NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9371 8.3549 109.7349 45.3791 0.0000 173.2648 2 L 4.3064 8.1239 120.6156 51.0876 43.4347 175.6754 3 S 4.4857 9.9906 118.0515 58.0255 66.0853 174.7833 4 D 4.6931 8.7835 121.8736 57.6834 40.6056 179.4381 5 G 3.6492 8.0630 105.6946 47.7574 0.0000 175.5719 6 E 3.9315 8.0389 120.7919 58.9768 29.4067 179.3686 7 W 4.3314 8.1315 119.0116 59.7457 29.1104 178.2922 8 Q 4.0642 8.3530 119.5651 59.2450 28.4652 178.4404 9 L 4.0220 7.8524 119.4839 57.7244 41.5859 179.5139 10 V 3.7150 7.8919 118.1415 66.3301 31.5562 178.1802 11 L 4.1620 8.4475 118.8327 57.5939 41.1923 179.0904 12 N 4.3381 8.0468 116.4032 56.7575 39.2948 176.8217 13 V 3.7611 8.1354 119.8263 65.8026 31.5512 177.7064 14 W 4.2821 8.8336 128.5454 60.3590 30.2942 177.9121 15 G 3.7237 8.1068 105.7229 47.9075 0.0000 175.7347 16 K 3.9161 7.6975 119.6872 59.2372 32.3051 179.3742 17 V 2.9600 6.9504 117.8691 65.3588 31.1280 177.5859 18 E 4.0116 7.7119 117.1881 58.2922 29.3485 178.2197 19 A 4.2668 7.2531 118.1333 52.9570 20.0407 177.5849 20 D 4.6318 7.9056 115.6163 52.4243 43.4684 175.7414 21 V 3.5632 7.8123 123.5646 65.7208 32.2005 176.8533 22 A 4.0554 7.9740 120.2157 54.9210 18.2333 179.7231 23 G 3.5416 7.8574 105.7611 47.8610 0.0000 175.7926 24 H 4.1787 8.2690 119.2479 58.1748 28.6871 178.2717 25 G 3.5228 8.2782 107.8497 47.6466 0.0000 175.3919 26 Q 3.7992 8.0059 122.2520 58.9860 29.0101 178.0997 27 E 3.7876 7.8376 119.7137 59.1808 29.5377 178.8833 28 V 3.4801 7.7459 118.1867 66.1237 31.5889 178.0900 29 L 3.4846 7.6267 118.3456 57.2031 41.2864 179.5555 30 I 3.6155 7.6770 120.1307 64.3102 37.0413 178.4771 31 R 3.8492 8.0353 119.1703 59.1376 29.8386 178.8598 32 L 3.9276 7.8311 120.0174 58.3855 41.6498 179.1630 33 F 4.6611 7.9212 117.5379 60.2756 38.5774 177.8078 34 K 4.2542 8.4145 118.1959 58.8755 32.0856 179.1525 35 G 3.7253 8.0519 105.3456 46.5464 0.0000 173.9283 36 H 4.7495 8.4480 118.2562 51.9797 30.4171 171.6773 37 P 4.6782 0.0000 0.0000 64.6458 31.1123 177.3617 38 E 4.0928 8.3167 116.1978 59.7660 29.3067 179.2670 39 T 3.8126 8.4724 110.9743 64.4161 68.7558 176.0972 40 L 3.4675 7.8847 122.8377 58.0031 41.7061 178.5322 41 E 3.9937 7.7907 118.1050 59.1164 29.6284 177.8826 42 K 4.0571 8.1247 116.1160 57.4728 32.5167 176.5925 43 F 4.5575 8.1268 119.4357 55.5066 39.4703 176.2802 44 D 4.5784 8.4875 126.7692 56.9403 40.8525 178.1943 45 K 4.1323 7.5866 116.6200 57.7607 32.5275 177.2551 46 F 5.0388 6.9489 115.4670 57.9346 41.0186 178.6611 47 K 4.4981 8.3245 119.3840 59.5151 31.8303 176.7587 48 H 4.4586 7.7820 114.1808 56.9066 29.0860 176.0541 49 L 4.2536 7.8908 121.0804 54.9496 41.6946 177.1154 50 K 4.4621 9.1383 122.1811 56.4892 33.4463 176.2208 51 S 4.6310 7.3759 113.1913 55.9787 67.2621 174.3026 52 E 3.9155 8.6210 121.5158 59.4445 29.4741 178.2278 53 D 4.4346 8.0213 118.5921 57.1109 40.7541 178.4569 54 E 3.9756 8.3292 119.4537 59.6111 29.2724 179.1404 55 M 4.0097 7.9866 117.6909 58.4526 32.1073 178.7294 56 K 4.0502 8.4794 117.5350 59.3055 32.2686 179.0128 57 A 4.2789 7.7280 119.6641 53.2823 18.4845 177.4354 58 S 4.0365 7.4677 113.1141 58.6101 62.9085 174.4982 59 E 3.9482 8.9344 129.0958 59.5937 29.6137 178.2743 60 D 4.5536 8.1442 118.2817 56.7701 40.9507 178.4109 61 L 3.2488 7.7221 120.8905 57.8206 42.0941 178.8549 62 K 3.8833 7.7151 119.3759 59.4500 32.1156 178.9015 63 K 4.0287 8.0683 118.6899 59.7667 31.9059 178.9032 64 H 4.4263 8.6491 118.7455 59.0030 29.8213 177.6097 65 G 3.5130 8.2023 107.8263 47.5684 0.0000 175.0641 66 N 4.2937 8.2197 119.5770 56.8813 39.0525 177.0558 67 T 3.8926 7.9477 116.8770 66.8860 68.5944 176.8683 68 T 3.8710 8.0871 117.7765 66.7970 68.5797 176.7647 69 L 4.3271 8.0908 120.3127 57.4236 41.5945 179.6158 70 T 3.9905 8.6293 116.4079 66.5159 68.2425 176.4667 71 A 3.9998 7.9864 122.5830 55.0935 18.4333 179.4722 72 L 3.7306 7.9746 118.9174 57.9661 42.0953 179.3557 73 G 3.2310 8.2100 105.9381 47.5578 0.0000 175.9163 74 G 3.5632 7.5058 107.2370 47.4963 0.0000 175.6727 75 I 3.8208 7.3617 122.2183 64.0846 37.1748 178.5777 76 L 3.9210 7.5287 119.7834 57.6521 41.1274 179.7330 77 K 3.8877 7.6690 117.4161 58.9146 32.2562 178.6342 78 K 3.9525 7.7757 116.6822 55.7782 32.4260 176.8263 79 K 2.0000 8.1783 118.4603 56.7003 30.2025 174.5459 80 G 4.1290 8.0765 110.5063 46.3315 0.0000 174.8822 81 H 4.6550 6.8715 117.0232 54.1118 27.1021 175.0499 82 H 5.1047 7.4389 117.7450 54.6724 29.6227 175.1966 83 E 3.9447 8.3602 122.3583 60.2261 29.1298 178.9944 84 A 4.1441 7.9252 118.0341 54.5276 17.3826 178.9227 85 E 4.1441 8.0814 117.1208 59.2482 29.7735 179.0262 86 L 4.2987 8.3656 119.4398 57.8865 41.6882 179.1758 87 T 3.8718 7.6936 115.8867 66.5712 68.5951 174.3012 88 P 4.2729 0.0000 0.0000 65.9689 31.1993 178.0924 89 L 4.0628 7.4860 119.3681 57.6850 42.0607 178.6140 90 A 4.1405 8.5065 121.1998 55.2699 18.5072 179.0222 91 Q 3.7351 8.0380 118.2825 59.6522 28.9609 179.1575 92 S 4.0880 7.9513 114.2662 61.2882 63.2387 175.8964 93 H 3.8150 8.2355 119.2169 58.0214 28.1135 177.4725 94 A 3.0566 8.0345 123.1054 55.0727 17.9080 179.8954 95 T 3.5221 6.9473 112.4543 65.6357 68.9773 175.4596 96 K 4.2479 7.7327 118.8940 58.0959 33.6967 176.5558 97 H 4.3694 8.5131 114.6585 55.5756 29.7110 175.3945 98 K 3.6909 6.9914 117.3117 57.2410 29.3621 176.3780 99 I 4.2382 7.9615 118.9094 59.0184 38.1757 175.1458 100 P 4.4107 0.0000 0.0000 62.5468 31.9899 178.2186 101 V 3.4399 7.7146 114.0762 63.8198 31.2329 178.9354 102 K 3.7966 7.7515 119.2579 59.2579 32.0176 178.1757 103 Y 4.0141 7.6855 116.6649 60.6754 37.8099 178.1814 104 L 4.1444 7.7377 119.8960 57.6817 41.6326 179.0308 105 E 4.0667 7.8252 118.8843 59.0084 29.6849 178.4976 106 F 4.6850 8.0502 118.1112 60.8470 38.9603 177.4586 107 I 3.9148 8.1311 118.0709 63.7967 37.8504 178.1643 108 S 4.2132 8.1606 116.0524 61.6128 62.5905 176.4024 109 E 4.0500 8.4243 121.1247 59.3855 29.1750 179.2084 110 A 4.3210 8.0456 122.1749 54.6115 18.3699 179.7591 111 I 3.6476 8.0061 118.3595 64.5653 37.2286 178.7216 112 I 3.8131 7.7312 120.2785 64.6694 36.8383 178.5033 113 Q 4.0641 8.4112 119.1511 59.0236 28.3990 179.2820 114 V 3.5409 8.0162 119.3706 65.8478 31.5636 178.1363 115 L 3.6229 7.8646 118.8591 57.5918 41.0470 179.3063 116 Q 4.2062 7.8611 118.6016 59.3590 29.1244 178.1873 117 S 4.2601 8.0232 115.1862 61.4637 63.0663 176.3822 118 K 4.1040 8.4537 120.2143 57.8699 33.2148 176.9502 119 H 5.0380 8.6939 116.4926 53.5496 29.4722 172.6433 120 P 4.3810 0.0000 0.0000 65.8645 31.6462 178.5358 121 G 3.7690 8.1016 106.7192 47.7655 0.0000 174.1357 122 D 4.5645 8.0354 118.1554 55.6118 41.9967 177.5368 123 F 4.9656 8.3876 123.6678 58.1477 36.4886 175.2893 124 G 3.9086 7.6714 108.1104 43.5506 0.0000 170.6759 125 A 3.8673 8.3736 120.7279 55.4172 18.4971 179.8525 126 D 4.1738 7.9251 116.5238 57.4887 40.9771 178.7227 127 A 4.0071 7.8177 120.7531 55.0503 18.3120 179.4815 128 Q 3.2748 8.0176 117.0400 58.9160 28.7570 179.3330 129 G 3.5157 8.0544 106.4436 47.6219 0.0000 175.5754 130 A 3.8331 7.8144 122.7902 55.1524 18.4289 179.4430 131 M 4.0338 8.4113 117.1715 58.9670 32.3727 178.6354 132 S 4.2088 8.4015 115.5884 61.5054 62.8848 176.8098 133 K 3.9435 8.2406 121.1275 59.2632 31.7038 179.2905 134 A 3.8783 7.8575 121.1878 55.0887 18.2289 179.6471 135 L 4.2007 8.0490 117.4758 57.5552 41.7382 179.2179 136 E 3.9549 8.3794 119.6321 58.9774 29.5576 178.6509 137 L 3.9602 8.2755 120.7421 57.9683 42.1381 178.4347 138 F 4.1223 8.2674 120.6891 61.6525 39.3163 177.2048 139 R 3.3377 8.2711 118.1872 59.0671 29.8902 178.2472 140 N 4.2364 8.2576 116.4617 56.3816 38.5781 177.0653 141 D 4.3441 8.4532 120.5993 57.6035 40.8374 178.8024 142 M 3.8293 7.9367 119.1800 58.3276 31.8976 178.7311 143 A 3.6129 7.7850 120.5683 54.8272 18.6040 179.5194 144 A 3.9357 7.8581 119.1364 55.3224 18.3333 180.0589 145 K 4.0026 8.0788 117.0093 59.8452 31.9839 179.0390 146 Y 4.0203 8.5795 117.2566 60.9626 37.7700 178.8477 147 K 4.4032 8.2538 120.6289 59.6455 32.2145 178.8265 148 E 4.0934 7.9733 115.7735 58.9653 29.5753 178.2048 149 L 4.4376 7.7038 118.2242 55.1888 41.9818 177.5536 150 G 3.7366 8.1482 107.2708 45.3249 0.0000 173.0759 151 F 4.5716 8.8597 119.2789 55.1574 41.4473 177.0673 152 Q 4.3602 8.5866 122.4357 53.8785 26.5813 176.0392 153 G 3.8060 7.8741 110.4299 46.1589 0.0000 170.8900 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 G 8.35 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 2 L 8.12 4.31 0.00 0.70 0.96 0.54 -0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.99 4.49 0.00 4.01 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.78 4.69 0.00 2.77 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 5 G 8.06 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 6 E 8.04 3.93 0.00 1.88 1.71 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 2.21 2.26 0.00 7 W 8.13 4.33 0.00 3.62 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 8 Q 8.35 4.06 0.00 2.46 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 9 L 7.85 4.02 0.00 1.91 1.73 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.89 3.71 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.86 0.00 0.00 11 L 8.45 4.16 0.00 1.91 1.80 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.05 4.34 0.00 3.15 3.02 0.00 0.00 7.17 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 13 V 8.14 3.76 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.20 0.00 0.00 14 W 8.83 4.28 0.00 3.59 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 15 G 8.11 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 16 K 7.70 3.92 0.00 1.73 1.44 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.31 7.81 17 V 6.95 2.96 0.73 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 0.05 0.00 0.00 0.20 0.00 0.00 18 E 7.71 4.01 0.00 2.01 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 2.33 2.33 0.00 19 A 7.25 4.27 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 20 D 7.91 4.63 0.00 2.66 2.53 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 21 V 7.81 3.56 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 1.09 0.00 0.00 0.91 0.00 0.00 22 A 7.97 4.06 1.30 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 23 G 7.86 3.54 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 0.00 0.00 0.00 24 H 8.27 4.18 0.00 3.08 3.22 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.28 3.52 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 26 Q 8.01 3.80 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 27 E 7.84 3.79 0.00 2.15 1.93 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 2.20 2.26 0.00 28 V 7.75 3.48 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 1.01 0.00 0.00 0.93 0.00 0.00 29 L 7.63 3.48 0.00 1.50 0.82 0.81 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.68 3.62 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.69 0.87 0.00 0.00 31 R 8.04 3.85 0.00 1.89 1.93 0.00 3.24 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 32 L 7.83 3.93 0.00 1.71 1.55 1.04 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.92 4.66 0.00 3.04 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.41 4.25 0.00 1.69 1.86 0.00 1.68 0.00 0.00 1.88 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.57 7.81 35 G 8.05 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 36 H 8.45 4.75 0.00 2.93 3.05 0.00 5.65 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.68 0.00 2.16 2.13 0.00 3.85 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 2.10 2.02 0.00 38 E 8.32 4.09 0.00 2.33 2.32 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 2.37 2.58 0.00 39 T 8.47 3.81 4.39 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 0.77 0.00 0.00 40 L 7.88 3.47 0.00 1.57 1.79 0.13 0.88 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 41 E 7.79 3.99 0.00 2.04 2.26 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 2.37 2.39 0.00 42 K 8.12 4.06 0.00 1.81 1.74 0.00 1.94 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.67 1.93 7.81 43 F 8.13 4.56 0.00 3.20 2.59 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 44 D 8.49 4.58 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 45 K 7.59 4.13 0.00 0.89 1.76 0.00 1.61 0.00 0.00 1.60 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.30 1.13 7.81 46 F 6.95 5.04 0.00 2.78 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 47 K 8.32 4.50 0.00 1.52 1.50 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.64 7.81 48 H 7.78 4.46 0.00 3.21 3.37 0.00 5.71 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.89 4.25 0.00 1.59 1.59 0.98 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.14 4.46 0.00 1.70 1.83 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.53 1.49 7.81 51 S 7.38 4.63 0.00 3.98 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 52 E 8.62 3.92 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 53 D 8.02 4.43 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.33 3.98 0.00 2.15 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 2.33 2.34 0.00 55 M 7.99 4.01 0.00 1.96 2.26 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.58 0.00 56 K 8.48 4.05 0.00 1.72 1.84 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.41 7.81 57 A 7.73 4.28 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 58 S 7.47 4.04 0.00 3.89 3.74 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 59 E 8.93 3.95 0.00 2.09 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 2.40 2.41 0.00 60 D 8.14 4.55 0.00 2.98 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 61 L 7.72 3.25 0.00 1.19 1.53 0.72 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.72 3.88 0.00 1.98 1.91 0.00 1.54 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.50 7.81 63 K 8.07 4.03 0.00 2.10 1.91 0.00 1.79 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.65 7.81 64 H 8.65 4.43 0.00 3.64 3.59 0.00 5.78 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.20 3.51 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 0.00 66 N 8.22 4.29 0.00 2.92 3.02 0.00 0.00 7.25 6.58 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 67 T 7.95 3.89 4.37 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 1.25 0.00 0.00 68 T 8.09 3.87 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 1.27 0.00 0.00 69 L 8.09 4.33 0.00 1.76 1.90 0.85 0.66 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 70 T 8.63 3.99 4.48 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 1.25 0.00 0.00 71 A 7.99 4.00 1.41 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 72 L 7.97 3.73 0.00 1.61 1.63 0.16 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.21 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.51 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 75 I 7.36 3.82 1.86 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 1.51 1.09 0.86 0.00 0.00 76 L 7.53 3.92 0.00 1.20 1.39 0.08 0.65 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 77 K 7.67 3.89 0.00 1.84 1.79 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.44 1.37 7.81 78 K 7.78 3.95 0.00 1.77 1.76 0.00 1.77 0.00 0.00 1.53 0.00 0.00 3.08 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.73 7.81 79 K 8.18 2.00 0.00 1.04 0.74 0.00 1.43 0.00 0.00 1.25 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.55 1.01 7.81 80 G 8.08 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 H 6.87 4.65 0.00 3.22 3.31 0.00 5.70 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.44 5.10 0.00 3.29 3.41 0.00 5.68 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.36 3.94 0.00 2.09 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 2.44 2.51 0.00 84 A 7.93 4.14 1.30 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 85 E 8.08 4.14 0.00 2.18 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 2.37 2.44 0.00 86 L 8.37 4.30 0.00 1.74 1.71 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.69 3.87 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 88 P 0.00 4.27 0.00 2.28 2.34 0.00 3.66 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.05 0.00 89 L 7.49 4.06 0.00 2.12 1.89 1.10 1.34 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 90 A 8.51 4.14 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 91 Q 8.04 3.74 0.00 2.39 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 92 S 7.95 4.09 0.00 4.03 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 0.00 93 H 8.24 3.82 0.00 3.51 3.53 0.00 5.81 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.03 3.06 -0.01 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 95 T 6.95 3.52 4.30 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 1.14 0.00 0.00 96 K 7.73 4.25 0.00 1.52 1.63 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.09 1.31 7.81 97 H 8.51 4.37 0.00 2.99 3.19 0.00 5.86 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 98 K 6.99 3.69 0.00 1.68 1.83 0.00 1.75 0.00 0.00 1.95 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.29 1.50 7.81 99 I 7.96 4.24 2.07 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.98 1.14 0.00 0.00 100 P 0.00 4.41 0.00 1.64 1.70 0.00 2.85 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.64 0.00 101 V 7.71 3.44 1.83 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 0.46 0.00 0.00 0.74 0.00 0.00 102 K 7.75 3.80 0.00 1.59 1.60 0.00 1.55 0.00 0.00 1.93 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.39 1.29 7.81 103 Y 7.69 4.01 0.00 3.26 3.07 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 0.00 0.00 0.00 104 L 7.74 4.14 0.00 1.74 1.71 0.54 0.81 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 0.00 105 E 7.83 4.07 0.00 1.96 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 2.50 2.45 0.00 106 F 8.05 4.69 0.00 3.25 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 0.00 107 I 8.13 3.91 2.01 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 1.58 1.38 1.13 0.00 0.00 108 S 8.16 4.21 0.00 4.23 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 0.00 109 E 8.42 4.05 0.00 2.35 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 2.42 2.46 0.00 110 A 8.05 4.32 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 0.00 111 I 8.01 3.65 2.04 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 1.57 0.85 1.01 0.00 0.00 112 I 7.73 3.81 2.12 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.10 1.16 0.00 0.00 113 Q 8.41 4.06 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 114 V 8.02 3.54 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 0.93 0.00 0.00 0.89 0.00 0.00 115 L 7.86 3.62 0.00 0.80 0.39 0.55 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.86 4.21 0.00 2.29 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 117 S 8.02 4.26 0.00 3.81 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 0.00 118 K 8.45 4.10 0.00 1.34 1.42 0.00 1.41 0.00 0.00 1.37 0.00 0.00 2.81 0.00 0.00 2.44 0.00 0.00 0.00 0.00 1.27 1.39 7.81 119 H 8.69 5.04 0.00 3.11 3.32 0.00 5.63 0.00 0.00 0.00 0.00 6.77 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 4.38 0.00 2.20 2.34 0.00 3.84 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 2.01 1.99 0.00 121 G 8.10 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.04 4.56 0.00 2.75 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 0.00 123 F 8.39 4.97 0.00 3.00 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 0.00 124 G 7.67 3.91 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 0.00 125 A 8.37 3.87 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 0.00 126 D 7.93 4.17 0.00 2.66 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 0.00 127 A 7.82 4.01 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 0.00 128 Q 8.02 3.27 0.00 1.90 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 1.16 1.75 0.00 129 G 8.05 3.52 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 0.00 130 A 7.81 3.83 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 0.00 131 M 8.41 4.03 0.00 2.43 2.37 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.90 0.00 132 S 8.40 4.21 0.00 3.88 3.91 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 0.00 133 K 8.24 3.94 0.00 1.79 1.68 0.00 1.58 0.00 0.00 1.52 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.53 7.81 134 A 7.86 3.88 1.30 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 0.00 135 L 8.05 4.20 0.00 1.80 1.84 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.38 3.95 0.00 2.06 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 0.00 2.31 2.31 0.00 137 L 8.28 3.96 0.00 1.90 2.01 1.00 1.35 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 0.00 138 F 8.27 4.12 0.00 3.16 3.24 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 0.00 139 R 8.27 3.34 0.00 1.83 2.10 0.00 3.12 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 140 N 8.26 4.24 0.00 2.92 2.82 0.00 0.00 6.99 7.59 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 0.00 141 D 8.45 4.34 0.00 2.70 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 0.00 142 M 7.94 3.83 0.00 1.49 1.61 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.95 0.00 143 A 7.78 3.61 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 0.00 144 A 7.86 3.94 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 0.00 145 K 8.08 4.00 0.00 2.04 1.95 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.65 7.81 146 Y 8.58 4.02 0.00 3.23 3.07 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 0.00 0.00 0.00 147 K 8.25 4.40 0.00 2.07 1.99 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.49 7.81 148 E 7.97 4.09 0.00 2.23 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 2.51 2.38 0.00 149 L 7.70 4.44 0.00 2.03 2.03 0.68 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 150 G 8.15 3.74 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 0.00 0.00 0.00 151 F 8.86 4.57 0.00 2.78 3.01 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 0.00 152 Q 8.59 4.36 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.04 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 153 G 7.87 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