NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4122 8.2893 120.3486 55.3594 33.0825 174.7246 2 N 4.6496 8.5900 124.0706 51.4547 38.9029 172.9970 3 I 4.5855 8.8199 121.2619 59.5588 41.7982 176.2680 4 I 4.3692 8.3332 124.0386 59.5962 38.5346 175.1488 5 K 4.4479 8.6162 124.8950 54.4100 33.9922 176.1802 6 A 4.5626 8.3895 126.4514 50.8297 20.8044 175.1243 7 N 5.0483 8.2234 117.1059 51.9249 41.3853 175.0672 8 V 3.8552 8.1819 114.4253 62.6840 32.2903 176.8302 9 A 4.2478 8.0551 123.6372 52.1454 18.6510 177.9715 10 A 4.6114 8.2652 122.2363 51.2418 21.6006 174.1052 11 P 4.6638 0.0000 0.0000 64.9431 32.1564 178.8175 12 D 4.5148 8.0668 115.7078 54.2522 40.5232 175.7495 13 A 4.6196 7.7209 124.7277 51.7987 20.2231 178.4017 14 R 4.8076 9.5312 120.9819 55.1781 32.5234 175.7105 15 V 4.9264 8.7576 124.6212 60.0194 34.6873 174.0174 16 A 4.8472 8.4630 128.4926 50.0860 21.4842 175.2103 17 I 4.7729 8.6324 123.6390 59.6167 39.6761 174.7143 18 T 5.0273 8.5418 117.7971 60.0436 70.6779 173.4082 19 I 5.2571 8.2601 126.7550 58.2584 40.4241 174.5649 20 A 5.0536 8.4194 127.7855 51.2984 19.1893 177.9201 21 R 4.4566 9.3014 119.5359 58.3380 30.3126 176.9579 22 F 4.5752 8.2246 121.3851 59.9272 39.6844 174.3449 23 N 4.6730 9.8735 123.8213 54.5245 35.6244 176.1358 24 Q 4.1634 8.2855 120.1626 59.3011 28.0745 177.9181 25 F 4.0211 8.4974 121.7204 61.1521 39.4596 176.4299 26 I 4.1805 8.3025 118.8887 63.9193 37.5341 177.7827 27 N 4.3638 8.3219 116.6092 56.3856 38.2481 177.0005 28 D 4.4581 8.6755 120.7461 57.5640 40.9863 178.7512 29 S 4.0776 7.9523 113.0990 60.9478 62.4604 175.3994 30 L 4.0559 7.9057 123.3047 58.8708 41.7185 178.1738 31 L 3.8632 8.5199 120.4534 57.4641 41.8586 178.8649 32 D 4.4939 8.5472 118.3485 57.1589 40.9619 179.7907 33 G 3.5725 8.1913 105.9805 47.8433 0.0000 175.2279 34 A 3.9363 8.0318 123.8899 54.6989 18.4296 179.4213 35 V 3.4418 7.7676 115.6830 66.3620 31.4428 177.3316 36 D 4.3023 8.0752 117.0146 57.6341 40.9805 177.6986 37 A 3.9414 8.2214 121.0948 55.7832 18.4085 179.0234 38 L 3.8588 8.5407 116.5653 59.2263 41.9541 179.8903 39 T 4.2566 8.2620 110.7639 64.2571 68.6555 176.4032 40 R 3.8806 8.3047 123.3047 58.1084 30.3335 178.3573 41 I 4.2374 7.7838 118.3338 63.5186 38.0842 177.6925 42 G 3.8580 7.7963 103.6535 44.3159 0.0000 174.0104 43 Q 3.8658 7.9554 118.1883 56.3518 27.1105 173.3182 44 V 3.7882 7.4736 118.7604 62.3635 32.2527 175.2835 45 K 4.1535 8.5629 128.7882 56.2884 32.5731 176.5626 46 D 4.7171 8.7968 124.5372 53.9591 39.1893 176.2097 47 D 4.7905 7.9698 117.2705 53.7559 40.2363 176.3485 48 N 4.7019 8.5654 117.7995 53.7478 39.3837 174.1542 49 I 4.9402 7.6026 120.1671 60.3305 38.3483 175.2237 50 T 4.7183 8.8794 117.3925 59.6987 71.9904 173.0254 51 V 4.6077 8.4054 123.4866 61.1142 34.0638 174.5576 52 V 4.3037 9.1413 129.4931 60.8048 33.5706 174.5372 53 W 4.9154 8.9904 129.0876 56.5992 29.5787 176.4800 54 V 4.3786 8.7358 119.1716 59.0300 33.7480 174.6826 55 P 4.3286 0.0000 0.0000 65.0611 31.3026 176.8384 56 G 4.5159 7.9693 108.4726 42.7985 0.0000 174.1180 57 A 4.0937 8.4844 120.8279 54.8290 18.0989 179.3345 58 Y 4.2120 8.1534 117.0482 60.5976 39.2620 177.3431 59 E 4.1360 8.2842 118.9968 58.0884 29.6318 178.6371 60 L 3.8815 7.5580 119.4709 58.1572 41.6172 176.9964 61 P 4.1607 0.0000 0.0000 64.9268 31.0831 177.9608 62 L 3.8459 7.7058 117.8959 58.4810 42.3797 179.3273 63 A 3.9827 7.8192 120.1101 55.6267 18.3169 179.8436 64 T 3.8298 8.2197 108.4341 64.5112 68.6843 176.1865 65 E 3.8419 8.9311 122.7149 59.1751 29.6970 178.2786 66 A 4.0117 8.0507 120.6456 55.6256 18.1931 179.6492 67 L 4.1234 7.5533 115.0100 57.8430 41.9026 179.4552 68 A 4.2319 8.3249 120.9286 55.1438 18.2428 179.8616 69 K 3.9333 8.2043 116.1616 59.5501 32.1230 179.0126 70 S 4.2062 8.0352 112.9916 59.4360 61.1015 175.7816 71 G 3.9383 8.5524 110.5217 46.2648 0.0000 176.0049 72 K 3.9042 7.7073 120.3525 56.2436 31.8886 182.1200 73 Y 5.1254 6.9188 113.4263 56.8490 40.6868 175.4797 74 D 4.7211 9.3067 121.9692 56.0572 41.8187 176.4245 75 A 4.5445 7.3631 117.4491 51.2308 22.5539 175.0916 76 V 4.7538 8.2088 119.8055 61.0350 34.6824 174.4885 77 V 4.3683 8.7763 128.2989 61.5257 33.3972 174.1789 78 A 4.9310 8.6132 130.2425 49.7363 20.7695 175.2368 79 L 5.2705 7.8486 123.2276 52.7110 44.3774 176.3652 80 G 4.1978 7.7465 108.1850 46.1548 0.0000 171.9308 81 T 5.0313 8.1564 116.5636 61.4818 71.8320 174.4237 82 V 4.2146 9.1105 125.2818 61.3100 33.9793 173.8592 83 I 4.6714 8.1659 128.5836 59.6141 38.6572 175.9587 84 R 3.6500 8.3963 127.8442 56.5495 30.2424 176.2925 85 G 4.4235 8.3617 116.4266 44.3273 0.0000 172.9240 86 G 3.6416 8.7818 107.6914 47.4561 0.0000 173.2701 87 T 4.5281 7.6066 108.3372 59.7431 71.5630 173.4588 88 A 4.4943 8.3565 121.2531 52.7005 18.8679 178.6035 89 H 4.2805 8.3577 120.3024 60.3618 29.6443 176.9078 90 F 4.0443 8.4771 121.9279 61.4984 38.9904 176.6145 91 E 3.5990 7.9752 118.3986 59.5468 29.3423 178.4520 92 Y 4.3164 7.3976 116.0267 60.9585 38.2093 177.4674 93 V 3.6706 7.7192 119.2708 65.8844 31.5474 177.7919 94 A 4.0889 7.8444 120.3533 55.2649 18.1327 179.5592 95 G 3.6486 8.1244 104.8179 47.6675 0.0000 175.9441 96 G 3.8996 8.7440 108.1500 45.7270 0.0000 174.6533 97 A 4.3723 7.7521 122.6420 54.2655 19.7920 179.1430 98 S 4.1234 8.3123 111.9369 61.8384 62.3751 176.2533 99 N 4.4416 8.4547 119.3346 55.9499 38.3196 177.4404 100 G 3.6962 7.6493 105.8386 48.0209 0.0000 175.4554 101 L 3.9949 8.0008 121.7573 57.2682 41.8652 179.5970 102 A 3.9894 8.0256 120.5190 55.0904 18.2709 179.5824 103 S 3.9628 8.2923 111.7232 61.5186 62.4497 176.1394 104 V 3.5482 7.7368 120.7300 66.2698 31.1639 177.6755 105 A 4.3940 7.7720 120.9201 54.8220 18.0045 179.4331 106 Q 3.9249 7.6834 116.2981 59.1748 29.1372 177.8386 107 D 4.5235 8.0555 119.4727 57.0499 41.2528 178.4884 108 S 4.3512 8.3450 112.8377 58.6477 63.4561 175.4712 109 G 3.8802 8.0036 109.3321 45.8265 0.0000 173.7306 110 V 3.9653 7.4902 121.0359 61.5579 33.0757 173.6154 111 P 4.5788 0.0000 0.0000 62.7614 32.4277 175.1268 112 V 4.9120 8.4347 123.7495 61.0250 33.9711 174.1956 113 A 4.5037 8.7996 130.1199 50.7502 20.6123 176.2671 114 F 4.7982 8.9752 126.8832 56.2270 38.2778 175.9491 115 G 3.9338 8.1007 118.1142 45.0500 0.0000 171.2160 116 V 4.5691 6.0973 117.8513 60.5151 33.7850 176.0157 117 L 4.2411 8.6723 129.4420 55.1077 42.7187 176.6965 118 T 5.4062 8.7197 112.7676 58.7282 68.7081 172.5728 119 T 4.5911 8.1207 120.8836 61.1001 72.0806 175.1300 120 E 4.1586 9.8306 120.6601 57.2057 30.5750 177.2192 121 S 4.7117 7.5915 111.9892 55.5533 67.6306 174.7638 122 I 3.6771 8.2397 123.1852 64.3312 36.5904 177.9572 123 E 3.9104 8.1884 118.9403 59.7625 29.6053 178.6551 124 Q 4.2820 8.0854 117.4211 58.8186 28.7538 178.5221 125 A 4.0146 7.8068 121.7072 55.4504 18.2680 179.7584 126 I 3.7646 7.8782 118.1465 64.6199 37.1165 178.5515 127 E 4.5331 8.0285 120.3872 58.1492 29.2909 178.4571 128 R 4.5372 8.0020 115.7248 55.6887 30.5448 176.7479 129 A 4.8248 7.2208 121.8908 52.7107 19.5017 176.9397 130 G 4.4398 7.7896 108.1554 48.0746 0.0000 175.5149 131 T 4.6198 7.5623 114.8105 60.1342 68.7769 175.7230 132 K 3.7926 9.2193 117.0926 59.3371 31.7794 177.8866 133 A 4.5655 7.7611 119.3314 52.0556 20.0315 178.8702 134 G 3.7491 8.0781 110.7678 47.2583 0.0000 173.7893 135 N 5.2382 8.2364 117.6196 50.9116 40.8602 175.5773 136 K 4.0328 8.9216 128.8698 59.0718 32.0621 179.0904 137 G 4.0634 8.2884 107.7295 47.3598 0.0000 175.6578 138 A 4.0358 7.8795 123.4424 54.2607 18.4173 179.2648 139 E 3.8465 8.3941 117.8798 59.4135 29.8247 178.8982 140 A 4.0514 8.6095 122.3539 54.4316 18.4492 179.3762 141 A 3.9142 8.2867 119.6794 55.3014 18.3680 179.9645 142 L 3.9223 7.9681 117.6466 58.2009 41.3090 179.8636 143 T 3.8420 8.1387 109.4122 64.5843 68.4739 176.1216 144 A 3.9834 7.8584 123.7738 55.0616 18.3360 179.0462 145 L 3.8674 7.8509 116.7156 58.1891 41.8039 179.2671 146 E 4.0762 8.4206 118.8017 60.0497 29.4443 179.0439 147 M 4.0654 7.9337 118.1660 58.3369 31.9039 178.4825 148 I 3.6923 7.7070 119.9281 64.7522 37.2769 178.1686 149 N 4.3020 7.9330 116.6310 56.2930 38.1844 177.4468 150 V 3.5817 7.8929 118.8050 66.2194 31.7062 177.8728 151 L 4.0782 8.3783 118.7483 57.7785 41.3808 179.1817 152 K 3.8186 8.0999 118.5344 59.4844 32.1084 176.7533 153 A 4.4963 8.1407 120.3733 51.7661 19.6257 177.2235 154 I 3.8916 7.9057 121.1666 63.1419 37.7213 173.9809 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 M 8.29 4.41 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 2 N 8.59 4.65 0.00 2.95 2.79 0.00 0.00 6.06 6.93 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 3 I 8.82 4.59 1.87 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 1.41 0.67 0.91 0.00 0.00 4 I 8.33 4.37 1.87 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 1.41 0.60 0.91 0.00 0.00 5 K 8.62 4.45 0.00 1.71 1.71 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 6 A 8.39 4.56 1.25 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 7 N 8.22 5.05 0.00 2.66 2.68 0.00 0.00 7.00 7.71 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 8 V 8.18 3.86 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 0.75 0.00 0.00 0.93 0.00 0.00 9 A 8.06 4.25 1.27 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 0.00 0.00 10 A 8.27 4.61 1.27 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 0.00 0.00 11 P 0.00 4.66 0.00 2.23 2.37 0.00 3.86 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 2.07 1.94 0.00 12 D 8.07 4.51 0.00 2.69 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.72 4.62 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 14 R 9.53 4.81 0.00 1.42 1.79 0.00 3.22 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 15 V 8.76 4.93 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 16 A 8.46 4.85 0.30 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 17 I 8.63 4.77 1.68 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.80 0.68 0.00 0.00 18 T 8.54 5.03 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 1.09 0.00 0.00 19 I 8.26 5.26 0.70 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 -0.16 0.45 0.00 0.00 20 A 8.42 5.05 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 21 R 9.30 4.46 0.00 2.09 2.51 0.00 2.86 0.00 0.00 3.11 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.63 0.00 22 F 8.22 4.58 0.00 3.15 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 23 N 9.87 4.67 0.00 2.97 3.00 0.00 0.00 6.88 8.19 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 24 Q 8.29 4.16 0.00 2.52 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.72 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 25 F 8.50 4.02 0.00 3.14 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 26 I 8.30 4.18 2.11 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.88 0.95 0.00 0.00 27 N 8.32 4.36 0.00 2.87 2.92 0.00 0.00 7.07 8.08 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 28 D 8.68 4.46 0.00 2.64 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 7.95 4.08 0.00 3.82 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 30 L 7.91 4.06 0.00 1.92 1.64 0.97 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.52 3.86 0.00 1.78 1.75 0.77 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.55 4.49 0.00 2.88 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 33 G 8.19 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 34 A 8.03 3.94 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 35 V 7.77 3.44 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 1.01 0.00 0.00 0.94 0.00 0.00 36 D 8.08 4.30 0.00 2.84 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 37 A 8.22 3.94 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 38 L 8.54 3.86 0.00 1.84 1.73 0.89 0.69 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 39 T 8.26 4.26 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 1.25 0.00 0.00 40 R 8.30 3.88 0.00 1.82 2.24 0.00 3.24 0.00 0.00 3.46 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 41 I 7.78 4.24 2.08 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 1.45 0.97 0.91 0.00 0.00 42 G 7.80 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 7.96 3.87 0.00 2.38 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.95 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 44 V 7.47 3.79 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 0.93 0.00 0.00 1.05 0.00 0.00 45 K 8.56 4.15 0.00 1.80 1.67 0.00 1.92 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.37 7.81 46 D 8.80 4.72 0.00 2.83 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 47 D 7.97 4.79 0.00 2.79 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 48 N 8.57 4.70 0.00 2.87 3.00 0.00 0.00 6.92 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.60 4.94 1.88 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 1.40 0.52 0.89 0.00 0.00 50 T 8.88 4.72 4.32 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 1.52 0.00 0.00 51 V 8.41 4.61 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 0.48 0.00 0.00 0.84 0.00 0.00 52 V 9.14 4.30 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 0.93 0.00 0.00 0.86 0.00 0.00 53 W 8.99 4.92 0.00 3.21 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 54 V 8.74 4.38 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 0.81 0.00 0.00 0.99 0.00 0.00 55 P 0.00 4.33 0.00 2.19 2.30 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.04 0.00 56 G 7.97 4.52 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 0.00 0.00 0.00 57 A 8.48 4.09 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 58 Y 8.15 4.21 0.00 2.91 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.28 4.14 0.00 2.01 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 2.65 2.58 0.00 60 L 7.56 3.88 0.00 1.75 1.70 0.87 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.16 0.00 2.02 1.85 0.00 3.67 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 62 L 7.71 3.85 0.00 1.63 1.67 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 63 A 7.82 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 64 T 8.22 3.83 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 1.19 0.00 0.00 65 E 8.93 3.84 0.00 2.00 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 0.00 2.31 2.33 0.00 66 A 8.05 4.01 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 67 L 7.55 4.12 0.00 1.77 1.67 0.62 0.69 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 68 A 8.32 4.23 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.20 3.93 0.00 1.74 1.90 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.64 1.60 7.81 70 S 8.04 4.21 0.00 3.93 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 71 G 8.55 3.94 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 0.00 0.00 0.00 72 K 7.71 3.90 0.00 1.83 1.74 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.39 1.28 7.81 73 Y 6.92 5.13 0.00 3.05 2.97 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 74 D 9.31 4.72 0.00 2.56 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 75 A 7.36 4.54 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 76 V 8.21 4.75 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 0.96 0.00 0.00 0.85 0.00 0.00 77 V 8.78 4.37 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 0.87 0.00 0.00 0.88 0.00 0.00 78 A 8.61 4.93 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 79 L 7.85 5.27 0.00 1.39 1.40 0.84 0.64 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 80 G 7.75 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 0.00 0.00 0.00 0.00 81 T 8.16 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 1.19 0.00 0.00 82 V 9.11 4.21 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 0.89 0.00 0.00 0.87 0.00 0.00 83 I 8.17 4.67 1.85 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 1.24 0.69 0.85 0.00 0.00 84 R 8.40 3.65 0.00 0.67 1.38 0.00 3.07 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.17 0.00 85 G 8.36 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 0.00 0.00 0.00 0.00 86 G 8.78 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 87 T 7.61 4.53 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 1.24 0.00 0.00 88 A 8.36 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 89 H 8.36 4.28 0.00 3.32 3.42 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 F 8.48 4.04 0.00 3.11 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 91 E 7.98 3.60 0.00 1.95 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 2.01 2.18 0.00 92 Y 7.40 4.32 0.00 2.99 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 93 V 7.72 3.67 1.94 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 1.04 0.00 0.00 0.74 0.00 0.00 94 A 7.84 4.09 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 95 G 8.12 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.74 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 97 A 7.75 4.37 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 98 S 8.31 4.12 0.00 3.68 3.86 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 0.00 0.00 0.00 99 N 8.45 4.44 0.00 2.80 2.83 0.00 0.00 6.95 7.38 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 0.00 100 G 7.65 3.70 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 0.00 0.00 0.00 101 L 8.00 3.99 0.00 2.05 1.82 1.04 1.04 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 0.00 102 A 8.03 3.99 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 0.00 103 S 8.29 3.96 0.00 3.95 4.03 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 0.00 104 V 7.74 3.55 2.22 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 1.04 0.00 0.00 0.91 0.00 0.00 105 A 7.77 4.39 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 0.00 106 Q 7.68 3.92 0.00 2.09 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 107 D 8.06 4.52 0.00 2.70 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 0.00 108 S 8.35 4.35 0.00 4.02 4.04 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 0.00 109 G 8.00 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 0.00 0.00 0.00 110 V 7.49 3.97 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 1.01 0.00 0.00 1.02 0.00 0.00 111 P 0.00 4.58 0.00 2.12 1.97 0.00 3.79 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 2.12 2.09 0.00 112 V 8.43 4.91 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 0.81 0.00 0.00 0.96 0.00 0.00 113 A 8.80 4.50 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 0.00 114 F 8.98 4.80 0.00 3.01 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 0.00 115 G 8.10 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 0.00 116 V 6.10 4.57 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 0.66 0.00 0.00 0.03 0.00 0.00 117 L 8.67 4.24 0.00 1.62 1.58 0.92 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.72 5.41 4.45 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 119 T 8.12 4.59 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 1.26 0.00 0.00 120 E 9.83 4.16 0.00 1.95 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 2.30 2.30 0.00 121 S 7.59 4.71 0.00 3.94 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 0.00 122 I 8.24 3.68 1.84 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 1.47 0.55 0.86 0.00 0.00 123 E 8.19 3.91 0.00 1.93 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 2.30 2.49 0.00 124 Q 8.09 4.28 0.00 2.30 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 125 A 7.81 4.01 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 0.00 126 I 7.88 3.76 2.00 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 1.88 0.97 0.99 0.00 0.00 127 E 8.03 4.53 0.00 2.23 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 2.34 2.40 0.00 128 R 8.00 4.54 0.00 1.87 1.94 0.00 3.11 0.00 0.00 3.19 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 129 A 7.22 4.82 1.28 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 0.00 130 G 7.79 4.44 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 0.00 131 T 7.56 4.62 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 1.27 0.00 0.00 132 K 9.22 3.79 0.00 1.77 1.96 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.49 7.81 133 A 7.76 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 134 G 8.08 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 0.00 0.00 0.00 135 N 8.24 5.24 0.00 2.70 2.66 0.00 0.00 6.93 6.77 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 0.00 136 K 8.92 4.03 0.00 1.82 1.82 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.47 7.81 137 G 8.29 4.06 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 0.00 0.00 0.00 138 A 7.88 4.04 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 0.00 139 E 8.39 3.85 0.00 2.05 2.09 0.00 0.00 0.00 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 2.33 0.00 140 A 8.61 4.05 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 0.00 141 A 8.29 3.91 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 0.00 142 L 7.97 3.92 0.00 2.02 1.72 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.14 3.84 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 1.30 0.00 0.00 144 A 7.86 3.98 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 0.00 145 L 7.85 3.87 0.00 1.87 1.93 1.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.42 4.08 0.00 2.02 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 2.32 2.38 0.00 147 M 7.93 4.07 0.00 2.10 2.35 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 2.63 2.91 0.00 148 I 7.71 3.69 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 1.68 0.88 0.92 0.00 0.00 149 N 7.93 4.30 0.00 2.83 2.86 0.00 0.00 6.73 8.90 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 0.00 150 V 7.89 3.58 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 0.83 0.00 0.00 0.98 0.00 0.00 151 L 8.38 4.08 0.00 1.93 1.69 0.93 0.85 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 0.00 152 K 8.10 3.82 0.00 1.84 2.09 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.50 7.81 153 A 8.14 4.50 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 0.00 154 I 7.91 3.89 1.87 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 1.16 0.72 0.91 0.00 0.00