#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1g0h s LYS 302 N 0.00 3.41 0.23 2.12 -0.14 -1.26 -4.83 119.74 119.27 1g0h s LYS 302 Ca 0.00 1.46 -0.07 0.00 -1.36 0.00 0.00 55.97 56.00 1g0h s LYS 302 Cb 0.00 -2.03 0.37 0.00 -1.68 0.00 0.00 37.83 34.50 1g0h s LYS 302 CO 0.00 -0.78 1.70 -1.49 -0.76 0.00 0.00 175.35 174.03 1g0h h TRP 303 N 1.06 0.28 0.00 3.18 -0.00 -2.04 0.76 115.95 119.19 1g0h h TRP 303 Ca -0.49 0.04 -0.04 0.00 -0.00 0.00 0.00 58.89 58.39 1g0h h TRP 303 Cb 1.24 -0.02 -0.01 0.00 -0.00 0.00 0.00 29.16 30.38 1g0h h TRP 303 CO 0.54 -0.03 -0.21 0.38 -0.00 0.00 0.00 178.44 179.12 1g0h h ASP 304 N 0.30 0.00 -0.18 -3.49 3.04 -1.99 -1.90 116.42 112.19 1g0h h ASP 304 Ca 0.36 0.00 -0.20 0.00 -3.24 0.00 0.00 57.03 53.95 1g0h h ASP 304 Cb 0.57 0.00 0.01 0.00 -1.04 0.00 0.00 39.33 38.86 1g0h h ASP 304 CO -0.44 0.21 -0.66 -0.33 -2.04 0.00 0.00 179.24 175.98 1g0h h GLU 305 N 0.00 0.77 0.12 4.15 5.08 -1.28 -0.05 114.58 123.36 1g0h h GLU 305 Ca -0.00 -0.58 0.00 0.00 -1.00 0.00 0.00 59.36 57.78 1g0h h GLU 305 Cb 0.37 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 1g0h h GLU 305 CO 0.03 1.20 -0.11 0.82 -1.00 0.00 0.00 179.01 179.95 1g0h h ILE 306 N 0.50 0.75 0.14 3.13 5.03 -0.53 0.19 117.51 126.72 1g0h h ILE 306 Ca -0.03 0.00 0.02 0.00 -0.12 0.00 0.00 64.86 64.73 1g0h h ILE 306 Cb 1.29 0.75 -0.04 0.00 -3.03 0.00 0.00 36.82 35.79 1g0h h ILE 306 CO 0.14 0.00 -0.30 1.23 -0.68 0.00 0.00 178.15 178.54 1g0h h GLY 307 N -0.25 -0.58 1.35 5.37 0.00 -1.41 0.25 103.07 107.80 1g0h h GLY 307 Ca 0.00 0.35 0.01 0.00 0.00 0.00 0.00 47.33 47.70 1g0h h GLY 307 CO -0.03 -0.24 0.43 0.50 0.00 0.00 0.00 176.54 177.20 1g0h h LYS 308 N -0.53 0.84 -0.26 4.80 1.57 -0.92 -1.47 116.57 120.61 1g0h h LYS 308 Ca 0.03 -0.05 -0.14 0.00 -1.87 0.00 0.00 60.65 58.61 1g0h h LYS 308 Cb 0.55 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1g0h h LYS 308 CO -0.16 0.56 -0.43 -0.97 -0.57 0.00 0.00 179.45 177.87 1g0h h ASN 309 N 0.86 0.68 0.44 0.86 -0.00 0.62 -2.35 115.58 116.70 1g0h h ASN 309 Ca 0.24 -0.32 -0.14 0.00 -0.00 0.00 0.00 56.30 56.08 1g0h h ASN 309 Cb -0.08 -0.19 -0.01 0.00 -0.00 0.00 0.00 38.32 38.03 1g0h h ASN 309 CO -0.05 1.03 -0.59 0.40 -0.00 0.00 0.00 177.43 178.21 1g0h h ILE 310 N 0.52 1.40 0.68 2.57 2.04 -0.08 -3.13 117.51 121.52 1g0h h ILE 310 Ca 0.04 -1.99 -0.03 0.00 1.00 0.00 0.00 64.86 63.88 1g0h h ILE 310 Cb 0.96 2.03 -0.00 0.00 -0.74 0.00 0.00 36.82 39.07 1g0h h ILE 310 CO 0.09 0.58 -0.43 0.00 0.00 0.00 0.00 178.15 178.38 1g0h h ALA 311 N 1.27 -1.22 -0.43 1.87 0.00 -0.89 -1.58 119.26 118.29 1g0h h ALA 311 Ca -0.01 -0.22 0.13 0.00 0.00 0.00 0.00 54.91 54.81 1g0h h ALA 311 Cb 1.08 0.56 -0.02 0.00 0.00 0.00 0.00 17.79 19.41 1g0h h ALA 311 CO 0.09 -1.19 0.39 0.87 0.00 0.00 0.00 179.25 179.41 1g0h h LYS 312 N -1.05 0.00 0.15 0.00 1.57 -1.50 -1.75 116.57 113.99 1g0h h LYS 312 Ca -0.09 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.38 1g0h h LYS 312 Cb 0.84 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.16 1g0h h LYS 312 CO 0.08 0.00 -1.51 1.49 -0.57 0.00 0.00 179.45 178.94 1g0h h GLU 313 N 0.00 0.32 -0.65 3.15 4.57 -1.40 -3.14 114.58 117.42 1g0h h GLU 313 Ca 0.21 -0.54 -0.08 0.00 -1.18 0.00 0.00 59.36 57.76 1g0h h GLU 313 Cb 0.98 0.20 -0.03 0.00 -0.16 0.00 0.00 28.75 29.75 1g0h h GLU 313 CO -0.00 1.21 0.10 0.82 -1.18 0.00 0.00 179.01 179.96 1g0h h ILE 314 N 0.09 1.26 -0.39 2.32 2.04 -0.66 -3.13 117.51 119.04 1g0h h ILE 314 Ca -0.24 -1.04 0.08 0.00 1.00 0.00 0.00 64.86 64.66 1g0h h ILE 314 Cb 2.04 0.67 -0.09 0.00 -0.74 0.00 0.00 36.82 38.71 1g0h h ILE 314 CO 0.19 0.39 -0.23 -0.08 0.00 0.00 0.00 178.15 178.42 1g0h h GLU 315 N 1.00 -0.15 -0.67 2.37 4.81 -1.41 0.81 114.58 121.34 1g0h h GLU 315 Ca 0.20 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.58 1g0h h GLU 315 Cb 0.45 0.03 -0.11 0.00 0.63 0.00 0.00 28.75 29.75 1g0h h GLU 315 CO 0.01 -0.10 0.02 0.87 -0.73 0.00 0.00 179.01 179.09 1g0h h LYS 316 N -0.16 0.13 0.01 1.92 1.57 -1.49 -2.25 116.57 116.30 1g0h h LYS 316 Ca 0.19 -0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.82 1g0h h LYS 316 Cb 0.46 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1g0h h LYS 316 CO -0.49 0.09 -0.75 0.93 -0.57 0.00 0.00 179.45 178.66 1g0h h GLU 317 N 0.13 0.01 0.00 3.15 4.39 -1.52 -3.41 114.58 117.34 1g0h h GLU 317 Ca 0.36 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.92 1g0h h GLU 317 Cb 0.59 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 1g0h h GLU 317 CO -0.56 1.01 -0.62 -0.84 -1.16 0.00 0.00 179.01 176.85 1g0h h ILE 318 N -0.96 0.87 -0.53 3.13 -0.00 -0.79 -3.33 117.51 115.90 1g0h h ILE 318 Ca -0.20 -2.26 0.11 0.00 -0.00 0.00 0.00 64.86 62.51 1g0h h ILE 318 Cb 1.20 2.41 -0.09 0.00 -0.00 0.00 0.00 36.82 40.34 1g0h h ILE 318 CO -0.11 0.50 -0.06 -0.07 -0.00 0.00 0.00 178.15 178.41 1g0h h LEU 319 N 0.00 -0.35 -1.39 0.16 3.38 -1.61 0.57 115.31 116.07 1g0h h LEU 319 Ca -0.02 0.14 0.26 0.00 0.09 0.00 0.00 57.88 58.36 1g0h h LEU 319 Cb 1.42 0.27 -0.04 0.00 0.09 0.00 0.00 40.66 42.41 1g0h h LEU 319 CO 0.07 -0.13 1.00 -0.65 0.09 0.00 0.00 178.44 178.82 1g0h h PRO 320 N 0.06 0.00 -0.01 1.13 0.11 -1.83 0.91 132.00 132.38 1g0h h PRO 320 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 1g0h h PRO 320 Cb 0.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1g0h h PRO 320 CO -0.49 0.00 -0.15 0.66 -0.21 0.00 0.00 178.00 177.81 1g0h n TYR 321 N -3.43 0.00 -1.65 0.65 4.01 0.20 -4.62 117.16 112.31 1g0h n TYR 321 Ca 0.20 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.51 1g0h n TYR 321 Cb 1.29 -0.14 -0.03 0.00 -0.31 0.00 0.00 39.34 40.14 1g0h n TYR 321 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1g0h s PHE 322 N -2.44 1.24 0.00 -0.72 5.99 0.32 -0.76 117.98 121.61 1g0h s PHE 322 Ca 0.28 0.12 0.00 0.00 0.00 0.00 0.00 56.93 57.33 1g0h s PHE 322 Cb 0.20 -4.07 0.00 0.00 0.00 0.00 0.00 43.02 39.15 1g0h s PHE 322 CO 0.48 -4.68 0.00 0.41 -0.00 0.00 0.00 175.22 171.43 1g0h n GLY 323 N 5.21 1.09 2.75 13.12 0.00 -0.08 -4.80 105.19 122.48 1g0h n GLY 323 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 1g0h n GLY 323 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1g0h n ARG 324 N -2.00 4.26 0.00 1.61 1.74 0.06 -4.64 116.66 117.69 1g0h n ARG 324 Ca 0.00 -3.82 0.01 0.00 -0.77 0.00 0.00 57.85 53.27 1g0h n ARG 324 Cb 0.00 -2.72 0.05 0.00 -1.02 0.00 0.00 32.46 28.78 1g0h n ARG 324 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1g0h n LYS 325 N 2.36 0.02 0.00 5.56 4.81 -1.25 -0.03 118.16 129.63 1g0h n LYS 325 Ca 0.44 0.35 0.12 0.00 -0.87 0.00 0.00 58.31 58.36 1g0h n LYS 325 Cb 0.31 -1.50 0.27 0.00 0.02 0.00 0.00 35.03 34.13 1g0h n LYS 325 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1g0h n ASP 326 N -1.38 1.24 -0.42 3.14 5.68 -1.26 -4.21 116.55 119.35 1g0h n ASP 326 Ca 0.01 -1.02 0.04 0.00 -0.50 0.00 0.00 54.79 53.32 1g0h n ASP 326 Cb 0.02 0.24 0.08 0.00 -1.14 0.00 0.00 41.12 40.33 1g0h n ASP 326 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1g0h n LYS 327 N -0.55 1.93 -3.91 0.11 5.02 0.96 -5.04 118.16 116.68 1g0h n LYS 327 Ca 0.11 -1.58 -0.12 0.00 -2.02 0.00 0.00 58.31 54.70 1g0h n LYS 327 Cb 0.38 -1.18 -0.13 0.00 -0.02 0.00 0.00 35.03 34.07 1g0h n LYS 327 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1g0h s SER 328 N -0.89 0.10 0.28 4.39 0.15 -1.26 -5.03 113.70 111.44 1g0h s SER 328 Ca 0.14 -0.12 0.09 0.00 0.70 0.00 0.00 55.95 56.77 1g0h s SER 328 Cb 0.08 0.02 -0.05 0.00 -1.71 0.00 0.00 66.02 64.35 1g0h s SER 328 CO 0.11 -0.06 -0.13 -0.72 1.20 0.00 0.00 173.24 173.63 1g0h s TYR 329 N -0.34 2.14 -0.44 3.44 -0.85 -1.26 -4.93 117.35 115.11 1g0h s TYR 329 Ca -0.03 -0.50 -0.18 0.00 -0.52 0.00 0.00 57.07 55.84 1g0h s TYR 329 Cb -0.02 -1.08 0.03 0.00 0.38 0.00 0.00 41.96 41.27 1g0h s TYR 329 CO -0.00 0.53 0.49 0.08 -1.52 0.00 0.00 175.55 175.13 1g0h s VAL 330 N -2.73 5.02 -1.49 -3.49 1.01 -1.26 0.31 120.40 117.77 1g0h s VAL 330 Ca 0.29 -0.32 0.29 0.00 0.00 0.00 0.00 61.98 62.24 1g0h s VAL 330 Cb -0.01 -4.10 0.40 0.00 0.00 0.00 0.00 36.38 32.67 1g0h s VAL 330 CO 0.13 -0.51 1.86 1.33 0.00 0.00 0.00 175.10 177.91 1g0h n VAL 331 N 5.52 0.00 -2.43 2.92 0.24 -0.61 -4.96 118.33 119.01 1g0h n VAL 331 Ca -0.06 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.20 1g0h n VAL 331 Cb 0.47 -0.17 0.00 0.00 -1.47 0.00 0.00 33.84 32.67 1g0h n VAL 331 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1g0h n GLY 332 N 1.32 -0.51 2.79 7.63 0.00 -1.24 -5.01 105.19 110.17 1g0h n GLY 332 Ca 0.13 -0.92 -0.29 0.00 0.00 0.00 0.00 46.02 44.94 1g0h n GLY 332 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1g0h s THR 333 N -3.37 0.96 0.13 2.61 2.01 -1.26 -1.31 115.64 115.41 1g0h s THR 333 Ca 0.00 -1.14 -0.34 0.00 0.31 0.00 0.00 61.69 60.52 1g0h s THR 333 Cb 0.00 -1.54 -0.14 0.00 0.01 0.00 0.00 72.50 70.83 1g0h s THR 333 CO 0.00 -0.41 1.56 -1.54 -0.69 0.00 0.00 174.62 173.54 1g0h n SER 334 N 4.85 2.88 0.00 3.53 3.41 -1.10 -4.73 113.62 122.46 1g0h n SER 334 Ca -0.06 1.08 0.00 0.00 -0.26 0.00 0.00 58.87 59.63 1g0h n SER 334 Cb 0.44 -1.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 1g0h n SER 334 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 1g0h n PRO 335 N 3.46 0.00 0.00 4.33 -0.02 -1.26 0.46 135.00 141.97 1g0h n PRO 335 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1g0h n PRO 335 Cb 0.27 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.75 1g0h n PRO 335 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1g0h n SER 336 N -3.96 0.00 0.00 2.55 2.88 -1.26 -4.94 113.62 108.89 1g0h n SER 336 Ca 0.00 0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 1g0h n SER 336 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1g0h n SER 336 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1g0h n GLY 337 N -0.35 -0.29 3.28 0.46 0.00 0.17 -5.15 105.19 103.32 1g0h n GLY 337 Ca 0.00 0.08 -0.15 0.00 0.00 0.00 0.00 46.02 45.95 1g0h n GLY 337 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1g0h s ASP 338 N 0.00 1.91 0.03 1.61 -0.00 -1.24 -4.97 116.67 114.00 1g0h s ASP 338 Ca 0.00 -1.07 -0.32 0.00 -0.00 0.00 0.00 52.55 51.16 1g0h s ASP 338 Cb 0.00 -0.02 -0.10 0.00 -0.00 0.00 0.00 42.92 42.79 1g0h s ASP 338 CO 0.00 -0.36 1.90 -0.62 -0.00 0.00 0.00 175.17 176.09 1g0h n GLU 339 N -0.28 2.62 -3.10 8.23 4.71 -1.26 -2.72 120.64 128.84 1g0h n GLU 339 Ca -0.09 0.96 -0.44 0.00 -0.01 0.00 0.00 57.16 57.58 1g0h n GLU 339 Cb 0.61 -2.86 -0.05 0.00 -1.01 0.00 0.00 31.44 28.13 1g0h n GLU 339 CO 0.00 0.00 0.00 0.99 0.09 0.00 0.00 177.13 178.21 1g0h s THR 340 N 3.73 4.79 0.65 2.62 2.01 -0.43 -4.87 115.64 124.16 1g0h s THR 340 Ca 0.88 -0.69 -0.12 0.00 0.31 0.00 0.00 61.69 62.07 1g0h s THR 340 Cb -0.53 -4.42 -0.02 0.00 0.01 0.00 0.00 72.50 67.54 1g0h s THR 340 CO 0.43 -1.01 1.05 -1.61 -0.69 0.00 0.00 174.62 172.79 1g0h s GLU 341 N 2.80 3.21 0.32 4.92 0.41 -1.26 -1.57 118.70 127.53 1g0h s GLU 341 Ca 0.14 0.95 0.10 0.00 -0.41 0.00 0.00 54.97 55.76 1g0h s GLU 341 Cb -0.21 -2.03 0.95 0.00 -1.78 0.00 0.00 34.13 31.07 1g0h s GLU 341 CO 0.09 -0.89 1.68 0.97 -0.49 0.00 0.00 175.26 176.63 1g0h h ILE 342 N -0.35 0.37 -0.00 -1.63 6.09 -0.51 0.37 117.51 121.86 1g0h h ILE 342 Ca -0.44 -0.13 -0.15 0.00 -1.37 0.00 0.00 64.86 62.77 1g0h h ILE 342 Cb 1.21 -0.03 -0.02 0.00 0.47 0.00 0.00 36.82 38.44 1g0h h ILE 342 CO 0.58 0.07 -0.71 2.19 -3.07 0.00 0.00 178.15 177.22 1g0h h PHE 343 N 0.37 0.04 -0.14 2.19 -5.15 -1.91 -1.89 116.94 110.45 1g0h h PHE 343 Ca 0.67 -0.02 0.05 0.00 -0.20 0.00 0.00 57.97 58.47 1g0h h PHE 343 Cb 1.43 -0.01 -0.06 0.00 0.22 0.00 0.00 35.95 37.53 1g0h h PHE 343 CO -0.06 0.72 -0.28 -0.44 -2.00 0.00 0.00 178.31 176.25 1g0h h ASP 344 N 0.02 -0.87 0.59 -0.68 3.32 -1.28 -1.88 116.42 115.63 1g0h h ASP 344 Ca -0.01 0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1g0h h ASP 344 Cb 1.25 0.38 -0.01 0.00 0.22 0.00 0.00 39.33 41.17 1g0h h ASP 344 CO 0.09 -0.33 -0.40 0.50 -1.72 0.00 0.00 179.24 177.39 1g0h h LYS 345 N -0.35 -0.91 -0.37 3.56 3.11 -1.17 -2.15 116.57 118.30 1g0h h LYS 345 Ca 0.10 0.06 0.08 0.00 -2.81 0.00 0.00 60.65 58.08 1g0h h LYS 345 Cb 0.50 0.21 -0.09 0.00 -1.00 0.00 0.00 32.23 31.85 1g0h h LYS 345 CO -0.34 -0.61 -0.28 0.82 -2.81 0.00 0.00 179.45 176.23 1g0h h ILE 346 N -0.94 0.29 -0.82 2.00 2.04 -1.29 0.06 117.51 118.85 1g0h h ILE 346 Ca -0.07 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1g0h h ILE 346 Cb 0.78 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1g0h h ILE 346 CO 0.05 0.00 0.49 0.77 0.00 0.00 0.00 178.15 179.45 1g0h h SER 347 N -0.23 1.00 0.60 1.72 4.64 -1.29 -1.86 113.55 118.12 1g0h h SER 347 Ca 0.17 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.39 1g0h h SER 347 Cb 0.51 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1g0h h SER 347 CO -0.50 0.78 -0.30 -0.08 -0.87 0.00 0.00 176.83 175.86 1g0h h GLU 348 N 1.13 -0.79 -0.58 4.77 4.81 -0.65 -2.57 114.58 120.70 1g0h h GLU 348 Ca 0.29 0.05 0.17 0.00 -0.13 0.00 0.00 59.36 59.75 1g0h h GLU 348 Cb -0.03 0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1g0h h GLU 348 CO -0.05 -0.53 0.45 -0.44 -0.73 0.00 0.00 179.01 177.71 1g0h h ASP 349 N -0.82 0.00 0.41 1.04 3.32 -0.82 0.21 116.42 119.75 1g0h h ASP 349 Ca -0.08 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.81 1g0h h ASP 349 Cb 0.63 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.17 1g0h h ASP 349 CO 0.12 0.00 -0.68 0.40 -1.72 0.00 0.00 179.24 177.36 1g0h h ILE 350 N 0.00 1.41 0.15 0.35 2.04 -0.94 -2.51 117.51 118.01 1g0h h ILE 350 Ca 0.28 -2.16 -0.01 0.00 1.00 0.00 0.00 64.86 63.97 1g0h h ILE 350 Cb 1.17 2.13 0.00 0.00 -0.74 0.00 0.00 36.82 39.38 1g0h h ILE 350 CO -0.00 0.64 -0.07 0.00 0.00 0.00 0.00 178.15 178.71 1g0h h ALA 351 N 1.11 -0.20 0.00 1.87 0.00 -0.43 -3.05 119.26 118.57 1g0h h ALA 351 Ca -0.02 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1g0h h ALA 351 Cb 1.23 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 1g0h h ALA 351 CO 0.11 -0.44 -0.02 -0.07 0.00 0.00 0.00 179.25 178.83 1g0h h LEU 352 N -0.54 0.00 -0.03 0.00 4.07 -1.28 -1.73 115.31 115.80 1g0h h LEU 352 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1g0h h LEU 352 Cb 0.42 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.16 1g0h h LEU 352 CO 0.03 0.02 -0.02 0.50 -1.08 0.00 0.00 178.44 177.89 1g0h h LYS 353 N 0.00 0.07 -0.65 1.13 3.64 -1.33 -0.59 116.57 118.84 1g0h h LYS 353 Ca -0.00 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1g0h h LYS 353 Cb 0.09 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 1g0h h LYS 353 CO 0.00 0.50 0.25 1.88 -2.27 0.00 0.00 179.45 179.81 1g0h h TYR 354 N -0.36 0.99 -0.12 1.91 -1.99 -1.54 -3.18 116.97 112.68 1g0h h TYR 354 Ca 0.01 -0.08 -0.14 0.00 2.00 0.00 0.00 58.73 60.52 1g0h h TYR 354 Cb 0.48 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 38.90 1g0h h TYR 354 CO 0.08 0.78 -0.53 -0.07 -0.00 0.00 0.00 178.16 178.42 1g0h h LEU 355 N 0.92 0.37 -0.74 3.88 3.38 -1.28 -3.34 115.31 118.50 1g0h h LEU 355 Ca 0.22 -0.19 0.04 0.00 0.09 0.00 0.00 57.88 58.04 1g0h h LEU 355 Cb 0.22 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1g0h h LEU 355 CO -0.02 0.83 0.45 0.11 0.09 0.00 0.00 178.44 179.91 1g0h h LYS 356 N 0.26 0.84 0.00 1.13 1.57 -1.08 -0.31 116.57 118.97 1g0h h LYS 356 Ca 0.01 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1g0h h LYS 356 Cb 1.02 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.15 1g0h h LYS 356 CO 0.09 0.55 0.00 -1.13 -0.57 0.00 0.00 179.45 178.39 1g0h n SER 357 N -4.67 0.00 -0.07 0.86 3.41 -1.25 -3.18 113.62 108.71 1g0h n SER 357 Ca 0.09 -1.54 -0.07 0.00 -0.26 0.00 0.00 58.87 57.08 1g0h n SER 357 Cb 0.12 0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 63.92 1g0h n SER 357 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1g0h n LEU 358 N -0.54 0.23 -3.33 1.04 4.77 -0.13 -5.03 117.00 114.01 1g0h n LEU 358 Ca 0.01 0.11 -0.14 0.00 -0.03 0.00 0.00 56.01 55.96 1g0h n LEU 358 Cb 0.01 0.37 0.01 0.00 -2.33 0.00 0.00 43.42 41.47 1g0h n LEU 358 CO 0.01 0.41 0.03 -3.20 -1.33 0.00 0.00 177.39 173.32 1g0h n ASN 359 N -2.78 -6.55 -4.45 -1.43 5.15 -1.19 -5.06 115.26 98.95 1g0h n ASN 359 Ca -0.26 -0.30 -0.22 0.00 -0.60 0.00 0.00 54.58 53.20 1g0h n ASN 359 Cb 1.07 -3.66 -0.10 0.00 -0.53 0.00 0.00 39.78 36.55 1g0h n ASN 359 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1g0h s VAL 360 N -2.76 1.22 0.41 3.44 -7.23 -1.26 -4.77 120.40 109.46 1g0h s VAL 360 Ca 0.08 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.10 1g0h s VAL 360 Cb -0.01 -2.78 -0.08 0.00 0.56 0.00 0.00 36.38 34.06 1g0h s VAL 360 CO 0.82 0.00 0.84 0.20 -0.31 0.00 0.00 175.10 176.65 1g0h s ASN 361 N -3.52 6.68 -0.12 4.85 0.01 0.12 -4.46 114.94 118.50 1g0h s ASN 361 Ca 0.35 1.37 0.02 0.00 -0.71 0.00 0.00 52.86 53.89 1g0h s ASN 361 Cb 0.08 -2.42 0.02 0.00 0.41 0.00 0.00 41.25 39.34 1g0h s ASN 361 CO 0.16 -0.39 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.56 1g0h s ILE 362 N -2.30 1.63 -0.33 0.60 1.01 -0.45 -1.05 121.20 120.31 1g0h s ILE 362 Ca 0.56 -0.71 -0.10 0.00 0.00 0.00 0.00 60.65 60.39 1g0h s ILE 362 Cb -0.10 -1.49 -0.00 0.00 0.01 0.00 0.00 42.46 40.89 1g0h s ILE 362 CO 0.24 0.47 0.17 -0.69 0.00 0.00 0.00 174.94 175.13 1g0h s VAL 363 N 1.05 4.64 0.19 2.92 1.01 -0.67 0.41 120.40 129.95 1g0h s VAL 363 Ca -0.04 -0.50 0.08 0.00 0.00 0.00 0.00 61.98 61.51 1g0h s VAL 363 Cb -0.15 -3.42 -0.04 0.00 0.00 0.00 0.00 36.38 32.77 1g0h s VAL 363 CO -0.04 -0.00 -0.15 -0.94 0.00 0.00 0.00 175.10 173.97 1g0h s SER 364 N 1.61 2.52 0.00 3.32 1.04 0.10 -0.90 113.70 121.40 1g0h s SER 364 Ca 0.04 -0.97 -0.21 0.00 0.48 0.00 0.00 55.95 55.28 1g0h s SER 364 Cb -0.18 -0.13 -0.20 0.00 0.10 0.00 0.00 66.02 65.62 1g0h s SER 364 CO 0.07 -0.15 1.17 -0.08 0.98 0.00 0.00 173.24 175.23 1g0h h GLU 365 N 2.77 0.31 -1.32 4.02 4.81 -1.83 -1.43 114.58 121.90 1g0h h GLU 365 Ca -0.39 -0.26 -0.70 0.00 -0.13 0.00 0.00 59.36 57.89 1g0h h GLU 365 Cb 1.22 0.05 -0.28 0.00 0.63 0.00 0.00 28.75 30.37 1g0h h GLU 365 CO 0.59 0.90 0.93 0.39 -0.73 0.00 0.00 179.01 181.09 1g0h n GLU 366 N -4.45 2.69 0.00 1.92 4.71 -1.26 -4.18 120.64 120.07 1g0h n GLU 366 Ca -0.08 -3.32 0.00 0.00 -0.01 0.00 0.00 57.16 53.74 1g0h n GLU 366 Cb 0.49 -2.27 0.00 0.00 -1.01 0.00 0.00 31.44 28.65 1g0h n GLU 366 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1g0h n LEU 367 N -0.77 0.00 0.00 -4.62 0.00 -1.23 -4.85 117.00 105.53 1g0h n LEU 367 Ca 0.60 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.61 1g0h n LEU 367 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.95 1g0h n LEU 367 CO 0.70 0.01 0.00 0.61 0.00 0.00 0.00 177.39 178.71 1g0h n GLY 368 N 0.00 1.59 3.04 -3.96 0.00 -0.54 -4.73 105.19 100.60 1g0h n GLY 368 Ca 0.00 -0.07 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 1g0h n GLY 368 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1g0h s VAL 369 N 0.00 1.27 -0.28 1.61 1.01 -1.26 0.01 120.40 122.76 1g0h s VAL 369 Ca 0.00 -0.55 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 1g0h s VAL 369 Cb 0.00 -1.15 0.04 0.00 0.00 0.00 0.00 36.38 35.26 1g0h s VAL 369 CO 0.00 0.39 -0.02 -0.63 0.00 0.00 0.00 175.10 174.84 1g0h s ILE 370 N 0.70 3.01 -0.35 2.22 1.01 0.17 -5.00 121.20 122.96 1g0h s ILE 370 Ca -0.13 -1.20 -0.10 0.00 0.00 0.00 0.00 60.65 59.21 1g0h s ILE 370 Cb -0.16 -2.64 0.02 0.00 0.01 0.00 0.00 42.46 39.69 1g0h s ILE 370 CO 0.03 0.02 0.19 -0.62 0.00 0.00 0.00 174.94 174.56 1g0h s ASP 371 N 1.30 5.66 0.00 3.58 -1.08 -1.26 -1.35 116.67 123.52 1g0h s ASP 371 Ca -0.03 -0.86 0.20 0.00 -0.52 0.00 0.00 52.55 51.35 1g0h s ASP 371 Cb -0.18 -2.01 0.57 0.00 -1.46 0.00 0.00 42.92 39.84 1g0h s ASP 371 CO -0.02 -0.33 1.48 0.59 0.52 0.00 0.00 175.17 177.41 1g0h n ASN 372 N 4.99 3.49 -3.60 -0.34 5.03 -1.26 -4.99 115.26 118.58 1g0h n ASN 372 Ca -0.12 -2.00 -0.22 0.00 0.87 0.00 0.00 54.58 53.11 1g0h n ASN 372 Cb 0.47 -0.42 0.01 0.00 -1.02 0.00 0.00 39.78 38.82 1g0h n ASN 372 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 1g0h n SER 373 N 1.42 -5.68 -4.56 6.41 7.64 -1.26 -4.92 113.62 112.66 1g0h n SER 373 Ca 0.22 -0.78 -0.26 0.00 1.01 0.00 0.00 58.87 59.06 1g0h n SER 373 Cb 0.55 -3.05 -0.10 0.00 -1.01 0.00 0.00 64.21 60.60 1g0h n SER 373 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1g0h s SER 374 N -3.16 3.84 0.00 6.43 0.15 -1.26 -5.02 113.70 114.67 1g0h s SER 374 Ca 0.17 -1.15 0.27 0.00 0.70 0.00 0.00 55.95 55.93 1g0h s SER 374 Cb -0.07 -0.39 0.82 0.00 -1.71 0.00 0.00 66.02 64.67 1g0h s SER 374 CO 0.86 -0.21 1.62 -1.84 1.20 0.00 0.00 173.24 174.87 1g0h n GLU 375 N -0.83 0.17 -3.41 5.44 0.28 -1.26 -4.72 120.64 116.30 1g0h n GLU 375 Ca -0.05 -0.07 -0.38 0.00 -0.16 0.00 0.00 57.16 56.50 1g0h n GLU 375 Cb 0.63 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.93 1g0h n GLU 375 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1g0h s TRP 376 N -2.88 3.38 -0.13 -1.84 0.52 -1.26 -0.07 118.94 116.66 1g0h s TRP 376 Ca 0.15 0.59 0.02 0.00 0.02 0.00 0.00 56.10 56.88 1g0h s TRP 376 Cb 0.18 -2.50 0.02 0.00 -1.15 0.00 0.00 33.47 30.02 1g0h s TRP 376 CO 0.61 0.01 -0.17 0.99 0.02 0.00 0.00 176.95 178.41 1g0h s THR 377 N 1.25 1.65 -0.28 2.01 2.01 0.19 0.13 115.64 122.59 1g0h s THR 377 Ca 0.18 -0.72 -0.06 0.00 0.31 0.00 0.00 61.69 61.40 1g0h s THR 377 Cb -0.15 -1.51 0.01 0.00 0.01 0.00 0.00 72.50 70.86 1g0h s THR 377 CO 0.08 0.47 0.06 -0.69 -0.69 0.00 0.00 174.62 173.85 1g0h s VAL 378 N 1.08 3.84 -0.23 3.82 1.01 -0.21 0.06 120.40 129.77 1g0h s VAL 378 Ca -0.04 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.19 1g0h s VAL 378 Cb -0.14 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.25 1g0h s VAL 378 CO -0.04 0.13 0.08 -0.69 0.00 0.00 0.00 175.10 174.58 1g0h s VAL 379 N 1.49 4.54 -0.01 2.92 1.01 -0.54 -1.67 120.40 128.14 1g0h s VAL 379 Ca 0.03 -0.10 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1g0h s VAL 379 Cb -0.17 -3.11 -0.00 0.00 0.00 0.00 0.00 36.38 33.10 1g0h s VAL 379 CO 0.01 0.36 -0.04 0.27 0.00 0.00 0.00 175.10 175.70 1g0h s ILE 380 N 1.30 0.36 -0.35 2.22 -4.36 -0.07 -1.54 121.20 118.75 1g0h s ILE 380 Ca 0.05 -0.18 -0.01 0.00 -0.26 0.00 0.00 60.65 60.25 1g0h s ILE 380 Cb -0.15 -0.31 0.08 0.00 1.25 0.00 0.00 42.46 43.33 1g0h s ILE 380 CO 0.04 0.11 0.09 -0.62 0.24 0.00 0.00 174.94 174.79 1g0h s ASP 381 N -0.03 5.00 0.33 4.36 3.68 -0.67 -3.00 116.67 126.34 1g0h s ASP 381 Ca 0.01 -1.72 0.11 0.00 2.13 0.00 0.00 52.55 53.08 1g0h s ASP 381 Cb -0.03 -1.74 0.96 0.00 -1.45 0.00 0.00 42.92 40.66 1g0h s ASP 381 CO -0.00 -0.39 1.69 -0.65 0.13 0.00 0.00 175.17 175.95 1g0h h PRO 382 N 7.95 0.43 -3.27 4.34 0.11 -1.89 0.46 132.00 140.13 1g0h h PRO 382 Ca -0.15 -0.03 -0.37 0.00 0.11 0.00 0.00 66.00 65.56 1g0h h PRO 382 Cb 1.05 -0.10 -0.39 0.00 0.11 0.00 0.00 31.00 31.67 1g0h h PRO 382 CO 0.59 0.28 -0.73 0.42 -0.21 0.00 0.00 178.00 178.35 1g0h s ILE 383 N -5.74 -0.12 -0.32 4.15 -1.09 -1.26 -4.13 121.20 112.69 1g0h s ILE 383 Ca -0.10 0.36 -0.10 0.00 -2.23 0.00 0.00 60.65 58.58 1g0h s ILE 383 Cb 0.28 -0.21 -0.00 0.00 -1.58 0.00 0.00 42.46 40.96 1g0h s ILE 383 CO 0.79 0.13 0.17 -0.62 -1.23 0.00 0.00 174.94 174.18 1g0h s ASP 384 N 2.17 5.62 0.00 3.58 2.15 0.34 -4.43 116.67 126.11 1g0h s ASP 384 Ca 0.05 -0.61 0.00 0.00 0.43 0.00 0.00 52.55 52.42 1g0h s ASP 384 Cb -0.12 -2.01 0.00 0.00 -0.30 0.00 0.00 42.92 40.48 1g0h s ASP 384 CO -0.04 -0.23 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 1g0h n GLY 385 N 4.99 0.82 0.21 2.66 0.00 -1.26 -0.04 105.19 112.57 1g0h n GLY 385 Ca -0.13 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.82 1g0h n GLY 385 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1g0h h SER 386 N 0.00 -0.77 -0.66 1.61 0.02 -1.89 -1.42 113.55 110.43 1g0h h SER 386 Ca 0.00 0.09 0.06 0.00 -0.84 0.00 0.00 61.79 61.10 1g0h h SER 386 Cb 0.00 0.30 -0.08 0.00 0.14 0.00 0.00 62.40 62.76 1g0h h SER 386 CO 0.00 -0.22 -0.39 0.33 -1.14 0.00 0.00 176.83 175.41 1g0h n PHE 387 N -3.85 -0.29 -0.34 3.45 -0.00 -1.26 0.17 117.46 115.34 1g0h n PHE 387 Ca -0.03 0.83 0.12 0.00 -0.00 0.00 0.00 57.45 58.36 1g0h n PHE 387 Cb 0.17 -0.54 0.32 0.00 -0.00 0.00 0.00 39.48 39.43 1g0h n PHE 387 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.76 175.85 1g0h h ASN 388 N 0.00 0.79 -0.28 -2.13 2.35 -1.82 -1.43 115.58 113.06 1g0h h ASN 388 Ca 0.11 0.07 -0.05 0.00 -0.55 0.00 0.00 56.30 55.88 1g0h h ASN 388 Cb 0.27 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1g0h h ASN 388 CO -0.62 0.34 -0.01 0.15 -1.65 0.00 0.00 177.43 175.64 1g0h h PHE 389 N 0.80 0.56 0.00 1.19 3.57 0.28 1.50 116.94 124.84 1g0h h PHE 389 Ca 0.53 -0.10 0.00 0.00 3.53 0.00 0.00 57.97 61.93 1g0h h PHE 389 Cb 0.78 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.37 1g0h h PHE 389 CO -0.00 0.67 -0.49 0.97 -2.23 0.00 0.00 178.31 177.23 1g0h h ILE 390 N 0.29 0.00 -0.44 1.41 2.10 -0.88 -0.17 117.51 119.82 1g0h h ILE 390 Ca 0.08 -0.59 0.00 0.00 1.08 0.00 0.00 64.86 65.42 1g0h h ILE 390 Cb 0.45 1.29 0.00 0.00 -1.09 0.00 0.00 36.82 37.47 1g0h h ILE 390 CO 0.02 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 177.68 1g0h n ASN 391 N -2.30 3.00 -2.23 2.19 3.02 -0.55 -3.61 115.26 114.78 1g0h n ASN 391 Ca 0.03 -2.19 -0.20 0.00 -0.03 0.00 0.00 54.58 52.19 1g0h n ASN 391 Cb 0.46 -0.41 -0.02 0.00 -0.61 0.00 0.00 39.78 39.20 1g0h n ASN 391 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g0h n GLY 392 N 0.97 -0.20 3.59 7.41 0.00 -0.60 -4.88 105.19 111.47 1g0h n GLY 392 Ca 0.16 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1g0h n GLY 392 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1g0h s ILE 393 N -2.98 4.98 -0.84 -0.61 1.01 0.50 -4.93 121.20 118.32 1g0h s ILE 393 Ca 0.00 0.74 -0.07 0.00 0.00 0.00 0.00 60.65 61.31 1g0h s ILE 393 Cb 0.00 -3.96 -0.15 0.00 0.01 0.00 0.00 42.46 38.36 1g0h s ILE 393 CO 0.00 -0.12 2.99 -0.81 0.00 0.00 0.00 174.94 177.00 1g0h n PRO 394 N 5.79 2.67 -3.57 2.79 -0.04 -1.26 -4.12 135.00 137.25 1g0h n PRO 394 Ca -0.02 -1.54 -0.29 0.00 -0.04 0.00 0.00 63.50 61.60 1g0h n PRO 394 Cb 0.49 -2.39 -0.15 0.00 -0.04 0.00 0.00 33.50 31.41 1g0h n PRO 394 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1g0h s PHE 395 N 1.94 0.60 0.12 0.54 2.19 -1.26 -4.96 117.98 117.14 1g0h s PHE 395 Ca 0.61 -1.07 -0.25 0.00 0.33 0.00 0.00 56.93 56.55 1g0h s PHE 395 Cb 0.21 -1.05 0.07 0.00 -1.31 0.00 0.00 43.02 40.94 1g0h s PHE 395 CO -0.03 -0.84 0.80 -0.59 1.83 0.00 0.00 175.22 176.39 1g0h s PHE 396 N 1.96 -0.33 -0.23 10.12 -0.12 -1.26 -4.60 117.98 123.52 1g0h s PHE 396 Ca 0.10 0.09 -0.26 0.00 -0.05 0.00 0.00 56.93 56.80 1g0h s PHE 396 Cb -0.17 0.59 0.09 0.00 -0.63 0.00 0.00 43.02 42.91 1g0h s PHE 396 CO -0.33 -0.79 0.83 0.00 -0.05 0.00 0.00 175.22 174.87 1g0h s ALA 397 N -3.45 -1.85 -0.08 1.99 0.00 0.94 -4.40 121.76 114.91 1g0h s ALA 397 Ca 0.06 1.85 -0.29 0.00 0.00 0.00 0.00 51.96 53.58 1g0h s ALA 397 Cb -0.02 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 22.03 1g0h s ALA 397 CO -0.05 -0.31 0.98 0.12 0.00 0.00 0.00 175.76 176.50 1g0h s PHE 398 N 0.00 3.55 -0.14 0.00 5.36 -0.63 0.13 117.98 126.25 1g0h s PHE 398 Ca -0.01 1.59 -0.01 0.00 -0.96 0.00 0.00 56.93 57.54 1g0h s PHE 398 Cb -0.04 -3.15 -0.02 0.00 -0.34 0.00 0.00 43.02 39.47 1g0h s PHE 398 CO 0.00 -0.16 -0.11 0.00 -1.46 0.00 0.00 175.22 173.49 1g0h s PHE 400 N 0.39 -0.20 -0.08 0.00 5.36 0.20 -1.67 117.98 121.98 1g0h s PHE 400 Ca -0.09 0.03 0.04 0.00 -0.96 0.00 0.00 56.93 55.95 1g0h s PHE 400 Cb -0.15 -0.45 0.00 0.00 -0.34 0.00 0.00 43.02 42.07 1g0h s PHE 400 CO 0.05 -0.65 -0.21 0.20 -1.46 0.00 0.00 175.22 173.15 1g0h s GLY 401 N 2.29 1.18 -0.18 13.12 0.00 -0.59 0.12 107.32 123.26 1g0h s GLY 401 Ca 0.07 -0.84 -0.04 0.00 0.00 0.00 0.00 44.72 43.91 1g0h s GLY 401 CO -0.16 -0.28 -0.03 0.14 0.00 0.00 0.00 173.10 172.77 1g0h s VAL 402 N 0.32 3.78 -0.03 1.40 1.01 0.34 -1.47 120.40 125.75 1g0h s VAL 402 Ca -0.15 -0.38 0.07 0.00 0.00 0.00 0.00 61.98 61.52 1g0h s VAL 402 Cb -0.16 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1g0h s VAL 402 CO 0.07 0.46 -0.24 -0.36 0.00 0.00 0.00 175.10 175.03 1g0h s PHE 403 N 0.81 2.41 -0.21 5.22 0.40 0.11 -0.81 117.98 125.91 1g0h s PHE 403 Ca -0.01 -0.40 -0.02 0.00 -0.60 0.00 0.00 56.93 55.91 1g0h s PHE 403 Cb -0.14 -1.53 0.01 0.00 0.51 0.00 0.00 43.02 41.86 1g0h s PHE 403 CO 0.02 -0.00 -0.11 0.21 0.70 0.00 0.00 175.22 176.03 1g0h s LYS 404 N -0.61 3.17 -1.32 0.44 2.20 -0.51 0.53 119.74 123.64 1g0h s LYS 404 Ca 0.10 -0.74 -0.01 0.00 -0.36 0.00 0.00 55.97 54.96 1g0h s LYS 404 Cb -0.10 -2.82 0.00 0.00 -1.51 0.00 0.00 37.83 33.40 1g0h s LYS 404 CO -0.00 -0.22 0.13 0.09 -0.36 0.00 0.00 175.35 174.99 1g0h n ASN 405 N 4.71 -4.86 -3.91 1.43 4.13 0.91 -2.10 115.26 115.57 1g0h n ASN 405 Ca -0.19 -0.07 -0.28 0.00 1.68 0.00 0.00 54.58 55.71 1g0h n ASN 405 Cb 0.50 -3.90 0.01 0.00 -1.54 0.00 0.00 39.78 34.85 1g0h n ASN 405 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1g0h n ASN 406 N -1.19 -2.94 -4.11 6.41 3.02 -1.26 -4.99 115.26 110.19 1g0h n ASN 406 Ca -0.16 -0.86 -0.22 0.00 -0.03 0.00 0.00 54.58 53.31 1g0h n ASN 406 Cb 0.63 -3.64 -0.15 0.00 -0.61 0.00 0.00 39.78 36.01 1g0h n ASN 406 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1g0h s GLU 407 N -6.49 1.09 0.37 3.52 2.56 -0.89 -5.11 118.70 113.76 1g0h s GLU 407 Ca 0.40 -0.53 -0.28 0.00 0.00 0.00 0.00 54.97 54.56 1g0h s GLU 407 Cb -0.20 -1.07 -0.11 0.00 2.00 0.00 0.00 34.13 34.75 1g0h s GLU 407 CO 0.85 0.29 1.46 -1.25 -0.56 0.00 0.00 175.26 176.04 1g0h s PRO 408 N -0.44 4.13 0.00 4.30 0.04 -1.26 -1.42 135.00 140.35 1g0h s PRO 408 Ca 0.05 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.60 1g0h s PRO 408 Cb -0.06 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.51 1g0h s PRO 408 CO -0.00 -0.49 0.00 0.98 0.04 0.00 0.00 177.00 177.53 1g0h n TYR 409 N 0.49 0.00 -3.69 0.56 9.36 -0.34 -4.69 117.16 118.84 1g0h n TYR 409 Ca 0.01 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.09 1g0h n TYR 409 Cb 0.40 0.23 -0.08 0.00 -0.63 0.00 0.00 39.34 39.25 1g0h n TYR 409 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1g0h s TYR 410 N -1.92 -0.39 -0.02 2.98 6.14 0.01 0.17 117.35 124.31 1g0h s TYR 410 Ca 0.00 0.77 0.00 0.00 0.64 0.00 0.00 57.07 58.48 1g0h s TYR 410 Cb 0.00 0.19 0.03 0.00 0.42 0.00 0.00 41.96 42.60 1g0h s TYR 410 CO 0.00 -0.39 0.02 0.20 0.64 0.00 0.00 175.55 176.02 1g0h s GLY 411 N -0.79 0.16 -0.05 8.97 0.00 -0.98 0.13 107.32 114.76 1g0h s GLY 411 Ca -0.09 0.24 0.05 0.00 0.00 0.00 0.00 44.72 44.93 1g0h s GLY 411 CO 0.04 0.66 -0.20 -2.27 0.00 0.00 0.00 173.10 171.34 1g0h s LEU 412 N 1.06 2.40 -0.15 0.66 2.96 0.12 -1.94 118.68 123.79 1g0h s LEU 412 Ca -0.09 -0.35 -0.03 0.00 -0.22 0.00 0.00 54.13 53.43 1g0h s LEU 412 Cb -0.13 -1.46 0.05 0.00 0.50 0.00 0.00 46.19 45.15 1g0h s LEU 412 CO -0.02 0.30 0.06 -0.89 -1.32 0.00 0.00 176.35 174.47 1g0h s THR 413 N -0.46 0.19 -0.35 3.68 2.01 0.04 -0.63 115.64 120.13 1g0h s THR 413 Ca 0.05 -0.20 -0.11 0.00 0.31 0.00 0.00 61.69 61.74 1g0h s THR 413 Cb -0.12 -0.68 0.00 0.00 0.01 0.00 0.00 72.50 71.71 1g0h s THR 413 CO 0.01 -0.13 0.21 -0.47 -0.69 0.00 0.00 174.62 173.55 1g0h s TYR 414 N 2.02 3.21 -0.92 4.92 6.04 -0.42 -0.98 117.35 131.23 1g0h s TYR 414 Ca 0.02 -0.58 -0.18 0.00 0.04 0.00 0.00 57.07 56.36 1g0h s TYR 414 Cb -0.15 -2.43 0.14 0.00 -1.04 0.00 0.00 41.96 38.47 1g0h s TYR 414 CO -0.07 -0.50 1.10 -2.00 -1.54 0.00 0.00 175.55 172.54 1g0h s GLU 415 N 1.63 3.60 0.12 4.97 2.12 -0.65 -1.61 118.70 128.87 1g0h s GLU 415 Ca 0.04 -1.81 -0.28 0.00 0.36 0.00 0.00 54.97 53.29 1g0h s GLU 415 Cb -0.18 -4.87 -0.09 0.00 0.26 0.00 0.00 34.13 29.25 1g0h s GLU 415 CO 0.08 -1.74 1.47 0.74 -0.54 0.00 0.00 175.26 175.27 1g0h h PHE 416 N 8.76 -1.52 0.00 5.30 -1.00 -1.86 0.20 116.94 126.83 1g0h h PHE 416 Ca 0.15 0.08 0.00 0.00 2.81 0.00 0.00 57.97 61.01 1g0h h PHE 416 Cb 1.03 0.72 0.00 0.00 3.61 0.00 0.00 35.95 41.31 1g0h h PHE 416 CO 1.15 -0.40 0.00 1.28 -1.61 0.00 0.00 178.31 178.74 1g0h n LEU 417 N -4.99 0.45 -0.00 1.54 4.77 -1.26 -0.28 117.00 117.23 1g0h n LEU 417 Ca -0.02 0.62 0.09 0.00 -0.03 0.00 0.00 56.01 56.68 1g0h n LEU 417 Cb 0.28 -0.57 -0.13 0.00 -2.33 0.00 0.00 43.42 40.67 1g0h n LEU 417 CO -0.03 -0.50 -0.42 0.41 -1.33 0.00 0.00 177.39 175.52 1g0h n THR 418 N -2.01 0.00 -3.86 -5.08 -1.04 -0.98 -4.98 114.28 96.32 1g0h n THR 418 Ca 0.02 -0.27 -0.28 0.00 -2.04 0.00 0.00 64.05 61.48 1g0h n THR 418 Cb 0.19 0.48 0.03 0.00 -1.82 0.00 0.00 70.33 69.21 1g0h n THR 418 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1g0h n LYS 419 N -1.84 -5.36 -3.57 -2.82 5.02 0.67 -4.94 118.16 105.32 1g0h n LYS 419 Ca -0.00 0.60 -0.40 0.00 -2.02 0.00 0.00 58.31 56.49 1g0h n LYS 419 Cb 0.40 -5.39 -0.11 0.00 -0.02 0.00 0.00 35.03 29.91 1g0h n LYS 419 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1g0h s SER 420 N -3.60 5.91 -0.38 4.39 0.01 -0.96 -5.00 113.70 114.08 1g0h s SER 420 Ca 0.48 -0.41 -0.20 0.00 1.31 0.00 0.00 55.95 57.13 1g0h s SER 420 Cb -0.24 -2.10 0.01 0.00 0.21 0.00 0.00 66.02 63.90 1g0h s SER 420 CO 0.83 -0.21 0.62 -0.36 0.41 0.00 0.00 173.24 174.53 1g0h s PHE 421 N 1.70 3.13 -0.18 2.43 0.40 -1.26 -1.64 117.98 122.55 1g0h s PHE 421 Ca 0.06 0.23 -0.14 0.00 -0.60 0.00 0.00 56.93 56.48 1g0h s PHE 421 Cb -0.17 -3.17 -0.05 0.00 0.51 0.00 0.00 43.02 40.14 1g0h s PHE 421 CO 0.09 -0.68 0.29 0.71 0.70 0.00 0.00 175.22 176.34 1g0h s TYR 422 N 2.70 3.41 0.15 0.36 1.51 -0.15 -0.56 117.35 124.78 1g0h s TYR 422 Ca 0.23 0.53 -0.20 0.00 -1.01 0.00 0.00 57.07 56.63 1g0h s TYR 422 Cb -0.14 -2.37 0.05 0.00 -0.11 0.00 0.00 41.96 39.39 1g0h s TYR 422 CO 0.16 0.15 0.51 -1.83 -1.11 0.00 0.00 175.55 173.43 1g0h s GLU 423 N 0.77 1.20 -0.20 -0.62 -1.05 0.55 -0.78 118.70 118.57 1g0h s GLU 423 Ca 0.15 -0.60 -0.11 0.00 -0.15 0.00 0.00 54.97 54.26 1g0h s GLU 423 Cb -0.13 0.54 0.07 0.00 -0.44 0.00 0.00 34.13 34.16 1g0h s GLU 423 CO 0.05 -0.50 0.49 0.00 0.95 0.00 0.00 175.26 176.24 1g0h s ALA 424 N -3.78 -1.29 0.06 -0.84 0.00 -0.82 0.18 121.76 115.27 1g0h s ALA 424 Ca 0.02 1.79 -0.22 0.00 0.00 0.00 0.00 51.96 53.55 1g0h s ALA 424 Cb 0.00 -1.09 -0.06 0.00 0.00 0.00 0.00 23.12 21.97 1g0h s ALA 424 CO -0.12 -0.32 0.65 0.71 0.00 0.00 0.00 175.76 176.68 1g0h s TYR 425 N 1.52 3.78 0.03 0.00 2.02 -1.25 -2.32 117.35 121.13 1g0h s TYR 425 Ca -0.09 1.36 -0.35 0.00 -0.37 0.00 0.00 57.07 57.62 1g0h s TYR 425 Cb -0.08 -2.64 -0.13 0.00 -0.40 0.00 0.00 41.96 38.71 1g0h s TYR 425 CO -0.15 0.45 1.70 1.17 -1.57 0.00 0.00 175.55 177.15 1g0h n LYS 426 N 2.18 2.04 0.00 -0.62 0.00 0.44 -0.06 118.16 122.13 1g0h n LYS 426 Ca -0.07 0.74 0.00 0.00 0.00 0.00 0.00 58.31 58.98 1g0h n LYS 426 Cb 0.50 -2.53 0.00 0.00 0.00 0.00 0.00 35.03 33.00 1g0h n LYS 426 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1g0h n GLY 427 N 3.80 2.40 0.71 3.14 0.00 -1.26 -4.90 105.19 109.08 1g0h n GLY 427 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.32 1g0h n GLY 427 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1g0h n LYS 428 N -2.00 1.74 0.00 1.61 0.00 0.91 -5.09 118.16 115.33 1g0h n LYS 428 Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 58.31 56.83 1g0h n LYS 428 Cb 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 35.03 33.64 1g0h n LYS 428 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1g0h n GLY 429 N 1.20 2.13 3.77 3.14 0.00 -1.24 -4.85 105.19 109.34 1g0h n GLY 429 Ca 0.11 -1.85 -0.36 0.00 0.00 0.00 0.00 46.02 43.92 1g0h n GLY 429 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g0h s ALA 430 N -2.73 3.58 0.19 4.61 0.00 -1.21 -3.80 121.76 122.40 1g0h s ALA 430 Ca 0.00 -0.72 0.11 0.00 0.00 0.00 0.00 51.96 51.35 1g0h s ALA 430 Cb 0.00 -1.79 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 1g0h s ALA 430 CO 0.00 0.53 -0.22 0.71 0.00 0.00 0.00 175.76 176.77 1g0h s TYR 431 N -0.72 2.19 -0.31 0.00 1.51 0.49 -0.89 117.35 119.62 1g0h s TYR 431 Ca 0.12 -0.38 -0.00 0.00 -1.01 0.00 0.00 57.07 55.80 1g0h s TYR 431 Cb -0.12 -1.08 0.10 0.00 -0.11 0.00 0.00 41.96 40.75 1g0h s TYR 431 CO 0.03 0.48 0.09 -1.17 -1.11 0.00 0.00 175.55 173.86 1g0h s LEU 432 N -2.72 2.41 -1.53 -1.29 2.96 -0.11 -0.33 118.68 118.07 1g0h s LEU 432 Ca 0.20 -1.64 -0.02 0.00 -0.22 0.00 0.00 54.13 52.45 1g0h s LEU 432 Cb -0.07 -0.92 0.00 0.00 0.50 0.00 0.00 46.19 45.70 1g0h s LEU 432 CO 0.09 -0.40 0.30 0.59 -1.32 0.00 0.00 176.35 175.61 1g0h n ASN 433 N 4.80 -5.65 0.00 3.68 3.02 0.28 -2.44 115.26 118.96 1g0h n ASN 433 Ca -0.02 -0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 1g0h n ASN 433 Cb 0.42 -4.57 0.00 0.00 -0.61 0.00 0.00 39.78 35.02 1g0h n ASN 433 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g0h n GLY 434 N -1.26 3.05 3.72 7.41 0.00 -1.26 -5.02 105.19 111.83 1g0h n GLY 434 Ca -0.16 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1g0h n GLY 434 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1g0h s ARG 435 N -0.29 4.58 0.19 1.61 0.52 -1.02 -4.99 118.95 119.54 1g0h s ARG 435 Ca 0.00 1.35 -0.31 0.00 -0.52 0.00 0.00 55.73 56.25 1g0h s ARG 435 Cb 0.00 -3.43 -0.09 0.00 0.52 0.00 0.00 34.95 31.95 1g0h s ARG 435 CO 0.00 0.06 1.45 0.21 0.02 0.00 0.00 175.30 177.04 1g0h s LYS 436 N 0.63 4.27 0.36 3.54 2.20 -1.26 -0.93 119.74 128.55 1g0h s LYS 436 Ca 0.48 2.25 0.08 0.00 -0.36 0.00 0.00 55.97 58.42 1g0h s LYS 436 Cb -0.21 -3.16 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 1g0h s LYS 436 CO 0.27 -0.46 0.16 0.96 -0.36 0.00 0.00 175.35 175.92 1g0h s ILE 437 N 0.58 2.81 -0.26 5.43 -4.36 -0.07 -4.88 121.20 120.45 1g0h s ILE 437 Ca 0.63 -1.69 -0.25 0.00 -0.26 0.00 0.00 60.65 59.08 1g0h s ILE 437 Cb -0.41 -2.97 0.08 0.00 1.25 0.00 0.00 42.46 40.41 1g0h s ILE 437 CO 0.36 -0.13 0.78 -0.75 0.24 0.00 0.00 174.94 175.44 1g0h s LYS 438 N -3.87 0.79 0.93 0.37 2.20 -1.23 -4.54 119.74 114.38 1g0h s LYS 438 Ca 0.39 0.89 -0.13 0.00 -0.36 0.00 0.00 55.97 56.76 1g0h s LYS 438 Cb -0.01 0.38 0.03 0.00 -1.51 0.00 0.00 37.83 36.72 1g0h s LYS 438 CO 0.23 -0.10 0.42 1.33 -0.36 0.00 0.00 175.35 176.86 1g0h n VAL 439 N 2.52 0.18 -2.18 4.02 0.24 -0.71 -4.08 118.33 118.32 1g0h n VAL 439 Ca -0.14 -0.21 -0.41 0.00 -2.04 0.00 0.00 64.34 61.54 1g0h n VAL 439 Cb 0.55 -0.63 -0.03 0.00 -1.47 0.00 0.00 33.84 32.26 1g0h n VAL 439 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1g0h s LYS 440 N -3.56 4.39 0.23 7.34 2.20 -1.26 -4.83 119.74 124.25 1g0h s LYS 440 Ca 0.58 2.11 -0.30 0.00 -0.36 0.00 0.00 55.97 58.00 1g0h s LYS 440 Cb -0.22 -3.14 -0.10 0.00 -1.51 0.00 0.00 37.83 32.85 1g0h s LYS 440 CO 0.67 -0.21 1.48 -0.51 -0.36 0.00 0.00 175.35 176.42 1g0h s ASP 441 N -0.04 6.62 0.23 1.43 -0.00 -1.26 -4.86 116.67 118.78 1g0h s ASP 441 Ca 0.53 2.67 -0.30 0.00 -0.00 0.00 0.00 52.55 55.46 1g0h s ASP 441 Cb -0.38 -2.62 -0.10 0.00 -0.00 0.00 0.00 42.92 39.83 1g0h s ASP 441 CO 0.44 -0.75 1.38 0.12 -0.00 0.00 0.00 175.17 176.36 1g0h s PHE 442 N 0.27 3.13 -0.22 4.23 2.19 -1.26 -5.02 117.98 121.30 1g0h s PHE 442 Ca 0.62 1.13 -0.04 0.00 0.33 0.00 0.00 56.93 58.98 1g0h s PHE 442 Cb -0.43 -3.72 0.12 0.00 -1.31 0.00 0.00 43.02 37.68 1g0h s PHE 442 CO 0.41 -2.28 0.35 1.21 1.83 0.00 0.00 175.22 176.73 1g0h s ASN 443 N 0.30 0.38 0.39 6.13 3.84 -1.26 -5.05 114.94 119.67 1g0h s ASN 443 Ca 0.58 0.28 0.28 0.00 0.21 0.00 0.00 52.86 54.21 1g0h s ASN 443 Cb -0.39 0.99 1.22 0.00 -0.55 0.00 0.00 41.25 42.51 1g0h s ASN 443 CO 0.42 -0.29 1.84 1.55 -2.79 0.00 0.00 177.10 177.83 1g0h h PRO 444 N 8.21 0.00 -0.40 0.43 0.13 -1.97 0.01 132.00 138.41 1g0h h PRO 444 Ca -0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.95 1g0h h PRO 444 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1g0h h PRO 444 CO 0.24 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.10 1g0h n ASN 445 N -2.59 3.11 -2.74 1.44 5.03 -1.26 -4.38 115.26 113.86 1g0h n ASN 445 Ca 0.01 -1.95 -0.04 0.00 0.87 0.00 0.00 54.58 53.47 1g0h n ASN 445 Cb 0.23 -0.26 0.06 0.00 -1.02 0.00 0.00 39.78 38.79 1g0h n ASN 445 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1g0h n ASN 446 N 1.24 0.92 -4.70 6.41 4.05 -0.02 -4.83 115.26 118.34 1g0h n ASN 446 Ca 0.19 -2.34 -0.42 0.00 0.45 0.00 0.00 54.58 52.46 1g0h n ASN 446 Cb 0.54 -0.25 -0.03 0.00 1.23 0.00 0.00 39.78 41.27 1g0h n ASN 446 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 1g0h s ILE 447 N -2.81 4.46 -0.20 -1.44 1.01 -1.18 -4.83 121.20 116.21 1g0h s ILE 447 Ca 0.25 1.76 0.01 0.00 0.00 0.00 0.00 60.65 62.68 1g0h s ILE 447 Cb 0.39 -4.13 0.03 0.00 0.01 0.00 0.00 42.46 38.76 1g0h s ILE 447 CO -0.02 0.07 -0.16 -0.69 0.00 0.00 0.00 174.94 174.13 1g0h s VAL 448 N 1.57 2.03 0.10 2.92 1.01 -1.26 -0.05 120.40 126.72 1g0h s VAL 448 Ca 0.54 -1.12 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 1g0h s VAL 448 Cb -0.24 -1.94 -0.04 0.00 0.00 0.00 0.00 36.38 34.16 1g0h s VAL 448 CO 0.25 0.35 0.02 0.27 0.00 0.00 0.00 175.10 175.98 1g0h s ILE 449 N 1.26 0.22 0.03 2.22 -4.36 -0.83 0.31 121.20 120.04 1g0h s ILE 449 Ca 0.01 -1.88 0.06 0.00 -0.26 0.00 0.00 60.65 58.58 1g0h s ILE 449 Cb -0.15 -1.85 -0.02 0.00 1.25 0.00 0.00 42.46 41.68 1g0h s ILE 449 CO -0.10 -0.67 -0.19 -0.55 0.24 0.00 0.00 174.94 173.67 1g0h s SER 450 N -3.01 2.20 0.11 4.36 0.15 -0.63 -1.98 113.70 114.90 1g0h s SER 450 Ca 0.18 -0.45 -0.22 0.00 0.70 0.00 0.00 55.95 56.16 1g0h s SER 450 Cb 0.07 -0.19 0.06 0.00 -1.71 0.00 0.00 66.02 64.25 1g0h s SER 450 CO -0.02 0.15 0.55 -0.72 1.20 0.00 0.00 173.24 174.40 1g0h s TYR 451 N -0.69 -0.45 -0.34 3.44 -0.85 -1.26 -2.66 117.35 114.53 1g0h s TYR 451 Ca 0.06 0.35 -0.00 0.00 -0.52 0.00 0.00 57.07 56.96 1g0h s TYR 451 Cb -0.08 0.43 0.11 0.00 0.38 0.00 0.00 41.96 42.80 1g0h s TYR 451 CO 0.01 -0.75 0.14 0.71 -1.52 0.00 0.00 175.55 174.14 1g0h s TYR 452 N -3.21 1.67 0.30 -3.49 1.51 -0.82 -4.96 117.35 108.35 1g0h s TYR 452 Ca -0.01 -1.88 -0.12 0.00 -1.01 0.00 0.00 57.07 54.05 1g0h s TYR 452 Cb -0.00 -1.68 -0.08 0.00 -0.11 0.00 0.00 41.96 40.09 1g0h s TYR 452 CO -0.08 -0.85 0.66 -1.25 -1.11 0.00 0.00 175.55 172.92 1g0h s PRO 453 N 1.28 3.87 0.95 -1.71 0.04 -1.26 -2.11 135.00 136.07 1g0h s PRO 453 Ca 0.12 0.45 -0.14 0.00 0.04 0.00 0.00 61.00 61.48 1g0h s PRO 453 Cb -0.19 -2.52 0.16 0.00 0.04 0.00 0.00 34.50 31.99 1g0h s PRO 453 CO -0.17 0.19 1.16 -1.54 0.04 0.00 0.00 177.00 176.68 1g0h s SER 454 N -2.48 3.13 0.00 6.66 1.04 -1.25 -4.47 113.70 116.32 1g0h s SER 454 Ca 0.51 0.83 0.00 0.00 0.48 0.00 0.00 55.95 57.77 1g0h s SER 454 Cb -0.11 -1.30 0.00 0.00 0.10 0.00 0.00 66.02 64.71 1g0h s SER 454 CO 0.21 -2.78 1.53 1.17 0.98 0.00 0.00 173.24 174.36 1g0h n LYS 455 N -3.89 0.83 0.00 4.02 4.81 -1.26 -3.41 118.16 119.26 1g0h n LYS 455 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.52 1g0h n LYS 455 Cb 0.59 -1.08 0.00 0.00 0.02 0.00 0.00 35.03 34.56 1g0h n LYS 455 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1g0h n LYS 456 N 1.43 5.46 -2.43 1.64 4.01 -1.26 -5.10 118.16 121.90 1g0h n LYS 456 Ca 0.00 0.00 -0.38 0.00 -0.51 0.00 0.00 58.31 57.42 1g0h n LYS 456 Cb 0.42 -0.53 -0.03 0.00 -0.51 0.00 0.00 35.03 34.37 1g0h n LYS 456 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1g0h s ILE 457 N -0.15 3.46 -1.18 -0.18 1.09 -1.22 -4.92 121.20 118.10 1g0h s ILE 457 Ca 0.00 1.20 -0.20 0.00 -1.10 0.00 0.00 60.65 60.55 1g0h s ILE 457 Cb 0.00 -3.66 0.03 0.00 -1.06 0.00 0.00 42.46 37.77 1g0h s ILE 457 CO 0.00 0.09 1.71 -0.62 -0.10 0.00 0.00 174.94 176.02 1g0h s ASP 458 N -1.31 6.36 0.35 3.58 2.15 -1.26 -4.76 116.67 121.79 1g0h s ASP 458 Ca 0.56 -1.94 0.11 0.00 0.43 0.00 0.00 52.55 51.70 1g0h s ASP 458 Cb -0.27 -2.58 0.88 0.00 -0.30 0.00 0.00 42.92 40.66 1g0h s ASP 458 CO 0.34 -1.66 1.82 -0.07 -0.17 0.00 0.00 175.17 175.42 1g0h h LEU 459 N 13.79 0.63 0.67 -1.34 3.38 -1.95 1.26 115.31 131.74 1g0h h LEU 459 Ca 0.32 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.33 1g0h h LEU 459 Cb 0.93 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 1g0h h LEU 459 CO 1.40 0.25 -0.43 -0.33 0.09 0.00 0.00 178.44 179.42 1g0h h GLU 460 N 0.62 -1.00 -0.73 1.13 4.39 -1.98 0.68 114.58 117.69 1g0h h GLU 460 Ca 0.52 0.07 -0.05 0.00 0.34 0.00 0.00 59.36 60.24 1g0h h GLU 460 Cb 0.99 0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 29.84 1g0h h GLU 460 CO -0.28 -0.67 0.26 -0.22 -1.16 0.00 0.00 179.01 176.95 1g0h h LYS 461 N -1.04 1.11 0.01 2.33 3.64 -1.43 -1.16 116.57 120.03 1g0h h LYS 461 Ca -0.08 -0.22 0.03 0.00 -1.27 0.00 0.00 60.65 59.11 1g0h h LYS 461 Cb 0.84 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.44 1g0h h LYS 461 CO 0.07 0.93 -0.32 1.25 -2.27 0.00 0.00 179.45 179.11 1g0h h LEU 462 N 1.06 -0.97 -1.46 5.20 5.85 0.17 0.93 115.31 126.10 1g0h h LEU 462 Ca 0.24 0.12 0.00 0.00 0.84 0.00 0.00 57.88 59.08 1g0h h LEU 462 Cb 0.26 0.39 0.00 0.00 0.37 0.00 0.00 40.66 41.67 1g0h h LEU 462 CO -0.01 -0.39 0.00 0.03 -0.34 0.00 0.00 178.44 177.73 1g0h h ARG 463 N -0.48 0.00 0.00 1.25 3.08 0.63 -2.22 114.38 116.64 1g0h h ARG 463 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1g0h h ARG 463 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1g0h h ARG 463 CO -0.26 0.00 -0.17 -0.91 -1.07 0.00 0.00 179.97 177.56 1g0h h ASN 464 N 0.00 0.00 0.12 7.04 2.35 0.45 -3.32 115.58 122.22 1g0h h ASN 464 Ca 0.00 -0.01 -0.31 0.00 -0.55 0.00 0.00 56.30 55.42 1g0h h ASN 464 Cb 0.26 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 1g0h h ASN 464 CO 0.00 0.01 -1.65 0.11 -1.65 0.00 0.00 177.43 174.25 1g0h h LYS 465 N 0.00 0.25 -6.68 0.81 1.79 -0.83 -3.48 116.57 108.43 1g0h h LYS 465 Ca 0.00 -0.42 -0.51 0.00 -2.18 0.00 0.00 60.65 57.54 1g0h h LYS 465 Cb 0.92 0.16 -0.00 0.00 -1.58 0.00 0.00 32.23 31.73 1g0h h LYS 465 CO 0.00 1.20 -0.00 0.14 -1.08 0.00 0.00 179.45 179.71 1g0h s VAL 466 N -2.51 4.89 -0.13 0.50 -7.23 -1.17 -4.75 120.40 110.01 1g0h s VAL 466 Ca -0.21 0.37 0.19 0.00 -1.81 0.00 0.00 61.98 60.51 1g0h s VAL 466 Cb 0.05 -3.73 -0.22 0.00 0.56 0.00 0.00 36.38 33.05 1g0h s VAL 466 CO 0.76 -0.42 0.52 1.17 -0.31 0.00 0.00 175.10 176.83 1g0h n LYS 467 N -1.10 0.65 -3.92 4.82 4.81 0.92 -4.90 118.16 119.44 1g0h n LYS 467 Ca 0.01 0.05 -0.10 0.00 -0.87 0.00 0.00 58.31 57.39 1g0h n LYS 467 Cb 0.54 -1.65 -0.11 0.00 0.02 0.00 0.00 35.03 33.83 1g0h n LYS 467 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1g0h s ARG 468 N -2.96 0.34 0.02 1.64 0.52 0.21 -4.97 118.95 113.75 1g0h s ARG 468 Ca -0.06 -0.42 0.07 0.00 -0.52 0.00 0.00 55.73 54.80 1g0h s ARG 468 Cb 0.09 0.13 -0.02 0.00 0.52 0.00 0.00 34.95 35.68 1g0h s ARG 468 CO 0.84 -0.07 -0.20 0.08 0.02 0.00 0.00 175.30 175.97 1g0h s VAL 469 N -1.19 1.63 -0.08 3.52 1.01 -1.26 -1.96 120.40 122.07 1g0h s VAL 469 Ca -0.13 -1.05 -0.04 0.00 0.00 0.00 0.00 61.98 60.76 1g0h s VAL 469 Cb -0.08 -1.39 0.03 0.00 0.00 0.00 0.00 36.38 34.95 1g0h s VAL 469 CO 0.00 0.31 0.18 -0.13 0.00 0.00 0.00 175.10 175.47 1g0h s ARG 470 N -0.86 0.15 -0.16 2.72 1.81 -0.84 -4.97 118.95 116.81 1g0h s ARG 470 Ca 0.08 0.38 -0.03 0.00 -1.72 0.00 0.00 55.73 54.43 1g0h s ARG 470 Cb -0.08 -0.08 0.05 0.00 -0.45 0.00 0.00 34.95 34.39 1g0h s ARG 470 CO 0.01 -0.12 0.05 0.42 -0.68 0.00 0.00 175.30 174.98 1g0h s ILE 471 N 0.89 0.24 -0.03 1.52 1.01 -1.26 -3.74 121.20 119.82 1g0h s ILE 471 Ca -0.07 -0.26 0.16 0.00 0.00 0.00 0.00 60.65 60.48 1g0h s ILE 471 Cb -0.08 -0.74 -0.25 0.00 0.01 0.00 0.00 42.46 41.40 1g0h s ILE 471 CO -0.05 -0.15 0.33 0.49 0.00 0.00 0.00 174.94 175.56 1g0h n PHE 472 N 5.16 0.00 -2.44 3.97 0.99 -1.26 -5.03 117.46 118.85 1g0h n PHE 472 Ca -0.08 0.00 -0.03 0.00 -0.00 0.00 0.00 57.45 57.34 1g0h n PHE 472 Cb 0.48 -0.40 0.01 0.00 -1.00 0.00 0.00 39.48 38.57 1g0h n PHE 472 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1g0h n GLY 473 N 1.61 0.50 3.01 1.37 0.00 -1.26 -4.91 105.19 105.52 1g0h n GLY 473 Ca -0.05 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1g0h n GLY 473 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g0h s ALA 474 N -3.05 -2.96 0.11 4.61 0.00 -1.26 -4.53 121.76 114.67 1g0h s ALA 474 Ca 0.04 0.41 -0.20 0.00 0.00 0.00 0.00 51.96 52.21 1g0h s ALA 474 Cb -0.02 -2.82 -0.08 0.00 0.00 0.00 0.00 23.12 20.21 1g0h s ALA 474 CO 0.12 -2.31 1.71 0.35 0.00 0.00 0.00 175.76 175.63 1g0h h PHE 475 N 6.17 0.28 -0.65 0.00 3.04 -1.92 0.26 116.94 124.11 1g0h h PHE 475 Ca 0.03 -0.01 0.13 0.00 3.98 0.00 0.00 57.97 62.10 1g0h h PHE 475 Cb 1.18 -0.09 -0.12 0.00 2.56 0.00 0.00 35.95 39.48 1g0h h PHE 475 CO 0.07 0.25 -0.15 0.78 -2.02 0.00 0.00 178.31 177.23 1g0h h GLY 476 N 0.23 0.49 1.47 2.40 0.00 -1.94 0.23 103.07 105.95 1g0h h GLY 476 Ca 0.07 0.21 -0.26 0.00 0.00 0.00 0.00 47.33 47.35 1g0h h GLY 476 CO -0.01 -0.25 -1.37 -2.00 0.00 0.00 0.00 176.54 172.91 1g0h h LEU 477 N 0.01 0.07 -0.45 3.11 5.85 -1.81 -3.25 115.31 118.83 1g0h h LEU 477 Ca 0.32 -0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.96 1g0h h LEU 477 Cb 0.49 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1g0h h LEU 477 CO -0.67 1.08 0.26 -0.33 -0.34 0.00 0.00 178.44 178.44 1g0h h GLU 478 N 0.01 0.51 -0.78 1.25 5.08 0.09 -1.73 114.58 119.01 1g0h h GLU 478 Ca -0.16 -0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.33 1g0h h GLU 478 Cb 1.91 -0.11 -0.15 0.00 0.50 0.00 0.00 28.75 30.89 1g0h h GLU 478 CO 0.12 0.34 -0.21 0.52 -1.00 0.00 0.00 179.01 178.77 1g0h h MET 479 N 0.52 -0.01 0.00 2.33 2.86 -0.60 0.72 114.93 120.75 1g0h h MET 479 Ca 0.18 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.82 1g0h h MET 479 Cb 0.03 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1g0h h MET 479 CO -0.09 -0.01 0.00 0.00 1.06 0.00 0.00 176.91 177.87 1g0h h TYR 481 N 0.00 0.19 -0.03 0.00 -1.99 0.72 0.09 116.97 115.95 1g0h h TYR 481 Ca 0.00 -0.08 -0.12 0.00 2.00 0.00 0.00 58.73 60.52 1g0h h TYR 481 Cb 0.16 -0.03 0.01 0.00 2.00 0.00 0.00 36.73 38.86 1g0h h TYR 481 CO 0.00 0.78 -0.47 0.28 -0.00 0.00 0.00 178.16 178.75 1g0h h VAL 482 N 0.10 1.44 -0.77 -2.88 2.07 -1.23 0.27 116.25 115.25 1g0h h VAL 482 Ca -0.01 -1.95 0.17 0.00 0.82 0.00 0.00 66.70 65.73 1g0h h VAL 482 Cb 1.21 2.51 -0.11 0.00 -1.52 0.00 0.00 31.29 33.38 1g0h h VAL 482 CO 0.10 0.56 0.22 0.00 0.02 0.00 0.00 177.57 178.48 1g0h h ALA 483 N 0.35 1.05 -0.00 1.67 0.00 -1.27 -0.96 119.26 120.10 1g0h h ALA 483 Ca -0.05 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1g0h h ALA 483 Cb 1.17 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1g0h h ALA 483 CO 0.09 -0.33 -0.36 0.36 0.00 0.00 0.00 179.25 179.02 1g0h n LYS 484 N -5.13 0.29 -0.28 0.00 2.85 0.01 -2.89 118.16 113.01 1g0h n LYS 484 Ca 0.16 -0.16 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 1g0h n LYS 484 Cb 0.49 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.38 1g0h n LYS 484 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1g0h n GLY 485 N 1.44 1.25 0.12 2.58 0.00 -0.36 -4.60 105.19 105.61 1g0h n GLY 485 Ca 0.08 -0.19 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 1g0h n GLY 485 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1g0h n THR 486 N -1.91 1.57 -4.08 2.61 -1.04 0.93 -4.44 114.28 107.92 1g0h n THR 486 Ca 0.00 -0.30 -0.33 0.00 -2.04 0.00 0.00 64.05 61.38 1g0h n THR 486 Cb 0.04 -1.87 -0.07 0.00 -1.82 0.00 0.00 70.33 66.61 1g0h n THR 486 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1g0h s LEU 487 N -7.47 3.92 0.39 -4.42 1.43 -1.04 -4.87 118.68 106.62 1g0h s LEU 487 Ca -0.32 0.14 0.18 0.00 -1.03 0.00 0.00 54.13 53.10 1g0h s LEU 487 Cb 0.09 -2.34 0.81 0.00 0.03 0.00 0.00 46.19 44.79 1g0h s LEU 487 CO 0.59 0.25 1.82 0.44 0.23 0.00 0.00 176.35 179.68 1g0h h ASP 488 N 3.94 0.00 0.00 2.29 5.19 -0.49 -3.36 116.42 123.99 1g0h h ASP 488 Ca -0.49 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1g0h h ASP 488 Cb 1.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.69 1g0h h ASP 488 CO 0.64 0.34 0.00 0.00 -3.12 0.00 0.00 179.24 177.10 1g0h n ALA 489 N -2.35 0.00 -2.78 3.45 0.00 -1.23 -1.91 120.51 115.69 1g0h n ALA 489 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.28 1g0h n ALA 489 Cb 0.43 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.75 1g0h n ALA 489 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1g0h s VAL 490 N -2.00 0.57 0.10 0.00 0.11 -0.93 -1.60 120.40 116.64 1g0h s VAL 490 Ca 0.00 -0.68 -0.11 0.00 -2.93 0.00 0.00 61.98 58.26 1g0h s VAL 490 Cb 0.00 -0.55 0.01 0.00 -1.53 0.00 0.00 36.38 34.31 1g0h s VAL 490 CO 0.00 -0.09 0.26 0.72 -3.33 0.00 0.00 175.10 172.66 1g0h s PHE 491 N -0.73 0.02 -0.32 1.54 -0.71 -1.09 -1.93 117.98 114.77 1g0h s PHE 491 Ca -0.03 -0.39 -0.02 0.00 -1.04 0.00 0.00 56.93 55.46 1g0h s PHE 491 Cb -0.06 0.05 0.12 0.00 -1.21 0.00 0.00 43.02 41.92 1g0h s PHE 491 CO 0.00 -0.59 0.19 0.34 -1.34 0.00 0.00 175.22 173.82 1g0h s ASP 492 N -2.77 3.06 -0.17 1.98 2.15 -0.50 -1.95 116.67 118.47 1g0h s ASP 492 Ca 0.03 -1.72 0.16 0.00 0.43 0.00 0.00 52.55 51.46 1g0h s ASP 492 Cb 0.03 -0.29 0.73 0.00 -0.30 0.00 0.00 42.92 43.10 1g0h s ASP 492 CO -0.11 -0.37 1.65 1.33 -0.17 0.00 0.00 175.17 177.51 1g0h n VAL 493 N 4.62 2.30 -3.13 1.11 0.24 -0.89 -2.81 118.33 119.76 1g0h n VAL 493 Ca 0.04 -1.38 -0.37 0.00 -2.04 0.00 0.00 64.34 60.59 1g0h n VAL 493 Cb 0.40 -0.09 -0.02 0.00 -1.47 0.00 0.00 33.84 32.65 1g0h n VAL 493 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1g0h n ARG 494 N 0.67 3.81 -0.82 7.34 -4.01 -1.20 -3.83 116.66 118.62 1g0h n ARG 494 Ca 0.26 -4.62 -0.12 0.00 -1.04 0.00 0.00 57.85 52.33 1g0h n ARG 494 Cb 1.02 -2.41 -0.12 0.00 -3.04 0.00 0.00 32.46 27.91 1g0h n ARG 494 CO 0.00 0.00 0.00 -2.30 -3.04 0.00 0.00 177.63 172.29 1g0h n PRO 495 N 1.01 0.00 0.00 2.89 -0.01 -1.26 -4.74 135.00 132.89 1g0h n PRO 495 Ca 0.29 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.78 1g0h n PRO 495 Cb 0.36 -0.55 0.00 0.00 -0.01 0.00 0.00 33.50 33.30 1g0h n PRO 495 CO 0.00 0.00 0.00 1.17 -0.01 0.00 0.00 175.50 176.66 1g0h n LYS 496 N 3.01 0.44 -1.88 -0.52 3.00 -1.26 -4.75 118.16 116.20 1g0h n LYS 496 Ca 0.37 0.00 -0.36 0.00 -0.00 0.00 0.00 58.31 58.32 1g0h n LYS 496 Cb 0.08 -0.71 0.05 0.00 0.00 0.00 0.00 35.03 34.45 1g0h n LYS 496 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.40 177.54 1g0h s VAL 497 N -1.42 2.51 0.53 3.15 -7.23 -1.26 -4.73 120.40 111.95 1g0h s VAL 497 Ca 0.00 0.30 0.02 0.00 -1.81 0.00 0.00 61.98 60.49 1g0h s VAL 497 Cb 0.00 -3.07 0.02 0.00 0.56 0.00 0.00 36.38 33.89 1g0h s VAL 497 CO 0.00 -0.08 0.17 0.54 -0.31 0.00 0.00 175.10 175.42 1g0h n ARG 498 N -1.83 0.72 -0.15 4.82 1.74 -1.26 -0.71 116.66 119.97 1g0h n ARG 498 Ca 0.14 -3.65 -0.08 0.00 -0.77 0.00 0.00 57.85 53.49 1g0h n ARG 498 Cb 0.50 0.75 0.01 0.00 -1.02 0.00 0.00 32.46 32.70 1g0h n ARG 498 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1g0h h ALA 499 N 1.03 0.58 -0.89 7.54 0.00 -1.80 -2.33 119.26 123.39 1g0h h ALA 499 Ca -0.40 -0.06 0.25 0.00 0.00 0.00 0.00 54.91 54.70 1g0h h ALA 499 Cb 1.29 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.86 1g0h h ALA 499 CO 0.65 0.07 0.63 0.28 0.00 0.00 0.00 179.25 180.87 1g0h h VAL 500 N 0.61 0.58 0.00 0.00 2.07 -1.93 -0.11 116.25 117.47 1g0h h VAL 500 Ca 0.17 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 67.60 1g0h h VAL 500 Cb -0.02 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1g0h h VAL 500 CO -0.03 0.01 -0.31 0.44 0.02 0.00 0.00 177.57 177.70 1g0h h ASP 501 N 0.07 0.00 0.00 0.57 3.32 -1.80 -3.37 116.42 115.21 1g0h h ASP 501 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1g0h h ASP 501 Cb 1.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.15 1g0h h ASP 501 CO -0.04 0.31 0.00 2.30 -1.72 0.00 0.00 179.24 180.09 1g0h n ILE 502 N -3.23 0.00 0.19 0.35 -5.35 -0.19 -3.42 119.36 107.71 1g0h n ILE 502 Ca 0.02 -0.27 -0.17 0.00 -0.27 0.00 0.00 62.75 62.06 1g0h n ILE 502 Cb 0.61 1.19 -0.09 0.00 -1.74 0.00 0.00 39.64 39.60 1g0h n ILE 502 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1g0h h ALA 503 N 0.00 -0.98 -0.81 -1.28 0.00 -1.40 0.68 119.26 115.47 1g0h h ALA 503 Ca 0.00 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1g0h h ALA 503 Cb 0.09 0.76 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1g0h h ALA 503 CO 0.00 -1.11 0.45 0.66 0.00 0.00 0.00 179.25 179.26 1g0h h SER 504 N -0.83 1.00 0.89 0.00 4.64 -1.86 -2.33 113.55 115.06 1g0h h SER 504 Ca -0.02 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1g0h h SER 504 Cb 0.78 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1g0h h SER 504 CO -0.18 0.80 -0.27 -1.20 -0.87 0.00 0.00 176.83 175.11 1g0h n SER 505 N -4.42 0.41 0.12 4.97 7.64 -1.12 -2.56 113.62 118.67 1g0h n SER 505 Ca 0.08 0.20 -0.14 0.00 1.01 0.00 0.00 58.87 60.03 1g0h n SER 505 Cb 0.09 -0.18 -0.08 0.00 -1.01 0.00 0.00 64.21 63.03 1g0h n SER 505 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1g0h h TYR 506 N 0.00 -0.21 0.40 1.43 3.20 0.95 0.07 116.97 122.80 1g0h h TYR 506 Ca 0.00 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1g0h h TYR 506 Cb 0.58 0.07 0.00 0.00 1.54 0.00 0.00 36.73 38.92 1g0h h TYR 506 CO 0.00 -0.13 -0.19 0.82 -1.64 0.00 0.00 178.16 177.02 1g0h h ILE 507 N -0.24 0.61 -0.65 1.81 2.04 -1.46 0.06 117.51 119.68 1g0h h ILE 507 Ca -0.02 -0.02 0.10 0.00 1.00 0.00 0.00 64.86 65.92 1g0h h ILE 507 Cb 0.18 0.62 -0.08 0.00 -0.74 0.00 0.00 36.82 36.80 1g0h h ILE 507 CO 0.04 0.00 0.25 0.40 0.00 0.00 0.00 178.15 178.84 1g0h h ILE 508 N -0.55 0.75 -0.32 -0.67 2.04 -1.51 -1.56 117.51 115.70 1g0h h ILE 508 Ca -0.05 -0.15 -0.06 0.00 1.00 0.00 0.00 64.86 65.60 1g0h h ILE 508 Cb 0.42 0.28 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1g0h h ILE 508 CO 0.09 0.08 -0.02 0.00 0.00 0.00 0.00 178.15 178.30 1g0h h LYS 510 N 0.37 0.20 0.00 0.00 1.79 -0.57 -0.59 116.57 117.77 1g0h h LYS 510 Ca 0.09 -0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.55 1g0h h LYS 510 Cb 0.48 -0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1g0h h LYS 510 CO 0.02 0.14 0.00 0.39 -1.08 0.00 0.00 179.45 178.92 1g0h n GLU 511 N -5.10 0.06 0.00 3.15 -0.58 -0.62 -1.41 120.64 116.13 1g0h n GLU 511 Ca 0.03 0.33 0.12 0.00 -0.42 0.00 0.00 57.16 57.22 1g0h n GLU 511 Cb 0.20 -1.63 0.25 0.00 -0.57 0.00 0.00 31.44 29.69 1g0h n GLU 511 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1g0h n ALA 512 N -1.59 3.28 -0.70 0.62 0.00 -0.29 -3.34 120.51 118.49 1g0h n ALA 512 Ca 0.03 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.99 1g0h n ALA 512 Cb 0.18 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1g0h n ALA 512 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1g0h n GLY 513 N 1.37 1.04 3.90 0.00 0.00 -0.50 -1.73 105.19 109.27 1g0h n GLY 513 Ca 0.11 -0.44 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 1g0h n GLY 513 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1g0h s ALA 514 N -2.00 3.44 -0.13 4.61 0.00 -0.83 -4.88 121.76 121.97 1g0h s ALA 514 Ca 0.00 -0.48 -0.14 0.00 0.00 0.00 0.00 51.96 51.34 1g0h s ALA 514 Cb 0.00 -2.55 -0.05 0.00 0.00 0.00 0.00 23.12 20.53 1g0h s ALA 514 CO 0.00 -0.20 0.33 -0.51 0.00 0.00 0.00 175.76 175.38 1g0h s LEU 515 N -4.41 4.30 -0.20 0.00 1.43 -0.05 -4.65 118.68 115.10 1g0h s LEU 515 Ca 0.47 0.62 -0.00 0.00 -1.03 0.00 0.00 54.13 54.19 1g0h s LEU 515 Cb -0.10 -2.43 0.05 0.00 0.03 0.00 0.00 46.19 43.74 1g0h s LEU 515 CO 0.40 0.14 -0.03 -0.63 0.23 0.00 0.00 176.35 176.46 1g0h s ILE 516 N 0.13 1.17 0.40 -0.59 1.01 -1.26 -0.88 121.20 121.18 1g0h s ILE 516 Ca 0.19 -0.87 0.04 0.00 0.00 0.00 0.00 60.65 60.01 1g0h s ILE 516 Cb -0.14 -1.45 -0.02 0.00 0.01 0.00 0.00 42.46 40.86 1g0h s ILE 516 CO 0.06 -0.04 0.15 0.42 0.00 0.00 0.00 174.94 175.53 1g0h s THR 517 N 1.58 0.52 0.42 2.92 -4.23 -0.64 -0.82 115.64 115.39 1g0h s THR 517 Ca -0.02 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 58.54 1g0h s THR 517 Cb -0.17 -2.37 0.05 0.00 1.34 0.00 0.00 72.50 71.35 1g0h s THR 517 CO -0.07 0.00 0.43 -0.90 -0.54 0.00 0.00 174.62 173.54 1g0h n ASP 518 N -1.33 2.01 -0.31 3.99 5.68 -0.49 -0.29 116.55 125.82 1g0h n ASP 518 Ca -0.04 -2.31 0.11 0.00 -0.50 0.00 0.00 54.79 52.05 1g0h n ASP 518 Cb 0.65 -0.15 0.29 0.00 -1.14 0.00 0.00 41.12 40.76 1g0h n ASP 518 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1g0h h GLU 519 N 0.00 0.49 0.00 0.11 3.07 -1.89 0.24 114.58 116.60 1g0h h GLU 519 Ca -0.24 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.59 1g0h h GLU 519 Cb 0.95 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 1g0h h GLU 519 CO 0.36 0.32 0.00 0.09 -1.40 0.00 0.00 179.01 178.38 1g0h n ASN 520 N -4.96 0.00 0.00 1.42 3.02 -1.26 -4.79 115.26 108.69 1g0h n ASN 520 Ca 0.21 0.04 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 1g0h n ASN 520 Cb 0.58 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 39.46 1g0h n ASN 520 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1g0h n GLY 521 N 0.30 0.60 3.82 7.41 0.00 0.83 -5.03 105.19 113.12 1g0h n GLY 521 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 1g0h n GLY 521 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1g0h s ASP 522 N -2.01 7.04 -0.36 1.61 1.01 -1.26 -4.78 116.67 117.93 1g0h s ASP 522 Ca 0.00 1.28 -0.44 0.00 0.71 0.00 0.00 52.55 54.11 1g0h s ASP 522 Cb 0.00 -2.37 -0.18 0.00 1.01 0.00 0.00 42.92 41.38 1g0h s ASP 522 CO 0.00 0.18 1.60 1.21 0.21 0.00 0.00 175.17 178.37 1g0h n GLU 523 N 1.30 0.46 -2.06 8.23 2.13 -1.26 -1.39 120.64 128.04 1g0h n GLU 523 Ca -0.07 0.17 -0.42 0.00 0.66 0.00 0.00 57.16 57.49 1g0h n GLU 523 Cb 0.51 -1.74 -0.03 0.00 0.27 0.00 0.00 31.44 30.45 1g0h n GLU 523 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1g0h s LEU 524 N 2.84 4.36 -0.13 4.31 2.96 0.00 -4.73 118.68 128.30 1g0h s LEU 524 Ca 1.01 2.43 0.01 0.00 -0.22 0.00 0.00 54.13 57.36 1g0h s LEU 524 Cb -1.31 -3.58 0.02 0.00 0.50 0.00 0.00 46.19 41.82 1g0h s LEU 524 CO 0.73 -0.75 -0.16 -0.54 -1.32 0.00 0.00 176.35 174.30 1g0h s LYS 525 N 1.46 2.42 0.06 1.98 1.02 -1.26 -4.94 119.74 120.48 1g0h s LYS 525 Ca 0.68 -0.62 0.04 0.00 0.02 0.00 0.00 55.97 56.08 1g0h s LYS 525 Cb -0.39 -2.08 -0.03 0.00 -0.52 0.00 0.00 37.83 34.82 1g0h s LYS 525 CO 0.30 -0.11 -0.11 -0.59 -0.92 0.00 0.00 175.35 173.92 1g0h s PHE 526 N 1.11 0.98 0.06 3.18 -0.12 -1.26 -5.13 117.98 116.80 1g0h s PHE 526 Ca -0.03 -0.46 -0.13 0.00 -0.05 0.00 0.00 56.93 56.26 1g0h s PHE 526 Cb -0.14 -0.56 -0.06 0.00 -0.63 0.00 0.00 43.02 41.62 1g0h s PHE 526 CO -0.05 -0.00 0.44 0.34 -0.05 0.00 0.00 175.22 175.90 1g0h s ASP 527 N -1.62 6.75 -1.26 1.98 3.68 -1.26 -5.00 116.67 119.94 1g0h s ASP 527 Ca -0.05 0.93 -0.17 0.00 2.13 0.00 0.00 52.55 55.38 1g0h s ASP 527 Cb -0.10 -2.23 0.09 0.00 -1.45 0.00 0.00 42.92 39.23 1g0h s ASP 527 CO 0.01 0.22 1.66 -0.76 0.13 0.00 0.00 175.17 176.43 1g0h s LEU 528 N -1.59 4.06 0.17 -1.34 1.43 -1.26 -4.78 118.68 115.38 1g0h s LEU 528 Ca 0.30 -2.50 0.06 0.00 -1.03 0.00 0.00 54.13 50.96 1g0h s LEU 528 Cb -0.15 -2.54 -0.05 0.00 0.03 0.00 0.00 46.19 43.48 1g0h s LEU 528 CO 0.17 -1.11 -0.12 0.54 0.23 0.00 0.00 176.35 176.06 1g0h s ASN 529 N 4.00 2.13 -0.46 2.29 6.03 -1.26 -4.99 114.94 122.68 1g0h s ASN 529 Ca 0.51 -1.02 0.03 0.00 -1.03 0.00 0.00 52.86 51.35 1g0h s ASN 529 Cb 0.02 -0.06 0.62 0.00 -3.03 0.00 0.00 41.25 38.80 1g0h s ASN 529 CO 0.05 -0.27 1.90 0.00 -2.03 0.00 0.00 177.10 176.75 1g0h n ALA 530 N -0.28 5.57 -2.27 3.54 0.00 -1.26 -4.09 120.51 121.72 1g0h n ALA 530 Ca -0.09 -2.85 -0.15 0.00 0.00 0.00 0.00 53.44 50.36 1g0h n ALA 530 Cb 0.61 -1.47 -0.10 0.00 0.00 0.00 0.00 19.45 18.49 1g0h n ALA 530 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1g0h s THR 531 N -3.34 0.43 0.17 0.00 2.01 -1.26 -4.88 115.64 108.78 1g0h s THR 531 Ca 0.56 -1.99 0.00 0.00 0.31 0.00 0.00 61.69 60.56 1g0h s THR 531 Cb 0.46 -2.48 0.00 0.00 0.01 0.00 0.00 72.50 70.50 1g0h s THR 531 CO 0.09 -0.12 0.00 -0.90 -0.69 0.00 0.00 174.62 173.01 1g0h n ASP 532 N -0.36 -6.11 -4.97 3.53 3.85 -1.26 -4.70 116.55 106.53 1g0h n ASP 532 Ca -0.01 1.28 -0.21 0.00 -0.71 0.00 0.00 54.79 55.14 1g0h n ASP 532 Cb 0.65 -3.95 0.01 0.00 -1.35 0.00 0.00 41.12 36.48 1g0h n ASP 532 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1g0h s ARG 533 N -0.71 3.00 -0.02 0.11 3.03 -1.26 -4.54 118.95 118.55 1g0h s ARG 533 Ca 0.00 -0.74 -0.06 0.00 2.03 0.00 0.00 55.73 56.96 1g0h s ARG 533 Cb 0.00 -2.65 0.01 0.00 -1.03 0.00 0.00 34.95 31.28 1g0h s ARG 533 CO 0.00 -0.22 0.14 -0.48 -1.13 0.00 0.00 175.30 173.61 1g0h s LEU 534 N -4.45 1.51 -0.10 -1.89 0.05 0.11 -4.88 118.68 109.03 1g0h s LEU 534 Ca 0.49 0.01 -0.29 0.00 0.05 0.00 0.00 54.13 54.39 1g0h s LEU 534 Cb -0.10 0.60 -0.04 0.00 -2.05 0.00 0.00 46.19 44.60 1g0h s LEU 534 CO 0.35 -0.23 1.49 0.20 -0.55 0.00 0.00 176.35 177.62 1g0h s ASN 535 N -0.74 6.78 0.00 1.48 -0.87 -1.26 -4.20 114.94 116.13 1g0h s ASN 535 Ca -0.08 2.01 0.01 0.00 -1.57 0.00 0.00 52.86 53.23 1g0h s ASN 535 Cb -0.05 -2.54 -0.01 0.00 -0.02 0.00 0.00 41.25 38.64 1g0h s ASN 535 CO 0.01 -0.85 -0.04 -0.51 -2.57 0.00 0.00 177.10 173.14 1g0h s ILE 536 N 3.78 0.29 -0.32 0.60 2.07 -1.12 -4.38 121.20 122.11 1g0h s ILE 536 Ca 0.66 -0.30 0.01 0.00 -1.41 0.00 0.00 60.65 59.61 1g0h s ILE 536 Cb -0.29 -0.28 0.10 0.00 0.13 0.00 0.00 42.46 42.13 1g0h s ILE 536 CO 0.23 -0.01 0.09 -0.63 -1.91 0.00 0.00 174.94 172.71 1g0h s ILE 537 N -0.31 1.33 -0.22 2.00 1.01 0.60 -1.41 121.20 124.21 1g0h s ILE 537 Ca -0.01 -1.73 -0.12 0.00 0.00 0.00 0.00 60.65 58.79 1g0h s ILE 537 Cb -0.03 -1.99 -0.05 0.00 0.01 0.00 0.00 42.46 40.40 1g0h s ILE 537 CO -0.00 -0.66 0.22 0.68 0.00 0.00 0.00 174.94 175.18 1g0h s VAL 538 N 1.36 5.33 0.22 2.92 -7.23 -0.81 -1.62 120.40 120.56 1g0h s VAL 538 Ca 0.10 0.33 0.00 0.00 -1.81 0.00 0.00 61.98 60.61 1g0h s VAL 538 Cb -0.18 -3.56 -0.05 0.00 0.56 0.00 0.00 36.38 33.16 1g0h s VAL 538 CO -0.19 0.34 0.10 0.00 -0.31 0.00 0.00 175.10 175.04 1g0h s ALA 539 N 0.98 1.43 -0.17 1.32 0.00 -0.05 -2.20 121.76 123.06 1g0h s ALA 539 Ca 0.11 -1.76 0.21 0.00 0.00 0.00 0.00 51.96 50.52 1g0h s ALA 539 Cb -0.13 1.15 -0.31 0.00 0.00 0.00 0.00 23.12 23.83 1g0h s ALA 539 CO 0.04 -0.51 0.52 0.27 0.00 0.00 0.00 175.76 176.09 1g0h n ASN 540 N -0.35 0.30 -3.55 0.00 6.94 -0.80 -0.87 115.26 116.93 1g0h n ASN 540 Ca 0.00 -0.15 -0.14 0.00 -0.02 0.00 0.00 54.58 54.27 1g0h n ASN 540 Cb 0.66 1.82 -0.05 0.00 -2.36 0.00 0.00 39.78 39.84 1g0h n ASN 540 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 1g0h s SER 541 N -4.20 -0.49 0.20 0.53 1.04 -1.26 -4.77 113.70 104.75 1g0h s SER 541 Ca -0.05 0.24 -0.12 0.00 0.48 0.00 0.00 55.95 56.50 1g0h s SER 541 Cb 0.14 0.51 0.25 0.00 0.10 0.00 0.00 66.02 67.02 1g0h s SER 541 CO 0.87 -0.73 1.67 0.50 0.98 0.00 0.00 173.24 176.53 1g0h h LYS 542 N 2.74 0.10 -0.13 4.02 3.11 -1.99 0.26 116.57 124.69 1g0h h LYS 542 Ca -0.31 -0.01 0.04 0.00 -2.81 0.00 0.00 60.65 57.57 1g0h h LYS 542 Cb 1.21 -0.02 -0.04 0.00 -1.00 0.00 0.00 32.23 32.38 1g0h h LYS 542 CO 0.40 0.07 -0.13 0.93 -2.81 0.00 0.00 179.45 177.91 1g0h h GLU 543 N 0.11 -0.15 -0.73 1.90 3.07 -1.99 0.28 114.58 117.06 1g0h h GLU 543 Ca 0.30 0.01 0.14 0.00 -0.50 0.00 0.00 59.36 59.31 1g0h h GLU 543 Cb 0.47 0.03 -0.10 0.00 -0.84 0.00 0.00 28.75 28.32 1g0h h GLU 543 CO -0.50 -0.10 0.27 1.98 -1.40 0.00 0.00 179.01 179.26 1g0h h MET 544 N -0.15 0.39 -0.20 2.33 4.05 -1.75 -1.99 114.93 117.61 1g0h h MET 544 Ca 0.09 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.48 1g0h h MET 544 Cb 0.28 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.98 1g0h h MET 544 CO -0.22 0.26 0.12 1.25 0.23 0.00 0.00 176.91 178.55 1g0h h LEU 545 N 0.40 0.23 0.39 3.39 5.85 0.12 -2.92 115.31 122.78 1g0h h LEU 545 Ca 0.40 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 59.08 1g0h h LEU 545 Cb 0.62 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.57 1g0h h LEU 545 CO -0.41 0.20 -0.39 0.44 -0.34 0.00 0.00 178.44 177.94 1g0h h ASP 546 N 0.25 -1.07 -0.92 1.25 3.45 0.11 0.19 116.42 119.68 1g0h h ASP 546 Ca 0.07 0.09 0.26 0.00 0.43 0.00 0.00 57.03 57.88 1g0h h ASP 546 Cb 0.01 0.36 -0.15 0.00 -0.56 0.00 0.00 39.33 38.99 1g0h h ASP 546 CO -0.01 -0.54 0.28 0.40 -1.57 0.00 0.00 179.24 177.80 1g0h h ILE 547 N -0.81 0.27 0.00 0.35 2.04 -1.39 1.62 117.51 119.59 1g0h h ILE 547 Ca -0.03 -0.07 -0.10 0.00 1.00 0.00 0.00 64.86 65.66 1g0h h ILE 547 Cb 0.72 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1g0h h ILE 547 CO -0.07 0.04 -0.46 0.40 0.00 0.00 0.00 178.15 178.06 1g0h h ILE 548 N 0.20 1.16 0.17 -0.67 2.04 -1.21 -3.08 117.51 116.13 1g0h h ILE 548 Ca 0.60 -1.68 -0.30 0.00 1.00 0.00 0.00 64.86 64.48 1g0h h ILE 548 Cb 1.27 1.95 0.02 0.00 -0.74 0.00 0.00 36.82 39.33 1g0h h ILE 548 CO -0.68 0.45 -1.33 -0.07 0.00 0.00 0.00 178.15 176.53 1g0h h LEU 549 N 0.00 0.67 -0.72 1.44 3.38 0.51 -3.20 115.31 117.41 1g0h h LEU 549 Ca -0.00 -0.69 0.11 0.00 0.09 0.00 0.00 57.88 57.38 1g0h h LEU 549 Cb 0.91 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 41.37 1g0h h LEU 549 CO 0.06 1.53 0.32 -0.78 0.09 0.00 0.00 178.44 179.67 1g0h h ASP 550 N 0.14 0.38 -0.37 -0.43 3.58 0.28 -0.71 116.42 119.28 1g0h h ASP 550 Ca -0.19 0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.34 1g0h h ASP 550 Cb 2.03 0.02 0.00 0.00 1.72 0.00 0.00 39.33 43.10 1g0h h ASP 550 CO 0.24 0.20 0.00 0.18 -2.88 0.00 0.00 179.24 176.98 1g0h n LEU 551 N -4.92 2.00 -0.10 2.28 4.32 -1.18 -5.08 117.00 114.31 1g0h n LEU 551 Ca 0.12 -1.00 0.16 0.00 -0.02 0.00 0.00 56.01 55.27 1g0h n LEU 551 Cb 0.32 -0.25 0.86 0.00 -1.62 0.00 0.00 43.42 42.73 1g0h n LEU 551 CO 0.22 0.50 1.06 0.18 -1.22 0.00 0.00 177.39 178.13