NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9236 8.3544 109.7354 45.1023 0.0000 175.1239 2 S 3.9823 9.0630 117.5720 60.4131 62.3112 172.4823 3 M 4.3705 8.5558 119.0501 54.8582 34.2895 173.9617 4 T 3.1355 8.2609 121.2839 63.9160 65.2132 170.8188 5 E 4.3553 8.4072 124.7558 54.8364 29.8458 175.7753 6 E 4.4740 8.2962 124.9755 56.3197 32.2269 177.3374 7 T 4.2848 8.6394 115.6517 65.1009 65.8329 171.1196 8 H 4.7117 7.6834 114.9846 56.8244 31.1849 173.3864 9 P 4.4044 0.0000 0.0000 65.9056 31.7161 177.4579 10 D 4.2953 8.0537 115.4141 53.4216 40.9919 174.4505 11 D 4.6362 7.6922 118.1530 51.6051 39.3718 173.2828 12 D 4.6482 7.3582 118.4564 55.6876 41.5671 174.8348 13 S 4.6010 7.6629 110.9447 58.7523 63.3155 173.4929 14 Y 4.0549 7.7359 118.7999 58.3312 37.3255 175.7218 15 I 4.2480 8.2115 119.7286 62.0725 39.1533 176.5326 16 V 4.5924 7.7601 121.6871 60.9231 35.1387 174.1397 17 R 5.1404 8.7504 126.5209 54.9025 32.7454 174.2023 18 V 4.8242 9.3096 119.1716 59.2478 36.3593 174.2906 19 K 4.8582 8.2916 119.3717 55.6513 34.9312 175.4520 20 A 4.4377 8.4729 124.3999 51.4942 23.8401 174.3790 21 V 4.2419 7.9405 119.0084 61.3449 31.6622 175.5229 22 V 3.8700 8.1775 122.4634 62.2030 32.2787 175.6341 23 M 4.8757 8.4536 125.8714 54.2818 35.2861 174.9704 24 T 4.9303 8.2388 112.0869 61.3834 71.5106 172.4214 25 R 4.9992 8.2899 127.2314 53.4529 31.9687 174.3124 26 D 4.7506 9.0725 127.1919 54.6352 38.6644 174.0658 27 D 4.6107 8.0170 121.6545 54.0648 41.2001 174.2716 28 S 4.3968 7.6545 111.2676 59.0233 65.8418 175.3147 29 S 4.0420 8.0497 117.7881 59.0362 59.7357 173.1698 30 G 4.1649 8.0857 117.7681 43.7410 0.0000 173.5858 31 G 3.8453 6.8524 109.2314 45.1972 0.0000 173.8494 32 W 4.9219 8.3408 124.6396 56.1979 28.5793 175.0654 33 F 5.1122 9.4490 121.0659 54.0206 40.2328 173.6856 34 P 4.5584 0.0000 0.0000 62.9631 30.7192 175.9372 35 Q 3.9588 7.7026 123.6105 58.6948 28.4410 176.3307 36 E 4.4393 7.8167 115.8386 55.5668 31.8930 172.2592 37 G 3.7324 8.3029 113.2784 41.9911 0.0000 173.7370 38 G 3.9604 7.4546 111.7970 45.7526 0.0000 175.0117 39 G 3.7959 7.5591 112.1346 44.7237 0.0000 169.2178 40 I 3.3842 7.8239 130.0386 61.0353 37.9591 172.9521 41 S 4.9138 8.6354 118.7430 56.9197 67.0100 173.7872 42 R 4.1785 8.9989 126.1324 55.3602 28.9920 175.0242 43 V 4.6787 8.2758 124.2049 61.4401 34.6113 174.2807 44 G 4.6352 8.9372 111.1653 45.9641 0.0000 171.6972 45 V 4.7884 9.0118 119.6772 60.9368 34.8474 174.1148 46 C 5.0248 8.1899 122.3817 55.2300 32.1350 173.1781 47 K 3.8771 8.6703 125.3676 55.9567 31.7404 176.3259 48 V 4.2447 7.7532 123.0280 61.6778 34.6109 174.8117 49 M 4.6385 8.0514 116.9530 55.4537 33.3113 173.4480 50 H 4.6084 8.4882 115.0651 54.2877 29.4849 174.6910 51 P 4.3238 0.0000 0.0000 64.7491 31.4860 177.2222 52 E 3.8982 8.1222 117.5316 57.6568 29.4846 174.9320 53 G 3.6373 7.8039 109.3175 45.7785 0.0000 172.4283 54 N 4.9314 7.8537 118.8712 53.1086 40.8400 175.0480 55 G 4.2977 8.6857 111.8816 45.6645 0.0000 175.1129 56 R 3.8408 7.8173 118.7118 56.7628 30.2685 175.3347 57 S 4.7628 8.4899 119.8643 56.8028 66.7466 172.9283 58 G 4.2103 8.5611 108.4805 44.4780 0.0000 171.5787 59 F 5.1939 8.2579 116.5529 55.5319 43.7038 174.4188 60 L 4.9572 8.5950 122.8270 53.4661 45.1402 175.8038 61 I 4.3295 8.7821 128.9772 61.1214 37.2939 174.2595 62 H 5.4546 8.7911 127.4980 54.3143 33.3284 172.8572 63 G 4.4618 8.8187 111.0855 45.4562 0.0000 172.5255 64 E 5.1343 9.0144 125.4380 55.1947 31.7522 176.0912 65 R 4.4177 8.1614 118.2844 55.3156 30.8218 177.2031 66 Q 4.2785 8.1259 122.4189 52.9014 26.2464 176.0302 67 K 4.2266 7.5425 119.2495 55.4766 33.9104 174.2408 68 D 4.5070 8.2340 119.4539 53.0764 39.7467 174.8760 69 K 4.1955 8.3204 118.3589 57.0487 31.3073 176.2322 70 L 4.5196 8.1258 125.9149 52.6233 45.1165 175.1262 71 V 3.7710 8.6185 127.1436 63.8971 31.3723 175.7179 72 V 4.3271 8.5773 121.2505 61.2346 33.2856 176.1570 73 L 4.6009 7.5683 122.9298 53.3742 45.5754 174.3840 74 E 4.9283 8.6912 126.8963 55.5025 32.4817 174.5714 75 C 5.0018 9.5595 125.4944 58.0973 30.1183 171.7143 76 Y 4.6361 9.3692 123.9016 57.3943 39.3425 174.8136 77 V 4.4120 8.1291 118.7756 59.6708 35.6918 176.3425 78 R 4.0511 8.4164 118.6988 57.5744 31.0143 177.3937 79 K 4.3994 7.8791 115.8857 55.9489 33.9429 174.0821 80 D 4.6833 7.9748 116.3520 51.3830 41.8717 174.6882 81 L 4.0971 8.1907 122.0584 53.7346 45.2967 174.6010 82 V 4.3346 8.1092 123.7917 61.3845 33.3612 174.1008 83 Y 4.8476 8.6590 124.8445 57.8128 40.1016 175.7811 84 T 4.3639 9.2724 117.2994 62.9761 73.2585 173.3822 85 K 4.5567 8.6796 129.1123 55.0172 32.0420 176.0538 86 A 4.2586 8.7494 130.5550 54.5983 18.9675 177.0478 87 N 5.1883 8.1014 110.9691 50.6672 42.5982 173.8161 88 P 4.5825 0.0000 0.0000 65.4568 31.6310 177.2403 89 T 4.7565 8.0366 110.5257 61.5302 67.9397 172.8727 90 F 4.6043 8.8448 123.8047 57.3490 42.5611 172.2164 91 H 5.4647 7.9365 126.7428 54.6623 32.4766 172.5627 92 H 5.3880 9.3503 120.1082 53.7925 32.7409 171.9401 93 W 5.6551 8.8362 115.2774 54.9530 31.7479 173.4410 94 K 4.6796 8.4582 123.5772 54.3951 33.4418 176.5024 95 V 4.2714 7.4957 121.4250 61.2592 32.3186 176.4090 96 D 4.6809 8.3852 123.9739 55.1005 40.3293 174.1875 97 N 4.3336 7.8456 122.2244 53.6330 37.3257 175.2373 98 R 3.6710 8.3474 126.7527 55.0662 29.8217 175.0500 99 K 4.3717 7.6605 118.2956 54.9665 34.5752 175.7527 100 F 5.1265 7.9658 127.3280 56.7189 41.4883 174.6858 101 G 3.2805 7.8060 105.3826 46.3478 0.0000 172.1170 102 L 4.5796 6.8717 118.1696 54.4574 44.3686 174.9986 103 T 4.1110 7.8816 117.9607 61.6646 69.9041 174.5158 104 F 4.9321 8.3425 126.7007 57.7857 39.2638 175.6071 105 Q 4.6214 9.0718 118.4207 56.3011 30.2514 176.2625 106 S 4.6916 8.0787 114.1929 55.4917 68.5918 173.3001 107 P 4.2186 0.0000 0.0000 65.5562 30.8038 178.5238 108 A 3.9274 7.8784 121.1254 55.2734 18.4161 179.1067 109 D 4.2713 8.0033 116.5297 56.3559 39.4920 178.0257 110 A 2.0000 7.7661 122.2246 54.6010 18.2343 179.5449 111 R 3.6804 8.0632 116.2221 59.2371 30.1624 178.7708 112 A 3.9317 8.1264 120.8360 55.0107 18.4005 179.4500 113 F 4.0602 8.5227 119.5293 61.6180 39.4763 177.0154 114 D 4.3070 8.2700 118.6564 57.2650 40.5564 178.8882 115 R 3.8456 8.1199 119.2796 59.3806 30.0833 178.8111 116 G 3.4008 7.9521 105.5197 47.6222 0.0000 175.7253 117 V 2.7880 7.4936 121.0302 65.2811 31.3493 178.0195 118 R 3.6870 7.8156 118.5630 59.4419 29.8781 178.6509 119 K 3.8585 7.9701 117.9724 59.1661 31.9089 179.0742 120 A 3.2709 7.9160 121.3585 55.1095 18.1424 179.6617 121 I 3.4799 7.6474 118.3265 64.3957 37.0701 177.9507 122 E 3.8621 8.1195 120.0180 59.8883 29.2358 178.8384 123 D 4.3997 8.1578 117.6077 56.7663 40.9998 178.3066 124 L 4.2590 8.0302 120.9719 57.7860 42.1577 178.0798 125 I 4.0863 7.7978 117.4757 63.0024 38.3892 174.9401 126 E 4.2711 8.4411 124.4512 56.6887 29.8817 174.3086 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 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 S 9.06 3.98 0.00 3.91 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 3 M 8.56 4.37 0.00 2.01 1.95 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 2.52 2.59 0.00 4 T 8.26 3.14 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 1.21 0.00 0.00 5 E 8.41 4.36 0.00 1.94 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 2.40 2.26 0.00 6 E 8.30 4.47 0.00 2.13 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 2.31 2.27 0.00 7 T 8.64 4.28 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 1.09 0.00 0.00 8 H 7.68 4.71 0.00 3.18 3.26 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.40 0.00 2.24 2.33 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 10 D 8.05 4.30 0.00 2.66 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 11 D 7.69 4.64 0.00 2.91 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 12 D 7.36 4.65 0.00 3.04 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 13 S 7.66 4.60 0.00 3.88 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.74 4.05 0.00 2.96 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 15 I 8.21 4.25 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.60 0.98 0.00 0.00 16 V 7.76 4.59 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 1.18 0.00 0.00 0.93 0.00 0.00 17 R 8.75 5.14 0.00 1.85 1.79 0.00 3.25 0.00 0.00 3.42 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.71 0.00 18 V 9.31 4.82 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 0.90 0.00 0.00 1.12 0.00 0.00 19 K 8.29 4.86 0.00 1.82 1.76 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.53 7.81 20 A 8.47 4.44 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.94 4.24 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 0.90 0.00 0.00 0.93 0.00 0.00 22 V 8.18 3.87 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 0.78 0.00 0.00 0.88 0.00 0.00 23 M 8.45 4.88 0.00 2.24 1.85 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 2.66 2.67 0.00 24 T 8.24 4.93 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 0.35 0.00 0.00 25 R 8.29 5.00 0.00 0.67 0.72 0.00 2.36 0.00 0.00 2.46 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.08 0.00 26 D 9.07 4.75 0.00 3.14 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 27 D 8.02 4.61 0.00 2.81 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 28 S 7.65 4.40 0.00 3.76 3.69 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 29 S 8.05 4.04 0.00 3.69 3.67 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 30 G 8.09 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 31 G 6.85 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 32 W 8.34 4.92 0.00 3.17 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 F 9.45 5.11 0.00 3.08 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.56 0.00 2.11 2.17 0.00 3.98 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 35 Q 7.70 3.96 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.43 0.00 0.00 0.00 0.00 0.00 2.31 2.17 0.00 36 E 7.82 4.44 0.00 1.87 1.80 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 2.20 2.24 0.00 37 G 8.30 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 38 G 7.45 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 7.56 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 40 I 7.82 3.38 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 1.41 0.76 0.99 0.00 0.00 41 S 8.64 4.91 0.00 3.83 3.79 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 42 R 9.00 4.18 0.00 2.04 1.91 0.00 3.03 0.00 0.00 3.14 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 43 V 8.28 4.68 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 0.88 0.00 0.00 0.98 0.00 0.00 44 G 8.94 4.64 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 45 V 9.01 4.79 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 0.97 0.00 0.00 0.89 0.00 0.00 46 C 8.19 5.02 0.00 2.79 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 0.00 0.00 0.00 47 K 8.67 3.88 0.00 1.73 1.67 0.00 1.54 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.96 0.44 7.81 48 V 7.75 4.24 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 0.64 0.00 0.00 1.08 0.00 0.00 49 M 8.05 4.64 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 50 H 8.49 4.61 0.00 3.37 3.47 0.00 5.49 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.32 0.00 2.05 2.15 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 52 E 8.12 3.90 0.00 1.86 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 0.00 2.37 2.34 0.00 53 G 7.80 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 54 N 7.85 4.93 0.00 2.74 2.79 0.00 0.00 7.34 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 8.69 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 0.00 0.00 0.00 0.00 56 R 7.82 3.84 0.00 1.78 1.93 0.00 3.12 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 57 S 8.49 4.76 0.00 3.49 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 58 G 8.56 4.21 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 0.00 59 F 8.26 5.19 0.00 2.78 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 60 L 8.59 4.96 0.00 1.80 1.47 0.98 1.18 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 61 I 8.78 4.33 1.85 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.38 0.74 0.00 0.00 62 H 8.79 5.45 0.00 3.10 3.13 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 8.82 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 64 E 9.01 5.13 0.00 1.99 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 2.30 2.34 0.00 65 R 8.16 4.42 0.00 1.84 1.92 0.00 3.19 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 66 Q 8.13 4.28 0.00 2.07 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.49 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 67 K 7.54 4.23 0.00 1.66 1.67 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.23 1.41 7.81 68 D 8.23 4.51 0.00 2.86 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 69 K 8.32 4.20 0.00 1.63 1.82 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.52 7.81 70 L 8.13 4.52 0.00 1.71 1.49 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.62 3.77 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 0.80 0.00 0.00 1.04 0.00 0.00 72 V 8.58 4.33 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 0.76 0.00 0.00 0.94 0.00 0.00 73 L 7.57 4.60 0.00 1.63 1.48 1.20 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.69 4.93 0.00 2.03 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 0.00 2.39 2.43 0.00 75 C 9.56 5.00 0.00 3.01 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 76 Y 9.37 4.64 0.00 3.07 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 77 V 8.13 4.41 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 0.74 0.00 0.00 0.92 0.00 0.00 78 R 8.42 4.05 0.00 1.86 2.01 0.00 3.31 0.00 0.00 3.08 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 79 K 7.88 4.40 0.00 1.68 1.73 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.32 7.81 80 D 7.97 4.68 0.00 2.75 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 81 L 8.19 4.10 0.00 1.58 1.58 0.89 0.31 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 82 V 8.11 4.33 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 1.03 0.00 0.00 0.94 0.00 0.00 83 Y 8.66 4.85 0.00 2.95 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 84 T 9.27 4.36 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 1.26 0.00 0.00 85 K 8.68 4.56 0.00 1.47 1.72 0.00 2.01 0.00 0.00 2.12 0.00 0.00 2.84 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.81 7.81 86 A 8.75 4.26 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 87 N 8.10 5.19 0.00 2.80 2.71 0.00 0.00 6.97 7.45 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 88 P 0.00 4.58 0.00 2.10 2.18 0.00 3.70 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 2.07 2.13 0.00 89 T 8.04 4.76 4.35 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 1.31 0.00 0.00 90 F 8.84 4.60 0.00 2.89 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 91 H 7.94 5.46 0.00 3.53 3.20 0.00 5.68 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 H 9.35 5.39 0.00 3.47 3.16 0.00 5.49 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 W 8.84 5.66 0.00 3.08 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.46 4.68 0.00 1.77 1.74 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.67 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.46 7.81 95 V 7.50 4.27 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 0.82 0.00 0.00 0.75 0.00 0.00 96 D 8.39 4.68 0.00 2.78 2.81 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 97 N 7.85 4.33 0.00 2.77 2.83 0.00 0.00 7.03 7.74 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 98 R 8.35 3.67 0.00 2.28 2.00 0.00 3.20 0.00 0.00 3.38 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.72 0.00 99 K 7.66 4.37 0.00 1.61 1.46 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.69 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.58 7.81 100 F 7.97 5.13 0.00 1.98 2.48 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 0.00 101 G 7.81 3.28 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 0.00 102 L 6.87 4.58 0.00 1.31 1.43 -0.26 0.25 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 0.00 103 T 7.88 4.11 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 1.25 0.00 0.00 104 F 8.34 4.93 0.00 2.92 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 0.00 105 Q 9.07 4.62 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.62 0.00 0.00 0.00 0.00 0.00 2.44 2.31 0.00 106 S 8.08 4.69 0.00 4.03 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 0.00 107 P 0.00 4.22 0.00 2.22 2.28 0.00 3.69 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 2.05 2.02 0.00 108 A 7.88 3.93 1.31 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 0.00 0.00 109 D 8.00 4.27 0.00 2.96 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 0.00 110 A 7.77 2.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.06 3.68 0.00 1.87 1.86 0.00 3.21 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.74 0.00 112 A 8.13 3.93 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 0.00 113 F 8.52 4.06 0.00 3.33 3.31 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 0.00 114 D 8.27 4.31 0.00 2.80 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 0.00 115 R 8.12 3.85 0.00 1.97 2.04 0.00 3.09 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 116 G 7.95 3.40 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 0.00 117 V 7.49 2.79 1.59 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 0.04 0.00 0.00 -0.57 0.00 0.00 118 R 7.82 3.69 0.00 1.97 1.91 0.00 3.11 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 119 K 7.97 3.86 0.00 1.68 1.77 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.54 7.81 120 A 7.92 3.27 0.60 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 0.00 121 I 7.65 3.48 1.75 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 1.39 0.87 0.89 0.00 0.00 122 E 8.12 3.86 0.00 2.09 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 2.29 2.34 0.00 123 D 8.16 4.40 0.00 2.83 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.03 4.26 0.00 1.82 1.86 0.99 1.35 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 0.00 125 I 7.80 4.09 1.87 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 1.41 0.97 1.03 0.00 0.00 126 E 8.44 4.27 0.00 1.89 1.73 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 2.22 2.27 0.00