NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 G 4.0138 8.3393 109.7389 45.8998 0.0000 171.7621 26 S 4.4561 7.1100 113.1144 57.5716 66.2131 171.3389 27 H 3.9823 9.7481 114.6597 58.0756 28.1787 177.4404 28 M 4.7602 7.1389 120.8721 52.1126 32.8492 174.7200 29 P 4.8480 0.0000 0.0000 64.4894 31.8754 177.8573 30 Q 4.0410 8.0255 116.2655 58.8531 28.4291 178.5923 31 I 3.6693 7.4261 122.0399 64.3630 36.6828 177.9009 32 E 3.9572 8.1731 118.8462 59.6668 29.2661 179.6830 33 R 3.9408 7.7430 117.9300 59.2647 30.1150 179.0928 34 R 3.8898 8.2356 118.6888 59.3587 30.0109 178.5636 35 I 3.6872 7.9532 119.7620 64.4628 37.1311 178.6088 36 K 4.0040 7.7174 118.1246 59.2694 31.8378 179.6232 37 K 3.9835 8.2364 119.0435 59.3520 32.0593 179.4088 38 L 3.9904 8.2287 119.6473 57.9913 41.6099 179.7081 39 I 3.7748 7.7660 119.7693 64.2402 36.9638 178.5127 40 S 4.0990 8.1726 114.2112 61.2676 62.2259 176.1346 41 L 4.1048 8.5105 122.2869 57.8809 41.3041 179.8403 42 G 3.7139 8.0184 105.1633 47.5699 0.0000 175.7271 43 K 3.9760 7.9039 121.1998 59.2004 32.2566 178.8648 44 K 4.1193 8.2403 118.5626 59.3965 32.0681 179.2847 45 K 4.2215 8.3758 118.3803 57.3964 31.9564 178.2312 46 G 4.1400 6.7435 115.4479 45.8248 0.0000 172.1395 47 Y 4.8129 7.3293 118.6002 55.2906 41.0779 176.6023 48 I 4.2335 8.1521 117.1136 60.1848 36.8327 174.4221 49 T 5.2009 7.7482 123.9100 61.4666 73.9339 173.3011 50 Y 4.0420 8.9409 125.3682 61.1990 38.8296 178.8840 51 E 4.0675 8.3246 118.8690 59.4048 29.4310 178.8570 52 D 4.4450 7.9731 117.8466 57.0979 41.1951 178.3581 53 I 3.8559 7.8773 120.6796 64.4416 36.9902 177.9849 54 D 4.3567 7.6824 120.0482 57.2119 40.4547 178.7794 55 K 4.2023 8.0475 117.2214 58.8712 32.9548 178.5563 56 A 4.1436 7.7718 121.4189 53.0726 18.7469 177.5006 57 F 4.0383 7.3305 119.5632 57.9868 39.8665 173.1304 58 P 3.0137 0.0000 0.0000 61.5500 32.0596 174.3556 59 P 4.8218 0.0000 0.0000 61.9163 33.7427 175.0376 60 D 4.7026 8.5794 120.7212 54.2097 41.0892 176.8175 61 F 4.3493 8.3454 113.4810 57.1114 37.9407 175.1149 62 E 3.9781 8.8787 125.6064 58.1760 29.8878 177.0121 63 G 4.2170 7.7225 104.9999 44.3075 0.0000 171.9140 64 F 4.7929 9.0200 124.4471 56.3689 40.5504 174.8844 65 D 4.8795 7.7248 126.8281 52.5876 44.1233 176.8470 66 T 3.8836 8.5708 120.1500 66.6347 69.0810 176.4043 67 N 4.4929 8.2127 118.7669 56.1739 38.4822 176.8524 68 L 3.9468 7.5579 121.7013 58.1156 41.5849 179.1261 69 I 3.7307 7.3800 119.4506 64.4180 37.1182 178.2915 70 E 4.0836 8.1110 117.9518 59.4847 29.6009 179.1893 71 R 3.9972 8.4019 119.4622 58.7479 29.9716 179.0289 72 I 3.6902 8.4074 120.1583 64.8801 37.0800 178.2494 73 H 4.2204 7.9467 116.4137 58.4598 28.4757 177.8473 74 E 3.9541 8.3713 119.6304 59.7128 29.5911 179.1314 75 E 4.2123 8.3198 120.0548 58.5586 29.3664 179.0692 76 L 4.1496 8.1481 120.9575 58.0454 41.8863 178.6346 77 E 3.9825 7.6656 117.6431 58.9816 29.9155 178.2822 78 K 4.1192 8.3999 117.8354 59.9400 32.8946 177.3468 79 H 4.3982 8.2644 118.3288 56.0623 30.3507 175.7177 80 G 4.1308 8.2588 106.2033 46.1536 0.0000 172.6294 81 I 3.8034 7.5562 119.7652 60.2488 38.3338 174.9900 82 N 4.6579 8.6821 125.9953 52.7000 38.8592 174.4279 83 I 4.5981 8.0840 122.3104 59.7542 41.2313 173.7672 84 V 4.5155 8.8355 126.8945 60.0557 33.6851 176.5298 85 E 4.0055 8.5989 120.1905 56.8926 29.9466 178.2935 86 N 4.5078 8.3174 114.7200 53.4210 38.6423 173.3707 87 E 4.2047 7.5530 118.4148 55.4484 30.6184 175.8698 88 P 4.6198 0.0000 0.0000 62.3793 29.1729 175.6176 89 E 4.4551 7.8605 113.5313 55.9973 30.3459 177.6697 90 E 4.5600 7.7757 121.0579 54.2464 29.2938 174.0474 91 E 4.7627 7.9119 121.1697 54.0662 32.8835 173.0465 92 E 4.4923 7.9854 119.3023 55.7327 33.1694 175.3560 93 I 4.1754 7.8215 119.7570 60.3387 39.3739 176.0137 94 S 3.7505 8.8847 112.9114 59.2597 60.6744 173.8742 95 A 4.6768 7.0380 121.0340 49.3503 19.8145 176.8894 96 G 3.7755 7.6528 113.6632 45.8545 0.0000 171.9948 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 25 G 8.34 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 0.00 0.00 0.00 26 S 7.11 4.46 0.00 4.04 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 27 H 9.75 3.98 0.00 3.29 3.35 0.00 5.67 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 M 7.14 4.76 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.53 0.00 29 P 0.00 4.85 0.00 2.11 2.05 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.84 0.00 30 Q 8.03 4.04 0.00 2.69 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 31 I 7.43 3.67 2.04 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 1.52 0.82 0.91 0.00 0.00 32 E 8.17 3.96 0.00 2.13 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 2.42 2.41 0.00 33 R 7.74 3.94 0.00 1.76 1.96 0.00 3.29 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.77 0.00 34 R 8.24 3.89 0.00 2.18 2.07 0.00 3.15 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 35 I 7.95 3.69 2.00 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 1.51 0.69 0.89 0.00 0.00 36 K 7.72 4.00 0.00 1.89 1.82 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.61 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.64 1.54 7.81 37 K 8.24 3.98 0.00 1.99 1.86 0.00 1.67 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.73 7.81 38 L 8.23 3.99 0.00 1.82 1.69 0.90 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.77 3.77 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 1.41 0.76 0.94 0.00 0.00 40 S 8.17 4.10 0.00 3.99 4.02 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 0.00 0.00 0.00 41 L 8.51 4.10 0.00 1.85 1.71 0.96 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.02 3.71 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 0.00 0.00 0.00 43 K 7.90 3.98 0.00 2.04 1.89 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.62 7.81 44 K 8.24 4.12 0.00 1.96 1.84 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.46 1.51 7.81 45 K 8.38 4.22 0.00 1.86 1.89 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.72 1.62 7.81 46 G 6.74 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.33 4.81 0.00 3.35 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 48 I 8.15 4.23 2.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.77 0.96 0.00 0.00 49 T 7.75 5.20 4.56 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 0.00 0.00 1.32 0.00 0.00 50 Y 8.94 4.04 0.00 3.07 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.32 4.07 0.00 2.10 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 2.53 2.52 0.00 52 D 7.97 4.45 0.00 2.95 2.85 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 0.00 0.00 0.00 0.00 53 I 7.88 3.86 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.81 0.83 0.00 0.00 54 D 7.68 4.36 0.00 2.70 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 55 K 8.05 4.20 0.00 1.93 1.97 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.19 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.70 7.81 56 A 7.77 4.14 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 57 F 7.33 4.04 0.00 3.03 3.01 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 58 P 0.00 3.01 0.00 1.91 1.40 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.80 0.00 59 P 0.00 4.82 0.00 2.31 2.18 0.00 3.70 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.16 0.00 60 D 8.58 4.70 0.00 2.64 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 61 F 8.35 4.35 0.00 3.27 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 62 E 8.88 3.98 0.00 1.94 1.99 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 2.26 2.43 0.00 63 G 7.72 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 64 F 9.02 4.79 0.00 3.22 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 65 D 7.72 4.88 0.00 2.67 2.46 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 66 T 8.57 3.88 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 1.23 0.00 0.00 67 N 8.21 4.49 0.00 2.80 2.86 0.00 0.00 6.80 6.75 0.00 0.00 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 7.56 3.95 0.00 1.63 1.76 0.90 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 69 I 7.38 3.73 2.03 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.15 1.00 0.00 0.00 70 E 8.11 4.08 0.00 2.20 2.21 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 0.00 2.45 2.40 0.00 71 R 8.40 4.00 0.00 1.98 2.02 0.00 3.30 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.81 0.00 72 I 8.41 3.69 1.98 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 1.50 0.91 0.85 0.00 0.00 73 H 7.95 4.22 0.00 3.27 3.36 0.00 5.81 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 74 E 8.37 3.95 0.00 2.26 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 0.00 2.39 2.59 0.00 75 E 8.32 4.21 0.00 2.27 2.07 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 2.36 2.49 0.00 76 L 8.15 4.15 0.00 1.77 1.87 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 77 E 7.67 3.98 0.00 1.97 2.10 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 2.31 2.36 0.00 78 K 8.40 4.12 0.00 1.89 1.93 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.71 1.62 7.81 79 H 8.26 4.40 0.00 3.37 3.44 0.00 5.76 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 80 G 8.26 4.13 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 0.00 0.00 0.00 81 I 7.56 3.80 1.85 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 1.41 0.83 0.95 0.00 0.00 82 N 8.68 4.66 0.00 2.77 2.77 0.00 0.00 6.88 7.47 0.00 0.00 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 I 8.08 4.60 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.49 0.98 0.00 0.00 84 V 8.84 4.52 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 0.87 0.00 0.00 0.95 0.00 0.00 85 E 8.60 4.01 0.00 2.01 1.99 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 2.40 2.22 0.00 86 N 8.32 4.51 0.00 2.87 3.01 0.00 0.00 6.92 7.62 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 87 E 7.55 4.20 0.00 1.89 1.80 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 2.27 2.29 0.00 88 P 0.00 4.62 0.00 2.07 1.99 0.00 3.70 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 89 E 7.86 4.46 0.00 2.03 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 0.00 2.21 2.55 0.00 90 E 7.78 4.56 0.00 1.90 1.85 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 0.00 2.16 2.24 0.00 91 E 7.91 4.76 0.00 2.04 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 2.17 2.24 0.00 92 E 7.99 4.49 0.00 1.92 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 2.20 2.27 0.00 93 I 7.82 4.18 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 1.41 0.84 0.91 0.00 0.00 94 S 8.88 3.75 0.00 3.99 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 95 A 7.04 4.68 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 96 G 7.65 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00