NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -7 M 4.4083 8.3049 118.1959 55.4451 32.5209 174.4319 -6 H 4.5530 8.7263 116.6140 53.6630 29.2535 173.0985 -5 H 4.8243 8.7917 124.1155 54.3830 33.4012 171.3255 -4 H 4.2772 8.5076 126.3061 54.6258 30.6221 173.3287 -3 H 4.3634 8.1868 126.9751 54.2657 29.8556 173.8469 -2 H 4.4257 8.1804 127.0236 56.5386 30.3966 174.0909 -1 H 4.7966 8.2969 121.2198 53.4112 31.2422 173.5036 0 A 3.9811 8.5471 127.7712 54.3351 18.7919 178.3278 1 M 3.4462 8.7747 118.0886 55.2219 28.9589 175.8206 2 E 4.3307 7.6053 119.4031 57.9659 30.7646 177.1291 3 E 4.6169 8.6692 118.6282 55.1084 33.0630 175.1577 4 V 4.4741 9.2060 126.0909 60.4288 34.6552 174.3343 5 T 4.9649 8.4775 123.2332 61.9757 70.4368 173.6954 6 I 4.4024 9.1078 127.6653 59.3630 39.7948 174.4306 7 K 4.6425 8.7849 128.7289 54.8167 33.5090 174.8959 8 A 4.6949 9.0766 130.8274 50.4899 21.1146 175.0456 9 N 5.0370 8.7893 120.4071 51.6109 40.6320 174.2643 10 L 4.3214 9.1042 125.5261 53.1873 43.5490 175.7866 11 I 4.4476 7.9331 124.9590 59.5167 39.0426 175.6299 12 F 4.8048 8.6755 126.0824 55.9682 40.5557 176.9841 13 A 4.0368 9.0204 123.5841 55.5261 18.1571 178.4399 14 N 4.6396 8.2174 110.1318 53.1336 37.6189 175.7519 15 G 4.0480 8.3435 109.0509 45.4077 0.0000 174.4751 16 S 4.6561 7.8939 114.1785 58.7010 64.5360 173.1220 17 T 5.2648 8.3150 109.9316 60.5352 72.3782 172.5129 18 Q 4.8217 8.9117 122.0448 54.9495 32.8213 173.2879 19 T 5.3185 8.5466 114.5442 60.2067 71.9943 172.6525 20 A 4.5429 8.7208 123.1854 50.6916 23.2074 174.5712 21 E 4.9462 8.0291 119.5544 54.3171 32.5552 175.1966 22 F 4.9663 9.2031 126.2493 56.3461 43.3368 174.6187 23 K 5.0030 9.3786 123.9274 53.7530 35.8878 176.3205 24 G 3.6745 7.8799 108.1019 45.3487 0.0000 173.4228 25 T 4.3887 8.1759 113.0836 61.2199 71.0306 175.0337 26 F 3.9577 9.0947 124.2111 61.5235 39.4436 177.2919 27 E 3.9495 8.3001 117.5485 59.4042 29.3754 179.2296 28 K 3.8508 8.1229 119.1862 59.3188 32.4203 178.6481 29 A 3.8632 8.1455 121.6905 55.4330 18.2351 179.7923 30 T 3.1040 7.4565 108.2877 64.5840 68.6802 176.9323 31 S 3.9897 7.5157 117.6293 61.4619 62.7985 176.5752 32 E 3.7788 7.8744 120.9836 59.0080 29.1048 179.2367 33 A 2.8667 6.6346 120.4661 54.9806 18.2810 179.3720 34 Y 3.9523 7.5588 115.2893 60.9668 37.6858 178.4260 35 A 4.0628 7.8967 121.0773 55.2483 18.9094 178.7526 36 Y 4.3607 8.1471 117.8761 60.8756 38.9392 177.9967 37 A 3.5493 7.8717 121.6667 55.2216 18.1307 179.3673 38 D 4.6629 8.4066 117.5589 57.5470 40.6785 178.6476 39 T 4.1422 7.6099 108.3116 63.3024 69.2306 175.5412 40 L 4.4749 7.6326 121.1088 54.8541 42.2658 178.3226 41 K 4.5660 7.8316 123.7571 59.4745 31.7814 179.5355 42 K 3.9116 8.1200 119.2836 57.4479 31.5854 179.1249 43 D 4.7476 7.9938 116.7006 54.6204 41.7414 176.7872 44 N 4.7833 8.4541 113.9079 52.2968 39.9264 175.3000 45 G 3.8802 8.4556 107.8711 44.2604 0.0000 172.7879 46 E 4.2179 8.4458 117.6932 55.9049 29.9987 176.4685 47 W 5.0676 7.8615 118.2532 54.7377 31.1839 174.5236 48 T 4.7694 8.5094 108.7168 59.8388 71.3453 173.4181 49 V 4.6437 8.1618 120.3690 59.9290 34.5465 174.2301 50 D 4.7953 8.6520 120.2043 52.4291 43.5224 174.8598 51 V 4.3352 8.5144 125.8832 61.1481 32.9099 174.5680 52 A 4.8253 8.4143 129.4044 50.0259 21.6853 175.2766 53 D 4.6801 8.7145 122.0871 53.2692 40.4141 176.3333 54 K 4.4979 8.3653 117.1278 56.9393 34.9976 176.5491 55 A 4.7587 7.4092 118.3476 51.1911 21.9315 174.5110 56 Y 4.8196 8.2870 116.8003 56.6909 42.2428 174.7600 57 T 4.6447 8.5370 117.5825 61.7357 71.0863 173.7609 58 L 4.5588 8.5374 125.5948 52.9958 43.5085 175.6486 59 N 4.6783 8.7115 121.8335 51.7810 38.8793 174.5428 60 I 4.1653 8.2059 125.1467 59.3078 38.2239 175.1981 61 K 4.5391 8.3048 126.8256 54.4074 33.7907 175.2215 62 F 4.5112 8.7536 124.5211 56.2597 40.2884 175.8692 63 A 4.1419 8.6917 127.1321 52.7138 19.1328 177.7203 64 G 4.1021 8.2915 108.7522 45.9528 0.0000 173.2324 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ -7 M 8.30 4.41 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 -6 H 8.73 4.55 0.00 3.28 3.41 0.00 5.84 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -5 H 8.79 4.82 0.00 3.02 3.15 0.00 5.91 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -4 H 8.51 4.28 0.00 1.70 2.65 0.00 5.96 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -3 H 8.19 4.36 0.00 3.07 3.18 0.00 5.98 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -2 H 8.18 4.43 0.00 3.15 3.10 0.00 5.92 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -1 H 8.30 4.80 0.00 3.09 3.12 0.00 5.91 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 A 8.55 3.98 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.77 3.45 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.08 0.00 2 E 7.61 4.33 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 3 E 8.67 4.62 0.00 1.71 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.84 0.00 4 V 9.21 4.47 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.99 0.00 0.00 5 T 8.48 4.96 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 6 I 9.11 4.40 2.02 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.83 0.86 0.00 0.00 7 K 8.78 4.64 0.00 1.71 1.71 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.47 7.81 8 A 9.08 4.69 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 N 8.79 5.04 0.00 2.57 2.73 0.00 0.00 7.06 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 9.10 4.32 0.00 1.44 0.97 1.07 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.93 4.45 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.47 0.88 0.00 0.00 12 F 8.68 4.80 0.00 3.02 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 9.02 4.04 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.22 4.64 0.00 2.87 2.96 0.00 0.00 6.26 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.34 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.89 4.66 0.00 4.04 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.32 5.26 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 Q 8.91 4.82 0.00 2.37 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.75 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 19 T 8.55 5.32 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 20 A 8.72 4.54 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.03 4.95 0.00 1.77 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.30 0.00 22 F 9.20 4.97 0.00 2.84 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 K 9.38 5.00 0.00 1.47 1.50 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.24 0.99 7.81 24 G 7.88 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.18 4.39 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 26 F 9.09 3.96 0.00 2.91 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.30 3.95 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.59 0.00 28 K 8.12 3.85 0.00 1.81 1.77 0.00 1.63 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.42 7.81 29 A 8.15 3.86 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.46 3.10 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31 S 7.52 3.99 0.00 4.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.87 3.78 0.00 1.73 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 33 A 6.63 2.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Y 7.56 3.95 0.00 3.10 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.90 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 Y 8.15 4.36 0.00 3.13 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.87 3.55 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 D 8.41 4.66 0.00 3.02 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 7.61 4.14 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 40 L 7.63 4.47 0.00 1.81 1.90 0.76 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.83 4.57 0.00 1.92 1.93 0.00 2.12 0.00 0.00 1.94 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.90 1.79 7.81 42 K 8.12 3.91 0.00 1.77 1.75 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.06 7.81 43 D 7.99 4.75 0.00 2.60 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.45 4.78 0.00 2.91 3.02 0.00 0.00 7.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.46 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.45 4.22 0.00 1.93 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.16 0.00 47 W 7.86 5.07 0.00 3.43 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 T 8.51 4.77 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 49 V 8.16 4.64 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.11 0.00 0.00 50 D 8.65 4.80 0.00 2.62 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.51 4.34 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 1.13 0.00 0.00 52 A 8.41 4.83 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.71 4.68 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.37 4.50 0.00 1.70 1.83 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.35 1.35 7.81 55 A 7.41 4.76 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.29 4.82 0.00 2.88 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.54 4.64 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 58 L 8.54 4.56 0.00 1.59 1.56 0.90 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.71 4.68 0.00 2.68 2.77 0.00 0.00 7.04 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 8.21 4.17 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.53 0.56 0.00 0.00 61 K 8.30 4.54 0.00 1.67 1.63 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.46 7.81 62 F 8.75 4.51 0.00 3.06 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.69 4.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.29 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00