NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3177 8.3349 115.2880 57.7571 63.4954 173.5564 2 Q 5.5695 7.9048 121.6431 54.7407 30.8054 170.8614 3 L 4.4809 7.6473 119.4345 54.7806 44.2393 176.1506 4 T 4.6479 7.8321 108.2956 59.8304 72.3039 175.1136 5 K 3.8533 8.4893 120.1830 60.0192 31.9762 178.9121 6 D 4.3781 8.1225 118.0689 57.7966 40.8442 178.6224 7 E 3.9699 8.3901 118.8127 59.6661 29.3288 179.8409 8 I 3.6877 7.8255 119.5288 64.4045 37.3170 177.6655 9 E 3.8246 8.2640 120.2986 59.5524 29.2757 178.6870 10 E 3.8214 8.4205 119.0103 59.2634 29.5798 178.5256 11 V 3.3363 7.4005 116.9276 66.9623 31.7598 177.0615 12 R 3.7172 9.2449 117.2910 59.3518 29.4761 178.0053 13 E 3.8556 8.9444 118.1404 59.2403 30.4209 179.9525 14 V 3.6760 7.8073 117.9149 66.0075 31.6041 177.3249 15 F 4.3265 8.5862 120.9991 61.7602 39.1117 176.7474 16 D 4.6871 8.3546 118.8627 56.7003 40.6588 178.1430 17 L 3.9425 7.7168 120.2742 58.5933 41.7844 179.1174 18 F 4.0946 8.2840 116.2715 60.6664 39.1407 177.2288 19 D 4.6711 8.3316 119.0234 56.8126 38.9912 177.3256 20 F 3.7327 8.9163 122.0393 60.9552 38.9848 176.6143 21 W 4.2451 8.4211 121.7230 58.6386 29.3403 176.6049 22 D 4.8691 7.8855 117.1446 53.0868 39.4139 177.1879 23 G 3.8982 8.9437 109.5531 47.7498 0.0000 173.6360 24 R 3.8955 6.4076 120.4662 56.7271 28.8658 174.9112 25 D 4.6138 8.1142 121.1036 52.7788 40.5841 177.1336 26 G 4.0680 8.9771 107.1905 46.2846 0.0000 173.1062 27 D 5.4200 8.2078 118.8391 52.3260 44.1001 175.4172 28 V 4.4726 8.6542 122.2911 60.8043 34.5498 174.4767 29 D 4.6703 8.7506 126.4806 54.1668 42.0775 176.8812 30 A 4.0181 9.0410 127.9144 55.2777 18.5056 179.7814 31 A 4.3103 7.8375 116.7902 53.6042 18.8149 178.0680 32 K 4.6204 7.8885 113.4495 55.6741 33.4320 178.1625 33 V 3.8073 9.0667 122.6245 66.5890 31.2004 177.4528 34 G 3.6427 8.2459 105.1747 46.9551 0.0000 174.7335 35 D 4.4827 8.0194 119.8210 57.2408 40.9936 178.5264 36 L 2.7945 7.7882 118.5628 58.0853 42.0015 178.3440 37 L 4.0823 8.2109 117.9680 58.3066 41.7519 180.1423 38 R 4.8038 8.0178 118.9002 59.0970 29.8672 178.7240 39 C 3.9612 8.2723 114.7307 61.7455 28.1905 175.1167 40 L 4.3248 7.8108 119.9539 54.7173 41.6793 177.3582 41 G 4.0873 8.8145 107.2845 45.3889 0.0000 173.8437 42 M 4.5100 7.9152 119.4570 54.8178 33.2118 175.0990 43 N 5.4463 8.1412 117.1799 50.8277 39.2684 172.5748 44 P 4.5191 0.0000 0.0000 62.2460 32.8152 177.5227 45 T 4.4856 7.9936 110.3674 60.4442 72.0582 175.2408 46 E 4.0679 9.5268 122.7680 59.9482 29.6053 179.6504 47 A 4.0617 8.2658 120.3840 55.6144 18.1446 179.6882 48 Q 3.9582 8.1924 115.7965 58.8650 28.9799 179.1303 49 V 3.7269 7.9250 119.5759 66.2419 31.6582 177.8559 50 H 4.4741 7.9481 114.7314 58.6703 28.6768 177.2930 51 Q 4.3061 8.2349 114.9452 57.7996 28.3359 176.3041 52 H 4.8223 8.4552 115.1098 55.7613 29.9638 173.8015 53 G 4.3864 8.0165 110.0534 46.6987 0.0000 175.7992 54 G 3.8635 8.2487 108.3728 46.0564 0.0000 172.3016 55 T 4.7820 8.1893 111.2792 59.3842 71.8198 174.5687 56 K 4.0278 8.5245 123.3369 58.9141 32.7445 177.4452 57 K 4.2818 7.6657 117.5819 56.6093 33.3667 176.9615 58 M 4.3232 8.7340 120.4709 58.0955 32.0388 177.4207 59 G 4.1220 7.8894 105.8329 45.6241 0.0000 174.7737 60 E 4.2176 8.2832 119.9407 57.7484 30.3004 176.6388 61 K 4.6302 7.5426 118.2688 54.6547 35.9018 174.2102 62 A 5.1391 8.3879 126.6588 50.3884 22.0935 175.1243 63 Y 5.6351 8.7163 115.8261 55.3058 42.4886 175.6664 64 K 4.9988 8.8455 121.7139 54.4333 34.1770 177.4960 65 L 2.5279 8.3457 122.2557 57.9631 41.5750 178.6979 66 E 3.9620 7.9468 116.8038 58.5160 29.2443 178.0859 67 E 4.2171 8.0094 118.6563 58.3015 29.8480 178.7136 68 I 3.3754 7.3762 119.5116 64.5862 37.1987 177.5196 69 L 4.1102 7.4260 118.7718 57.9356 41.3747 177.5668 70 P 4.0066 0.0000 0.0000 66.4348 30.9010 178.3371 71 I 3.7209 7.1701 118.8037 64.1603 36.8426 177.3012 72 Y 4.2269 8.5093 120.4139 61.2808 38.8267 177.5799 73 E 3.4783 8.8981 120.4569 59.6212 29.3784 178.1329 74 E 3.8027 9.1206 118.4326 60.2405 29.4911 179.4627 75 M 3.7492 8.2776 118.2961 58.9188 32.5353 178.2532 76 S 4.2853 7.8583 113.4798 59.9725 63.2142 176.1155 77 S 4.1749 9.7527 117.8135 60.3039 62.9129 174.9730 78 K 4.1416 7.4036 121.0714 56.6604 32.4800 175.8234 79 D 4.7884 8.3710 121.0707 54.0675 43.3043 175.9789 80 T 4.2942 7.6826 115.6051 61.2536 66.5414 175.1691 81 G 3.6008 7.5692 111.1515 47.2013 0.0000 174.0340 82 T 4.0735 8.3798 114.3718 65.1107 68.0543 171.5795 83 A 4.7007 8.3197 126.5710 50.1593 22.6604 177.1812 84 A 4.2917 8.6591 122.8539 56.2685 18.3483 179.2591 85 D 4.2862 8.3643 115.6776 58.3435 40.9047 178.6847 86 E 3.8563 8.0103 117.7151 59.9716 29.5437 179.7435 87 F 4.3586 7.7682 116.9396 61.0849 38.8513 176.5623 88 M 4.3728 8.4509 118.8102 57.2447 31.8932 177.7172 89 E 3.8870 8.4555 117.4474 59.6413 29.7988 179.4773 90 A 3.9014 7.5656 118.7174 55.3793 18.6460 179.3489 91 F 4.4593 8.2502 115.9023 60.8609 38.9566 177.8662 92 K 3.5431 8.6218 118.5085 60.1170 31.6419 178.6252 93 T 3.5785 7.4013 111.8363 64.4666 67.0925 174.1801 94 F 4.7069 8.6076 117.5791 57.2864 39.8599 176.3920 95 D 4.7928 8.5304 121.6041 53.4521 38.9694 175.2569 96 R 4.1170 8.5846 123.7252 58.4368 30.2762 177.6040 97 E 4.6007 8.2956 114.1003 55.0782 30.3939 175.9977 98 G 4.2165 8.2315 106.2564 46.9805 0.0000 175.0147 99 Q 4.2970 7.6309 116.0208 55.8059 30.3916 177.1971 100 G 4.2538 8.3370 105.5275 44.4252 0.0000 172.3558 101 L 5.0354 7.6852 118.9973 52.7299 43.8124 175.9330 102 I 4.7250 8.1930 123.2406 59.0177 41.2753 174.9101 103 S 4.3358 8.7936 121.2718 58.6145 62.8323 174.7588 104 S 3.9913 9.1308 122.5717 61.7088 62.2450 176.2769 105 A 3.8993 7.5440 122.8460 55.2430 17.9642 179.4242 106 E 3.8041 8.2047 116.5626 59.5980 29.5453 179.2085 107 I 3.8910 7.7572 119.1504 64.8145 37.1254 178.0341 108 R 3.9835 7.9474 118.1792 59.5230 29.9756 178.2234 109 N 4.2286 8.1035 116.6789 57.7714 38.8605 175.9488 110 V 3.4701 8.5937 119.7957 66.0121 31.4877 177.3532 111 L 4.1474 8.6877 119.3756 58.1198 41.4150 179.0443 112 K 4.4482 8.8832 118.6378 58.9385 32.3080 178.8626 113 M 4.2135 8.7105 120.6184 57.5028 32.3078 176.2468 114 L 4.6169 8.2611 118.6211 53.3906 44.9002 176.4789 115 G 3.5714 8.4279 106.0249 47.1013 0.0000 174.0860 116 E 4.0913 8.7968 121.5347 56.4896 28.2643 176.1117 117 R 4.3153 7.7493 122.7186 54.3464 31.8613 175.5802 118 I 4.7762 7.7405 119.3378 59.7346 41.1835 175.8310 119 T 4.1641 9.8083 121.9543 63.2890 69.6473 175.6700 120 E 3.8915 8.9740 124.2873 60.0532 29.6619 178.1014 121 D 4.2795 8.2940 117.1379 57.5313 41.2437 177.9100 122 Q 3.9882 8.1087 117.4961 59.5093 28.8612 179.7571 123 C 4.1830 8.2228 117.3367 63.0324 28.3050 175.3386 124 N 4.2603 7.9519 117.4041 56.8214 38.1765 176.6182 125 D 3.7421 7.9840 119.5369 57.6530 41.0435 178.9610 126 I 3.7575 7.6478 118.0850 64.5482 37.8931 177.9365 127 F 4.0064 8.1845 118.2818 60.8400 38.5659 177.8746 128 T 3.9180 8.3296 115.8020 66.5108 67.9506 176.9100 129 F 4.6663 8.2909 119.2496 60.4777 38.9754 176.5365 130 C 4.4847 7.9848 113.6601 58.0775 29.5333 173.8188 131 D 4.2249 7.2741 117.9996 55.4356 39.1898 173.4754 132 I 4.3615 7.8934 118.5890 59.6326 38.7798 176.4886 133 R 4.4547 8.3602 124.7515 54.7308 31.6096 175.6785 134 E 4.7995 8.2019 115.7955 53.5549 32.0042 175.3983 135 D 4.5978 9.2271 122.4539 53.5942 42.0738 177.7447 136 I 2.8957 7.4568 117.5250 61.8105 38.2272 175.1742 137 D 4.7910 7.7568 123.9777 54.2082 42.4969 176.3436 138 G 4.2919 7.8434 103.7075 43.5637 0.0000 171.7476 139 N 4.7042 7.3133 118.2408 53.5715 41.8482 177.6151 140 I 4.3532 8.5515 129.0792 60.3937 39.5979 174.4760 141 K 4.2458 8.6011 126.7850 56.0371 31.9163 177.1798 142 Y 3.8620 7.8499 125.9584 59.8272 37.6805 177.9594 143 E 4.0372 7.7731 120.5680 60.0350 29.7152 177.2576 144 D 4.1768 8.0654 115.7378 57.3630 40.8989 178.1978 145 L 3.7054 7.5964 119.2124 59.0151 42.5347 178.5582 146 M 3.8665 8.7553 117.9318 58.8836 31.7781 177.8131 147 K 3.8056 8.7112 119.5077 59.7934 32.7995 178.7339 148 K 3.9674 8.1392 118.0360 59.8779 32.0960 178.9493 149 V 3.4836 7.8087 117.9466 66.6176 31.2318 177.7708 150 M 4.2310 7.9997 115.9197 57.0937 31.8434 177.8030 151 A 4.1911 8.1129 121.2483 51.8877 19.6018 178.1811 152 G 3.9301 7.6237 105.0937 45.2005 0.0000 172.9772 153 P 4.0558 0.0000 0.0000 64.3508 31.4690 176.6845 154 F 4.9239 6.8691 116.1199 53.9081 39.4373 172.9309 155 P 3.6951 0.0000 0.0000 66.7529 31.4002 176.2404 156 D 4.5514 8.8626 125.2012 55.2303 40.6805 176.4217 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 S 8.33 4.32 0.00 3.83 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 2 Q 7.90 5.57 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.84 0.00 0.00 0.00 0.00 0.00 2.13 2.45 0.00 3 L 7.65 4.48 0.00 1.67 1.81 1.08 0.79 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 4 T 7.83 4.65 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 1.28 0.00 0.00 5 K 8.49 3.85 0.00 1.82 1.92 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.56 7.81 6 D 8.12 4.38 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 7 E 8.39 3.97 0.00 2.36 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 2.39 2.45 0.00 8 I 7.83 3.69 2.02 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 1.38 1.29 0.90 0.00 0.00 9 E 8.26 3.82 0.00 2.21 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 2.33 2.40 0.00 10 E 8.42 3.82 0.00 2.27 1.85 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 2.29 2.31 0.00 11 V 7.40 3.34 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 0.65 0.00 0.00 0.79 0.00 0.00 12 R 9.24 3.72 0.00 2.01 2.02 0.00 3.33 0.00 0.00 3.15 8.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 13 E 8.94 3.86 0.00 2.05 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 2.34 2.39 0.00 14 V 7.81 3.68 2.33 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 1.19 0.00 0.00 0.98 0.00 0.00 15 F 8.59 4.33 0.00 3.18 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 16 D 8.35 4.69 0.00 2.96 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 17 L 7.72 3.94 0.00 1.76 1.90 1.03 1.16 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 18 F 8.28 4.09 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 19 D 8.33 4.67 0.00 2.77 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 0.00 0.00 0.00 20 F 8.92 3.73 0.00 3.11 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 21 W 8.42 4.25 0.00 3.42 3.39 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 22 D 7.89 4.87 0.00 2.78 2.78 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 23 G 8.94 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 6.41 3.90 0.00 1.64 1.69 0.00 3.20 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 25 D 8.11 4.61 0.00 2.74 2.78 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 26 G 8.98 4.07 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 0.00 0.00 0.00 27 D 8.21 5.42 0.00 2.69 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 28 V 8.65 4.47 2.41 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 1.15 0.00 0.00 0.57 0.00 0.00 29 D 8.75 4.67 0.00 2.81 2.57 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 30 A 9.04 4.02 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 31 A 7.84 4.31 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 32 K 7.89 4.62 0.00 1.98 1.91 0.00 1.93 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.44 1.65 7.81 33 V 9.07 3.81 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 1.03 0.00 0.00 1.31 0.00 0.00 34 G 8.25 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.02 4.48 0.00 2.96 3.04 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 36 L 7.79 2.79 0.00 0.97 1.61 0.63 1.03 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 37 L 8.21 4.08 0.00 2.02 1.77 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 38 R 8.02 4.80 0.00 2.05 2.02 0.00 3.18 0.00 0.00 3.29 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 39 C 8.27 3.96 0.00 3.29 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 40 L 7.81 4.32 0.00 1.84 1.56 0.62 1.00 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 41 G 8.81 4.09 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 0.00 0.00 0.00 42 M 7.92 4.51 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.66 0.00 43 N 8.14 5.45 0.00 2.70 2.75 0.00 0.00 6.96 8.02 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 44 P 0.00 4.52 0.00 2.16 2.03 0.00 3.77 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 1.99 1.95 0.00 45 T 7.99 4.49 4.53 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 1.22 0.00 0.00 46 E 9.53 4.07 0.00 2.28 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 2.35 2.45 0.00 47 A 8.27 4.06 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 48 Q 8.19 3.96 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 49 V 7.93 3.73 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 0.95 0.00 0.00 0.91 0.00 0.00 50 H 7.95 4.47 0.00 3.27 3.35 0.00 5.95 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 8.23 4.31 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 7.38 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 52 H 8.46 4.82 0.00 3.24 3.24 0.00 5.82 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 53 G 8.02 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 0.00 0.00 0.00 0.00 54 G 8.25 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.19 4.78 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 1.27 0.00 0.00 56 K 8.52 4.03 0.00 1.79 1.88 0.00 1.71 0.00 0.00 1.82 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.51 7.81 57 K 7.67 4.28 0.00 1.91 1.81 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.49 7.81 58 M 8.73 4.32 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 59 G 7.89 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 0.00 0.00 0.00 60 E 8.28 4.22 0.00 1.95 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 2.27 2.28 0.00 61 K 7.54 4.63 0.00 1.67 1.39 0.00 1.45 0.00 0.00 1.80 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.81 1.27 7.81 62 A 8.39 5.14 1.17 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 0.00 0.00 63 Y 8.72 5.64 0.00 3.03 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 64 K 8.85 5.00 0.00 1.74 1.82 0.00 1.99 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.58 1.55 7.81 65 L 8.35 2.53 0.00 0.83 1.45 0.54 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.95 3.96 0.00 1.93 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 2.30 2.42 0.00 67 E 8.01 4.22 0.00 2.17 1.84 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 2.30 2.38 0.00 68 I 7.38 3.38 1.59 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.89 0.84 0.00 0.00 69 L 7.43 4.11 0.00 1.63 1.71 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.01 0.00 2.20 2.29 0.00 3.67 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 2.18 2.02 0.00 71 I 7.17 3.72 1.89 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.63 0.88 0.00 0.00 72 Y 8.51 4.23 0.00 2.74 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 73 E 8.90 3.48 0.00 2.01 2.02 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 2.21 2.22 0.00 74 E 9.12 3.80 0.00 2.09 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 2.51 2.45 0.00 75 M 8.28 3.75 0.00 2.10 2.16 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 2.57 2.66 0.00 76 S 7.86 4.29 0.00 3.74 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 9.75 4.17 0.00 3.86 3.89 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 78 K 7.40 4.14 0.00 1.67 1.68 0.00 1.59 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.59 7.81 79 D 8.37 4.79 0.00 2.63 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 80 T 7.68 4.29 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 1.18 0.00 0.00 81 G 7.57 3.60 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 0.00 82 T 8.38 4.07 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 -0.03 0.00 0.00 83 A 8.32 4.70 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 84 A 8.66 4.29 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 85 D 8.36 4.29 0.00 2.69 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 86 E 8.01 3.86 0.00 1.55 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 2.37 0.00 87 F 7.77 4.36 0.00 3.42 3.12 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 88 M 8.45 4.37 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.77 0.00 89 E 8.46 3.89 0.00 2.00 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 2.54 2.50 0.00 90 A 7.57 3.90 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 91 F 8.25 4.46 0.00 3.06 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 0.00 0.00 0.00 92 K 8.62 3.54 0.00 1.89 1.92 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.50 1.66 7.81 93 T 7.40 3.58 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 94 F 8.61 4.71 0.00 3.18 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 95 D 8.53 4.79 0.00 2.76 2.78 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 96 R 8.58 4.12 0.00 1.90 2.05 0.00 3.25 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 97 E 8.30 4.60 0.00 2.02 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 98 G 8.23 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 0.00 0.00 0.00 99 Q 7.63 4.30 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.21 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 100 G 8.34 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 0.00 0.00 0.00 101 L 7.69 5.04 0.00 1.52 1.56 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.19 4.73 1.95 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 1.35 1.31 0.95 0.00 0.00 103 S 8.79 4.34 0.00 3.90 3.76 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 0.00 104 S 9.13 3.99 0.00 3.76 3.95 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 0.00 105 A 7.54 3.90 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 0.00 106 E 8.20 3.80 0.00 2.14 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 0.00 2.33 2.35 0.00 107 I 7.76 3.89 2.00 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 1.65 0.69 1.12 0.00 0.00 108 R 7.95 3.98 0.00 2.00 2.01 0.00 3.04 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.80 0.00 109 N 8.10 4.23 0.00 2.90 2.79 0.00 0.00 6.92 7.35 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 0.00 110 V 8.59 3.47 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 0.94 0.00 0.00 0.28 0.00 0.00 111 L 8.69 4.15 0.00 1.87 1.78 1.00 0.87 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 0.00 112 K 8.88 4.45 0.00 1.81 1.78 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.59 7.81 113 M 8.71 4.21 0.00 1.96 2.32 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.73 0.00 114 L 8.26 4.62 0.00 1.72 1.66 1.05 0.99 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 0.00 115 G 8.43 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 0.00 116 E 8.80 4.09 0.00 1.99 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 2.33 2.35 0.00 117 R 7.75 4.32 0.00 1.71 2.08 0.00 3.59 0.00 0.00 3.90 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.52 0.00 118 I 7.74 4.78 2.23 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 1.25 0.62 0.93 0.00 0.00 119 T 9.81 4.16 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 120 E 8.97 3.89 0.00 2.07 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 2.37 2.43 0.00 121 D 8.29 4.28 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.11 3.99 0.00 2.37 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.70 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 123 C 8.22 4.18 0.00 3.17 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 0.00 124 N 7.95 4.26 0.00 2.81 2.82 0.00 0.00 7.09 7.58 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 0.00 125 D 7.98 3.74 0.00 2.63 2.51 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 0.00 126 I 7.65 3.76 1.86 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 1.39 1.03 0.83 0.00 0.00 127 F 8.18 4.01 0.00 3.47 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 T 8.33 3.92 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 1.12 0.00 0.00 129 F 8.29 4.67 0.00 3.17 2.89 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 0.00 130 C 7.98 4.48 0.00 2.89 2.89 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 0.00 131 D 7.27 4.22 0.00 2.67 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 0.00 132 I 7.89 4.36 2.17 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 1.31 0.92 1.09 0.00 0.00 133 R 8.36 4.45 0.00 1.78 1.85 0.00 3.30 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 134 E 8.20 4.80 0.00 1.95 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 2.07 2.14 0.00 135 D 9.23 4.60 0.00 2.68 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 0.00 136 I 7.46 2.90 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.60 0.90 0.00 0.00 137 D 7.76 4.79 0.00 2.56 2.54 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 0.00 138 G 7.84 4.29 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 0.00 139 N 7.31 4.70 0.00 2.66 2.40 0.00 0.00 6.87 7.32 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 0.00 140 I 8.55 4.35 1.90 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.34 1.04 0.00 0.00 141 K 8.60 4.25 0.00 1.61 1.61 0.00 1.79 0.00 0.00 1.81 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.36 7.81 142 Y 7.85 3.86 0.00 2.18 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 0.00 143 E 7.77 4.04 0.00 2.00 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 0.00 2.44 2.50 0.00 144 D 8.07 4.18 0.00 2.86 2.52 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 0.00 145 L 7.60 3.71 0.00 1.68 1.74 0.43 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 146 M 8.76 3.87 0.00 2.37 2.19 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 2.62 2.66 0.00 147 K 8.71 3.81 0.00 1.82 1.88 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.69 7.81 148 K 8.14 3.97 0.00 1.74 1.84 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.46 7.81 149 V 7.81 3.48 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 0.89 0.00 0.00 0.81 0.00 0.00 150 M 8.00 4.23 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 151 A 8.11 4.19 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 0.00 152 G 7.62 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 0.00 153 P 0.00 4.06 0.00 0.94 1.65 0.00 3.58 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.67 0.00 154 F 6.87 4.92 0.00 3.11 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 0.00 155 P 0.00 3.70 0.00 2.06 1.92 0.00 3.73 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 2.03 2.12 0.00 156 D 8.86 4.55 0.00 2.69 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00