NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 A 4.3529 8.2493 123.5811 51.8545 19.8714 176.8937 -1 S 3.9113 8.5028 114.2452 58.8998 63.3026 173.3062 0 A 3.6872 8.2196 121.6403 52.7665 16.4703 178.3594 1 V 3.9159 7.4023 119.1434 64.3331 32.5237 174.9493 2 T 4.4332 8.5509 115.0768 62.8785 71.3508 173.1511 3 D 5.2553 7.7568 121.8639 51.6507 43.8451 175.2690 4 V 4.9613 8.8514 121.9792 61.0151 35.4685 173.7825 5 L 4.8518 9.2027 129.6244 53.2477 44.4550 174.6095 6 L 4.8686 8.8252 130.1033 53.9811 43.7944 174.7404 7 C 4.8303 9.0959 125.4594 58.4063 29.8401 172.8904 8 V 4.7221 9.8975 124.6246 59.8811 33.9138 175.7097 9 G 4.0181 7.5070 115.6306 44.9796 0.0000 170.4954 10 N 4.9652 8.1235 116.7904 51.6280 40.7776 175.2794 11 S 4.1348 8.7603 122.4831 61.4462 63.2707 175.0280 12 M 4.3033 8.4235 119.4331 55.4796 31.9030 176.4153 13 M 5.0799 7.7826 119.4953 55.0665 34.2402 177.1232 14 G 4.1386 7.9179 112.1213 46.6603 0.0000 178.0237 15 D 4.4024 9.5017 125.6630 56.3575 40.5572 177.0152 16 D 4.6038 8.1609 118.7635 56.1133 41.0619 177.2030 17 G 3.8683 8.2332 105.1125 45.4721 0.0000 174.9967 18 A 4.0593 7.7751 124.6738 55.2874 18.3786 179.9969 19 G 3.5907 7.9229 104.7317 47.0201 0.0000 173.5703 20 P 4.2230 0.0000 0.0000 64.9911 31.2964 178.4837 21 L 3.9853 8.1637 119.1778 57.9737 41.9420 178.6510 22 L 3.8361 7.9360 120.0749 58.1137 41.9121 178.7449 23 A 3.9475 7.9328 120.5848 55.2953 18.3412 179.4564 24 E 3.8629 8.2625 116.9951 59.3934 29.5039 179.7470 25 K 3.7052 8.0552 118.5140 59.6771 31.8047 179.1834 26 C 4.3623 8.3281 116.8714 62.8564 27.7967 176.1060 27 A 4.0932 8.0898 121.4632 55.0793 18.0240 179.2533 28 A 4.3139 7.8776 118.2229 54.1071 19.4358 177.9758 29 A 4.5978 7.7744 119.2766 50.2880 20.5088 173.5795 30 P 4.6350 0.0000 0.0000 62.1430 32.2809 176.3623 31 K 4.4992 8.2077 120.0195 55.5308 35.5052 178.0887 32 G 3.9818 8.6595 112.2080 45.4631 0.0000 173.3712 33 N 4.7376 8.1744 118.6803 52.7070 38.7753 175.0100 34 W 4.4200 7.8443 119.3749 56.7812 29.8975 175.8282 35 V 3.9671 8.8671 125.6053 62.4259 32.2221 174.6581 36 V 4.7290 8.4797 128.3123 61.4752 33.0807 174.5972 37 I 4.2357 8.7595 129.8576 59.8577 38.7469 175.2922 38 D 4.7855 8.6208 128.7471 53.5318 39.3013 176.4319 39 G 3.4076 9.1194 108.2104 46.0462 0.0000 173.3763 40 G 3.9951 7.6465 109.7894 46.3389 0.0000 175.2654 41 S 4.1743 8.8408 114.3598 60.6108 63.2409 174.4940 42 A 4.7173 7.6190 121.9571 49.5336 21.4292 174.1076 43 P 5.0973 0.0000 0.0000 64.1955 32.2738 178.2577 44 E 3.9308 8.5246 119.6098 59.5554 29.3555 177.9935 45 N 4.8846 8.1173 112.2151 53.1846 37.9154 175.4852 46 D 4.7912 8.1040 119.1305 54.9434 41.7031 178.4430 47 I 3.7170 7.2938 120.0636 64.3443 37.1437 178.2571 48 V 3.5593 7.8220 118.3365 65.9728 31.3582 177.7906 49 A 4.0017 7.9221 119.9540 55.1749 18.1164 179.3928 50 I 3.6548 7.4402 117.0610 64.6360 37.5738 178.3521 51 R 4.0440 8.2577 119.6100 59.4896 29.6928 178.4599 52 E 4.0448 8.0901 117.5508 59.2139 29.5156 179.0173 53 L 4.0475 8.0593 118.1029 55.3172 42.2686 177.0715 54 R 3.7748 7.6525 116.7302 56.4033 28.0843 174.3432 55 P 4.5633 0.0000 0.0000 63.0672 32.6748 176.1107 56 T 4.4098 8.6312 108.7973 62.5549 70.7208 174.4785 57 R 4.8928 7.6965 122.5091 54.7595 33.9995 173.0784 58 L 5.3723 9.2221 128.0905 53.2153 45.2899 174.4129 59 L 4.9747 9.0467 128.6592 53.3095 44.4616 174.7282 60 I 4.7481 8.6156 127.3996 59.3853 39.9359 174.6024 61 V 4.4809 8.2786 126.7809 60.9288 34.2951 173.8090 62 D 5.0773 8.3973 126.2380 52.5737 45.1370 174.0327 63 A 4.7920 8.6176 128.2690 52.3921 19.0905 176.8354 64 T 4.6697 8.9969 112.8306 60.1116 72.7174 172.8885 65 D 4.4986 8.8472 125.1945 54.5113 41.5836 175.4140 66 M 4.6145 9.1190 125.0402 54.4855 33.2712 176.1361 67 G 3.8414 8.4400 106.4698 46.3410 0.0000 173.7140 68 L 4.6478 7.8346 119.0791 52.1723 44.3928 175.8723 69 N 4.5403 8.2996 116.3689 52.5083 39.0200 173.3542 70 P 4.5128 0.0000 0.0000 64.5872 31.7715 177.0565 71 G 4.0007 8.9991 111.6488 45.0279 0.0000 173.7076 72 E 4.1838 7.9529 119.9527 56.6427 30.6715 175.9639 73 I 4.8911 8.2929 123.5313 59.6829 39.7741 175.1644 74 R 4.9683 8.8088 124.2719 54.6850 35.3025 174.0150 75 I 4.7380 8.8652 123.0523 60.6877 38.9020 174.8572 76 I 4.7367 8.6280 128.4649 59.5264 38.3574 175.7541 77 D 4.5688 8.7111 127.5458 53.4252 41.7746 175.5572 78 P 4.1687 0.0000 0.0000 66.0325 31.2256 178.3562 79 D 4.3111 8.0886 116.0851 57.6166 41.0431 178.0276 80 D 4.3410 7.8750 118.7468 57.0712 40.8115 178.4651 81 I 3.4990 7.8680 120.3580 64.2463 37.1978 178.3011 82 A 3.7655 7.8872 121.2859 55.2646 18.0488 179.6207 83 E 3.7321 7.8490 115.6626 59.6041 29.6085 179.0488 84 M 4.2353 8.1689 117.0154 55.4156 32.6963 176.0194 85 F 3.6316 7.3779 116.7983 58.3094 37.5168 176.0125 86 M 4.1863 7.6371 119.6824 55.7775 32.5601 176.1878 87 M 5.1494 8.2741 122.4570 53.3763 35.3719 175.6859 88 T 4.2482 8.6050 112.8624 61.0588 69.9117 175.4066 89 T 3.7899 8.3444 115.5017 64.7368 67.2471 173.9475 90 H 4.8013 7.8565 116.2129 55.0979 28.8242 174.2554 91 N 4.2007 8.0190 115.4306 54.3725 36.6204 173.7373 92 M 4.3098 7.8328 117.4178 53.7416 33.1074 173.4755 93 P 4.6693 0.0000 0.0000 62.4280 32.2325 177.1486 94 L 4.0566 9.0338 125.8476 58.0803 41.8870 178.9212 95 N 4.3296 8.0407 116.7365 56.0650 37.1592 176.6916 96 Y 4.2553 7.7804 117.7433 60.9068 37.8948 178.5495 97 L 4.0214 7.9701 119.3272 57.9384 41.7753 179.5267 98 I 3.7429 7.9120 119.7307 64.4501 36.9162 178.0358 99 D 4.2987 8.5575 119.3740 57.3493 41.0297 178.1165 100 Q 3.9358 8.1469 120.1842 58.8805 29.0758 177.8331 101 L 3.9928 8.1488 120.2719 57.9686 41.8381 179.5018 102 K 4.0454 8.3451 118.4743 59.7072 31.7152 178.9375 103 E 3.9688 7.6800 118.7798 59.1985 29.6596 178.1208 104 D 4.5770 7.7912 117.1847 55.6870 41.1061 177.0688 105 I 4.2327 7.7627 118.0918 62.9212 39.3346 175.7766 106 G 4.0775 7.4697 109.5032 43.8969 0.0000 172.9185 107 E 4.5224 7.2206 117.2018 54.3282 31.7996 175.4776 108 V 4.9466 8.4445 126.3184 61.2259 34.7334 174.3188 109 I 4.6719 9.1068 128.5863 59.4709 40.4993 174.0494 110 F 4.8787 8.9935 129.3497 56.3784 41.6025 173.5414 111 L 4.9036 8.4863 129.5714 53.2557 44.0969 175.0708 112 G 4.4601 9.0868 114.1662 44.5701 0.0000 172.0568 113 I 4.9618 8.1688 124.1590 58.9555 40.3915 174.6625 114 Q 4.6963 9.2580 129.3870 54.7628 29.6593 174.0639 115 P 4.8079 0.0000 0.0000 62.5389 32.7105 175.1582 116 D 4.6552 9.0344 118.2039 55.4464 42.1932 176.1662 117 I 4.7449 7.8160 111.7329 58.9740 40.6027 173.9263 118 V 4.7210 8.3744 124.9599 61.7932 34.0859 174.3694 119 G 2.9385 7.7812 112.5841 44.9335 0.0000 171.9881 120 F 4.6255 8.6371 124.0204 59.5505 39.5452 174.5213 121 Y 3.2993 8.4124 124.7621 58.8696 35.8299 169.4972 122 Y 4.6991 7.6882 118.1114 57.3869 39.1945 173.9564 123 P 4.8096 0.0000 0.0000 62.5975 32.8897 175.1245 124 M 4.6158 8.4106 120.2624 55.2551 33.1362 175.7110 125 T 4.4150 9.6800 116.2016 60.4916 70.8029 175.5170 126 Q 3.9376 8.7393 123.7130 59.2700 29.0216 177.2329 127 P 4.2452 0.0000 0.0000 65.4512 31.2305 178.7049 128 I 3.7946 7.6646 118.4279 63.9897 37.2135 178.0268 129 K 3.8473 7.9875 119.4386 59.8329 31.8602 178.9033 130 D 4.3841 8.4174 118.8705 57.3898 40.7024 178.8589 131 A 3.9890 8.0320 121.2143 55.0833 18.2977 179.8538 132 V 3.5022 8.0496 117.0479 66.0569 31.6103 177.8135 133 E 4.0053 8.3083 119.0474 59.5844 29.2407 178.8350 134 T 3.9761 8.0184 114.9002 66.7992 68.8494 176.4003 135 V 4.0520 8.0674 120.0545 66.2245 31.5323 177.1591 136 Y 4.1895 8.3708 119.5196 61.0684 38.4342 177.9456 137 Q 4.0961 8.2841 116.0363 57.3700 29.0166 177.4053 138 R 4.4759 7.8998 118.0439 56.6219 31.0201 177.8137 139 L 4.5806 7.8541 119.4873 56.5455 41.4368 176.7923 140 E 4.1230 7.8793 119.9810 56.8839 29.9094 176.2470 141 G 3.9399 9.0199 113.6326 45.6987 0.0000 172.8444 142 W 4.3079 7.9654 128.8949 57.9669 31.2287 175.3153 143 E 4.9103 7.8765 123.3720 55.6202 34.0841 175.8255 144 G 3.8536 8.4706 111.2667 47.4514 0.0000 174.0184 145 N 5.1018 8.9065 120.8369 52.4506 38.5806 175.1246 146 G 2.0824 8.1316 104.4830 45.7935 0.0000 175.6203 147 G 3.5595 7.8299 105.2656 44.9364 0.0000 174.3128 148 F 4.5198 7.2309 117.8316 56.4462 40.0411 175.5148 149 A 4.3623 8.4364 125.3807 51.6560 19.7431 176.6435 150 Q 4.5682 8.5677 121.5717 55.7248 30.0834 175.6055 151 L 4.1420 8.9856 128.9504 55.1320 42.8326 176.3480 152 A 4.4857 8.6855 130.0878 51.0000 18.6181 177.2339 153 V 4.0483 7.9993 120.5875 62.8051 31.5185 175.2625 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 -2 A 8.25 4.35 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 -1 S 8.50 3.91 0.00 4.07 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 A 8.22 3.69 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.40 3.92 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.92 0.00 0.00 2 T 8.55 4.43 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 1.14 0.00 0.00 3 D 7.76 5.26 0.00 1.87 1.54 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 4 V 8.85 4.96 2.15 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 1.14 0.00 0.00 0.96 0.00 0.00 5 L 9.20 4.85 0.00 1.27 1.42 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.83 4.87 0.00 1.76 1.48 1.01 0.69 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 7 C 9.10 4.83 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 8 V 9.90 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 0.97 0.00 0.00 0.93 0.00 0.00 9 G 7.51 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 10 N 8.12 4.97 0.00 2.70 2.75 0.00 0.00 7.66 7.18 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 11 S 8.76 4.13 0.00 3.84 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 12 M 8.42 4.30 0.00 1.99 2.26 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 13 M 7.78 5.08 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.66 0.00 14 G 7.92 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 0.00 0.00 0.00 0.00 15 D 9.50 4.40 0.00 2.85 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 16 D 8.16 4.60 0.00 2.85 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 17 G 8.23 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 18 A 7.78 4.06 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 19 G 7.92 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.22 0.00 2.12 2.10 0.00 3.56 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 21 L 8.16 3.99 0.00 1.76 1.77 0.85 0.76 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 22 L 7.94 3.84 0.00 1.75 1.73 1.01 0.66 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 23 A 7.93 3.95 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 24 E 8.26 3.86 0.00 2.17 1.95 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 2.28 2.36 0.00 25 K 8.06 3.71 0.00 1.58 0.80 0.00 1.38 0.00 0.00 0.93 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.13 1.45 7.81 26 C 8.33 4.36 0.00 3.14 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 27 A 8.09 4.09 1.35 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 0.00 0.00 0.00 28 A 7.88 4.31 1.35 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 0.00 0.00 0.00 29 A 7.77 4.60 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 30 P 0.00 4.64 0.00 2.11 2.08 0.00 3.73 0.00 0.00 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.27 0.00 31 K 8.21 4.50 0.00 1.59 1.59 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.24 0.26 7.81 32 G 8.66 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 33 N 8.17 4.74 0.00 2.42 2.68 0.00 0.00 6.80 7.68 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 34 W 7.84 4.42 0.00 3.12 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 35 V 8.87 3.97 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 1.01 0.00 0.00 0.95 0.00 0.00 36 V 8.48 4.73 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 0.83 0.00 0.00 0.98 0.00 0.00 37 I 8.76 4.24 1.87 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 1.13 0.73 0.91 0.00 0.00 38 D 8.62 4.79 0.00 2.72 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.12 3.41 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 40 G 7.65 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 41 S 8.84 4.17 0.00 3.87 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 42 A 7.62 4.72 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 43 P 0.00 5.10 0.00 2.28 2.36 0.00 3.92 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 44 E 8.52 3.93 0.00 2.15 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 2.45 2.43 0.00 45 N 8.12 4.88 0.00 2.84 2.93 0.00 0.00 5.91 8.06 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 46 D 8.10 4.79 0.00 2.80 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 47 I 7.29 3.72 1.99 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 1.43 0.81 0.93 0.00 0.00 48 V 7.82 3.56 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 1.05 0.00 0.00 0.94 0.00 0.00 49 A 7.92 4.00 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 50 I 7.44 3.65 2.01 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 1.69 0.87 0.93 0.00 0.00 51 R 8.26 4.04 0.00 2.02 2.08 0.00 3.14 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 52 E 8.09 4.04 0.00 2.14 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 2.59 2.50 0.00 53 L 8.06 4.05 0.00 1.84 1.74 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 54 R 7.65 3.77 0.00 1.94 1.97 0.00 3.16 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.74 0.00 55 P 0.00 4.56 0.00 2.35 2.06 0.00 3.80 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 2.00 1.97 0.00 56 T 8.63 4.41 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 1.18 0.00 0.00 57 R 7.70 4.89 0.00 1.85 1.84 0.00 3.31 0.00 0.00 3.54 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 58 L 9.22 5.37 0.00 1.80 1.51 1.02 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 59 L 9.05 4.97 0.00 1.23 0.76 0.55 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 60 I 8.62 4.75 1.69 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.55 0.80 0.00 0.00 61 V 8.28 4.48 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 0.84 0.00 0.00 0.62 0.00 0.00 62 D 8.40 5.08 0.00 2.69 2.31 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 63 A 8.62 4.79 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.00 4.67 4.34 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 1.51 0.00 0.00 65 D 8.85 4.50 0.00 2.66 2.65 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 66 M 9.12 4.61 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.49 0.00 67 G 8.44 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 68 L 7.83 4.65 0.00 1.77 1.64 0.95 1.10 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 69 N 8.30 4.54 0.00 2.76 2.74 0.00 0.00 6.81 8.03 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 70 P 0.00 4.51 0.00 2.04 2.02 0.00 3.69 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 2.04 2.11 0.00 71 G 9.00 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 72 E 7.95 4.18 0.00 2.01 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 2.49 2.46 0.00 73 I 8.29 4.89 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.63 -0.00 0.00 0.00 74 R 8.81 4.97 0.00 1.72 1.89 0.00 3.50 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 75 I 8.87 4.74 1.99 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.02 1.12 0.00 0.00 76 I 8.63 4.74 1.96 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.53 0.88 0.00 0.00 77 D 8.71 4.57 0.00 2.76 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 78 P 0.00 4.17 0.00 2.15 2.12 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 79 D 8.09 4.31 0.00 2.73 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 80 D 7.87 4.34 0.00 2.87 2.67 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 0.00 0.00 0.00 0.00 81 I 7.87 3.50 1.87 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.67 0.69 0.00 0.00 82 A 7.89 3.77 1.24 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 83 E 7.85 3.73 0.00 1.95 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 2.28 2.45 0.00 84 M 8.17 4.24 0.00 1.97 2.11 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 2.76 2.58 0.00 85 F 7.38 3.63 0.00 3.17 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 86 M 7.64 4.19 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 87 M 8.27 5.15 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.71 0.00 88 T 8.60 4.25 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 1.32 0.00 0.00 89 T 8.34 3.79 4.18 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 1.00 0.00 0.00 90 H 7.86 4.80 0.00 3.43 3.28 0.00 5.86 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 N 8.02 4.20 0.00 2.88 2.90 0.00 0.00 6.81 7.18 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 92 M 7.83 4.31 0.00 2.30 1.96 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.59 0.00 93 P 0.00 4.67 0.00 2.11 1.83 0.00 3.58 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 1.66 1.90 0.00 94 L 9.03 4.06 0.00 1.64 1.52 0.96 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.04 4.33 0.00 2.93 3.03 0.00 0.00 6.29 7.57 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 96 Y 7.78 4.26 0.00 3.19 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 97 L 7.97 4.02 0.00 1.91 1.76 0.97 0.90 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 98 I 7.91 3.74 1.88 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.89 0.96 0.00 0.00 99 D 8.56 4.30 0.00 2.84 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 0.00 100 Q 8.15 3.94 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 101 L 8.15 3.99 0.00 1.92 1.74 0.99 0.92 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 K 8.35 4.05 0.00 1.99 1.89 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.63 7.81 103 E 7.68 3.97 0.00 1.91 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 0.00 2.31 2.34 0.00 104 D 7.79 4.58 0.00 2.80 2.71 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 0.00 105 I 7.76 4.23 1.99 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 1.25 0.50 0.96 0.00 0.00 106 G 7.47 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 0.00 107 E 7.22 4.52 0.00 2.16 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 0.00 2.35 2.33 0.00 108 V 8.44 4.95 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 0.96 0.00 0.00 0.98 0.00 0.00 109 I 9.11 4.67 1.93 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 1.41 0.65 1.17 0.00 0.00 110 F 8.99 4.88 0.00 3.24 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 0.00 111 L 8.49 4.90 0.00 1.60 1.34 0.75 0.54 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 0.00 112 G 9.09 4.46 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 0.00 113 I 8.17 4.96 1.81 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.57 0.87 0.00 0.00 114 Q 9.26 4.70 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.90 0.00 0.00 0.00 0.00 0.00 2.49 2.21 0.00 115 P 0.00 4.81 0.00 2.24 2.05 0.00 3.87 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 2.00 1.96 0.00 116 D 9.03 4.66 0.00 2.64 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 0.00 117 I 7.82 4.74 2.07 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.33 0.93 0.00 0.00 118 V 8.37 4.72 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 0.84 0.00 0.00 0.96 0.00 0.00 119 G 7.78 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 0.00 0.00 0.00 120 F 8.64 4.63 0.00 2.89 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 0.00 121 Y 8.41 3.30 0.00 2.69 2.92 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 0.00 122 Y 7.69 4.70 0.00 2.97 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 0.00 123 P 0.00 4.81 0.00 2.07 2.06 0.00 3.73 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 124 M 8.41 4.62 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 125 T 9.68 4.41 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 1.22 0.00 0.00 126 Q 8.74 3.94 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.68 0.00 127 P 0.00 4.25 0.00 2.20 2.09 0.00 3.60 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 2.11 2.18 0.00 128 I 7.66 3.79 2.10 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 1.64 0.93 0.90 0.00 0.00 129 K 7.99 3.85 0.00 1.97 1.86 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.44 1.48 7.81 130 D 8.42 4.38 0.00 2.87 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 0.00 131 A 8.03 3.99 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 0.00 132 V 8.05 3.50 2.18 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 1.04 0.00 0.00 1.00 0.00 0.00 133 E 8.31 4.01 0.00 2.15 2.16 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 2.36 2.50 0.00 134 T 8.02 3.98 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 1.47 0.00 0.00 135 V 8.07 4.05 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 1.02 0.00 0.00 0.73 0.00 0.00 136 Y 8.37 4.19 0.00 3.14 3.26 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 0.00 137 Q 8.28 4.10 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.52 0.00 0.00 0.00 0.00 0.00 2.77 2.64 0.00 138 R 7.90 4.48 0.00 2.19 1.87 0.00 2.72 0.00 0.00 2.94 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.98 0.00 139 L 7.85 4.58 0.00 1.74 1.79 0.77 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 140 E 7.88 4.12 0.00 1.94 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 141 G 9.02 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 0.00 142 W 7.97 4.31 0.00 4.00 3.38 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 0.00 143 E 7.88 4.91 0.00 1.91 1.76 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 2.56 2.22 0.00 144 G 8.47 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 0.00 145 N 8.91 5.10 0.00 2.80 2.95 0.00 0.00 6.72 7.62 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 0.00 146 G 8.13 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 0.00 0.00 0.00 147 G 7.83 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 F 7.23 4.52 0.00 3.28 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 0.00 149 A 8.44 4.36 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.57 4.57 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 151 L 8.99 4.14 0.00 1.68 1.61 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 152 A 8.69 4.49 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 0.00 153 V 8.00 4.05 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 0.78 0.00 0.00 0.94 0.00 0.00