NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 P 4.3626 0.0000 0.0000 62.2010 32.8699 177.0022 11 A 3.8327 8.5774 127.4677 54.7141 18.7341 177.5447 12 L 4.2270 8.6587 115.8375 56.8767 42.9090 177.3185 13 D 4.3912 7.7128 118.7302 57.3159 40.7547 177.6011 14 S 4.2698 7.8072 112.5768 58.8809 63.0803 173.7866 15 L 3.7607 7.3998 122.7245 55.1567 41.7662 176.3085 16 A 4.2072 8.5626 130.0050 51.7236 18.6741 176.0625 17 L 4.5728 8.3257 123.1747 53.3162 43.5182 176.3823 18 D 4.6497 8.6333 123.5317 53.4468 40.3708 175.6273 19 L 4.9963 8.1736 123.8399 53.3855 44.1728 176.2680 20 T 4.7002 8.9106 117.9407 61.6894 71.9686 173.3022 21 L 4.6918 8.5356 125.5619 54.3440 42.8316 176.0338 22 R 4.5147 9.1946 124.9434 54.3702 32.4539 175.8875 23 C 4.8472 8.5245 124.4107 60.1327 28.9226 172.3525 24 G 3.7495 8.3737 105.9306 44.5947 0.0000 173.0300 25 E 4.7410 8.8637 115.4886 55.3394 32.6166 173.7425 26 L 4.5979 7.8839 117.6548 54.9035 42.7969 174.1155 27 R 4.5892 8.4514 119.7136 54.4350 32.0027 174.9630 28 L 5.0137 8.2271 124.4189 52.3442 45.3380 177.1146 29 T 4.1653 9.0765 113.6399 61.3708 70.8516 175.7127 30 L 3.9494 8.4867 121.5474 57.9797 41.5963 179.7526 31 A 3.9914 7.9082 120.1349 55.1185 18.4732 179.3653 32 E 3.8639 8.1272 117.0859 59.6226 29.3930 179.4544 33 L 4.0123 7.8602 118.8321 58.0458 42.1147 178.9457 34 R 4.0718 7.8142 117.6130 59.3207 30.1136 178.9353 35 R 4.2224 7.7550 116.5948 57.3202 30.1289 176.7241 36 L 3.9074 7.3941 120.9877 55.3982 42.2156 175.7711 37 D 4.9497 8.3893 124.6176 50.6218 42.1455 175.2323 38 A 3.9428 8.3197 122.4307 54.2228 18.6392 177.3803 39 G 4.0808 8.8679 109.2816 45.7342 0.0000 174.5394 40 T 3.8872 7.1998 116.4333 63.6684 68.8260 173.5837 41 I 4.3214 8.2484 126.7486 59.6468 38.3877 174.9088 42 L 4.5985 8.2099 125.7192 52.5545 43.1739 176.2133 43 E 4.0215 8.7049 124.3991 56.1614 30.2499 175.8318 44 V 4.4931 8.2143 125.0547 61.4025 33.7764 174.8213 45 T 4.5652 8.9496 123.2244 62.5109 70.9411 173.7897 46 G 4.1155 9.5586 111.2812 45.4424 0.0000 174.0189 47 I 4.6728 7.0686 109.9523 58.6289 40.7577 174.7321 48 S 4.6403 8.2028 115.8268 56.2041 64.6288 171.8491 49 P 4.1846 0.0000 0.0000 64.4083 31.6524 177.2851 50 G 3.8979 9.0625 109.3382 45.4366 0.0000 172.3426 51 H 5.4388 7.4260 115.3899 54.2930 31.9331 173.3305 52 A 4.9351 8.6977 120.4535 51.2620 23.0764 175.3705 53 T 4.9507 8.7286 110.2994 60.0246 71.8177 173.3193 54 L 4.8861 8.9009 126.5440 54.5081 43.7358 175.0702 55 C 5.3318 9.2535 123.6299 58.2174 32.5690 172.5309 56 H 4.8662 9.3843 123.8917 53.8850 31.2380 174.8860 57 G 3.7253 8.6764 118.0151 47.2543 0.0000 173.0687 58 E 4.4702 8.9855 123.1153 55.6849 29.7215 174.8607 59 Q 4.3847 8.0987 120.3846 54.2793 29.6301 175.2970 60 V 4.1907 8.3670 123.6463 62.9867 32.1347 175.6449 61 V 4.4800 8.7937 119.4317 61.4714 34.1572 175.0647 62 A 4.9610 7.6153 120.2347 51.0476 22.5055 174.8453 63 E 4.9240 8.7919 118.7548 55.0651 33.8083 175.7679 64 G 4.4912 8.4674 107.6281 46.1972 0.0000 171.3717 65 E 5.1887 8.8436 119.1548 54.1840 32.5241 176.0372 66 L 4.6614 8.9518 125.0843 54.8493 42.3109 176.8864 67 V 4.5470 8.8373 116.6448 59.4875 36.1803 173.8539 68 D 5.0669 8.5893 121.7822 52.9336 42.5673 176.3254 69 V 4.1234 9.2664 127.6544 61.7814 31.1147 174.7598 70 E 3.9259 9.8238 127.9802 56.9727 27.1432 176.2285 71 G 4.0019 9.2382 107.8499 45.2115 0.0000 174.8492 72 R 4.4600 7.9002 119.0827 54.6029 31.7101 175.0403 73 L 4.6346 8.3117 122.6043 54.8593 42.8805 176.1403 74 G 4.2681 9.4756 112.9965 44.2438 0.0000 171.5377 75 L 5.0300 8.3741 123.4506 52.9963 44.1030 175.7389 76 Q 4.2990 9.0871 130.0254 55.0343 29.8674 175.0524 77 I 4.3096 8.4442 128.7248 62.1291 36.9933 176.1520 78 T 4.4450 8.7516 117.3607 62.7639 70.5460 175.0396 79 R 4.6510 7.6792 120.5686 55.0226 33.6799 173.4415 80 L 4.7437 8.4944 125.4417 53.4924 43.3426 176.7081 81 V 3.9768 8.3611 122.8516 63.0103 31.0964 175.4390 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 10 P 0.00 4.36 0.00 2.36 2.06 0.00 3.56 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.09 0.00 11 A 8.58 3.83 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 12 L 8.66 4.23 0.00 1.81 1.72 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 13 D 7.71 4.39 0.00 2.90 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 14 S 7.81 4.27 0.00 4.04 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 15 L 7.40 3.76 0.00 1.82 1.60 0.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.56 4.21 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 17 L 8.33 4.57 0.00 1.63 1.59 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.63 4.65 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.17 5.00 0.00 1.53 1.67 0.93 0.96 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 20 T 8.91 4.70 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 1.21 0.00 0.00 21 L 8.54 4.69 0.00 1.51 1.61 0.92 0.84 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 22 R 9.19 4.51 0.00 1.82 1.76 0.00 3.05 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 23 C 8.52 4.85 0.00 2.98 2.90 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 24 G 8.37 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.86 4.74 0.00 2.10 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 2.19 2.31 0.00 26 L 7.88 4.60 0.00 1.71 1.73 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 27 R 8.45 4.59 0.00 1.75 1.82 0.00 3.17 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 28 L 8.23 5.01 0.00 1.62 1.50 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 29 T 9.08 4.17 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 1.26 0.00 0.00 30 L 8.49 3.95 0.00 1.80 1.77 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.91 3.99 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 32 E 8.13 3.86 0.00 2.22 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 2.33 2.31 0.00 33 L 7.86 4.01 0.00 1.62 1.70 0.92 0.87 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 34 R 7.81 4.07 0.00 2.02 1.97 0.00 3.21 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 35 R 7.75 4.22 0.00 2.04 1.99 0.00 3.17 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 36 L 7.39 3.91 0.00 1.79 1.78 0.92 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 37 D 8.39 4.95 0.00 2.91 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 38 A 8.32 3.94 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 39 G 8.87 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 7.20 3.89 4.32 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 1.21 0.00 0.00 41 I 8.25 4.32 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 0.70 0.91 0.00 0.00 42 L 8.21 4.60 0.00 1.62 1.59 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 43 E 8.70 4.02 0.00 1.92 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 2.29 2.30 0.00 44 V 8.21 4.49 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 0.98 0.00 0.00 0.98 0.00 0.00 45 T 8.95 4.57 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 1.21 0.00 0.00 46 G 9.56 4.12 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 0.00 0.00 0.00 47 I 7.07 4.67 1.90 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 1.47 0.78 0.92 0.00 0.00 48 S 8.20 4.64 0.00 4.04 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 49 P 0.00 4.18 0.00 2.07 2.05 0.00 3.71 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 50 G 9.06 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 0.00 0.00 0.00 51 H 7.43 5.44 0.00 3.14 3.20 0.00 5.68 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 52 A 8.70 4.94 1.21 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 0.00 0.00 0.00 0.00 0.00 53 T 8.73 4.95 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 1.22 0.00 0.00 54 L 8.90 4.89 0.00 1.75 1.58 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 55 C 9.25 5.33 0.00 2.98 2.90 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 56 H 9.38 4.87 0.00 3.14 3.18 0.00 5.71 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 57 G 8.68 3.73 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 0.00 0.00 0.00 58 E 8.99 4.47 0.00 1.92 1.96 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 2.22 2.36 0.00 59 Q 8.10 4.38 0.00 2.28 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.01 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 60 V 8.37 4.19 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 0.83 0.00 0.00 0.93 0.00 0.00 61 V 8.79 4.48 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 0.69 0.00 0.00 1.00 0.00 0.00 62 A 7.62 4.96 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 63 E 8.79 4.92 0.00 1.89 1.82 0.00 0.00 0.00 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 2.22 0.00 64 G 8.47 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.84 5.19 0.00 1.84 1.79 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 2.04 2.21 0.00 66 L 8.95 4.66 0.00 1.45 1.60 0.91 0.83 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 67 V 8.84 4.55 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 0.71 0.00 0.00 0.92 0.00 0.00 68 D 8.59 5.07 0.00 2.67 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 69 V 9.27 4.12 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 1.03 0.00 0.00 0.93 0.00 0.00 70 E 9.82 3.93 0.00 2.11 1.98 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 2.22 2.28 0.00 71 G 9.24 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 72 R 7.90 4.46 0.00 2.00 1.84 0.00 3.12 0.00 0.00 3.09 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 73 L 8.31 4.63 0.00 1.63 1.56 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.48 4.27 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 0.00 75 L 8.37 5.03 0.00 1.62 1.57 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 9.09 4.30 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 77 I 8.44 4.31 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 1.40 0.92 0.97 0.00 0.00 78 T 8.75 4.45 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 1.29 0.00 0.00 79 R 7.68 4.65 0.00 1.87 1.75 0.00 3.16 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 80 L 8.49 4.74 0.00 1.56 1.57 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.36 3.98 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 0.71 0.00 0.00 0.93 0.00 0.00