NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3041 8.2644 123.5810 52.1147 19.9983 177.3661 3 R 3.9440 7.9362 122.9684 58.5675 31.2056 174.9562 4 R 3.9069 8.5222 117.4223 57.7546 30.5931 176.6776 5 R 4.3014 8.1476 119.7297 56.0169 31.8513 177.0825 6 R 4.0068 8.3849 119.5109 56.9180 29.7334 177.3268 7 A 3.5018 7.9524 119.6270 52.6848 17.8276 177.0071 8 E 4.3718 8.5226 116.1382 55.9009 31.7027 175.2580 9 V 3.3221 8.1491 122.7285 62.4244 32.1666 175.4040 10 R 4.1301 8.4576 127.6359 55.7760 30.7400 174.9589 11 Q 4.3732 8.4523 126.2191 54.7423 30.1241 175.3208 12 L 4.4249 8.2639 125.2561 53.9699 43.2357 175.1896 13 Q 4.6278 8.1607 120.0074 53.4826 30.8024 173.2714 14 P 4.3760 0.0000 0.0000 62.7645 32.2513 174.9913 15 D 4.7477 8.5469 119.2051 53.6087 41.6986 177.6597 16 L 4.4178 8.6818 123.9447 55.3265 41.1857 177.2558 17 V 4.3341 7.8393 117.2601 64.4234 36.1442 175.1263 18 Y 4.2739 8.3624 113.1790 56.7461 39.3087 175.7602 19 G 4.0780 8.4293 108.7572 46.2717 0.0000 173.3530 20 D 4.8719 7.5342 116.0867 51.8884 45.9370 175.4637 21 V 3.7465 8.4838 119.8706 64.2707 31.7002 178.5174 22 L 3.9601 8.9679 120.4583 58.3735 41.8865 179.0723 23 V 3.7597 8.3694 116.4593 66.0029 31.4017 177.5849 24 T 4.1585 7.7527 108.0672 64.5001 69.2654 176.4790 25 A 3.9554 7.8185 124.1867 54.9394 17.7675 179.3596 26 F 4.2728 8.2877 118.6465 61.5314 39.4553 177.3930 27 I 3.3171 7.7205 119.5408 64.2282 36.7986 177.9387 28 N 4.2317 7.6446 115.9244 56.3379 38.1273 177.4607 29 K 3.8400 7.2532 117.7419 59.5643 32.2727 179.2694 30 I 3.6187 6.8336 117.6402 62.6486 37.2912 176.3485 31 M 4.1436 7.2797 120.2039 55.1102 32.9939 175.5411 32 R 4.4446 7.9326 123.3808 55.5078 33.0771 175.1545 33 D 4.3771 9.5168 122.5284 55.4527 38.0067 175.1596 34 G 3.8971 8.4184 105.2932 46.3174 0.0000 176.3343 35 K 4.3447 7.4765 120.6540 55.8384 27.9965 177.5110 36 K 3.9195 7.7155 123.0655 59.3220 32.6498 177.1809 37 N 4.2780 8.1001 117.0910 56.5225 38.9751 176.4387 38 L 3.9359 7.7995 120.9671 57.7222 42.2249 178.2879 39 A 3.8674 8.0090 120.5416 55.1509 17.8960 179.1366 40 A 3.7110 8.4048 119.2955 56.2007 18.4211 179.3104 41 R 3.6722 7.8073 114.5289 59.8067 30.0258 179.1020 42 I 3.6834 7.9126 118.3740 64.8206 37.4378 177.4359 43 F 4.4459 7.8739 121.1408 62.3019 39.0889 176.8371 44 Y 4.0814 7.4395 115.0324 61.3101 37.5851 178.2754 45 D 4.4586 8.6176 118.6762 57.2547 41.0657 178.7230 46 A 4.2929 8.1536 120.9929 55.0499 19.2117 179.1338 47 C 3.8404 8.3198 115.4628 62.7973 28.0660 176.6806 48 K 4.0456 8.1401 121.2872 59.5784 31.8025 178.7426 49 I 3.8215 8.0188 120.4875 64.5462 36.9034 178.1124 50 I 3.7077 7.8254 119.9620 64.6375 36.7643 177.8252 51 Q 4.1773 7.3893 117.3059 59.1117 28.7541 178.6675 52 E 3.8073 8.4908 116.7894 60.5779 29.6456 179.4417 53 K 4.2165 8.7186 120.3976 57.6890 32.7371 177.2795 54 T 4.6926 8.2956 113.5424 59.9545 70.4835 174.6683 55 G 3.6931 8.6689 115.2277 47.3736 0.0000 173.8084 56 Q 4.0476 7.7359 119.3353 56.1464 29.3840 176.2403 57 E 4.5074 7.9776 116.6483 55.2432 29.8369 175.8444 58 P 3.7070 0.0000 0.0000 64.2515 32.1277 177.7464 59 L 4.0053 8.0838 120.5058 58.1261 42.4511 179.4815 60 K 4.3047 8.6100 119.4794 58.4330 32.9662 179.0272 61 V 3.5706 7.8410 118.1531 65.9923 31.1959 177.5408 62 F 4.2355 8.7684 120.2849 60.4418 38.8368 176.6044 63 K 3.6307 7.1135 118.7605 59.1395 32.1702 177.9548 64 Q 4.0290 7.8573 119.5563 59.2167 28.9160 177.1848 65 A 3.9265 8.1268 121.7499 55.0098 17.9416 179.4384 66 V 3.2925 7.2040 114.8102 66.2325 31.1376 178.3262 67 E 3.9598 7.7516 118.2321 58.8557 29.1666 177.2311 68 N 5.4228 8.0743 115.1989 53.4235 39.2932 176.0116 69 V 4.4325 7.3989 119.8931 62.5844 33.5550 176.0513 70 K 3.9859 7.5490 119.6864 55.7291 31.9782 174.6006 71 P 4.7469 0.0000 0.0000 61.9891 32.1746 175.6589 72 R 4.0514 9.1426 124.2753 59.2602 29.9318 175.3680 73 M 5.4092 7.6429 113.0941 54.0401 36.8097 173.2953 74 E 4.7859 9.5310 117.0755 55.6406 33.8832 174.4970 75 V 5.3634 8.2743 113.3754 59.3351 32.9888 175.7848 76 R 4.5424 8.4599 124.8332 54.6219 32.4142 177.9624 77 S 4.3823 8.5174 115.4451 60.4433 62.6875 173.1592 78 R 4.1089 7.2954 118.7512 56.4842 32.0148 173.9022 79 R 4.6963 7.7604 120.5134 54.5326 31.7777 175.9230 80 V 3.4352 8.5946 123.5452 62.3666 32.0075 174.7118 81 G 3.2928 8.9500 107.1408 45.8743 0.0000 174.5690 82 G 3.8369 8.4601 112.2481 45.3199 0.0000 170.9769 83 A 4.4585 7.3654 123.1497 50.2254 21.5476 176.7073 84 N 5.7907 8.0494 119.6408 51.6463 38.6301 175.2438 85 Y 4.1010 7.1101 115.3470 58.1396 38.9960 178.1079 86 Q 4.1402 8.6563 124.2222 56.0217 28.9677 175.9870 87 V 4.2164 8.2453 125.1564 61.5375 33.2934 173.6860 88 P 5.2311 0.0000 0.0000 62.3703 32.9398 175.0499 89 M 4.4323 8.3942 116.0476 54.6294 34.5311 174.4640 90 E 4.3459 9.0961 120.0943 56.7589 30.8150 176.7671 91 V 4.1820 7.8462 122.4749 61.0933 32.5574 175.4299 92 S 3.9857 8.7249 122.3485 58.0685 62.9864 172.9943 93 P 4.1285 0.0000 0.0000 66.6283 30.2514 178.6470 94 R 3.8806 7.9216 117.0142 58.7537 30.0163 178.9073 95 R 3.7184 7.7938 117.9206 59.2290 30.3263 177.7469 96 Q 3.8064 8.6889 120.7608 59.6004 28.8997 179.1045 97 Q 3.8812 7.9584 120.0599 59.1316 28.9701 177.9333 98 S 4.0059 7.4019 115.8865 61.7497 62.8194 176.2048 99 L 3.1838 7.7287 120.7664 58.1952 41.4289 179.2764 100 A 3.7340 7.4860 118.9840 55.6313 18.1777 179.3176 101 L 4.0321 8.3107 116.0080 58.3552 42.0009 179.4252 102 R 3.8214 8.0306 118.0302 59.5542 29.8121 177.9944 103 W 4.7035 8.4337 118.3907 60.3180 29.1587 178.1823 104 L 4.1395 8.0943 118.0659 58.1985 41.1499 179.6049 105 V 3.8886 7.9017 117.3035 66.4009 31.3178 177.6920 106 Q 3.9651 8.0251 115.9797 59.3864 28.9212 179.0540 107 A 4.1474 8.9093 121.1708 55.3994 18.2924 179.2215 108 A 4.0733 8.6320 119.0452 55.6032 18.7573 178.9558 109 N 4.6550 8.1728 113.4588 54.6614 38.6733 176.6594 110 Q 4.3352 8.3172 118.5292 56.1859 28.5205 175.8539 111 R 4.6075 7.4771 117.1324 54.3108 31.7306 174.4677 112 P 4.6767 0.0000 0.0000 62.9060 31.6285 176.1731 113 E 4.1810 7.8302 118.2594 56.4075 29.3658 176.2791 114 R 3.9387 7.8205 120.9591 58.5334 30.7113 179.2257 115 R 4.0556 7.6988 119.0800 57.0133 31.3169 176.7445 116 A 4.4444 8.4763 117.7764 54.5562 19.8936 178.7981 117 A 3.9385 7.8135 118.7583 55.5659 18.4940 179.6623 118 V 3.5353 7.9111 110.1064 65.2539 31.5806 178.3394 119 R 3.8561 8.0328 117.0739 59.5824 29.6884 178.7255 120 I 3.8081 7.8555 118.8822 65.2854 37.5268 177.3336 121 A 4.0636 9.2949 121.9319 53.6171 17.8748 179.1064 122 H 4.0674 8.4221 113.8904 58.3319 29.4805 177.0921 123 E 4.0550 9.0858 120.9783 58.9467 29.3653 178.3865 124 L 4.2854 8.8487 119.4191 56.8765 41.7313 178.7544 125 M 4.2168 7.9580 118.2499 57.7503 31.9469 178.1633 126 D 4.3079 8.1241 119.1111 56.9268 41.1272 178.1514 127 A 3.9536 7.4737 119.7950 55.6274 18.4563 179.0709 128 A 4.0051 7.7474 117.3256 55.4132 18.3500 179.0353 129 E 4.1854 7.2962 113.8547 58.5571 29.8877 177.2155 130 G 4.3211 8.4039 108.0574 45.4860 0.0000 174.0770 131 K 4.6205 7.9743 115.4058 55.1120 32.6789 175.2097 132 G 4.3427 7.6918 104.9409 43.1039 0.0000 172.7583 133 G 3.6630 8.5557 105.9513 47.6848 0.0000 175.8224 134 A 4.1004 7.8504 122.3779 54.8564 18.6544 179.6361 135 V 3.7087 7.6005 116.6084 65.9848 31.7315 177.5999 136 K 3.8187 7.9341 119.2569 59.5704 31.8094 178.5001 137 K 3.7079 7.6240 114.9191 57.3367 32.0853 177.3196 138 K 3.9227 7.9435 120.0381 58.0568 33.5607 177.5700 139 E 3.9060 8.3642 119.0718 59.8520 29.4553 178.5543 140 D 4.2306 8.0821 116.9253 57.7732 40.9393 178.3954 141 V 3.6209 7.5822 117.6572 65.6282 31.5777 176.9214 142 E 4.3976 7.7589 117.0960 58.4438 29.8482 178.3297 143 R 3.9056 8.1883 117.7993 59.5017 29.9710 178.4380 144 M 4.1413 8.0447 118.1511 57.7149 32.0959 177.0750 145 A 4.0479 7.1593 120.3514 52.8030 19.5068 178.1158 146 E 3.6816 8.9055 122.4255 57.2374 29.7304 176.2606 147 A 4.1126 8.8298 121.2122 53.9578 18.9350 177.6552 148 N 4.8747 7.7986 111.7607 53.1135 38.7971 176.4354 149 R 3.8382 7.4626 118.5638 58.1009 30.3835 177.5466 150 A 3.9495 8.1238 120.9862 56.2443 18.5963 179.8829 151 Y 4.2899 7.2346 110.5509 58.4278 37.2919 176.5219 152 A 4.4137 8.1164 122.3738 52.8815 19.0939 178.9384 153 H 4.8468 8.0313 110.9404 56.0317 28.8209 175.2409 154 Y 4.7049 7.5935 116.0350 60.4337 39.1327 177.7374 155 R 3.8153 9.0429 116.2816 57.8478 29.7311 176.3318 156 W 4.1098 8.2916 115.9316 56.9723 29.6271 173.9662 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 A 8.26 4.30 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 3 R 7.94 3.94 0.00 1.86 1.95 0.00 3.23 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 4 R 8.52 3.91 0.00 1.83 1.73 0.00 3.25 0.00 0.00 3.22 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 5 R 8.15 4.30 0.00 1.77 1.84 0.00 3.24 0.00 0.00 3.14 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 6 R 8.38 4.01 0.00 1.74 1.89 0.00 3.36 0.00 0.00 3.21 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 7 A 7.95 3.50 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 8 E 8.52 4.37 0.00 1.91 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 2.21 2.28 0.00 9 V 8.15 3.32 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 0.74 0.00 0.00 0.92 0.00 0.00 10 R 8.46 4.13 0.00 1.80 1.80 0.00 3.27 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 11 Q 8.45 4.37 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 12 L 8.26 4.42 0.00 1.70 1.63 1.03 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.16 4.63 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.94 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 14 P 0.00 4.38 0.00 2.12 2.05 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 15 D 8.55 4.75 0.00 3.06 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 16 L 8.68 4.42 0.00 1.81 1.74 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.84 4.33 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.28 0.00 0.00 0.70 0.00 0.00 18 Y 8.36 4.27 0.00 3.13 3.03 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 19 G 8.43 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 20 D 7.53 4.87 0.00 2.80 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.48 3.75 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 0.94 0.00 0.00 0.97 0.00 0.00 22 L 8.97 3.96 0.00 1.74 1.97 0.89 0.72 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 23 V 8.37 3.76 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 1.11 0.00 0.00 24 T 7.75 4.16 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 1.44 0.00 0.00 25 A 7.82 3.96 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 26 F 8.29 4.27 0.00 3.33 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 27 I 7.72 3.32 1.88 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 1.13 0.85 0.74 0.00 0.00 28 N 7.64 4.23 0.00 2.90 2.82 0.00 0.00 7.03 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 29 K 7.25 3.84 0.00 1.56 1.73 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.58 7.81 30 I 6.83 3.62 1.67 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.23 0.74 0.00 0.00 31 M 7.28 4.14 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.46 0.00 32 R 7.93 4.44 0.00 1.82 1.74 0.00 3.28 0.00 0.00 3.31 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 33 D 9.52 4.38 0.00 2.82 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 34 G 8.42 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 35 K 7.48 4.34 0.00 1.92 1.76 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 36 K 7.72 3.92 0.00 1.79 1.78 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.45 7.81 37 N 8.10 4.28 0.00 2.86 2.79 0.00 0.00 6.88 6.66 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 38 L 7.80 3.94 0.00 1.77 1.78 0.90 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.01 3.87 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 40 A 8.40 3.71 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 41 R 7.81 3.67 0.00 2.00 2.13 0.00 3.23 0.00 0.00 3.16 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 42 I 7.91 3.68 2.00 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 1.40 0.81 0.95 0.00 0.00 43 F 7.87 4.45 0.00 2.77 2.85 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 44 Y 7.44 4.08 0.00 3.13 2.85 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 45 D 8.62 4.46 0.00 2.75 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 46 A 8.15 4.29 1.54 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 47 C 8.32 3.84 0.00 2.89 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 48 K 8.14 4.05 0.00 1.99 1.96 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 49 I 8.02 3.82 2.08 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 1.74 0.82 0.99 0.00 0.00 50 I 7.83 3.71 2.11 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 1.69 1.12 0.97 0.00 0.00 51 Q 7.39 4.18 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.59 2.43 0.00 52 E 8.49 3.81 0.00 2.05 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 2.57 2.56 0.00 53 K 8.72 4.22 0.00 1.72 1.87 0.00 1.67 0.00 0.00 1.61 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.47 7.81 54 T 8.30 4.69 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 1.27 0.00 0.00 55 G 8.67 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 0.00 0.00 0.00 56 Q 7.74 4.05 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.71 0.00 0.00 0.00 0.00 0.00 2.42 2.49 0.00 57 E 7.98 4.51 0.00 2.13 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 2.28 2.26 0.00 58 P 0.00 3.71 0.00 2.24 1.86 0.00 3.68 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 59 L 8.08 4.01 0.00 1.75 1.86 0.94 0.76 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 60 K 8.61 4.30 0.00 1.88 1.89 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.43 7.81 61 V 7.84 3.57 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 1.03 0.00 0.00 1.02 0.00 0.00 62 F 8.77 4.24 0.00 3.07 3.12 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 0.00 0.00 0.00 63 K 7.11 3.63 0.00 2.11 1.93 0.00 1.62 0.00 0.00 1.59 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.43 7.81 64 Q 7.86 4.03 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.51 2.35 0.00 65 A 8.13 3.93 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 66 V 7.20 3.29 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 0.77 0.00 0.00 0.16 0.00 0.00 67 E 7.75 3.96 0.00 2.20 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 0.00 2.28 2.37 0.00 68 N 8.07 5.42 0.00 2.91 2.82 0.00 0.00 6.73 7.22 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 69 V 7.40 4.43 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 1.17 0.00 0.00 1.06 0.00 0.00 70 K 7.55 3.99 0.00 1.69 1.92 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.41 1.57 7.81 71 P 0.00 4.75 0.00 2.37 2.45 0.00 3.76 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 72 R 9.14 4.05 0.00 2.03 2.02 0.00 3.19 0.00 0.00 3.35 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 73 M 7.64 5.41 0.00 2.06 1.94 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 2.52 2.55 0.00 74 E 9.53 4.79 0.00 2.04 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 2.26 2.36 0.00 75 V 8.27 5.36 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 0.65 0.00 0.00 0.97 0.00 0.00 76 R 8.46 4.54 0.00 1.86 1.92 0.00 3.21 0.00 0.00 3.37 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 77 S 8.52 4.38 0.00 3.83 3.84 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 78 R 7.30 4.11 0.00 1.79 1.89 0.00 2.27 0.00 0.00 2.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.10 0.00 79 R 7.76 4.70 0.00 1.51 1.58 0.00 3.26 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.39 0.00 80 V 8.59 3.44 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 0.51 0.00 0.00 0.54 0.00 0.00 81 G 8.95 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 0.00 0.00 0.00 82 G 8.46 3.84 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 0.00 0.00 0.00 83 A 7.37 4.46 0.35 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 84 N 8.05 5.79 0.00 2.64 2.70 0.00 0.00 7.31 7.46 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 85 Y 7.11 4.10 0.00 2.71 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 86 Q 8.66 4.14 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 87 V 8.25 4.22 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 1.11 0.00 0.00 1.10 0.00 0.00 88 P 0.00 5.23 0.00 2.02 1.99 0.00 3.83 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 2.03 2.13 0.00 89 M 8.39 4.43 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.59 0.00 90 E 9.10 4.35 0.00 1.90 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 2.34 2.34 0.00 91 V 7.85 4.18 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 0.72 0.00 0.00 1.08 0.00 0.00 92 S 8.72 3.99 0.00 3.88 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 93 P 0.00 4.13 0.00 2.28 2.31 0.00 3.74 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 2.07 2.08 0.00 94 R 7.92 3.88 0.00 1.85 2.00 0.00 3.10 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 95 R 7.79 3.72 0.00 1.85 2.03 0.00 3.22 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 96 Q 8.69 3.81 0.00 2.35 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 97 Q 7.96 3.88 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 98 S 7.40 4.01 0.00 3.92 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 99 L 7.73 3.18 0.00 1.05 0.13 0.78 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.49 3.73 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 0.00 101 L 8.31 4.03 0.00 1.84 1.92 0.97 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.03 3.82 0.00 1.87 1.81 0.00 3.14 0.00 0.00 3.19 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 103 W 8.43 4.70 0.00 3.47 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.09 4.14 0.00 2.30 2.10 1.01 0.72 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 0.00 105 V 7.90 3.89 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 0.95 0.00 0.00 0.68 0.00 0.00 106 Q 8.03 3.97 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.70 0.00 0.00 0.00 0.00 0.00 2.48 2.73 0.00 107 A 8.91 4.15 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.63 4.07 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 0.00 109 N 8.17 4.65 0.00 2.93 2.87 0.00 0.00 6.97 7.47 0.00 0.00 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 Q 8.32 4.34 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.71 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 111 R 7.48 4.61 0.00 2.07 2.05 0.00 3.21 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 112 P 0.00 4.68 0.00 2.19 2.15 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 113 E 7.83 4.18 0.00 1.97 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 0.00 2.33 2.25 0.00 114 R 7.82 3.94 0.00 1.80 1.87 0.00 3.39 0.00 0.00 3.23 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 115 R 7.70 4.06 0.00 1.79 1.92 0.00 3.19 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 116 A 8.48 4.44 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 0.00 117 A 7.81 3.94 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 0.00 118 V 7.91 3.54 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 0.78 0.00 0.00 0.91 0.00 0.00 119 R 8.03 3.86 0.00 2.06 2.19 0.00 3.42 0.00 0.00 3.18 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 120 I 7.86 3.81 2.14 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 1.62 0.79 1.26 0.00 0.00 121 A 9.29 4.06 1.37 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 0.00 0.00 122 H 8.42 4.07 0.00 3.17 3.41 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 9.09 4.06 0.00 2.18 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 2.63 2.51 0.00 124 L 8.85 4.29 0.00 2.02 1.79 1.19 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 125 M 7.96 4.22 0.00 2.09 2.28 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.67 0.00 126 D 8.12 4.31 0.00 2.78 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 0.00 127 A 7.47 3.95 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 0.00 128 A 7.75 4.01 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 0.00 129 E 7.30 4.19 0.00 2.22 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 2.31 2.32 0.00 130 G 8.40 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 0.00 131 K 7.97 4.62 0.00 1.81 1.80 0.00 1.52 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.43 7.81 132 G 7.69 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 0.00 133 G 8.56 3.66 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 0.00 0.00 0.00 134 A 7.85 4.10 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 0.00 135 V 7.60 3.71 2.19 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 1.01 0.00 0.00 1.02 0.00 0.00 136 K 7.93 3.82 0.00 1.85 1.88 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.44 7.81 137 K 7.62 3.71 0.00 1.39 1.23 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.66 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.29 1.44 7.81 138 K 7.94 3.92 0.00 1.88 1.96 0.00 1.89 0.00 0.00 1.78 0.00 0.00 3.40 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.55 1.84 7.81 139 E 8.36 3.91 0.00 1.95 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 2.33 2.59 0.00 140 D 8.08 4.23 0.00 2.68 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 7.58 3.62 2.19 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 1.10 0.00 0.00 0.62 0.00 0.00 142 E 7.76 4.40 0.00 2.22 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 2.48 2.63 0.00 143 R 8.19 3.91 0.00 1.85 1.99 0.00 3.15 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.86 0.00 144 M 8.04 4.14 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.94 0.00 145 A 7.16 4.05 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 0.00 146 E 8.91 3.68 0.00 2.17 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 2.26 2.24 0.00 147 A 8.83 4.11 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 0.00 148 N 7.80 4.87 0.00 2.86 3.06 0.00 0.00 6.45 7.33 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 0.00 149 R 7.46 3.84 0.00 1.73 1.97 0.00 3.25 0.00 0.00 3.21 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 150 A 8.12 3.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.23 4.29 0.00 2.85 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 A 8.12 4.41 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 0.00 153 H 8.03 4.85 0.00 3.34 3.36 0.00 5.51 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.59 4.70 0.00 2.97 2.88 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 0.00 155 R 9.04 3.82 0.00 2.05 2.14 0.00 3.42 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.93 0.00 156 W 8.29 4.11 0.00 3.61 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00