NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3059 8.2493 123.5813 52.4413 20.0617 177.9118 2 Q 3.4715 7.7175 124.8738 56.7813 28.0990 176.2800 3 C 4.9201 9.8158 111.5684 55.4569 39.5123 173.1545 4 E 4.4403 7.2979 115.7410 55.1848 33.9298 176.1485 5 A 4.6571 8.2645 121.9353 51.1476 23.1834 175.3457 6 T 4.9873 8.3675 116.0057 61.7523 71.6933 173.5629 7 I 4.8098 8.7806 124.8528 59.3741 41.9915 173.5267 8 E 5.4683 9.8394 127.8963 54.5588 33.0856 175.0421 9 S 5.3154 9.4721 117.5164 55.7271 66.2730 173.2220 10 N 5.1175 8.2909 119.8792 52.1378 39.3420 174.6224 11 D 4.7049 8.6685 121.8048 54.8800 40.9050 175.2764 12 A 4.9615 8.0159 121.6196 50.5535 22.3676 177.8144 13 M 4.0908 8.0508 120.0600 54.1676 30.6121 176.3158 14 Q 4.5176 7.0374 118.4570 54.1079 33.2475 174.8612 15 Y 4.9774 8.3370 119.3872 56.6886 39.6410 176.4840 16 D 4.5721 8.9814 122.2788 54.9692 40.0045 176.3432 17 L 4.8079 8.0400 120.0020 53.1002 43.6231 176.0660 18 K 4.6307 8.7335 121.9356 57.0157 33.8214 175.7668 19 E 5.3456 8.2302 119.8374 54.8404 33.0308 174.1008 20 M 5.0042 9.5678 125.3151 53.5322 36.0709 174.4132 21 V 4.8405 8.5131 122.2658 61.1195 34.2565 174.5440 22 V 3.8453 8.5732 128.5105 61.1001 33.0638 174.5467 23 D 5.0579 8.6708 127.9162 54.0880 42.0889 177.0359 24 K 4.1866 8.6989 124.5179 58.2613 32.1175 178.0054 25 S 4.4076 8.3820 112.9942 58.9527 63.5588 173.5154 26 C 4.5593 8.1329 120.4214 56.5257 40.3556 173.2531 27 K 4.1610 8.6851 125.8057 57.9484 33.2406 176.1080 28 Q 5.1037 7.9463 116.2573 53.9213 32.3222 175.0083 29 F 4.7947 8.4682 122.6213 56.7527 43.4741 173.3116 30 T 4.7823 7.3956 121.3100 61.5398 71.7214 172.9117 31 V 4.3520 8.3364 126.2511 61.2345 34.0197 173.8644 32 H 4.8415 8.7762 125.6849 54.1141 30.6634 173.3029 33 L 4.8798 8.8253 127.1717 53.7334 43.6594 175.3785 34 K 4.9830 9.1451 125.4529 54.8489 36.0839 174.7292 35 H 5.1390 9.2459 124.7073 54.9663 30.8928 174.8112 36 V 4.1303 8.9415 119.5744 61.7115 31.8542 177.1576 37 G 4.3402 8.3288 109.2644 44.8464 0.0000 174.2628 38 K 4.8188 9.0807 118.2159 56.7248 33.6000 176.1453 39 M 4.6153 8.0682 120.1091 53.8541 34.4257 175.7824 40 A 4.3703 8.3560 123.6513 51.9738 19.6805 178.8685 41 K 3.9694 8.5365 120.9929 59.1378 32.5657 179.3374 42 S 4.5445 8.1295 111.8738 60.2476 63.6213 175.0430 43 A 4.3780 7.9901 123.5017 54.7242 19.0867 178.4873 44 M 4.4167 7.9748 115.3983 53.6721 32.5025 174.7651 45 G 3.6433 6.4840 104.5098 46.6376 0.0000 173.4398 46 H 5.2945 8.8488 116.4353 54.4672 33.8452 172.7384 47 N 5.6999 8.6475 116.4206 51.8326 40.8326 172.5476 48 W 5.6478 8.8482 126.9618 55.5427 34.3369 174.6548 49 V 4.5252 8.1964 126.5834 60.7393 34.4501 173.5544 50 L 4.8083 8.1755 129.7733 53.3504 44.3656 175.1815 51 T 5.0073 8.8068 115.1002 59.8041 73.2668 173.3579 52 K 4.3308 8.7051 120.9954 56.0942 32.6285 178.0346 53 E 3.8648 8.7538 122.9568 59.3228 29.5096 178.3924 54 A 4.0625 8.0601 121.2537 55.4978 18.6373 178.5647 55 D 4.6466 8.1630 113.3014 54.8058 40.5942 178.4042 56 K 3.5954 7.5800 121.5646 59.6580 32.1761 178.5379 57 E 3.2399 7.8568 118.3124 59.0074 29.3843 179.5746 58 G 3.4429 7.7368 105.2668 47.7244 0.0000 175.8627 59 V 3.6105 7.9996 120.8289 65.4527 31.5331 177.9542 60 A 4.1247 8.1206 120.8498 55.4793 18.1969 179.7303 61 T 3.6378 7.6394 114.1319 67.0318 68.3628 176.8295 62 D 4.5138 7.8297 119.1557 56.9359 40.9705 178.9724 63 G 3.9312 8.4185 108.3514 47.5231 0.0000 175.4002 64 M 4.0781 8.4298 121.6634 58.4873 32.0477 177.9904 65 N 4.5670 8.1310 114.6769 55.5843 38.7440 176.8180 66 A 4.1377 8.0137 121.8900 52.2141 18.9249 178.8121 67 G 3.8672 7.3760 100.3252 45.1859 0.0000 174.3335 68 L 3.0003 7.6977 120.4632 57.4636 42.2018 179.1874 69 A 3.9321 7.7924 120.0000 54.5801 18.6190 177.7084 70 Q 4.3678 7.8483 113.2473 55.0652 29.0541 175.3942 71 D 4.6961 8.3779 116.8595 56.0924 39.1006 172.9692 72 Y 3.9030 7.3003 112.0047 59.0095 36.2865 171.2577 73 V 4.3691 7.5118 116.5634 60.3894 34.6973 174.6937 74 K 3.8141 8.7806 127.8118 56.3350 32.4770 175.6224 75 A 4.1021 8.6292 129.3384 53.6650 18.7122 177.0060 76 G 3.8468 8.8995 109.6496 46.2070 0.0000 172.9789 77 D 4.3813 7.8221 119.9615 53.9225 40.8971 177.2832 78 T 3.9862 8.4863 117.9928 64.3877 68.9163 175.5368 79 R 4.0442 8.1021 119.8268 57.2009 30.4394 176.4217 80 V 4.0280 7.5302 118.5969 61.3952 31.4378 175.6317 81 I 3.7861 8.3195 129.5187 64.1926 37.2996 176.3198 82 A 4.7659 7.3269 118.8780 51.6622 22.2511 174.7596 83 H 5.4089 8.5815 113.5446 54.9921 31.3976 173.4862 84 T 4.5276 8.6332 111.4600 60.5506 71.0650 174.0023 85 K 4.5539 8.9978 121.9171 55.9569 33.4074 177.0253 86 V 4.5079 8.6154 122.2534 62.3757 32.3620 175.2344 87 I 4.7566 8.9124 120.8093 59.2879 41.4920 175.2440 88 G 4.2796 8.8331 111.2446 44.2362 0.0000 173.0425 89 G 3.7333 7.7007 109.0396 46.3926 0.0000 174.4025 90 G 3.8688 8.9019 112.0707 45.1650 0.0000 172.6720 91 E 4.8089 7.7338 119.2230 55.0029 32.6162 174.5627 92 S 5.1359 8.2604 113.6740 57.9294 66.1821 172.7812 93 D 4.8162 9.0242 118.8629 53.3520 44.8005 173.9963 94 S 5.7431 8.8022 118.2424 55.8169 67.0137 173.7424 95 V 4.5739 7.9340 119.8366 60.6562 34.7806 173.5367 96 T 5.0768 8.6360 119.8956 61.7393 71.0931 173.2073 97 F 5.1281 8.7354 120.3837 54.8286 42.4961 173.3899 98 D 4.9343 8.7144 119.0901 53.4950 41.8329 177.4996 99 V 3.7930 8.7539 127.2643 65.5473 31.7129 177.5294 100 S 4.3854 8.0316 112.4970 59.7249 62.8809 175.2535 101 K 4.1674 7.9715 120.2604 57.9951 32.0689 176.6727 102 L 4.5988 7.8729 119.9643 52.9670 42.6142 176.1823 103 T 4.3577 9.0416 121.0484 62.0397 69.3712 173.0020 104 P 4.4492 0.0000 0.0000 64.0352 32.1716 175.8848 105 G 4.3080 8.9653 114.3034 45.9242 0.0000 173.9836 106 E 3.6988 7.0540 116.0862 56.3358 29.9654 175.8096 107 A 4.8816 8.1305 126.6085 50.8322 20.8296 175.7573 108 Y 4.6869 8.8696 118.3528 56.0530 42.0204 174.4358 109 A 5.2135 8.9005 124.0053 50.5200 21.4038 175.5197 110 Y 5.0558 8.2191 120.7888 55.2992 41.1405 174.7759 111 F 5.5191 8.4194 115.7133 56.6516 41.9879 171.8078 112 C 5.2102 9.3357 119.9949 57.7407 32.9860 173.9274 113 S 5.0241 9.2599 120.3777 57.8940 63.2170 174.0654 114 F 3.6836 8.1738 123.8567 57.5966 39.5504 172.3206 115 P 3.9844 0.0000 0.0000 64.5829 31.1350 176.6470 116 G 4.0636 9.2267 111.6317 45.7414 0.0000 173.1789 117 H 4.6903 8.5872 116.7581 56.4305 29.9568 177.1590 118 W 4.6662 8.9739 115.2483 58.7197 27.6183 177.2644 119 A 3.5064 6.2016 119.9151 53.6868 18.1271 177.8338 120 M 4.0652 7.6606 114.0796 56.8191 33.2534 175.7140 121 H 4.7253 8.3178 121.1108 54.6294 28.7328 173.3071 122 K 5.2782 7.9931 123.6481 56.2964 35.9544 174.4920 123 G 3.5219 8.2639 106.6817 46.0779 0.0000 171.9205 124 T 5.1777 8.1370 115.7185 61.4544 71.9864 173.4413 125 L 5.5740 9.2987 127.8000 53.2852 45.3539 175.2277 126 K 5.1459 9.0627 123.7384 55.3248 36.6165 174.5671 127 L 4.9028 8.4974 123.5672 54.5393 43.3182 175.3323 128 S 4.7237 8.8251 119.4059 57.6002 66.8508 174.1454 129 N 4.6202 8.5296 118.9498 52.8975 37.2473 174.2653 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 1 A 8.25 4.31 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 Q 7.72 3.47 0.00 2.39 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.46 0.00 0.00 0.00 0.00 0.00 2.15 2.43 0.00 3 C 9.82 4.92 0.00 2.80 3.31 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 4 E 7.30 4.44 0.00 1.76 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 1.88 2.15 0.00 5 A 8.26 4.66 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 6 T 8.37 4.99 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 7 I 8.78 4.81 1.65 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.92 0.59 0.00 0.00 8 E 9.84 5.47 0.00 1.96 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 9 S 9.47 5.32 0.00 3.51 3.96 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 0.00 0.00 0.00 0.00 10 N 8.29 5.12 0.00 2.81 2.85 0.00 0.00 6.44 8.05 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 11 D 8.67 4.70 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.02 4.96 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.05 4.09 0.00 1.82 1.89 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.16 0.00 14 Q 7.04 4.52 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.62 6.88 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 15 Y 8.34 4.98 0.00 3.35 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 16 D 8.98 4.57 0.00 2.85 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 17 L 8.04 4.81 0.00 1.77 1.76 0.96 0.93 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 18 K 8.73 4.63 0.00 1.83 1.89 0.00 1.62 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 1.52 1.60 7.81 19 E 8.23 5.35 0.00 1.98 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 0.00 2.27 2.54 0.00 20 M 9.57 5.00 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 21 V 8.51 4.84 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 0.79 0.00 0.00 0.98 0.00 0.00 22 V 8.57 3.85 1.89 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 0.62 0.00 0.00 0.22 0.00 0.00 23 D 8.67 5.06 0.00 2.89 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.70 4.19 0.00 1.82 1.86 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.56 7.81 25 S 8.38 4.41 0.00 3.98 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 26 C 8.13 4.56 0.00 3.12 3.34 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 27 K 8.69 4.16 0.00 1.87 1.77 0.00 1.54 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 28 Q 7.95 5.10 0.00 1.84 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.46 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 29 F 8.47 4.79 0.00 2.65 1.73 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 30 T 7.40 4.78 3.80 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 0.91 0.00 0.00 31 V 8.34 4.35 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.46 0.00 0.00 32 H 8.78 4.84 0.00 2.95 3.09 0.00 5.66 0.00 0.00 0.00 0.00 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.83 4.88 0.00 1.65 1.66 1.18 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 34 K 9.15 4.98 0.00 1.71 1.67 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.33 7.81 35 H 9.25 5.14 0.00 3.22 3.30 0.00 5.57 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 8.94 4.13 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 0.72 0.00 0.00 1.01 0.00 0.00 37 G 8.33 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 38 K 9.08 4.82 0.00 1.71 1.85 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.37 7.81 39 M 8.07 4.62 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.53 0.00 40 A 8.36 4.37 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 41 K 8.54 3.97 0.00 1.90 1.83 0.00 1.81 0.00 0.00 1.94 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.58 7.81 42 S 8.13 4.54 0.00 4.14 4.10 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 43 A 7.99 4.38 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 M 7.97 4.42 0.00 1.82 1.91 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 45 G 6.48 3.64 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 0.00 0.00 0.00 46 H 8.85 5.29 0.00 3.12 3.21 0.00 5.56 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.65 5.70 0.00 2.82 3.05 0.00 0.00 5.91 9.21 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 48 W 8.85 5.65 0.00 3.41 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 49 V 8.20 4.53 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 0.00 0.00 0.64 0.00 0.00 0.81 0.00 0.00 50 L 8.18 4.81 0.00 0.62 0.93 0.89 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.81 5.01 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 1.36 0.00 0.00 52 K 8.71 4.33 0.00 1.84 1.67 0.00 1.66 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.64 1.52 7.81 53 E 8.75 3.86 0.00 1.81 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 2.25 2.30 0.00 54 A 8.06 4.06 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 55 D 8.16 4.65 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.58 3.60 0.00 1.64 1.58 0.00 1.46 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.71 0.21 7.81 57 E 7.86 3.24 0.00 1.79 1.65 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 1.47 1.59 0.00 58 G 7.74 3.44 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 59 V 8.00 3.61 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.08 0.00 0.00 60 A 8.12 4.12 0.98 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 0.00 0.00 61 T 7.64 3.64 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 1.12 0.00 0.00 62 D 7.83 4.51 0.00 2.66 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 63 G 8.42 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 M 8.43 4.08 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 65 N 8.13 4.57 0.00 2.91 2.87 0.00 0.00 7.03 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 66 A 8.01 4.14 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 67 G 7.38 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 0.00 0.00 0.00 68 L 7.70 3.00 0.00 1.54 1.52 1.09 1.21 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 69 A 7.79 3.93 1.23 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 0.00 0.00 0.00 70 Q 7.85 4.37 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.32 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 71 D 8.38 4.70 0.00 2.85 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 72 Y 7.30 3.90 0.00 3.24 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 0.00 73 V 7.51 4.37 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 0.63 0.00 0.00 0.86 0.00 0.00 74 K 8.78 3.81 0.00 1.82 1.83 0.00 1.77 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.51 1.45 7.81 75 A 8.63 4.10 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 76 G 8.90 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 0.00 0.00 0.00 77 D 7.82 4.38 0.00 2.88 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 78 T 8.49 3.99 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 79 R 8.10 4.04 0.00 1.97 2.15 0.00 3.15 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 80 V 7.53 4.03 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 0.82 0.00 0.00 0.92 0.00 0.00 81 I 8.32 3.79 1.74 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.61 0.62 0.00 0.00 82 A 7.33 4.77 1.15 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 0.00 0.00 83 H 8.58 5.41 0.00 3.10 3.19 0.00 5.71 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 8.63 4.53 4.49 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 1.31 0.00 0.00 85 K 9.00 4.55 0.00 1.79 1.86 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.66 1.51 7.81 86 V 8.62 4.51 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 1.04 0.00 0.00 1.27 0.00 0.00 87 I 8.91 4.76 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.71 0.97 0.00 0.00 88 G 8.83 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 0.00 0.00 0.00 0.00 89 G 7.70 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 0.00 0.00 0.00 90 G 8.90 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 0.00 0.00 0.00 91 E 7.73 4.81 0.00 2.14 1.90 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 2.24 2.22 0.00 92 S 8.26 5.14 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 93 D 9.02 4.82 0.00 2.82 2.52 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 94 S 8.80 5.74 0.00 3.70 3.57 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 95 V 7.93 4.57 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 1.10 0.00 0.00 96 T 8.64 5.08 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 1.11 0.00 0.00 97 F 8.74 5.13 0.00 3.03 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 98 D 8.71 4.93 0.00 2.83 2.66 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 99 V 8.75 3.79 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 0.98 0.00 0.00 0.82 0.00 0.00 100 S 8.03 4.39 0.00 4.08 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 7.97 4.17 0.00 1.99 1.91 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.55 7.81 102 L 7.87 4.60 0.00 1.61 1.45 0.89 -0.06 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 0.00 103 T 9.04 4.36 4.54 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 1.26 0.00 0.00 104 P 0.00 4.45 0.00 2.07 2.02 0.00 3.77 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 105 G 8.97 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 0.00 106 E 7.05 3.70 0.00 2.04 1.77 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 2.12 2.21 0.00 107 A 8.13 4.88 1.22 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 0.00 0.00 108 Y 8.87 4.69 0.00 3.15 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 8.90 5.21 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 0.00 110 Y 8.22 5.06 0.00 1.93 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 F 8.42 5.52 0.00 3.34 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 0.00 112 C 9.34 5.21 0.00 2.97 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 0.00 113 S 9.26 5.02 0.00 4.17 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 0.00 114 F 8.17 3.68 0.00 3.05 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 0.00 115 P 0.00 3.98 0.00 1.50 1.74 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.32 0.00 116 G 9.23 4.06 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 0.00 0.00 0.00 117 H 8.59 4.69 0.00 3.58 3.48 0.00 5.67 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 W 8.97 4.67 0.00 3.48 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 6.20 3.51 0.19 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 0.00 120 M 7.66 4.07 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.24 0.00 121 H 8.32 4.73 0.00 3.00 3.26 0.00 5.62 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 0.00 122 K 7.99 5.28 0.00 1.86 1.85 0.00 1.87 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.38 7.81 123 G 8.26 3.52 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 0.00 124 T 8.14 5.18 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 1.27 0.00 0.00 125 L 9.30 5.57 0.00 2.11 1.73 1.20 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.06 5.15 0.00 1.88 1.91 0.00 1.39 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.43 7.81 127 L 8.50 4.90 0.00 1.70 1.66 0.97 0.87 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 0.00 128 S 8.83 4.72 0.00 3.94 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 0.00 129 N 8.53 4.62 0.00 2.81 2.73 0.00 0.00 5.88 7.58 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