NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4616 8.1776 115.2883 57.8793 63.5418 174.4574 3 V 3.3524 8.2475 128.6377 64.5863 31.0180 176.7731 4 Y 3.9791 8.4991 118.3264 60.9689 38.0055 178.9911 5 D 4.3986 7.7783 118.0432 57.1360 41.2070 178.3369 6 A 4.0721 8.1218 121.2092 55.1230 18.4335 179.6049 7 A 3.8908 8.2272 119.0782 54.9451 18.1631 179.5476 8 A 4.0754 7.5337 118.0631 54.7074 18.5400 179.0999 9 Q 4.2449 7.6637 115.0894 56.6941 30.0123 177.2303 10 L 4.2269 7.2520 121.2407 53.6881 40.1120 176.9489 11 T 4.1927 7.6435 114.5835 60.5058 71.5158 175.0422 12 A 3.9495 8.4318 121.9151 55.6307 18.2631 179.5097 13 D 4.2925 7.9889 116.7764 57.3397 40.9776 179.0513 14 V 3.5079 7.4205 117.4807 65.9377 31.5341 178.2269 15 K 3.8689 8.1807 118.4244 59.2248 31.7625 179.2067 16 K 3.9495 8.0324 119.8631 59.7759 32.1629 178.6663 17 D 4.6646 8.1281 119.0589 57.2592 40.6599 178.8681 18 L 3.7651 7.9810 119.6269 57.7428 41.5851 179.7426 19 R 4.0639 8.1624 118.0208 59.4205 29.8127 178.8173 20 D 4.4902 8.5762 119.2526 57.5729 40.9058 179.1340 21 S 3.3655 8.3291 114.6873 60.7397 63.1064 176.3031 22 W 4.3611 8.6701 132.1517 60.0765 30.2149 177.7414 23 K 3.9199 7.9560 119.1473 59.1175 31.6251 178.5549 24 V 3.7251 6.9880 115.6385 65.4527 31.7649 178.2006 25 I 3.4467 7.3754 112.2240 63.3419 37.5874 177.7828 26 G 2.1093 7.0589 108.6526 45.8576 0.0000 174.7687 27 S 4.0606 7.1404 114.4554 60.2580 63.6154 174.1540 28 D 4.6674 7.1410 119.9583 51.0991 40.9817 175.5504 29 K 3.8444 7.9423 123.0950 58.5560 32.4736 178.4058 30 K 4.0079 7.9468 119.5785 59.3904 32.3134 178.9779 31 G 3.7750 8.0023 106.6678 47.6474 0.0000 175.3832 32 N 4.4556 8.2579 119.8544 55.2147 38.4572 178.0211 33 G 3.4970 8.0650 107.5506 47.8458 0.0000 176.0917 34 V 3.6075 7.7401 120.7685 65.2874 31.4829 177.9566 35 A 3.9927 7.8598 122.0841 54.3917 18.2129 179.5081 36 L 3.7654 7.8298 117.3712 58.2193 41.6832 179.7468 37 M 3.4470 7.5813 118.1616 58.4155 31.9087 179.0034 38 T 3.9169 8.0059 110.2023 65.1010 68.7119 176.6847 39 T 3.9189 7.7912 118.5993 66.0783 68.4011 176.3885 40 L 3.8097 7.6235 122.2361 58.3468 41.8673 179.2186 41 F 4.4929 7.4807 116.0095 60.3612 38.8262 177.3723 42 A 4.1831 7.8644 119.9394 55.1689 18.3836 178.9415 43 D 4.6470 8.2968 115.6977 55.2132 42.7855 176.8607 44 N 5.1685 8.2393 116.5297 50.3216 39.2657 174.7813 45 Q 4.2639 8.2154 120.5418 58.7429 29.0602 177.8189 46 E 4.2330 8.2388 116.6727 58.1841 30.0650 177.8756 47 T 4.6177 8.1802 110.6081 63.0900 69.5327 176.5419 48 I 3.8609 7.8437 123.2620 64.6504 36.8561 178.0528 49 G 3.6188 8.1180 105.0406 48.1789 0.0000 174.8168 50 Y 4.3058 7.7907 117.5968 59.8148 38.0730 176.3737 51 F 4.8500 8.2259 118.8634 56.7927 40.0582 177.8634 52 K 3.8215 8.3798 124.5576 59.7082 32.0328 178.5036 53 R 3.9683 7.9874 117.3891 59.1592 30.0790 177.0499 54 L 4.2221 7.9442 116.0801 55.0894 42.7096 179.1425 55 G 3.7604 7.6658 106.6105 46.7066 0.0000 176.5681 56 D 4.4853 8.3769 122.4253 53.5224 40.8598 176.8571 57 V 3.7190 7.9605 120.8971 63.2206 31.5302 177.8392 58 S 4.3179 7.8164 112.8268 60.5784 63.1488 175.7567 59 Q 4.1516 8.0716 121.8938 55.9080 28.8257 177.2610 60 G 3.7889 8.6820 109.5531 46.2904 0.0000 176.7149 61 M 3.8877 8.9978 122.5176 58.2197 31.9153 176.9761 62 A 4.0163 7.6836 119.9001 53.8119 18.8547 177.2075 63 N 4.6365 8.2266 115.6179 52.5723 39.4399 175.0561 64 D 4.3736 8.6687 129.1108 57.5465 41.0167 178.9780 65 K 4.0169 8.1046 118.4684 59.3050 32.0796 179.0690 66 L 4.0447 8.7062 121.1631 58.0118 42.0314 179.0168 67 R 4.0032 8.4018 119.1161 59.3769 30.1674 178.7190 68 G 3.6704 8.3915 105.8139 48.0263 0.0000 175.1558 69 H 4.2401 8.5003 120.6737 59.2211 29.9843 177.5824 70 S 4.0886 8.5191 117.3781 61.6012 62.4057 176.8269 71 I 3.7754 7.7016 121.4950 64.7649 37.0523 178.2533 72 T 4.1600 7.8727 116.1369 66.5887 68.2290 176.3970 73 L 3.9589 8.0139 122.2538 58.4760 42.1410 179.0170 74 M 4.2291 7.9917 118.0473 58.3796 31.8354 177.9959 75 Y 4.0965 7.8438 116.1256 59.9012 38.1069 177.7298 76 A 3.8187 7.8493 122.5666 54.8651 18.4693 179.6390 77 L 3.5298 7.4938 117.0570 57.5854 41.7152 179.2149 78 Q 3.4844 7.8545 119.5768 58.8706 28.7425 177.8102 79 N 4.2533 7.6020 116.9892 56.7764 39.4429 176.3241 80 F 4.5912 7.6928 118.9472 60.9144 39.0717 177.7161 81 I 3.5401 7.6254 119.1681 64.5664 36.6546 178.2898 82 D 4.4970 8.0700 118.0334 56.4709 40.7677 177.7019 83 Q 4.4613 7.6490 116.9667 55.7885 28.8196 177.2610 84 L 3.9948 7.5509 121.1340 57.7642 41.6056 178.2548 85 D 4.3313 8.0594 117.9345 56.1090 41.2317 175.9120 86 N 4.8272 7.8834 118.1822 50.7897 40.5675 172.8285 87 P 4.2306 0.0000 0.0000 66.1845 30.8821 178.0119 88 D 4.4717 8.3396 118.6096 57.1927 40.6485 178.3059 89 D 4.4077 8.2106 119.0259 56.8005 41.0666 178.3183 90 L 3.9068 8.0358 121.0553 58.0707 41.9872 179.2159 91 V 3.3759 7.7821 118.3598 66.0978 31.2967 177.8353 92 C 4.1179 7.7877 113.7470 61.2717 29.5257 176.1199 93 V 3.7749 7.7068 114.4646 63.7565 31.1494 178.7052 94 V 3.6036 7.8098 118.3722 65.9771 31.3638 178.0111 95 E 3.9163 8.4409 118.5652 58.8359 28.9602 179.3230 96 K 3.9532 7.4743 119.4188 59.5424 32.1345 178.7883 97 V 3.8191 7.8940 118.1057 65.7658 31.3579 177.7347 98 A 3.8751 8.3470 121.0468 55.2381 18.2795 179.6395 99 V 3.5098 7.8562 116.6127 66.4019 31.3237 177.9986 100 N 4.4076 7.8293 114.2125 55.9556 38.5240 176.1861 101 H 4.5863 7.9746 116.4971 57.3511 29.6838 177.2615 102 I 3.7125 8.0425 122.5042 64.4655 36.6773 178.4936 103 T 3.9193 7.7619 108.9842 64.1692 68.7633 175.1881 104 R 4.3315 7.7909 118.9854 55.1608 30.2420 175.9551 105 K 3.7933 7.6590 116.0567 57.5206 29.9511 175.7222 106 I 4.0467 7.7414 119.8637 59.8895 38.1003 177.2692 107 S 4.5140 8.3697 120.6989 57.3172 65.5703 174.9054 108 A 3.9622 8.4337 123.2458 55.2051 17.8481 179.7328 109 A 3.9860 7.9023 117.8681 55.5234 18.8828 179.3188 110 E 4.1459 8.1901 116.6262 59.3291 29.6187 179.2947 111 F 4.1951 8.6884 121.2628 61.0247 39.4688 177.0530 112 G 3.8967 8.2818 104.5417 46.4618 0.0000 174.9839 113 K 4.2593 7.9564 120.4614 57.9508 32.0923 178.2361 114 I 3.7961 7.5321 119.0422 62.9640 37.8299 177.1454 115 N 4.4542 8.1631 118.0172 56.3371 38.3243 177.1282 116 G 3.6495 7.5509 107.3729 47.4998 0.0000 173.7645 117 P 4.1863 0.0000 0.0000 65.1113 31.2980 178.7096 118 I 3.4997 7.7064 118.4336 64.1226 36.9413 178.2691 119 K 3.8963 8.1977 120.5078 59.5978 32.0085 179.0061 120 K 3.9601 8.0049 118.6520 59.4418 31.7495 179.6106 121 V 3.5340 7.8116 117.8445 65.8563 31.6666 177.8013 122 L 4.0216 8.1638 118.8565 57.7026 41.4997 179.2216 123 A 4.1843 8.2494 121.0891 55.2063 18.1130 179.5685 124 S 4.2894 8.0340 111.0648 60.1808 63.1222 175.6744 125 K 4.4634 7.7607 120.8395 55.5421 32.3622 175.3017 126 N 4.2116 8.1661 116.3184 54.6184 37.5040 173.7797 127 F 4.5070 8.3434 115.2261 55.0669 40.6150 176.5307 128 G 4.0831 8.5854 114.7051 44.0178 0.0000 171.9387 129 D 4.5083 8.9230 118.6655 57.7177 40.5190 178.7753 130 K 3.8034 8.1723 119.2669 60.0046 32.0950 178.1808 131 Y 4.2425 8.2469 116.4661 60.7634 37.9385 177.8387 132 A 4.2451 8.1693 121.4708 55.3326 18.4289 179.2956 133 N 4.4015 8.8500 115.3251 56.1718 38.0736 177.5839 134 A 3.9663 7.7714 122.3029 55.1096 18.4687 179.8329 135 W 3.9871 8.5793 117.1848 59.5920 29.0781 178.6619 136 A 4.1049 8.2620 121.0387 55.1124 17.5431 179.8301 137 K 4.0015 7.6244 116.4507 59.2380 32.4027 179.0897 138 L 3.9678 7.5018 119.8198 58.0163 42.0374 179.1264 139 V 3.7969 8.2406 118.2244 65.9441 31.4810 177.8404 140 A 4.4843 8.0176 121.8989 54.3989 17.8807 179.8027 141 V 3.4091 7.2955 116.4494 66.0041 31.7965 178.1633 142 V 3.4630 7.4801 117.5753 65.9258 31.3169 177.7461 143 Q 3.7791 8.0679 117.5772 58.9441 28.3279 178.7935 144 A 4.0225 7.7949 120.1363 53.9577 18.4522 178.3474 145 A 4.3589 7.5513 117.2859 51.9731 19.6092 176.9782 146 L 4.0978 7.4330 122.8974 54.7102 41.8469 176.5086 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 2 S 8.18 4.46 0.00 3.91 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 3 V 8.25 3.35 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 0.09 0.00 0.00 0.66 0.00 0.00 4 Y 8.50 3.98 0.00 3.03 3.02 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 0.00 0.00 0.00 5 D 7.78 4.40 0.00 2.82 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 6 A 8.12 4.07 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 7 A 8.23 3.89 1.29 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 8 A 7.53 4.08 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 9 Q 7.66 4.24 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.28 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 10 L 7.25 4.23 0.00 1.67 1.54 0.78 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 11 T 7.64 4.19 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 12 A 8.43 3.95 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 13 D 7.99 4.29 0.00 2.67 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 V 7.42 3.51 2.23 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 0.93 0.00 0.00 0.88 0.00 0.00 15 K 8.18 3.87 0.00 1.93 1.80 0.00 1.68 0.00 0.00 1.52 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.57 7.81 16 K 8.03 3.95 0.00 2.05 1.97 0.00 1.56 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.78 7.81 17 D 8.13 4.66 0.00 2.89 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 18 L 7.98 3.77 0.00 1.68 1.25 0.55 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.16 4.06 0.00 2.06 2.06 0.00 3.16 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 20 D 8.58 4.49 0.00 2.95 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 21 S 8.33 3.37 0.00 3.53 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 22 W 8.67 4.36 0.00 3.82 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 23 K 7.96 3.92 0.00 1.85 2.05 0.00 1.88 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.43 7.81 24 V 6.99 3.73 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 1.00 0.00 0.00 1.06 0.00 0.00 25 I 7.38 3.45 1.53 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.13 0.60 0.00 0.00 26 G 7.06 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 0.00 0.00 0.00 27 S 7.14 4.06 0.00 3.81 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 28 D 7.14 4.67 0.00 2.74 2.39 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 29 K 7.94 3.84 0.00 1.73 1.70 0.00 1.13 0.00 0.00 0.76 0.00 0.00 2.13 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.25 1.36 7.81 30 K 7.95 4.01 0.00 1.82 1.77 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 31 G 8.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.26 4.46 0.00 2.70 2.71 0.00 0.00 7.01 7.13 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 33 G 8.06 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.74 3.61 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 1.08 0.00 0.00 0.96 0.00 0.00 35 A 7.86 3.99 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 36 L 7.83 3.77 0.00 1.77 1.57 0.79 0.59 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 37 M 7.58 3.45 0.00 1.56 1.93 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.70 0.00 38 T 8.01 3.92 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 1.30 0.00 0.00 39 T 7.79 3.92 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 1.19 0.00 0.00 40 L 7.62 3.81 0.00 1.56 1.24 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.48 4.49 0.00 3.03 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 42 A 7.86 4.18 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 43 D 8.30 4.65 0.00 2.63 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 44 N 8.24 5.17 0.00 2.98 2.90 0.00 0.00 6.82 7.24 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 45 Q 8.22 4.26 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.95 0.00 0.00 0.00 0.00 0.00 2.61 2.47 0.00 46 E 8.24 4.23 0.00 2.14 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 2.38 2.37 0.00 47 T 8.18 4.62 4.71 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 1.45 0.00 0.00 48 I 7.84 3.86 1.95 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.72 0.73 0.00 0.00 49 G 8.12 3.62 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 0.00 0.00 0.00 50 Y 7.79 4.31 0.00 2.82 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 51 F 8.23 4.85 0.00 3.11 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 52 K 8.38 3.82 0.00 1.77 1.83 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.45 7.81 53 R 7.99 3.97 0.00 1.83 1.99 0.00 3.31 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 54 L 7.94 4.22 0.00 1.84 1.74 1.03 1.06 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 55 G 7.67 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 0.00 0.00 0.00 56 D 8.38 4.49 0.00 2.70 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 57 V 7.96 3.72 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 0.44 0.00 0.00 0.33 0.00 0.00 58 S 7.82 4.32 0.00 4.03 3.97 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 59 Q 8.07 4.15 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.83 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 60 G 8.68 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 0.00 0.00 0.00 61 M 9.00 3.89 0.00 1.96 2.12 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 2.59 2.61 0.00 62 A 7.68 4.02 1.35 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 0.00 0.00 63 N 8.23 4.64 0.00 2.77 2.88 0.00 0.00 7.02 9.07 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 64 D 8.67 4.37 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 K 8.10 4.02 0.00 1.99 1.90 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.51 7.81 66 L 8.71 4.04 0.00 1.78 1.86 1.07 0.91 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 67 R 8.40 4.00 0.00 2.05 2.05 0.00 3.16 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 68 G 8.39 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 0.00 0.00 0.00 69 H 8.50 4.24 0.00 3.37 3.65 0.00 5.79 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 70 S 8.52 4.09 0.00 4.02 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 71 I 7.70 3.78 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.66 1.16 0.00 0.00 72 T 7.87 4.16 4.42 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 1.25 0.00 0.00 73 L 8.01 3.96 0.00 1.71 1.79 0.91 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 74 M 7.99 4.23 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.89 0.00 75 Y 7.84 4.10 0.00 3.15 3.02 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 0.00 0.00 0.00 76 A 7.85 3.82 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 77 L 7.49 3.53 0.00 1.55 1.26 0.98 1.11 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 78 Q 7.85 3.48 0.00 2.44 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.54 2.65 0.00 79 N 7.60 4.25 0.00 2.87 2.83 0.00 0.00 7.28 7.19 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 80 F 7.69 4.59 0.00 3.06 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 81 I 7.63 3.54 1.60 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.23 0.82 0.00 0.00 82 D 8.07 4.50 0.00 2.81 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 83 Q 7.65 4.46 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.78 0.00 0.00 0.00 0.00 0.00 2.76 2.57 0.00 84 L 7.55 3.99 0.00 1.62 1.68 0.79 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.06 4.33 0.00 2.66 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 7.88 4.83 0.00 2.67 2.67 0.00 0.00 6.91 8.92 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 87 P 0.00 4.23 0.00 2.33 2.30 0.00 3.75 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.07 0.00 88 D 8.34 4.47 0.00 2.97 2.80 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 89 D 8.21 4.41 0.00 2.82 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 90 L 8.04 3.91 0.00 1.89 1.73 0.77 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 91 V 7.78 3.38 1.97 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 0.60 0.00 0.00 0.63 0.00 0.00 92 C 7.79 4.12 0.00 3.20 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 93 V 7.71 3.77 2.25 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 1.08 0.00 0.00 1.18 0.00 0.00 94 V 7.81 3.60 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 0.88 0.00 0.00 0.27 0.00 0.00 95 E 8.44 3.92 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 2.20 2.43 0.00 96 K 7.47 3.95 0.00 1.91 2.08 0.00 1.86 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.62 7.81 97 V 7.89 3.82 2.45 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 1.19 0.00 0.00 1.15 0.00 0.00 98 A 8.35 3.88 1.27 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 0.00 0.00 0.00 99 V 7.86 3.51 2.23 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 1.02 0.00 0.00 0.98 0.00 0.00 100 N 7.83 4.41 0.00 2.98 2.84 0.00 0.00 7.01 8.04 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 0.00 101 H 7.97 4.59 0.00 3.32 3.38 0.00 5.82 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 8.04 3.71 1.86 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 1.54 1.15 0.90 0.00 0.00 103 T 7.76 3.92 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 1.24 0.00 0.00 104 R 7.79 4.33 0.00 1.81 1.85 0.00 3.37 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00 105 K 7.66 3.79 0.00 1.98 1.95 0.00 1.64 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.46 7.81 106 I 7.74 4.05 1.97 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.64 0.94 0.00 0.00 107 S 8.37 4.51 0.00 4.07 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 0.00 108 A 8.43 3.96 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 0.00 109 A 7.90 3.99 1.35 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 0.00 0.00 110 E 8.19 4.15 0.00 2.09 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 2.40 0.00 111 F 8.69 4.20 0.00 3.24 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.28 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 0.00 113 K 7.96 4.26 0.00 1.98 1.88 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.72 7.81 114 I 7.53 3.80 1.56 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.09 0.73 0.00 0.00 115 N 8.16 4.45 0.00 2.96 2.89 0.00 0.00 6.69 7.70 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 0.00 116 G 7.55 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 0.00 117 P 0.00 4.19 0.00 2.15 2.14 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 118 I 7.71 3.50 1.95 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 1.19 0.74 0.63 0.00 0.00 119 K 8.20 3.90 0.00 1.88 2.10 0.00 1.56 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.55 7.81 120 K 8.00 3.96 0.00 1.95 1.81 0.00 1.78 0.00 0.00 1.55 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.61 7.81 121 V 7.81 3.53 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 0.67 0.00 0.00 0.86 0.00 0.00 122 L 8.16 4.02 0.00 1.93 1.92 0.91 0.60 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 0.00 123 A 8.25 4.18 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 0.00 124 S 8.03 4.29 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 7.76 4.46 0.00 2.05 1.96 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.64 1.46 7.81 126 N 8.17 4.21 0.00 2.81 2.72 0.00 0.00 6.93 6.31 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 0.00 127 F 8.34 4.51 0.00 3.09 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 0.00 128 G 8.59 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 0.00 0.00 0.00 0.00 129 D 8.92 4.51 0.00 2.81 2.80 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 0.00 130 K 8.17 3.80 0.00 1.72 1.60 0.00 1.50 0.00 0.00 1.67 0.00 0.00 2.70 0.00 0.00 2.14 0.00 0.00 0.00 0.00 1.02 1.36 7.81 131 Y 8.25 4.24 0.00 3.49 3.29 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 0.00 132 A 8.17 4.25 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 0.00 133 N 8.85 4.40 0.00 2.92 2.90 0.00 0.00 6.88 6.68 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 0.00 134 A 7.77 3.97 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 0.00 135 W 8.58 3.99 0.00 3.63 3.37 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 0.00 136 A 8.26 4.10 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 0.00 137 K 7.62 4.00 0.00 1.82 1.83 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.63 7.81 138 L 7.50 3.97 0.00 1.55 1.75 0.65 0.50 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 0.00 139 V 8.24 3.80 2.36 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 1.20 0.00 0.00 1.17 0.00 0.00 140 A 8.02 4.48 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 0.00 141 V 7.30 3.41 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 0.58 0.00 0.00 0.83 0.00 0.00 142 V 7.48 3.46 1.97 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 0.26 0.00 0.00 0.83 0.00 0.00 143 Q 8.07 3.78 0.00 2.29 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.62 2.70 0.00 144 A 7.79 4.02 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 0.00 145 A 7.55 4.36 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 0.00 146 L 7.43 4.10 0.00 1.68 1.49 0.44 0.66 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