NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 92 T 4.5443 8.1749 117.3857 63.8068 69.8038 175.6334 93 N 4.5759 9.0543 124.5225 50.4167 37.4795 175.4244 94 K 4.2357 7.8676 116.9988 58.2254 34.8268 178.5852 95 R 4.1695 7.9550 118.9632 57.8009 31.1454 178.3089 96 G 4.2488 7.2537 109.5056 45.8311 0.0000 176.7939 97 E 3.8520 8.8948 124.7996 56.4552 29.6267 176.5996 98 R 4.1180 7.0365 119.4889 55.4745 30.9717 179.9099 99 R 3.0415 8.3082 115.3243 56.8945 30.7220 176.6661 100 R 5.5466 8.4521 122.7705 55.0317 31.9222 176.7544 101 R 4.6859 8.4280 124.2879 54.2383 33.7436 173.7738 102 R 5.5362 8.7559 122.3767 54.4871 30.9109 175.2235 103 C 4.7584 8.3687 117.5311 56.1810 33.4458 172.2007 104 Q 5.0041 8.4110 121.4545 54.6208 30.9265 174.2921 105 V 4.3906 9.2161 126.5568 60.2341 34.0710 175.7464 106 A 4.0635 8.8566 126.5035 50.7218 20.9144 176.5225 107 F 4.4596 8.9299 113.7832 59.6382 39.0807 175.9363 108 S 4.5829 7.7881 120.6425 56.5398 63.9758 173.2503 109 Y 3.9461 8.8312 129.4764 56.2570 37.3346 175.3136 110 L 4.2324 7.5543 125.7982 55.1858 40.9959 175.2824 111 P 4.4458 0.0000 0.0000 63.1303 31.2526 175.5403 112 Q 4.4056 7.8476 118.4906 56.1989 29.2082 174.5634 113 N 4.8011 9.9851 120.2610 54.5945 40.3374 175.6253 114 D 4.7423 8.7402 114.7991 53.8954 43.2886 176.2913 115 D 5.5432 7.4933 128.8575 54.9520 43.5989 173.8632 116 E 4.9602 7.9341 120.3250 53.4161 33.2375 175.4954 117 L 4.6882 8.3878 119.3761 54.4596 42.2724 175.5024 118 E 5.3286 8.5991 119.7933 53.7791 31.6114 175.3428 119 L 4.7224 8.3957 126.9129 53.1422 42.1157 177.5467 120 K 3.9348 9.1803 124.1422 59.0074 32.4200 178.8842 121 V 4.9932 7.9049 115.0014 59.6273 33.8710 174.4379 122 G 5.6235 7.3408 120.2413 46.9198 0.0000 171.3939 123 D 5.0795 7.3219 123.0558 53.2941 44.3214 175.8801 124 I 4.9123 8.1855 120.8812 59.8134 39.4366 175.2215 125 I 4.7711 9.3377 127.6364 59.8539 40.7951 174.9567 126 E 4.7211 8.6500 121.9903 57.0361 32.2263 176.3898 127 V 4.0922 9.7305 122.1848 61.6499 31.9186 177.6765 128 V 5.1163 8.2260 127.6724 59.3401 34.3906 178.6802 129 G 3.5405 7.9265 109.4008 45.9437 0.0000 174.9289 130 E 4.5541 8.7748 120.6888 57.8671 29.5243 178.8502 131 V 3.7395 8.1863 120.3580 65.3361 31.8781 176.0903 132 E 4.3382 8.6097 119.4426 60.0020 29.7756 177.2955 133 E 4.3595 8.4670 115.5854 59.2659 27.1710 176.3549 134 G 4.0475 10.6144 114.9651 44.8054 0.0000 171.5330 135 W 4.7022 7.9889 118.3538 53.4371 33.7617 174.2365 136 W 5.6011 9.1095 121.1557 55.4665 33.7896 174.2242 137 E 4.5878 8.4207 119.9590 55.6032 32.6871 175.2575 138 G 4.1518 8.2270 111.6220 45.9854 0.0000 171.8362 139 V 5.0787 7.7344 117.5311 59.7434 34.8441 175.0627 140 L 4.7503 9.2459 125.2076 54.1598 43.6133 175.6756 141 N 4.2617 10.2858 122.4516 54.3404 36.1640 175.5434 142 G 3.8993 8.5726 105.6245 44.9306 0.0000 174.0556 143 K 4.2870 8.7541 122.7421 55.5456 31.8050 175.5057 144 T 4.7634 8.1067 123.3917 62.9490 70.6752 174.5024 145 G 4.5626 8.9758 110.4417 47.6685 0.0000 171.7459 146 M 4.5545 8.5992 119.2425 54.8443 35.0995 175.2561 147 F 5.9584 8.2697 119.5286 53.4026 41.0356 172.5902 148 P 4.2493 0.0000 0.0000 63.8876 31.6953 175.9601 149 S 3.9293 8.0515 110.1932 59.4917 60.6585 174.7862 150 N 4.0604 8.1846 118.5909 56.4208 39.0130 175.6616 151 F 4.5623 7.9265 114.9002 57.7604 41.1994 174.9024 152 I 4.8485 7.4857 119.8922 58.7995 39.9547 174.0536 153 K 4.8105 8.0755 128.7723 56.3745 34.3794 173.6538 154 E 4.5380 9.0472 130.7432 56.9851 34.0488 177.9309 155 L 4.0374 7.8895 123.5271 55.8130 42.1343 176.9655 156 S 4.7028 9.2846 122.7105 58.6598 62.2838 172.1571 157 G 3.9249 7.6245 115.2394 44.4476 0.0000 170.6786 158 E 4.3287 9.2344 133.1697 56.2522 31.4142 175.5555 159 S 3.8441 8.6974 105.4709 61.1071 59.5883 169.6111 160 D 4.4370 7.8723 112.5984 56.0022 38.6799 175.2026 161 E 4.7554 7.5628 112.9438 56.0415 31.0946 177.7941 162 L 4.5021 7.6871 119.6239 54.8135 40.8670 178.1204 163 G 4.0035 8.2963 107.7160 45.3394 0.0000 175.1481 164 I 3.6620 7.0482 120.5912 61.9619 37.6123 175.9445 165 S 4.6246 8.2135 127.1020 56.7491 63.3592 174.5268 166 Q 4.2006 8.4132 122.9442 56.2395 28.4889 175.5085 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 92 T 8.17 4.54 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 1.23 0.00 0.00 93 N 9.05 4.58 0.00 2.89 2.80 0.00 0.00 7.01 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 94 K 7.87 4.24 0.00 1.88 1.96 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.43 7.81 95 R 7.95 4.17 0.00 1.80 2.00 0.00 3.24 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 96 G 7.25 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 0.00 0.00 0.00 0.00 97 E 8.89 3.85 0.00 2.04 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 2.35 2.36 0.00 98 R 7.04 4.12 0.00 1.93 1.97 0.00 3.26 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 99 R 8.31 3.04 0.00 1.94 1.83 0.00 3.11 0.00 0.00 3.33 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 100 R 8.45 5.55 0.00 1.66 1.86 0.00 3.36 0.00 0.00 3.80 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 101 R 8.43 4.69 0.00 1.73 1.55 0.00 3.12 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.45 0.00 102 R 8.76 5.54 0.00 1.93 1.87 0.00 2.60 0.00 0.00 3.89 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.38 0.00 103 C 8.37 4.76 0.00 2.70 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 0.00 104 Q 8.41 5.00 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 105 V 9.22 4.39 1.77 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 0.74 0.00 0.00 0.84 0.00 0.00 106 A 8.86 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.93 4.46 0.00 3.19 3.14 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 0.00 108 S 7.79 4.58 0.00 3.64 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 0.00 109 Y 8.83 3.95 0.00 2.95 3.02 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 0.00 110 L 7.55 4.23 0.00 1.62 1.58 0.78 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 111 P 0.00 4.45 0.00 1.88 1.72 0.00 3.28 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 112 Q 7.85 4.41 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.10 7.05 0.00 0.00 0.00 0.00 0.00 2.46 2.39 0.00 113 N 9.99 4.80 0.00 2.74 2.84 0.00 0.00 7.31 7.96 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 0.00 114 D 8.74 4.74 0.00 2.65 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.49 5.54 0.00 2.67 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 0.00 116 E 7.93 4.96 0.00 1.99 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 2.30 2.35 0.00 117 L 8.39 4.69 0.00 1.94 1.84 1.34 0.93 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 0.00 118 E 8.60 5.33 0.00 2.26 1.88 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 2.16 2.42 0.00 119 L 8.40 4.72 0.00 1.76 1.60 0.36 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 120 K 9.18 3.93 0.00 1.73 1.86 0.00 1.54 0.00 0.00 1.64 0.00 0.00 3.28 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.48 1.41 7.81 121 V 7.90 4.99 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 1.03 0.00 0.00 0.97 0.00 0.00 122 G 7.34 5.62 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 0.00 0.00 0.00 123 D 7.32 5.08 0.00 2.60 2.59 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 0.00 124 I 8.19 4.91 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.54 0.93 0.00 0.00 125 I 9.34 4.77 2.09 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.00 1.26 0.00 0.00 126 E 8.65 4.72 0.00 1.92 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 2.20 2.30 0.00 127 V 9.73 4.09 2.20 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 0.63 0.00 0.00 1.07 0.00 0.00 128 V 8.23 5.12 2.24 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 1.13 0.00 0.00 0.95 0.00 0.00 129 G 7.93 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 E 8.77 4.55 0.00 2.25 2.20 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 2.74 2.40 0.00 131 V 8.19 3.74 2.14 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 0.72 0.00 0.00 1.03 0.00 0.00 132 E 8.61 4.34 0.00 2.20 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 2.42 2.45 0.00 133 E 8.47 4.36 0.00 2.22 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 2.25 2.29 0.00 134 G 10.61 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 0.00 0.00 0.00 135 W 7.99 4.70 0.00 3.14 3.07 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 0.00 136 W 9.11 5.60 0.00 3.34 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 0.00 137 E 8.42 4.59 0.00 1.76 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 2.20 2.47 0.00 138 G 8.23 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.73 5.08 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 0.79 0.00 0.00 1.02 0.00 0.00 140 L 9.25 4.75 0.00 1.73 1.76 1.04 0.83 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 0.00 141 N 10.29 4.26 0.00 2.92 2.88 0.00 0.00 7.49 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.57 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 0.00 143 K 8.75 4.29 0.00 1.84 2.01 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.55 7.81 144 T 8.11 4.76 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 1.23 0.00 0.00 145 G 8.98 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 0.00 0.00 0.00 0.00 146 M 8.60 4.55 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.64 0.00 147 F 8.27 5.96 0.00 2.90 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 0.00 148 P 0.00 4.25 0.00 1.29 1.19 0.00 4.32 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.90 0.00 149 S 8.05 3.93 0.00 3.26 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 0.00 150 N 8.18 4.06 0.00 2.45 2.67 0.00 0.00 6.85 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 0.00 151 F 7.93 4.56 0.00 3.15 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 7.49 4.85 1.31 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.76 -0.51 0.00 0.00 153 K 8.08 4.81 0.00 1.76 1.81 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.50 7.81 154 E 9.05 4.54 0.00 1.80 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 155 L 7.89 4.04 0.00 1.46 1.53 -1.27 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 156 S 9.28 4.70 0.00 4.04 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 0.00 157 G 7.62 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 0.00 158 E 9.23 4.33 0.00 1.94 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 2.24 2.24 0.00 159 S 8.70 3.84 0.00 4.21 3.97 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 0.00 160 D 7.87 4.44 0.00 2.81 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 0.00 161 E 7.56 4.76 0.00 2.32 1.90 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 2.40 2.49 0.00 162 L 7.69 4.50 0.00 1.63 1.69 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 163 G 8.30 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 0.00 164 I 7.05 3.66 2.02 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 0.58 0.91 0.00 0.00 165 S 8.21 4.62 0.00 3.98 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 Q 8.41 4.20 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.70 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00