NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.3371 8.1849 120.6299 54.8951 42.3548 175.8770 8 T 4.1749 8.3276 120.9929 61.8185 69.7833 171.6891 9 E 4.4033 8.9412 125.7033 56.1359 31.6773 175.1477 10 Y 4.7672 8.0293 117.5974 57.1235 41.9812 174.1337 11 T 4.7091 8.1106 111.4543 60.1194 71.6962 173.5028 12 L 4.2438 8.0798 121.2116 54.4054 44.7452 173.5324 13 Q 4.5424 8.6873 127.3363 54.5711 30.3929 174.2637 14 A 4.7331 8.1255 126.3610 50.5900 22.4648 175.5343 15 N 4.7475 8.6160 117.9973 52.0233 38.6913 175.9954 16 W 4.1678 9.0670 129.7730 60.8137 30.7958 177.8074 17 F 4.2068 8.8587 114.9425 59.1189 38.7113 175.9822 18 D 4.7608 8.1459 120.1694 54.5136 41.2865 178.3991 19 I 3.6513 7.3927 121.6803 64.5927 37.1320 178.3577 20 T 3.9546 7.6427 109.8898 64.3535 68.5441 176.6652 21 G 3.5931 7.9423 108.6679 47.8299 0.0000 175.7163 22 I 3.8373 7.6742 121.9209 63.7366 37.1843 178.3382 23 L 3.9406 8.0681 121.5224 57.8556 41.7478 178.5432 24 W 4.1309 8.1357 126.8960 60.7021 30.9628 177.2810 25 L 3.8612 8.4614 118.7356 57.8115 41.0929 179.2944 26 L 3.9828 8.0466 120.1567 58.3068 41.8531 179.4064 27 G 3.5006 7.8623 104.9679 47.7502 0.0000 175.5926 28 Q 3.9406 7.4940 119.0916 57.5812 28.5552 177.4643 29 V 4.2408 7.1162 113.9483 61.1464 32.4806 175.4878 30 D 4.3543 7.8080 116.4989 54.2042 37.4524 177.0647 31 G 4.2180 7.8146 108.7667 44.8048 0.0000 173.7000 32 K 4.4958 7.8678 116.1490 55.2545 34.9146 175.7048 33 I 3.8088 8.4159 125.0575 62.3229 37.1797 176.7340 34 I 4.0890 8.3754 124.1434 62.0033 36.0488 172.0633 35 N 4.9285 7.5955 115.3823 52.5342 41.4806 173.0908 36 S 4.8552 8.0380 117.5221 56.7687 66.3764 172.6260 37 D 4.4276 8.1760 116.3010 53.5892 43.6294 174.7533 38 V 4.4544 8.3644 125.5813 61.4022 33.2974 174.8355 39 Q 4.4096 8.3510 123.5160 54.2617 32.7531 173.7620 40 A 4.7024 8.0366 123.0870 50.4497 20.9970 176.4120 41 F 4.9491 8.4598 119.5947 55.4633 42.8216 174.6274 42 V 4.1318 8.4367 122.4897 61.8399 32.2073 175.2856 43 L 4.6013 8.4748 127.2641 53.4103 42.9071 175.7980 44 L 4.7349 8.3873 122.7175 52.7640 44.1028 175.7403 45 R 4.5394 8.5254 122.2292 54.6281 31.5890 175.2979 46 V 4.4864 8.2989 117.5661 59.3334 34.8767 174.8343 47 A 4.6754 8.2119 123.8771 50.2866 21.4564 175.5354 48 L 4.5790 7.9846 121.2742 53.3034 43.6897 173.7987 49 P 4.2948 0.0000 0.0000 62.1877 32.2440 177.5304 50 A 3.9362 8.8684 124.3663 55.4775 18.0108 179.6071 51 A 3.9972 8.0693 117.5701 54.7334 18.5083 178.7490 52 K 4.4162 8.0865 114.6944 56.0624 33.1040 178.2348 53 V 3.6605 7.6357 119.4904 66.1928 31.3627 177.5105 54 A 3.9881 8.0504 119.5529 55.2203 18.2561 178.9004 55 E 3.8915 8.2164 117.1845 59.5990 29.7767 178.6941 56 F 4.2495 8.5215 120.7394 61.2907 39.4982 177.0408 57 S 3.9356 8.8413 113.0408 61.2488 62.3043 176.0299 58 A 4.0007 8.1534 123.5539 55.0754 18.1333 179.6861 59 K 4.0490 8.0541 116.7592 58.8709 32.2577 179.4205 60 L 3.8426 7.6323 120.9499 57.7341 41.9096 178.8078 61 A 3.9323 7.8523 120.5577 55.1861 18.0692 178.8383 62 D 4.2638 7.9154 116.3005 57.7640 41.0527 178.4140 63 F 4.3268 8.2724 119.7283 60.3358 39.4822 175.6135 64 S 4.2640 7.8653 110.3445 56.9249 63.2463 174.3827 65 G 3.7574 8.6611 107.0338 46.8059 0.0000 175.2857 66 G 3.9987 8.1630 109.6718 44.8797 0.0000 176.1455 67 S 4.2149 7.5455 114.1491 61.2800 63.1279 175.2290 68 L 4.0853 7.3002 120.8146 54.4592 41.8508 177.1339 69 Q 4.2265 8.2384 119.9041 54.3342 31.7125 174.9155 70 L 4.3125 8.5305 126.2170 53.8928 41.2995 175.0600 71 L 4.5281 8.1479 125.7856 52.6852 43.0835 177.0876 72 A 4.2855 8.4249 126.3015 52.0823 19.3227 177.2499 73 I 4.0573 8.0896 118.9526 61.5655 37.4142 176.2310 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 L 8.18 4.34 0.00 1.64 1.73 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 8 T 8.33 4.17 4.37 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 0.00 0.00 0.00 0.88 0.00 0.00 9 E 8.94 4.40 0.00 1.81 1.78 0.00 0.00 0.00 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 2.27 0.00 10 Y 8.03 4.77 0.00 2.92 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.11 4.71 4.29 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 1.24 0.00 0.00 12 L 8.08 4.24 0.00 1.60 1.58 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.69 4.54 0.00 2.05 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.48 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 14 A 8.13 4.73 1.23 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 0.00 0.00 0.00 15 N 8.62 4.75 0.00 3.13 3.07 0.00 0.00 5.72 8.88 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 16 W 9.07 4.17 0.00 3.30 3.10 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 17 F 8.86 4.21 0.00 3.35 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 18 D 8.15 4.76 0.00 2.88 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 I 7.39 3.65 1.56 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.73 0.81 0.00 0.00 20 T 7.64 3.95 4.17 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 0.96 0.00 0.00 21 G 7.94 3.59 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 0.00 0.00 0.00 22 I 7.67 3.84 2.03 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.97 0.93 0.00 0.00 23 L 8.07 3.94 0.00 1.86 1.91 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 24 W 8.14 4.13 0.00 3.38 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.46 3.86 0.00 1.81 1.72 1.01 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.05 3.98 0.00 2.10 1.68 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.86 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 7.49 3.94 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.25 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 29 V 7.12 4.24 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.95 0.00 0.00 30 D 7.81 4.35 0.00 2.79 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.81 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 0.00 0.00 0.00 0.00 32 K 7.87 4.50 0.00 1.83 1.74 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.46 7.81 33 I 8.42 3.81 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.54 0.93 0.00 0.00 34 I 8.38 4.09 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.64 0.91 0.00 0.00 35 N 7.60 4.93 0.00 2.64 2.67 0.00 0.00 6.73 7.63 0.00 0.00 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 S 8.04 4.86 0.00 4.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.18 4.43 0.00 2.60 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.36 4.45 2.09 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 0.90 0.00 0.00 0.99 0.00 0.00 39 Q 8.35 4.41 0.00 1.94 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.49 0.00 0.00 0.00 0.00 0.00 2.13 2.30 0.00 40 A 8.04 4.70 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.46 4.95 0.00 2.98 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 42 V 8.44 4.13 2.17 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 0.86 0.00 0.00 0.98 0.00 0.00 43 L 8.47 4.60 0.00 1.71 1.61 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.39 4.73 0.00 1.63 1.59 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.53 4.54 0.00 1.74 1.81 0.00 3.18 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 46 V 8.30 4.49 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.97 0.00 0.00 47 A 8.21 4.68 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.98 4.58 0.00 1.51 1.33 0.67 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.29 0.00 2.17 1.99 0.00 3.53 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.04 0.00 50 A 8.87 3.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.07 4.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.09 4.42 0.00 1.76 1.84 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.39 7.81 53 V 7.64 3.66 2.22 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 0.89 0.00 0.00 0.95 0.00 0.00 54 A 8.05 3.99 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 55 E 8.22 3.89 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 56 F 8.52 4.25 0.00 3.03 3.23 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 0.00 57 S 8.84 3.94 0.00 4.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.15 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.05 4.05 0.00 1.78 1.80 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.44 7.81 60 L 7.63 3.84 0.00 1.70 1.50 0.50 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.85 3.93 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 62 D 7.92 4.26 0.00 2.85 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.27 4.33 0.00 3.03 3.27 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 64 S 7.87 4.26 0.00 4.02 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 65 G 8.66 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 8.16 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.55 4.21 0.00 3.97 4.01 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 0.00 0.00 0.00 68 L 7.30 4.09 0.00 1.63 1.66 0.99 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.24 4.23 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.10 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 70 L 8.53 4.31 0.00 1.61 1.66 1.13 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 71 L 8.15 4.53 0.00 1.67 1.59 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 72 A 8.42 4.29 1.25 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 0.00 0.00 0.00 73 I 8.09 4.06 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.65 0.91 0.00 0.00