 0.55 0.43 0.41 0.00 4.64 -1.36 -0.75 113.55 117.47 3geb h SER 292 Ca 0.33 -0.31 -0.12 0.00 -0.47 0.00 0.00 61.79 61.22 3geb h SER 292 Cb 0.35 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 3geb h SER 292 CO -0.27 1.07 -0.53 -0.09 -0.87 0.00 0.00 176.83 176.13 3geb h ARG 293 N 0.22 0.13 -0.09 4.77 2.43 -0.62 -3.31 114.38 117.92 3geb h ARG 293 Ca -0.04 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 3geb h ARG 293 Cb 1.40 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 3geb h ARG 293 CO 0.13 0.64 0.00 0.66 -1.51 0.00 0.00 179.97 179.89 3geb n TYR 294 N -3.92 0.15 -3.29 2.20 4.02 -0.71 -5.03 117.16 110.59 3geb n TYR 294 Ca -0.02 -0.57 -0.17 0.00 -0.01 0.00 0.00 57.90 57.13 3geb n TYR 294 Cb 0.56 -0.07 0.06 0.00 -0.02 0.00 0.00 39.34 39.87 3geb n TYR 294 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3geb n GLY 295 N -0.38 -0.20 3.84 2.72 0.00 -0.52 -5.04 105.19 105.61 3geb n GLY 295 Ca 0.05 0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 3geb n GLY 295 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3geb s LYS 296 N -5.76 2.72 -0.11 1.61 3.01 -0.40 -5.05 119.74 115.76 3geb s LYS 296 Ca 0.33 -1.29 -0.29 0.00 -1.01 0.00 0.00 55.97 53.71 3geb s LYS 296 Cb -0.15 -2.46 -0.04 0.00 -1.01 0.00 0.00 37.83 34.17 3geb s LYS 296 CO 0.57 0.14 1.61 0.34 0.51 0.00 0.00 175.35 178.51 3geb s ASP 297 N -3.96 6.60 0.31 2.83 2.15 -1.26 -4.66 116.67 118.68 3geb s ASP 297 Ca 0.40 2.01 0.03 0.00 0.43 0.00 0.00 52.55 55.41 3geb s ASP 297 Cb -0.06 -2.53 0.61 0.00 -0.30 0.00 0.00 42.92 40.64 3geb s ASP 297 CO 0.26 -1.01 1.90 0.71 -0.17 0.00 0.00 175.17 176.85 3geb h THR 298 N 5.74 1.00 -0.01 1.71 1.35 -1.96 -1.19 112.91 119.55 3geb h THR 298 Ca -0.36 -0.32 -0.22 0.00 -0.55 0.00 0.00 66.41 64.95 3geb h THR 298 Cb 1.16 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 3geb h THR 298 CO 0.97 0.17 -0.93 0.74 -0.25 0.00 0.00 175.52 176.22 3geb h THR 299 N 0.93 1.40 -0.52 6.82 2.02 -1.99 -2.62 112.91 118.96 3geb h THR 299 Ca 0.41 -2.42 -0.11 0.00 0.77 0.00 0.00 66.41 65.06 3geb h THR 299 Cb 0.35 2.39 -0.02 0.00 -1.74 0.00 0.00 68.15 69.13 3geb h THR 299 CO -0.17 0.72 -0.11 0.74 0.37 0.00 0.00 175.52 177.07 3geb h THR 300 N 0.24 1.27 0.05 3.16 2.02 -1.87 -2.23 112.91 115.54 3geb h THR 300 Ca -0.08 -1.25 -0.00 0.00 0.77 0.00 0.00 66.41 65.85 3geb h THR 300 Cb 1.56 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 3geb h THR 300 CO 0.16 0.44 -0.02 0.28 0.37 0.00 0.00 175.52 176.75 3geb h SER 301 N 0.86 -0.05 -0.68 4.18 0.02 -1.18 -2.73 113.55 113.96 3geb h SER 301 Ca 0.14 -0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 3geb h SER 301 Cb 0.66 0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.18 3geb h SER 301 CO 0.05 -0.04 0.32 0.58 -1.14 0.00 0.00 176.83 176.60 3geb h VAL 302 N -0.07 1.23 -0.41 2.27 2.07 -1.43 -1.63 116.25 118.29 3geb h VAL 302 Ca -0.01 -0.67 0.04 0.00 0.82 0.00 0.00 66.70 66.88 3geb h VAL 302 Cb 0.05 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 3geb h VAL 302 CO 0.01 0.27 0.19 -0.09 0.02 0.00 0.00 177.57 177.97 3geb h ARG 303 N 0.95 0.37 -0.33 1.57 2.43 -1.32 -0.89 114.38 117.17 3geb h ARG 303 Ca 0.23 -0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.31 3geb h ARG 303 Cb 0.14 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.59 3geb h ARG 303 CO -0.03 0.25 -0.09 0.82 -1.51 0.00 0.00 179.97 179.42 3geb h ILE 304 N 0.39 1.28 -0.18 1.20 2.04 -1.38 -2.16 117.51 118.69 3geb h ILE 304 Ca 0.18 -1.14 0.03 0.00 1.00 0.00 0.00 64.86 64.93 3geb h ILE 304 Cb 0.11 1.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 3geb h ILE 304 CO -0.14 0.37 -0.01 1.23 0.00 0.00 0.00 178.15 179.60 3geb h GLY 305 N 0.41 0.16 0.99 5.37 0.00 -0.98 0.66 103.07 109.69 3geb h GLY 305 Ca 0.08 0.03 -0.03 0.00 0.00 0.00 0.00 47.33 47.41 3geb h GLY 305 CO 0.03 -0.04 0.28 1.41 0.00 0.00 0.00 176.54 178.22 3geb h LEU 306 N 0.05 0.79 -0.75 3.11 3.38 -1.18 0.26 115.31 120.96 3geb h LEU 306 Ca 0.09 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3geb h LEU 306 Cb 0.11 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3geb h LEU 306 CO -0.15 0.71 0.22 0.24 0.09 0.00 0.00 178.44 179.55 3geb h MET 307 N 0.82 1.16 -0.30 1.13 2.86 -1.10 -1.29 114.93 118.21 3geb h MET 307 Ca 0.20 -0.26 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 3geb h MET 307 Cb 0.14 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 3geb h MET 307 CO -0.02 0.99 -0.39 1.98 1.06 0.00 0.00 176.91 180.53 3geb h MET 308 N 1.11 0.71 -0.36 1.72 4.05 -0.58 -2.23 114.93 119.35 3geb h MET 308 Ca 0.24 -0.36 0.03 0.00 -0.28 0.00 0.00 59.70 59.33 3geb h MET 308 Cb 0.33 0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.10 3geb h MET 308 CO -0.00 0.97 0.16 1.49 0.23 0.00 0.00 176.91 179.76 3geb h GLU 309 N 0.58 0.33 -0.56 0.39 4.81 -0.08 -2.19 114.58 117.87 3geb h GLU 309 Ca 0.05 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.29 3geb h GLU 309 Cb 0.92 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.19 3geb h GLU 309 CO 0.08 0.22 0.33 1.49 -0.73 0.00 0.00 179.01 180.40 3geb h GLU 310 N 0.34 0.64 0.00 1.92 4.81 -1.03 -1.73 114.58 119.52 3geb h GLU 310 Ca 0.15 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 3geb h GLU 310 Cb 0.09 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 3geb h GLU 310 CO -0.12 0.42 -0.09 0.52 -0.73 0.00 0.00 179.01 179.01 3geb h MET 311 N 0.66 0.00 0.12 1.92 2.86 -1.05 0.66 114.93 120.09 3geb h MET 311 Ca 0.23 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.86 3geb h MET 311 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.70 3geb h MET 311 CO -0.10 0.09 -0.06 0.82 1.06 0.00 0.00 176.91 178.72 3geb h ILE 312 N 0.00 0.67 -0.17 -1.22 2.04 -0.77 -2.61 117.51 115.45 3geb h ILE 312 Ca -0.00 -1.24 -0.03 0.00 1.00 0.00 0.00 64.86 64.59 3geb h ILE 312 Cb 0.18 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 3geb h ILE 312 CO 0.01 0.20 -0.02 -0.26 0.00 0.00 0.00 178.15 178.08 3geb h PHE 313 N -0.96 0.24 -0.04 1.37 0.05 -1.23 0.18 116.94 116.55 3geb h PHE 313 Ca -0.02 -0.01 -0.15 0.00 3.82 0.00 0.00 57.97 61.61 3geb h PHE 313 Cb 0.45 -0.07 -0.01 0.00 2.00 0.00 0.00 35.95 38.31 3geb h PHE 313 CO 0.09 0.27 -0.65 -0.97 -0.18 0.00 0.00 178.31 176.87 3geb h ASN 314 N 0.24 0.19 -0.02 2.17 -0.73 -0.97 0.11 115.58 116.57 3geb h ASN 314 Ca 0.06 -0.11 -0.15 0.00 1.87 0.00 0.00 56.30 57.96 3geb h ASN 314 Cb 0.20 -0.05 0.01 0.00 0.27 0.00 0.00 38.32 38.75 3geb h ASN 314 CO 0.01 0.78 -0.56 0.25 -0.37 0.00 0.00 177.43 177.53 3geb h LEU 315 N 0.11 0.52 -0.50 0.34 6.46 -0.97 -2.25 115.31 119.03 3geb h LEU 315 Ca -0.01 -0.74 -0.00 0.00 -0.12 0.00 0.00 57.88 57.00 3geb h LEU 315 Cb 1.16 -0.16 -0.02 0.00 -0.73 0.00 0.00 40.66 40.91 3geb h LEU 315 CO 0.10 1.20 0.29 0.00 -0.62 0.00 0.00 178.44 179.40 3geb h ALA 316 N 0.34 0.63 0.39 1.25 0.00 -0.54 0.67 119.26 122.00 3geb h ALA 316 Ca -0.07 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3geb h ALA 316 Cb 1.27 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3geb h ALA 316 CO 0.11 0.12 -0.19 -0.44 0.00 0.00 0.00 179.25 178.86 3geb h ASP 317 N 0.66 -0.44 -0.06 0.00 3.32 -0.86 -0.64 116.42 118.41 3geb h ASP 317 Ca 0.18 -0.07 0.03 0.00 0.02 0.00 0.00 57.03 57.18 3geb h ASP 317 Cb 0.00 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 3geb h ASP 317 CO -0.03 0.00 -0.11 0.74 -1.72 0.00 0.00 179.24 178.12 3geb h THR 318 N -1.07 0.71 0.00 0.35 2.02 -1.44 -3.31 112.91 110.17 3geb h THR 318 Ca -0.05 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.07 3geb h THR 318 Cb 0.49 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 3geb h THR 318 CO 0.09 0.00 -1.72 1.41 0.37 0.00 0.00 175.52 175.67 3geb n HIS 319 N -5.24 0.00 -1.14 3.16 8.25 0.21 -4.67 115.22 115.78 3geb n HIS 319 Ca -0.05 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.40 3geb n HIS 319 Cb 0.16 -0.41 0.26 0.00 1.12 0.00 0.00 29.99 31.12 3geb n HIS 319 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3geb n LEU 320 N -2.12 4.86 -2.66 2.41 4.77 -0.49 -4.92 117.00 118.84 3geb n LEU 320 Ca -0.07 -3.31 -0.14 0.00 -0.03 0.00 0.00 56.01 52.45 3geb n LEU 320 Cb 0.52 -0.65 -0.00 0.00 -2.33 0.00 0.00 43.42 40.95 3geb n LEU 320 CO 0.30 0.89 -0.12 0.49 -1.33 0.00 0.00 177.39 177.62 3geb n PHE 321 N -0.57 -1.54 0.30 -1.77 3.01 -1.10 -4.84 117.46 110.94 3geb n PHE 321 Ca 0.33 0.12 0.20 0.00 1.01 0.00 0.00 57.45 59.11 3geb n PHE 321 Cb 1.14 -2.78 1.05 0.00 -0.01 0.00 0.00 39.48 38.89 3geb n PHE 321 CO 0.00 0.00 0.00 0.35 1.01 0.00 0.00 176.76 178.12 3geb h PHE 322 N -0.26 0.00 0.00 1.38 3.57 -1.32 -1.44 116.94 118.87 3geb h PHE 322 Ca -0.32 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.14 3geb h PHE 322 Cb 1.23 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.96 3geb h PHE 322 CO 0.70 0.00 -0.23 -0.91 -2.23 0.00 0.00 178.31 175.64 3geb h ASN 323 N 0.00 0.00 0.17 0.41 2.35 -1.83 -0.58 115.58 116.10 3geb h ASN 323 Ca 0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 3geb h ASN 323 Cb 0.03 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.39 3geb h ASN 323 CO 0.00 0.23 -1.86 0.47 -1.65 0.00 0.00 177.43 174.62 3geb n ASP 324 N -3.20 0.16 -0.00 5.81 10.43 -0.61 -4.47 116.55 124.66 3geb n ASP 324 Ca 0.02 0.06 0.08 0.00 2.57 0.00 0.00 54.79 57.52 3geb n ASP 324 Cb 0.56 1.64 -0.10 0.00 1.84 0.00 0.00 41.12 45.06 3geb n ASP 324 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3geb n LEU 325 N -2.38 0.50 0.16 0.64 4.77 -0.79 -4.52 117.00 115.39 3geb n LEU 325 Ca -0.06 -0.33 0.05 0.00 -0.03 0.00 0.00 56.01 55.64 3geb n LEU 325 Cb 0.62 0.00 0.28 0.00 -2.33 0.00 0.00 43.42 41.98 3geb n LEU 325 CO 0.45 0.13 0.78 1.21 -1.33 0.00 0.00 177.39 178.63 3geb n GLU 326 N -1.61 0.07 0.00 3.23 2.13 -0.23 -2.77 120.64 121.47 3geb n GLU 326 Ca 0.01 0.54 0.00 0.00 0.66 0.00 0.00 57.16 58.37 3geb n GLU 326 Cb 0.31 -2.13 0.00 0.00 0.27 0.00 0.00 31.44 29.89 3geb n GLU 326 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 3geb n ASP 327 N -1.97 0.00 -4.63 4.31 5.68 -1.26 -4.93 116.55 113.74 3geb n ASP 327 Ca -0.01 0.42 -0.40 0.00 -0.50 0.00 0.00 54.79 54.31 3geb n ASP 327 Cb 0.41 -0.43 0.03 0.00 -1.14 0.00 0.00 41.12 39.99 3geb n ASP 327 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3geb n ASP 329 N -0.09 5.54 -4.77 0.00 9.92 -1.26 -4.94 116.55 120.95 3geb n ASP 329 Ca 0.10 -3.62 -0.40 0.00 -0.53 0.00 0.00 54.79 50.35 3geb n ASP 329 Cb 0.43 -0.86 -0.00 0.00 -0.64 0.00 0.00 41.12 40.04 3geb n ASP 329 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 3geb s GLN 330 N -3.52 4.02 -0.20 -1.24 0.74 -1.26 -4.49 119.66 113.71 3geb s GLN 330 Ca 0.42 2.25 -0.10 0.00 0.05 0.00 0.00 55.36 57.98 3geb s GLN 330 Cb 0.20 -2.83 -0.20 0.00 1.10 0.00 0.00 33.01 31.28 3geb s GLN 330 CO -0.09 -0.48 0.10 -0.89 -0.55 0.00 0.00 175.29 173.38 3geb n ILE 331 N 0.25 1.62 -4.35 -2.34 5.41 -1.26 -4.01 119.36 114.68 3geb n ILE 331 Ca 0.03 -0.42 -0.19 0.00 1.00 0.00 0.00 62.75 63.16 3geb n ILE 331 Cb 0.42 -1.78 -0.14 0.00 -0.71 0.00 0.00 39.64 37.44 3geb n ILE 331 CO 0.00 0.00 0.00 -2.28 0.00 0.00 0.00 176.55 174.27 3geb s HIS 332 N -2.49 1.06 0.46 1.39 5.04 -1.26 -1.47 115.29 118.02 3geb s HIS 332 Ca -0.29 -0.31 0.21 0.00 -1.54 0.00 0.00 55.06 53.13 3geb s HIS 332 Cb 0.08 -0.65 1.20 0.00 0.04 0.00 0.00 32.58 33.26 3geb s HIS 332 CO 0.65 0.01 1.91 -0.39 -2.34 0.00 0.00 174.74 174.57 3geb h VAL 333 N 4.63 0.70 -0.45 0.89 -1.51 -1.82 -2.29 116.25 116.40 3geb h VAL 333 Ca -0.36 -0.09 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 3geb h VAL 333 Cb 1.18 0.42 0.00 0.00 -2.13 0.00 0.00 31.29 30.76 3geb h VAL 333 CO 0.45 0.05 0.00 0.47 -1.23 0.00 0.00 177.57 177.31 3geb n ASP 334 N -4.43 4.65 0.00 4.19 8.00 -1.26 -4.55 116.55 123.14 3geb n ASP 334 Ca 0.16 -2.70 0.03 0.00 0.71 0.00 0.00 54.79 52.99 3geb n ASP 334 Cb 0.67 -0.64 0.17 0.00 -0.02 0.00 0.00 41.12 41.31 3geb n ASP 334 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3geb n ASP 335 N 0.51 0.00 -0.77 -2.24 9.92 -0.86 -3.24 116.55 119.88 3geb n ASP 335 Ca 0.22 -1.75 -0.00 0.00 -0.53 0.00 0.00 54.79 52.73 3geb n ASP 335 Cb 0.98 0.00 -0.00 0.00 -0.64 0.00 0.00 41.12 41.45 3geb n ASP 335 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 3geb n VAL 336 N -0.59 0.00 0.24 2.53 0.24 -1.26 -4.94 118.33 114.55 3geb n VAL 336 Ca 0.04 -0.21 0.08 0.00 -2.04 0.00 0.00 64.34 62.22 3geb n VAL 336 Cb 0.02 0.48 0.59 0.00 -1.47 0.00 0.00 33.84 33.46 3geb n VAL 336 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 3geb h SER 337 N 0.21 0.00 0.46 -1.34 4.64 -1.86 -2.50 113.55 113.17 3geb h SER 337 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 3geb h SER 337 Cb 1.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 3geb h SER 337 CO -0.01 0.17 0.00 0.77 -0.87 0.00 0.00 176.83 176.89 3geb h SER 338 N 0.00 0.00 -1.10 4.97 4.64 -1.92 -2.90 113.55 117.24 3geb h SER 338 Ca -0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 3geb h SER 338 Cb 0.35 0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.21 3geb h SER 338 CO 0.02 0.00 0.71 0.47 -0.87 0.00 0.00 176.83 177.16 3geb n ASP 339 N -2.46 7.13 -0.09 4.97 8.00 -0.94 -4.92 116.55 128.24 3geb n ASP 339 Ca 0.00 -3.51 0.00 0.00 0.71 0.00 0.00 54.79 51.99 3geb n ASP 339 Cb 0.16 -1.07 0.00 0.00 -0.02 0.00 0.00 41.12 40.19 3geb n ASP 339 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 3geb n ASP 340 N -0.18 1.24 0.00 -2.24 2.03 -1.10 -3.43 116.55 112.88 3geb n ASP 340 Ca 0.50 -0.06 0.00 0.00 0.52 0.00 0.00 54.79 55.75 3geb n ASP 340 Cb 0.53 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.93 3geb n ASP 340 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3geb n ASN 341 N -0.10 0.00 0.00 1.67 4.13 -1.26 -4.98 115.26 114.72 3geb n ASN 341 Ca 0.00 -0.68 0.00 0.00 1.68 0.00 0.00 54.58 55.58 3geb n ASN 341 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 3geb n ASN 341 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3geb n GLY 342 N 0.00 0.24 3.65 7.41 0.00 -1.26 -4.96 105.19 110.27 3geb n GLY 342 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 3geb n GLY 342 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3geb s GLN 343 N -1.06 0.76 -0.44 1.61 0.74 -1.26 -4.98 119.66 115.03 3geb s GLN 343 Ca 0.00 1.18 -0.21 0.00 0.05 0.00 0.00 55.36 56.37 3geb s GLN 343 Cb 0.00 -1.72 0.03 0.00 1.10 0.00 0.00 33.01 32.41 3geb s GLN 343 CO 0.00 -2.69 0.67 0.34 -0.55 0.00 0.00 175.29 173.07 3geb s ASP 344 N -2.89 6.34 -0.03 6.67 2.15 -1.26 -4.93 116.67 122.71 3geb s ASP 344 Ca 0.66 -0.31 0.11 0.00 0.43 0.00 0.00 52.55 53.43 3geb s ASP 344 Cb -0.22 -2.33 0.37 0.00 -0.30 0.00 0.00 42.92 40.44 3geb s ASP 344 CO 0.59 -0.82 1.25 0.18 -0.17 0.00 0.00 175.17 176.20 3geb n LEU 345 N 6.37 2.45 0.23 -1.34 4.77 -1.26 -3.93 117.00 124.29 3geb n LEU 345 Ca -0.01 -1.23 0.12 0.00 -0.03 0.00 0.00 56.01 54.86 3geb n LEU 345 Cb 0.48 -0.35 0.41 0.00 -2.33 0.00 0.00 43.42 41.63 3geb n LEU 345 CO 0.55 0.50 0.84 0.77 -1.33 0.00 0.00 177.39 178.72 3geb h SER 346 N 2.22 0.00 -1.21 -1.43 4.64 -2.04 -3.23 113.55 112.51 3geb h SER 346 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 3geb h SER 346 Cb 0.72 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 62.40 3geb h SER 346 CO 0.07 0.11 -0.86 0.35 -0.87 0.00 0.00 176.83 175.63 3geb n THR 347 N -3.19 2.08 -4.51 2.95 -2.24 -1.25 -5.04 114.28 103.08 3geb n THR 347 Ca 0.02 -4.33 -0.26 0.00 -2.27 0.00 0.00 64.05 57.20 3geb n THR 347 Cb 0.45 -0.73 -0.13 0.00 -2.10 0.00 0.00 70.33 67.81 3geb n THR 347 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3geb s TYR 348 N -3.49 1.96 -0.41 4.78 5.04 -1.22 -5.11 117.35 118.90 3geb s TYR 348 Ca 0.43 -0.40 -0.04 0.00 -2.44 0.00 0.00 57.07 54.62 3geb s TYR 348 Cb 0.41 -1.12 0.10 0.00 0.35 0.00 0.00 41.96 41.70 3geb s TYR 348 CO -0.09 0.18 0.21 1.21 -1.34 0.00 0.00 175.55 175.71 3geb s ASN 349 N -1.59 5.33 0.17 4.32 3.84 -1.26 -4.95 114.94 120.79 3geb s ASN 349 Ca 0.09 -1.85 -0.06 0.00 0.21 0.00 0.00 52.86 51.25 3geb s ASN 349 Cb -0.10 -1.86 0.04 0.00 -0.55 0.00 0.00 41.25 38.78 3geb s ASN 349 CO 0.03 -0.53 1.47 -0.26 -2.79 0.00 0.00 177.10 175.02 3geb h PHE 350 N 8.15 0.84 0.00 0.43 -1.00 -1.99 -3.04 116.94 120.32 3geb h PHE 350 Ca -0.16 -0.30 0.00 0.00 2.81 0.00 0.00 57.97 60.32 3geb h PHE 350 Cb 1.06 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 40.46 3geb h PHE 350 CO 0.58 1.07 0.00 -1.13 -1.61 0.00 0.00 178.31 177.22 3geb n SER 351 N -3.97 0.06 -2.20 2.17 3.41 -1.26 -3.24 113.62 108.58 3geb n SER 351 Ca -0.04 0.52 -0.16 0.00 -0.26 0.00 0.00 58.87 58.94 3geb n SER 351 Cb 0.61 -0.53 0.03 0.00 -0.26 0.00 0.00 64.21 64.07 3geb n SER 351 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3geb n ALA 352 N -1.53 4.24 -1.18 7.33 0.00 -1.15 -4.76 120.51 123.46 3geb n ALA 352 Ca 0.02 -3.46 0.07 0.00 0.00 0.00 0.00 53.44 50.08 3geb n ALA 352 Cb 0.09 -0.49 0.10 0.00 0.00 0.00 0.00 19.45 19.16 3geb n ALA 352 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3geb n ASP 353 N -0.67 1.86 -1.89 0.00 5.68 -1.20 -5.01 116.55 115.32 3geb n ASP 353 Ca 0.32 -2.80 -0.19 0.00 -0.50 0.00 0.00 54.79 51.62 3geb n ASP 353 Cb 0.91 -0.36 -0.05 0.00 -1.14 0.00 0.00 41.12 40.48 3geb n ASP 353 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3geb n GLY 354 N -1.10 0.88 3.79 6.12 0.00 -1.26 -4.97 105.19 108.64 3geb n GLY 354 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 3geb n GLY 354 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3geb s PHE 355 N -2.73 3.17 0.00 1.61 2.19 -1.26 -5.15 117.98 115.81 3geb s PHE 355 Ca 0.00 1.62 0.00 0.00 0.33 0.00 0.00 56.93 58.88 3geb s PHE 355 Cb 0.00 -3.08 0.00 0.00 -1.31 0.00 0.00 43.02 38.63 3geb s PHE 355 CO 0.00 -0.65 0.00 -2.39 1.83 0.00 0.00 175.22 174.01 3geb n HIS 356 N -0.47 0.00 -0.23 10.12 1.44 -1.26 -5.04 115.22 119.78 3geb n HIS 356 Ca 0.07 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.86 3geb n HIS 356 Cb 0.51 0.00 0.16 0.00 0.12 0.00 0.00 29.99 30.78 3geb n HIS 356 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 3geb n GLY 372 N -0.36 -0.97 0.08 -1.39 0.00 -1.26 -4.91 105.19 96.38 3geb n GLY 372 Ca 0.00 0.67 0.08 0.00 0.00 0.00 0.00 46.02 46.77 3geb n GLY 372 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3geb n GLY 373 N -1.36 -1.28 0.11 -0.02 0.00 -1.26 -3.54 105.19 97.84 3geb n GLY 373 Ca 0.14 -0.29 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 3geb n GLY 373 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3geb h VAL 374 N 0.00 1.54 -0.11 1.61 2.07 -2.02 -1.14 116.25 118.20 3geb h VAL 374 Ca -0.05 -2.64 -0.12 0.00 0.82 0.00 0.00 66.70 64.71 3geb h VAL 374 Cb 1.16 2.43 -0.01 0.00 -1.52 0.00 0.00 31.29 33.35 3geb h VAL 374 CO 0.01 0.76 -0.46 0.44 0.02 0.00 0.00 177.57 178.34 3geb h ASP 375 N 0.03 0.29 0.13 0.57 3.32 -1.99 0.13 116.42 118.89 3geb h ASP 375 Ca -0.02 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 3geb h ASP 375 Cb 1.40 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.87 3geb h ASP 375 CO 0.11 0.71 -0.06 -0.25 -1.72 0.00 0.00 179.24 178.03 3geb h TRP 376 N 0.22 -0.16 -0.77 4.55 7.01 -1.54 0.63 115.95 125.88 3geb h TRP 376 Ca 0.01 -0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.10 3geb h TRP 376 Cb 0.90 0.05 -0.05 0.00 -2.10 0.00 0.00 29.16 27.96 3geb h TRP 376 CO 0.02 0.25 0.51 0.52 -2.79 0.00 0.00 178.44 176.95 3geb h MET 377 N -0.63 0.69 -0.11 2.65 2.86 -1.05 0.39 114.93 119.74 3geb h MET 377 Ca -0.02 -0.04 -0.20 0.00 -2.06 0.00 0.00 59.70 57.38 3geb h MET 377 Cb 0.48 -0.16 0.01 0.00 0.06 0.00 0.00 31.60 32.00 3geb h MET 377 CO 0.03 0.46 -0.71 0.00 1.06 0.00 0.00 176.91 177.75 3geb h ARG 378 N 0.72 0.67 -0.13 1.72 -0.00 -0.62 -0.95 114.38 115.78 3geb h ARG 378 Ca 0.35 -0.58 0.00 0.00 -0.50 0.00 0.00 59.98 59.26 3geb h ARG 378 Cb 0.43 0.13 -0.01 0.00 0.00 0.00 0.00 29.97 30.52 3geb h ARG 378 CO -0.13 1.19 0.09 0.87 0.00 0.00 0.00 179.97 181.99 3geb h LYS 379 N 0.34 0.16 0.04 0.04 1.57 0.05 -0.24 116.57 118.53 3geb h LYS 379 Ca -0.06 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3geb h LYS 379 Cb 1.35 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.63 3geb h LYS 379 CO 0.15 0.10 -0.02 1.25 -0.57 0.00 0.00 179.45 180.36 3geb h LEU 380 N 0.16 -0.05 -1.10 2.94 5.85 -0.83 -2.17 115.31 120.11 3geb h LEU 380 Ca 0.05 -0.62 0.15 0.00 0.84 0.00 0.00 57.88 58.30 3geb h LEU 380 Cb 0.00 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 40.96 3geb h LEU 380 CO -0.01 0.68 0.61 0.00 -0.34 0.00 0.00 178.44 179.38 3geb h ALA 381 N -0.11 1.66 -0.22 1.25 0.00 -0.87 0.24 119.26 121.21 3geb h ALA 381 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3geb h ALA 381 Cb 0.67 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3geb h ALA 381 CO 0.01 0.06 0.14 0.74 0.00 0.00 0.00 179.25 180.20 3geb h PHE 382 N 0.84 0.28 -0.31 0.00 0.05 -1.08 0.95 116.94 117.67 3geb h PHE 382 Ca 0.50 0.00 0.07 0.00 3.82 0.00 0.00 57.97 62.37 3geb h PHE 382 Cb 0.67 -0.09 -0.07 0.00 2.00 0.00 0.00 35.95 38.45 3geb h PHE 382 CO -0.00 0.19 -0.18 0.00 -0.18 0.00 0.00 178.31 178.14 3geb h ARG 383 N 0.29 -0.14 -0.10 1.51 2.47 0.11 -0.41 114.38 118.11 3geb h ARG 383 Ca 0.08 0.01 -0.16 0.00 -1.26 0.00 0.00 59.98 58.65 3geb h ARG 383 Cb -0.02 0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.32 3geb h ARG 383 CO -0.02 -0.09 -0.62 1.88 0.56 0.00 0.00 179.97 181.68 3geb h TYR 384 N -0.14 0.46 -0.24 3.04 -1.99 -1.02 -2.07 116.97 115.00 3geb h TYR 384 Ca 0.16 -0.18 -0.09 0.00 2.00 0.00 0.00 58.73 60.62 3geb h TYR 384 Cb 0.39 -0.08 -0.01 0.00 2.00 0.00 0.00 36.73 39.02 3geb h TYR 384 CO -0.38 0.88 -0.23 -0.09 -0.00 0.00 0.00 178.16 178.35 3geb h ARG 385 N 0.26 0.45 -0.09 4.88 2.43 -0.43 -0.43 114.38 121.46 3geb h ARG 385 Ca -0.01 -0.16 -0.03 0.00 -0.81 0.00 0.00 59.98 58.97 3geb h ARG 385 Cb 1.15 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.67 3geb h ARG 385 CO 0.10 0.65 -0.06 -0.09 -1.51 0.00 0.00 179.97 179.07 3geb h ARG 386 N 0.40 0.19 -0.48 0.20 9.65 -0.97 -1.67 114.38 121.70 3geb h ARG 386 Ca 0.06 -0.09 0.07 0.00 -1.10 0.00 0.00 59.98 58.92 3geb h ARG 386 Cb 0.62 -0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 29.15 3geb h ARG 386 CO 0.04 0.58 0.17 0.28 2.80 0.00 0.00 179.97 183.84 3geb h VAL 387 N -0.20 0.83 -0.44 0.20 2.07 -1.18 -0.84 116.25 116.69 3geb h VAL 387 Ca 0.02 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.45 3geb h VAL 387 Cb 0.53 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3geb h VAL 387 CO 0.02 0.06 0.24 0.50 0.02 0.00 0.00 177.57 178.41 3geb h LYS 388 N 0.34 0.46 -0.72 1.57 3.64 -1.02 -0.25 116.57 120.59 3geb h LYS 388 Ca 0.23 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 3geb h LYS 388 Cb 0.24 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.92 3geb h LYS 388 CO -0.24 0.31 0.41 0.93 -2.27 0.00 0.00 179.45 178.58 3geb h GLU 389 N 0.48 0.99 -0.05 1.90 5.08 -0.50 -2.55 114.58 119.93 3geb h GLU 389 Ca 0.18 -0.10 -0.21 0.00 -1.00 0.00 0.00 59.36 58.24 3geb h GLU 389 Cb 0.06 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 3geb h GLU 389 CO -0.11 0.72 -0.83 0.52 -1.00 0.00 0.00 179.01 178.31 3geb h MET 390 N 1.00 0.45 -0.88 2.33 2.86 -0.64 -2.59 114.93 117.45 3geb h MET 390 Ca 0.26 -0.41 0.04 0.00 -2.06 0.00 0.00 59.70 57.53 3geb h MET 390 Cb 0.00 0.10 -0.05 0.00 0.06 0.00 0.00 31.60 31.71 3geb h MET 390 CO -0.04 1.06 0.57 -0.92 1.06 0.00 0.00 176.91 178.63 3geb h TYR 391 N 0.28 1.06 0.04 -0.22 3.20 -0.67 -0.19 116.97 120.47 3geb h TYR 391 Ca -0.05 0.03 -0.24 0.00 3.14 0.00 0.00 58.73 61.61 3geb h TYR 391 Cb 1.43 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 39.35 3geb h TYR 391 CO 0.06 0.60 -1.02 -0.91 -1.64 0.00 0.00 178.16 175.24 3geb h ASN 392 N 1.09 0.50 0.78 -2.11 2.35 -1.46 0.52 115.58 117.25 3geb h ASN 392 Ca 0.36 -0.44 -0.18 0.00 -0.55 0.00 0.00 56.30 55.49 3geb h ASN 392 Cb 0.04 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 3geb h ASN 392 CO -0.13 1.26 -0.84 0.71 -1.65 0.00 0.00 177.43 176.78 3geb h THR 393 N 0.19 1.57 -0.23 2.81 1.35 -1.27 -3.33 112.91 114.00 3geb h THR 393 Ca -0.10 -2.80 0.00 0.00 -0.55 0.00 0.00 66.41 62.97 3geb h THR 393 Cb 1.68 2.52 0.00 0.00 -1.73 0.00 0.00 68.15 70.62 3geb h THR 393 CO 0.17 0.80 0.00 -1.22 -0.25 0.00 0.00 175.52 175.03 3geb n TYR 394 N -3.58 0.48 -0.00 4.73 4.02 -0.10 -4.54 117.16 118.18 3geb n TYR 394 Ca -0.01 -0.66 -0.05 0.00 -0.01 0.00 0.00 57.90 57.17 3geb n TYR 394 Cb 0.80 -0.13 0.16 0.00 -0.02 0.00 0.00 39.34 40.15 3geb n TYR 394 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 3geb h LYS 395 N 1.42 0.53 -0.35 -0.72 2.10 -1.00 -2.84 116.57 115.71 3geb h LYS 395 Ca 0.00 -0.22 -0.06 0.00 -2.00 0.00 0.00 60.65 58.37 3geb h LYS 395 Cb 0.93 -0.02 -0.04 0.00 -0.90 0.00 0.00 32.23 32.20 3geb h LYS 395 CO 0.07 0.77 0.02 0.09 -2.00 0.00 0.00 179.45 178.39 3geb n ASN 396 N -4.10 3.81 -2.77 7.07 3.02 -1.26 -4.26 115.26 116.77 3geb n ASN 396 Ca -0.01 -3.19 -0.09 0.00 -0.03 0.00 0.00 54.58 51.26 3geb n ASN 396 Cb 0.44 -0.59 0.08 0.00 -0.61 0.00 0.00 39.78 39.09 3geb n ASN 396 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 3geb n ASN 397 N -0.55 -1.58 -0.29 6.41 5.15 -1.09 -5.01 115.26 118.30 3geb n ASN 397 Ca 0.26 -3.19 0.03 0.00 -0.60 0.00 0.00 54.58 51.09 3geb n ASN 397 Cb 1.00 1.19 0.23 0.00 -0.53 0.00 0.00 39.78 41.67 3geb n ASN 397 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 3geb h VAL 398 N 2.46 1.10 -0.67 3.44 2.07 -1.77 -2.27 116.25 120.62 3geb h VAL 398 Ca -0.13 -0.36 -0.01 0.00 0.82 0.00 0.00 66.70 67.02 3geb h VAL 398 Cb 1.15 -0.04 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 3geb h VAL 398 CO 0.14 0.19 0.38 1.23 0.02 0.00 0.00 177.57 179.54 3geb h GLY 399 N 1.04 0.97 1.16 2.17 0.00 -1.90 -1.90 103.07 104.62 3geb h GLY 399 Ca 0.37 -0.41 0.02 0.00 0.00 0.00 0.00 47.33 47.31 3geb h GLY 399 CO -0.13 0.39 0.53 -1.33 0.00 0.00 0.00 176.54 176.01 3geb h GLY 400 N 0.96 1.13 0.24 4.60 0.00 -1.67 -1.22 103.07 107.12 3geb h GLY 400 Ca 0.24 -0.41 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 3geb h GLY 400 CO -0.04 0.38 -0.07 -2.00 0.00 0.00 0.00 176.54 174.80 3geb h LEU 401 N 1.04 -0.17 -0.55 3.11 5.85 -1.40 -3.36 115.31 119.83 3geb h LEU 401 Ca 0.31 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3geb h LEU 401 Cb -0.05 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3geb h LEU 401 CO -0.08 0.41 0.00 0.16 -0.34 0.00 0.00 178.44 178.60 3geb h ILE 402 N -0.96 0.00 0.00 4.05 3.07 -1.38 -3.50 117.51 118.80 3geb h ILE 402 Ca -0.02 -0.46 0.00 0.00 1.55 0.00 0.00 64.86 65.93 3geb h ILE 402 Cb 0.46 1.36 0.00 0.00 -0.27 0.00 0.00 36.82 38.37 3geb h ILE 402 CO 0.03 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.74 3geb n GLY 403 N 0.54 1.27 0.11 0.16 0.00 -0.46 -4.66 105.19 102.14 3geb n GLY 403 Ca 0.03 -2.24 -0.20 0.00 0.00 0.00 0.00 46.02 43.61 3geb n GLY 403 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3geb h THR 404 N 0.00 1.24 -0.40 2.61 2.02 -1.93 -3.05 112.91 113.40 3geb h THR 404 Ca 0.00 -2.35 -0.11 0.00 0.77 0.00 0.00 66.41 64.72 3geb h THR 404 Cb 0.00 2.81 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 3geb h THR 404 CO 0.00 0.59 -0.17 1.55 0.37 0.00 0.00 175.52 177.85 3geb h PRO 405 N -0.65 0.82 0.00 6.66 0.13 -1.96 -3.11 132.00 133.89 3geb h PRO 405 Ca -0.23 -0.35 -0.08 0.00 -0.87 0.00 0.00 66.00 64.48 3geb h PRO 405 Cb 1.46 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.55 3geb h PRO 405 CO -0.01 0.98 -0.36 0.87 -0.23 0.00 0.00 178.00 179.25 3geb h LYS 406 N 0.63 0.00 -0.38 0.86 1.57 -1.83 -2.98 116.57 114.45 3geb h LYS 406 Ca 0.09 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 3geb h LYS 406 Cb 0.73 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 3geb h LYS 406 CO 0.05 0.36 0.09 -0.09 -0.57 0.00 0.00 179.45 179.30 3geb h ARG 407 N 0.00 0.60 -0.58 3.15 2.43 -1.46 -0.27 114.38 118.25 3geb h ARG 407 Ca -0.00 -0.15 -0.10 0.00 -0.81 0.00 0.00 59.98 58.92 3geb h ARG 407 Cb 0.66 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.11 3geb h ARG 407 CO 0.05 0.64 -0.03 0.93 -1.51 0.00 0.00 179.97 180.04 3geb h GLU 408 N 0.46 1.04 -0.77 0.20 5.08 -1.52 -0.28 114.58 118.79 3geb h GLU 408 Ca 0.12 -0.34 -0.04 0.00 -1.00 0.00 0.00 59.36 58.10 3geb h GLU 408 Cb 0.31 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3geb h GLU 408 CO 0.00 1.03 0.34 1.15 -1.00 0.00 0.00 179.01 180.53 3geb h THR 409 N 0.94 1.25 0.01 1.13 2.02 -1.39 -0.41 112.91 116.46 3geb h THR 409 Ca 0.16 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.59 3geb h THR 409 Cb 0.59 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.31 3geb h THR 409 CO 0.04 0.31 -0.00 -0.25 0.37 0.00 0.00 175.52 175.98 3geb h TRP 410 N 1.10 -0.01 -0.12 3.16 7.01 -0.61 -1.44 115.95 125.03 3geb h TRP 410 Ca 0.26 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.26 3geb h TRP 410 Cb 0.17 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.22 3geb h TRP 410 CO 0.01 -0.00 0.06 -0.07 -2.79 0.00 0.00 178.44 175.65 3geb h LEU 411 N -0.02 0.16 -2.00 0.65 3.38 -0.83 0.56 115.31 117.21 3geb h LEU 411 Ca -0.00 -0.11 0.12 0.00 0.09 0.00 0.00 57.88 57.98 3geb h LEU 411 Cb 0.02 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3geb h LEU 411 CO 0.00 0.22 0.30 -0.61 0.09 0.00 0.00 178.44 178.45 3geb h GLN 412 N 0.08 0.00 0.20 1.13 5.75 -0.96 -0.44 115.11 120.88 3geb h GLN 412 Ca 0.04 -0.00 -0.34 0.00 -0.15 0.00 0.00 58.65 58.20 3geb h GLN 412 Cb 0.10 -0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.67 3geb h GLN 412 CO -0.01 0.00 -1.65 1.25 -2.65 0.00 0.00 178.83 175.78 3geb h LEU 413 N 0.00 0.66 -1.15 -2.39 5.85 -0.72 -2.99 115.31 114.57 3geb h LEU 413 Ca 0.20 -0.93 -0.04 0.00 0.84 0.00 0.00 57.88 57.95 3geb h LEU 413 Cb 0.79 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 3geb h LEU 413 CO -0.00 1.76 0.13 0.03 -0.34 0.00 0.00 178.44 180.01 3geb h ARG 414 N 0.08 0.73 -0.00 1.25 2.47 -0.33 -1.92 114.38 116.65 3geb h ARG 414 Ca -0.32 -0.13 -0.00 0.00 -1.26 0.00 0.00 59.98 58.27 3geb h ARG 414 Cb 2.09 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 30.29 3geb h ARG 414 CO 0.20 0.65 0.00 0.00 0.56 0.00 0.00 179.97 181.38 3geb h ALA 415 N 1.44 0.01 -0.96 0.04 0.00 -1.19 -1.94 119.26 116.65 3geb h ALA 415 Ca 0.16 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3geb h ALA 415 Cb 0.24 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 3geb h ALA 415 CO -0.01 -0.35 0.63 0.93 0.00 0.00 0.00 179.25 180.46 3geb h GLU 416 N -0.28 1.16 -0.53 0.00 5.08 -1.36 -2.56 114.58 116.09 3geb h GLU 416 Ca 0.00 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 3geb h GLU 416 Cb 0.29 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 3geb h GLU 416 CO 0.00 0.77 0.17 1.25 -1.00 0.00 0.00 179.01 180.20 3geb h LEU 417 N 1.20 0.76 -1.46 1.33 5.85 -1.23 -0.70 115.31 121.05 3geb h LEU 417 Ca 0.39 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.88 3geb h LEU 417 Cb 0.04 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 3geb h LEU 417 CO -0.13 0.75 0.07 -0.33 -0.34 0.00 0.00 178.44 178.47 3geb h GLU 418 N 0.72 0.43 -0.08 1.25 4.39 -0.97 0.12 114.58 120.44 3geb h GLU 418 Ca 0.17 -0.06 -0.03 0.00 0.34 0.00 0.00 59.36 59.78 3geb h GLU 418 Cb 0.26 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 28.83 3geb h GLU 418 CO -0.01 0.40 -0.08 0.00 -1.16 0.00 0.00 179.01 178.16 3geb h ALA 419 N 1.66 0.12 -0.81 3.43 0.00 -1.10 0.47 119.26 123.03 3geb h ALA 419 Ca 0.10 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 3geb h ALA 419 Cb 0.17 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 3geb h ALA 419 CO -0.00 -0.06 0.33 1.25 0.00 0.00 0.00 179.25 180.77 3geb h LEU 420 N -0.23 1.11 -1.38 0.00 5.85 -0.62 -2.89 115.31 117.15 3geb h LEU 420 Ca 0.01 -0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.56 3geb h LEU 420 Cb 0.60 -0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.35 3geb h LEU 420 CO 0.02 0.97 0.00 0.35 -0.34 0.00 0.00 178.44 179.44 3geb n THR 421 N -4.28 0.34 -3.60 1.05 -2.24 0.39 -4.96 114.28 100.98 3geb n THR 421 Ca 0.07 -0.45 -0.20 0.00 -2.27 0.00 0.00 64.05 61.20 3geb n THR 421 Cb 0.18 0.43 0.05 0.00 -2.10 0.00 0.00 70.33 68.90 3geb n THR 421 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3geb n ASP 422 N 0.58 -1.49 -1.87 3.42 8.00 -0.78 -3.11 116.55 121.30 3geb n ASP 422 Ca 0.16 -0.75 -0.16 0.00 0.71 0.00 0.00 54.79 54.75 3geb n ASP 422 Cb 0.37 -4.45 -0.00 0.00 -0.02 0.00 0.00 41.12 37.03 3geb n ASP 422 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 3geb n LEU 423 N -4.22 -1.85 0.27 0.64 4.77 0.09 -4.95 117.00 111.76 3geb n LEU 423 Ca -0.30 -0.06 -0.17 0.00 -0.03 0.00 0.00 56.01 55.46 3geb n LEU 423 Cb 0.68 -2.31 -0.08 0.00 -2.33 0.00 0.00 43.42 39.37 3geb n LEU 423 CO 0.66 -0.09 0.61 -0.25 -1.33 0.00 0.00 177.39 176.99 3geb h TRP 424 N -0.21 -1.02 -0.88 -1.77 2.91 -1.80 -0.32 115.95 112.86 3geb h TRP 424 Ca -0.37 0.00 0.02 0.00 1.13 0.00 0.00 58.89 59.67 3geb h TRP 424 Cb 1.27 0.38 -0.05 0.00 -0.51 0.00 0.00 29.16 30.26 3geb h TRP 424 CO 0.41 -0.54 0.58 1.25 -1.03 0.00 0.00 178.44 179.11 3geb h LEU 425 N -0.83 0.98 -0.68 0.65 5.85 -1.91 -0.28 115.31 119.10 3geb h LEU 425 Ca -0.05 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.68 3geb h LEU 425 Cb 0.72 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.47 3geb h LEU 425 CO -0.01 0.69 0.42 0.74 -0.34 0.00 0.00 178.44 179.95 3geb h THR 426 N 1.15 1.10 -0.23 1.05 2.02 -1.84 1.00 112.91 117.15 3geb h THR 426 Ca 0.34 -0.29 -0.04 0.00 0.77 0.00 0.00 66.41 67.19 3geb h THR 426 Cb -0.06 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.53 3geb h THR 426 CO -0.09 0.15 -0.02 0.45 0.37 0.00 0.00 175.52 176.39 3geb h HIS 427 N 0.83 0.46 -0.52 3.16 3.86 0.39 -2.17 115.15 121.16 3geb h HIS 427 Ca 0.27 -0.09 -0.08 0.00 -1.16 0.00 0.00 60.37 59.31 3geb h HIS 427 Cb 0.01 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.34 3geb h HIS 427 CO -0.04 0.61 -0.00 0.66 0.86 0.00 0.00 177.93 180.02 3geb h SER 428 N 0.18 0.86 -0.31 2.45 4.64 -0.87 -2.27 113.55 118.22 3geb h SER 428 Ca 0.06 -0.22 -0.03 0.00 -0.47 0.00 0.00 61.79 61.13 3geb h SER 428 Cb 0.44 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.28 3geb h SER 428 CO 0.02 0.92 0.12 -0.07 -0.87 0.00 0.00 176.83 176.95 3geb h LEU 429 N 0.82 0.49 -0.11 5.97 3.38 -0.73 0.25 115.31 125.38 3geb h LEU 429 Ca 0.15 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3geb h LEU 429 Cb 0.49 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 3geb h LEU 429 CO 0.02 0.47 0.02 0.11 0.09 0.00 0.00 178.44 179.16 3geb h LYS 430 N 0.53 0.18 -0.66 1.13 1.79 -0.93 0.12 116.57 118.74 3geb h LYS 430 Ca 0.13 -0.05 0.02 0.00 -2.18 0.00 0.00 60.65 58.58 3geb h LYS 430 Cb 0.15 -0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 30.74 3geb h LYS 430 CO -0.01 0.37 0.42 0.00 -1.08 0.00 0.00 179.45 179.14 3geb h ALA 431 N 0.81 0.85 0.05 3.86 0.00 -0.84 -1.87 119.26 122.12 3geb h ALA 431 Ca 0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 3geb h ALA 431 Cb 0.27 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3geb h ALA 431 CO 0.00 0.19 -0.02 -0.07 0.00 0.00 0.00 179.25 179.35 3geb h LEU 432 N 0.82 -0.05 -1.88 0.00 3.38 -0.30 -2.87 115.31 114.41 3geb h LEU 432 Ca 0.26 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3geb h LEU 432 Cb -0.01 0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3geb h LEU 432 CO -0.09 0.20 0.00 0.78 0.09 0.00 0.00 178.44 179.41 3geb h ASN 433 N -0.30 0.00 -0.01 -0.43 2.35 -0.64 -1.56 115.58 114.98 3geb h ASN 433 Ca -0.01 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 55.65 3geb h ASN 433 Cb 0.28 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.65 3geb h ASN 433 CO 0.01 0.00 -0.36 0.25 -1.65 0.00 0.00 177.43 175.68 3geb h LEU 434 N 0.00 0.34 -1.06 1.61 5.85 -1.14 -2.79 115.31 118.12 3geb h LEU 434 Ca 0.00 -0.75 -0.09 0.00 0.84 0.00 0.00 57.88 57.88 3geb h LEU 434 Cb 0.23 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.15 3geb h LEU 434 CO 0.00 1.04 -0.32 0.40 -0.34 0.00 0.00 178.44 179.23 3geb h ILE 435 N -0.33 1.27 0.34 4.05 2.04 -1.25 -2.74 117.51 120.88 3geb h ILE 435 Ca -0.04 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.50 3geb h ILE 435 Cb 1.09 1.52 -0.00 0.00 -0.74 0.00 0.00 36.82 38.69 3geb h ILE 435 CO 0.07 0.39 -0.21 -1.13 0.00 0.00 0.00 178.15 177.28 3geb h ASN 436 N 0.24 -0.52 -0.13 1.72 -1.24 -1.31 -2.92 115.58 111.40 3geb h ASN 436 Ca 0.03 0.03 0.04 0.00 0.71 0.00 0.00 56.30 57.11 3geb h ASN 436 Cb 0.68 0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.88 3geb h ASN 436 CO 0.05 -0.32 0.34 0.77 -1.29 0.00 0.00 177.43 176.98 3geb h SER 437 N -0.51 0.00 -2.83 1.15 4.64 -1.45 -3.42 113.55 111.13 3geb h SER 437 Ca -0.05 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.74 3geb h SER 437 Cb 0.41 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.51 3geb h SER 437 CO 0.04 0.00 0.88 -0.13 -0.87 0.00 0.00 176.83 176.76 3geb s ARG 438 N -4.30 4.25 0.20 4.77 0.52 -1.04 -4.93 118.95 118.42 3geb s ARG 438 Ca -0.04 2.17 -0.22 0.00 -0.52 0.00 0.00 55.73 57.13 3geb s ARG 438 Cb 0.11 -3.48 0.13 0.00 0.52 0.00 0.00 34.95 32.23 3geb s ARG 438 CO 0.38 -0.62 1.57 -1.00 0.02 0.00 0.00 175.30 175.65 3geb h PRO 439 N 7.73 -0.11 -1.34 3.54 0.13 -1.86 -3.11 132.00 136.98 3geb h PRO 439 Ca -0.41 0.01 -0.61 0.00 -0.87 0.00 0.00 66.00 64.12 3geb h PRO 439 Cb 1.20 0.03 -0.39 0.00 0.13 0.00 0.00 31.00 31.96 3geb h PRO 439 CO 0.91 -0.07 -0.37 0.09 -0.23 0.00 0.00 178.00 178.32 3geb n ASN 440 N -5.43 5.41 -4.02 1.44 3.02 -1.26 -4.98 115.26 109.44 3geb n ASN 440 Ca 0.05 -3.75 -0.15 0.00 -0.03 0.00 0.00 54.58 50.70 3geb n ASN 440 Cb 0.36 -0.55 -0.13 0.00 -0.61 0.00 0.00 39.78 38.85 3geb n ASN 440 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3geb s VAL 442 N -0.70 0.30 -0.15 0.00 0.11 -0.86 -4.63 120.40 114.48 3geb s VAL 442 Ca -0.03 -1.24 -0.05 0.00 -2.93 0.00 0.00 61.98 57.72 3geb s VAL 442 Cb -0.06 -0.75 -0.04 0.00 -1.53 0.00 0.00 36.38 34.00 3geb s VAL 442 CO 0.00 -0.61 0.03 0.20 -3.33 0.00 0.00 175.10 171.38 3geb s ASN 443 N -1.96 5.37 0.06 3.54 0.01 -1.26 -1.16 114.94 119.54 3geb s ASN 443 Ca -0.07 0.06 0.07 0.00 -0.71 0.00 0.00 52.86 52.21 3geb s ASN 443 Cb -0.05 -1.81 -0.03 0.00 0.41 0.00 0.00 41.25 39.77 3geb s ASN 443 CO -0.03 0.23 -0.19 -0.69 -1.51 0.00 0.00 177.10 174.92 3geb s VAL 444 N 0.01 1.50 -0.08 1.60 1.01 0.07 -4.82 120.40 119.68 3geb s VAL 444 Ca 0.04 -1.23 0.04 0.00 0.00 0.00 0.00 61.98 60.83 3geb s VAL 444 Cb -0.13 -1.34 -0.01 0.00 0.00 0.00 0.00 36.38 34.91 3geb s VAL 444 CO 0.01 0.07 -0.20 -0.22 0.00 0.00 0.00 175.10 174.76 3geb s LEU 445 N -1.37 2.36 -0.17 3.92 2.96 0.13 -0.45 118.68 126.07 3geb s LEU 445 Ca 0.05 -0.41 -0.00 0.00 -0.22 0.00 0.00 54.13 53.54 3geb s LEU 445 Cb -0.09 -1.47 0.04 0.00 0.50 0.00 0.00 46.19 45.17 3geb s LEU 445 CO 0.02 0.23 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.54 3geb s VAL 446 N -0.06 1.12 0.19 1.68 1.01 -0.13 -0.73 120.40 123.48 3geb s VAL 446 Ca -0.05 -0.64 0.09 0.00 0.00 0.00 0.00 61.98 61.38 3geb s VAL 446 Cb -0.14 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.90 3geb s VAL 446 CO 0.04 0.13 -0.18 0.28 0.00 0.00 0.00 175.10 175.38 3geb s THR 447 N 1.63 1.90 -1.26 3.92 -1.32 -0.70 -4.14 115.64 115.66 3geb s THR 447 Ca 0.01 -2.06 0.26 0.00 -1.21 0.00 0.00 61.69 58.69 3geb s THR 447 Cb -0.15 -1.96 0.17 0.00 -1.51 0.00 0.00 72.50 69.04 3geb s THR 447 CO -0.08 -0.39 1.60 0.41 -2.21 0.00 0.00 174.62 173.95 3geb n THR 448 N 0.01 0.00 -1.73 5.08 -1.04 -1.26 0.78 114.28 116.12 3geb n THR 448 Ca -0.11 -0.04 -0.31 0.00 -2.04 0.00 0.00 64.05 61.55 3geb n THR 448 Cb 0.58 0.11 0.03 0.00 -1.82 0.00 0.00 70.33 69.24 3geb n THR 448 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3geb s THR 449 N -2.81 4.21 0.56 12.58 2.01 -1.26 -4.34 115.64 126.60 3geb s THR 449 Ca 0.17 0.76 -0.18 0.00 0.31 0.00 0.00 61.69 62.75 3geb s THR 449 Cb 0.18 -3.54 -0.05 0.00 0.01 0.00 0.00 72.50 69.11 3geb s THR 449 CO 0.60 -0.90 1.08 -1.10 -0.69 0.00 0.00 174.62 173.62 3geb s GLN 450 N -4.95 3.35 0.24 4.92 -0.21 -1.26 -4.39 119.66 117.35 3geb s GLN 450 Ca 0.58 1.40 -0.10 0.00 0.02 0.00 0.00 55.36 57.26 3geb s GLN 450 Cb -0.13 -2.02 0.36 0.00 1.00 0.00 0.00 33.01 32.21 3geb s GLN 450 CO 0.52 -0.81 1.62 1.25 -2.12 0.00 0.00 175.29 175.75 3geb h LEU 451 N 0.87 -0.56 -0.45 2.90 5.85 -1.91 -1.55 115.31 120.45 3geb h LEU 451 Ca -0.48 0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.39 3geb h LEU 451 Cb 1.24 0.42 -0.02 0.00 0.37 0.00 0.00 40.66 42.67 3geb h LEU 451 CO 0.57 -0.22 0.04 0.40 -0.34 0.00 0.00 178.44 178.89 3geb h ILE 452 N 0.03 1.25 -0.20 4.05 1.08 -1.92 -1.33 117.51 120.48 3geb h ILE 452 Ca 0.38 -0.96 -0.12 0.00 -0.39 0.00 0.00 64.86 63.77 3geb h ILE 452 Cb 0.62 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 35.35 3geb h ILE 452 CO -0.73 0.33 -0.38 -0.65 -0.69 0.00 0.00 178.15 176.03 3geb h PRO 453 N 0.62 0.45 -0.48 2.37 0.11 -1.86 -2.35 132.00 130.85 3geb h PRO 453 Ca 0.13 -0.21 -0.04 0.00 0.11 0.00 0.00 66.00 65.99 3geb h PRO 453 Cb 0.43 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 3geb h PRO 453 CO 0.01 0.76 0.15 0.00 -0.21 0.00 0.00 178.00 178.72 3geb h ALA 454 N 1.22 0.63 -0.67 -0.75 0.00 -1.15 -1.71 119.26 116.83 3geb h ALA 454 Ca 0.04 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3geb h ALA 454 Cb 0.84 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 3geb h ALA 454 CO 0.07 0.28 0.31 -0.07 0.00 0.00 0.00 179.25 179.84 3geb h LEU 455 N 0.64 0.87 0.13 0.00 3.38 -1.14 -0.51 115.31 118.67 3geb h LEU 455 Ca 0.15 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3geb h LEU 455 Cb 0.27 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 3geb h LEU 455 CO -0.01 0.74 -0.13 0.00 0.09 0.00 0.00 178.44 179.14 3geb h ALA 456 N 1.39 -0.25 0.05 1.53 0.00 -0.93 -2.50 119.26 118.55 3geb h ALA 456 Ca 0.23 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.11 3geb h ALA 456 Cb 0.12 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3geb h ALA 456 CO -0.03 -0.66 -0.07 0.87 0.00 0.00 0.00 179.25 179.36 3geb h LYS 457 N -0.28 -0.15 -0.69 0.00 1.57 -0.90 -2.37 116.57 113.76 3geb h LYS 457 Ca 0.00 0.01 0.15 0.00 -1.87 0.00 0.00 60.65 58.94 3geb h LYS 457 Cb 0.27 0.03 -0.12 0.00 0.08 0.00 0.00 32.23 32.49 3geb h LYS 457 CO -0.03 -0.10 -0.05 0.28 -0.57 0.00 0.00 179.45 178.98 3geb h VAL 458 N -0.15 0.38 -0.07 0.50 2.07 -0.99 0.35 116.25 118.34 3geb h VAL 458 Ca 0.01 -0.02 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 3geb h VAL 458 Cb 0.16 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 3geb h VAL 458 CO -0.04 0.01 0.02 -0.07 0.02 0.00 0.00 177.57 177.52 3geb h LEU 459 N 0.07 0.10 -0.48 2.57 3.38 -1.30 0.66 115.31 120.30 3geb h LEU 459 Ca 0.36 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3geb h LEU 459 Cb 0.59 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3geb h LEU 459 CO -0.64 0.25 0.00 0.18 0.09 0.00 0.00 178.44 178.32 3geb n LEU 460 N -4.94 0.35 -0.65 1.67 4.77 -0.65 -1.57 117.00 115.99 3geb n LEU 460 Ca -0.06 0.60 0.06 0.00 -0.03 0.00 0.00 56.01 56.58 3geb n LEU 460 Cb 0.12 -0.58 0.16 0.00 -2.33 0.00 0.00 43.42 40.79 3geb n LEU 460 CO 0.34 -0.50 0.63 -1.22 -1.33 0.00 0.00 177.39 175.31 3geb n TYR 461 N -1.91 0.49 -1.55 -1.77 4.02 0.02 -4.97 117.16 111.50 3geb n TYR 461 Ca 0.02 -0.52 -0.10 0.00 -0.01 0.00 0.00 57.90 57.28 3geb n TYR 461 Cb 0.16 -0.04 -0.03 0.00 -0.02 0.00 0.00 39.34 39.40 3geb n TYR 461 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3geb n GLY 462 N 0.44 0.83 0.03 2.72 0.00 -0.61 -4.90 105.19 103.70 3geb n GLY 462 Ca 0.12 -0.53 0.12 0.00 0.00 0.00 0.00 46.02 45.73 3geb n GLY 462 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3geb n LEU 463 N -1.25 0.60 -0.23 0.99 4.77 0.23 -4.14 117.00 117.96 3geb n LEU 463 Ca -0.11 0.05 0.13 0.00 -0.03 0.00 0.00 56.01 56.05 3geb n LEU 463 Cb 0.41 -0.19 0.42 0.00 -2.33 0.00 0.00 43.42 41.73 3geb n LEU 463 CO 0.15 0.06 1.22 1.23 -1.33 0.00 0.00 177.39 178.72 3geb h GLY 464 N 4.76 1.03 0.54 -0.72 0.00 -1.73 -1.22 103.07 105.72 3geb h GLY 464 Ca 0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.04 3geb h GLY 464 CO 0.00 0.08 -0.26 0.23 0.00 0.00 0.00 176.54 176.60 3geb h SER 465 N 0.60 -0.61 0.13 0.19 0.87 -1.74 -3.23 113.55 109.77 3geb h SER 465 Ca 0.42 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 61.00 3geb h SER 465 Cb 0.75 0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 3geb h SER 465 CO -0.17 -0.32 0.00 0.58 -0.53 0.00 0.00 176.83 176.39 3geb h VAL 466 N -0.95 0.00 -3.41 2.23 2.07 -1.74 -3.40 116.25 111.04 3geb h VAL 466 Ca -0.07 -0.05 -0.67 0.00 0.82 0.00 0.00 66.70 66.73 3geb h VAL 466 Cb 0.55 0.62 -0.35 0.00 -1.52 0.00 0.00 31.29 30.59 3geb h VAL 466 CO 0.12 0.00 -0.82 -0.36 0.02 0.00 0.00 177.57 176.53 3geb s PHE 467 N -3.57 2.99 0.30 1.57 0.40 -0.48 -4.86 117.98 114.32 3geb s PHE 467 Ca -0.02 -1.85 -0.29 0.00 -0.60 0.00 0.00 56.93 54.18 3geb s PHE 467 Cb 0.07 -1.95 -0.10 0.00 0.51 0.00 0.00 43.02 41.56 3geb s PHE 467 CO 0.25 -0.81 1.15 -1.25 0.70 0.00 0.00 175.22 175.26 3geb s PRO 468 N 1.24 4.55 0.65 0.24 0.04 -1.26 -4.72 135.00 135.73 3geb s PRO 468 Ca -0.00 1.90 0.32 0.00 0.04 0.00 0.00 61.00 63.25 3geb s PRO 468 Cb -0.16 -3.13 1.75 0.00 0.04 0.00 0.00 34.50 33.00 3geb s PRO 468 CO -0.09 0.09 2.01 0.97 0.04 0.00 0.00 177.00 180.03 3geb h ILE 469 N 3.04 0.09 -0.45 0.56 2.10 -1.97 0.17 117.51 121.05 3geb h ILE 469 Ca -0.47 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.47 3geb h ILE 469 Cb 1.22 0.73 0.00 0.00 -1.09 0.00 0.00 36.82 37.68 3geb h ILE 469 CO 0.66 0.00 0.00 -1.84 -1.08 0.00 0.00 178.15 175.89 3geb n GLU 470 N -3.10 3.23 -0.30 2.19 0.00 -1.26 -3.61 120.64 117.79 3geb n GLU 470 Ca -0.01 -2.12 0.08 0.00 0.00 0.00 0.00 57.16 55.12 3geb n GLU 470 Cb 0.35 -1.82 0.16 0.00 0.00 0.00 0.00 31.44 30.13 3geb n GLU 470 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3geb n ASN 471 N 0.66 2.01 -4.04 -1.84 4.13 0.58 -4.97 115.26 111.79 3geb n ASN 471 Ca 0.19 -3.30 -0.28 0.00 1.68 0.00 0.00 54.58 52.87 3geb n ASN 471 Cb 0.75 -0.45 -0.17 0.00 -1.54 0.00 0.00 39.78 38.38 3geb n ASN 471 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3geb s ILE 472 N -2.83 1.41 -0.03 2.41 1.01 -1.24 0.21 121.20 122.15 3geb s ILE 472 Ca 0.33 -0.59 0.04 0.00 0.00 0.00 0.00 60.65 60.43 3geb s ILE 472 Cb 0.30 -1.30 -0.00 0.00 0.01 0.00 0.00 42.46 41.47 3geb s ILE 472 CO -0.01 0.42 -0.15 -0.31 0.00 0.00 0.00 174.94 174.90 3geb s TYR 473 N 1.02 1.42 -0.12 3.97 1.51 0.09 -4.62 117.35 120.62 3geb s TYR 473 Ca -0.06 -0.36 -0.15 0.00 -1.01 0.00 0.00 57.07 55.49 3geb s TYR 473 Cb -0.15 -0.96 -0.05 0.00 -0.11 0.00 0.00 41.96 40.70 3geb s TYR 473 CO -0.02 -0.11 0.35 0.45 -1.11 0.00 0.00 175.55 175.12 3geb s SER 474 N -0.04 6.56 -0.30 2.29 0.15 -0.54 -1.72 113.70 120.09 3geb s SER 474 Ca -0.01 0.66 0.11 0.00 0.70 0.00 0.00 55.95 57.42 3geb s SER 474 Cb -0.09 -2.22 0.78 0.00 -1.71 0.00 0.00 66.02 62.78 3geb s SER 474 CO 0.01 0.12 1.80 0.00 1.20 0.00 0.00 173.24 176.37 3geb n ALA 475 N 3.25 4.39 0.02 5.45 0.00 0.23 -4.44 120.51 129.41 3geb n ALA 475 Ca -0.11 -2.21 -0.10 0.00 0.00 0.00 0.00 53.44 51.01 3geb n ALA 475 Cb 0.52 -1.22 0.03 0.00 0.00 0.00 0.00 19.45 18.78 3geb n ALA 475 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3geb h THR 476 N 3.14 1.34 0.22 0.00 1.35 -1.76 -2.30 112.91 114.89 3geb h THR 476 Ca 0.18 -1.93 -0.33 0.00 -0.55 0.00 0.00 66.41 63.78 3geb h THR 476 Cb 2.25 1.90 0.03 0.00 -1.73 0.00 0.00 68.15 70.60 3geb h THR 476 CO 0.67 0.59 -1.52 0.50 -0.25 0.00 0.00 175.52 175.52 3geb h LYS 477 N 0.39 0.46 0.00 4.72 3.64 -1.79 -3.42 116.57 120.57 3geb h LYS 477 Ca -0.01 -0.79 0.00 0.00 -1.27 0.00 0.00 60.65 58.58 3geb h LYS 477 Cb 1.19 0.29 0.00 0.00 -0.41 0.00 0.00 32.23 33.31 3geb h LYS 477 CO 0.12 1.37 0.00 0.25 -2.27 0.00 0.00 179.45 178.92 3geb n THR 478 N -3.65 0.00 0.00 1.00 -2.24 -1.26 -5.15 114.28 102.98 3geb n THR 478 Ca -0.18 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 3geb n THR 478 Cb 1.09 1.24 0.00 0.00 -2.10 0.00 0.00 70.33 70.56 3geb n THR 478 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3geb n GLY 479 N 0.26 1.65 0.20 3.38 0.00 -0.87 -4.21 105.19 105.61 3geb n GLY 479 Ca 0.00 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.21 3geb n GLY 479 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3geb h LYS 480 N 0.00 0.17 -0.29 1.61 1.57 -1.92 -1.89 116.57 115.82 3geb h LYS 480 Ca 0.00 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.57 3geb h LYS 480 Cb 0.00 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 3geb h LYS 480 CO 0.00 0.50 -0.41 1.49 -0.57 0.00 0.00 179.45 180.47 3geb h GLU 481 N 0.15 0.71 -0.17 3.15 4.22 -1.86 0.07 114.58 120.85 3geb h GLU 481 Ca 0.02 -0.37 -0.01 0.00 0.08 0.00 0.00 59.36 59.08 3geb h GLU 481 Cb 0.69 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 3geb h GLU 481 CO 0.05 0.98 0.08 1.03 -2.18 0.00 0.00 179.01 178.97 3geb h SER 482 N 0.58 0.23 -0.63 1.04 0.87 -1.65 -2.33 113.55 111.66 3geb h SER 482 Ca 0.05 -0.14 -0.05 0.00 -1.23 0.00 0.00 61.79 60.41 3geb h SER 482 Cb 0.95 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.82 3geb h SER 482 CO 0.09 0.31 0.21 0.00 -0.53 0.00 0.00 176.83 176.90 3geb h PHE 484 N 0.97 1.23 -0.39 0.00 0.05 -0.76 -0.96 116.94 117.08 3geb h PHE 484 Ca 0.22 0.03 -0.11 0.00 3.82 0.00 0.00 57.97 61.93 3geb h PHE 484 Cb 0.27 -0.41 -0.01 0.00 2.00 0.00 0.00 35.95 37.80 3geb h PHE 484 CO 0.02 0.68 -0.18 1.49 -0.18 0.00 0.00 178.31 180.14 3geb h GLU 485 N 1.24 0.81 -0.81 1.51 4.81 -0.88 -1.58 114.58 119.68 3geb h GLU 485 Ca 0.41 -0.35 0.02 0.00 -0.13 0.00 0.00 59.36 59.31 3geb h GLU 485 Cb 0.06 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 3geb h GLU 485 CO -0.14 0.98 0.53 -0.09 -0.73 0.00 0.00 179.01 179.55 3geb h ARG 486 N 0.61 1.03 -0.45 1.92 2.43 -0.68 -2.10 114.38 117.13 3geb h ARG 486 Ca 0.09 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.13 3geb h ARG 486 Cb 0.73 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 30.03 3geb h ARG 486 CO 0.06 0.68 -0.01 0.82 -1.51 0.00 0.00 179.97 180.01 3geb h ILE 487 N 1.06 1.24 -0.16 1.20 2.04 -1.02 -1.93 117.51 119.93 3geb h ILE 487 Ca 0.30 -0.98 -0.08 0.00 1.00 0.00 0.00 64.86 65.10 3geb h ILE 487 Cb -0.08 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 36.89 3geb h ILE 487 CO -0.08 0.34 -0.27 0.24 0.00 0.00 0.00 178.15 178.38 3geb h MET 488 N 0.70 0.31 0.00 2.37 2.86 -0.75 -2.05 114.93 118.37 3geb h MET 488 Ca 0.14 -0.11 -0.13 0.00 -2.06 0.00 0.00 59.70 57.54 3geb h MET 488 Cb 0.44 -0.02 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 3geb h MET 488 CO 0.02 0.56 -0.63 1.96 1.06 0.00 0.00 176.91 179.88 3geb h GLN 489 N 0.27 0.00 -0.01 1.72 1.08 -1.01 -0.97 115.11 116.19 3geb h GLN 489 Ca 0.04 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.08 3geb h GLN 489 Cb 0.62 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.03 3geb h GLN 489 CO 0.04 0.63 -0.75 -0.09 -0.95 0.00 0.00 178.83 177.71 3geb h ARG 490 N 0.00 0.06 0.00 1.46 2.43 -0.69 -3.35 114.38 114.29 3geb h ARG 490 Ca -0.01 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3geb h ARG 490 Cb 1.22 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.78 3geb h ARG 490 CO 0.08 0.78 -1.23 1.19 -1.51 0.00 0.00 179.97 179.28 3geb n PHE 491 N -3.69 0.00 0.00 2.20 3.01 -0.86 -5.10 117.46 113.02 3geb n PHE 491 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 3geb n PHE 491 Cb 0.72 -0.19 0.00 0.00 -0.01 0.00 0.00 39.48 40.00 3geb n PHE 491 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3geb n GLY 492 N 1.53 1.38 0.05 1.37 0.00 -0.37 -4.55 105.19 104.60 3geb n GLY 492 Ca -0.00 -1.87 0.10 0.00 0.00 0.00 0.00 46.02 44.25 3geb n GLY 492 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3geb n ARG 493 N 1.45 0.08 0.08 1.61 1.74 -1.26 -3.48 116.66 116.88 3geb n ARG 493 Ca 0.00 0.25 -0.22 0.00 -0.77 0.00 0.00 57.85 57.11 3geb n ARG 493 Cb 0.00 -1.63 -0.14 0.00 -1.02 0.00 0.00 32.46 29.67 3geb n ARG 493 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3geb h LYS 494 N 0.00 0.53 -7.25 5.56 1.57 -1.95 -3.46 116.57 111.57 3geb h LYS 494 Ca 0.00 -0.74 -0.51 0.00 -1.87 0.00 0.00 60.65 57.52 3geb h LYS 494 Cb 0.38 0.25 0.12 0.00 0.08 0.00 0.00 32.23 33.07 3geb h LYS 494 CO 0.00 1.33 0.34 0.00 -0.57 0.00 0.00 179.45 180.56 3geb s ALA 495 N -2.85 2.29 -0.12 3.86 0.00 -1.23 -5.03 121.76 118.68 3geb s ALA 495 Ca -0.11 0.47 -0.02 0.00 0.00 0.00 0.00 51.96 52.31 3geb s ALA 495 Cb 0.04 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.81 3geb s ALA 495 CO 0.90 -1.62 -0.04 0.14 0.00 0.00 0.00 175.76 175.14 3geb s VAL 496 N -2.55 3.88 -0.24 0.00 -7.23 -1.00 -4.98 120.40 108.28 3geb s VAL 496 Ca 0.65 -0.39 -0.09 0.00 -1.81 0.00 0.00 61.98 60.35 3geb s VAL 496 Cb -0.20 -2.65 -0.04 0.00 0.56 0.00 0.00 36.38 34.04 3geb s VAL 496 CO 0.49 0.54 0.12 -0.31 -0.31 0.00 0.00 175.10 175.63 3geb s TYR 497 N -0.18 3.21 -0.38 2.82 1.51 -1.26 -1.27 117.35 121.80 3geb s TYR 497 Ca 0.03 -0.02 -0.10 0.00 -1.01 0.00 0.00 57.07 55.97 3geb s TYR 497 Cb -0.13 -2.26 0.04 0.00 -0.11 0.00 0.00 41.96 39.51 3geb s TYR 497 CO 0.02 -0.11 0.20 0.08 -1.11 0.00 0.00 175.55 174.63 3geb s VAL 498 N 1.29 4.31 -0.04 0.71 1.01 0.05 -3.05 120.40 124.69 3geb s VAL 498 Ca 0.06 -1.06 -0.24 0.00 0.00 0.00 0.00 61.98 60.74 3geb s VAL 498 Cb -0.14 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 3geb s VAL 498 CO 0.05 -0.29 0.72 -0.69 0.00 0.00 0.00 175.10 174.89 3geb s VAL 499 N 1.49 4.99 -0.20 2.92 1.01 0.06 -0.43 120.40 130.23 3geb s VAL 499 Ca 0.01 1.50 0.00 0.00 0.00 0.00 0.00 61.98 63.50 3geb s VAL 499 Cb -0.20 -4.06 0.05 0.00 0.00 0.00 0.00 36.38 32.16 3geb s VAL 499 CO 0.05 0.27 -0.07 -0.63 0.00 0.00 0.00 175.10 174.72 3geb s ILE 500 N 0.65 1.41 0.19 2.22 1.01 -0.46 -0.88 121.20 125.34 3geb s ILE 500 Ca 0.38 -0.93 -0.23 0.00 0.00 0.00 0.00 60.65 59.87 3geb s ILE 500 Cb -0.18 -1.58 0.05 0.00 0.01 0.00 0.00 42.46 40.76 3geb s ILE 500 CO 0.19 0.08 0.71 -0.83 0.00 0.00 0.00 174.94 175.09 3geb s GLY 501 N 1.48 -0.36 -0.06 6.18 0.00 -1.08 -2.20 107.32 111.27 3geb s GLY 501 Ca -0.02 0.19 0.19 0.00 0.00 0.00 0.00 44.72 45.08 3geb s GLY 501 CO -0.08 0.06 0.45 2.09 0.00 0.00 0.00 173.10 175.62 3geb n ASP 502 N -0.41 0.27 -4.54 1.64 5.75 -1.26 -1.59 116.55 116.41 3geb n ASP 502 Ca -0.10 0.12 -0.21 0.00 -0.01 0.00 0.00 54.79 54.59 3geb n ASP 502 Cb 0.62 1.07 0.10 0.00 -1.03 0.00 0.00 41.12 41.88 3geb n ASP 502 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3geb n GLY 503 N 1.47 1.07 0.10 6.12 0.00 -1.26 -4.75 105.19 107.94 3geb n GLY 503 Ca -0.16 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.77 3geb n GLY 503 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3geb h VAL 504 N -0.38 0.64 -0.70 1.61 -1.51 -1.98 -3.08 116.25 110.85 3geb h VAL 504 Ca -0.30 -2.11 -0.07 0.00 -1.23 0.00 0.00 66.70 63.00 3geb h VAL 504 Cb 1.17 2.17 -0.03 0.00 -2.13 0.00 0.00 31.29 32.47 3geb h VAL 504 CO 0.35 0.37 0.18 -0.08 -1.23 0.00 0.00 177.57 177.15 3geb h GLU 505 N 0.00 1.12 -0.38 5.19 4.81 -1.99 0.12 114.58 123.45 3geb h GLU 505 Ca -0.12 -0.27 -0.02 0.00 -0.13 0.00 0.00 59.36 58.83 3geb h GLU 505 Cb 1.54 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.76 3geb h GLU 505 CO 0.05 0.99 0.17 0.93 -0.73 0.00 0.00 179.01 180.43 3geb h GLU 506 N 1.06 0.56 0.40 1.92 3.07 -1.97 -1.36 114.58 118.25 3geb h GLU 506 Ca 0.22 -0.09 -0.02 0.00 -0.50 0.00 0.00 59.36 58.98 3geb h GLU 506 Cb 0.36 -0.10 -0.00 0.00 -0.84 0.00 0.00 28.75 28.17 3geb h GLU 506 CO 0.00 0.51 -0.27 1.49 -1.40 0.00 0.00 179.01 179.34 3geb h GLU 507 N 0.47 -0.62 -0.12 2.33 4.81 -1.30 -1.70 114.58 118.45 3geb h GLU 507 Ca 0.13 0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.38 3geb h GLU 507 Cb 0.14 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.65 3geb h GLU 507 CO -0.01 -0.41 -0.04 1.96 -0.73 0.00 0.00 179.01 179.78 3geb h GLN 508 N -0.64 0.18 -0.36 1.92 4.20 -1.06 -1.99 115.11 117.35 3geb h GLN 508 Ca -0.05 -0.03 -0.13 0.00 0.06 0.00 0.00 58.65 58.50 3geb h GLN 508 Cb 0.52 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.26 3geb h GLN 508 CO 0.04 0.23 -0.31 0.78 -0.67 0.00 0.00 178.83 178.91 3geb h GLY 509 N 0.47 0.86 1.77 3.46 0.00 -1.17 -0.94 103.07 107.53 3geb h GLY 509 Ca 0.04 -0.80 -0.20 0.00 0.00 0.00 0.00 47.33 46.37 3geb h GLY 509 CO 0.01 0.73 -0.89 0.00 0.00 0.00 0.00 176.54 176.39 3geb h ALA 510 N 0.98 0.50 -0.39 3.60 0.00 -1.05 -3.23 119.26 119.67 3geb h ALA 510 Ca 0.08 -0.73 -0.13 0.00 0.00 0.00 0.00 54.91 54.12 3geb h ALA 510 Cb 0.84 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3geb h ALA 510 CO 0.07 0.92 -0.29 0.87 0.00 0.00 0.00 179.25 180.82 3geb h LYS 511 N 0.11 0.84 -0.05 0.00 1.57 -1.23 0.55 116.57 118.37 3geb h LYS 511 Ca -0.05 -0.38 -0.05 0.00 -1.87 0.00 0.00 60.65 58.30 3geb h LYS 511 Cb 1.52 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.80 3geb h LYS 511 CO 0.14 1.02 -0.19 -0.22 -0.57 0.00 0.00 179.45 179.62 3geb h LYS 512 N 0.72 0.09 -0.54 3.15 3.64 -1.21 -2.61 116.57 119.81 3geb h LYS 512 Ca 0.08 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3geb h LYS 512 Cb 0.84 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 3geb h LYS 512 CO 0.07 0.28 0.00 0.72 -2.27 0.00 0.00 179.45 178.26 3geb n HIS 513 N -4.27 1.20 -2.63 1.91 8.25 -1.08 -4.95 115.22 113.65 3geb n HIS 513 Ca -0.02 -0.63 -0.19 0.00 -0.26 0.00 0.00 57.72 56.63 3geb n HIS 513 Cb 0.28 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.18 3geb n HIS 513 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3geb n ASN 514 N 0.79 -5.21 -4.76 0.41 5.03 -0.58 -4.96 115.26 105.97 3geb n ASN 514 Ca 0.23 -0.05 -0.39 0.00 0.87 0.00 0.00 54.58 55.24 3geb n ASN 514 Cb 0.80 -4.32 -0.06 0.00 -1.02 0.00 0.00 39.78 35.18 3geb n ASN 514 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 3geb s MET 515 N -5.27 4.30 0.36 3.52 -1.94 0.18 -5.00 119.30 115.45 3geb s MET 515 Ca 0.10 0.70 -0.28 0.00 -1.71 0.00 0.00 55.69 54.49 3geb s MET 515 Cb -0.05 -3.34 -0.11 0.00 2.01 0.00 0.00 34.83 33.34 3geb s MET 515 CO 0.12 0.37 1.46 -1.25 -0.01 0.00 0.00 175.02 175.71 3geb s PRO 516 N -0.18 4.16 -0.04 2.03 0.04 -1.17 -4.39 135.00 135.44 3geb s PRO 516 Ca 0.30 2.50 0.05 0.00 0.04 0.00 0.00 61.00 63.90 3geb s PRO 516 Cb -0.18 -2.99 -0.01 0.00 0.04 0.00 0.00 34.50 31.36 3geb s PRO 516 CO 0.16 -0.48 -0.20 0.12 0.04 0.00 0.00 177.00 176.65 3geb s PHE 517 N -1.01 1.97 -0.32 0.56 5.36 -1.26 -0.76 117.98 122.52 3geb s PHE 517 Ca 0.53 -0.55 -0.03 0.00 -0.96 0.00 0.00 56.93 55.92 3geb s PHE 517 Cb -0.45 -1.31 0.05 0.00 -0.34 0.00 0.00 43.02 40.97 3geb s PHE 517 CO 0.60 -0.17 0.04 -1.58 -1.46 0.00 0.00 175.22 172.65 3geb s TRP 518 N -0.10 3.28 -0.15 10.12 0.52 -0.06 -4.99 118.94 127.56 3geb s TRP 518 Ca -0.02 -1.77 -0.29 0.00 0.02 0.00 0.00 56.10 54.04 3geb s TRP 518 Cb -0.12 -2.21 -0.00 0.00 -1.15 0.00 0.00 33.47 29.99 3geb s TRP 518 CO 0.02 -0.79 1.03 0.50 0.02 0.00 0.00 176.95 177.73 3geb s ARG 519 N 1.29 4.36 -0.66 4.98 3.52 -1.26 -2.65 118.95 128.52 3geb s ARG 519 Ca -0.04 1.40 -0.00 0.00 -0.13 0.00 0.00 55.73 56.95 3geb s ARG 519 Cb -0.20 -3.58 0.17 0.00 -1.56 0.00 0.00 34.95 29.78 3geb s ARG 519 CO -0.00 -0.44 0.48 0.42 -0.81 0.00 0.00 175.30 174.94 3geb s ILE 520 N 2.49 3.53 -0.53 4.11 1.01 -0.62 -4.87 121.20 126.32 3geb s ILE 520 Ca 0.47 -3.35 0.24 0.00 0.00 0.00 0.00 60.65 58.01 3geb s ILE 520 Cb -0.17 -3.30 0.15 0.00 0.01 0.00 0.00 42.46 39.15 3geb s ILE 520 CO 0.14 -0.92 1.42 0.28 0.00 0.00 0.00 174.94 175.86 3geb h SER 521 N 6.55 0.00 -5.00 3.58 0.02 -1.86 -3.35 113.55 113.50 3geb h SER 521 Ca 0.02 -0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 3geb h SER 521 Cb 0.89 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.44 3geb h SER 521 CO 0.73 0.04 0.28 0.00 -1.14 0.00 0.00 176.83 176.74 3geb h HIS 523 N 2.00 1.11 -0.95 0.00 2.76 -1.96 -2.32 115.15 115.79 3geb h HIS 523 Ca -0.32 0.03 0.03 0.00 -2.20 0.00 0.00 60.37 57.91 3geb h HIS 523 Cb 1.25 -0.36 -0.05 0.00 1.55 0.00 0.00 27.41 29.79 3geb h HIS 523 CO 1.37 0.58 0.62 0.00 -1.30 0.00 0.00 177.93 179.21 3geb h ALA 524 N 1.42 1.38 -0.17 5.26 0.00 -1.99 -1.56 119.26 123.60 3geb h ALA 524 Ca 0.40 -0.05 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 3geb h ALA 524 Cb 0.13 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3geb h ALA 524 CO -0.16 0.53 -0.26 -0.44 0.00 0.00 0.00 179.25 178.92 3geb h ASP 525 N 1.21 0.32 -0.30 0.00 3.32 -1.79 0.17 116.42 119.35 3geb h ASP 525 Ca 0.38 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 57.26 3geb h ASP 525 Cb -0.00 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3geb h ASP 525 CO -0.11 0.58 -0.07 0.25 -1.72 0.00 0.00 179.24 178.17 3geb h LEU 526 N 0.29 0.58 -0.89 1.55 6.46 -1.09 -0.53 115.31 121.67 3geb h LEU 526 Ca 0.04 -0.36 -0.12 0.00 -0.12 0.00 0.00 57.88 57.33 3geb h LEU 526 Cb 0.61 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.37 3geb h LEU 526 CO 0.04 0.80 -0.50 -0.33 -0.62 0.00 0.00 178.44 177.84 3geb h GLU 527 N 0.34 0.13 -0.52 1.25 5.08 -0.96 0.09 114.58 119.98 3geb h GLU 527 Ca 0.08 -0.07 -0.09 0.00 -1.00 0.00 0.00 59.36 58.28 3geb h GLU 527 Cb 0.55 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 3geb h GLU 527 CO 0.03 0.60 -0.01 0.00 -1.00 0.00 0.00 179.01 178.63 3geb h ALA 528 N 1.39 0.71 0.05 3.43 0.00 -0.51 -2.11 119.26 122.22 3geb h ALA 528 Ca 0.00 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3geb h ALA 528 Cb 0.92 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3geb h ALA 528 CO 0.07 0.53 -0.02 1.25 0.00 0.00 0.00 179.25 181.08 3geb h LEU 529 N 0.80 -0.05 -1.12 0.00 5.85 -0.59 -1.23 115.31 118.96 3geb h LEU 529 Ca 0.15 -0.21 0.15 0.00 0.84 0.00 0.00 57.88 58.80 3geb h LEU 529 Cb 0.54 0.01 -0.09 0.00 0.37 0.00 0.00 40.66 41.50 3geb h LEU 529 CO 0.03 0.18 0.61 -0.09 -0.34 0.00 0.00 178.44 178.83 3geb h ARG 530 N -0.29 0.79 -0.09 1.25 2.43 -0.94 0.12 114.38 117.65 3geb h ARG 530 Ca -0.01 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 3geb h ARG 530 Cb 0.27 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 3geb h ARG 530 CO 0.01 0.52 -0.52 1.25 -1.51 0.00 0.00 179.97 179.72 3geb h HIS 531 N 0.81 0.29 -0.42 2.20 2.76 -1.15 -1.24 115.15 118.40 3geb h HIS 531 Ca 0.51 -0.10 -0.10 0.00 -2.20 0.00 0.00 60.37 58.48 3geb h HIS 531 Cb 0.72 -0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.60 3geb h HIS 531 CO -0.00 0.71 -0.15 0.00 -1.30 0.00 0.00 177.93 177.18 3geb h ALA 532 N 1.27 0.95 -0.22 5.26 0.00 0.43 -2.48 119.26 124.48 3geb h ALA 532 Ca 0.00 -0.34 -0.15 0.00 0.00 0.00 0.00 54.91 54.42 3geb h ALA 532 Cb 0.98 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3geb h ALA 532 CO 0.08 0.61 -0.50 -0.07 0.00 0.00 0.00 179.25 179.37 3geb h LEU 533 N 0.69 0.65 0.14 0.00 3.38 -0.91 -0.81 115.31 118.44 3geb h LEU 533 Ca 0.11 -0.33 0.02 0.00 0.09 0.00 0.00 57.88 57.77 3geb h LEU 533 Cb 0.64 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 3geb h LEU 533 CO 0.05 1.03 -0.27 -0.33 0.09 0.00 0.00 178.44 179.01 3geb h GLU 534 N 0.47 -0.47 0.00 1.13 4.39 -0.91 -2.11 114.58 117.08 3geb h GLU 534 Ca 0.02 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.75 3geb h GLU 534 Cb 1.03 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.79 3geb h GLU 534 CO 0.10 -0.31 0.00 1.28 -1.16 0.00 0.00 179.01 178.91 3geb n LEU 535 N -5.38 0.00 0.00 1.33 4.77 -0.96 -4.84 117.00 111.91 3geb n LEU 535 Ca -0.07 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.91 3geb n LEU 535 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 3geb n LEU 535 CO 0.25 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.69 3geb n GLU 536 N -0.89 -0.39 -0.09 3.23 1.02 -0.79 -4.78 120.64 117.94 3geb n GLU 536 Ca 0.15 0.10 0.17 0.00 -0.02 0.00 0.00 57.16 57.56 3geb n GLU 536 Cb 0.07 -3.78 0.58 0.00 -0.02 0.00 0.00 31.44 28.30 3geb n GLU 536 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 3geb h TYR 537 N 0.00 0.28 0.00 -0.32 3.20 -1.43 -3.48 116.97 115.22 3geb h TYR 537 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3geb h TYR 537 Cb 0.19 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.38 3geb h TYR 537 CO 0.12 0.11 0.00 -0.11 -1.64 0.00 0.00 178.16 176.64