NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5253 8.3601 120.5314 54.2954 42.5350 175.9265 3 A 3.7632 7.5518 121.8443 54.7345 18.8840 177.1375 4 A 4.3968 8.2707 122.2762 51.3434 16.5475 174.2903 5 I 4.5134 7.1391 124.4836 60.2962 46.7141 177.1986 6 K 4.0111 8.3683 128.7630 59.5641 32.3096 181.3196 7 R 4.3184 8.9167 124.5823 63.1091 29.4172 184.7359 8 K 4.2765 7.9035 123.0229 59.4219 31.7634 180.8135 9 L 4.4121 8.0272 121.3835 58.3988 41.5259 180.0649 10 Q 4.1131 7.8879 123.2752 60.5701 28.6995 181.2520 11 S 5.0551 7.9165 119.6276 57.4478 61.4772 176.2437 *12 F 4.5748 8.2017 115.6660 57.7449 41.0363 176.9179 13 N 4.1397 7.8568 115.0469 54.3948 34.6390 177.2581 14 I 4.9185 7.4400 118.7218 58.5167 40.2131 177.0238 15 S 4.2906 9.1850 126.5784 60.7749 64.9637 175.6582 16 N 4.0202 7.6203 114.9085 51.9932 34.0977 170.2864 17 I 3.9798 7.7101 120.9707 61.4662 38.6249 178.0206 18 V 4.2629 8.1883 125.4623 61.4670 34.4020 174.6881 19 I 4.2612 8.5972 131.3912 61.7175 38.5683 175.2834 20 K 4.1529 7.6183 124.4911 55.7569 37.1136 173.7168 21 S 4.6842 8.8319 116.1726 60.1529 61.7468 170.2847 22 S 5.1110 8.3223 120.8756 55.6030 64.0135 173.9640 23 P 4.3921 0.0000 0.0000 63.5144 30.8268 176.0537 24 I 4.3874 7.6553 119.7537 58.9860 39.3958 175.4691 25 S 4.1741 8.5449 120.4916 59.3559 63.1525 175.9600 26 G 4.1066 8.9202 107.3876 45.8011 0.0000 173.0731 27 I 5.1796 7.4916 118.3829 59.6203 41.6404 175.2027 28 K 4.6065 9.2778 122.3027 54.9910 35.8410 176.0200 29 T 3.6143 8.6217 122.0299 64.2200 68.1249 172.3231 30 A 4.4622 8.2845 128.3402 50.7922 18.5892 175.2853 31 V 4.1115 8.6310 120.6665 63.4843 31.7493 175.1125 32 T 4.6918 8.7377 121.6949 60.4173 71.7641 175.5232 33 D 4.7805 8.6632 118.0899 53.9100 39.9465 173.4279 34 Q 4.4322 9.2855 117.8658 56.2497 30.0593 174.9486 35 G 4.1645 6.8896 104.0018 43.0550 0.0000 173.3702 36 I 4.2415 7.7022 121.1444 60.7160 36.1335 176.4349 37 L 4.6574 8.4517 128.3610 54.1536 44.5302 174.9303 38 Y 4.9594 8.4052 115.2081 57.2093 42.1509 174.9858 39 V 5.2638 8.7387 125.8330 60.4253 35.2394 175.5250 40 S 4.9286 8.7315 123.0704 58.6752 63.1215 175.5204 41 E 3.9381 9.8839 126.6190 60.6746 29.3084 179.4596 42 D 4.3714 8.3333 116.6314 56.6684 40.0640 180.6593 43 G 4.1559 8.0483 108.5938 46.7563 0.0000 174.6950 44 K 4.4748 7.8486 117.9633 53.5712 33.9182 177.6813 45 Y 5.1793 7.7051 115.3879 57.1425 41.7488 173.8092 46 L 5.0935 8.7556 125.8658 53.2837 45.0271 175.4061 47 F 4.5687 9.5406 125.2537 55.5986 40.6113 175.8682 48 E 4.6150 8.8175 127.3043 56.2871 30.9748 176.8860 49 G 4.2233 7.8754 108.3241 44.7697 0.0000 176.3151 50 K 4.4062 8.5300 129.2050 55.0957 34.6747 174.4249 51 L 4.2089 8.4189 130.5555 54.7417 43.2673 174.7748 52 Y 5.2859 8.1090 125.1794 59.0065 41.5406 174.4402 53 E 5.1063 7.8014 120.9611 56.8254 33.1739 178.4503 54 L 4.7388 8.2078 129.1161 56.1095 43.4387 182.9138 55 T 3.4760 9.4684 108.8369 61.5426 68.5466 178.0553 56 N 5.0038 9.1229 114.4902 55.8969 44.7401 176.4747 57 N 4.4598 8.2214 114.0859 53.3793 38.3019 177.5591 58 G 3.9855 7.1792 103.3729 44.2657 0.0000 170.4984 59 P 4.8355 0.0000 0.0000 62.9404 28.5656 176.0098 60 V 3.8507 8.1457 119.8389 61.8216 32.1808 174.8603 61 D 4.3132 8.5825 127.9522 53.8834 41.4062 176.9901 62 V 3.5983 8.3902 126.1124 66.0060 31.5294 177.4807 63 A 4.3368 8.6766 119.0928 52.9915 18.0569 179.4314 64 G 3.5421 8.0853 108.0402 48.4426 0.0000 177.0180 65 K 4.0800 7.7252 125.4293 59.0634 31.4392 181.1780 66 I 3.9173 7.4733 118.3748 64.3148 37.3475 177.8448 67 L 3.9494 8.2781 121.9078 58.0864 41.9158 179.0054 68 V 3.9075 8.0109 119.3777 65.4762 30.9452 177.8799 69 D 4.3251 7.8514 118.9868 56.7802 40.4188 178.4442 70 K 3.6316 7.7457 118.9821 59.9150 32.3649 177.8694 71 L 4.0351 8.1151 119.6919 58.2150 41.9769 178.1364 72 N 4.1244 8.8011 116.5270 56.6130 38.5574 177.0468 73 S 4.2508 8.0608 112.9724 60.1964 63.2213 174.7801 74 Y 4.9893 8.3072 120.5701 58.3953 38.4452 178.0344 75 K 4.4054 8.4611 123.3117 59.7214 32.8240 177.1580 76 D 4.8903 8.1464 114.7373 54.7484 40.3238 176.5409 77 E 4.7756 8.7386 118.6539 56.2533 31.6981 176.3892 78 M 4.6764 7.8850 118.1662 55.4572 33.2425 176.9681 79 I 4.0959 8.5657 124.0332 60.0090 37.4353 174.9290 80 V 4.1415 7.9031 126.4289 62.4690 32.4729 175.4288 81 Y 4.6608 8.1985 122.9112 54.9873 37.4051 173.1866 82 P 4.5661 0.0000 0.0000 61.8956 32.8049 175.8642 83 A 4.7843 7.9464 125.5121 51.4843 20.9583 178.5196 84 K 4.3050 7.1525 118.4059 55.8292 33.5012 175.9340 85 N 4.8229 7.5884 124.1324 51.6429 40.8917 174.4412 86 E 4.3194 8.7668 124.2597 56.8402 30.0469 176.7975 87 K 4.5755 9.3077 119.5943 56.5417 34.6516 175.8380 88 H 4.9548 7.8992 115.7039 54.4743 33.6368 172.8521 89 V 4.5039 8.3082 120.1282 61.4764 32.4217 173.5102 90 V 4.4815 8.4180 118.8090 59.5481 34.2888 174.6174 91 T 4.8427 8.2978 121.4627 62.1717 70.4578 173.7737 92 V 4.8409 8.6473 126.7709 61.1016 34.3710 174.1836 93 F 5.0309 9.3196 127.2988 56.8408 40.3203 174.6081 94 M 5.0825 9.1525 123.0249 53.7882 36.1367 173.3048 95 D 5.4744 8.6377 121.4597 52.4216 44.0899 175.7467 96 I 4.2042 8.7833 117.3219 62.6480 38.2181 176.3670 97 T 4.5129 8.3823 111.8999 61.5994 69.1500 173.7709 98 C 4.8957 7.9915 121.9070 55.5937 44.6992 172.2928 99 H 3.9226 8.9661 128.0764 60.1096 29.2677 176.3261 100 Y 3.7202 7.8497 117.2980 60.6570 37.8169 178.6102 101 C 4.3970 8.1843 117.4207 60.0424 40.7073 175.1030 102 H 4.5160 8.4883 121.5999 58.6481 29.2433 176.7172 103 L 3.7600 7.6925 121.0265 58.2610 42.2395 178.2603 104 L 4.4767 8.1292 120.3839 58.7873 42.0707 178.5067 105 H 4.2250 8.1991 119.3119 58.6718 29.6425 176.7400 106 Q 4.3509 7.8658 116.7175 57.1824 28.5051 176.5575 107 Q 4.6935 7.8227 118.7906 55.1122 30.2707 177.3383 108 L 4.1702 8.1928 124.0481 58.5432 41.4784 179.9927 109 K 4.0251 8.0953 123.0321 59.9147 31.4707 180.9162 110 E 4.0490 7.9644 119.3762 59.4884 29.5333 178.8410 111 Y 4.0653 8.0750 116.9759 61.1801 37.9548 178.5629 112 N 4.5483 9.1648 118.4580 56.5396 38.5583 176.6584 113 D 4.6656 8.3391 117.0862 55.3463 40.9855 177.3291 114 L 4.6488 7.3607 119.1209 53.7621 42.2782 176.3419 115 G 3.8028 8.2299 107.4730 46.4581 0.0000 173.0348 116 I 5.0210 7.7871 120.4018 59.3538 39.0750 175.6989 117 T 4.2347 9.0209 125.6594 62.9451 69.7678 174.0631 118 V 4.3163 8.3159 127.1307 61.6333 33.4573 174.5486 119 R 4.7572 8.4496 126.8225 54.6233 33.0381 174.3421 120 Y 5.3289 8.4682 122.0524 57.1583 39.8959 174.9298 121 L 5.1863 8.8747 122.2174 52.8513 45.6666 175.5513 122 A 4.2184 8.0094 122.5774 51.1021 20.0270 177.7723 123 F 4.8764 8.4802 122.2410 56.2059 39.7511 171.1497 124 P 4.5860 0.0000 0.0000 61.9779 31.0461 177.5288 125 R 4.0942 9.0527 123.4255 59.5385 30.3462 180.2042 126 A 4.1574 7.8662 119.7496 52.0960 17.4748 177.7693 127 G 3.6085 7.6293 111.5318 46.2010 0.0000 173.1433 128 M 4.2402 8.0117 114.8876 55.2917 32.2949 177.1423 129 N 4.9528 7.2369 115.1011 50.7544 38.9473 172.6466 130 N 4.4390 7.5158 115.9072 50.8190 40.3651 175.7680 131 Q 3.9027 8.6166 120.2437 60.1855 28.7456 179.5851 132 T 4.2136 8.1456 116.9352 66.1418 68.0850 176.3265 133 A 4.0010 8.1022 122.4651 54.6349 18.4925 179.7354 134 K 4.1640 7.8348 116.8436 59.4004 32.1655 179.3633 135 Q 4.0863 8.2747 118.6059 59.1608 28.5450 178.5118 136 M 4.3736 7.9790 119.9439 58.0337 32.0490 178.4864 137 E 3.9533 7.9793 118.4979 59.0863 29.7195 178.4783 138 A 4.0438 7.8894 120.3499 55.4449 18.2530 179.6069 139 I 3.6911 7.9561 116.9668 64.5345 37.3397 178.6086 140 W 4.0522 8.8373 118.4807 58.4832 28.9773 177.0265 141 T 4.4205 7.5664 106.1292 60.8205 68.9141 174.0887 142 A 4.2338 7.4587 125.7004 52.3824 18.6973 177.6137 143 K 4.1744 8.4386 116.5924 59.1446 32.5436 177.8667 144 D 4.6496 7.6593 117.7931 50.7194 42.0749 172.8048 145 P 4.2838 0.0000 0.0000 65.3358 31.4775 177.7731 146 V 3.4560 7.4042 115.6391 65.7908 31.3351 177.9743 147 F 3.9773 8.4724 120.1648 61.1514 39.3348 176.8501 148 A 4.0400 8.1705 119.9905 55.2344 18.1462 179.2806 149 L 3.7854 8.3304 118.9256 58.3305 41.7136 178.6207 150 N 4.2686 8.4658 116.8295 56.6474 38.4661 177.2502 151 E 3.8414 8.1766 119.6367 59.1135 29.5009 179.1427 152 A 4.2034 7.8045 122.2175 54.6987 18.4936 179.4860 153 E 4.0175 8.3613 116.7197 58.5698 29.3005 178.5459 154 K 4.3961 7.1658 115.5379 56.1632 32.5416 177.3937 155 G 3.9942 7.8523 107.8246 45.3572 0.0000 174.5823 156 N 4.6278 8.1026 118.3757 52.0115 37.1711 174.5137 157 L 4.4086 7.8505 122.1127 52.9086 42.9310 175.3895 158 P 4.3887 0.0000 0.0000 63.3347 32.0110 177.3491 159 K 4.1167 8.7495 124.4470 57.6953 32.0986 176.0356 160 E 4.3359 7.8701 116.0128 57.5257 30.8239 175.7645 161 V 4.1174 7.4714 114.8655 63.1587 33.8384 171.7984 162 K 4.5736 8.5664 124.1382 54.9017 34.7720 175.3795 163 T 4.4032 8.0978 116.4294 61.4134 69.4607 173.3322 164 P 4.0670 0.0000 0.0000 63.4755 31.7510 173.8019 165 N 4.9631 8.1997 121.5395 53.9401 45.7800 176.3667 166 I 3.7042 9.0273 119.5048 64.1454 37.2265 179.0333 167 V 3.2807 7.6723 112.9368 63.7716 31.2585 178.4075 168 K 3.8341 7.6657 119.1604 59.3819 32.2540 178.6371 169 K 3.9325 7.8994 119.9032 59.8841 31.8109 178.4986 170 H 4.4275 8.0891 115.8979 58.8289 28.8701 176.8481 171 Y 4.0969 8.3853 121.8318 60.8968 38.7622 177.8354 172 E 4.0962 8.7684 119.6352 59.6675 29.4948 179.3716 173 L 4.3345 8.2578 119.7967 57.8121 42.0713 179.3363 174 G 3.0417 8.3338 106.1464 47.4828 0.0000 175.7879 175 I 3.6403 7.6510 121.9067 64.2682 36.9687 178.0887 176 Q 3.9231 7.6689 117.0375 59.3105 28.6536 179.0806 177 F 4.1670 7.7237 116.9540 58.3901 39.0018 176.3410 178 G 3.8367 8.3917 106.9080 45.4874 0.0000 173.6084 179 V 3.4554 7.5082 119.8379 62.5549 31.6503 175.9162 180 R 4.5413 8.2412 123.8424 54.7909 31.3594 174.7625 181 G 4.0153 6.9103 106.5872 45.9425 0.0000 172.4368 182 T 4.6943 8.1367 108.2063 58.8621 71.7910 171.8675 183 P 5.0082 0.0000 0.0000 62.5256 33.6003 175.3353 184 S 4.7023 8.3872 115.4656 57.3026 67.0520 173.2132 185 I 4.5431 8.4582 126.6353 60.3358 38.7516 174.9265 186 V 4.3492 9.0221 129.0573 61.0437 33.0772 175.5999 187 T 4.2329 8.4747 122.6182 61.8705 67.8818 174.7828 188 S 4.3117 8.5465 119.6592 60.5196 63.2334 174.7232 189 T 4.4109 7.9022 111.5152 61.5072 68.8727 176.6225 190 G 4.1921 8.0013 109.5309 46.4782 0.0000 176.6570 191 E 4.2387 7.4518 118.0464 57.1698 29.1592 176.7700 192 L 4.6462 7.9228 113.0083 55.4565 43.2230 174.1063 193 I 4.3197 8.5372 128.9506 62.2707 37.6420 176.4584 194 G 3.7547 7.4298 108.6321 45.3262 0.0000 173.3960 195 G 4.2580 7.6458 111.2454 42.7926 0.0000 172.4828 196 Y 4.4032 7.9538 122.4590 57.5065 39.4125 175.7189 197 L 4.0158 7.5914 125.6062 51.8608 45.2685 176.5803 198 K 3.9184 8.0137 123.7909 56.9311 34.1036 174.3411 199 P 3.3189 0.0000 0.0000 66.1599 31.2584 178.2206 200 A 3.8442 7.7749 117.7746 56.0360 18.7123 178.9515 201 D 4.2951 8.0386 115.1445 57.6104 40.5533 179.2272 202 L 3.9691 8.3239 120.7445 57.9702 41.9323 178.7086 203 L 3.9114 8.1985 120.8418 58.2615 42.0304 178.5802 204 R 3.8301 8.1530 116.9476 59.6876 30.1500 178.5603 205 A 3.7472 8.0263 119.8388 55.4526 18.1533 179.7623 206 L 3.9795 7.2066 115.4502 57.8093 41.9493 179.1295 207 E 4.1298 8.2020 117.6426 59.3800 29.4884 178.7335 208 E 4.3189 8.5603 118.3318 58.6904 29.7686 178.0845 209 T 4.1291 7.1632 113.0245 60.4400 68.5382 174.5670 210 A 4.1590 8.4441 128.6655 52.3606 18.4366 176.8838 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 D 8.36 4.53 0.00 2.66 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 3 A 7.55 3.76 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 4 A 8.27 4.40 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 5 I 7.14 4.51 1.96 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.03 0.92 0.00 0.00 6 K 8.37 4.01 0.00 1.75 1.84 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.11 7.81 7 R 8.92 4.32 0.00 1.77 1.95 0.00 3.24 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 8 K 7.90 4.28 0.00 1.85 1.76 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.36 1.10 7.81 9 L 8.03 4.41 0.00 1.73 1.75 0.97 0.97 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 10 Q 7.89 4.11 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 7.22 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 11 S 7.92 5.06 0.00 3.65 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 *12 F 8.20 4.57 0.00 2.23 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 0.00 0.00 0.00 13 N 7.86 4.14 0.00 2.79 2.69 0.00 0.00 6.65 8.76 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 14 I 7.44 4.92 1.96 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 2.33 0.91 0.00 0.00 15 S 9.18 4.29 0.00 3.89 3.83 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 0.00 0.00 0.00 16 N 7.62 4.02 0.00 2.79 2.77 0.00 0.00 6.56 7.72 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 17 I 7.71 3.98 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.96 0.90 0.00 0.00 18 V 8.19 4.26 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 0.93 0.00 0.00 0.97 0.00 0.00 19 I 8.60 4.26 1.97 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.51 1.00 0.00 0.00 20 K 7.62 4.15 0.00 1.45 1.64 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.13 1.10 7.81 21 S 8.83 4.68 0.00 3.39 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 22 S 8.32 5.11 0.00 4.16 4.15 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 23 P 0.00 4.39 0.00 2.03 2.12 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 24 I 7.66 4.39 1.77 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.61 0.85 0.00 0.00 25 S 8.54 4.17 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.92 4.11 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 0.00 0.00 0.00 27 I 7.49 5.18 2.05 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.96 1.07 0.00 0.00 28 K 9.28 4.61 0.00 1.61 1.71 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.36 1.42 7.81 29 T 8.62 3.61 4.14 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 0.86 0.00 0.00 30 A 8.28 4.46 1.19 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 31 V 8.63 4.11 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 0.89 0.00 0.00 0.82 0.00 0.00 32 T 8.74 4.69 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 33 D 8.66 4.78 0.00 2.72 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 34 Q 9.29 4.43 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.62 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 35 G 6.89 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 0.00 0.00 0.00 36 I 7.70 4.24 1.78 0.00 0.00 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 1.22 0.48 0.63 0.00 0.00 37 L 8.45 4.66 0.00 1.67 1.67 0.94 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.41 4.96 0.00 2.91 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 39 V 8.74 5.26 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 1.23 0.00 0.00 1.01 0.00 0.00 40 S 8.73 4.93 0.00 3.46 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 41 E 9.88 3.94 0.00 1.74 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 2.51 2.46 0.00 42 D 8.33 4.37 0.00 2.69 2.58 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 43 G 8.05 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 0.00 0.00 0.00 44 K 7.85 4.47 0.00 1.74 1.66 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.24 0.98 7.81 45 Y 7.71 5.18 0.00 2.92 2.58 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 46 L 8.76 5.09 0.00 1.66 1.54 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 47 F 9.54 4.57 0.00 3.24 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 48 E 8.82 4.61 0.00 1.96 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 2.25 2.33 0.00 49 G 7.88 4.22 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 0.00 50 K 8.53 4.41 0.00 1.76 1.78 0.00 1.86 0.00 0.00 1.36 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.72 1.23 7.81 51 L 8.42 4.21 0.00 0.94 0.62 0.71 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 8.11 5.29 0.00 2.73 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 53 E 7.80 5.11 0.00 1.82 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 2.05 2.22 0.00 54 L 8.21 4.74 0.00 1.77 1.68 0.83 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 55 T 9.47 3.48 4.24 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 1.21 0.00 0.00 56 N 9.12 5.00 0.00 2.64 2.81 0.00 0.00 6.72 8.00 0.00 0.00 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 8.22 4.46 0.00 2.74 2.73 0.00 0.00 6.61 7.51 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 58 G 7.18 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 59 P 0.00 4.84 0.00 2.06 1.68 0.00 3.68 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 60 V 8.15 3.85 2.24 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 0.94 0.00 0.00 0.98 0.00 0.00 61 D 8.58 4.31 0.00 2.37 2.37 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 62 V 8.39 3.60 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 1.01 0.00 0.00 0.89 0.00 0.00 63 A 8.68 4.34 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 64 G 8.09 3.54 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 0.00 65 K 7.73 4.08 0.00 1.82 1.83 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 66 I 7.47 3.92 1.94 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.96 0.84 0.00 0.00 67 L 8.28 3.95 0.00 1.81 1.32 0.75 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.01 3.91 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 0.99 0.00 0.00 1.02 0.00 0.00 69 D 7.85 4.33 0.00 2.81 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 70 K 7.75 3.63 0.00 1.67 2.11 0.00 1.57 0.00 0.00 1.59 0.00 0.00 3.28 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.42 7.81 71 L 8.12 4.04 0.00 2.08 1.97 0.76 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.80 4.12 0.00 2.94 2.89 0.00 0.00 6.91 7.14 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 73 S 8.06 4.25 0.00 3.89 4.03 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 74 Y 8.31 4.99 0.00 3.14 2.95 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 75 K 8.46 4.41 0.00 1.90 1.81 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.49 7.81 76 D 8.15 4.89 0.00 2.78 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 77 E 8.74 4.78 0.00 2.22 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 0.00 2.31 2.34 0.00 78 M 7.88 4.68 0.00 1.95 2.20 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.55 0.00 79 I 8.57 4.10 1.89 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.32 0.72 0.00 0.00 80 V 7.90 4.14 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 0.73 0.00 0.00 0.89 0.00 0.00 81 Y 8.20 4.66 0.00 2.73 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 82 P 0.00 4.57 0.00 1.93 2.00 0.00 3.66 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 83 A 7.95 4.78 1.33 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 0.00 0.00 84 K 7.15 4.31 0.00 1.81 1.59 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.06 7.81 85 N 7.59 4.82 0.00 2.61 2.69 0.00 0.00 6.96 7.65 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 86 E 8.77 4.32 0.00 2.27 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 2.27 2.33 0.00 87 K 9.31 4.58 0.00 1.44 1.61 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.32 7.81 88 H 7.90 4.95 0.00 3.04 3.10 0.00 5.57 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.31 4.50 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 0.79 0.00 0.00 0.98 0.00 0.00 90 V 8.42 4.48 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 nan 0.00 0.00 0.81 0.00 0.00 91 T 8.30 4.84 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 0.96 0.00 0.00 92 V 8.65 4.84 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 1.16 0.00 0.00 0.80 0.00 0.00 93 F 9.32 5.03 0.00 2.89 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 94 M 9.15 5.08 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 95 D 8.64 5.47 0.00 2.96 2.58 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 96 I 8.78 4.20 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.74 1.03 0.00 0.00 97 T 8.38 4.51 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 1.22 0.00 0.00 98 C 7.99 4.90 0.00 3.05 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 99 H 8.97 3.92 0.00 3.08 3.14 0.00 5.72 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 0.00 100 Y 7.85 3.72 0.00 3.01 2.75 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 0.00 101 C 8.18 4.40 0.00 3.18 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 0.00 102 H 8.49 4.52 0.00 3.16 3.38 0.00 5.85 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.69 3.76 0.00 1.34 1.41 0.86 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.13 4.48 0.00 2.10 2.11 0.63 0.94 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 0.00 105 H 8.20 4.22 0.00 3.36 3.35 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.87 4.35 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.09 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 107 Q 7.82 4.69 0.00 2.43 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 108 L 8.19 4.17 0.00 1.56 1.64 0.58 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.10 4.03 0.00 1.76 1.83 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.11 7.81 110 E 7.96 4.05 0.00 2.00 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 2.29 2.39 0.00 111 Y 8.07 4.07 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 0.00 112 N 9.16 4.55 0.00 2.99 2.91 0.00 0.00 7.07 7.96 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 0.00 113 D 8.34 4.67 0.00 2.76 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 0.00 114 L 7.36 4.65 0.00 1.74 1.70 0.86 0.86 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 0.00 115 G 8.23 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 0.00 0.00 0.00 0.00 116 I 7.79 5.02 2.12 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.83 0.94 0.00 0.00 117 T 9.02 4.23 4.33 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 1.19 0.00 0.00 118 V 8.32 4.32 1.78 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 0.23 0.00 0.00 0.61 0.00 0.00 119 R 8.45 4.76 0.00 1.70 1.75 0.00 3.14 0.00 0.00 3.13 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 120 Y 8.47 5.33 0.00 3.11 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 0.00 121 L 8.87 5.19 0.00 0.72 1.02 0.44 0.35 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 0.00 122 A 8.01 4.22 -0.13 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 0.00 0.00 123 F 8.48 4.88 0.00 3.28 3.07 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 0.00 124 P 0.00 4.59 0.00 2.07 2.01 0.00 3.81 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 125 R 9.05 4.09 0.00 1.94 2.17 0.00 3.31 0.00 0.00 3.42 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 126 A 7.87 4.16 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 0.00 127 G 7.63 3.61 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 0.00 0.00 0.00 128 M 8.01 4.24 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.05 0.00 129 N 7.24 4.95 0.00 2.54 2.64 0.00 0.00 7.01 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 0.00 130 N 7.52 4.44 0.00 2.82 2.81 0.00 0.00 5.68 7.50 0.00 0.00 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 Q 8.62 3.90 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.94 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 132 T 8.15 4.21 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 133 A 8.10 4.00 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 0.00 134 K 7.83 4.16 0.00 1.91 2.01 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.69 1.44 7.81 135 Q 8.27 4.09 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.75 0.00 136 M 7.98 4.37 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.80 0.00 137 E 7.98 3.95 0.00 2.27 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 2.27 2.58 0.00 138 A 7.89 4.04 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 I 7.96 3.69 2.24 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.88 0.69 0.00 0.00 140 W 8.84 4.05 0.00 3.61 3.19 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 0.00 141 T 7.57 4.42 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 1.32 0.00 0.00 142 A 7.46 4.23 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 0.00 143 K 8.44 4.17 0.00 1.74 1.84 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.41 7.81 144 D 7.66 4.65 0.00 2.61 2.47 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 0.00 145 P 0.00 4.28 0.00 2.01 1.83 0.00 3.59 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 146 V 7.40 3.46 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 0.82 0.00 0.00 0.56 0.00 0.00 147 F 8.47 3.98 0.00 3.21 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 0.00 148 A 8.17 4.04 1.39 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 0.00 0.00 149 L 8.33 3.79 0.00 1.48 1.70 0.73 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 150 N 8.47 4.27 0.00 2.76 2.79 0.00 0.00 7.09 7.70 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 0.00 151 E 8.18 3.84 0.00 1.97 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 1.54 1.74 0.00 152 A 7.80 4.20 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 0.00 153 E 8.36 4.02 0.00 1.98 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 0.00 2.28 1.92 0.00 154 K 7.17 4.40 0.00 1.83 1.80 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.56 7.81 155 G 7.85 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 0.00 156 N 8.10 4.63 0.00 2.83 2.77 0.00 0.00 6.89 6.35 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 0.00 157 L 7.85 4.41 0.00 1.64 1.60 0.98 1.13 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 0.00 158 P 0.00 4.39 0.00 2.39 2.09 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.11 0.00 159 K 8.75 4.12 0.00 1.80 1.76 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.00 7.81 160 E 7.87 4.34 0.00 2.06 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 2.29 2.37 0.00 161 V 7.47 4.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.00 0.00 0.00 162 K 8.57 4.57 0.00 1.77 1.72 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.44 7.81 163 T 8.10 4.40 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 164 P 0.00 4.07 0.00 1.95 1.93 0.00 3.67 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 2.21 2.21 0.00 165 N 8.20 4.96 0.00 2.68 2.78 0.00 0.00 7.24 7.98 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 0.00 166 I 9.03 3.70 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.37 0.71 0.00 0.00 167 V 7.67 3.28 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 0.53 0.00 0.00 0.83 0.00 0.00 168 K 7.67 3.83 0.00 1.72 1.96 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.38 7.81 169 K 7.90 3.93 0.00 1.79 1.71 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.65 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.01 1.52 7.81 170 H 8.09 4.43 0.00 3.23 3.49 0.00 5.73 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 Y 8.39 4.10 0.00 3.05 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 0.00 172 E 8.77 4.10 0.00 2.16 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 2.49 2.71 0.00 173 L 8.26 4.33 0.00 2.15 2.28 1.26 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 174 G 8.33 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 I 7.65 3.64 2.00 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 1.55 0.66 0.92 0.00 0.00 176 Q 7.67 3.92 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.00 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 177 F 7.72 4.17 0.00 2.95 2.95 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 0.00 178 G 8.39 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 0.00 179 V 7.51 3.46 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 0.00 0.00 -0.09 0.00 0.00 0.09 0.00 0.00 180 R 8.24 4.54 0.00 1.75 1.86 0.00 3.33 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.78 0.00 181 G 6.91 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 0.00 182 T 8.14 4.69 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 0.00 183 P 0.00 5.01 0.00 2.27 2.36 0.00 3.94 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 2.31 2.04 0.00 184 S 8.39 4.70 0.00 3.65 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 0.00 185 I 8.46 4.54 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.70 0.86 0.00 0.00 186 V 9.02 4.35 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 0.65 0.00 0.00 0.75 0.00 0.00 187 T 8.47 4.23 4.24 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 1.30 0.00 0.00 188 S 8.55 4.31 0.00 4.03 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 T 7.90 4.41 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 1.23 0.00 0.00 190 G 8.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 E 7.45 4.24 0.00 2.01 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 2.35 2.29 0.00 192 L 7.92 4.65 0.00 1.64 1.58 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 193 I 8.54 4.32 1.84 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 1.21 0.69 0.88 0.00 0.00 194 G 7.43 3.75 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 0.00 195 G 7.65 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 0.00 0.00 0.00 0.00 196 Y 7.95 4.40 0.00 2.77 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 L 7.59 4.02 0.00 1.52 1.40 0.87 0.79 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 0.00 198 K 8.01 3.92 0.00 1.88 1.87 0.00 1.52 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.55 7.81 199 P 0.00 3.32 0.00 1.75 1.55 0.00 3.52 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.98 0.00 200 A 7.77 3.84 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 0.00 201 D 8.04 4.30 0.00 2.80 2.68 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 0.00 202 L 8.32 3.97 0.00 2.02 2.08 0.90 0.55 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 0.00 203 L 8.20 3.91 0.00 1.77 1.86 1.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 204 R 8.15 3.83 0.00 1.99 1.94 0.00 3.20 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 205 A 8.03 3.75 1.33 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 0.00 0.00 206 L 7.21 3.98 0.00 1.74 1.48 0.84 0.85 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 0.00 207 E 8.20 4.13 0.00 1.90 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 2.42 2.53 0.00 208 E 8.56 4.32 0.00 1.88 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 2.45 2.47 0.00 209 T 7.16 4.13 4.24 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 1.21 0.00 0.00 210 A 8.44 4.16 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 * Residues marked with a * may have inaccurate shift predictions.