NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.1056 8.0385 122.4999 55.1843 43.7705 177.8833 5 A 4.4176 7.8623 118.1478 51.9434 18.3799 174.4703 6 E 4.2459 8.8772 118.6347 58.7196 31.5322 174.6898 7 H 4.9362 7.6150 115.1813 54.3953 29.5470 173.7483 8 L 4.3448 7.6758 118.9325 54.6464 42.7062 177.9950 9 L 4.3318 8.1783 121.8724 54.2277 42.4238 177.3930 10 K 4.2502 8.3828 121.1037 55.4448 32.7226 175.4189 11 P 4.5065 0.0000 0.0000 62.2134 32.0181 176.1879 12 L 4.0797 8.2164 119.9779 54.0596 42.2276 175.7719 13 P 4.5513 0.0000 0.0000 61.8255 32.4333 176.9871 14 A 4.0084 8.4886 121.0345 55.0128 18.2141 178.0957 15 D 4.5509 8.0350 112.4400 52.9905 39.9784 176.6449 16 K 3.8914 7.7569 117.8474 57.6112 30.1106 174.8273 17 Q 4.5184 8.0330 117.4463 54.8412 30.2032 175.2932 18 I 4.3661 8.1210 124.5009 59.5925 39.2544 174.9711 19 E 4.5490 8.7677 127.3764 56.9577 30.2682 178.3076 20 T 3.9406 9.4762 122.5497 66.6639 68.6777 177.3083 21 G 3.3952 7.6791 106.9537 47.5757 0.0000 173.7570 22 P 4.3461 0.0000 0.0000 64.6425 31.3925 178.4825 23 F 4.1708 8.1328 119.2313 61.4866 39.3291 177.2898 24 L 3.8354 8.2007 118.6022 57.5381 41.1483 179.0596 25 E 3.8943 8.0510 118.3779 59.0786 29.7347 178.5710 26 A 4.2260 7.9311 120.7465 55.4383 18.6108 179.9785 27 V 3.7759 7.6251 110.2392 63.4729 31.4087 178.6586 28 S 4.2522 7.7608 113.5239 61.0436 62.8335 175.3277 29 H 4.4592 7.7484 118.3494 56.8791 29.0574 176.9192 30 L 4.4229 7.9371 122.1340 57.2600 41.6712 176.9712 31 P 4.7493 0.0000 0.0000 65.6530 31.4375 176.7800 32 P 4.4408 0.0000 0.0000 65.4322 31.0856 178.3906 33 F 4.0912 8.0298 116.1172 60.1081 38.3349 177.3808 34 F 4.3135 8.3275 117.6405 60.1403 38.4996 177.2296 35 D 4.6220 8.0869 117.2642 56.5917 40.7553 176.7742 36 C 4.8149 7.5383 114.5679 59.5420 28.4434 174.5989 37 L 4.3060 7.6300 118.8292 55.0849 41.6729 177.8825 38 G 4.0537 9.8458 106.5074 45.1736 0.0000 172.9156 39 S 4.7075 7.9317 112.4212 54.8861 65.4921 173.0155 40 P 4.4844 0.0000 0.0000 64.6822 31.0344 178.6153 41 V 3.4343 7.3078 117.8964 65.7753 31.5302 176.9850 42 F 4.4688 7.6775 116.1588 58.7448 38.9680 177.7108 43 T 3.8738 7.7185 116.6990 66.3318 68.3509 174.6535 44 P 4.2330 0.0000 0.0000 65.2678 31.2011 178.8546 45 I 3.4818 7.4695 118.3868 64.1659 37.0308 178.0564 46 K 3.5530 7.8946 120.3808 59.4103 31.9534 178.6030 47 A 3.9310 7.8117 121.0254 55.0296 18.2335 179.1856 48 D 4.1732 7.9202 116.5049 57.4255 41.3454 178.5997 49 I 3.7160 7.4558 120.0022 64.5176 37.1214 178.3212 50 S 4.2597 8.3052 116.3144 61.8292 62.7502 177.0134 51 G 3.7162 8.3546 108.4455 48.1605 0.0000 175.4028 52 N 4.4386 8.2481 118.7977 55.9496 38.4819 177.5704 53 I 3.8023 7.9136 121.2416 64.8261 37.2523 178.5747 54 T 3.8994 8.2074 116.6816 66.6061 68.1198 176.8993 55 K 4.0368 8.1625 120.3874 59.4582 31.9831 179.5904 56 I 3.7262 7.9620 120.1098 64.1909 36.9850 178.0966 57 K 3.9207 8.4261 120.6574 59.8808 31.7131 178.5799 58 A 4.0369 7.9756 119.6037 54.9717 18.4273 179.5485 59 V 3.6114 7.6498 116.9174 66.2019 31.4763 177.5199 60 Y 4.2402 8.2488 119.5766 61.0680 38.4250 178.0015 61 D 4.3546 8.4187 118.7889 57.0394 40.9170 178.4445 62 T 4.2708 7.6093 110.1063 63.7694 70.1902 174.6647 63 N 4.7966 8.0589 118.1001 51.7340 41.1462 172.2641 64 P 3.5569 0.0000 0.0000 64.8671 32.0719 178.8479 65 A 4.0882 7.9157 119.6714 55.0218 18.5077 178.6072 66 K 3.9048 7.8561 115.4900 58.5966 32.2285 177.2744 67 F 5.2005 7.6140 117.1229 56.7797 39.8822 176.8878 68 R 4.3919 8.7727 122.6641 58.4053 30.2882 175.9397 69 T 5.1336 7.6021 106.3200 59.4752 73.0383 174.8121 70 L 4.0396 8.4295 121.6223 57.7075 41.5145 179.4863 71 Q 3.9605 8.1191 119.1925 59.4163 28.8619 177.9816 72 N 4.5932 8.2608 118.6903 55.7963 38.6465 177.1878 73 I 4.1358 7.7130 120.3335 64.7967 37.4302 178.5437 74 L 4.3331 7.9151 119.3727 57.7062 41.1812 179.4450 75 E 3.8165 8.2735 117.7307 59.1909 29.7377 179.2887 76 V 3.5411 8.0868 119.4898 65.8251 31.7640 177.9530 77 E 4.3759 8.5362 118.2689 58.9178 29.1572 179.2211 78 K 2.5485 7.3026 119.6061 58.8976 31.8348 178.5034 79 E 3.7789 7.4515 117.6701 59.5343 29.6918 178.1715 80 M 4.0275 8.2622 117.2726 57.9447 32.2805 176.7226 81 Y 4.6448 7.7925 114.3597 56.0623 40.5484 177.6347 82 G 3.7466 8.5493 108.0895 46.5037 0.0000 177.4582 83 A 4.2319 8.8672 127.4614 54.1802 18.4345 178.6348 84 E 4.2301 8.2617 115.2554 58.0612 30.1852 176.8526 85 W 4.1604 7.9493 128.4595 56.8768 31.1409 173.6757 86 P 3.0240 0.0000 0.0000 62.1573 31.3044 176.0114 87 K 4.2591 7.2507 121.0566 55.5490 31.7127 176.4242 88 V 4.2400 7.2514 110.7514 61.0278 36.7844 175.4404 89 G 3.8426 8.3790 109.3142 46.6355 0.0000 175.5426 90 A 4.0920 9.0211 120.3869 55.1198 18.3635 179.8219 91 T 3.9244 8.7178 115.1889 66.9481 68.6372 176.4128 92 L 3.9554 7.9264 121.7051 57.9310 42.0680 178.4892 93 A 4.3219 7.8062 121.6899 54.7346 18.3532 179.5127 94 L 3.9642 8.4727 118.7611 58.1002 41.7429 178.7736 95 M 3.0794 7.8473 118.5722 58.0335 32.0876 178.1481 96 W 4.1598 7.9749 118.5307 59.0355 29.2306 178.4043 97 L 4.0618 8.3449 121.1631 58.0781 41.5442 179.2151 98 K 4.0708 8.0543 118.7230 60.0405 32.2731 179.4163 99 R 4.5289 6.9352 121.1389 58.2807 30.1007 178.9621 100 G 3.8486 8.1941 105.6627 48.1471 0.0000 175.7705 101 L 4.5773 8.4972 123.5326 56.9021 41.5789 179.6176 102 R 3.8822 8.7381 119.3559 59.1755 30.0116 178.2644 103 F 4.0861 8.7129 120.7840 61.4798 39.3762 177.1822 104 I 4.0703 8.2323 119.0389 64.4049 36.7954 178.1206 105 Q 4.2851 8.6751 120.6782 59.4895 28.9079 178.7091 106 V 3.5565 8.0040 119.2823 65.7148 31.5386 177.5055 107 F 4.0597 8.0982 120.4302 61.5474 39.1664 177.1895 108 L 3.8003 8.2192 118.4859 57.7233 41.3208 179.3977 109 Q 3.9182 8.2354 119.6248 58.9703 29.1134 178.0082 110 S 4.0912 8.1592 114.3718 61.3992 62.4251 176.1912 111 I 3.6497 7.3811 122.2439 64.7655 36.6789 178.2443 112 C 4.1236 7.9158 115.9678 62.7152 28.0100 175.1563 113 D 4.6616 8.0457 118.0419 53.9619 40.5915 177.0010 114 G 3.8739 7.8346 107.5611 46.0060 0.0000 173.6599 115 E 4.1078 7.8646 119.5018 55.8583 29.7431 176.5399 116 R 4.5110 8.0682 118.6150 55.0386 32.5222 173.5357 117 D 4.6584 8.4763 117.5613 52.8931 41.3580 176.1897 118 E 4.0017 9.0750 127.2574 59.8415 29.7374 178.6201 119 N 4.4691 8.4263 114.4876 56.0067 38.7487 175.0786 120 H 4.9373 7.8923 115.1792 53.3682 28.9732 172.0725 121 P 4.4482 0.0000 0.0000 64.3306 32.3702 177.5416 122 N 4.7583 8.1886 116.7899 53.3075 38.9697 173.9694 123 L 4.9725 7.4650 116.6797 53.9535 43.5633 175.9946 124 I 4.6599 7.9036 110.2569 60.5495 38.3603 177.9385 125 R 3.9576 8.1348 123.2423 59.9480 29.9305 178.9645 126 V 3.7441 7.7706 118.6037 64.6826 31.4935 178.2185 127 N 4.4158 8.3968 117.8509 55.6585 38.5900 177.1668 128 A 4.2362 8.4709 122.1709 55.4285 18.4437 179.8959 129 T 4.2181 8.3125 114.5902 66.6511 68.5494 176.9722 130 K 3.9491 8.1775 121.2457 59.3301 32.2695 178.5199 131 A 3.8095 7.8823 121.1283 55.4203 18.0404 178.9236 132 Y 4.2633 8.2231 117.7771 61.1236 38.5857 178.2804 133 E 3.8009 8.1444 118.2269 59.4220 29.5795 178.7906 134 M 4.1373 7.9536 117.6748 57.1368 32.2845 177.5985 135 A 4.5921 7.9656 119.2465 52.9589 20.6400 177.5022 136 L 4.5945 7.3165 115.0403 55.8445 44.6109 178.7105 137 K 3.1735 7.4062 119.8867 58.7571 32.0478 178.4276 138 K 3.9196 7.3584 115.7600 58.4421 32.9677 176.7875 139 Y 4.6182 7.5779 117.0558 57.9129 38.2622 174.2600 140 H 5.2444 7.8231 118.0527 53.7182 31.0020 175.3857 141 G 3.9990 8.8127 111.6075 43.8044 0.0000 174.5589 142 W 4.4239 8.7165 116.8617 59.4431 28.0126 178.5433 143 I 2.8378 6.7356 120.3818 63.9046 36.4911 178.3226 144 V 3.5524 7.4767 118.6073 65.8477 31.3832 177.8947 145 Q 4.5359 8.1159 119.3578 58.6078 28.7549 179.0273 146 K 4.1887 8.1502 119.0740 59.3545 31.9669 179.5865 147 I 3.6936 7.7941 120.4386 64.0524 36.9782 178.0085 148 F 3.9659 8.4569 121.8829 61.5369 38.8946 177.0815 149 Q 3.5481 7.8361 115.8420 58.8009 28.8303 178.7886 150 A 4.2183 7.8591 120.9847 55.2268 18.5297 179.6276 151 A 3.7773 8.0805 119.4699 54.8932 18.2813 179.5113 152 L 3.5698 7.4054 119.0170 58.1684 41.7409 178.3245 153 Y 4.1769 7.4607 114.2720 59.5191 38.0176 176.4689 154 A 4.0841 7.6808 121.9218 53.5450 18.8221 177.8120 155 A 4.0900 7.5513 119.2546 51.9950 18.6741 175.9809 156 P 4.5408 0.0000 0.0000 61.8104 32.8246 176.1609 157 Y 4.5048 8.1136 115.9392 57.6124 39.7635 177.3183 158 K 4.0169 9.1318 124.1198 59.9156 32.3655 179.1615 159 S 4.1794 8.0722 114.2567 62.0400 62.7203 176.3925 160 D 4.4792 8.2648 121.9999 56.6057 40.8365 178.3848 161 F 4.3078 8.4376 121.4944 61.2451 39.4099 177.2863 162 L 3.7678 8.0142 118.4995 57.4881 41.2893 179.2315 163 K 3.9076 7.8381 118.2810 59.4044 32.1220 178.4023 164 A 4.1059 7.7120 120.4460 55.0539 18.3857 179.3957 165 L 4.1029 7.3844 116.0776 56.8335 43.0520 179.0463 166 S 4.6112 7.6548 119.6828 57.6513 59.4334 174.7481 167 K 4.3290 7.6190 123.6657 55.5658 32.1189 179.8854 *169 Q 4.5347 8.0930 121.6411 56.3926 30.1478 179.3990 170 N 4.7942 7.9059 113.3657 50.9332 36.1968 178.5766 171 V 4.3764 7.3355 120.2098 59.0264 34.2530 174.8170 172 T 4.1653 8.1300 113.6103 61.2981 70.9486 175.2142 173 E 3.9283 8.6039 121.8530 59.5649 29.7777 178.8335 174 E 3.9804 8.0756 118.2376 59.1241 29.5669 178.7125 175 E 3.9012 8.1456 119.4691 59.3087 29.7269 178.3454 176 C 3.9999 8.0769 118.6345 62.6634 31.5648 175.6131 177 L 3.9714 7.9926 120.4295 57.7314 41.1214 179.1941 178 E 3.9331 8.0355 119.0084 59.0683 29.4872 179.0362 179 K 4.0279 8.0982 118.7825 59.3948 32.0925 179.4306 180 I 3.7154 7.8461 120.2183 64.4160 36.7753 178.6737 181 R 3.9838 8.1128 118.3431 58.9517 30.1619 178.6246 182 L 4.0888 7.9425 120.1796 58.2021 41.6592 178.5528 183 F 4.1269 8.3949 120.6894 61.6114 39.2782 177.0548 184 L 4.0982 8.1732 117.7250 57.2720 41.3419 178.9333 185 V 3.5625 7.5920 118.6590 66.3464 31.4449 177.5727 186 N 4.4483 7.8769 115.5900 55.7205 38.5735 176.7961 187 Y 4.0725 7.3422 120.5291 61.1223 38.7578 178.4458 188 T 4.0500 8.2399 117.4425 65.9545 68.5951 176.4514 189 A 3.9612 7.7332 122.1633 55.5523 18.3800 179.8711 190 T 3.8242 7.9155 113.9813 66.8785 68.5553 177.0298 191 I 3.7175 7.8466 121.9478 64.4001 37.0451 178.0811 192 D 4.3128 8.3493 120.1149 57.5586 40.7194 179.1015 193 V 3.6111 7.8632 118.4597 66.1570 31.5226 178.1700 194 I 3.8112 7.8608 119.5539 64.6069 36.9878 178.0614 195 Y 3.9497 8.4215 117.7622 60.8169 37.5562 178.0718 196 E 3.9963 8.5615 120.5240 59.5313 29.7641 178.5132 197 M 4.0149 8.2173 118.2200 59.0054 32.1833 177.8592 198 Y 3.7063 8.1777 116.6901 60.9559 38.0489 178.5949 199 T 3.9491 7.8005 116.4386 66.8125 68.4586 177.0927 200 Q 4.0624 8.2049 118.7300 58.8289 28.8477 177.1102 201 M 4.3046 8.0168 115.0993 54.7287 32.3797 175.3391 202 N 4.1241 7.6550 115.7484 54.5417 37.9813 174.3444 203 A 3.8174 8.0576 118.6852 52.0029 19.5953 178.2473 204 E 4.0989 7.9531 117.2965 55.6799 30.3606 175.7229 205 L 4.8704 8.0219 124.6498 53.2922 44.9347 175.9439 206 N 5.0927 8.6097 117.1257 53.0089 39.3509 174.7718 207 Y 4.3825 8.0448 116.7009 57.0892 38.6396 175.6176 208 K 4.8434 8.5710 120.7129 55.2157 34.6207 177.0840 209 V 4.1218 8.3737 113.0269 61.7362 32.0041 175.9183 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 4 L 8.04 4.11 0.00 1.44 1.52 -0.69 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 5 A 7.86 4.42 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 6 E 8.88 4.25 0.00 1.87 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 2.27 2.24 0.00 7 H 7.62 4.94 0.00 3.05 3.08 0.00 5.66 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 L 7.68 4.34 0.00 1.68 1.65 0.95 1.22 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 9 L 8.18 4.33 0.00 1.63 1.67 1.03 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 K 8.38 4.25 0.00 1.79 1.78 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.49 7.81 11 P 0.00 4.51 0.00 2.19 2.06 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 12 L 8.22 4.08 0.00 1.66 1.66 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.55 0.00 2.23 2.22 0.00 3.71 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.05 0.00 14 A 8.49 4.01 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 15 D 8.04 4.55 0.00 2.78 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.76 3.89 0.00 1.97 1.96 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.40 7.81 17 Q 8.03 4.52 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.38 6.67 0.00 0.00 0.00 0.00 0.00 2.59 2.48 0.00 18 I 8.12 4.37 1.75 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.96 0.84 0.00 0.00 19 E 8.77 4.55 0.00 1.98 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 2.45 2.39 0.00 20 T 9.48 3.94 4.13 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 1.01 0.00 0.00 21 G 7.68 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.35 0.00 2.24 2.17 0.00 3.71 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 2.35 2.19 0.00 23 F 8.13 4.17 0.00 3.19 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 L 8.20 3.84 0.00 1.81 1.68 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.05 3.89 0.00 2.14 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 0.00 2.35 2.52 0.00 26 A 7.93 4.23 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 27 V 7.63 3.78 2.03 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 0.33 0.00 0.00 0.59 0.00 0.00 28 S 7.76 4.25 0.00 3.99 4.13 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 29 H 7.75 4.46 0.00 3.13 3.37 0.00 5.65 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.94 4.42 0.00 1.94 1.81 1.12 0.90 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 31 P 0.00 4.75 0.00 2.25 2.26 0.00 3.83 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 32 P 0.00 4.44 0.00 1.91 1.99 0.00 3.67 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.15 0.00 33 F 8.03 4.09 0.00 3.06 2.83 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 34 F 8.33 4.31 0.00 3.34 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.09 4.62 0.00 2.81 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 C 7.54 4.81 0.00 2.97 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.63 4.31 0.00 1.42 1.24 0.96 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.85 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.93 4.71 0.00 3.94 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 40 P 0.00 4.48 0.00 2.28 2.28 0.00 3.76 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 2.03 2.00 0.00 41 V 7.31 3.43 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 0.40 0.00 0.00 0.74 0.00 0.00 42 F 7.68 4.47 0.00 3.31 3.16 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 43 T 7.72 3.87 4.38 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 1.20 0.00 0.00 44 P 0.00 4.23 0.00 2.05 2.01 0.00 3.59 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 45 I 7.47 3.48 1.85 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 1.40 1.30 0.32 0.00 0.00 46 K 7.89 3.55 0.00 1.74 1.92 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.56 7.81 47 A 7.81 3.93 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 48 D 7.92 4.17 0.00 2.72 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 49 I 7.46 3.72 1.91 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.86 1.05 0.00 0.00 50 S 8.31 4.26 0.00 4.09 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.35 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 0.00 0.00 0.00 52 N 8.25 4.44 0.00 2.96 3.05 0.00 0.00 7.05 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 7.91 3.80 2.05 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 1.55 0.91 0.92 0.00 0.00 54 T 8.21 3.90 4.48 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 1.23 0.00 0.00 55 K 8.16 4.04 0.00 1.99 1.88 0.00 1.84 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.49 7.81 56 I 7.96 3.73 1.96 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.82 0.99 0.00 0.00 57 K 8.43 3.92 0.00 1.99 2.07 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.38 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.51 1.75 7.81 58 A 7.98 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.65 3.61 2.04 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 0.26 0.00 0.00 0.97 0.00 0.00 60 Y 8.25 4.24 0.00 3.10 3.27 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 61 D 8.42 4.35 0.00 2.86 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 62 T 7.61 4.27 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 63 N 8.06 4.80 0.00 2.67 2.57 0.00 0.00 7.06 8.88 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 64 P 0.00 3.56 0.00 2.07 1.68 0.00 3.53 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.60 0.00 65 A 7.92 4.09 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 66 K 7.86 3.90 0.00 1.41 1.35 0.00 1.48 0.00 0.00 1.45 0.00 0.00 2.71 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.35 1.01 7.81 67 F 7.61 5.20 0.00 3.36 3.16 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 68 R 8.77 4.39 0.00 2.11 2.01 0.00 3.20 0.00 0.00 3.40 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.72 0.00 69 T 7.60 5.13 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 1.25 0.00 0.00 70 L 8.43 4.04 0.00 1.65 1.69 0.25 0.46 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 71 Q 8.12 3.96 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.43 2.66 0.00 72 N 8.26 4.59 0.00 3.18 3.16 0.00 0.00 6.55 6.99 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 73 I 7.71 4.14 2.16 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.30 0.97 0.00 0.00 74 L 7.92 4.33 0.00 1.78 1.84 0.96 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.27 3.82 0.00 2.12 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 0.00 2.58 2.26 0.00 76 V 8.09 3.54 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 1.00 0.00 0.00 0.85 0.00 0.00 77 E 8.54 4.38 0.00 2.49 2.50 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 2.73 2.79 0.00 78 K 7.30 2.55 0.00 0.79 1.30 0.00 1.05 0.00 0.00 1.19 0.00 0.00 2.71 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.80 0.21 7.81 79 E 7.45 3.78 0.00 1.89 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 2.24 2.28 0.00 80 M 8.26 4.03 0.00 1.81 2.17 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.17 0.00 81 Y 7.79 4.64 0.00 3.31 3.05 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 0.00 0.00 0.00 82 G 8.55 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 83 A 8.87 4.23 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 84 E 8.26 4.23 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 2.45 2.41 0.00 85 W 7.95 4.16 0.00 3.27 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 3.02 0.00 1.49 0.49 0.00 3.61 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.40 0.00 87 K 7.25 4.26 0.00 1.58 1.79 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.33 7.81 88 V 7.25 4.24 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 0.48 0.00 0.00 0.40 0.00 0.00 89 G 8.38 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 90 A 9.02 4.09 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 91 T 8.72 3.92 4.38 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 1.03 0.00 0.00 92 L 7.93 3.96 0.00 2.06 1.82 1.21 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 93 A 7.81 4.32 1.49 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 0.00 0.00 0.00 94 L 8.47 3.96 0.00 1.89 1.92 0.95 0.84 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 95 M 7.85 3.08 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.75 0.00 96 W 7.97 4.16 0.00 3.42 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 97 L 8.34 4.06 0.00 1.92 1.89 1.05 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.05 4.07 0.00 1.89 1.88 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 0.70 7.81 99 R 6.94 4.53 0.00 2.09 2.02 0.00 2.21 0.00 0.00 2.33 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.15 0.00 100 G 8.19 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 0.00 101 L 8.50 4.58 0.00 1.95 1.87 1.18 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.74 3.88 0.00 2.10 2.27 0.00 2.93 0.00 0.00 2.89 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 103 F 8.71 4.09 0.00 3.40 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 0.00 104 I 8.23 4.07 2.47 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.00 1.08 0.00 0.00 105 Q 8.68 4.29 0.00 2.26 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 106 V 8.00 3.56 1.97 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 0.97 0.00 0.00 0.91 0.00 0.00 107 F 8.10 4.06 0.00 2.71 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 0.00 108 L 8.22 3.80 0.00 1.82 1.72 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 109 Q 8.24 3.92 0.00 2.29 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.54 0.00 110 S 8.16 4.09 0.00 3.94 3.91 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 0.00 111 I 7.38 3.65 1.80 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 1.04 0.31 0.86 0.00 0.00 112 C 7.92 4.12 0.00 3.06 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 D 8.05 4.66 0.00 2.79 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 0.00 114 G 7.83 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 0.00 115 E 7.86 4.11 0.00 2.11 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 2.33 2.22 0.00 116 R 8.07 4.51 0.00 1.88 1.88 0.00 3.03 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 117 D 8.48 4.66 0.00 2.74 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 E 9.07 4.00 0.00 2.00 2.03 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 2.33 2.31 0.00 119 N 8.43 4.47 0.00 2.97 2.76 0.00 0.00 6.66 8.16 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 0.00 120 H 7.89 4.94 0.00 3.15 3.25 0.00 5.61 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 0.00 121 P 0.00 4.45 0.00 2.19 2.19 0.00 3.78 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 1.95 0.00 122 N 8.19 4.76 0.00 2.80 2.83 0.00 0.00 7.16 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.46 4.97 0.00 1.88 1.62 0.97 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.90 4.66 1.98 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.03 0.92 0.00 0.00 125 R 8.13 3.96 0.00 1.82 1.92 0.00 2.96 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 126 V 7.77 3.74 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.96 0.00 0.00 127 N 8.40 4.42 0.00 2.93 2.73 0.00 0.00 7.50 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 0.00 128 A 8.47 4.24 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.31 4.22 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 1.40 0.00 0.00 130 K 8.18 3.95 0.00 1.96 1.97 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.45 7.81 131 A 7.88 3.81 0.58 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 0.00 132 Y 8.22 4.26 0.00 2.91 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 0.00 133 E 8.14 3.80 0.00 2.12 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 2.33 2.39 0.00 134 M 7.95 4.14 0.00 1.94 2.06 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 2.65 2.68 0.00 135 A 7.97 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 0.00 136 L 7.32 4.59 0.00 1.30 1.37 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 137 K 7.41 3.17 0.00 0.79 1.34 0.00 1.69 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.29 1.30 7.81 138 K 7.36 3.92 0.00 1.53 1.55 0.00 1.27 0.00 0.00 1.26 0.00 0.00 2.55 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.41 0.21 7.81 139 Y 7.58 4.62 0.00 3.11 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 0.00 140 H 7.82 5.24 0.00 3.32 3.29 0.00 5.67 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 0.00 141 G 8.81 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 W 8.72 4.42 0.00 3.67 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 I 6.74 2.84 1.36 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.54 0.00 0.00 144 V 7.48 3.55 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 0.93 0.00 0.00 0.85 0.00 0.00 145 Q 8.12 4.54 0.00 2.53 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.72 2.68 0.00 146 K 8.15 4.19 0.00 2.06 1.93 0.00 1.82 0.00 0.00 1.74 0.00 0.00 3.21 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.65 1.95 7.81 147 I 7.79 3.69 1.98 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 1.33 0.74 0.83 0.00 0.00 148 F 8.46 3.97 0.00 2.66 2.93 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 0.00 149 Q 7.84 3.55 0.00 2.30 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.74 0.00 0.00 0.00 0.00 0.00 2.45 2.65 0.00 150 A 7.86 4.22 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 A 8.08 3.78 1.13 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 0.00 152 L 7.41 3.57 0.00 0.88 1.13 0.74 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 153 Y 7.46 4.18 0.00 2.93 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 0.00 154 A 7.68 4.08 1.13 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 0.00 155 A 7.55 4.09 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 0.00 156 P 0.00 4.54 0.00 2.34 2.18 0.00 3.78 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.24 0.00 157 Y 8.11 4.50 0.00 3.26 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 0.00 158 K 9.13 4.02 0.00 1.86 2.06 0.00 1.68 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.52 1.52 7.81 159 S 8.07 4.18 0.00 4.09 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 0.00 160 D 8.26 4.48 0.00 2.89 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 0.00 161 F 8.44 4.31 0.00 3.19 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 0.00 162 L 8.01 3.77 0.00 1.78 1.65 0.99 0.47 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 0.00 163 K 7.84 3.91 0.00 1.91 1.98 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.46 7.81 164 A 7.71 4.11 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 0.00 165 L 7.38 4.10 0.00 1.57 1.53 0.22 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 166 S 7.65 4.61 0.00 3.96 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 0.00 167 K 7.62 4.33 0.00 1.77 1.67 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 0.99 7.81 *169 Q 8.09 4.53 0.00 2.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.32 0.00 0.00 0.00 0.00 0.00 2.18 1.89 0.00 170 N 7.91 4.79 0.00 2.74 2.67 0.00 0.00 6.51 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 V 7.34 4.38 2.06 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 0.79 0.00 0.00 0.91 0.00 0.00 172 T 8.13 4.17 4.37 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 1.20 0.00 0.00 173 E 8.60 3.93 0.00 2.05 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 2.37 2.40 0.00 174 E 8.08 3.98 0.00 2.08 1.97 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 2.39 2.41 0.00 175 E 8.15 3.90 0.00 2.09 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 2.29 2.34 0.00 176 C 8.08 4.00 0.00 3.00 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 0.00 177 L 7.99 3.97 0.00 1.72 1.68 0.91 0.65 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 0.00 178 E 8.04 3.93 0.00 2.26 2.03 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 2.30 2.39 0.00 179 K 8.10 4.03 0.00 1.94 1.82 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.60 7.81 180 I 7.85 3.72 1.97 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 1.35 0.83 0.90 0.00 0.00 181 R 8.11 3.98 0.00 1.93 2.00 0.00 3.17 0.00 0.00 3.15 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 182 L 7.94 4.09 0.00 1.91 1.94 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 183 F 8.39 4.13 0.00 3.08 3.20 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 0.00 184 L 8.17 4.10 0.00 1.97 1.75 1.05 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 185 V 7.59 3.56 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.96 0.00 0.00 186 N 7.88 4.45 0.00 2.78 2.98 0.00 0.00 6.54 7.48 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 0.00 187 Y 7.34 4.07 0.00 2.26 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 0.00 188 T 8.24 4.05 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 1.19 0.00 0.00 189 A 7.73 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 T 7.92 3.82 4.44 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 1.36 0.00 0.00 191 I 7.85 3.72 1.78 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.37 0.93 0.00 0.00 192 D 8.35 4.31 0.00 2.81 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 0.00 193 V 7.86 3.61 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 1.05 0.00 0.00 0.97 0.00 0.00 194 I 7.86 3.81 2.04 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 1.35 0.91 0.87 0.00 0.00 195 Y 8.42 3.95 0.00 3.10 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 0.00 196 E 8.56 4.00 0.00 2.07 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 2.33 2.35 0.00 197 M 8.22 4.01 0.00 2.35 2.06 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.47 0.00 198 Y 8.18 3.71 0.00 3.10 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 T 7.80 3.95 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 200 Q 8.20 4.06 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.87 0.00 0.00 0.00 0.00 0.00 2.64 2.49 0.00 201 M 8.02 4.30 0.00 2.25 2.18 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 2.59 2.72 0.00 202 N 7.66 4.12 0.00 2.89 2.95 0.00 0.00 7.04 7.42 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 0.00 203 A 8.06 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 204 E 7.95 4.10 0.00 1.93 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 2.26 2.32 0.00 205 L 8.02 4.87 0.00 1.65 1.69 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 206 N 8.61 5.09 0.00 2.74 2.85 0.00 0.00 6.98 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 Y 8.04 4.38 0.00 3.13 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 0.00 208 K 8.57 4.84 0.00 1.87 1.87 0.00 1.76 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.51 7.81 209 V 8.37 4.12 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 0.77 0.00 0.00 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.