NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Q 4.1731 8.3444 119.6854 56.2924 29.7951 178.7436 16 L 3.4010 7.7462 131.0639 54.9699 39.5643 169.2925 17 V 3.8663 8.7561 125.8377 61.6316 32.7663 175.1177 18 I 4.2157 8.2284 128.9750 61.1586 37.6252 175.8460 19 Q 4.5076 9.1685 125.2741 57.6405 29.7277 175.6882 20 E 4.7596 7.8076 114.8130 55.4594 33.1007 174.9227 21 S 5.0060 8.4865 116.0360 57.2870 66.0913 173.2199 22 I 4.3543 8.8779 127.0480 59.5853 38.9802 174.9642 23 L 4.7832 8.4625 129.1250 54.7667 42.9190 175.4087 24 M 5.0807 9.2701 125.0344 53.6430 36.7187 174.2693 25 L 4.7995 8.8289 119.7263 52.7961 44.3781 176.4067 26 P 3.9913 0.0000 0.0000 66.0714 31.2494 178.7530 27 E 3.9452 8.0666 116.6029 59.3788 29.2021 178.9872 28 E 3.9513 8.0860 118.6307 59.4463 29.4487 179.7399 29 V 3.7206 7.6455 117.6740 65.9594 31.6832 177.3772 30 E 4.7289 8.3777 120.7005 58.9240 29.2214 178.3820 31 E 3.9307 8.2982 118.2150 58.4073 29.5905 177.9926 32 V 4.1354 6.8500 116.5996 65.0892 32.6725 177.6571 33 I 3.9161 8.4454 118.6799 62.4157 37.0585 177.5868 34 G 4.0698 8.7553 107.6759 45.0018 0.0000 172.9406 35 N 5.1260 7.8791 116.2406 51.1619 41.9622 172.8792 36 K 4.7718 8.5768 122.5510 53.8368 33.6406 174.3078 37 P 3.7210 0.0000 0.0000 62.2798 31.7603 176.4658 38 E 4.2512 8.4180 118.3065 56.4939 29.7029 176.1851 39 S 4.5032 6.7570 112.6640 58.4867 66.5312 175.0614 40 D 4.6301 8.8336 119.2322 55.0946 41.4041 176.1172 41 I 4.6924 8.5830 122.2533 59.4824 41.0687 174.5936 42 L 4.9868 8.9860 125.6059 53.0692 44.2103 176.0411 43 V 4.2512 9.0810 126.3999 62.2798 32.6112 174.7055 44 H 5.2902 9.1589 127.5131 54.9775 30.1323 174.4236 45 T 5.1645 8.7963 120.7510 61.6287 71.4397 173.7513 46 A 4.9897 9.1048 127.2684 50.3909 21.7673 174.6733 47 Y 4.8202 9.1335 124.2188 57.4286 40.5213 175.0295 48 D 4.3785 7.8598 124.7376 52.0241 41.8606 176.4466 49 E 3.6146 8.0415 124.0899 58.9006 29.3658 178.8694 50 S 4.1435 7.1668 112.9569 60.3652 63.3460 174.6864 51 T 3.7667 7.8354 116.2294 61.6202 69.5740 173.5865 52 D 4.3647 7.8592 120.9689 55.9522 39.9099 172.5807 53 E 5.0056 7.4897 117.5683 54.6626 33.8771 176.5163 54 N 5.3665 8.8105 120.2349 51.6649 41.2231 173.9321 55 V 4.3063 9.0242 125.9984 62.1983 33.1086 174.5328 56 M 5.2795 8.7945 127.8716 53.4159 35.1133 174.4716 57 L 4.8600 9.1832 126.2260 53.3915 44.5955 174.8681 58 L 5.2742 8.9417 128.1014 53.9139 43.3590 176.1900 59 T 5.3863 8.8155 113.6804 59.4123 72.8566 173.4893 60 S 4.7817 8.9957 117.4815 58.0151 64.7737 173.0758 61 D 4.7832 8.5237 119.8060 53.3946 42.5016 175.1543 62 A 3.3192 8.6105 124.4970 52.0132 18.6842 175.5294 63 P 4.2223 0.0000 0.0000 62.5393 31.9766 176.6052 64 E 4.0152 7.3372 118.2579 59.5098 29.7942 177.8465 65 Y 4.2104 7.4823 111.9652 57.8289 35.5650 169.9758 66 K 4.1574 7.9658 121.7452 55.8878 33.1852 174.2792 67 P 4.5294 0.0000 0.0000 63.6410 31.6185 174.4568 68 W 4.7827 9.9435 132.0728 58.4128 32.9315 174.8949 69 A 4.8492 7.8067 118.8333 50.1705 23.0259 173.7196 70 L 4.9942 8.8984 120.8200 53.3046 45.3961 175.3568 71 V 4.8084 8.6812 126.0350 61.2173 34.4438 173.9309 72 I 4.7407 8.6667 129.2637 59.7494 39.4861 174.4990 73 Q 5.6346 8.7517 126.9184 53.4159 32.5094 174.7407 74 D 4.9873 8.4603 125.5675 52.0537 42.0937 176.7085 75 S 4.2313 8.9091 113.8732 61.3101 62.7693 175.1175 76 N 4.9157 7.7774 116.5441 52.4527 37.3174 175.0203 77 G 3.9051 8.1030 104.2162 47.4564 0.0000 174.0202 78 E 4.2925 7.7710 121.1426 55.6532 31.0207 174.9884 79 N 5.3854 8.6822 122.6650 51.6816 41.0110 175.1267 80 K 4.4764 9.2984 124.2501 54.7565 32.5325 175.3194 81 I 4.5394 7.9220 124.1847 60.8226 38.8651 175.2468 82 K 4.3759 8.3954 125.1799 55.6978 35.8608 174.7549 83 M 4.2139 8.6034 127.6521 55.0953 32.9722 176.3578 84 L 4.2916 8.1502 121.8896 54.8394 41.6465 176.4703 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 15 Q 8.34 4.17 0.00 2.05 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 16 L 7.75 3.40 0.00 1.70 1.56 0.92 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.76 3.87 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 0.87 0.00 0.00 0.99 0.00 0.00 18 I 8.23 4.22 1.85 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 1.39 0.88 0.99 0.00 0.00 19 Q 9.17 4.51 0.00 1.92 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.63 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 20 E 7.81 4.76 0.00 2.00 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 2.28 2.34 0.00 21 S 8.49 5.01 0.00 3.72 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 22 I 8.88 4.35 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 1.11 1.20 0.91 0.00 0.00 23 L 8.46 4.78 0.00 1.64 1.56 0.95 0.89 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 24 M 9.27 5.08 0.00 1.91 1.89 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 2.49 2.61 0.00 25 L 8.83 4.80 0.00 1.53 1.51 0.90 1.39 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 26 P 0.00 3.99 0.00 2.08 2.18 0.00 3.53 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 2.27 0.00 27 E 8.07 3.95 0.00 2.03 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 2.39 2.45 0.00 28 E 8.09 3.95 0.00 2.16 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 2.33 2.31 0.00 29 V 7.65 3.72 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 1.28 0.00 0.00 0.91 0.00 0.00 30 E 8.38 4.73 0.00 2.13 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 0.00 2.34 2.24 0.00 31 E 8.30 3.93 0.00 2.13 2.23 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 2.34 2.34 0.00 32 V 6.85 4.14 2.26 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 0.96 0.00 0.00 1.02 0.00 0.00 33 I 8.45 3.92 2.36 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 1.83 1.29 0.82 0.00 0.00 34 G 8.76 4.07 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 0.00 0.00 0.00 35 N 7.88 5.13 0.00 2.88 2.91 0.00 0.00 6.66 7.07 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 36 K 8.58 4.77 0.00 1.89 1.72 0.00 1.74 0.00 0.00 1.93 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.27 1.51 7.81 37 P 0.00 3.72 0.00 1.61 0.49 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.44 0.00 38 E 8.42 4.25 0.00 2.05 2.06 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 2.22 2.21 0.00 39 S 6.76 4.50 0.00 3.74 3.79 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 40 D 8.83 4.63 0.00 2.54 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 41 I 8.58 4.69 1.78 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.49 0.99 0.00 0.00 42 L 8.99 4.99 0.00 1.71 1.35 1.24 0.82 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 43 V 9.08 4.25 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 0.88 0.00 0.00 0.96 0.00 0.00 44 H 9.16 5.29 0.00 3.33 3.22 0.00 5.83 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 8.80 5.16 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 1.27 0.00 0.00 46 A 9.10 4.99 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 47 Y 9.13 4.82 0.00 2.91 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 48 D 7.86 4.38 0.00 2.60 2.26 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 49 E 8.04 3.61 0.00 1.87 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 2.38 2.32 0.00 50 S 7.17 4.14 0.00 3.92 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 51 T 7.84 3.77 4.20 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 1.17 0.00 0.00 52 D 7.86 4.36 0.00 2.81 2.75 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 53 E 7.49 5.01 0.00 1.86 1.76 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 2.42 2.29 0.00 54 N 8.81 5.37 0.00 2.70 2.80 0.00 0.00 6.67 7.78 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 55 V 9.02 4.31 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 1.02 0.00 0.00 0.97 0.00 0.00 56 M 8.79 5.28 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 57 L 9.18 4.86 0.00 1.69 1.62 0.91 0.53 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 58 L 8.94 5.27 0.00 2.02 1.88 1.25 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.82 5.39 4.50 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 1.37 0.00 0.00 60 S 9.00 4.78 0.00 3.89 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 61 D 8.52 4.78 0.00 2.82 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 62 A 8.61 3.32 1.24 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 0.00 0.00 0.00 63 P 0.00 4.22 0.00 2.05 2.01 0.00 3.62 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.87 0.00 64 E 7.34 4.02 0.00 1.92 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 2.16 0.00 65 Y 7.48 4.21 0.00 3.20 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 66 K 7.97 4.16 0.00 1.91 1.76 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.49 7.81 67 P 0.00 4.53 0.00 2.02 2.04 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 68 W 9.94 4.78 0.00 3.35 3.32 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 69 A 7.81 4.85 0.59 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 70 L 8.90 4.99 0.00 1.67 1.58 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.68 4.81 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 0.94 0.00 0.00 0.93 0.00 0.00 72 I 8.67 4.74 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 1.24 1.03 0.91 0.00 0.00 73 Q 8.75 5.63 0.00 2.24 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.63 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 74 D 8.46 4.99 0.00 2.84 2.82 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 0.00 0.00 0.00 75 S 8.91 4.23 0.00 3.90 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 76 N 7.78 4.92 0.00 2.82 2.86 0.00 0.00 6.99 6.88 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 77 G 8.10 3.91 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 0.00 0.00 0.00 78 E 7.77 4.29 0.00 2.28 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 2.30 2.34 0.00 79 N 8.68 5.39 0.00 2.63 2.71 0.00 0.00 6.82 7.61 0.00 0.00 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 K 9.30 4.48 0.00 1.82 1.71 0.00 1.54 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.41 7.81 81 I 7.92 4.54 1.83 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 1.21 0.46 0.81 0.00 0.00 82 K 8.40 4.38 0.00 1.73 1.54 0.00 1.58 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.52 7.81 83 M 8.60 4.21 0.00 1.72 1.84 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 84 L 8.15 4.29 0.00 1.58 1.54 0.92 0.64 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