NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2661 8.3044 120.3563 55.9721 33.2664 175.3502 2 L 4.2086 9.1258 124.4208 54.2365 40.0979 171.2508 3 M 4.4350 7.6847 120.5976 51.6996 35.2997 173.1044 4 P 4.5631 0.0000 0.0000 63.3949 31.8332 175.6828 5 R 4.7264 8.1315 115.5646 55.6718 31.9451 174.6373 6 R 4.3729 8.0977 122.6265 54.5762 37.3760 176.9016 7 M 3.4698 9.3360 123.1002 56.3167 32.8640 175.6957 8 K 3.8738 8.3272 123.1163 58.1743 32.6460 176.9853 9 Y 4.8316 7.3723 115.6302 55.6652 40.8747 175.7877 10 R 4.1496 8.9308 121.2451 58.1326 30.0091 177.0544 11 K 4.6785 7.9190 116.3244 54.2248 35.4121 175.1742 12 Q 4.5937 8.2018 119.0891 53.8834 31.7521 174.9285 13 Q 4.1312 8.5337 118.0890 56.1347 29.3303 177.2622 14 R 4.0655 8.7110 120.6082 57.5232 30.5667 178.1617 15 G 4.0440 8.1774 105.6683 45.0201 0.0000 171.9717 16 R 4.6905 8.3075 116.7742 54.9748 33.2022 175.8024 17 L 4.5311 8.1580 121.9303 52.7301 41.4737 174.5973 18 K 4.2387 8.5368 120.5187 55.6197 32.2217 176.2578 19 G 3.5751 7.8694 112.7978 42.4210 0.0000 168.1901 20 A 3.7655 8.5498 130.5416 51.3256 18.0058 178.1628 21 T 4.0533 7.9846 119.1183 63.7874 69.0561 174.8036 22 K 4.0545 8.4949 123.9194 57.5168 32.6001 176.6505 23 G 3.7540 7.9451 106.4213 46.4967 0.0000 171.8983 24 G 3.5710 7.5973 104.6548 46.2713 0.0000 175.4704 25 D 5.0710 7.9094 120.0090 53.5533 40.4460 175.9870 26 Y 4.6412 7.0176 116.6546 55.0759 39.8495 175.5305 27 V 4.1427 8.3890 121.1643 61.0032 31.4385 175.3468 28 A 4.7012 8.7909 128.0495 51.7480 18.7666 176.2588 29 F 4.1612 7.8614 115.2337 58.6658 42.0686 178.0498 30 G 4.4524 8.8797 114.2760 44.5871 0.0000 172.2184 31 D 4.4656 8.3123 117.9141 56.2138 41.5167 175.5655 32 Y 5.1376 8.1111 116.0595 56.6637 41.4942 174.2866 33 G 4.7794 9.2649 108.3460 45.0151 0.0000 170.7026 34 L 5.4142 9.2382 121.8215 52.9812 44.7657 175.4164 35 V 4.9890 8.7762 125.6780 59.6806 34.5882 174.7409 36 A 4.4837 8.8311 125.8768 52.1375 19.0763 177.9531 37 L 4.4365 8.8682 122.1494 55.4309 43.2901 176.9751 38 E 4.8729 7.8213 115.9154 53.2619 32.5189 174.1839 39 P 4.6632 0.0000 0.0000 63.0047 32.4089 175.1544 40 A 4.2638 8.4456 123.8044 51.8646 23.4590 175.2517 41 W 5.2321 8.6099 119.4643 55.6235 30.3724 176.3259 42 I 4.5474 8.8266 127.1189 60.4390 38.5212 175.9922 43 T 4.6510 9.3629 116.2142 60.5086 70.5193 175.7816 44 A 4.0283 8.7949 125.4019 55.5279 18.3840 180.1911 45 Q 4.0061 8.1621 115.6110 59.6080 28.2115 179.0515 46 Q 3.9870 7.7892 118.9317 58.8333 29.1682 177.8795 47 I 4.0612 7.9085 120.8615 64.7990 37.1373 177.5934 48 E 3.8555 8.2581 119.2248 59.4991 29.3616 178.6517 49 A 4.0738 7.9288 118.2012 53.9582 18.8990 177.9563 50 A 4.5990 7.8772 118.6343 52.5489 21.0324 178.7533 51 R 3.5739 8.0712 117.8192 59.4138 30.1265 179.2408 52 V 3.5059 7.6531 111.4926 64.3961 31.5737 177.9195 53 A 3.9515 8.0333 118.6203 56.2898 18.1500 178.5283 54 M 3.6965 8.1001 116.4244 58.7336 32.1468 178.3541 55 V 3.4130 8.0544 111.4471 64.5763 31.7529 178.9491 56 R 3.7566 7.9972 119.1639 59.8750 30.4025 177.6339 57 H 4.2009 7.6700 117.0895 58.0214 31.2496 176.0088 58 F 4.8488 7.4143 117.4909 54.1904 36.5910 175.0088 59 R 3.8478 8.0197 120.8598 58.8742 30.3622 177.8961 60 R 3.8920 8.8195 119.7739 57.3771 27.9959 174.7882 61 G 3.8048 7.3900 112.2976 43.8980 0.0000 170.6092 62 G 4.1117 7.9072 109.1884 44.9713 0.0000 171.3700 63 K 4.5099 8.6165 121.3168 54.5844 35.6364 176.2388 64 I 4.5357 8.1480 127.0882 59.5249 39.4127 174.7984 65 F 4.9799 9.2048 126.0432 55.7165 41.2719 174.5415 66 I 4.4846 8.4595 118.4054 59.3963 38.5445 175.4760 67 R 4.7379 9.3417 126.7366 55.4442 30.8164 176.2417 68 I 4.6699 7.9045 111.4017 58.9447 40.4065 174.4227 69 F 5.0027 8.6327 124.2601 55.6311 41.4622 172.7102 70 P 4.9362 0.0000 0.0000 62.8034 29.5719 174.9627 71 D 4.5110 8.1252 122.7200 52.6319 40.0613 175.4115 72 K 4.4589 7.6475 121.6413 54.3903 34.2140 173.3415 73 P 3.9825 0.0000 0.0000 62.5480 31.9609 175.0305 74 Y 4.6121 8.1152 126.7716 56.2399 40.4647 174.5797 75 T 4.7556 7.2870 115.5881 59.9311 72.1590 173.1264 76 K 4.1920 7.9713 119.7126 55.5152 35.6432 175.1285 77 K 4.1203 8.7071 127.1093 55.2451 32.7689 175.0595 78 P 4.2883 0.0000 0.0000 62.4891 31.5913 175.4156 79 L 4.1860 8.1887 120.3733 55.8505 42.7011 176.7802 80 E 4.1073 8.8101 122.4293 56.7924 27.0613 174.4050 81 V 4.2912 7.0758 118.2635 59.9555 33.1622 175.8980 82 R 4.4429 8.1022 118.3301 54.6117 31.1854 175.8394 83 M 3.9435 8.3124 118.1581 57.1230 32.8541 178.3286 84 G 3.7167 8.2787 107.1115 45.4998 0.0000 172.9005 85 K 3.6333 9.4674 112.7101 57.4753 29.5134 176.0276 86 G 4.0578 8.0569 101.3950 45.0715 0.0000 173.1791 87 K 4.0466 8.2321 120.2129 55.4722 32.7773 176.7206 88 G 3.9926 8.4566 112.7343 46.8136 0.0000 171.7789 89 N 4.9892 8.3323 116.6078 50.7374 40.1113 174.6512 90 V 3.8051 8.2165 119.7097 63.9930 31.6920 174.3210 91 E 4.3423 9.5195 129.3057 56.8653 30.4440 175.5880 92 G 3.9334 7.5084 110.2919 45.8620 0.0000 171.0987 93 Y 5.1595 8.5940 120.3086 56.4717 42.8471 174.4654 94 V 5.0292 8.7722 114.4340 59.6777 36.7766 174.1472 95 A 4.9024 9.0455 123.2576 49.9487 21.6420 176.0803 96 V 4.2272 8.4185 122.6950 63.1024 32.8874 175.8052 97 V 4.4028 8.7352 126.4311 61.8276 34.7275 173.7641 98 K 4.9055 8.6131 126.6977 53.5073 35.9737 174.0376 99 P 4.3736 0.0000 0.0000 64.6549 31.7859 177.5744 100 G 4.0064 9.4352 111.5581 44.9784 0.0000 173.0833 101 R 4.2973 7.7454 121.7024 56.2496 31.0968 175.8152 102 V 4.1266 8.7803 128.1281 62.7803 31.0730 175.8957 103 M 4.1981 9.1247 128.4292 57.7885 32.5312 176.9407 104 F 6.0255 7.6344 115.0656 55.0257 43.4735 173.6310 105 E 5.3326 8.4609 112.6128 56.2522 32.1024 175.8503 106 V 4.8853 8.7219 117.2420 60.2848 34.4070 174.7663 107 A 5.0370 8.6329 123.3144 50.6135 22.9951 176.0206 108 G 3.9255 9.0802 106.3433 45.7875 0.0000 173.5670 109 V 4.2836 7.1174 114.9801 60.2388 34.9941 173.6833 110 T 4.1423 8.1343 114.7892 61.3192 70.8485 175.3697 111 E 3.1357 8.7122 121.2657 58.9599 29.2030 179.2453 112 E 3.8795 7.9570 117.7998 59.6233 30.0319 178.6079 113 Q 4.2978 7.8748 117.2671 57.0770 28.8844 177.3525 114 A 4.2213 7.8944 123.3316 54.6967 18.3338 180.6690 115 M 4.4354 7.6912 115.0897 54.9952 32.5139 177.1627 116 E 4.3981 9.3140 120.1076 57.1607 32.2947 177.1985 117 A 3.8184 7.7166 119.0134 53.6581 18.1641 178.9509 118 L 4.0567 7.6280 117.0870 56.9242 42.4673 178.4830 119 R 4.0093 7.9733 116.6335 59.5639 30.0694 178.1820 120 I 3.9441 7.9027 119.2273 64.2420 37.2013 177.9495 121 A 4.1374 7.5628 121.4515 55.2973 18.2026 179.6093 122 G 3.6290 8.5676 104.4613 48.5700 0.0000 175.0777 123 H 4.5117 7.9288 115.9179 57.1126 28.8557 176.7174 124 K 4.3800 8.4415 119.6610 55.3879 32.5761 175.9464 125 L 4.7481 7.2432 120.7711 52.0771 43.5347 175.5695 126 P 4.4468 0.0000 0.0000 63.9706 31.3305 175.1942 127 I 4.9199 6.9694 110.6430 57.8300 40.8280 174.2605 128 K 4.5472 8.3868 119.1573 55.8935 33.3444 176.4720 129 T 5.1767 8.3363 113.0756 59.8842 72.3817 172.7181 130 K 4.6944 8.9756 122.3011 54.9182 36.0604 174.9482 131 I 4.9207 8.3713 126.0935 60.6347 38.7554 175.3141 132 V 4.6898 8.6110 117.3952 59.9531 36.5393 174.0508 133 R 4.7542 8.1944 121.2827 54.0804 33.1171 174.9393 134 R 3.9843 7.8605 122.5017 57.0865 32.1039 172.9546 135 D 4.6893 8.5395 122.2197 54.0259 44.0193 176.3090 136 A 3.7720 8.8532 129.3170 56.8626 18.8410 177.6559 137 Y 4.0862 7.7453 116.1917 56.9003 39.6082 175.1908 138 D 4.9162 8.2742 125.6808 53.0006 45.2519 175.8081 139 E 4.4271 8.3575 121.8987 54.1267 28.0697 175.0743 140 A 4.4801 7.3798 122.4677 52.5075 22.2840 176.8686 141 Q 4.1380 8.3635 115.7432 56.8556 29.7470 174.5479 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 8.30 4.27 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 2 L 9.13 4.21 0.00 1.84 2.12 1.04 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 3 M 7.68 4.44 0.00 1.83 0.86 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 4 P 0.00 4.56 0.00 2.12 2.05 0.00 2.69 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 5 R 8.13 4.73 0.00 1.75 1.89 0.00 3.27 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 6 R 8.10 4.37 0.00 1.78 1.14 0.00 3.45 0.00 0.00 3.13 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 7 M 9.34 3.47 0.00 2.16 2.13 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 2.67 2.66 0.00 8 K 8.33 3.87 0.00 0.79 1.23 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.68 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.28 1.32 7.81 9 Y 7.37 4.83 0.00 2.96 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 10 R 8.93 4.15 0.00 1.95 2.10 0.00 2.99 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 11 K 7.92 4.68 0.00 1.70 1.67 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.21 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.27 1.36 7.81 12 Q 8.20 4.59 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.95 0.00 0.00 0.00 0.00 0.00 2.17 2.30 0.00 13 Q 8.53 4.13 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.12 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 14 R 8.71 4.07 0.00 1.89 2.13 0.00 3.48 0.00 0.00 3.41 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.05 0.00 15 G 8.18 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 0.00 0.00 0.00 16 R 8.31 4.69 0.00 1.75 1.77 0.00 3.19 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 17 L 8.16 4.53 0.00 1.57 1.56 0.71 1.09 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 18 K 8.54 4.24 0.00 1.74 1.77 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.42 7.81 19 G 7.87 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.55 3.77 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 T 7.98 4.05 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 1.26 0.00 0.00 22 K 8.49 4.05 0.00 1.71 1.81 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.42 7.81 23 G 7.95 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 24 G 7.60 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 25 D 7.91 5.07 0.00 2.76 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 26 Y 7.02 4.64 0.00 2.85 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.39 4.14 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 0.79 0.00 0.00 1.16 0.00 0.00 28 A 8.79 4.70 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 29 F 7.86 4.16 0.00 2.72 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 30 G 8.88 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 0.00 0.00 0.00 0.00 31 D 8.31 4.47 0.00 3.17 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 32 Y 8.11 5.14 0.00 2.99 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 33 G 9.26 4.78 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 0.00 0.00 0.00 34 L 9.24 5.41 0.00 1.78 1.50 0.98 0.98 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 35 V 8.78 4.99 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 0.90 0.00 0.00 0.99 0.00 0.00 36 A 8.83 4.48 1.20 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 37 L 8.87 4.44 0.00 1.58 1.71 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 38 E 7.82 4.87 0.00 1.96 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 2.21 2.23 0.00 39 P 0.00 4.66 0.00 2.04 2.07 0.00 3.82 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 1.92 1.93 0.00 40 A 8.45 4.26 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 41 W 8.61 5.23 0.00 3.23 2.87 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 42 I 8.83 4.55 1.90 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 1.25 0.63 0.99 0.00 0.00 43 T 9.36 4.65 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 1.13 0.00 0.00 44 A 8.79 4.03 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 45 Q 8.16 4.01 0.00 2.28 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 46 Q 7.79 3.99 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 47 I 7.91 4.06 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.80 1.06 0.00 0.00 48 E 8.26 3.86 0.00 2.13 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 2.39 0.00 49 A 7.93 4.07 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 50 A 7.88 4.60 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 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.07 3.57 0.00 1.81 2.08 0.00 2.99 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.41 0.00 52 V 7.65 3.51 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 0.87 0.00 0.00 0.91 0.00 0.00 53 A 8.03 3.95 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 54 M 8.10 3.70 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.38 0.00 55 V 8.05 3.41 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 0.71 0.00 0.00 0.92 0.00 0.00 56 R 8.00 3.76 0.00 1.81 1.99 0.00 3.31 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 57 H 7.67 4.20 0.00 3.12 3.30 0.00 5.78 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 58 F 7.41 4.85 0.00 2.95 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 59 R 8.02 3.85 0.00 1.97 2.04 0.00 3.19 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 60 R 8.82 3.89 0.00 1.96 1.99 0.00 3.15 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 61 G 7.39 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 7.91 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 63 K 8.62 4.51 0.00 1.66 1.27 0.00 1.58 0.00 0.00 1.55 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.83 1.22 7.81 64 I 8.15 4.54 1.73 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 1.37 0.82 0.70 0.00 0.00 65 F 9.20 4.98 0.00 3.04 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 66 I 8.46 4.48 1.93 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 1.30 0.58 0.56 0.00 0.00 67 R 9.34 4.74 0.00 1.98 1.88 0.00 2.84 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.42 0.00 68 I 7.90 4.67 1.93 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 1.49 0.84 0.92 0.00 0.00 69 F 8.63 5.00 0.00 2.82 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 70 P 0.00 4.94 0.00 2.12 2.05 0.00 3.60 0.00 0.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.92 0.00 71 D 8.13 4.51 0.00 2.63 2.42 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 72 K 7.65 4.46 0.00 1.64 1.52 0.00 1.30 0.00 0.00 0.82 0.00 0.00 2.70 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.11 1.25 7.81 73 P 0.00 3.98 0.00 1.87 1.88 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.29 0.00 74 Y 8.12 4.61 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 75 T 7.29 4.76 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 1.04 0.00 0.00 76 K 7.97 4.19 0.00 1.46 1.53 0.00 1.87 0.00 0.00 1.91 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.26 1.32 7.81 77 K 8.71 4.12 0.00 1.75 1.70 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.42 7.81 78 P 0.00 4.29 0.00 2.02 2.02 0.00 3.64 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 79 L 8.19 4.19 0.00 1.68 1.52 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.81 4.11 0.00 2.17 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 2.20 2.28 0.00 81 V 7.08 4.29 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 0.70 0.00 0.00 0.92 0.00 0.00 82 R 8.10 4.44 0.00 1.93 1.96 0.00 3.06 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 83 M 8.31 3.94 0.00 2.02 2.07 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 2.61 2.51 0.00 84 G 8.28 3.72 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 0.00 0.00 0.00 85 K 9.47 3.63 0.00 1.88 1.86 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.35 7.81 86 G 8.06 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 87 K 8.23 4.05 0.00 1.70 1.68 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.40 7.81 88 G 8.46 3.99 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 0.00 0.00 0.00 89 N 8.33 4.99 0.00 2.80 2.90 0.00 0.00 5.55 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 90 V 8.22 3.81 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 0.50 0.00 0.00 0.84 0.00 0.00 91 E 9.52 4.34 0.00 1.76 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 0.00 2.48 2.39 0.00 92 G 7.51 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 93 Y 8.59 5.16 0.00 2.82 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 94 V 8.77 5.03 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 0.49 0.00 0.00 0.35 0.00 0.00 95 A 9.05 4.90 1.20 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 96 V 8.42 4.23 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 0.98 0.00 0.00 0.92 0.00 0.00 97 V 8.74 4.40 2.28 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 0.90 0.00 0.00 0.93 0.00 0.00 98 K 8.61 4.91 0.00 1.72 1.67 0.00 1.85 0.00 0.00 1.98 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.46 7.81 99 P 0.00 4.37 0.00 2.16 2.14 0.00 3.54 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 100 G 9.44 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 0.00 0.00 0.00 101 R 7.75 4.30 0.00 1.94 1.84 0.00 3.22 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 102 V 8.78 4.13 2.21 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 0.92 0.00 0.00 1.02 0.00 0.00 103 M 9.12 4.20 0.00 1.55 1.43 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.37 0.00 104 F 7.63 6.03 0.00 2.99 2.87 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 0.00 105 E 8.46 5.33 0.00 2.41 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 0.00 2.37 2.62 0.00 106 V 8.72 4.89 2.29 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 0.98 0.00 0.00 1.16 0.00 0.00 107 A 8.63 5.04 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 0.00 108 G 9.08 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 0.00 109 V 7.12 4.28 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 0.62 0.00 0.00 0.36 0.00 0.00 110 T 8.13 4.14 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 1.24 0.00 0.00 111 E 8.71 3.14 0.00 2.05 2.35 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 2.39 2.34 0.00 112 E 7.96 3.88 0.00 2.14 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 2.25 2.41 0.00 113 Q 7.87 4.30 0.00 2.25 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.97 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 114 A 7.89 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 M 7.69 4.44 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.63 0.00 116 E 9.31 4.40 0.00 1.94 1.78 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 2.28 2.30 0.00 117 A 7.72 3.82 1.03 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 0.00 0.00 118 L 7.63 4.06 0.00 1.72 1.75 1.08 0.96 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 0.00 119 R 7.97 4.01 0.00 1.79 2.11 0.00 3.27 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.74 0.00 120 I 7.90 3.94 1.83 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.00 0.92 0.00 0.00 121 A 7.56 4.14 1.53 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 0.00 0.00 0.00 0.00 0.00 0.00 122 G 8.57 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.93 4.51 0.00 3.37 3.35 0.00 5.65 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 0.00 124 K 8.44 4.38 0.00 1.85 1.88 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.72 1.75 7.81 125 L 7.24 4.75 0.00 1.78 1.50 0.70 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.45 0.00 2.15 2.16 0.00 3.69 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.09 0.00 127 I 6.97 4.92 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.48 0.92 0.00 0.00 128 K 8.39 4.55 0.00 1.71 1.73 0.00 1.59 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.55 7.81 129 T 8.34 5.18 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 1.12 0.00 0.00 130 K 8.98 4.69 0.00 1.82 1.62 0.00 1.52 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.47 7.81 131 I 8.37 4.92 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.73 1.06 0.00 0.00 132 V 8.61 4.69 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 0.74 0.00 0.00 0.98 0.00 0.00 133 R 8.19 4.75 0.00 1.24 1.56 0.00 2.99 0.00 0.00 2.42 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.93 0.00 134 R 7.86 3.98 0.00 1.80 1.85 0.00 3.29 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 135 D 8.54 4.69 0.00 2.62 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 0.00 0.00 0.00 136 A 8.85 3.77 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 0.00 137 Y 7.75 4.09 0.00 3.05 2.86 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 0.00 138 D 8.27 4.92 0.00 2.60 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 8.36 4.43 0.00 1.90 1.89 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 2.07 2.13 0.00 140 A 7.38 4.48 1.18 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 0.00 0.00 141 Q 8.36 4.14 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.60 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00