NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 60 A 4.3256 8.2649 123.5736 52.2367 20.5673 178.2559 61 L 4.0061 8.1392 114.0516 55.9184 42.1689 175.7058 62 I 4.4150 7.5711 118.6873 59.2393 39.5562 174.9913 63 R 4.2572 8.2075 124.2399 55.6288 31.2926 177.2111 64 K 4.0393 8.6672 125.1877 59.5995 32.3993 179.2651 65 L 4.0380 7.8699 118.7995 57.4896 41.6415 177.6560 66 P 4.3072 0.0000 0.0000 65.2283 31.2784 178.4830 67 F 4.0147 7.8421 119.4476 61.3532 39.3284 176.8970 68 Q 3.8591 8.7430 119.5860 59.1637 28.7017 178.3658 69 R 3.7953 8.0526 119.7113 59.1586 30.0489 178.1309 70 L 3.7786 7.6966 120.1898 58.0727 42.0396 179.0613 71 V 3.2161 7.2904 117.9371 65.9861 31.3785 178.0728 72 R 3.8842 7.7568 117.6315 59.4206 29.6815 178.9691 73 E 3.9354 8.0667 117.2293 59.3163 29.8569 179.2088 74 I 3.7324 7.9395 119.8331 64.4039 37.1903 178.4521 75 A 4.4080 8.5795 121.8159 55.0838 18.0884 179.4223 76 Q 3.9334 7.9989 118.4771 59.4728 28.9437 177.9897 77 D 4.2461 7.7217 117.6914 56.0881 40.7556 177.6310 78 F 4.9379 7.0720 117.0039 57.6798 40.1277 176.3797 79 K 4.3693 7.8696 118.5120 55.3215 35.0518 175.3363 80 T 4.2342 8.4461 116.1731 61.8146 69.7094 173.5159 81 D 4.2658 8.5803 119.5715 54.8025 37.7790 173.2780 82 L 4.3296 7.4565 118.2192 53.9774 44.2462 175.1880 83 R 4.7127 8.3792 125.0979 54.9798 31.9589 175.7458 84 F 4.6848 8.6095 117.9013 55.6573 41.1701 176.8890 85 Q 4.2413 8.4906 123.6884 55.7848 30.5820 177.8410 86 S 4.2318 8.7947 118.6215 61.9728 62.8029 177.1116 87 S 4.1651 8.1404 116.9229 60.8664 62.6921 176.3342 88 A 4.0190 7.8839 124.0759 55.1128 18.3412 179.4570 89 V 3.6184 8.0147 116.8601 66.3920 31.4650 177.8848 90 M 3.9983 8.3256 117.6479 58.5731 32.0572 177.9549 91 A 4.0089 8.2748 121.0725 55.3144 18.5230 179.6444 92 L 4.0211 8.2753 117.5635 57.8496 41.6193 179.5164 93 Q 2.9427 8.5738 119.9207 58.9730 28.9760 178.2239 94 E 3.8634 8.4019 119.6538 59.4127 29.4176 179.2954 95 A 4.0749 8.2644 120.9153 55.1076 18.3048 179.9527 96 S 4.2015 8.3255 113.9217 61.7838 62.8542 176.6417 97 E 3.9525 8.3775 121.2432 59.4849 29.2532 179.3912 98 A 4.0036 8.1615 120.7428 55.1015 18.3303 179.0514 99 Y 4.0651 8.4276 118.4366 61.0225 38.9164 178.4304 100 L 3.5642 8.2621 120.1378 57.4444 41.7005 179.5964 101 V 3.7156 8.1789 118.4100 66.0674 31.4957 178.0078 102 A 4.1543 8.0083 120.4754 55.0158 18.1485 179.3576 103 L 3.6715 7.8447 119.2153 58.2714 41.9808 179.3081 104 F 4.4295 8.3748 118.1140 60.2949 38.7509 177.5682 105 E 3.9959 8.2845 118.5014 59.6880 29.3449 179.1728 106 D 4.3950 8.1447 118.8250 57.4640 40.2786 178.9735 107 T 3.8801 8.2587 116.8384 66.7050 68.4060 176.1930 108 N 4.3838 8.5681 119.2407 56.5754 38.8735 176.8032 109 L 3.9724 7.9986 120.5107 57.8666 41.7167 178.9795 110 C 4.0617 8.2109 118.2480 62.5102 31.4484 175.4919 111 A 4.0110 7.9832 122.2244 55.2395 17.9709 179.6006 112 I 3.7528 8.0376 118.5468 64.9744 37.0090 178.2575 113 H 4.2167 8.4194 117.6929 58.8287 29.7587 176.3280 114 A 4.1447 7.8155 120.1719 51.5776 18.7856 176.8581 115 K 3.8816 8.0480 115.6246 57.8593 29.8938 175.8907 116 R 4.7301 8.2173 115.9275 54.7043 33.3218 176.6789 117 V 4.1692 8.3147 112.2469 61.5569 32.6964 175.9666 118 T 4.5679 7.6261 117.2439 61.2434 70.1879 174.1559 119 I 4.2219 8.2445 120.1698 60.8954 38.8313 174.9795 120 M 4.9076 9.2147 122.0021 52.3546 35.6529 174.8723 121 P 4.3060 0.0000 0.0000 65.8997 31.2948 179.0267 122 K 4.0008 8.0844 116.9982 60.1580 32.2687 178.8118 123 D 4.3756 8.1591 119.9875 57.1617 40.7367 178.7687 124 I 3.7326 7.5912 121.1557 63.9310 37.2071 178.3548 125 Q 4.0087 8.1453 118.8476 58.9935 28.5331 178.8560 126 L 4.0099 8.4142 120.2328 57.7015 41.6315 179.3784 127 A 4.0360 8.3499 121.0838 55.2694 18.3663 179.9391 128 R 3.9614 8.0830 116.5481 59.2141 30.1753 179.5490 129 R 3.9611 8.0258 118.2007 59.1826 29.9560 178.8099 130 I 3.7913 8.2117 117.4125 63.3646 38.0576 177.1632 131 R 4.3842 8.5672 116.8207 56.2863 30.3737 175.5819 132 G 3.4126 8.7271 111.5914 43.9286 0.0000 175.1273 133 E 3.3755 8.8542 123.9357 57.8753 29.8035 175.0476 134 R 4.2630 9.5910 114.5429 56.6721 31.0185 171.5995 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 60 A 8.26 4.33 1.29 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 0.00 0.00 0.00 61 L 8.14 4.01 0.00 1.83 1.73 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 62 I 7.57 4.42 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.50 0.81 0.00 0.00 63 R 8.21 4.26 0.00 1.85 1.81 0.00 3.18 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 64 K 8.67 4.04 0.00 2.04 1.79 0.00 1.74 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.63 7.81 65 L 7.87 4.04 0.00 1.75 1.72 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 66 P 0.00 4.31 0.00 2.21 2.12 0.00 3.88 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 67 F 7.84 4.01 0.00 2.96 3.20 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 68 Q 8.74 3.86 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 69 R 8.05 3.80 0.00 1.95 1.99 0.00 3.18 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 70 L 7.70 3.78 0.00 1.68 1.49 0.84 0.85 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 7.29 3.22 1.74 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 -0.07 0.00 0.00 0.23 0.00 0.00 72 R 7.76 3.88 0.00 1.98 1.95 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 73 E 8.07 3.94 0.00 1.98 1.95 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 2.47 2.44 0.00 74 I 7.94 3.73 1.96 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 1.40 1.10 1.02 0.00 0.00 75 A 8.58 4.41 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.00 3.93 0.00 2.31 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 77 D 7.72 4.25 0.00 2.23 2.33 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.07 4.94 0.00 3.33 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 79 K 7.87 4.37 0.00 1.73 1.71 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.38 7.81 80 T 8.45 4.23 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 1.21 0.00 0.00 81 D 8.58 4.27 0.00 2.80 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 82 L 7.46 4.33 0.00 1.54 1.64 0.84 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.38 4.71 0.00 1.87 1.92 0.00 3.27 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 84 F 8.61 4.68 0.00 2.96 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.49 4.24 0.00 2.14 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.86 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 86 S 8.79 4.23 0.00 4.08 4.18 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 87 S 8.14 4.17 0.00 4.10 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 88 A 7.88 4.02 1.56 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 0.00 0.00 0.00 89 V 8.01 3.62 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.97 0.00 0.00 90 M 8.33 4.00 0.00 2.31 2.06 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 2.59 2.65 0.00 91 A 8.27 4.01 1.44 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 0.00 0.00 92 L 8.28 4.02 0.00 2.11 2.03 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 8.57 2.94 0.00 1.74 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 1.95 1.33 0.00 94 E 8.40 3.86 0.00 2.14 1.97 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 2.29 2.42 0.00 95 A 8.26 4.07 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 96 S 8.33 4.20 0.00 3.95 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 97 E 8.38 3.95 0.00 2.13 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 2.27 2.45 0.00 98 A 8.16 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Y 8.43 4.07 0.00 3.12 3.22 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 0.00 100 L 8.26 3.56 0.00 1.77 1.70 1.03 1.01 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 0.00 101 V 8.18 3.72 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 1.04 0.00 0.00 1.01 0.00 0.00 102 A 8.01 4.15 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.84 3.67 0.00 1.06 1.20 0.70 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 104 F 8.37 4.43 0.00 3.31 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 0.00 105 E 8.28 4.00 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 2.35 2.56 0.00 106 D 8.14 4.40 0.00 2.80 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.26 3.88 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 1.31 0.00 0.00 108 N 8.57 4.38 0.00 2.96 2.96 0.00 0.00 7.27 7.12 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 0.00 109 L 8.00 3.97 0.00 1.96 1.71 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 110 C 8.21 4.06 0.00 3.11 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 0.00 111 A 7.98 4.01 1.49 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 0.00 112 I 8.04 3.75 2.05 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 1.42 0.83 0.93 0.00 0.00 113 H 8.42 4.22 0.00 3.18 3.36 0.00 5.94 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.82 4.14 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.05 3.88 0.00 1.92 1.92 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.35 7.81 116 R 8.22 4.73 0.00 1.87 1.79 0.00 3.14 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 117 V 8.31 4.17 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 0.73 0.00 0.00 0.93 0.00 0.00 118 T 7.63 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 0.00 119 I 8.24 4.22 1.94 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.58 0.95 0.00 0.00 120 M 9.21 4.91 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.62 0.00 121 P 0.00 4.31 0.00 2.16 2.13 0.00 3.62 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 122 K 8.08 4.00 0.00 1.98 2.08 0.00 1.51 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.55 7.81 123 D 8.16 4.38 0.00 2.89 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 0.00 124 I 7.59 3.73 2.01 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 1.56 1.42 0.82 0.00 0.00 125 Q 8.15 4.01 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 126 L 8.41 4.01 0.00 1.66 1.72 0.93 0.73 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 0.00 127 A 8.35 4.04 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 0.00 128 R 8.08 3.96 0.00 2.07 2.02 0.00 3.14 0.00 0.00 3.36 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 129 R 8.03 3.96 0.00 1.98 1.97 0.00 3.30 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.78 0.00 130 I 8.21 3.79 1.87 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 1.52 0.74 0.96 0.00 0.00 131 R 8.57 4.38 0.00 1.86 1.97 0.00 3.28 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 132 G 8.73 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 E 8.85 3.38 0.00 2.17 1.87 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 2.25 2.39 0.00 134 R 9.59 4.26 0.00 1.94 2.03 0.00 3.35 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.29 0.00