NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3257 8.3049 120.3441 55.3993 33.4260 174.9597 2 N 4.5295 8.2591 122.7062 49.1621 40.4719 172.4688 3 T 4.4258 8.7430 115.6555 60.2578 72.4434 173.1612 4 P 4.1938 0.0000 0.0000 65.8566 31.3477 178.8127 5 E 3.9970 8.0511 115.7610 59.3225 29.5984 178.6262 6 H 4.1246 7.8554 119.5552 59.4211 29.8338 177.1608 7 M 3.5282 7.6349 119.9959 58.3969 31.6308 178.9629 8 T 3.8175 7.8956 115.8643 66.3494 68.6013 176.6883 9 A 3.9545 7.9218 122.8145 55.2050 18.2915 179.9069 10 V 3.5575 7.7877 116.7557 66.0047 31.5786 178.5222 11 V 3.3564 7.4719 118.2583 65.8778 31.2068 178.1362 12 Q 3.8682 8.0514 117.8951 58.7617 28.4641 178.5110 13 R 3.8437 8.1174 119.8461 59.4960 30.0883 177.6842 14 Y 4.1257 8.2087 119.3970 60.9452 38.8425 178.2390 15 V 3.3707 7.9173 118.6843 66.0764 31.5815 177.9040 16 A 3.9668 8.2031 120.2388 55.0375 18.1677 179.5212 17 A 3.9402 8.3300 119.7720 54.9596 18.4880 179.8353 18 L 3.8004 7.7956 117.5651 58.1515 41.5282 179.3888 19 N 4.3088 7.8910 114.5551 56.4350 38.5782 177.0504 20 A 4.1993 7.9914 120.7610 52.6467 18.5333 177.9912 21 G 3.7118 7.6362 104.6699 47.1394 0.0000 174.7529 22 D 4.5706 7.9474 121.3013 52.3261 40.0996 175.5795 23 L 3.9499 8.1353 127.3894 57.9607 42.5198 177.8523 24 D 4.5928 8.1322 118.0872 56.7253 40.6985 178.7461 25 G 3.6618 8.0874 105.9044 47.4140 0.0000 175.8567 26 I 3.9271 7.5167 122.2720 64.4596 37.3339 178.5798 27 V 3.8913 7.7275 118.3258 65.9840 31.0893 177.5335 28 A 4.2427 7.8600 118.6130 53.8758 18.5292 178.0209 29 L 4.1753 8.4614 117.4209 55.5696 42.3935 176.6951 30 F 4.8607 7.7060 116.8377 55.6279 40.6951 175.6394 31 A 4.3559 8.3730 126.4319 51.6675 19.2813 178.7070 32 D 4.5664 9.0275 118.9706 56.3153 41.0038 178.1317 33 D 4.8411 7.8439 115.9225 52.7787 39.9288 176.0752 34 A 4.5882 7.7774 121.6892 52.9780 19.7919 177.4330 35 T 5.0730 8.8697 109.9730 59.8511 72.3418 173.2489 36 V 4.7080 8.5416 122.7001 61.2232 35.0343 173.8859 37 E 4.6882 9.2961 128.4127 54.2691 31.7123 173.4014 38 N 5.2208 8.1664 124.3794 51.2309 41.3858 171.9059 39 P 4.8861 0.0000 0.0000 61.2060 33.9017 175.5751 40 V 3.6572 7.6523 119.8890 64.7313 31.5514 175.9337 41 G 3.9936 9.4824 115.5342 45.3214 0.0000 173.0501 42 S 4.7709 7.0054 113.2387 55.7831 65.5197 173.9464 43 E 3.9827 8.5128 121.9217 56.1925 29.5521 175.4539 44 P 4.5596 0.0000 0.0000 62.4867 32.4671 176.0212 45 R 4.2965 8.9193 123.9170 55.4159 31.4357 175.2733 46 S 4.9004 8.7506 118.8493 57.5009 64.6172 174.4790 47 G 4.6484 9.1432 111.7738 46.0810 0.0000 174.3060 48 T 3.8363 8.6784 116.8421 66.7187 68.4233 176.4916 49 A 3.9902 7.9845 121.3637 55.2486 18.5409 179.4306 50 A 4.0666 7.9124 118.7978 55.2354 18.5082 179.7363 51 I 3.6197 8.1596 118.8390 64.4743 37.1033 178.6061 52 R 3.9966 8.4596 120.1985 59.4569 29.9747 178.4057 53 E 3.9564 8.3441 117.4950 59.1859 29.6441 178.7108 54 F 3.9735 8.2314 121.5808 61.5579 39.3968 176.8981 55 Y 3.6959 8.0300 115.8420 60.5742 37.3637 178.2899 56 A 3.9797 8.0009 121.4489 55.3550 18.2805 179.1996 57 N 4.3707 8.1429 114.7828 56.2357 38.3300 177.9506 58 S 3.9667 7.2219 115.6783 61.0155 62.7720 175.7209 59 L 4.2650 8.0500 119.7605 55.1957 41.2076 178.7624 60 K 3.7370 7.4598 118.9973 57.5148 32.2606 176.8429 61 L 4.7339 6.6352 117.9977 51.7177 43.9059 174.5507 62 P 4.2919 0.0000 0.0000 62.8921 31.6677 175.9028 63 L 4.9506 8.3431 122.7862 53.5193 44.0461 176.3548 64 A 4.7557 8.6949 121.7127 50.6606 21.4999 175.3297 65 V 5.1126 9.7111 115.1898 60.5459 34.6832 175.7904 66 E 4.8337 9.1075 122.5619 54.5521 33.8645 174.8086 67 L 4.9621 8.7592 124.1552 55.0669 42.1510 176.8779 68 T 4.5733 9.0392 113.2050 62.0709 70.0131 173.9319 69 Q 4.6114 7.8720 119.7301 54.3012 33.0294 173.6058 70 E 4.1138 8.5142 117.1523 56.6248 30.0313 176.5982 71 V 4.0892 8.0981 120.3974 62.6366 32.8420 175.1660 72 R 4.6940 8.9014 126.4308 54.7724 31.8918 175.2985 73 A 5.2329 8.4048 125.3533 50.3583 22.0009 175.4680 74 V 4.1041 9.5391 120.3896 61.9318 34.9657 173.2388 75 A 3.7061 9.4848 122.6948 53.9809 15.6194 176.2248 76 N 4.3986 7.9765 114.5630 53.3857 36.9969 174.1412 77 E 5.5583 8.5131 116.2788 55.1505 34.5146 174.3145 78 A 5.3852 9.0485 122.0543 50.9402 23.4011 175.1330 79 A 5.3283 9.3628 121.8661 50.3770 23.0352 175.2491 80 F 5.3423 8.6206 114.7063 55.4472 42.1206 172.9038 81 A 5.4740 8.8406 121.7527 50.5518 21.3700 175.7412 82 F 5.5495 8.5942 116.0119 56.0486 42.2826 172.7755 83 I 4.7215 8.8691 111.1780 59.1299 41.1409 174.7697 84 V 4.8784 8.9110 124.2868 61.6495 34.0556 174.3953 85 S 5.3617 8.8194 124.8235 57.1013 65.9875 173.4465 86 F 4.8599 7.9548 113.7533 56.3691 41.0919 172.3675 87 E 4.8601 9.1231 122.3865 55.2648 31.6788 175.2801 88 Y 4.4960 9.0561 126.4871 56.5820 39.3578 172.7521 89 Q 3.2449 9.2113 122.6562 56.0198 25.8040 173.9398 90 G 3.9567 9.1361 107.2273 45.2001 0.0000 171.5356 91 R 4.4346 7.4412 118.6316 54.5959 30.9618 175.8239 92 K 4.4059 8.4825 124.3096 56.2783 33.0776 176.9512 93 T 4.6059 8.7361 121.3325 61.5045 72.6550 173.1895 94 V 4.6489 8.5718 124.5132 61.1786 34.7094 174.0987 95 V 4.6025 8.9321 128.3485 61.2527 33.7389 174.4177 96 A 4.7971 8.7665 130.1899 48.7182 19.1362 173.8203 97 P 4.8591 0.0000 0.0000 61.6672 34.9752 174.4991 98 I 4.9751 8.2976 119.2939 59.7966 40.2164 174.9086 99 D 5.3090 8.3696 126.9667 52.9232 43.7477 175.1234 100 H 5.2353 9.0237 120.6156 54.6844 33.0732 172.0075 101 F 5.4526 9.2106 124.7477 55.7799 41.8771 174.6710 102 R 5.0135 8.5013 122.7896 54.7026 32.5079 175.0125 103 F 5.0495 9.3778 125.6219 56.3402 41.4700 174.2691 104 N 4.9423 8.8023 117.7787 50.7354 39.9802 175.8711 105 G 3.7673 8.9494 107.2428 48.8151 0.0000 174.8156 106 A 3.9892 7.8794 120.8965 53.4171 18.5826 178.1929 107 G 4.4652 8.6922 104.2998 45.3066 0.0000 173.4201 108 K 4.4800 7.6551 118.3817 54.2277 34.2294 175.6784 109 V 3.4340 7.6982 122.5912 62.9928 31.6267 176.8364 110 V 4.1563 8.8845 121.4674 62.2102 33.5217 175.8680 111 S 5.0346 7.5343 114.5231 56.8377 66.1315 172.3018 112 M 5.3456 9.1200 125.5752 54.0320 35.9207 173.9541 113 R 5.0980 9.1255 123.8236 54.5479 34.7423 173.8315 114 A 5.3350 9.0706 126.5348 49.6727 21.2793 175.4701 115 L 4.6849 8.9697 126.7038 54.5426 42.9930 175.2962 116 F 5.2799 8.0990 120.1700 56.1567 41.0200 173.8112 117 G 4.0634 9.2264 108.0314 44.2941 0.0000 172.7433 118 E 3.9419 8.8237 117.1121 59.3765 29.4566 179.3224 119 K 4.0665 8.0067 117.8471 58.3225 32.6697 176.5284 120 N 4.7185 8.2185 114.9097 53.5237 40.1706 174.4678 121 I 4.3111 7.3051 120.7891 60.6850 37.8911 174.8243 122 H 4.9540 10.4541 124.2292 53.1911 32.8732 172.1410 123 A 4.7976 9.0093 129.1838 54.5721 20.3798 176.6677 124 G 4.2889 6.7900 115.7423 45.9526 0.0000 171.1757 125 A 4.1913 8.2260 129.8874 52.0835 19.3116 176.3312 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 M 8.30 4.33 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 2 N 8.26 4.53 0.00 2.97 2.50 0.00 0.00 7.22 6.51 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 3 T 8.74 4.43 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 1.18 0.00 0.00 4 P 0.00 4.19 0.00 2.14 2.12 0.00 3.56 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 5 E 8.05 4.00 0.00 2.13 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 0.00 2.33 2.28 0.00 6 H 7.86 4.12 0.00 3.16 3.37 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 M 7.63 3.53 0.00 1.71 1.93 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 2.16 0.81 0.00 8 T 7.90 3.82 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 1.14 0.00 0.00 9 A 7.92 3.95 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 10 V 7.79 3.56 2.40 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 1.21 0.00 0.00 0.94 0.00 0.00 11 V 7.47 3.36 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 -0.38 0.00 0.00 0.56 0.00 0.00 12 Q 8.05 3.87 0.00 2.23 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.53 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 13 R 8.12 3.84 0.00 2.01 2.13 0.00 3.16 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 14 Y 8.21 4.13 0.00 3.24 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 15 V 7.92 3.37 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 0.93 0.00 0.00 0.81 0.00 0.00 16 A 8.20 3.97 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 17 A 8.33 3.94 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 18 L 7.80 3.80 0.00 1.87 1.65 0.67 0.08 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 19 N 7.89 4.31 0.00 2.84 2.89 0.00 0.00 7.11 6.97 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 20 A 7.99 4.20 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.64 3.71 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 0.00 0.00 0.00 22 D 7.95 4.57 0.00 2.71 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 23 L 8.14 3.95 0.00 1.80 1.66 0.99 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 24 D 8.13 4.59 0.00 2.74 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 25 G 8.09 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 26 I 7.52 3.93 1.87 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.57 0.42 0.00 0.00 27 V 7.73 3.89 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 1.05 0.00 0.00 1.00 0.00 0.00 28 A 7.86 4.24 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.46 4.18 0.00 1.66 1.44 1.02 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 30 F 7.71 4.86 0.00 3.10 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 31 A 8.37 4.36 1.26 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 0.00 0.00 0.00 32 D 9.03 4.57 0.00 2.81 2.74 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 33 D 7.84 4.84 0.00 2.73 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.78 4.59 1.56 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 0.00 0.00 35 T 8.87 5.07 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 1.17 0.00 0.00 36 V 8.54 4.71 1.74 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 0.25 0.00 0.00 0.70 0.00 0.00 37 E 9.30 4.69 0.00 1.97 1.74 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 2.13 2.28 0.00 38 N 8.17 5.22 0.00 2.62 2.24 0.00 0.00 7.56 8.04 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 39 P 0.00 4.89 0.00 1.54 1.15 0.00 3.77 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.73 0.00 40 V 7.65 3.66 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 0.71 0.00 0.00 0.93 0.00 0.00 41 G 9.48 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 0.00 0.00 0.00 42 S 7.01 4.77 0.00 3.87 3.72 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.51 3.98 0.00 1.92 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 2.29 2.31 0.00 44 P 0.00 4.56 0.00 1.88 1.92 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 45 R 8.92 4.30 0.00 1.52 1.77 0.00 3.21 0.00 0.00 3.01 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.48 0.00 46 S 8.75 4.90 0.00 3.82 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 47 G 9.14 4.65 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 0.00 0.00 0.00 48 T 8.68 3.84 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 1.23 0.00 0.00 49 A 7.98 3.99 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 50 A 7.91 4.07 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 51 I 8.16 3.62 1.95 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.61 0.56 0.00 0.00 52 R 8.46 4.00 0.00 1.99 2.11 0.00 3.12 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 53 E 8.34 3.96 0.00 2.30 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 2.31 2.61 0.00 54 F 8.23 3.97 0.00 3.09 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 55 Y 8.03 3.70 0.00 3.12 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 56 A 8.00 3.98 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 57 N 8.14 4.37 0.00 2.74 2.75 0.00 0.00 7.01 6.82 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 58 S 7.22 3.97 0.00 3.71 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 8.05 4.27 0.00 1.71 1.67 0.94 1.19 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 60 K 7.46 3.74 0.00 1.81 1.86 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.59 7.81 61 L 6.64 4.73 0.00 1.35 1.59 0.67 0.88 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 62 P 0.00 4.29 0.00 2.07 2.02 0.00 3.70 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 2.04 2.12 0.00 63 L 8.34 4.95 0.00 1.55 1.66 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.69 4.76 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 65 V 9.71 5.11 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.01 0.00 0.00 66 E 9.11 4.83 0.00 1.95 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 2.25 2.31 0.00 67 L 8.76 4.96 0.00 1.56 1.66 0.79 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 68 T 9.04 4.57 4.29 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 1.32 0.00 0.00 69 Q 7.87 4.61 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.06 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 70 E 8.51 4.11 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 71 V 8.10 4.09 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 0.81 0.00 0.00 0.82 0.00 0.00 72 R 8.90 4.69 0.00 2.08 1.88 0.00 3.21 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 73 A 8.40 5.23 1.14 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 0.00 0.00 74 V 9.54 4.10 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 0.65 0.00 0.00 0.94 0.00 0.00 75 A 9.48 3.71 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 76 N 7.98 4.40 0.00 3.00 3.03 0.00 0.00 6.77 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 77 E 8.51 5.56 0.00 2.10 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 0.00 2.34 2.52 0.00 78 A 9.05 5.39 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 79 A 9.36 5.33 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 80 F 8.62 5.34 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.84 5.47 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 82 F 8.59 5.55 0.00 3.32 3.32 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 83 I 8.87 4.72 1.87 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 1.38 0.94 0.91 0.00 0.00 84 V 8.91 4.88 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 1.18 0.00 0.00 1.09 0.00 0.00 85 S 8.82 5.36 0.00 3.82 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 86 F 7.95 4.86 0.00 3.10 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 87 E 9.12 4.86 0.00 2.02 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 2.28 2.23 0.00 88 Y 9.06 4.50 0.00 3.21 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 89 Q 9.21 3.24 0.00 1.80 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 5.11 0.00 0.00 0.00 0.00 0.00 2.02 2.15 0.00 90 G 9.14 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 0.00 0.00 0.00 91 R 7.44 4.43 0.00 2.21 1.98 0.00 3.20 0.00 0.00 3.22 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 92 K 8.48 4.41 0.00 1.57 1.68 0.00 1.56 0.00 0.00 1.84 0.00 0.00 3.02 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.51 7.81 93 T 8.74 4.61 3.01 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 0.00 0.00 1.06 0.00 0.00 94 V 8.57 4.65 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 0.84 0.00 0.00 0.86 0.00 0.00 95 V 8.93 4.60 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 0.50 0.00 0.00 1.01 0.00 0.00 96 A 8.77 4.80 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 97 P 0.00 4.86 0.00 1.96 2.14 0.00 2.20 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.48 0.00 98 I 8.30 4.98 1.88 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 1.25 0.78 0.89 0.00 0.00 99 D 8.37 5.31 0.00 1.58 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 0.00 100 H 9.02 5.24 0.00 3.18 3.17 0.00 5.57 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 9.21 5.45 0.00 3.03 2.31 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 0.00 102 R 8.50 5.01 0.00 1.78 1.67 0.00 3.10 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 103 F 9.38 5.05 0.00 2.93 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 8.80 4.94 0.00 2.79 2.94 0.00 0.00 7.35 6.54 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 0.00 105 G 8.95 3.77 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 0.00 0.00 0.00 106 A 7.88 3.99 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 0.00 107 G 8.69 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 7.66 4.48 0.00 1.95 1.66 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.35 7.81 109 V 7.70 3.43 0.73 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 -0.14 0.00 0.00 -0.32 0.00 0.00 110 V 8.88 4.16 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 0.62 0.00 0.00 0.96 0.00 0.00 111 S 7.53 5.03 0.00 3.81 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 0.00 112 M 9.12 5.35 0.00 2.22 1.85 0.00 0.00 0.00 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 3.09 0.00 113 R 9.13 5.10 0.00 1.85 1.80 0.00 3.19 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 114 A 9.07 5.33 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.97 4.68 0.00 1.76 1.61 0.92 0.99 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 0.00 116 F 8.10 5.28 0.00 3.03 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 0.00 117 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 0.00 118 E 8.82 3.94 0.00 2.08 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 2.39 2.36 0.00 119 K 8.01 4.07 0.00 1.72 1.84 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 120 N 8.22 4.72 0.00 2.88 3.00 0.00 0.00 6.84 7.05 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 0.00 121 I 7.31 4.31 1.87 0.00 0.00 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 1.34 0.78 0.92 0.00 0.00 122 H 10.45 4.95 0.00 3.03 3.17 0.00 5.89 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 9.01 4.80 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 0.00 124 G 6.79 4.29 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 0.00 125 A 8.23 4.19 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