NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 M 4.3873 8.1514 120.3593 54.8380 33.0967 174.4306 18 G 3.5460 7.9368 107.3382 47.1581 0.0000 173.6483 19 L 3.9713 8.2172 121.2325 57.3856 42.9497 177.3517 20 E 3.8576 8.1767 118.6055 59.6121 29.6980 177.5350 21 D 4.3393 9.0127 119.8407 56.8942 41.1409 178.4647 22 K 3.8330 8.2493 118.2440 59.7416 32.1814 179.3044 23 V 3.5350 7.6899 118.1833 66.0634 31.0496 178.1436 24 S 3.9396 8.1492 114.0794 61.4220 62.6493 176.6218 25 K 4.8721 8.5545 123.7587 58.6490 31.7522 178.8401 26 Q 3.9662 8.3886 120.3038 59.4070 28.9471 178.5434 27 L 4.0739 8.2705 120.0686 58.1397 41.6384 179.5553 28 E 4.0644 8.7076 118.9808 59.3283 29.1618 179.3989 29 S 4.1432 8.6253 113.8858 61.1366 62.9622 175.8563 30 K 4.4229 7.7996 118.6743 55.2177 32.0230 177.0354 31 G 3.9503 8.1552 107.2971 46.2816 0.0000 173.9893 32 I 3.8161 7.8353 120.8463 60.5601 37.4434 175.7315 33 K 4.0826 8.6224 127.3023 55.1070 31.9112 175.1717 34 F 5.0986 7.7060 120.7654 54.9257 40.7600 173.8787 35 E 4.7315 9.0276 119.6002 54.8923 31.1148 175.8073 36 Y 4.6188 8.8700 125.5385 56.8610 37.9467 174.3856 37 E 3.6813 8.4004 128.8414 57.1165 27.1141 176.2462 38 E 3.8212 8.4649 120.6984 57.7671 30.1725 176.3841 39 W 4.9212 7.9284 116.1042 54.6029 32.2377 174.5897 40 K 4.5831 8.6844 120.3718 54.6959 33.5745 176.0545 41 V 4.2597 8.2409 122.7347 60.6736 32.2905 173.6990 42 P 4.6504 0.0000 0.0000 62.5907 32.0582 175.1600 43 Y 4.8673 7.9033 118.4333 56.0030 40.4948 173.7304 44 S 4.4567 8.4747 115.4140 56.3324 65.1228 173.1689 45 N 4.6327 8.4188 122.7362 52.2718 38.7714 174.6201 46 N 4.5734 8.6712 124.4299 52.5547 36.5435 174.1540 47 Q 4.3306 8.3098 123.2262 55.0269 30.0829 176.0354 48 Q 4.4275 8.5540 121.0994 54.3488 29.4159 174.5483 49 N 4.8513 8.3817 121.5026 52.3249 40.3382 174.4777 50 Y 4.3483 8.3447 121.2622 56.3013 39.0527 175.5112 51 S 4.6680 8.2788 120.5929 57.2338 64.5288 174.0722 52 S 4.7422 8.0910 115.6480 57.0329 65.3097 172.8165 53 H 4.9525 8.4178 118.3499 54.9390 32.8830 172.2274 54 T 4.7367 8.3216 109.4686 60.0738 71.1089 172.7910 55 Y 4.7166 8.4143 122.8258 56.2072 41.0366 175.0519 56 T 4.1705 7.8809 124.1671 60.7600 68.8427 172.3575 57 P 4.8911 0.0000 0.0000 61.8753 32.1809 176.9368 58 D 4.1904 8.8293 121.7959 56.8175 41.0715 176.9720 59 F 4.8811 8.5215 116.2962 55.3978 42.8061 173.7539 60 L 4.6761 8.3950 124.3658 52.9732 43.5796 176.2930 61 L 4.2857 8.4906 127.0816 53.6613 42.2318 176.8375 62 P 4.4135 0.0000 0.0000 64.9371 31.4918 177.0110 63 N 4.5522 7.9237 114.4429 52.4678 37.9649 176.2630 64 G 3.9182 8.1763 107.3730 45.0489 0.0000 173.8824 65 I 3.9807 8.3514 122.4903 61.0469 38.3627 175.0278 66 F 5.0574 9.3623 126.2545 56.2316 41.0762 175.1137 67 V 5.0855 9.1229 122.2412 61.1292 35.3552 173.6221 68 E 5.1261 9.3765 128.2668 54.5425 32.1661 175.1516 69 T 4.7180 9.2975 118.0525 61.6493 70.6595 174.7814 70 K 3.7408 8.5528 124.3903 56.2449 34.7265 175.5809 71 G 3.9044 9.1707 119.5189 45.7320 0.0000 171.8396 72 L 4.6023 7.7717 121.5538 52.5660 43.6734 176.0467 73 W 4.7840 9.6095 135.0000 55.6299 31.4475 175.3768 74 E 4.2440 8.3843 125.9457 55.2986 30.8073 177.8710 75 S 3.7294 8.3760 112.8378 61.7021 62.4028 175.2551 76 D 4.2352 7.9665 121.0887 57.5754 40.5177 177.9706 77 D 4.3420 8.0385 117.6734 57.7872 41.0276 178.6046 78 R 3.2313 6.9136 117.6672 58.8824 29.8526 178.8504 79 K 3.7853 7.7433 118.0148 59.5401 32.2803 178.9909 80 K 3.7368 8.3125 119.8000 60.0175 31.9777 178.1954 81 H 3.8081 8.3972 118.4532 59.1444 29.5107 177.1046 82 L 4.1362 7.9769 120.8947 57.2695 41.5005 179.2676 83 L 4.0081 8.1467 119.3568 57.9405 41.5357 179.4780 84 I 3.7375 7.4967 119.2576 64.5631 36.7732 178.6338 85 R 3.9401 7.5593 117.6690 59.2043 29.9184 178.8138 86 E 4.1278 7.6055 117.4557 59.6277 29.7834 179.1559 87 Q 4.2155 8.4326 116.1654 57.6886 29.8443 176.5878 88 H 5.2210 8.6695 116.9324 52.4784 29.7716 172.0290 89 P 4.3275 0.0000 0.0000 65.3871 32.0333 178.6371 90 E 4.0574 8.2794 116.8295 58.8170 29.5968 177.0602 91 L 4.1051 7.4242 118.7472 54.3696 42.2978 176.1268 92 D 4.7372 8.7514 123.5355 53.0882 41.8424 174.0901 93 I 5.1148 8.2216 126.0119 59.4751 39.3139 175.4064 94 R 4.9090 9.1854 125.6797 54.4487 34.2380 174.5455 95 I 4.8175 8.2940 121.8011 59.6933 40.2730 175.0865 96 V 4.8272 8.2197 124.7537 61.4290 34.0346 174.6052 97 F 5.8422 9.4751 127.2120 55.7060 40.4901 177.5356 98 S 4.3326 8.9182 117.1192 61.6652 64.1937 174.4132 99 S 4.5309 8.0170 114.8481 57.4646 63.5932 174.5523 100 S 3.9696 9.9880 124.2421 60.0982 63.1480 175.9064 101 R 4.1615 7.3470 117.7862 57.1684 30.1802 176.8648 102 T 3.8738 7.1482 116.2177 62.9227 69.0342 174.2319 103 K 4.6848 7.8991 123.9557 55.4347 33.2865 177.3934 104 L 4.1956 8.2537 122.2779 57.7518 41.9076 177.3081 105 Y 4.6993 7.4620 113.6578 55.5485 42.0171 174.0436 106 K 3.9424 8.7334 123.0814 58.3197 32.4453 177.3581 107 G 4.0233 8.9550 114.1380 45.5749 0.0000 173.6455 108 S 4.2184 7.8879 115.3311 57.7766 62.7261 172.4877 109 P 4.4074 0.0000 0.0000 65.6898 31.8263 177.2302 110 T 4.2306 7.9370 116.6680 63.2647 69.1709 173.4866 111 S 5.1716 8.9045 120.9221 56.5192 66.9175 174.2541 112 Y 4.5788 8.8301 120.1382 61.9017 37.5455 179.3974 113 G 2.9139 7.9330 105.6764 47.8569 0.0000 175.1116 114 E 4.0089 8.0387 120.7951 59.0262 29.6296 179.1688 115 F 4.0512 8.8614 120.7819 61.8067 39.4430 177.0805 116 C 4.4233 8.6872 116.5318 62.6286 27.9216 175.8422 117 E 4.0400 8.5986 121.6146 59.2220 29.1183 178.7875 118 K 3.9803 8.4944 118.4496 58.6657 32.1956 176.7710 119 H 4.6186 7.5162 113.3013 54.9113 29.3680 174.0594 120 G 3.7810 7.9444 107.0754 46.7381 0.0000 174.2328 121 I 4.3583 8.4258 122.6210 58.9926 37.4468 176.1592 122 K 4.5553 8.5371 126.1620 56.8165 33.1678 176.4431 123 F 6.2982 8.6429 117.4779 57.0475 41.5571 171.8613 124 A 4.2679 8.6399 118.7716 51.9191 22.2996 174.4477 125 D 5.3485 8.4743 118.0543 54.0133 42.8511 177.5013 126 K 4.1180 9.6518 127.5441 57.7074 31.7152 175.8958 127 L 4.6122 7.1173 113.8414 52.6355 45.6466 175.8020 128 I 3.3990 8.0187 121.6945 60.4920 37.3123 174.6559 129 P 3.8298 0.0000 0.0000 62.7653 31.7962 177.3854 130 A 3.9916 8.5633 124.5001 55.1853 17.9623 179.4802 131 E 3.9766 8.0069 116.1914 59.2930 29.7445 179.0188 132 W 5.4982 8.0869 120.2639 59.8241 29.0365 178.6113 133 I 3.7322 8.0059 117.6281 64.0448 36.5971 177.6484 134 K 4.2627 7.6754 116.8733 56.3801 32.8034 177.1743 135 E 4.1490 7.8887 120.6241 55.0933 30.0492 174.6550 136 P 4.4343 0.0000 0.0000 62.6157 31.7132 175.9392 137 K 4.1079 8.6829 123.6095 57.1915 32.4560 175.5375 138 K 4.7831 9.1072 124.9999 54.7752 35.6899 175.9789 139 E 4.2327 8.8285 120.9066 56.5876 30.4402 176.5475 140 V 4.2177 7.9161 121.0946 60.4401 34.4627 175.0820 141 P 4.5772 0.0000 0.0000 61.4671 29.7493 176.5958 142 F 4.2409 7.7782 123.4441 61.4474 39.7425 177.7222 143 D 4.4429 8.3928 119.4911 57.6551 40.6010 178.2745 144 R 4.0603 7.6652 115.9810 58.0704 30.2303 176.9484 145 L 4.6615 7.5444 117.4206 53.0273 43.5256 175.6499 146 K 4.6674 8.3277 119.4456 54.6547 34.9821 175.2657 147 R 4.6848 8.2217 116.4585 54.1843 32.2150 176.0979 148 K 4.1534 8.4059 115.9041 57.0365 32.9091 176.4006 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 17 M 8.15 4.39 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 18 G 7.94 3.55 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 0.00 19 L 8.22 3.97 0.00 1.76 1.69 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 20 E 8.18 3.86 0.00 2.11 2.15 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 2.55 2.45 0.00 21 D 9.01 4.34 0.00 3.00 2.65 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 22 K 8.25 3.83 0.00 2.02 1.88 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.68 7.81 23 V 7.69 3.53 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 1.02 0.00 0.00 0.95 0.00 0.00 24 S 8.15 3.94 0.00 4.10 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 25 K 8.55 4.87 0.00 1.93 1.91 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.89 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.46 1.43 7.81 26 Q 8.39 3.97 0.00 2.08 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 27 L 8.27 4.07 0.00 2.09 2.07 0.39 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 28 E 8.71 4.06 0.00 2.19 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 0.00 2.33 2.62 0.00 29 S 8.63 4.14 0.00 3.99 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.80 4.42 0.00 1.77 1.90 0.00 1.86 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.46 7.81 31 G 8.16 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 32 I 7.84 3.82 2.11 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 1.35 0.91 1.03 0.00 0.00 33 K 8.62 4.08 0.00 1.66 1.72 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.28 7.81 34 F 7.71 5.10 0.00 3.15 3.10 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 0.00 0.00 0.00 0.00 35 E 9.03 4.73 0.00 2.22 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 2.37 2.44 0.00 36 Y 8.87 4.62 0.00 3.39 3.11 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 37 E 8.40 3.68 0.00 1.80 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.47 0.00 38 E 8.46 3.82 0.00 1.81 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.47 0.00 39 W 7.93 4.92 0.00 3.29 3.15 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 40 K 8.68 4.58 0.00 1.80 1.78 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.41 7.81 41 V 8.24 4.26 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 0.87 0.00 0.00 0.97 0.00 0.00 42 P 0.00 4.65 0.00 2.12 1.98 0.00 3.82 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 43 Y 7.90 4.87 0.00 3.05 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.47 4.46 0.00 3.95 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 45 N 8.42 4.63 0.00 2.71 2.77 0.00 0.00 7.12 7.79 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 46 N 8.67 4.57 0.00 2.89 2.89 0.00 0.00 6.28 7.39 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 47 Q 8.31 4.33 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 48 Q 8.55 4.43 0.00 2.16 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 49 N 8.38 4.85 0.00 2.68 2.67 0.00 0.00 7.02 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 50 Y 8.34 4.35 0.00 2.90 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 51 S 8.28 4.67 0.00 3.88 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 52 S 8.09 4.74 0.00 3.91 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 53 H 8.42 4.95 0.00 3.14 3.24 0.00 5.64 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.32 4.74 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 1.24 0.00 0.00 55 Y 8.41 4.72 0.00 2.73 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 56 T 7.88 4.17 4.07 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 1.10 0.00 0.00 57 P 0.00 4.89 0.00 2.25 2.08 0.00 3.52 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 58 D 8.83 4.19 0.00 2.76 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.52 4.88 0.00 3.07 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 60 L 8.40 4.68 0.00 1.32 1.49 -0.13 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 61 L 8.49 4.29 0.00 1.85 1.54 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.41 0.00 2.03 2.12 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 63 N 7.92 4.55 0.00 2.97 3.04 0.00 0.00 6.44 7.30 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 64 G 8.18 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 0.00 0.00 0.00 65 I 8.35 3.98 1.92 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.60 0.72 0.00 0.00 66 F 9.36 5.06 0.00 3.15 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 67 V 9.12 5.09 2.30 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 1.26 0.00 0.00 1.13 0.00 0.00 68 E 9.38 5.13 0.00 2.16 1.81 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 2.39 2.27 0.00 69 T 9.30 4.72 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 70 K 8.55 3.74 0.00 1.49 0.97 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.70 1.31 7.81 71 G 9.17 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 72 L 7.77 4.60 0.00 1.70 1.68 1.03 0.98 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 73 W 9.61 4.78 0.00 2.35 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 0.00 0.00 0.00 0.00 74 E 8.38 4.24 0.00 1.96 1.79 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 2.40 2.23 0.00 75 S 8.38 3.73 0.00 3.87 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 76 D 7.97 4.24 0.00 2.66 2.65 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 77 D 8.04 4.34 0.00 2.63 2.48 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 78 R 6.91 3.23 0.00 1.39 1.24 0.00 2.21 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 79 K 7.74 3.79 0.00 1.86 1.81 0.00 1.62 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.39 7.81 80 K 8.31 3.74 0.00 1.80 1.88 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.20 1.38 7.81 81 H 8.40 3.81 0.00 3.50 3.53 0.00 5.83 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 82 L 7.98 4.14 0.00 1.94 1.70 0.89 0.33 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 83 L 8.15 4.01 0.00 1.77 1.70 0.88 1.18 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 84 I 7.50 3.74 1.82 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.87 0.00 0.00 85 R 7.56 3.94 0.00 1.95 2.03 0.00 3.29 0.00 0.00 3.31 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.00 0.00 86 E 7.61 4.13 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 87 Q 8.43 4.22 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.22 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 88 H 8.67 5.22 0.00 3.24 3.10 0.00 5.63 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.33 0.00 2.18 2.19 0.00 3.76 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 1.99 1.95 0.00 90 E 8.28 4.06 0.00 2.13 2.26 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 2.36 2.28 0.00 91 L 7.42 4.11 0.00 1.62 1.52 0.57 0.88 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 92 D 8.75 4.74 0.00 2.73 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 93 I 8.22 5.11 1.93 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 1.35 0.75 1.08 0.00 0.00 94 R 9.19 4.91 0.00 1.22 1.54 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.35 0.00 95 I 8.29 4.82 1.42 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 0.95 0.87 -0.58 0.00 0.00 96 V 8.22 4.83 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 0.97 0.00 0.00 1.08 0.00 0.00 97 F 9.48 5.84 0.00 3.09 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 98 S 8.92 4.33 0.00 3.89 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 99 S 8.02 4.53 0.00 3.83 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 0.00 100 S 9.99 3.97 0.00 3.88 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 0.00 101 R 7.35 4.16 0.00 1.82 1.97 0.00 3.17 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 1.67 1.59 0.00 102 T 7.15 3.87 3.08 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 0.74 0.00 0.00 103 K 7.90 4.68 0.00 1.70 1.80 0.00 1.97 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.33 1.38 7.81 104 L 8.25 4.20 0.00 1.75 1.57 1.02 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 105 Y 7.46 4.70 0.00 3.05 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 0.00 106 K 8.73 3.94 0.00 1.75 1.81 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.48 7.81 107 G 8.95 4.02 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 0.00 108 S 7.89 4.22 0.00 3.97 4.12 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 0.00 109 P 0.00 4.41 0.00 2.24 2.18 0.00 3.86 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 2.02 2.00 0.00 110 T 7.94 4.23 4.35 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 1.35 0.00 0.00 111 S 8.90 5.17 0.00 4.13 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 0.00 112 Y 8.83 4.58 0.00 2.55 1.87 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 0.00 113 G 7.93 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 0.00 0.00 0.00 114 E 8.04 4.01 0.00 2.36 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 0.00 2.37 2.35 0.00 115 F 8.86 4.05 0.00 3.21 3.48 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 0.00 116 C 8.69 4.42 0.00 2.74 3.30 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 0.00 117 E 8.60 4.04 0.00 2.35 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 0.00 2.42 2.45 0.00 118 K 8.49 3.98 0.00 1.75 1.72 0.00 1.72 0.00 0.00 1.44 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.18 1.37 7.81 119 H 7.52 4.62 0.00 3.01 3.21 0.00 5.98 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 G 7.94 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 0.00 121 I 8.43 4.36 2.17 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.77 1.03 0.00 0.00 122 K 8.54 4.56 0.00 1.62 1.80 0.00 1.47 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.47 7.81 123 F 8.64 6.30 0.00 3.59 3.33 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 0.00 124 A 8.64 4.27 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.47 5.35 0.00 2.55 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 0.00 126 K 9.65 4.12 0.00 1.82 1.91 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.41 7.81 127 L 7.12 4.61 0.00 1.46 1.38 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 128 I 8.02 3.40 1.77 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.33 1.09 0.00 0.00 129 P 0.00 3.83 0.00 0.93 1.46 0.00 2.20 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.38 0.00 130 A 8.56 3.99 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 0.00 131 E 8.01 3.98 0.00 1.96 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 0.00 2.27 2.33 0.00 132 W 8.09 5.50 0.00 3.58 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 0.00 133 I 8.01 3.73 2.02 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 1.69 0.70 0.91 0.00 0.00 134 K 7.68 4.26 0.00 1.97 1.87 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.71 7.81 135 E 7.89 4.15 0.00 2.11 1.87 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 2.37 2.65 0.00 136 P 0.00 4.43 0.00 2.17 2.08 0.00 3.80 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 137 K 8.68 4.11 0.00 1.79 1.78 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.47 7.81 138 K 9.11 4.78 0.00 1.68 1.69 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.42 7.81 139 E 8.83 4.23 0.00 1.86 1.91 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 2.32 2.26 0.00 140 V 7.92 4.22 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 0.45 0.00 0.00 0.79 0.00 0.00 141 P 0.00 4.58 0.00 2.23 2.16 0.00 3.63 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 142 F 7.78 4.24 0.00 3.26 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 0.00 143 D 8.39 4.44 0.00 2.70 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 0.00 144 R 7.67 4.06 0.00 1.86 2.04 0.00 3.33 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 145 L 7.54 4.66 0.00 1.93 1.65 0.95 0.43 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 0.00 146 K 8.33 4.67 0.00 1.72 1.71 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.40 7.81 147 R 8.22 4.68 0.00 1.88 1.93 0.00 3.02 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 148 K 8.41 4.15 0.00 1.85 1.81 0.00 1.48 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.47 7.81