NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 79 A 4.5075 8.0700 122.9788 52.3464 21.0267 178.5130 80 L 3.8391 8.0283 117.2363 56.4850 41.9987 174.1929 81 V 4.0145 8.5296 117.4191 64.3605 32.0840 176.4334 82 D 4.5679 8.2270 120.5910 56.2127 41.1405 177.9159 83 V 4.4226 7.6130 109.5984 60.4504 33.9169 175.3477 84 F 4.4037 8.6718 122.6434 58.7868 39.7531 174.2001 85 I 4.3613 7.0510 125.8126 62.4511 40.0255 175.7379 86 K 4.1222 6.2741 118.9240 55.2069 35.5082 173.9436 87 L 5.1164 8.6455 127.0609 53.6645 44.6421 174.4833 88 D 5.0540 8.5919 126.2453 52.6302 44.9976 174.1461 89 G 4.3410 8.2794 105.1210 46.7921 0.0000 173.4482 90 T 4.6798 8.8632 117.0012 63.3292 73.8542 174.1150 91 G 4.2838 8.4426 115.7464 47.2219 0.0000 174.0955 92 N 4.9884 8.7546 122.1300 52.6236 37.6291 173.7055 93 L 5.1832 8.3242 120.1371 53.2805 44.5899 175.3091 94 L 5.1570 8.7362 122.3753 52.8887 45.3801 175.7405 95 V 4.6550 8.8395 123.6032 61.1877 33.8319 173.8562 96 L 4.7832 8.8513 131.9711 53.8110 43.5730 174.9659 97 R 4.9862 8.7913 128.0375 55.1398 32.0573 175.1079 98 T 5.0345 8.4877 115.9378 59.4309 72.3531 173.2896 99 L 4.2547 8.2819 120.5168 53.8185 42.9277 175.6514 100 P 4.2938 0.0000 0.0000 64.4791 31.5877 177.2159 101 G 3.9188 8.7445 109.7448 46.1185 0.0000 173.6119 102 N 4.7907 7.9614 115.7809 52.8982 39.4447 176.5960 103 A 3.9818 8.0850 122.1848 55.7923 18.4702 180.0925 104 H 4.0699 8.2523 113.5955 58.5021 28.5935 177.8298 105 A 4.0063 7.9409 122.6849 55.2298 18.3307 179.5132 106 I 3.8552 7.6394 117.8512 64.0964 37.2252 178.8127 107 G 3.6744 8.1782 106.9831 47.6555 0.0000 176.0013 108 V 3.5858 7.8245 120.5598 65.5312 31.3242 177.8567 109 L 3.8313 7.2547 119.0803 58.1053 42.3230 178.5412 110 L 3.8008 8.2325 119.0376 58.0771 41.2445 179.4854 111 D 4.3486 8.0761 118.3346 57.1995 40.4536 178.3621 112 N 4.1755 7.6908 115.7091 55.3781 38.6747 177.0427 113 L 3.9143 7.3588 120.0748 55.1691 42.3604 176.3759 114 D 4.3355 7.3244 116.5942 54.8023 40.3106 173.8067 115 W 4.7003 7.6517 118.1393 56.5009 30.1711 177.8662 116 D 4.5231 8.9567 122.8254 57.4900 40.8401 177.9510 117 E 4.0757 8.3451 118.3112 58.6420 29.7794 176.4527 118 I 4.3951 7.5827 120.2888 60.1487 37.5517 175.8370 119 V 3.7722 9.0410 127.6506 65.4582 32.0839 175.8946 120 G 4.0985 7.3362 105.3277 46.3343 0.0000 172.2126 121 T 5.3116 8.5009 115.4201 61.7237 72.7109 173.9987 122 I 4.6103 8.6542 124.5408 59.8731 41.0116 174.0653 123 C 5.1938 8.8238 124.2501 56.8156 30.9134 173.3838 124 G 4.0759 8.7762 108.9255 45.9980 0.0000 173.7040 125 D 4.7282 9.0170 124.0640 55.0410 42.6437 175.6591 126 D 4.9777 7.9575 114.1429 52.8970 41.6998 174.7493 127 T 5.1103 7.8260 115.1349 62.3143 72.9781 172.2928 128 C 5.0490 9.2624 123.4048 57.8724 31.3281 172.5968 129 L 4.7792 9.0812 127.2069 53.8347 43.4830 175.2005 130 I 4.7069 8.7862 128.8920 59.8600 39.0373 175.3303 131 I 4.4606 8.7188 130.3349 60.7716 37.7383 175.4264 132 C 5.0461 8.6347 125.2571 58.0520 29.8771 174.9187 133 R 4.0754 8.5028 120.4652 59.1515 29.9835 177.8418 134 T 4.7685 7.4221 106.0203 58.5308 73.3062 172.7732 135 P 4.6310 0.0000 0.0000 65.0553 31.2507 179.2280 136 K 3.9900 7.9694 117.0977 59.5748 31.9925 178.9838 137 D 4.4025 8.1946 118.9421 56.9330 40.6741 178.7538 138 A 4.0112 8.0934 121.7154 55.0242 18.4351 179.5169 139 K 3.9349 8.2681 118.3703 59.3624 32.2347 178.8947 140 K 3.8457 8.0124 119.8843 59.5599 32.1534 178.8846 141 V 3.6381 8.0944 118.8546 66.1056 31.4263 177.7455 142 S 4.1703 8.6466 113.1877 61.5170 62.2612 175.9602 143 N 4.3196 8.2862 118.9738 56.6156 38.1291 177.5068 144 Q 4.0010 7.8586 117.8968 58.7248 28.9481 178.6960 145 L 4.2902 8.3139 120.2384 57.9709 41.7108 179.5700 146 L 3.9084 8.1426 118.7854 57.1228 41.2912 179.1986 147 S 4.3267 7.7393 112.8645 60.3103 63.1712 175.1376 148 M 4.3839 7.5401 121.3319 55.3148 31.9829 175.9532 149 L 4.1815 7.4174 125.1172 54.7913 41.9892 176.2556 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 79 A 8.07 4.51 1.33 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 0.00 0.00 80 L 8.03 3.84 0.00 1.82 1.68 1.11 0.61 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 81 V 8.53 4.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.94 0.00 0.00 82 D 8.23 4.57 0.00 2.97 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.61 4.42 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 0.97 0.00 0.00 1.05 0.00 0.00 84 F 8.67 4.40 0.00 3.09 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 85 I 7.05 4.36 1.73 0.00 0.00 0.81 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 0.89 0.80 0.00 0.00 86 K 6.27 4.12 0.00 1.62 1.38 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.29 1.34 7.81 87 L 8.65 5.12 0.00 2.16 1.72 1.05 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 88 D 8.59 5.05 0.00 2.71 2.49 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 89 G 8.28 4.34 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 0.00 90 T 8.86 4.68 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 91 G 8.44 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.75 4.99 0.00 3.14 3.00 0.00 0.00 5.81 6.67 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 93 L 8.32 5.18 0.00 1.68 1.59 0.93 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 94 L 8.74 5.16 0.00 1.61 1.57 1.05 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 95 V 8.84 4.65 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 0.99 0.00 0.00 0.93 0.00 0.00 96 L 8.85 4.78 0.00 1.78 1.52 1.04 0.87 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 97 R 8.79 4.99 0.00 1.75 1.59 0.00 3.03 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.49 0.00 98 T 8.49 5.03 4.31 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 1.18 0.00 0.00 99 L 8.28 4.25 0.00 1.66 1.62 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.29 0.00 2.03 2.00 0.00 3.75 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 2.02 2.09 0.00 101 G 8.74 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 N 7.96 4.79 0.00 2.94 2.82 0.00 0.00 6.86 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 0.00 103 A 8.08 3.98 1.38 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 0.00 0.00 104 H 8.25 4.07 0.00 3.24 3.37 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.94 4.01 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 0.00 106 I 7.64 3.86 2.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.88 0.91 0.00 0.00 107 G 8.18 3.67 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 0.00 0.00 0.00 108 V 7.82 3.59 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 0.96 0.00 0.00 109 L 7.25 3.83 0.00 1.58 1.73 0.84 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 110 L 8.23 3.80 0.00 1.78 1.57 0.66 1.07 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 0.00 111 D 8.08 4.35 0.00 2.74 2.68 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 0.00 112 N 7.69 4.18 0.00 2.86 2.82 0.00 0.00 7.05 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.36 3.91 0.00 0.88 0.66 -0.19 0.91 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 0.00 114 D 7.32 4.34 0.00 2.71 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 0.00 115 W 7.65 4.70 0.00 3.44 3.19 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 0.00 116 D 8.96 4.52 0.00 2.69 2.78 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 0.00 117 E 8.35 4.08 0.00 2.19 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 2.38 2.53 0.00 118 I 7.58 4.40 1.95 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.73 0.98 0.00 0.00 119 V 9.04 3.77 2.19 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 0.72 0.00 0.00 0.97 0.00 0.00 120 G 7.34 4.10 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 0.00 0.00 0.00 121 T 8.50 5.31 4.40 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 1.16 0.00 0.00 122 I 8.65 4.61 1.86 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 1.22 0.91 0.90 0.00 0.00 123 C 8.82 5.19 0.00 2.30 2.62 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 0.00 0.00 0.00 0.00 124 G 8.78 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 0.00 125 D 9.02 4.73 0.00 2.74 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.96 4.98 0.00 2.94 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 T 7.83 5.11 4.21 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 1.18 0.00 0.00 128 C 9.26 5.05 0.00 2.91 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 0.00 129 L 9.08 4.78 0.00 1.66 1.53 0.92 1.00 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 0.00 130 I 8.79 4.71 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.84 0.94 0.00 0.00 131 I 8.72 4.46 1.98 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 1.23 0.45 0.92 0.00 0.00 132 C 8.63 5.05 0.00 3.02 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 0.00 133 R 8.50 4.08 0.00 2.03 2.01 0.00 3.13 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.74 0.00 134 T 7.42 4.77 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 0.00 135 P 0.00 4.63 0.00 2.18 2.15 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 2.12 2.04 0.00 136 K 7.97 3.99 0.00 1.80 1.85 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.53 7.81 137 D 8.19 4.40 0.00 2.98 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 0.00 138 A 8.09 4.01 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 0.00 139 K 8.27 3.93 0.00 1.88 1.98 0.00 1.54 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.44 1.49 7.81 140 K 8.01 3.85 0.00 1.97 1.90 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.78 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.35 7.81 141 V 8.09 3.64 2.32 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 1.32 0.00 0.00 1.19 0.00 0.00 142 S 8.65 4.17 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.29 4.32 0.00 2.95 2.81 0.00 0.00 7.06 6.90 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 0.00 144 Q 7.86 4.00 0.00 1.84 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.96 0.00 0.00 0.00 0.00 0.00 2.15 2.39 0.00 145 L 8.31 4.29 0.00 1.97 1.78 1.05 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 146 L 8.14 3.91 0.00 1.67 1.66 0.96 0.54 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 0.00 147 S 7.74 4.33 0.00 4.04 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 0.00 148 M 7.54 4.38 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.04 2.64 0.00 149 L 7.42 4.18 0.00 1.50 1.40 0.07 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00