NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.3587 8.3449 119.6875 56.2294 30.2581 174.4364 4 Q 4.3033 7.5736 118.1983 55.2789 32.5472 172.2264 5 K 5.4332 8.2979 127.0935 57.0180 34.2256 172.2175 6 P 4.3235 0.0000 0.0000 64.2586 32.0603 176.8889 7 Q 4.5520 8.3170 121.6647 54.7739 27.4287 174.1123 8 L 5.0413 7.6092 121.5079 52.6883 46.3769 175.2165 9 V 4.4198 8.2746 121.8510 61.0886 35.0100 174.4948 10 Q 4.9462 8.7931 125.2010 54.7241 30.7996 174.6656 11 T 4.8262 9.0147 121.5410 61.3916 71.9376 173.5751 12 F 6.1846 7.7276 118.5806 54.1142 41.1080 174.2930 13 G 4.4411 8.7751 106.3738 44.8574 0.0000 171.2934 14 R 5.6689 8.4907 120.3664 54.9383 33.7378 174.6412 15 K 4.1631 8.8809 124.8733 56.8830 34.9289 175.6973 16 K 4.0128 9.5071 124.4651 57.9658 31.1674 173.7547 17 N 4.6094 8.0149 121.5970 53.8108 37.9319 174.6381 18 A 4.0315 8.7852 122.2474 51.8610 19.5333 176.5807 19 V 4.6789 8.5540 122.2792 61.0175 34.6231 173.9534 20 A 4.7825 9.6793 131.6299 50.2607 20.9570 175.7886 21 V 4.2331 8.9552 123.9526 62.9832 32.6458 174.8699 22 A 5.2261 9.2329 131.9074 50.1900 21.3292 174.7244 23 S 5.0881 9.4024 118.6744 56.9258 65.8212 173.4152 24 V 4.5563 8.5835 124.5281 61.0788 33.6320 174.1785 25 R 5.2602 8.5933 128.0608 53.5262 33.8768 172.5416 26 P 4.5850 0.0000 0.0000 61.9945 32.3683 173.4868 27 G 4.5830 8.6782 115.5187 46.8797 0.0000 174.2107 28 K 4.7242 9.1246 122.2958 54.8929 33.4277 176.0272 29 G 4.0344 8.4088 104.1719 46.1069 0.0000 173.8383 30 L 4.7112 7.4704 118.1760 53.3128 44.9621 177.8603 31 L 5.0021 8.3796 121.4537 53.0226 44.8075 174.5912 32 K 4.7862 8.7535 125.9937 54.5619 34.4594 175.2250 33 V 4.4313 8.4193 126.7790 61.5527 34.0506 174.7594 34 N 4.1433 10.9700 126.1697 54.1452 38.3811 174.3878 35 G 3.9663 8.9983 103.1653 45.6432 0.0000 172.8916 36 S 4.5193 7.4455 112.6512 57.0868 67.1684 173.4815 37 P 5.1479 0.0000 0.0000 61.2691 32.4372 177.0997 38 I 3.5245 8.4880 122.1978 64.8382 37.0827 177.2507 39 D 4.6826 8.1279 117.0174 55.8187 41.0151 176.4999 40 M 4.6173 8.0531 116.5551 55.3669 32.5556 175.9900 41 I 3.8892 7.5519 120.2310 61.3108 37.8478 175.9193 42 N 4.3605 8.7613 120.5046 56.4913 39.1279 174.7693 43 P 4.5171 0.0000 0.0000 60.5798 30.0108 176.5602 44 Q 3.9251 8.3991 121.6278 59.1639 28.6319 180.0378 45 I 3.8157 7.5087 120.4095 63.8976 37.0089 177.9122 46 L 4.0634 7.8603 119.8281 57.3366 41.1565 179.2754 47 Q 3.9959 8.2868 118.0174 59.2084 28.6055 178.8361 48 A 4.1181 7.9526 120.9365 55.3242 18.2572 179.4710 49 K 3.7816 8.1232 116.9687 60.1679 31.9396 179.4663 50 I 3.6229 7.3338 117.9077 64.3918 37.1745 177.7337 51 Y 4.0576 8.2207 116.9435 59.7931 37.6769 177.5313 52 E 3.8545 7.7441 120.6055 59.0502 29.4649 177.5356 53 P 4.1223 0.0000 0.0000 65.5973 31.4085 178.2607 54 I 3.6420 7.7516 118.0216 64.7001 36.7750 178.1955 55 L 3.9202 7.9133 118.2177 57.8902 41.6676 179.0580 56 L 3.8647 7.8185 119.0738 57.6329 41.7808 178.1176 57 L 4.4611 7.5491 117.0978 55.9771 43.4495 176.2746 58 G 4.0944 8.1142 106.6855 44.0209 0.0000 174.8633 59 Q 4.7685 9.2356 123.0100 59.2464 28.3457 179.1563 60 Q 3.9102 8.1459 119.5511 59.1401 28.2577 178.7984 61 K 3.9549 7.9448 118.8310 59.4583 32.4386 179.4467 62 F 4.0752 8.1829 114.3968 59.9429 37.7595 177.3463 63 A 3.1913 7.2863 121.3754 54.3216 17.9464 178.9698 64 N 4.2159 7.7460 115.0532 54.6493 39.0906 174.5022 65 L 4.9400 6.7868 118.9554 52.9010 45.6178 175.5518 66 D 5.1384 9.1262 120.5236 53.0039 43.2808 175.5393 67 I 4.7862 8.6757 126.2821 59.4789 39.3764 175.0726 68 R 4.9190 8.9386 124.9780 54.4059 31.4054 175.2364 69 I 5.2044 9.1204 124.4483 59.5057 41.3125 174.6682 70 R 5.1809 9.2063 123.9198 54.4646 33.7217 174.6577 71 V 4.8812 8.3536 122.4600 59.8569 34.3304 175.5898 72 R 4.5861 8.3517 127.4322 53.7427 28.9502 174.7058 73 G 4.3249 8.1023 123.1194 45.6282 0.0000 171.5490 74 S 4.4536 8.2244 115.5253 57.2661 65.6693 174.6015 75 G 4.0923 7.4247 105.5750 41.7528 0.0000 173.1160 76 Y 4.2675 8.2160 118.9239 61.6376 37.6839 179.4882 77 T 3.9844 8.0740 114.0919 66.8920 68.9790 176.2434 78 S 4.4644 8.2210 116.2878 61.9358 62.9119 176.3996 79 Q 4.0275 8.2870 120.7324 59.3290 28.5553 179.4719 80 V 3.5422 7.6096 118.7566 66.5493 31.3863 177.6582 81 Y 3.8566 8.2106 115.9818 60.8103 37.6502 178.5400 82 A 4.0924 7.9338 121.3306 55.1841 18.2638 179.5005 83 I 3.8585 8.4690 118.6439 64.3330 37.0462 178.6903 84 R 3.8120 7.9740 119.7229 59.5228 30.0943 178.2610 85 Q 4.3783 8.6058 120.5523 58.3882 28.8666 178.5216 86 A 3.9453 8.5445 122.2965 54.9984 18.4572 179.1749 87 L 3.9142 7.4510 116.6212 58.3755 41.6423 179.9672 88 S 4.1284 7.9708 114.4837 61.7757 62.8023 177.1784 89 K 4.0714 8.1970 121.1683 59.1924 31.6634 179.8200 90 G 3.5409 8.7923 106.4875 47.8989 0.0000 175.7210 91 I 3.6721 8.1162 123.1551 64.1476 36.8777 178.7751 92 V 3.6717 7.4562 117.8689 65.9518 31.4844 177.6165 93 A 4.1428 8.5276 120.9214 55.2141 18.1085 178.8529 94 Y 3.7026 8.8067 118.5461 61.2829 38.7684 178.0835 95 H 4.3157 8.0808 115.4622 58.5557 28.8246 177.4092 96 A 4.1420 7.5091 122.2491 54.9728 18.4624 178.7448 97 K 4.1279 8.0181 114.4923 57.7434 32.8442 177.4786 98 Y 4.3269 8.0817 114.5382 57.4280 38.3304 174.9276 99 V 4.4436 7.2251 118.4946 61.6676 34.6783 172.8906 100 D 4.4865 8.6303 120.1996 54.0465 40.5971 177.2524 101 E 3.9294 8.9943 124.6459 59.1284 29.2991 178.5207 102 N 4.3969 8.1147 117.0652 56.6781 39.0293 176.7222 103 S 4.1420 8.3736 116.1157 61.1091 62.8274 176.5027 104 K 3.9316 8.0045 122.7635 59.5686 32.1841 178.6609 105 R 3.9133 7.6365 117.2268 59.3387 29.9387 178.7026 106 E 3.9407 7.9579 117.9943 59.7806 29.4797 179.6164 107 I 3.7446 7.5236 119.6984 64.0257 37.1371 178.3312 108 K 3.8935 8.3262 120.8012 59.8305 32.1064 178.7072 109 E 4.0924 8.1484 118.4380 59.1790 29.4765 178.9978 110 Q 3.9639 8.0247 119.7435 59.3625 29.0931 178.8352 111 L 4.1168 8.2995 119.8536 58.1911 41.5893 179.0225 112 M 3.9876 8.2865 117.5497 58.9434 32.0294 178.6348 113 Q 4.1596 8.3635 116.8502 59.0684 28.9606 178.1754 114 Y 4.1141 7.5077 117.9605 59.2541 39.4715 175.0672 115 D 4.6611 8.1952 116.8031 53.1482 44.7730 175.2111 116 R 4.2147 8.6406 124.6476 58.5444 30.6339 178.5819 117 S 4.4445 9.4884 110.1866 59.3435 62.6233 174.5907 118 L 4.5735 7.8964 121.9793 55.4496 43.1553 177.6711 119 L 4.3021 7.8449 115.5741 56.0934 43.6365 176.8660 120 V 3.7987 7.8680 116.2055 62.6034 32.1152 174.3366 121 A 4.8237 8.0875 123.6938 49.8679 20.7839 175.8748 122 D 4.4416 8.7509 123.0326 53.4506 39.6076 173.9469 123 P 4.2582 0.0000 0.0000 65.5209 31.3347 177.1280 124 R 4.0479 7.7624 115.9332 55.8934 30.2496 176.3394 125 R 4.5556 8.0907 119.1040 56.1109 31.8387 174.4679 126 M 4.4258 8.4912 123.1347 55.0634 34.0436 175.1305 127 E 4.6350 8.2831 122.3437 53.0435 31.8713 173.8550 128 P 4.2870 0.0000 0.0000 62.6210 31.7707 176.4837 129 K 4.2774 8.2248 121.2710 56.7157 33.3505 175.6428 130 K 4.5817 8.0605 116.7248 55.1709 36.1068 176.9642 131 C 4.2257 8.9118 118.4281 59.9731 29.4620 174.9421 132 G 3.7386 8.0696 109.1469 47.7747 0.0000 173.7126 133 G 4.1660 7.5802 106.3974 46.4551 0.0000 173.3922 134 R 4.1533 8.8899 115.6278 58.1742 30.6451 176.2348 135 G 3.9438 7.5226 106.8487 44.4885 0.0000 172.4911 136 A 4.0313 8.7575 121.2959 55.1399 18.5314 179.1033 137 R 4.5981 7.6867 108.8484 56.1070 33.5027 175.0391 138 S 4.7120 7.8067 114.9182 57.4851 64.5549 172.8698 139 K 4.5700 8.0157 119.4617 54.7337 35.9251 175.8947 140 M 3.9043 8.6035 119.8224 56.0174 32.3557 176.1628 141 Q 4.1830 8.4957 123.5710 56.5958 29.3220 177.5035 142 K 4.4284 8.1032 117.5749 54.9685 33.6058 175.1237 143 A 4.2471 8.4286 126.2361 52.0865 18.3672 175.4661 144 Y 4.1359 8.1776 120.5341 54.7611 40.5040 176.1727 145 R 4.1668 8.1580 125.4977 57.0968 30.4317 176.3588 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 Q 8.34 4.36 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.61 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 4 Q 7.57 4.30 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.81 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 5 K 8.30 5.43 0.00 1.94 1.90 0.00 1.60 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.17 1.17 7.81 6 P 0.00 4.32 0.00 2.22 2.16 0.00 3.78 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 7 Q 8.32 4.55 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.87 0.00 8 L 7.61 5.04 0.00 1.61 1.47 0.95 0.95 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 9 V 8.27 4.42 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 0.89 0.00 0.00 0.42 0.00 0.00 10 Q 8.79 4.95 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.50 0.00 0.00 0.00 0.00 0.00 2.26 2.32 0.00 11 T 9.01 4.83 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 1.22 0.00 0.00 12 F 7.73 6.18 0.00 2.93 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 13 G 8.78 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.49 5.67 0.00 1.92 1.85 0.00 3.11 0.00 0.00 3.80 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 15 K 8.88 4.16 0.00 1.84 1.67 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.36 1.28 7.81 16 K 9.51 4.01 0.00 1.97 1.99 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.45 7.81 17 N 8.01 4.61 0.00 2.94 3.11 0.00 0.00 6.87 7.54 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 18 A 8.79 4.03 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 19 V 8.55 4.68 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 0.98 0.00 0.00 0.90 0.00 0.00 20 A 9.68 4.78 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 21 V 8.96 4.23 2.18 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 0.90 0.00 0.00 0.99 0.00 0.00 22 A 9.23 5.23 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 9.40 5.09 0.00 3.86 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 24 V 8.58 4.56 2.21 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 0.85 0.00 0.00 0.95 0.00 0.00 25 R 8.59 5.26 0.00 1.92 1.70 0.00 3.16 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.77 0.00 26 P 0.00 4.58 0.00 2.15 2.13 0.00 4.00 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.36 0.00 27 G 8.68 4.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 9.12 4.72 0.00 1.74 1.80 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.30 7.81 29 G 8.41 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 0.00 0.00 0.00 30 L 7.47 4.71 0.00 1.62 1.59 0.92 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.38 5.00 0.00 1.47 1.45 0.67 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.75 4.79 0.00 1.83 1.64 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.40 7.81 33 V 8.42 4.43 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 0.86 0.00 0.00 0.87 0.00 0.00 34 N 10.97 4.14 0.00 2.73 2.87 0.00 0.00 7.51 7.86 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 35 G 9.00 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 0.00 0.00 0.00 36 S 7.45 4.52 0.00 3.84 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 37 P 0.00 5.15 0.00 2.23 2.17 0.00 3.91 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 2.06 1.95 0.00 38 I 8.49 3.52 1.79 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.58 0.62 0.00 0.00 39 D 8.13 4.68 0.00 2.69 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 40 M 8.05 4.62 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 41 I 7.55 3.89 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.70 0.95 0.00 0.00 42 N 8.76 4.36 0.00 2.87 2.93 0.00 0.00 7.04 7.69 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 43 P 0.00 4.52 0.00 2.21 1.94 0.00 3.73 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.95 0.00 44 Q 8.40 3.93 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.09 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 45 I 7.51 3.82 1.86 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 1.51 1.05 0.91 0.00 0.00 46 L 7.86 4.06 0.00 1.67 1.66 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 8.29 4.00 0.00 2.26 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.51 2.67 0.00 48 A 7.95 4.12 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 49 K 8.12 3.78 0.00 1.91 1.68 0.00 1.59 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.43 1.47 7.81 50 I 7.33 3.62 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.36 0.62 0.00 0.00 51 Y 8.22 4.06 0.00 3.13 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 E 7.74 3.85 0.00 2.00 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 2.38 2.56 0.00 53 P 0.00 4.12 0.00 2.09 2.06 0.00 3.69 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 54 I 7.75 3.64 1.99 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.47 0.70 0.00 0.00 55 L 7.91 3.92 0.00 1.52 1.68 0.87 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.82 3.86 0.00 1.29 1.79 0.79 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.55 4.46 0.00 1.61 1.69 0.95 1.31 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 58 G 8.11 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 0.00 0.00 0.00 0.00 59 Q 9.24 4.77 0.00 2.16 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.82 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 60 Q 8.15 3.91 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.55 0.00 61 K 7.94 3.95 0.00 1.79 1.89 0.00 1.70 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.75 1.47 7.81 62 F 8.18 4.08 0.00 3.18 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 63 A 7.29 3.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 N 7.75 4.22 0.00 2.74 2.67 0.00 0.00 6.96 6.33 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 65 L 6.79 4.94 0.00 1.38 1.46 -0.23 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 66 D 9.13 5.14 0.00 2.49 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 67 I 8.68 4.79 1.85 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.71 0.88 0.00 0.00 68 R 8.94 4.92 0.00 1.84 2.03 0.00 2.71 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 69 I 9.12 5.20 1.97 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 0.94 0.95 0.00 0.00 70 R 9.21 5.18 0.00 1.67 1.78 0.00 3.07 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 71 V 8.35 4.88 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 1.23 0.00 0.00 0.99 0.00 0.00 72 R 8.35 4.59 0.00 1.78 1.75 0.00 3.26 0.00 0.00 3.21 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 73 G 8.10 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 74 S 8.22 4.45 0.00 3.94 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 75 G 7.42 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 76 Y 8.22 4.27 0.00 3.02 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 77 T 8.07 3.98 4.38 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 1.46 0.00 0.00 78 S 8.22 4.46 0.00 4.02 4.15 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 0.00 0.00 0.00 79 Q 8.29 4.03 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.46 2.60 0.00 80 V 7.61 3.54 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 0.92 0.00 0.00 1.04 0.00 0.00 81 Y 8.21 3.86 0.00 3.32 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 82 A 7.93 4.09 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.47 3.86 1.95 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 1.41 1.33 0.86 0.00 0.00 84 R 7.97 3.81 0.00 1.96 2.10 0.00 2.89 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 85 Q 8.61 4.38 0.00 2.34 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 86 A 8.54 3.95 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 87 L 7.45 3.91 0.00 1.92 1.70 0.78 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.97 4.13 0.00 4.10 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 89 K 8.20 4.07 0.00 1.94 1.72 0.00 1.60 0.00 0.00 1.23 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.64 7.81 90 G 8.79 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.12 3.67 1.89 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 1.39 0.82 0.97 0.00 0.00 92 V 7.46 3.67 2.22 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 0.83 0.00 0.00 1.06 0.00 0.00 93 A 8.53 4.14 1.40 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 94 Y 8.81 3.70 0.00 3.05 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 95 H 8.08 4.32 0.00 3.41 3.44 0.00 5.71 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.51 4.14 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.02 4.13 0.00 1.95 1.73 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.48 7.81 98 Y 8.08 4.33 0.00 2.26 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 99 V 7.23 4.44 2.42 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 0.90 0.00 0.00 1.10 0.00 0.00 100 D 8.63 4.49 0.00 2.78 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 0.00 101 E 8.99 3.93 0.00 2.08 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 2.39 2.46 0.00 102 N 8.11 4.40 0.00 2.84 2.80 0.00 0.00 6.98 7.42 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 0.00 103 S 8.37 4.14 0.00 4.01 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.00 3.93 0.00 1.90 2.09 0.00 1.76 0.00 0.00 2.17 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.56 7.81 105 R 7.64 3.91 0.00 2.04 2.13 0.00 3.36 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.84 0.00 106 E 7.96 3.94 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 107 I 7.52 3.74 1.86 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 1.35 0.83 0.91 0.00 0.00 108 K 8.33 3.89 0.00 1.98 1.93 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 109 E 8.15 4.09 0.00 2.10 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 2.34 2.41 0.00 110 Q 8.02 3.96 0.00 2.36 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 111 L 8.30 4.12 0.00 1.87 1.74 0.93 0.86 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 0.00 112 M 8.29 3.99 0.00 1.94 2.35 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.86 0.00 113 Q 8.36 4.16 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.98 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 114 Y 7.51 4.11 0.00 3.07 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 0.00 115 D 8.20 4.66 0.00 2.71 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 R 8.64 4.21 0.00 1.93 1.97 0.00 3.19 0.00 0.00 3.40 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 117 S 9.49 4.44 0.00 4.03 4.05 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 0.00 118 L 7.90 4.57 0.00 1.76 1.76 1.05 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.84 4.30 0.00 1.60 1.65 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.87 3.80 2.17 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 0.74 0.00 0.00 0.96 0.00 0.00 121 A 8.09 4.82 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 0.00 122 D 8.75 4.44 0.00 2.59 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 0.00 123 P 0.00 4.26 0.00 2.21 2.19 0.00 3.84 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 124 R 7.76 4.05 0.00 1.92 2.00 0.00 2.95 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 125 R 8.09 4.56 0.00 1.76 1.74 0.00 3.35 0.00 0.00 3.15 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 126 M 8.49 4.43 0.00 1.94 1.95 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 2.51 2.56 0.00 127 E 8.28 4.64 0.00 1.91 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 2.16 2.19 0.00 128 P 0.00 4.29 0.00 2.21 2.05 0.00 3.82 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 129 K 8.22 4.28 0.00 1.74 1.80 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.44 7.81 130 K 8.06 4.58 0.00 1.95 1.63 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.36 1.37 7.81 131 C 8.91 4.23 0.00 3.07 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 0.00 132 G 8.07 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 7.58 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 R 8.89 4.15 0.00 1.94 2.08 0.00 2.99 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 135 G 7.52 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 0.00 136 A 8.76 4.03 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 0.00 137 R 7.69 4.60 0.00 1.75 1.89 0.00 3.20 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 138 S 7.81 4.71 0.00 3.88 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 0.00 139 K 8.02 4.57 0.00 1.70 1.76 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.43 7.81 140 M 8.60 3.90 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.61 0.00 141 Q 8.50 4.18 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 142 K 8.10 4.43 0.00 1.89 2.11 0.00 1.91 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.65 7.81 143 A 8.43 4.25 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 0.00 144 Y 8.18 4.14 0.00 2.88 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 0.00 145 R 8.16 4.17 0.00 1.93 1.90 0.00 3.37 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00