NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.5086 8.3301 116.8018 58.7131 63.4681 173.5683 1 A 4.5108 8.1587 128.6711 50.2953 19.0610 174.4605 2 F 4.4412 9.5743 119.2020 58.2550 40.7823 174.6961 3 N 5.2455 7.6700 118.6000 53.7279 39.0830 173.6142 4 G 3.5677 8.0721 105.9325 43.5657 0.0000 171.5317 5 K 4.8670 8.0712 120.2825 54.4437 34.6993 175.7849 6 W 5.2926 9.5312 127.2375 55.0084 33.0785 174.5185 7 E 4.9899 9.2499 122.2625 54.6559 32.6522 174.5344 8 T 4.1837 8.3333 123.3363 64.0765 68.4084 173.0890 9 E 4.6139 9.3681 127.7103 57.3561 31.7585 175.9758 10 S 4.8357 7.6492 111.6669 57.0414 66.5556 173.4623 11 Q 4.9920 8.4450 118.8252 54.7731 31.0903 173.9228 12 E 4.5964 9.5229 124.0822 55.7928 32.0720 177.4186 13 G 4.0777 9.0814 110.5122 46.8991 0.0000 174.4205 14 Y 4.1820 8.2486 120.6830 61.0603 38.5760 177.7952 15 E 3.8483 8.2986 118.5640 59.1510 29.8078 177.5451 16 P 4.2586 0.0000 0.0000 65.2473 31.2398 178.6366 17 F 3.9862 8.1030 119.4915 61.4349 39.3219 177.0663 18 C 4.1123 8.0850 116.4090 62.7346 27.9964 176.1842 19 K 3.9083 8.1687 120.2242 59.2775 31.3390 179.2092 20 L 4.0217 7.4674 119.6795 57.7223 42.1330 178.1400 21 I 4.0574 7.0414 109.9425 60.4562 38.3572 175.5299 22 G 3.6383 7.7542 106.0474 46.9328 0.0000 174.1364 23 I 4.3733 7.4633 119.0250 58.3187 39.3629 175.4998 24 P 4.4259 0.0000 0.0000 62.4968 33.2445 177.0831 25 D 4.4050 8.6390 120.3256 57.6776 40.6445 178.7850 26 D 4.4978 8.0070 117.3601 55.6020 39.7119 178.0117 27 V 3.8729 7.6614 119.0017 65.4611 31.9060 177.3899 28 I 3.9478 7.8225 119.5245 63.4889 37.2290 176.5000 29 A 4.1885 7.7403 122.5545 53.1521 18.7482 178.1956 30 K 4.1541 8.9798 118.7924 56.8348 29.8645 176.7658 31 G 4.2297 7.7519 105.9710 45.6349 0.0000 174.9838 32 R 3.5033 7.8388 115.5128 57.8735 29.8639 176.8270 33 D 4.8022 8.0205 117.3935 53.9349 41.1370 175.1960 34 F 4.8977 8.0185 121.1360 56.2893 40.9893 174.7152 35 K 4.1499 7.7251 126.4421 54.2509 34.4258 175.3262 36 L 3.9839 7.9032 127.5778 54.1987 44.0222 175.1686 37 V 4.9061 8.2661 125.1558 61.6920 33.9529 174.2922 38 T 5.2715 9.0242 123.7308 61.8314 72.1287 172.6251 39 E 5.1932 9.2424 124.9707 54.6254 33.0307 175.0447 40 I 4.8390 8.8296 124.5035 59.4163 41.1304 174.3561 41 V 4.8262 8.6778 126.9067 60.2746 33.7395 173.9819 42 Q 4.3282 8.7492 128.4122 54.2931 31.5133 174.5786 43 N 4.7288 8.3795 124.8546 51.6645 40.8784 175.7716 44 G 3.8468 8.6231 118.0060 46.2473 0.0000 172.6301 45 D 4.8560 9.0067 127.7848 54.3041 42.4819 175.2612 46 D 5.1221 7.7114 120.4729 53.8050 42.4052 175.3950 47 F 5.1308 8.9287 121.1915 55.8487 43.5008 173.9157 48 T 5.0541 9.1919 119.2726 61.5743 71.7574 172.7820 49 W 4.9624 9.8486 135.0000 56.0996 33.2208 173.8682 50 T 5.0958 8.8716 125.1879 61.8868 70.4636 173.8512 51 Q 4.9852 9.1613 125.3401 54.2410 32.6663 174.3592 52 Y 4.8932 8.3666 120.7087 56.9037 39.2616 175.0338 53 Y 4.9916 8.9359 122.7264 55.4243 40.6938 174.0106 54 P 4.6163 0.0000 0.0000 63.9002 31.8773 176.3527 55 N 4.1723 9.0594 114.0578 53.9818 36.1477 174.1378 56 N 4.1301 7.4244 110.2336 54.8527 37.9994 174.3947 57 H 4.8157 8.2285 117.8578 55.1776 31.3155 174.0385 58 V 4.7159 8.3434 126.2289 61.1519 33.3677 174.8006 59 V 4.4362 8.6737 127.5100 61.4554 33.9387 174.0238 60 T 5.2152 8.6658 124.2900 61.8834 70.9862 173.3103 61 N 5.1645 9.6141 123.7526 51.3784 41.6742 173.5490 62 K 5.3255 8.8986 122.9637 54.5659 34.7552 175.4787 63 F 5.1362 8.8386 119.1082 55.3790 41.5842 173.2585 64 I 5.0745 8.4585 120.8534 59.2073 39.9764 175.5742 65 V 4.0256 8.5337 127.4999 64.4414 31.6786 175.8842 66 G 3.9821 10.0103 115.7201 45.9344 0.0000 173.0330 67 K 4.6477 7.7333 116.5621 53.9562 36.3995 175.8072 68 E 4.1156 9.0632 125.4686 57.3274 30.0409 176.1069 69 S 4.9121 9.1954 122.7754 56.5095 67.2614 173.1633 70 D 4.9141 8.6461 122.5489 54.6682 41.3958 175.6623 71 M 4.7752 8.8511 122.2299 53.4288 36.6907 173.9879 72 E 5.3198 8.3657 120.4185 54.9647 33.1371 175.3129 73 T 4.4545 8.9480 117.1354 60.8357 70.0311 176.0128 74 V 3.5586 8.1791 114.6101 63.5219 31.5288 177.7151 75 G 3.6415 7.9550 107.0600 45.8802 0.0000 174.6156 76 G 3.9262 8.0217 107.9578 44.9674 0.0000 173.2184 77 K 4.3602 8.2535 120.5246 55.5279 33.1765 176.3262 78 K 5.1867 8.7092 124.9629 55.8396 33.7480 175.7489 79 F 4.9300 8.7779 117.5941 56.2052 41.8647 172.5999 80 K 4.9576 8.5035 117.7475 54.9045 34.8516 175.9285 81 G 4.2441 8.5333 109.1340 45.6606 0.0000 171.8858 82 I 4.9084 8.2615 120.1526 59.3682 40.0689 175.3368 83 V 4.3706 8.3719 127.6470 61.4688 33.2031 175.0159 84 S 4.9845 8.6138 122.4172 57.1729 65.9257 172.7115 85 M 4.9961 8.5144 120.4405 53.9977 34.3320 175.0735 86 E 4.4427 8.8636 126.3419 55.3915 32.4032 176.0334 87 G 4.0008 9.6237 114.2153 46.6941 0.0000 174.0934 88 G 4.0189 8.6403 107.2628 44.8062 0.0000 173.9480 89 K 4.8072 7.6306 120.0485 54.5826 34.1547 175.8010 90 L 4.5621 8.6899 126.3231 54.9023 42.8270 176.2264 91 T 4.8693 8.8138 120.7441 61.5682 72.0308 172.8690 92 I 4.6620 8.4653 126.2610 59.2666 41.3698 174.6667 93 S 4.3095 8.4371 122.4698 57.4256 64.1412 173.0545 94 F 5.1277 8.7536 126.8806 54.6990 41.1302 173.9328 95 P 4.2906 0.0000 0.0000 64.2005 31.5677 177.3657 96 K 4.0314 9.7455 120.1315 56.7955 30.0626 174.5823 97 Y 5.3013 7.5995 120.1927 56.5252 42.7441 173.1568 98 Q 4.4996 8.7023 127.5071 54.0890 32.9810 173.3080 99 Q 4.7449 8.1819 126.2041 54.4242 32.5344 173.9022 100 T 5.1223 8.6994 122.5804 61.8628 72.1526 173.1273 101 T 5.3122 8.7893 115.4421 59.9942 72.2347 172.6775 102 E 5.2067 9.2548 121.8905 54.9529 34.0768 174.3847 103 I 4.5780 8.0871 121.1699 60.0343 38.1188 175.4404 104 S 4.4627 8.6071 122.7063 57.0145 64.3875 174.2945 105 G 3.8712 9.6784 117.7925 46.8217 0.0000 174.1101 106 G 3.9794 8.4756 104.7904 45.2204 0.0000 173.6087 107 K 4.9919 7.6427 118.6273 54.3153 36.1658 174.9115 108 L 4.3092 8.4837 124.6244 53.9109 43.2647 175.4400 109 V 4.7097 8.8277 127.7429 61.3023 33.9082 173.9719 110 E 5.0219 9.4018 128.9081 55.0419 31.7497 175.2885 111 T 4.8371 9.0404 122.5803 61.9869 71.1028 173.4333 112 S 4.9673 9.0119 123.6851 56.9002 65.7091 173.5117 113 T 5.2904 8.9868 120.8458 61.7371 71.4787 172.8353 114 A 5.2554 9.0451 127.9794 50.2206 22.1931 174.6482 115 S 5.0183 8.7066 118.7700 57.2881 64.8532 174.3705 116 G 3.9653 8.9184 111.6796 44.4769 0.0000 172.5838 117 A 3.9872 8.6690 121.1833 54.8903 18.4448 178.3692 118 Q 4.4975 7.7531 112.1767 56.6886 30.2008 175.4891 119 G 4.1055 7.8618 106.0031 44.7966 0.0000 175.5376 120 T 5.1412 8.3299 117.7427 60.0570 70.3806 171.8239 121 A 4.9631 8.9706 128.8611 50.0915 22.6103 174.8486 122 V 5.0822 8.4710 118.6948 60.9885 35.1675 173.9482 123 L 4.9844 8.9784 129.3378 53.1033 45.1576 174.9638 124 V 4.7022 9.0022 126.4708 61.2897 33.9157 173.9618 125 R 4.9492 9.3153 129.9994 55.0207 32.1087 174.6705 126 T 5.0812 9.0223 123.7566 61.9263 70.9340 173.6207 127 S 5.3548 9.2750 122.2890 56.5470 66.9098 173.3290 128 K 4.9209 8.6569 122.0950 54.5359 35.9213 175.2197 129 K 3.8280 8.4497 122.4802 56.3337 32.7603 176.3393 130 V 3.7152 8.5745 128.3180 62.2494 32.0564 175.9560 131 L 4.7181 8.3463 128.4470 53.8601 42.3369 176.4428 132 V 4.4426 7.3464 116.5940 59.3430 34.2896 172.7324 133 P 4.3458 0.0000 0.0000 62.9482 31.1046 176.1891 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 0 S 8.33 4.51 0.00 3.91 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 1 A 8.16 4.51 1.26 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 0.00 0.00 2 F 9.57 4.44 0.00 3.42 3.33 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 3 N 7.67 5.25 0.00 2.80 2.77 0.00 0.00 7.65 7.84 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 4 G 8.07 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 5 K 8.07 4.87 0.00 1.69 1.46 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.41 7.81 6 W 9.53 5.29 0.00 3.21 3.06 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 0.00 0.00 0.00 7 E 9.25 4.99 0.00 1.96 1.73 0.00 0.00 0.00 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 2.21 0.00 8 T 8.33 4.18 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 1.13 0.00 0.00 9 E 9.37 4.61 0.00 1.92 2.04 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 2.22 2.22 0.00 10 S 7.65 4.84 0.00 3.88 3.88 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 11 Q 8.44 4.99 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.78 0.00 0.00 0.00 0.00 0.00 2.08 2.22 0.00 12 E 9.52 4.60 0.00 1.88 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 2.25 2.39 0.00 13 G 9.08 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 14 Y 8.25 4.18 0.00 3.07 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 15 E 8.30 3.85 0.00 2.15 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 2.50 2.64 0.00 16 P 0.00 4.26 0.00 2.21 2.12 0.00 3.80 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 17 F 8.10 3.99 0.00 3.30 3.15 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 18 C 8.09 4.11 0.00 2.91 2.81 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 0.00 0.00 0.00 0.00 19 K 8.17 3.91 0.00 1.76 1.83 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.55 7.81 20 L 7.47 4.02 0.00 1.65 1.63 0.84 1.07 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 21 I 7.04 4.06 1.74 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 1.58 0.64 0.57 0.00 0.00 22 G 7.75 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 0.00 0.00 0.00 23 I 7.46 4.37 1.94 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 1.28 0.65 0.90 0.00 0.00 24 P 0.00 4.43 0.00 2.15 1.97 0.00 3.59 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 25 D 8.64 4.40 0.00 2.69 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 26 D 8.01 4.50 0.00 2.83 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 27 V 7.66 3.87 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 0.92 0.00 0.00 0.94 0.00 0.00 28 I 7.82 3.95 2.09 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 1.33 1.00 1.03 0.00 0.00 29 A 7.74 4.19 1.36 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 0.00 0.00 30 K 8.98 4.15 0.00 1.98 2.01 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.40 7.81 31 G 7.75 4.23 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 0.00 0.00 0.00 32 R 7.84 3.50 0.00 1.75 2.13 0.00 3.11 0.00 0.00 3.31 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 33 D 8.02 4.80 0.00 2.72 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 34 F 8.02 4.90 0.00 2.93 3.17 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 0.00 0.00 0.00 0.00 35 K 7.73 4.15 0.00 1.42 1.48 0.00 1.72 0.00 0.00 1.55 0.00 0.00 2.84 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.33 1.24 7.81 36 L 7.90 3.98 0.00 1.51 1.36 0.32 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.27 4.91 2.11 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 0.90 0.00 0.00 0.85 0.00 0.00 38 T 9.02 5.27 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 0.98 0.00 0.00 39 E 9.24 5.19 0.00 1.96 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 40 I 8.83 4.84 2.09 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 0.73 0.79 0.00 0.00 41 V 8.68 4.83 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 1.15 0.00 0.00 0.92 0.00 0.00 42 Q 8.75 4.33 0.00 1.54 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.90 0.00 0.00 0.00 0.00 0.00 1.85 1.16 0.00 43 N 8.38 4.73 0.00 2.56 2.56 0.00 0.00 7.32 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 44 G 8.62 3.85 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 0.00 0.00 0.00 45 D 9.01 4.86 0.00 2.79 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 46 D 7.71 5.12 0.00 2.53 2.50 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 0.00 47 F 8.93 5.13 0.00 1.51 2.27 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 0.00 48 T 9.19 5.05 4.26 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 1.26 0.00 0.00 49 W 9.85 4.96 0.00 3.64 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 50 T 8.87 5.10 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 0.89 0.00 0.00 51 Q 9.16 4.99 0.00 2.14 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 52 Y 8.37 4.89 0.00 2.86 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 53 Y 8.94 4.99 0.00 3.19 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 54 P 0.00 4.62 0.00 2.14 1.97 0.00 3.77 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 55 N 9.06 4.17 0.00 2.90 2.95 0.00 0.00 7.01 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 N 7.42 4.13 0.00 2.93 2.90 0.00 0.00 6.92 7.77 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 57 H 8.23 4.82 0.00 3.34 3.46 0.00 5.80 0.00 0.00 0.00 0.00 6.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 8.34 4.72 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 0.48 0.00 0.00 1.04 0.00 0.00 59 V 8.67 4.44 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.87 0.00 0.00 60 T 8.67 5.22 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 1.28 0.00 0.00 61 N 9.61 5.16 0.00 2.88 2.91 0.00 0.00 6.45 7.53 0.00 0.00 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 K 8.90 5.33 0.00 1.65 1.73 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.45 7.81 63 F 8.84 5.14 0.00 3.02 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 64 I 8.46 5.07 1.94 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 1.35 1.23 0.97 0.00 0.00 65 V 8.53 4.03 2.40 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 0.88 0.00 0.00 1.21 0.00 0.00 66 G 10.01 3.98 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 0.00 0.00 0.00 67 K 7.73 4.65 0.00 1.82 1.70 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.76 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.41 7.81 68 E 9.06 4.12 0.00 1.98 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 2.29 2.36 0.00 69 S 9.20 4.91 0.00 3.77 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 70 D 8.65 4.91 0.00 2.54 2.56 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 71 M 8.85 4.78 0.00 1.26 0.57 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 72 E 8.37 5.32 0.00 1.93 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 2.24 2.35 0.00 73 T 8.95 4.45 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 1.16 0.00 0.00 74 V 8.18 3.56 1.31 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 0.44 0.00 0.00 0.76 0.00 0.00 75 G 7.96 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 0.00 0.00 0.00 76 G 8.02 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.25 4.36 0.00 1.69 1.73 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.39 7.81 78 K 8.71 5.19 0.00 1.68 1.75 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.47 7.81 79 F 8.78 4.93 0.00 2.97 2.96 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 0.00 0.00 0.00 0.00 80 K 8.50 4.96 0.00 1.61 1.69 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.28 1.37 7.81 81 G 8.53 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 0.00 0.00 0.00 0.00 82 I 8.26 4.91 1.89 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 1.24 0.74 0.95 0.00 0.00 83 V 8.37 4.37 1.96 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 0.71 0.00 0.00 0.31 0.00 0.00 84 S 8.61 4.98 0.00 3.94 3.93 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 0.00 0.00 0.00 85 M 8.51 5.00 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.71 0.00 86 E 8.86 4.44 0.00 2.00 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 2.22 2.22 0.00 87 G 9.62 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 88 G 8.64 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 0.00 0.00 0.00 89 K 7.63 4.81 0.00 1.88 1.73 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.58 7.81 90 L 8.69 4.56 0.00 1.25 1.20 0.72 -0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.81 4.87 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 1.09 0.00 0.00 92 I 8.47 4.66 1.63 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.50 0.69 0.00 0.00 93 S 8.44 4.31 0.00 3.77 3.69 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 94 F 8.75 5.13 0.00 3.18 2.84 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 95 P 0.00 4.29 0.00 2.09 2.03 0.00 3.89 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.16 0.00 96 K 9.75 4.03 0.00 2.06 2.14 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.44 7.81 97 Y 7.60 5.30 0.00 2.96 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.70 4.50 0.00 1.86 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.18 2.10 0.00 99 Q 8.18 4.74 0.00 1.78 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.52 0.00 0.00 0.00 0.00 0.00 2.05 2.25 0.00 100 T 8.70 5.12 4.14 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 1.16 0.00 0.00 101 T 8.79 5.31 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 1.04 0.00 0.00 102 E 9.25 5.21 0.00 2.03 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 2.34 2.26 0.00 103 I 8.09 4.58 1.57 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 -0.10 0.84 0.00 0.00 104 S 8.61 4.46 0.00 3.79 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 0.00 105 G 9.68 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 106 G 8.48 3.98 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 0.00 0.00 0.00 107 K 7.64 4.99 0.00 1.80 1.95 0.00 1.68 0.00 0.00 1.59 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.69 7.81 108 L 8.48 4.31 0.00 0.27 0.99 0.67 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.83 4.71 2.04 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 0.89 0.00 0.00 0.89 0.00 0.00 110 E 9.40 5.02 0.00 1.88 1.82 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 2.30 2.28 0.00 111 T 9.04 4.84 4.17 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 0.00 0.00 0.00 1.15 0.00 0.00 112 S 9.01 4.97 0.00 3.34 3.78 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 0.00 113 T 8.99 5.29 4.12 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 1.20 0.00 0.00 114 A 9.05 5.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.71 5.02 0.00 3.77 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 0.00 116 G 8.92 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 0.00 0.00 0.00 117 A 8.67 3.99 1.26 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 0.00 0.00 118 Q 7.75 4.50 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.75 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 119 G 7.86 4.11 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 0.00 120 T 8.33 5.14 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 1.20 0.00 0.00 121 A 8.97 4.96 1.21 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 0.00 122 V 8.47 5.08 2.12 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 1.01 0.00 0.00 0.96 0.00 0.00 123 L 8.98 4.98 0.00 0.52 0.76 0.63 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 124 V 9.00 4.70 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 0.91 0.00 0.00 0.90 0.00 0.00 125 R 9.32 4.95 0.00 1.86 1.76 0.00 3.22 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 126 T 9.02 5.08 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 0.00 127 S 9.28 5.35 0.00 3.69 3.96 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 0.00 0.00 0.00 0.00 128 K 8.66 4.92 0.00 1.89 1.98 0.00 1.32 0.00 0.00 1.77 0.00 0.00 2.81 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.37 7.81 129 K 8.45 3.83 0.00 1.41 1.49 0.00 0.61 0.00 0.00 1.03 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.99 0.91 7.81 130 V 8.57 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 0.76 0.00 0.00 0.91 0.00 0.00 131 L 8.35 4.72 0.00 1.58 1.56 0.86 0.77 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 0.00 132 V 7.35 4.44 2.03 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 0.66 0.00 0.00 0.89 0.00 0.00 133 P 0.00 4.35 0.00 2.02 1.97 0.00 3.66 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 1.99 2.04 0.00