NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 I 4.0281 8.0093 120.7663 60.4057 38.4620 175.2222 4 D 3.9147 8.1635 128.1466 52.7654 39.8939 175.5996 5 Y 4.2115 8.4847 118.8030 59.8184 38.7552 177.3125 6 Y 4.5410 7.7999 116.4023 58.0046 39.5542 175.8618 7 D 4.7765 7.6126 122.9939 52.3763 40.0240 175.6269 8 Y 4.0786 8.1021 124.5158 61.3949 39.1628 176.5434 9 E 4.0691 8.6247 118.3200 59.6739 29.5369 179.0340 10 K 3.8475 8.0826 116.9902 59.9715 32.5349 179.2365 11 L 3.9343 7.7349 118.6777 57.7369 41.2094 179.5988 12 L 3.5038 7.6679 119.7308 58.0766 42.2794 178.4713 13 E 4.3185 8.2378 119.1348 58.9181 29.6677 178.5813 14 K 3.9537 8.6648 120.1426 59.0537 31.9883 178.1430 15 A 4.0829 7.7396 119.6528 53.5243 18.1702 177.7985 16 Y 4.5864 7.3220 113.4792 58.0598 38.9328 176.7718 17 Q 4.2604 7.6200 119.7337 58.3274 29.4902 176.4698 18 E 4.1049 8.0871 118.4673 58.6701 29.9447 177.4285 19 L 3.9561 7.2998 119.2761 54.5105 42.0623 175.1958 20 P 4.1868 0.0000 0.0000 61.8227 32.0439 175.6892 21 E 4.3165 8.4093 118.5355 57.9331 30.1717 179.3940 22 N 4.1341 7.5620 116.3385 55.5393 38.2079 176.8586 23 V 4.0599 7.5015 116.6783 62.7046 32.8533 177.0274 24 K 3.9854 8.0675 121.3315 58.8066 32.0985 176.1848 25 H 4.9156 7.4505 111.2619 54.0448 30.5709 173.9337 26 H 3.2869 7.3164 112.1565 58.4401 29.4693 174.8246 27 K 3.9025 7.6034 126.6569 56.5939 32.3050 177.1314 28 S 4.7779 8.1914 122.7086 55.5049 64.1129 173.8940 29 R 3.4591 8.1460 126.4926 55.5872 30.1053 175.9910 30 F 4.9035 7.7355 117.4987 56.7260 39.4266 176.0795 31 E 4.3640 8.3531 119.3052 57.0972 29.1548 176.9454 32 V 3.9120 7.3430 113.2010 59.9197 31.0850 174.1446 33 P 4.4914 0.0000 0.0000 61.6183 32.1390 176.6640 34 G 3.8717 8.6588 110.5728 45.2238 0.0000 172.7383 35 A 4.0152 8.4438 122.4881 52.0623 19.1025 177.1996 36 L 4.6172 8.4786 123.7568 53.4408 44.2173 174.7156 37 V 4.8180 8.3137 125.9545 61.2520 34.0267 174.7771 38 T 4.4893 8.9368 123.9723 61.9880 71.6526 173.2208 39 I 4.6973 8.4836 128.5475 59.8941 37.9037 174.6274 40 E 4.5610 9.0306 128.9905 55.2198 32.6555 176.1221 41 G 4.0383 8.7788 114.8190 47.0375 0.0000 173.9505 42 N 5.2451 9.0433 115.8654 51.7854 39.0751 173.7696 43 K 5.1262 8.5409 116.7436 55.5080 36.8497 175.2587 44 T 4.9577 8.7397 119.5463 62.2140 70.8399 173.5466 45 I 5.4183 9.2061 126.1524 58.1873 41.4091 174.0027 46 I 5.1304 8.6106 124.0335 58.5815 38.3657 174.7348 47 E 4.6773 8.5912 125.3527 56.5402 30.2018 176.8660 48 N 4.8918 8.1104 116.3527 53.8966 39.7605 175.2718 49 F 4.1681 8.3688 120.2461 62.2213 39.3707 176.7145 50 K 3.7509 8.0564 117.4083 60.4306 32.4471 178.1478 51 D 4.3616 7.8219 120.4037 57.3783 40.7111 178.7573 52 I 3.6467 7.9063 119.8020 64.1261 37.0790 177.9229 53 A 3.8272 7.5064 120.5076 55.5941 18.0796 179.3584 54 D 4.3264 8.4521 115.1378 56.6309 41.1308 177.7950 55 A 4.3244 7.5170 120.7148 53.6646 19.2955 178.0638 56 L 4.2531 8.0022 113.7599 54.4658 42.1317 176.0415 57 N 4.1590 7.8527 116.3041 54.8456 37.8262 173.5614 58 R 4.7209 7.6762 112.5414 53.5304 33.6006 175.3657 59 D 4.5670 8.4510 119.5626 54.3497 41.6258 176.1004 60 P 4.2298 0.0000 0.0000 65.7013 31.5664 178.6822 61 Q 4.2787 7.9608 114.9943 57.8931 28.5665 177.5116 62 H 4.2750 8.1857 119.4726 58.4265 29.9381 176.3409 63 L 3.7144 7.6903 121.5901 57.0233 42.4243 177.7038 64 L 3.9198 7.8802 120.4965 58.3430 41.8511 179.3453 65 K 3.8997 7.9110 117.7462 59.5956 32.1346 178.9107 66 F 4.1892 7.7817 120.4837 62.0816 38.9653 176.7011 67 L 3.7381 7.9921 118.8346 56.7556 41.2851 178.8786 68 L 3.3964 7.6835 120.5580 57.6906 41.9199 179.3228 69 R 4.0444 7.4034 118.5635 58.9674 30.2842 177.8132 70 E 3.9562 7.8364 118.9374 57.4454 29.6739 177.0049 71 I 4.3767 7.6302 118.8877 59.3334 40.6793 175.3574 72 A 4.7347 8.2002 122.8996 50.9745 18.3600 173.9952 73 T 4.9062 7.3189 110.7194 59.4836 73.3628 174.3677 74 A 4.7842 8.5291 121.3344 50.4297 22.1440 175.5527 75 G 4.8797 8.4792 107.0024 45.0791 0.0000 171.7615 76 T 4.8949 8.3056 114.5852 59.8218 70.9318 172.9272 77 L 4.9172 8.2974 127.1503 55.0746 42.5307 175.2987 78 E 4.4182 9.3697 117.3416 57.1445 33.5105 177.2702 79 G 3.7547 8.9219 113.0158 47.3893 0.0000 175.2075 80 R 4.0077 7.8514 115.4453 56.8011 28.1926 176.2042 81 R 5.1478 9.0090 115.2770 54.7707 33.9191 173.8368 82 V 4.6877 8.2422 117.4008 61.3766 35.3509 173.3947 83 V 4.5250 8.3614 127.6098 61.3784 33.3800 174.1615 84 L 5.1094 9.1174 128.6203 52.9862 43.7271 177.5064 85 Q 4.1600 8.9291 122.2292 57.6357 28.8844 176.8650 86 G 3.9559 8.0789 108.8489 45.3681 0.0000 171.6759 87 R 4.7090 7.8127 121.6286 54.1370 32.5711 175.3233 88 F 4.8218 8.6035 121.3213 55.7308 42.9322 174.7918 89 T 4.0155 8.5983 116.0874 60.7297 69.4710 173.4346 90 P 4.1121 0.0000 0.0000 66.2637 31.1821 178.2945 91 Y 4.4537 7.4715 114.7423 60.3313 37.8028 177.2278 92 L 3.9911 7.9134 120.8340 58.4380 42.5489 178.8657 93 I 3.7952 7.7910 118.6977 64.4248 37.1789 177.9640 94 A 4.1051 8.1527 121.7103 55.4658 17.7623 179.0912 95 N 4.5297 8.7536 115.5171 56.2938 39.0278 177.3490 96 K 4.2623 8.1775 120.1902 59.1055 32.2342 179.2431 97 L 4.2282 8.0179 118.9905 57.5720 41.4709 178.9517 98 K 3.9325 7.8397 118.2836 59.8498 32.0674 178.9494 99 K 4.0967 7.9219 117.2111 59.4070 31.9825 178.5927 100 Y 3.3485 8.2105 119.9121 60.7792 38.5133 178.1124 101 I 3.6407 8.0816 120.5664 64.5517 36.9800 178.3430 102 K 3.9987 7.6150 119.8228 58.3175 32.0804 177.3264 103 E 4.4124 7.6949 113.9961 55.9151 29.5983 176.0516 104 Y 4.6015 7.6295 112.9171 58.3514 41.7655 175.5000 105 V 4.3629 7.6677 117.2744 61.8515 33.4277 174.4259 106 I 4.7299 7.3246 118.2181 60.1503 40.6397 174.2557 107 C 4.3628 8.4863 124.3864 57.6700 31.6960 172.6122 108 P 4.3762 0.0000 0.0000 64.9893 31.4803 177.8719 109 V 3.8996 7.8242 112.0255 62.9843 32.1006 176.1602 110 C 4.5532 7.6310 116.6710 55.1936 29.8937 172.5531 111 G 4.3227 8.4443 114.1160 47.0807 0.0000 171.3331 112 S 4.4523 8.4016 120.3811 56.8613 66.6382 173.6555 113 P 4.6102 0.0000 0.0000 64.2099 31.1632 176.8650 114 D 4.5720 7.8894 117.1742 55.0219 40.7721 175.8586 115 T 4.3718 7.3320 114.4184 62.2427 68.1626 173.3479 116 K 4.6592 8.2357 125.7375 54.5245 36.3797 174.7558 117 I 4.2031 8.3757 126.3173 60.9985 38.2889 174.6169 118 I 4.6385 7.7892 125.9752 59.2122 41.3950 175.2962 119 K 4.4845 8.5166 123.8245 55.4042 34.1703 176.2057 120 R 4.5598 8.4513 119.1125 55.2477 30.0284 174.5924 121 D 4.3848 7.3684 117.1833 54.3822 43.8658 176.0444 122 R 4.0452 8.2478 118.1229 57.6083 29.9967 176.9294 123 F 4.7100 7.1647 117.9457 57.0733 39.5303 176.1562 124 H 4.7183 8.4886 123.0151 54.8969 27.4758 172.1639 125 F 4.9960 8.2727 120.2557 56.0464 40.6733 174.5330 126 L 5.1454 9.6723 122.8060 52.2639 45.1313 176.2647 127 K 4.4862 9.3215 121.9687 55.9847 35.2486 175.2357 128 C 3.6329 6.7998 117.9160 59.0191 30.2917 173.6450 129 E 4.2442 8.1848 125.0612 56.5534 30.0425 176.7029 130 A 4.4546 7.9759 121.1984 53.7784 20.2739 177.7581 131 C 4.2472 7.9621 108.3606 59.0210 30.6307 174.8216 132 G 3.9368 7.5947 106.3796 44.5162 0.0000 173.5415 133 A 4.0766 7.6848 122.9082 52.4170 19.0668 177.9295 134 E 4.6483 8.2595 122.6176 54.1550 29.6294 175.6653 135 T 4.0883 7.6832 112.2697 61.2219 70.6809 173.0406 136 P 4.7268 0.0000 0.0000 62.0589 31.3035 174.2793 137 I 4.2722 8.0066 119.8544 59.6557 38.5904 176.2300 138 Q 4.6545 8.1068 122.4737 55.5832 32.0390 174.2779 139 H 3.9301 7.7808 123.6820 57.0687 30.1903 173.9417 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 3 I 8.01 4.03 1.80 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 1.32 1.26 0.81 0.00 0.00 4 D 8.16 3.91 0.00 3.00 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 5 Y 8.48 4.21 0.00 2.50 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 6 Y 7.80 4.54 0.00 3.07 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 7.61 4.78 0.00 2.82 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 8 Y 8.10 4.08 0.00 3.09 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 9 E 8.62 4.07 0.00 2.11 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 2.56 2.45 0.00 10 K 8.08 3.85 0.00 2.00 1.85 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.66 7.81 11 L 7.73 3.93 0.00 1.59 1.48 0.90 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 12 L 7.67 3.50 0.00 1.36 1.79 0.56 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.24 4.32 0.00 2.16 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 2.38 2.37 0.00 14 K 8.66 3.95 0.00 1.82 1.84 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.41 7.81 15 A 7.74 4.08 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 16 Y 7.32 4.59 0.00 2.88 2.83 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 0.00 0.00 0.00 17 Q 7.62 4.26 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 18 E 8.09 4.10 0.00 1.96 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 2.29 2.30 0.00 19 L 7.30 3.96 0.00 1.94 1.76 1.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 20 P 0.00 4.19 0.00 2.23 2.09 0.00 3.64 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 21 E 8.41 4.32 0.00 2.02 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 2.24 0.00 22 N 7.56 4.13 0.00 3.27 2.96 0.00 0.00 5.64 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 23 V 7.50 4.06 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 0.76 0.00 0.00 1.01 0.00 0.00 24 K 8.07 3.99 0.00 2.09 1.94 0.00 1.76 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.53 0.00 0.00 0.00 0.00 1.49 1.77 7.81 25 H 7.45 4.92 0.00 3.44 3.29 0.00 5.61 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 26 H 7.32 3.29 0.00 3.08 3.22 0.00 5.90 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 27 K 7.60 3.90 0.00 1.62 1.60 0.00 1.49 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.54 1.41 7.81 28 S 8.19 4.78 0.00 3.99 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 29 R 8.15 3.46 0.00 1.59 1.69 0.00 3.15 0.00 0.00 3.47 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 30 F 7.74 4.90 0.00 3.20 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 31 E 8.35 4.36 0.00 2.05 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 2.65 2.46 0.00 32 V 7.34 3.91 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 0.71 0.00 0.00 1.04 0.00 0.00 33 P 0.00 4.49 0.00 2.21 2.08 0.00 3.81 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 34 G 8.66 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 8.44 4.02 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 36 L 8.48 4.62 0.00 1.72 1.57 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.31 4.82 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 0.87 0.00 0.00 0.92 0.00 0.00 38 T 8.94 4.49 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 1.20 0.00 0.00 39 I 8.48 4.70 1.84 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 1.22 0.51 0.85 0.00 0.00 40 E 9.03 4.56 0.00 1.97 1.77 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 2.20 2.21 0.00 41 G 8.78 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 42 N 9.04 5.25 0.00 2.54 2.73 0.00 0.00 6.56 7.61 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 43 K 8.54 5.13 0.00 1.95 1.82 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.25 7.81 44 T 8.74 4.96 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 1.37 0.00 0.00 45 I 9.21 5.42 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 0.89 1.61 0.95 0.00 0.00 46 I 8.61 5.13 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.49 0.82 0.00 0.00 47 E 8.59 4.68 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 48 N 8.11 4.89 0.00 2.86 2.84 0.00 0.00 6.69 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 49 F 8.37 4.17 0.00 3.21 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 50 K 8.06 3.75 0.00 2.09 2.13 0.00 1.40 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.53 7.81 51 D 7.82 4.36 0.00 3.14 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 52 I 7.91 3.65 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.57 0.87 0.00 0.00 53 A 7.51 3.83 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 54 D 8.45 4.33 0.00 2.74 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 55 A 7.52 4.32 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 56 L 8.00 4.25 0.00 1.82 1.80 1.02 1.39 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 57 N 7.85 4.16 0.00 2.80 2.84 0.00 0.00 6.92 7.03 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 58 R 7.68 4.72 0.00 1.89 1.90 0.00 3.34 0.00 0.00 3.48 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.75 0.00 59 D 8.45 4.57 0.00 2.68 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.23 0.00 2.19 2.05 0.00 3.59 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 61 Q 7.96 4.28 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 62 H 8.19 4.27 0.00 3.19 3.32 0.00 5.66 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 63 L 7.69 3.71 0.00 1.38 1.61 0.45 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.88 3.92 0.00 1.82 1.87 0.84 0.17 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 65 K 7.91 3.90 0.00 1.98 1.83 0.00 1.77 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.69 7.81 66 F 7.78 4.19 0.00 2.96 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 67 L 7.99 3.74 0.00 1.82 1.42 0.83 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.68 3.40 0.00 1.57 1.69 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.40 4.04 0.00 1.87 1.87 0.00 3.35 0.00 0.00 3.33 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 70 E 7.84 3.96 0.00 1.55 1.77 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 1.66 1.60 0.00 71 I 7.63 4.38 1.65 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.32 0.31 0.00 0.00 72 A 8.20 4.73 1.23 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 73 T 7.32 4.91 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 1.51 0.00 0.00 74 A 8.53 4.78 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 75 G 8.48 4.88 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 0.00 0.00 0.00 76 T 8.31 4.89 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 77 L 8.30 4.92 0.00 1.76 1.70 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 78 E 9.37 4.42 0.00 2.03 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 79 G 8.92 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 80 R 7.85 4.01 0.00 2.07 2.09 0.00 3.26 0.00 0.00 3.41 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 81 R 9.01 5.15 0.00 1.67 2.01 0.00 2.75 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 82 V 8.24 4.69 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 -0.01 0.00 0.00 83 V 8.36 4.52 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 0.96 0.00 0.00 0.91 0.00 0.00 84 L 9.12 5.11 0.00 1.94 1.73 0.76 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.93 4.16 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.61 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 86 G 8.08 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 87 R 7.81 4.71 0.00 1.47 1.61 0.00 3.07 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.45 0.00 88 F 8.60 4.82 0.00 3.00 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 89 T 8.60 4.02 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 1.21 0.00 0.00 90 P 0.00 4.11 0.00 1.64 2.01 0.00 3.31 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.10 0.00 91 Y 7.47 4.45 0.00 3.04 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 92 L 7.91 3.99 0.00 1.77 1.94 1.27 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.79 3.80 1.89 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 1.46 0.76 0.92 0.00 0.00 94 A 8.15 4.11 1.56 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 95 N 8.75 4.53 0.00 2.86 3.13 0.00 0.00 7.16 6.62 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 96 K 8.18 4.26 0.00 1.95 1.79 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.66 1.49 7.81 97 L 8.02 4.23 0.00 1.80 1.83 1.01 0.93 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 98 K 7.84 3.93 0.00 1.95 2.05 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.56 7.81 99 K 7.92 4.10 0.00 2.48 2.11 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.84 7.81 100 Y 8.21 3.35 0.00 2.80 3.13 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 0.00 101 I 8.08 3.64 2.06 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 1.52 0.88 0.91 0.00 0.00 102 K 7.62 4.00 0.00 1.81 2.01 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.39 7.81 103 E 7.69 4.41 0.00 1.75 1.70 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 2.25 1.84 0.00 104 Y 7.63 4.60 0.00 1.76 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 0.00 0.00 0.00 105 V 7.67 4.36 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 0.97 0.00 0.00 0.83 0.00 0.00 106 I 7.32 4.73 1.88 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 1.26 0.91 0.89 0.00 0.00 107 C 8.49 4.36 0.00 2.92 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 0.00 108 P 0.00 4.38 0.00 2.18 2.12 0.00 3.76 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.94 0.00 109 V 7.82 3.90 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.91 0.00 0.00 110 C 7.63 4.55 0.00 3.00 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 0.00 111 G 8.44 4.32 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 0.00 112 S 8.40 4.45 0.00 3.81 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 0.00 113 P 0.00 4.61 0.00 1.93 2.01 0.00 3.63 0.00 0.00 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.95 0.00 114 D 7.89 4.57 0.00 2.67 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 0.00 115 T 7.33 4.37 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 1.26 0.00 0.00 116 K 8.24 4.66 0.00 1.80 1.55 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.76 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.41 7.81 117 I 8.38 4.20 1.81 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.85 0.86 0.00 0.00 118 I 7.79 4.64 1.89 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 1.27 1.09 1.04 0.00 0.00 119 K 8.52 4.48 0.00 1.72 1.71 0.00 2.02 0.00 0.00 1.95 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.23 1.26 7.81 120 R 8.45 4.56 0.00 1.95 2.06 0.00 3.06 0.00 0.00 2.86 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.03 0.00 121 D 7.37 4.38 0.00 3.00 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 0.00 122 R 8.25 4.05 0.00 1.37 1.78 0.00 3.13 0.00 0.00 3.13 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.45 0.00 123 F 7.16 4.71 0.00 2.51 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 0.00 0.00 0.00 124 H 8.49 4.72 0.00 3.08 3.40 0.00 5.62 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.27 5.00 0.00 2.98 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 0.00 126 L 9.67 5.15 0.00 1.53 1.73 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 127 K 9.32 4.49 0.00 1.82 2.08 0.00 1.57 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.24 1.12 7.81 128 C 6.80 3.63 0.00 3.07 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.18 4.24 0.00 2.22 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 2.26 2.37 0.00 130 A 7.98 4.45 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 0.00 131 C 7.96 4.25 0.00 3.07 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 0.00 132 G 7.59 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 0.00 133 A 7.68 4.08 1.23 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 0.00 134 E 8.26 4.65 0.00 1.84 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 2.18 2.31 0.00 135 T 7.68 4.09 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 1.19 0.00 0.00 136 P 0.00 4.73 0.00 2.05 2.32 0.00 3.76 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 137 I 8.01 4.27 1.60 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 1.27 0.78 0.84 0.00 0.00 138 Q 8.11 4.65 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.15 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 139 H 7.78 3.93 0.00 3.13 3.11 0.00 5.76 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00