NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9087 8.3549 109.7375 45.3483 0.0000 173.4595 2 S 4.2013 7.7861 114.2048 56.0736 64.0689 173.8602 3 S 4.2279 8.8582 116.7324 62.7579 64.1979 172.9704 4 G 3.7395 7.2816 107.6191 44.1193 0.0000 173.0001 5 S 4.2475 7.9757 114.9127 57.4621 65.0524 175.9091 6 S 4.3552 8.8182 122.8683 57.4889 63.4456 173.0269 7 G 4.2071 7.4630 111.1268 45.5141 0.0000 171.9411 8 M 5.1605 8.6549 122.3851 53.4092 34.7549 175.1692 9 K 4.3892 8.3457 121.0596 57.8103 34.5323 176.5019 10 H 4.4475 7.5267 116.7122 54.7309 32.5962 172.1197 11 S 5.2197 9.4202 120.1878 55.8735 65.6681 172.7409 12 G 4.4118 7.4605 111.3663 44.3218 0.0000 171.9500 13 Y 4.5873 7.7757 119.9855 58.3143 38.6702 175.4433 14 L 4.5378 8.9630 121.5742 53.4513 47.3366 174.4790 15 W 4.4777 8.6614 120.7810 54.9579 30.4291 175.4369 16 A 5.2568 7.5091 125.1575 49.8076 21.8077 174.9613 17 I 5.4052 7.7043 119.5358 59.2221 41.4972 174.1658 18 G 4.9107 8.5497 120.1295 44.4770 0.0000 171.6475 19 K 4.3825 8.8553 116.7774 58.0062 33.4681 177.2947 20 N 4.6041 8.1032 113.8760 54.1827 39.4526 175.1385 21 V 4.2343 7.1359 109.3518 59.1097 35.4082 174.6638 22 W 4.1631 8.2174 116.6031 57.6590 26.7956 177.3873 23 K 4.1766 8.3122 119.0586 59.6097 31.7277 177.5723 24 R 4.4349 7.8402 115.5415 55.1315 31.1889 176.2195 25 W 4.7988 8.6027 131.5572 56.1672 30.2261 174.7892 26 K 4.6489 7.8463 125.7424 53.9200 35.4684 175.2521 27 K 3.0046 7.5416 125.6924 56.3945 32.0512 175.9938 28 R 4.7368 8.3296 126.3696 53.5875 34.2244 175.1212 29 F 4.5958 8.7788 123.2787 58.9322 40.9902 173.9085 30 F 4.6532 7.7508 122.0846 55.7013 43.3922 173.8066 31 V 4.8628 8.4400 122.2895 61.0601 34.6733 173.8998 32 L 4.8242 8.9152 130.3888 54.7248 42.7760 175.5533 33 V 4.9014 8.8154 126.7130 60.6692 34.5785 174.4909 34 Q 3.3588 8.2272 126.4945 54.3109 28.9961 175.6437 35 V 3.5769 8.1761 126.6085 65.2710 32.1412 175.6911 36 S 4.7529 7.7386 112.4760 55.6128 65.5411 174.4596 37 Q 3.7841 8.6474 121.6759 58.8260 28.3189 178.5471 38 Y 5.0367 7.8360 113.4726 57.6534 39.2538 175.3654 39 T 4.9962 8.6157 115.8892 62.2609 73.2985 173.7192 40 F 5.4180 9.1415 122.7661 55.9932 44.1542 173.2717 41 A 5.2186 9.0903 120.2656 51.1737 23.2608 175.8179 42 M 4.9796 9.4449 121.3005 54.6830 33.1895 175.0124 43 C 4.5097 8.9413 123.0524 58.5693 30.0595 173.6318 44 S 4.4657 8.5944 121.4145 56.6489 62.8466 172.6081 45 Y 4.7749 8.4066 122.4111 56.9563 36.7116 175.6178 46 R 4.1841 8.3331 123.9525 58.0397 30.9817 177.1092 47 E 4.1274 8.0289 117.2057 55.8855 30.3283 176.2228 48 K 4.2348 8.2316 120.9945 55.2934 31.8431 176.5426 49 K 3.6910 8.8541 126.0708 56.7742 28.4140 174.9962 50 A 4.7221 7.5192 119.3115 50.1386 22.8088 176.0384 51 E 4.2597 8.5840 117.3955 55.6995 30.0302 175.4014 52 P 4.4113 0.0000 0.0000 62.9934 32.0519 176.1243 53 Q 4.0534 8.1312 122.6670 58.3410 29.6087 175.3977 54 E 4.5289 7.6006 116.8755 54.4582 32.6023 174.2949 55 L 5.5033 7.6171 123.1733 53.5734 45.7233 174.7259 56 L 4.7378 8.6812 126.8738 53.1358 45.4427 175.1749 57 Q 4.6241 8.8471 126.6345 55.7214 30.0286 176.5525 58 L 5.0490 9.3176 125.7483 55.2615 42.6429 177.3036 59 D 4.9215 7.9350 120.1159 49.9087 37.7976 174.1664 60 G 3.8387 9.0867 118.1676 47.1325 0.0000 171.9773 61 Y 4.1870 7.6304 116.0104 58.0833 38.3672 176.5769 62 T 4.7013 8.9893 121.9482 61.8499 69.5535 173.2334 63 V 4.6162 8.5189 125.8484 60.5876 32.6647 175.2946 64 D 4.4528 8.4301 120.8352 52.2119 41.8296 174.7917 65 Y 4.3654 8.3511 118.2404 59.3170 38.2657 175.7846 66 T 4.8289 8.5919 117.8486 60.0847 70.9122 173.3113 67 D 4.4556 8.8699 126.4563 53.5902 41.4304 174.8995 68 P 2.9700 0.0000 0.0000 61.9425 30.6380 176.4207 69 Q 3.7505 7.4771 123.3268 54.6985 29.1900 174.4247 70 P 4.2688 0.0000 0.0000 65.6797 30.9044 174.0310 71 G 3.3421 8.6539 116.9180 45.1924 0.0000 172.5123 72 L 2.9294 6.5133 124.6649 54.4536 41.6554 177.7516 73 E 4.6837 8.4890 126.5718 54.8987 29.1136 173.8545 74 G 2.4627 7.9656 108.6813 45.5588 0.0000 172.1317 75 G 3.7892 6.7841 107.1459 42.5183 0.0000 172.1030 76 R 4.1172 7.9913 119.7809 58.3195 29.6715 176.4619 77 A 4.3257 7.8959 120.3030 52.5845 20.0628 175.4189 78 F 5.4478 8.9592 118.5649 55.6688 43.1260 174.3334 79 F 5.1199 9.4275 118.8941 55.9355 41.0759 172.9826 80 N 5.7020 9.1790 120.4363 50.8686 40.9897 172.7358 81 A 5.0591 9.2893 122.0775 50.4092 21.8836 175.7275 82 V 4.3498 8.8490 122.8197 61.5200 32.8450 174.7953 83 K 4.6759 8.6917 128.2871 54.6555 35.4115 176.7756 84 E 3.9077 8.7692 124.4349 59.2563 29.4402 179.0880 85 G 4.2241 7.8685 102.1967 44.8409 0.0000 171.4447 86 D 5.0691 7.8240 118.4490 52.4672 44.1239 175.2497 87 T 5.2613 8.5246 118.1780 62.0499 72.2187 173.4758 88 V 4.6994 8.5582 125.9431 61.1776 35.1995 174.2879 89 I 4.8231 7.8344 125.6951 59.8278 40.2958 174.6108 90 F 4.9467 8.8086 121.9697 55.8773 43.5492 173.6233 91 A 5.6146 8.8648 121.9337 50.2582 23.1309 175.3291 92 S 5.1104 8.6489 113.9144 56.5553 66.5070 174.1185 93 D 4.4479 9.0206 118.3013 56.2790 41.5153 176.0409 94 D 5.0114 7.7026 117.0841 50.7214 43.8869 175.8758 95 E 4.1125 8.6425 120.1256 59.0991 29.2103 178.5238 96 Q 3.9856 8.1019 119.4539 59.1400 29.1505 177.6153 97 D 4.3388 8.0045 118.2030 57.4372 41.3296 177.7767 98 R 3.3419 7.4750 117.7422 59.6603 29.9318 177.8072 99 I 3.7877 7.4633 119.1233 64.8718 37.2052 178.3149 100 L 4.0617 7.5473 118.4954 57.4976 41.2855 179.8144 101 W 3.9920 7.8660 118.9350 59.4014 29.0321 178.8654 102 V 3.4817 8.1160 118.5480 66.0150 30.7914 178.0202 103 Q 4.0520 8.5300 118.0223 58.8961 28.4610 178.7915 104 A 3.8597 7.5607 120.2156 55.4151 18.5737 179.3176 105 M 3.8628 8.3965 117.3497 58.7288 32.0666 178.2216 106 Y 4.2459 8.3365 119.8011 61.1694 38.7076 178.7926 107 R 3.3694 7.1438 116.4483 58.8250 30.1749 178.4023 108 A 3.5153 7.5424 120.0495 55.0945 18.3044 179.4095 109 T 4.6205 7.3051 108.4209 62.7692 69.5786 176.2666 110 G 3.5723 8.3954 108.7243 45.5754 0.0000 173.3029 111 Q 4.2906 8.0058 116.7854 55.9948 29.4358 176.3137 112 S 4.2663 8.5716 113.4171 60.9911 63.2738 174.6399 113 H 4.6125 7.8942 118.4983 53.9967 27.8810 174.7991 114 K 3.4209 8.3616 126.6107 54.9678 32.6719 175.0413 115 P 4.5469 0.0000 0.0000 62.6295 32.0522 176.0005 116 V 4.4907 8.1807 118.9411 58.9968 34.2611 173.3138 117 P 3.4615 0.0000 0.0000 61.5368 31.6676 174.8790 118 P 4.4826 0.0000 0.0000 62.6233 32.4154 175.2161 119 T 4.5572 7.9090 110.7836 62.1329 67.6194 174.9396 120 Q 4.2516 8.0594 120.6618 53.8314 27.4875 175.8566 121 S 4.1075 8.1987 116.2382 59.6313 62.6039 175.6525 122 G 4.9749 7.3673 126.3318 45.2200 0.0000 169.7224 123 P 4.5734 0.0000 0.0000 62.6325 32.7236 176.4204 124 S 4.7123 8.1556 113.4554 56.6526 65.6299 174.3650 125 S 4.4736 8.5282 118.8098 58.0878 63.2721 174.0935 126 G 3.7573 8.2538 112.4436 46.3243 0.0000 173.3296 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 1 G 8.35 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 2 S 7.79 4.20 0.00 3.95 3.82 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 3 S 8.86 4.23 0.00 3.97 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 4 G 7.28 3.74 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 0.00 0.00 0.00 5 S 7.98 4.25 0.00 3.74 3.64 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 6 S 8.82 4.36 0.00 3.85 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 7 G 7.46 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 0.00 0.00 0.00 0.00 8 M 8.65 5.16 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 9 K 8.35 4.39 0.00 1.72 1.73 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.77 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.53 1.64 7.81 10 H 7.53 4.45 0.00 2.55 1.69 0.00 5.80 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 S 9.42 5.22 0.00 3.96 3.80 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 0.00 0.00 0.00 12 G 7.46 4.41 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 13 Y 7.78 4.59 0.00 2.85 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 14 L 8.96 4.54 0.00 1.08 1.19 -0.38 0.74 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 15 W 8.66 4.48 0.00 2.22 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 0.00 0.00 0.00 0.00 16 A 7.51 5.26 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.70 5.41 2.32 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.37 1.09 0.00 0.00 18 G 8.55 4.91 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 19 K 8.86 4.38 0.00 1.80 1.89 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.50 7.81 20 N 8.10 4.60 0.00 2.69 2.81 0.00 0.00 6.70 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 21 V 7.14 4.23 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.13 0.00 0.00 22 W 8.22 4.16 0.00 3.63 3.23 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 23 K 8.31 4.18 0.00 1.79 1.96 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.61 1.52 7.81 24 R 7.84 4.43 0.00 1.87 1.95 0.00 3.30 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 25 W 8.60 4.80 0.00 3.46 3.10 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 26 K 7.85 4.65 0.00 1.77 1.52 0.00 1.83 0.00 0.00 1.58 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.11 1.44 7.81 27 K 7.54 3.00 0.00 0.79 0.74 0.00 1.55 0.00 0.00 1.12 0.00 0.00 2.72 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.88 0.67 7.81 28 R 8.33 4.74 0.00 1.44 1.57 0.00 3.18 0.00 0.00 3.04 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.47 0.00 29 F 8.78 4.60 0.00 3.07 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 30 F 7.75 4.65 0.00 2.85 2.54 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 31 V 8.44 4.86 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 1.05 0.00 0.00 0.69 0.00 0.00 32 L 8.92 4.82 0.00 2.17 1.66 1.11 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.82 4.90 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 1.32 0.00 0.00 1.20 0.00 0.00 34 Q 8.23 3.36 0.00 1.25 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.72 0.00 0.00 0.00 0.00 0.00 1.71 1.16 0.00 35 V 8.18 3.58 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 0.81 0.00 0.00 0.92 0.00 0.00 36 S 7.74 4.75 0.00 3.85 3.71 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 37 Q 8.65 3.78 0.00 2.05 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.36 0.00 0.00 0.00 0.00 0.00 2.17 2.32 0.00 38 Y 7.84 5.04 0.00 2.90 2.99 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 0.00 0.00 0.00 39 T 8.62 5.00 4.38 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 1.31 0.00 0.00 40 F 9.14 5.42 0.00 2.96 3.08 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 41 A 9.09 5.22 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 M 9.44 4.98 0.00 2.37 2.50 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.76 0.00 43 C 8.94 4.51 0.00 2.63 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 0.00 0.00 0.00 0.00 44 S 8.59 4.47 0.00 4.04 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 45 Y 8.41 4.77 0.00 3.29 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 46 R 8.33 4.18 0.00 1.82 2.01 0.00 3.22 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 47 E 8.03 4.13 0.00 1.94 1.92 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 2.31 2.40 0.00 48 K 8.23 4.23 0.00 1.75 1.73 0.00 1.88 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.41 7.81 49 K 8.85 3.69 0.00 1.91 1.92 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.39 7.81 50 A 7.52 4.72 1.22 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 0.00 0.00 51 E 8.58 4.26 0.00 2.14 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 2.31 2.27 0.00 52 P 0.00 4.41 0.00 1.96 1.47 0.00 3.86 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.03 0.00 53 Q 8.13 4.05 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.64 0.00 0.00 0.00 0.00 0.00 2.33 2.44 0.00 54 E 7.60 4.53 0.00 1.62 1.12 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 1.71 1.98 0.00 55 L 7.62 5.50 0.00 1.49 1.38 1.04 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.68 4.74 0.00 1.86 1.93 1.14 0.75 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 57 Q 8.85 4.62 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.01 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 58 L 9.32 5.05 0.00 1.85 1.82 1.01 0.77 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 59 D 7.93 4.92 0.00 2.89 2.80 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 0.00 0.00 0.00 60 G 9.09 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.63 4.19 0.00 3.09 2.98 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 0.00 0.00 0.00 62 T 8.99 4.70 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 63 V 8.52 4.62 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 0.95 0.00 0.00 64 D 8.43 4.45 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.35 4.37 0.00 2.92 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 66 T 8.59 4.83 4.33 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 1.37 0.00 0.00 67 D 8.87 4.46 0.00 2.65 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 2.97 0.00 1.63 1.67 0.00 3.67 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 1.80 1.93 0.00 69 Q 7.48 3.75 0.00 1.76 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 7.06 0.00 0.00 0.00 0.00 0.00 2.22 2.14 0.00 70 P 0.00 4.27 0.00 2.07 1.99 0.00 3.59 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.86 0.00 71 G 8.65 3.34 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 72 L 6.51 2.93 0.00 1.29 0.13 0.25 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.49 4.68 0.00 1.83 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 2.15 2.27 0.00 74 G 7.97 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.78 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 0.00 0.00 0.00 76 R 7.99 4.12 0.00 1.79 1.87 0.00 3.35 0.00 0.00 3.25 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 77 A 7.90 4.33 1.41 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 78 F 8.96 5.45 0.00 3.13 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 79 F 9.43 5.12 0.00 2.97 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 80 N 9.18 5.70 0.00 3.02 2.98 0.00 0.00 6.00 7.49 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 81 A 9.29 5.06 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 82 V 8.85 4.35 2.17 0.00 0.00 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 83 K 8.69 4.68 0.00 1.18 1.53 0.00 1.07 0.00 0.00 0.61 0.00 0.00 2.67 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.73 1.09 7.81 84 E 8.77 3.91 0.00 1.95 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 2.29 2.29 0.00 85 G 7.87 4.22 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 0.00 0.00 0.00 86 D 7.82 5.07 0.00 2.64 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 87 T 8.52 5.26 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 1.28 0.00 0.00 88 V 8.56 4.70 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 0.60 0.00 0.00 1.06 0.00 0.00 89 I 7.83 4.82 1.80 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 1.20 0.46 0.91 0.00 0.00 90 F 8.81 4.95 0.00 1.51 1.61 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 0.00 0.00 0.00 0.00 91 A 8.86 5.61 1.14 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 0.00 0.00 92 S 8.65 5.11 0.00 4.02 4.16 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 0.00 0.00 0.00 93 D 9.02 4.45 0.00 2.84 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 94 D 7.70 5.01 0.00 2.89 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 95 E 8.64 4.11 0.00 2.09 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 2.41 2.43 0.00 96 Q 8.10 3.99 0.00 2.22 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.67 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 97 D 8.00 4.34 0.00 3.28 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 98 R 7.47 3.34 0.00 1.78 2.16 0.00 3.40 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.00 0.00 99 I 7.46 3.79 2.05 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 1.61 0.60 0.97 0.00 0.00 100 L 7.55 4.06 0.00 1.69 1.45 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 101 W 7.87 3.99 0.00 3.16 2.88 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 0.00 0.00 0.00 102 V 8.12 3.48 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 0.66 0.00 0.00 0.25 0.00 0.00 103 Q 8.53 4.05 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.62 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 104 A 7.56 3.86 1.19 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 0.00 0.00 105 M 8.40 3.86 0.00 1.97 2.18 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.97 0.00 106 Y 8.34 4.25 0.00 2.97 3.23 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 0.00 107 R 7.14 3.37 0.00 1.78 1.75 0.00 3.23 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.85 0.00 108 A 7.54 3.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 T 7.31 4.62 4.42 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 1.38 0.00 0.00 110 G 8.40 3.57 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 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 8.01 4.29 0.00 2.29 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.85 7.37 0.00 0.00 0.00 0.00 0.00 2.78 2.71 0.00 112 S 8.57 4.27 0.00 3.75 3.82 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 0.00 113 H 7.89 4.61 0.00 3.19 3.29 0.00 5.70 0.00 0.00 0.00 0.00 6.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.36 3.42 0.00 1.58 1.56 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.87 0.21 7.81 115 P 0.00 4.55 0.00 2.18 1.89 0.00 2.35 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 116 V 8.18 4.49 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 0.88 0.00 0.00 0.88 0.00 0.00 117 P 0.00 3.46 0.00 2.03 1.92 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.89 0.00 118 P 0.00 4.48 0.00 2.11 2.03 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.78 0.00 119 T 7.91 4.56 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 1.18 0.00 0.00 120 Q 8.06 4.25 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 121 S 8.20 4.11 0.00 3.81 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 0.00 122 G 7.37 4.97 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 0.00 0.00 0.00 123 P 0.00 4.57 0.00 2.19 2.10 0.00 3.71 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 124 S 8.16 4.71 0.00 3.83 3.77 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 0.00 125 S 8.53 4.47 0.00 3.82 3.74 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 0.00 126 G 8.25 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 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