NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 L 4.2620 8.1849 122.4857 54.8035 43.4103 175.6861 9 Q 4.4919 8.1911 123.2582 53.4911 31.3376 175.3741 10 L 4.0489 8.3947 123.4934 57.6424 42.2119 178.9823 11 S 4.4502 8.1276 114.9298 60.6804 62.1468 176.4785 12 S 4.2106 7.6474 115.9162 60.9894 62.3713 175.6114 13 V 4.4152 8.3064 113.6816 59.9086 32.1724 174.9358 14 L 4.8568 7.2880 118.4505 53.0842 41.9425 175.2016 15 N 5.0504 8.4430 123.0454 50.7995 39.8181 175.9713 16 R 3.9019 7.8714 116.8292 59.0354 30.2156 179.2906 17 E 4.0056 7.6217 116.4963 58.8757 29.6837 177.2643 18 C 4.6941 8.4015 115.2969 59.6073 29.6213 173.1218 19 T 5.1593 7.7652 116.6970 62.0218 69.7172 173.8132 20 R 4.7961 9.2925 127.0103 54.4923 33.8609 173.9156 21 S 4.8059 8.2418 117.2909 56.4680 66.0652 173.0482 22 R 3.9063 9.1680 119.9750 56.8223 28.2987 177.1165 23 V 3.6524 7.6299 116.9628 63.2129 32.0371 174.3658 24 H 5.0576 8.6715 123.9314 54.1463 30.3197 173.3047 25 C 4.7531 8.3634 117.9766 57.3508 32.0761 173.7458 26 Q 4.4962 8.5573 119.9233 55.9266 28.9834 175.4683 27 S 4.6111 7.3538 112.8731 56.1565 66.8700 175.1920 28 K 3.9766 8.4425 122.3871 59.4075 31.9263 178.4909 29 K 4.0162 7.9936 119.5241 59.5356 32.1675 178.6005 30 R 3.8564 7.7783 117.6318 59.3053 30.0794 178.1509 31 A 4.0516 8.0234 120.6218 55.4895 18.4825 179.7238 32 L 4.1496 8.4920 117.5670 57.7105 41.5819 179.7545 33 E 4.0249 8.3537 118.9203 59.3843 29.4566 179.1536 34 I 3.7011 8.2529 120.1921 64.6231 37.2438 178.5321 35 I 3.7460 7.9109 120.4497 64.5256 36.7536 178.6900 36 S 4.2139 8.0913 115.8799 61.5058 62.6294 176.5677 37 E 3.9519 8.3134 121.2647 59.5067 28.8121 179.1017 38 L 3.9492 7.9303 118.6617 58.1587 41.8317 179.6809 39 A 3.8224 8.0996 119.9786 54.5951 18.3274 179.5252 40 A 3.9128 8.0371 119.5567 55.2726 18.2772 179.4547 41 K 3.7654 7.8914 116.7766 60.1779 32.2504 178.6365 42 Q 4.1447 7.5582 116.4118 58.0490 28.7477 177.5226 43 L 4.3630 7.6157 117.3868 53.4436 43.2448 176.1759 44 S 3.7668 8.1735 114.3118 59.6753 60.5639 171.9339 45 L 4.8732 7.3640 117.4824 51.9147 45.9133 175.2880 46 P 4.4290 0.0000 0.0000 62.2137 32.3886 175.3598 47 P 4.2045 0.0000 0.0000 65.8186 31.3648 178.1191 48 Q 4.1421 8.3190 115.8425 59.7014 27.9838 179.3884 49 V 3.6122 8.2065 120.1106 65.7885 31.6225 178.1957 50 V 3.6083 7.7908 117.5802 65.8657 31.4071 177.5324 51 F 4.3128 8.6630 122.1083 60.9282 39.2141 176.8685 52 E 3.9410 8.5077 117.9459 59.2451 29.1083 179.0331 53 A 3.9605 7.9559 120.7127 55.5509 18.4029 179.8548 54 I 3.7152 7.6533 117.9980 64.3000 37.0418 178.5168 55 L 3.6476 7.9976 121.6686 58.2242 41.6053 178.9373 56 T 3.7807 7.8639 115.2134 66.7679 68.6847 176.1367 57 R 3.9847 7.4764 119.8607 59.3040 30.0530 177.9660 58 E 4.1186 8.2966 119.3297 59.2774 29.3340 178.6317 59 K 4.1065 8.0888 116.9321 58.4780 32.1667 178.3488 60 M 4.3207 8.1413 119.1105 55.5819 32.6507 176.8182 61 G 4.0906 6.8404 106.1494 44.6436 0.0000 172.9941 62 S 4.3313 8.8529 118.7249 58.9456 62.9150 173.7784 63 T 4.3464 9.0950 116.9196 61.6149 69.0803 174.5463 64 G 4.0803 8.0061 112.9919 45.1233 0.0000 174.0285 65 I 4.0192 7.9912 119.5544 60.2879 37.4361 177.3306 66 G 3.9662 7.8112 106.1727 46.8026 0.0000 172.8541 67 N 4.2568 8.7375 113.4034 53.6279 36.4847 175.3874 68 G 4.1911 8.1578 101.6244 47.1187 0.0000 172.6548 69 I 4.9875 7.2594 119.0715 59.1637 40.1581 174.6964 70 A 4.6427 8.6763 126.6783 50.4133 22.5199 175.2916 71 I 5.9367 8.4570 122.8025 57.6672 37.2988 173.2085 72 P 4.7207 0.0000 0.0000 62.8771 32.8089 174.8297 73 H 5.2613 8.5294 117.0744 55.0908 31.3540 172.7184 74 G 4.3148 8.7974 105.3470 45.3081 0.0000 171.9203 75 K 5.1734 8.6075 120.5605 55.5112 34.8127 176.0812 76 L 4.9890 8.4822 123.9621 53.7030 45.2136 175.8361 77 E 4.5319 8.6528 118.9099 56.5130 30.6006 177.5395 78 E 4.2720 8.9626 120.0649 58.9660 29.6636 178.8235 79 D 4.6052 8.0156 116.0980 55.1027 39.6235 177.3905 80 T 3.9302 8.0838 118.1407 64.4854 68.6132 177.2430 81 L 3.7350 7.8221 119.4110 56.7857 41.3977 174.4106 82 R 4.6200 8.0645 113.1780 54.6806 32.4292 173.7210 83 A 4.7602 8.3304 120.6339 50.6780 20.7733 176.6146 84 V 4.3610 8.6353 121.4197 60.9641 34.3231 174.7234 85 G 4.3441 8.9382 114.7296 44.3705 0.0000 172.5948 86 V 4.6710 8.2313 120.9576 60.7106 35.5103 174.2311 87 F 5.2401 9.3904 128.9695 56.7367 42.5214 173.5950 88 V 4.6965 8.0790 119.3097 59.3526 35.5718 174.6165 89 Q 4.5120 8.1552 125.0261 54.1870 30.8941 174.6023 90 L 4.6092 8.5302 127.6403 54.4141 42.0107 177.3007 91 E 4.1595 9.3694 125.1363 58.6430 30.3353 177.1606 92 T 4.7561 7.5670 108.9597 58.6418 71.1770 172.4283 93 P 4.7181 0.0000 0.0000 63.0147 32.1249 175.5044 94 I 4.7103 8.7308 115.5692 58.7396 40.7891 174.6049 95 A 4.4319 8.6243 125.7461 52.0152 18.7746 177.1234 96 F 4.5438 8.5194 122.0794 57.0461 40.4658 173.9193 97 D 4.3734 8.4745 115.4487 54.9302 39.5477 173.6018 98 A 4.3395 7.9392 118.6460 51.4655 19.0492 179.4099 99 I 3.7941 8.0399 121.0547 63.8588 37.2959 177.1606 100 D 4.8393 7.8739 117.6103 52.6067 39.7432 176.8529 101 N 4.7114 8.4790 122.4438 54.6425 40.0086 174.8394 102 Q 4.1334 8.0780 118.8012 55.3407 29.9750 173.6161 103 P 4.9392 0.0000 0.0000 62.7757 33.2947 174.8027 104 V 4.7037 8.9028 121.4248 61.4810 33.6718 175.5505 105 D 4.8203 8.9713 123.1782 52.4574 41.9799 174.4587 106 L 4.8262 7.8027 119.8160 52.9931 45.1454 175.2551 107 L 5.8418 8.3280 123.3316 51.6703 45.8860 175.3985 108 F 5.2438 9.0404 124.8356 56.5377 42.1995 173.1523 109 A 5.8817 8.6226 128.5687 49.5181 22.0363 174.9774 110 L 4.9713 8.4479 122.5685 53.3409 45.4622 175.0742 111 L 4.9691 9.0906 128.0920 53.5210 43.3397 175.7785 112 V 4.6919 8.4052 124.6748 60.0927 34.1957 173.3549 113 P 4.6320 0.0000 0.0000 62.3999 31.9733 177.0484 114 A 3.9521 8.4859 126.7657 55.4917 18.6265 178.3788 115 D 4.8291 8.0673 112.9739 53.6451 39.8620 177.0310 116 Q 4.6484 8.4066 117.0767 55.5185 30.5269 177.2997 117 T 4.0148 8.1212 111.5595 64.6665 68.6902 176.1430 118 K 4.1245 7.9593 121.1244 59.5506 32.2158 179.2745 119 T 3.9543 7.7548 115.4426 66.9792 68.5702 175.9391 120 H 4.6227 7.9355 117.1041 56.4221 28.6212 177.1588 121 L 3.9892 7.6930 123.6377 58.1823 41.8732 178.3748 122 H 4.2885 8.3198 116.4079 58.7118 28.6199 177.8740 123 T 3.9051 7.7577 117.4127 66.2763 68.3375 176.3440 124 L 3.9876 8.0583 122.3346 58.2172 42.0974 178.7599 125 S 4.0160 8.0514 113.0063 61.3509 62.1640 175.9137 126 L 3.8334 7.8197 122.7059 58.1465 41.7914 178.8484 127 V 3.1905 7.6818 117.8261 65.8332 31.1559 177.4092 128 A 3.9041 7.7407 119.3226 55.3225 18.6507 179.0273 129 K 3.9057 8.0972 117.8617 59.7004 32.1683 178.8897 130 R 3.8259 8.0712 119.1028 59.3452 29.8943 177.9714 131 L 4.2062 7.8099 115.3387 55.8695 41.7048 178.2460 132 A 4.2588 7.5325 120.4696 52.5295 18.9886 176.9514 133 D 4.5133 7.6198 118.7585 53.3526 42.0816 177.2498 134 K 4.0029 8.7380 126.4753 59.7651 32.0612 179.2643 135 T 3.8271 7.9342 112.9267 65.0879 67.3311 175.9757 136 I 3.6660 8.0931 121.7984 64.8330 37.1331 178.1409 137 C 4.1784 7.8830 116.8580 62.7785 27.7182 176.3112 138 R 3.9244 7.9214 118.5954 59.3497 29.9429 179.0079 139 R 4.0824 8.1101 117.6461 59.4359 29.6706 179.0562 140 L 4.0592 8.2762 119.0170 58.0301 41.4368 179.6012 141 R 3.7921 8.1816 115.9244 57.9344 30.1515 177.8340 142 A 4.3308 7.9064 119.5738 52.3014 19.8229 177.5107 143 A 4.1889 6.8289 119.3181 53.3218 18.7737 177.3880 144 Q 4.6444 8.7924 118.6008 55.5606 30.3428 176.4890 145 S 4.7856 7.5601 112.6796 55.7271 67.6188 174.4056 146 D 4.4033 8.6721 122.8779 57.5965 40.5159 178.7908 147 E 4.0439 8.1449 119.5366 58.9338 29.7104 178.2315 148 E 3.9422 8.2358 119.4306 59.3196 29.6985 178.3869 149 L 4.0436 8.1528 119.1313 58.2961 41.8116 178.7328 150 Y 4.0548 8.1835 118.9511 61.1241 38.8025 177.7220 151 Q 3.9554 8.5138 120.2437 59.6099 28.8324 178.4769 152 I 3.6230 7.9908 120.2293 64.7350 37.4189 178.1718 153 I 3.5997 7.6267 118.1770 63.8134 37.8112 177.4509 154 T 3.8286 7.3896 109.2303 62.0580 68.9086 175.1516 155 D 4.5271 7.5455 119.1477 54.8669 40.8480 174.9421 156 T 4.2343 6.8248 114.8078 60.1357 66.9569 174.7534 157 E 4.4802 8.2149 123.6918 56.5675 29.1977 176.3282 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 8 L 8.18 4.26 0.00 1.59 1.61 0.93 0.38 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 9 Q 8.19 4.49 0.00 2.17 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 10 L 8.39 4.05 0.00 1.59 1.63 0.68 0.78 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 11 S 8.13 4.45 0.00 4.14 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 12 S 7.65 4.21 0.00 3.89 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 13 V 8.31 4.42 2.14 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 0.81 0.00 0.00 1.12 0.00 0.00 14 L 7.29 4.86 0.00 1.86 1.75 1.02 0.59 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 15 N 8.44 5.05 0.00 2.94 2.96 0.00 0.00 6.23 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 16 R 7.87 3.90 0.00 1.64 1.77 0.00 2.88 0.00 0.00 3.31 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.71 0.00 17 E 7.62 4.01 0.00 2.14 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 2.32 2.29 0.00 18 C 8.40 4.69 0.00 2.92 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 7.77 5.16 4.55 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 0.00 0.00 0.00 1.59 0.00 0.00 20 R 9.29 4.80 0.00 1.84 1.68 0.00 3.08 0.00 0.00 3.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 21 S 8.24 4.81 0.00 3.86 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 22 R 9.17 3.91 0.00 1.95 1.97 0.00 3.24 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.54 0.00 23 V 7.63 3.65 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 0.95 0.00 0.00 0.92 0.00 0.00 24 H 8.67 5.06 0.00 3.10 3.21 0.00 5.96 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 25 C 8.36 4.75 0.00 3.05 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.56 4.50 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 27 S 7.35 4.61 0.00 4.00 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 28 K 8.44 3.98 0.00 1.79 1.66 0.00 0.94 0.00 0.00 1.32 0.00 0.00 2.35 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 0.25 7.81 29 K 7.99 4.02 0.00 1.90 1.82 0.00 1.82 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.70 7.81 30 R 7.78 3.86 0.00 2.01 2.08 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 31 A 8.02 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.49 4.15 0.00 2.11 1.84 0.76 1.00 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 33 E 8.35 4.02 0.00 2.19 1.88 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 1.64 2.31 0.00 34 I 8.25 3.70 2.04 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 1.52 0.81 0.91 0.00 0.00 35 I 7.91 3.75 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.00 0.92 0.00 0.00 36 S 8.09 4.21 0.00 4.24 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 37 E 8.31 3.95 0.00 2.19 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 2.32 2.34 0.00 38 L 7.93 3.95 0.00 1.86 1.73 0.91 0.84 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 39 A 8.10 3.82 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 40 A 8.04 3.91 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.89 3.77 0.00 1.91 1.87 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.50 7.81 42 Q 7.56 4.14 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.53 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 43 L 7.62 4.36 0.00 1.65 1.71 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.17 3.77 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.36 4.87 0.00 1.58 1.52 0.93 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.43 0.00 2.44 2.19 0.00 3.74 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 2.08 1.99 0.00 47 P 0.00 4.20 0.00 2.08 2.16 0.00 3.88 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 48 Q 8.32 4.14 0.00 2.27 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 49 V 8.21 3.61 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 1.00 0.00 0.00 0.95 0.00 0.00 50 V 7.79 3.61 2.29 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 1.01 0.00 0.00 0.96 0.00 0.00 51 F 8.66 4.31 0.00 3.09 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 52 E 8.51 3.94 0.00 2.33 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 2.44 2.53 0.00 53 A 7.96 3.96 1.46 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 54 I 7.65 3.72 1.71 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 0.61 0.82 0.00 0.00 55 L 8.00 3.65 0.00 1.23 1.56 0.66 0.67 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 56 T 7.86 3.78 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 57 R 7.48 3.98 0.00 1.96 2.03 0.00 3.10 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.54 0.00 58 E 8.30 4.12 0.00 2.13 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 2.14 2.29 0.00 59 K 8.09 4.11 0.00 1.86 1.81 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.64 7.81 60 M 8.14 4.32 0.00 1.93 2.25 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.53 0.00 61 G 6.84 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 62 S 8.85 4.33 0.00 4.03 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 63 T 9.10 4.35 4.45 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 1.28 0.00 0.00 64 G 8.01 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 65 I 7.99 4.02 1.88 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 1.23 0.65 0.93 0.00 0.00 66 G 7.81 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 67 N 8.74 4.26 0.00 2.88 2.90 0.00 0.00 6.92 7.28 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 68 G 8.16 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 I 7.26 4.99 1.98 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.06 0.92 0.00 0.00 70 A 8.68 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 I 8.46 5.94 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 1.34 0.38 1.13 0.00 0.00 72 P 0.00 4.72 0.00 2.14 2.06 0.00 3.75 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 2.22 2.30 0.00 73 H 8.53 5.26 0.00 3.28 3.26 0.00 5.57 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.80 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.61 5.17 0.00 1.87 1.82 0.00 1.55 0.00 0.00 1.72 0.00 0.00 2.73 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.45 7.81 76 L 8.48 4.99 0.00 1.57 1.65 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.65 4.53 0.00 2.05 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 2.28 0.00 78 E 8.96 4.27 0.00 2.04 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 2.41 2.27 0.00 79 D 8.02 4.61 0.00 2.77 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 80 T 8.08 3.93 4.28 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 1.30 0.00 0.00 81 L 7.82 3.73 0.00 1.86 1.88 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 82 R 8.06 4.62 0.00 1.89 1.91 0.00 3.07 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 83 A 8.33 4.76 1.02 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 0.00 0.00 84 V 8.64 4.36 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 0.91 0.00 0.00 0.94 0.00 0.00 85 G 8.94 4.34 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 0.00 86 V 8.23 4.67 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 1.01 0.00 0.00 0.88 0.00 0.00 87 F 9.39 5.24 0.00 3.14 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 88 V 8.08 4.70 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 0.68 0.00 0.00 0.80 0.00 0.00 89 Q 8.16 4.51 0.00 1.93 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.01 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 90 L 8.53 4.61 0.00 1.51 1.64 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 91 E 9.37 4.16 0.00 1.65 1.75 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 2.23 2.26 0.00 92 T 7.57 4.76 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 1.22 0.00 0.00 93 P 0.00 4.72 0.00 2.10 2.09 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 94 I 8.73 4.71 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.35 0.96 0.00 0.00 95 A 8.62 4.43 1.28 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 96 F 8.52 4.54 0.00 2.90 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 97 D 8.47 4.37 0.00 2.77 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 98 A 7.94 4.34 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 99 I 8.04 3.79 2.07 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 1.37 0.47 0.93 0.00 0.00 100 D 7.87 4.84 0.00 2.78 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 0.00 101 N 8.48 4.71 0.00 2.93 3.04 0.00 0.00 7.00 7.23 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 0.00 102 Q 8.08 4.13 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 103 P 0.00 4.94 0.00 2.18 2.19 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 104 V 8.90 4.70 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.70 0.00 0.00 105 D 8.97 4.82 0.00 2.90 2.77 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 0.00 0.00 0.00 106 L 7.80 4.83 0.00 1.58 1.67 1.02 0.60 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 0.00 107 L 8.33 5.84 0.00 1.51 1.46 0.81 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 108 F 9.04 5.24 0.00 3.36 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 0.00 109 A 8.62 5.88 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 0.00 110 L 8.45 4.97 0.00 1.95 1.62 1.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 111 L 9.09 4.97 0.00 1.66 1.59 1.00 0.57 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 0.00 112 V 8.41 4.69 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 1.03 0.00 0.00 0.94 0.00 0.00 113 P 0.00 4.63 0.00 2.14 1.97 0.00 3.72 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 2.14 2.19 0.00 114 A 8.49 3.95 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 0.00 115 D 8.07 4.83 0.00 2.85 2.90 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 0.00 116 Q 8.41 4.65 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 117 T 8.12 4.01 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 1.36 0.00 0.00 118 K 7.96 4.12 0.00 1.79 1.90 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.53 1.47 7.81 119 T 7.75 3.95 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 1.17 0.00 0.00 120 H 7.94 4.62 0.00 3.32 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.69 3.99 0.00 1.94 1.67 0.89 0.91 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 0.00 122 H 8.32 4.29 0.00 3.42 3.32 0.00 5.86 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 0.00 123 T 7.76 3.91 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 1.28 0.00 0.00 124 L 8.06 3.99 0.00 1.84 1.77 0.89 0.54 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 0.00 125 S 8.05 4.02 0.00 4.04 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 0.00 126 L 7.82 3.83 0.00 1.84 1.83 0.87 0.80 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 0.00 127 V 7.68 3.19 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 0.36 0.00 0.00 0.06 0.00 0.00 128 A 7.74 3.90 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 0.00 129 K 8.10 3.91 0.00 2.08 1.88 0.00 1.50 0.00 0.00 1.54 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.46 7.81 130 R 8.07 3.83 0.00 1.84 1.88 0.00 2.95 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 131 L 7.81 4.21 0.00 1.61 1.70 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 132 A 7.53 4.26 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 0.00 133 D 7.62 4.51 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.74 4.00 0.00 1.83 1.84 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.49 7.81 135 T 7.93 3.83 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 1.24 0.00 0.00 136 I 8.09 3.67 1.99 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 1.73 0.75 0.85 0.00 0.00 137 C 7.88 4.18 0.00 3.14 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 0.00 138 R 7.92 3.92 0.00 1.99 2.00 0.00 3.34 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.84 0.00 139 R 8.11 4.08 0.00 2.02 1.98 0.00 3.13 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.94 0.00 140 L 8.28 4.06 0.00 1.92 1.91 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 141 R 8.18 3.79 0.00 1.95 1.99 0.00 3.16 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 142 A 7.91 4.33 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 0.00 143 A 6.83 4.19 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 0.00 144 Q 8.79 4.64 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.63 0.00 0.00 0.00 0.00 0.00 2.30 2.27 0.00 145 S 7.56 4.79 0.00 4.00 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 0.00 146 D 8.67 4.40 0.00 2.81 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 0.00 147 E 8.14 4.04 0.00 2.09 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 0.00 2.40 2.47 0.00 148 E 8.24 3.94 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 149 L 8.15 4.04 0.00 2.13 1.98 1.08 1.21 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 0.00 150 Y 8.18 4.05 0.00 3.23 3.17 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 0.00 151 Q 8.51 3.96 0.00 2.52 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.53 0.00 0.00 0.00 0.00 0.00 2.40 2.64 0.00 152 I 7.99 3.62 1.97 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.88 0.88 0.00 0.00 153 I 7.63 3.60 1.29 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.36 0.53 0.00 0.00 154 T 7.39 3.83 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 0.34 0.00 0.00 155 D 7.55 4.53 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 T 6.82 4.23 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 157 E 8.21 4.48 0.00 2.04 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 0.00 2.14 2.15 0.00