NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4651 8.2893 118.1957 54.7418 33.4674 175.2388 2 T 4.1329 8.8806 111.9137 61.6084 70.2927 172.3151 3 G 4.8880 8.7499 108.9929 45.2171 0.0000 173.6490 4 A 4.7311 7.8595 122.7584 49.8564 23.2173 174.8116 5 V 4.6106 8.6773 120.6873 61.6100 34.0135 174.7560 6 C 5.4414 9.0695 126.2884 56.8288 28.6027 171.6687 7 P 5.4686 0.0000 0.0000 61.2673 32.5625 175.7622 8 G 3.2958 7.9272 108.7477 46.0768 0.0000 173.7471 9 S 4.2086 8.0425 115.9906 59.7640 63.9543 175.0801 10 F 3.7923 6.9781 117.6515 59.0707 36.3691 175.4879 11 D 5.1240 7.6034 118.4919 51.7620 41.2467 171.8958 12 P 5.2792 0.0000 0.0000 59.3741 34.1027 176.3467 13 V 3.9116 8.1706 118.4274 62.1431 31.7435 176.2052 14 T 4.4894 8.3220 113.1253 59.7156 72.6319 175.3410 15 L 3.8451 8.2481 120.6074 56.9993 41.1542 180.2327 16 G 3.3234 7.4214 105.8029 47.9064 0.0000 175.2623 17 H 3.8829 7.5336 118.7617 58.4381 28.6795 178.0752 18 V 3.3376 7.2575 119.8390 65.7252 31.2074 177.3410 19 D 4.3304 7.8909 117.7589 57.4646 40.9901 178.3880 20 I 3.7129 7.3300 119.6750 64.4633 37.0703 178.0540 21 F 4.4738 8.0915 118.9663 61.0990 38.8068 177.6920 22 E 4.0311 8.7012 118.1073 59.7337 29.0741 179.8315 23 R 4.0402 8.2103 116.8455 58.8929 30.3311 178.7392 24 A 4.3602 8.6517 120.9770 55.3284 18.2824 179.5372 25 A 3.9923 8.2495 117.9141 55.1738 18.4835 179.1582 26 A 4.1818 8.0003 117.5291 53.9966 18.5432 177.9242 27 Q 4.3012 8.2531 113.7370 54.6725 31.1501 175.4892 28 F 4.7886 7.8654 115.2079 55.1433 41.9608 174.7088 29 D 4.6481 9.1916 125.0562 57.2019 41.2694 176.9105 30 E 4.8895 8.5675 118.2487 54.2532 33.5507 174.2542 31 V 4.8542 8.6280 125.6792 61.0632 34.7346 174.0088 32 V 4.6911 8.3195 127.8261 61.1763 33.6886 174.4176 33 V 4.2144 8.8247 128.4839 61.9190 33.1595 174.2912 34 A 4.6721 8.8918 130.2868 50.2920 21.1487 175.1243 35 I 4.9807 8.2852 124.5486 60.5050 38.7268 175.3329 36 L 5.2691 8.7893 127.3763 52.5745 43.4001 176.2926 37 V 4.2516 8.3488 121.2278 59.9196 33.0488 174.7561 38 N 4.7450 8.4738 123.0368 51.8455 39.8919 173.2664 39 P 4.2299 0.0000 0.0000 64.2286 31.7799 176.0420 40 A 4.5669 7.8751 120.6706 50.4164 19.7753 175.6257 41 K 4.5782 8.1133 125.1485 56.2634 34.4847 176.7842 42 T 4.1572 8.2771 116.6344 63.9140 69.1994 175.5365 43 G 3.9193 8.2462 113.3198 45.5742 0.0000 172.5073 44 M 3.9892 8.6387 117.6780 56.7152 32.4926 176.8386 45 F 5.0595 8.2310 115.8623 55.3340 41.9830 175.2629 46 D 4.8128 9.8480 124.3056 52.4967 42.0147 177.4371 47 L 3.9630 8.5791 120.4910 58.4283 41.6715 179.6886 48 D 4.3711 8.1755 117.9158 57.4843 40.8090 178.5834 49 E 3.9852 8.9020 119.3063 59.5904 29.6473 179.5368 50 R 3.8998 8.2720 118.2109 59.3142 29.9743 179.2939 51 I 3.6514 7.8870 119.2794 64.3225 37.1540 178.3529 52 A 3.9447 7.8446 121.2592 55.2769 18.3143 179.4011 53 M 3.8779 8.2729 117.6350 58.5528 31.8289 179.1071 54 V 3.5348 7.2645 116.1669 65.9273 32.0325 177.7959 55 K 4.0248 8.1392 118.2773 59.7578 31.7606 179.3423 56 E 4.0461 8.5426 117.2798 59.1206 29.4235 178.9520 57 S 4.4941 7.7912 113.4013 59.6436 63.2385 174.8054 58 T 4.6007 7.4310 111.8500 61.3370 68.7754 176.1529 59 T 3.9166 8.0901 113.7357 64.8776 68.7334 174.4435 60 H 4.5267 8.3024 115.7866 56.0780 29.3161 175.4424 61 L 4.5384 7.7387 122.3830 52.3114 41.2822 175.0697 62 P 4.2715 0.0000 0.0000 65.0366 31.9156 177.0827 63 N 4.8367 8.1045 114.5581 52.6899 38.4061 174.1964 64 L 5.3878 7.7682 120.9675 53.6985 44.7643 175.4887 65 R 4.7465 8.7762 120.2954 54.5549 33.5157 173.7384 66 V 4.7733 7.8445 118.3061 61.5022 34.7097 174.2382 67 Q 4.6359 8.2782 123.7497 55.3412 32.9894 172.8295 68 V 4.5796 8.6264 125.5599 61.8040 33.2648 175.1460 69 G 4.2400 8.5779 113.7470 44.7820 0.0000 171.6670 70 H 5.0626 8.8644 119.3783 54.0922 32.4405 175.5155 71 G 3.8650 8.5299 107.7448 45.9035 0.0000 173.6684 72 L 4.1016 8.2894 120.0004 54.6726 43.2481 177.9861 73 V 3.6464 8.5314 122.7239 66.3389 31.4064 178.6996 74 V 3.7082 7.7707 111.6954 64.3838 31.4583 178.0666 75 D 4.3585 8.1000 118.2734 57.3263 40.5299 178.3167 76 F 4.0112 7.8787 120.1172 61.1535 39.6242 177.1903 77 V 3.8017 7.9810 117.7937 66.2654 31.4061 178.3441 78 R 4.1170 8.1724 118.1354 59.0437 29.6939 178.5999 79 S 4.2999 7.9162 111.7175 59.7886 63.3914 174.9713 80 C 4.3696 7.6046 119.6338 59.0953 28.2099 174.0053 81 G 3.8321 7.9517 108.7944 46.0753 0.0000 173.1436 82 M 4.7692 7.7478 117.7883 53.5537 35.1763 175.3436 83 T 4.7995 8.2688 105.7872 61.1390 71.0973 172.8437 84 A 5.2649 7.8335 123.3498 50.6510 22.8273 175.2273 85 I 4.7474 8.7907 123.0364 59.6673 39.6104 174.8785 86 V 4.9471 8.7917 126.5398 61.2276 34.0655 174.5403 87 K 4.7742 8.9843 125.5142 54.9100 36.9051 175.4844 88 G 4.4666 8.8365 109.6697 45.2894 0.0000 172.9624 89 L 4.9435 8.8105 122.2311 53.0337 44.5239 178.0389 90 R 3.9957 9.0986 123.3030 58.7835 30.7928 177.1731 91 T 4.8674 8.2300 106.7541 58.8438 73.3180 174.7492 92 G 3.8068 8.7626 107.9967 48.4588 0.0000 176.0715 93 T 4.0136 7.8664 117.3005 66.6243 68.5614 176.4131 94 D 4.4358 8.0914 120.7028 57.3665 40.7646 178.6322 95 F 3.8786 8.3725 121.0832 61.3598 39.1092 177.0428 96 E 3.7588 8.0830 117.7993 59.3120 29.2273 178.8368 97 Y 4.0620 7.7366 119.6338 60.7529 39.0046 177.5240 98 E 3.9429 8.3729 119.7718 59.0210 29.3858 179.0662 99 L 3.7732 7.6857 120.9951 57.9592 41.9527 178.8046 100 Q 3.8672 7.2280 117.9134 59.4233 28.6961 178.9316 101 M 3.9073 7.3289 117.6297 58.2054 31.9633 178.4239 102 A 3.9505 8.4138 121.1957 55.6951 18.5851 179.8337 103 Q 3.9310 8.3310 116.4348 59.0937 28.7515 178.6333 104 M 4.0101 8.3871 119.7139 58.8483 32.1710 178.0918 105 N 4.3539 8.5884 117.0114 56.1019 38.6356 177.4101 106 K 4.1716 8.2201 122.5570 59.0299 32.0890 178.3344 107 H 4.1035 8.1065 117.8583 59.2404 29.9134 176.8462 108 I 4.0385 7.8418 112.4896 62.6764 37.9487 176.8143 109 A 4.4214 7.8567 120.0210 51.8703 21.8091 177.2576 110 G 3.9740 8.5675 104.4305 45.9854 0.0000 174.3417 111 V 3.9768 7.3755 121.2168 62.7436 32.6185 174.8486 112 D 4.8487 9.3127 127.5994 53.1528 43.9761 174.7929 113 T 4.9840 8.0311 117.7062 61.6574 71.8961 173.3003 114 F 4.5582 9.4467 124.9803 55.7073 41.3721 174.7072 115 F 5.5999 8.8847 121.8793 56.0410 41.2801 175.4780 116 V 4.7400 9.0224 114.8873 59.3440 35.2526 174.8241 117 A 4.5824 8.7105 126.0451 51.7188 19.1348 177.1069 118 T 3.9710 8.8614 117.5695 61.9950 69.0462 173.0867 119 A 4.1691 8.7119 129.6685 51.6389 19.4782 176.4994 120 P 4.2553 0.0000 0.0000 65.7260 31.4677 178.9675 121 R 3.9876 7.7559 111.6834 58.1578 29.5964 176.5209 122 Y 4.4601 7.4837 115.8736 57.3769 38.5644 177.2224 123 S 4.1357 8.1147 116.6823 60.3043 62.7613 175.3665 124 F 4.6871 7.7739 112.5896 56.3212 38.1903 175.2319 125 V 3.9141 7.3134 122.8218 62.2068 32.1268 175.8098 126 S 4.6616 8.1499 120.5613 55.8040 67.2952 175.0865 127 S 4.1469 8.6802 119.8471 62.0404 62.7906 177.3009 128 S 4.1968 7.9787 116.3830 61.1255 62.9299 176.1851 129 L 3.9314 7.8841 123.2848 57.8905 41.9444 178.5640 130 A 4.0485 8.2554 121.0096 55.2854 18.2373 179.7765 131 K 3.9855 8.1616 116.7832 59.5872 31.9175 179.2922 132 E 3.9546 7.7907 117.1737 59.5370 29.7446 179.4339 133 V 3.7325 7.8586 117.8286 65.9025 31.5808 177.8706 134 A 4.1942 8.1110 120.5086 55.5187 18.1097 179.2741 135 M 4.2002 8.3655 115.4445 57.1036 32.0159 177.1122 136 L 4.5586 7.9456 117.5646 54.2615 42.6489 177.2827 137 G 3.9599 8.5174 107.7831 44.9906 0.0000 174.4555 138 G 3.7263 7.5866 107.8278 44.9701 0.0000 173.2651 139 D 4.6565 8.4590 120.3582 53.1063 41.0994 176.0464 140 V 4.4140 8.1364 119.8591 61.1334 32.0551 178.5139 141 S 4.7444 9.0626 118.5212 61.0345 62.8826 175.6409 142 E 4.4347 8.2168 117.2904 56.9735 29.5326 176.7690 143 L 4.6115 8.1447 119.2790 54.4041 43.4427 176.1362 144 L 4.9425 7.1418 116.4087 51.6817 44.5696 174.5849 145 P 4.4337 0.0000 0.0000 62.2067 32.5590 176.6855 146 E 3.8518 9.0172 120.9023 59.5238 29.1728 177.6047 147 P 4.3960 0.0000 0.0000 64.8956 31.6324 177.4303 148 V 4.0468 8.1320 116.6587 64.1681 32.6323 177.2926 149 N 4.3478 7.9263 115.9385 56.1982 38.1330 177.0302 150 R 3.9169 8.4589 120.4986 59.6483 29.9895 178.8222 151 R 3.9902 7.8872 115.8288 58.6719 30.2938 178.5327 152 L 4.2965 7.9035 119.4217 57.5921 41.6024 179.1629 153 R 3.9524 8.0591 118.0730 59.0996 30.8637 177.7130 154 D 5.0610 7.3604 117.3013 53.7834 39.9596 177.0053 155 R 4.6533 7.9391 114.2482 55.3345 33.6883 175.9439 156 L 4.3202 7.8133 124.4728 55.0834 42.3753 175.6153 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 4.47 0.00 2.14 2.26 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 2.47 2.54 0.00 2 T 8.88 4.13 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 1.20 0.00 0.00 3 G 8.75 4.89 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 0.00 0.00 0.00 4 A 7.86 4.73 0.23 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 5 V 8.68 4.61 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 0.99 0.00 0.00 1.06 0.00 0.00 6 C 9.07 5.44 0.00 3.02 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 5.47 0.00 2.03 1.99 0.00 3.75 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.81 0.00 8 G 7.93 3.30 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 0.00 9 S 8.04 4.21 0.00 3.77 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 10 F 6.98 3.79 0.00 3.21 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.60 5.12 0.00 2.65 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 5.28 0.00 2.02 1.55 0.00 3.54 0.00 0.00 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 13 V 8.17 3.91 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 0.73 0.00 0.00 0.98 0.00 0.00 14 T 8.32 4.49 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 1.21 0.00 0.00 15 L 8.25 3.85 0.00 0.96 0.71 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.42 3.32 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 0.00 17 H 7.53 3.88 0.00 3.17 2.76 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.26 3.34 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 1.14 0.00 0.00 0.88 0.00 0.00 19 D 7.89 4.33 0.00 2.85 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 20 I 7.33 3.71 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.80 1.04 0.00 0.00 21 F 8.09 4.47 0.00 3.12 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 22 E 8.70 4.03 0.00 2.28 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 0.00 2.43 2.56 0.00 23 R 8.21 4.04 0.00 2.02 2.07 0.00 3.41 0.00 0.00 3.43 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.79 0.00 24 A 8.65 4.36 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.25 3.99 1.45 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 0.00 0.00 0.00 26 A 8.00 4.18 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 27 Q 8.25 4.30 0.00 1.63 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 28 F 7.87 4.79 0.00 2.98 2.93 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 29 D 9.19 4.65 0.00 2.80 2.76 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 30 E 8.57 4.89 0.00 2.01 1.72 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 2.16 2.21 0.00 31 V 8.63 4.85 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 0.81 0.00 0.00 0.98 0.00 0.00 32 V 8.32 4.69 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 1.05 0.00 0.00 0.92 0.00 0.00 33 V 8.82 4.21 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 -0.29 0.00 0.00 34 A 8.89 4.67 0.51 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 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.29 4.98 1.88 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 1.34 0.57 1.06 0.00 0.00 36 L 8.79 5.27 0.00 1.52 1.72 0.84 0.68 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 37 V 8.35 4.25 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 0.76 0.00 0.00 0.95 0.00 0.00 38 N 8.47 4.74 0.00 2.68 2.74 0.00 0.00 7.23 7.69 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 39 P 0.00 4.23 0.00 2.09 2.10 0.00 3.70 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 40 A 7.88 4.57 1.23 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 41 K 8.11 4.58 0.00 1.74 1.78 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.37 1.43 7.81 42 T 8.28 4.16 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 1.21 0.00 0.00 43 G 8.25 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 44 M 8.64 3.99 0.00 1.84 1.92 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.81 0.00 45 F 8.23 5.06 0.00 3.17 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 46 D 9.85 4.81 0.00 2.92 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.58 3.96 0.00 1.78 1.82 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 48 D 8.18 4.37 0.00 2.94 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 49 E 8.90 3.99 0.00 2.23 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 2.41 2.62 0.00 50 R 8.27 3.90 0.00 2.03 2.05 0.00 3.20 0.00 0.00 3.48 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.00 0.00 51 I 7.89 3.65 2.02 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 1.43 0.77 0.88 0.00 0.00 52 A 7.84 3.94 1.44 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 53 M 8.27 3.88 0.00 1.93 2.01 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 54 V 7.26 3.53 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 0.52 0.00 0.00 0.74 0.00 0.00 55 K 8.14 4.02 0.00 1.91 1.81 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.53 7.81 56 E 8.54 4.05 0.00 1.86 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 2.33 2.43 0.00 57 S 7.79 4.49 0.00 4.01 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 58 T 7.43 4.60 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 1.23 0.00 0.00 59 T 8.09 3.92 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 1.31 0.00 0.00 60 H 8.30 4.53 0.00 3.31 3.43 0.00 5.48 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 7.74 4.54 0.00 1.56 1.56 0.90 0.85 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 62 P 0.00 4.27 0.00 2.03 2.10 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 63 N 8.10 4.84 0.00 2.96 3.02 0.00 0.00 5.71 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 64 L 7.77 5.39 0.00 1.59 1.64 0.63 0.58 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 65 R 8.78 4.75 0.00 1.82 1.91 0.00 2.74 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 66 V 7.84 4.77 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 0.67 0.00 0.00 0.75 0.00 0.00 67 Q 8.28 4.64 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.64 0.00 0.00 0.00 0.00 0.00 2.52 2.35 0.00 68 V 8.63 4.58 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 0.79 0.00 0.00 0.94 0.00 0.00 69 G 8.58 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 70 H 8.86 5.06 0.00 3.15 3.24 0.00 5.83 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.53 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 72 L 8.29 4.10 0.00 1.73 1.63 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 73 V 8.53 3.65 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 1.07 0.00 0.00 0.90 0.00 0.00 74 V 7.77 3.71 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 0.80 0.00 0.00 0.95 0.00 0.00 75 D 8.10 4.36 0.00 2.90 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 76 F 7.88 4.01 0.00 2.98 3.25 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 77 V 7.98 3.80 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 1.03 0.00 0.00 1.09 0.00 0.00 78 R 8.17 4.12 0.00 1.88 1.95 0.00 3.17 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 79 S 7.92 4.30 0.00 3.93 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 80 C 7.60 4.37 0.00 3.02 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 81 G 7.95 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 M 7.75 4.77 0.00 2.08 1.94 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.44 0.00 83 T 8.27 4.80 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 1.22 0.00 0.00 84 A 7.83 5.26 1.23 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 85 I 8.79 4.75 1.81 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 1.11 0.76 0.92 0.00 0.00 86 V 8.79 4.95 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 1.08 0.00 0.00 0.84 0.00 0.00 87 K 8.98 4.77 0.00 1.77 1.87 0.00 1.76 0.00 0.00 1.94 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.45 7.81 88 G 8.84 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.81 4.94 0.00 1.62 1.58 0.71 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 90 R 9.10 4.00 0.00 2.01 2.02 0.00 3.43 0.00 0.00 3.37 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 91 T 8.23 4.87 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 1.24 0.00 0.00 92 G 8.76 3.81 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 0.00 0.00 0.00 93 T 7.87 4.01 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 1.22 0.00 0.00 94 D 8.09 4.44 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 95 F 8.37 3.88 0.00 2.99 3.22 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 96 E 8.08 3.76 0.00 2.21 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 2.36 2.55 0.00 97 Y 7.74 4.06 0.00 3.01 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 98 E 8.37 3.94 0.00 1.75 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 0.00 2.60 2.60 0.00 99 L 7.69 3.77 0.00 0.63 1.13 0.81 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 7.23 3.87 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 101 M 7.33 3.91 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 102 A 8.41 3.95 1.45 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 0.00 0.00 0.00 103 Q 8.33 3.93 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 104 M 8.39 4.01 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 105 N 8.59 4.35 0.00 2.94 2.84 0.00 0.00 6.71 6.92 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 0.00 106 K 8.22 4.17 0.00 1.95 1.80 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 107 H 8.11 4.10 0.00 3.17 3.56 0.00 5.99 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.84 4.04 1.88 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 1.72 0.72 0.97 0.00 0.00 109 A 7.86 4.42 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 0.00 110 G 8.57 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 0.00 111 V 7.38 3.98 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 0.93 0.00 0.00 0.94 0.00 0.00 112 D 9.31 4.85 0.00 2.79 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 0.00 113 T 8.03 4.98 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 0.48 0.00 0.00 114 F 9.45 4.56 0.00 2.95 3.05 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 0.00 115 F 8.88 5.60 0.00 3.04 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 0.00 116 V 9.02 4.74 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 0.86 0.00 0.00 1.09 0.00 0.00 117 A 8.71 4.58 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 T 8.86 3.97 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 1.29 0.00 0.00 119 A 8.71 4.17 1.45 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 0.00 0.00 0.00 120 P 0.00 4.26 0.00 2.15 2.12 0.00 3.58 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 121 R 7.76 3.99 0.00 1.66 1.83 0.00 2.72 0.00 0.00 2.96 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 122 Y 7.48 4.46 0.00 3.03 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 0.00 123 S 8.11 4.14 0.00 4.06 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 0.00 124 F 7.77 4.69 0.00 3.22 3.21 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 0.00 125 V 7.31 3.91 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 0.65 0.00 0.00 0.45 0.00 0.00 126 S 8.15 4.66 0.00 4.02 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 0.00 127 S 8.68 4.15 0.00 3.92 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 0.00 128 S 7.98 4.20 0.00 4.05 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 0.00 129 L 7.88 3.93 0.00 1.83 1.74 0.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.26 4.05 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 0.00 131 K 8.16 3.99 0.00 2.07 1.90 0.00 1.71 0.00 0.00 1.87 0.00 0.00 3.12 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.70 7.81 132 E 7.79 3.95 0.00 2.18 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 2.36 2.34 0.00 133 V 7.86 3.73 2.13 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 1.05 0.00 0.00 0.97 0.00 0.00 134 A 8.11 4.19 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 0.00 135 M 8.37 4.20 0.00 1.96 2.20 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 2.62 2.85 0.00 136 L 7.95 4.56 0.00 1.77 1.65 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 137 G 8.52 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 0.00 0.00 0.00 138 G 7.59 3.73 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 0.00 0.00 0.00 139 D 8.46 4.66 0.00 2.64 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 0.00 140 V 8.14 4.41 2.13 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 0.85 0.00 0.00 1.03 0.00 0.00 141 S 9.06 4.74 0.00 3.98 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 0.00 142 E 8.22 4.43 0.00 2.06 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 0.00 2.35 2.37 0.00 143 L 8.14 4.61 0.00 1.77 1.63 1.06 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.14 4.94 0.00 1.63 1.51 0.95 0.97 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 0.00 145 P 0.00 4.43 0.00 2.26 2.13 0.00 3.41 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 146 E 9.02 3.85 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 2.39 2.50 0.00 147 P 0.00 4.40 0.00 2.02 2.24 0.00 3.61 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.15 0.00 148 V 8.13 4.05 2.13 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 0.94 0.00 0.00 0.82 0.00 0.00 149 N 7.93 4.35 0.00 2.92 2.86 0.00 0.00 6.79 7.66 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 0.00 150 R 8.46 3.92 0.00 1.83 2.03 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 151 R 7.89 3.99 0.00 1.82 2.13 0.00 3.28 0.00 0.00 3.19 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 152 L 7.90 4.30 0.00 2.10 1.77 1.22 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 153 R 8.06 3.95 0.00 1.89 2.02 0.00 3.13 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.94 0.00 154 D 7.36 5.06 0.00 2.59 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 0.00 155 R 7.94 4.65 0.00 1.69 1.86 0.00 3.29 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 156 L 7.81 4.32 0.00 1.49 1.47 0.92 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00