NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 34 S 4.4108 8.3349 116.7945 58.2366 65.1425 173.8224 35 S 4.4626 7.7558 116.4725 57.7919 62.8961 174.0970 36 G 3.8713 7.8541 109.8802 46.9805 0.0000 175.1882 37 R 4.0486 7.6397 115.6521 58.1927 28.8075 177.2201 38 F 5.0207 8.0304 116.2997 57.1152 39.6847 177.0335 39 G 3.9607 7.9288 109.1309 45.9300 0.0000 173.7289 40 A 4.6021 8.4228 120.1722 52.7674 19.6092 176.7969 41 R 4.4866 6.7300 120.2688 56.7738 33.5549 175.1883 42 Y 3.9391 8.7094 120.1119 59.2009 36.3504 171.2340 43 G 3.9802 8.2106 103.0520 44.8281 0.0000 172.8358 44 R 3.6695 7.9010 113.9742 60.6183 29.7569 178.8770 45 V 3.7383 7.7610 117.6630 66.4707 31.7271 178.3638 46 S 4.3245 8.0820 112.7634 59.8533 63.1994 175.1859 47 R 4.6374 7.5860 116.1672 56.1810 30.8219 177.7643 48 R 4.0573 8.5782 120.1478 58.8769 29.8938 177.3525 49 R 4.5588 7.4559 115.2753 56.1991 30.4868 177.1322 50 V 4.1483 7.5051 119.2577 63.4373 34.0200 177.5607 51 A 4.0701 8.1952 120.8580 55.0995 18.3803 179.1780 52 E 4.1088 8.1027 116.6838 59.3465 29.3571 179.3368 53 I 4.0125 7.7333 118.3244 62.8537 37.3734 176.7553 54 E 4.7759 7.6645 118.3901 56.2378 30.7935 176.7394 55 S 4.4829 8.0487 113.5765 58.9056 64.7408 173.8876 56 E 4.4354 8.0863 118.1415 56.4090 29.8484 175.6352 57 M 4.7530 8.1324 117.1472 58.4470 33.3428 176.9078 58 N 5.0144 8.1803 112.7985 53.4111 38.6297 174.4360 59 E 4.3664 7.7240 119.0188 55.1517 30.7980 175.9898 60 D 4.7806 8.3319 124.4251 53.9264 40.6034 175.6317 61 H 4.9411 8.5302 120.0769 53.8244 31.1470 174.8733 62 A 4.3774 8.4595 122.2438 52.1521 17.5550 176.7186 63 C 4.4171 8.3801 122.6637 57.1042 32.9449 173.0595 64 P 4.3699 0.0000 0.0000 65.4379 31.3177 177.7568 65 N 4.3020 7.3151 114.3049 55.4708 39.3215 174.5432 66 C 4.8981 7.7019 113.9923 57.7034 30.4747 174.3909 67 G 4.0618 8.4722 110.2463 45.1932 0.0000 172.1051 68 E 4.2707 7.7433 119.5183 55.3990 30.4059 177.2950 69 D 4.4722 8.3684 119.6092 56.5396 41.2402 176.6632 70 R 4.1469 7.8903 118.2596 56.7535 30.2454 175.1772 71 V 4.8086 8.4851 122.5095 61.4440 34.1948 173.9945 72 D 5.2765 9.5924 127.8787 52.6043 44.5583 175.3377 73 R 3.9613 8.3529 120.2292 55.0859 31.2579 175.8546 74 Q 4.3963 8.0902 121.2723 55.5260 31.6473 176.3716 75 G 3.7219 6.5634 103.8526 46.2929 0.0000 172.8011 76 T 3.9779 8.3964 119.0705 64.8260 67.3408 174.5882 77 G 3.9492 8.5397 116.1296 45.6242 0.0000 170.9176 78 I 4.3024 6.7840 121.1747 60.0109 38.2930 175.1398 79 W 4.6241 8.6371 126.9939 54.8717 32.7718 174.4733 80 Q 5.1297 9.1279 121.6199 55.2079 32.7114 172.5817 81 C 5.5188 9.3007 124.8646 57.0033 32.8131 174.8097 82 S 4.1484 9.1084 121.1906 60.6047 62.4420 174.1290 83 Y 4.4549 7.5453 123.1913 58.4220 39.2956 174.6933 84 C 4.3910 8.0231 110.8457 57.7838 30.5329 174.2061 85 D 4.3520 7.7876 116.3289 55.9888 38.7907 173.4224 86 Y 4.4079 7.6361 120.9245 57.8563 39.0776 174.4812 87 K 4.8642 8.4967 129.1495 55.2766 33.0403 175.2113 88 F 5.0622 8.8663 122.7409 55.1087 41.7727 173.5955 89 T 4.9648 8.4589 108.8811 60.5456 70.6948 174.1151 90 G 4.1941 7.9602 109.8521 46.3211 0.0000 172.4406 91 G 3.8384 8.6401 108.0846 45.2042 0.0000 174.8329 92 S 3.9434 8.1582 119.1671 60.9480 62.6483 174.7344 93 Y 5.0761 7.6720 114.2066 57.4774 39.5427 175.7670 94 K 4.4413 7.9090 118.3864 53.8109 35.0571 175.3464 95 P 3.1139 0.0000 0.0000 64.6656 30.9609 175.7285 96 E 4.5289 7.4582 117.3938 54.6753 33.0388 174.9678 97 T 4.4356 8.2140 113.7289 59.7321 70.4798 174.1026 98 P 4.2592 0.0000 0.0000 65.1440 31.2051 177.8984 99 G 3.8302 8.0736 106.1153 46.6108 0.0000 175.3541 100 G 3.4573 7.9044 105.5843 46.0686 0.0000 175.1075 101 K 4.3543 7.8318 119.2675 57.6783 31.4012 177.9864 102 T 3.9802 7.3640 115.2458 65.0864 68.2952 176.8430 103 V 3.9236 7.6310 119.9212 65.7528 31.6913 177.1192 104 R 4.0357 7.4406 116.8510 59.3500 30.0576 177.9323 105 R 3.9777 7.1734 115.7342 59.4679 30.3365 176.6336 106 S 4.3322 7.8733 115.0551 58.5119 63.3260 173.8327 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 34 S 8.33 4.41 0.00 3.87 3.95 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.76 4.46 0.00 4.06 4.11 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.85 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.64 4.05 0.00 1.75 1.92 0.00 2.66 0.00 0.00 2.95 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.76 0.00 38 F 8.03 5.02 0.00 3.51 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.93 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.42 4.60 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 41 R 6.73 4.49 0.00 0.78 0.92 0.00 2.81 0.00 0.00 3.05 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.34 0.00 42 Y 8.71 3.94 0.00 3.06 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.21 3.98 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 0.00 0.00 0.00 44 R 7.90 3.67 0.00 1.87 1.92 0.00 3.15 0.00 0.00 3.27 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 45 V 7.76 3.74 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.93 0.00 0.00 46 S 8.08 4.32 0.00 4.01 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 47 R 7.59 4.64 0.00 2.19 2.25 0.00 2.84 0.00 0.00 3.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.64 0.00 48 R 8.58 4.06 0.00 2.03 1.96 0.00 3.09 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.68 0.00 49 R 7.46 4.56 0.00 1.91 1.90 0.00 3.15 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 50 V 7.51 4.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.93 0.00 0.00 51 A 8.20 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.10 4.11 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 53 I 7.73 4.01 1.79 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 1.67 0.46 0.74 0.00 0.00 54 E 7.66 4.78 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 55 S 8.05 4.48 0.00 3.95 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 56 E 8.09 4.44 0.00 2.15 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 2.28 0.00 57 M 8.13 4.75 0.00 2.22 2.42 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.03 2.68 0.00 58 N 8.18 5.01 0.00 2.80 2.85 0.00 0.00 6.78 7.66 0.00 0.00 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 E 7.72 4.37 0.00 2.11 1.70 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 2.13 2.23 0.00 60 D 8.33 4.78 0.00 2.59 2.67 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 61 H 8.53 4.94 0.00 3.03 3.19 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.46 4.38 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.38 4.42 0.00 2.97 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 64 P 0.00 4.37 0.00 1.90 1.99 0.00 3.32 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 65 N 7.32 4.30 0.00 2.42 2.66 0.00 0.00 6.87 7.54 0.00 0.00 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 C 7.70 4.90 0.00 3.08 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.47 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.74 4.27 0.00 1.88 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.18 0.00 69 D 8.37 4.47 0.00 2.65 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 7.89 4.15 0.00 1.83 2.03 0.00 2.99 0.00 0.00 3.38 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.63 0.00 71 V 8.49 4.81 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 1.05 0.00 0.00 1.21 0.00 0.00 72 D 9.59 5.28 0.00 2.65 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.35 3.96 0.00 1.22 1.44 0.00 2.83 0.00 0.00 2.94 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.50 0.00 74 Q 8.09 4.40 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.58 0.00 0.00 0.00 0.00 0.00 2.15 2.31 0.00 75 G 6.56 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 8.40 3.98 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 77 G 8.54 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 I 6.78 4.30 1.64 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 1.12 0.75 0.77 0.00 0.00 79 W 8.64 4.62 0.00 1.91 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 0.00 0.00 0.00 80 Q 9.13 5.13 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 81 C 9.30 5.52 0.00 3.41 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 9.11 4.15 0.00 4.11 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 0.00 83 Y 7.55 4.45 0.00 2.91 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 84 C 8.02 4.39 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.79 4.35 0.00 2.98 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.64 4.41 0.00 3.21 3.03 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 0.00 0.00 0.00 0.00 87 K 8.50 4.86 0.00 1.80 1.67 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.39 7.81 88 F 8.87 5.06 0.00 3.02 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.46 4.96 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 1.22 0.00 0.00 90 G 7.96 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 G 8.64 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.16 3.94 0.00 3.48 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 93 Y 7.67 5.08 0.00 3.10 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.91 4.44 0.00 1.79 1.87 0.00 1.34 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.38 1.39 7.81 95 P 0.00 3.11 0.00 1.95 1.13 0.00 2.98 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.39 0.00 96 E 7.46 4.53 0.00 1.80 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 2.17 2.23 0.00 97 T 8.21 4.44 4.24 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 0.00 0.00 0.00 1.20 0.00 0.00 98 P 0.00 4.26 0.00 2.06 2.16 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 99 G 8.07 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 7.90 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 7.83 4.35 0.00 1.79 1.84 0.00 1.65 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.62 1.67 7.81 102 T 7.36 3.98 4.35 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 1.21 0.00 0.00 103 V 7.63 3.92 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 0.88 0.00 0.00 1.00 0.00 0.00 104 R 7.44 4.04 0.00 2.05 1.97 0.00 3.25 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.60 0.00 105 R 7.17 3.98 0.00 2.09 2.02 0.00 3.15 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 106 S 7.87 4.33 0.00 3.97 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00