NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.3263 8.0327 117.3236 63.4287 70.9853 172.3080 3 L 4.2952 9.1032 128.6544 53.0832 43.5454 173.3986 4 I 4.7316 9.3520 130.0779 60.7145 39.1088 174.6909 5 I 4.9627 9.2919 128.2631 59.4782 40.1061 174.4156 6 L 5.3251 9.5521 127.5344 53.1992 43.9382 175.5132 7 E 5.2063 10.7800 123.4422 54.3302 34.1227 175.4358 8 G 4.5009 8.8926 108.5285 43.4378 0.0000 170.6749 9 P 4.7246 0.0000 0.0000 61.4159 31.3628 175.3923 10 D 4.4969 8.5654 118.7749 55.3368 41.1563 176.1293 11 C 3.6934 8.5284 113.9546 61.5398 25.5051 173.7960 12 C 4.3190 7.0301 111.0128 58.8838 28.8295 174.6375 13 F 4.2028 7.6152 116.5673 58.6517 36.2672 177.6189 14 K 3.9937 7.6306 120.5686 59.8593 32.0139 178.1990 15 S 4.2210 8.1056 113.9720 61.5387 62.9810 176.5161 16 T 3.8534 7.8175 118.9090 66.6321 68.4531 176.6344 17 V 3.5557 8.2801 120.3254 65.9033 31.3470 177.8397 18 A 3.9709 8.2421 120.2157 55.1286 18.2564 179.2225 19 A 3.9445 7.9556 119.2017 55.5110 18.4560 180.0624 20 K 3.8917 8.0130 116.7652 59.5898 32.1081 179.6726 21 L 3.9052 8.0146 119.3153 57.5866 41.4699 179.5725 22 S 4.2366 8.1902 114.5616 60.8120 62.1956 176.1007 23 K 3.9107 7.9131 121.0512 59.4745 31.9484 178.0419 24 E 4.0300 7.9611 118.6932 59.1229 29.8839 178.2412 25 L 3.8445 8.1280 117.7188 54.4201 42.7139 176.7652 26 K 3.9447 7.8325 117.4221 58.1279 29.5881 175.0121 27 Y 5.1960 7.3036 115.4082 55.5832 41.9119 175.7273 28 P 4.6139 0.0000 0.0000 62.6416 33.2982 174.8549 29 I 5.0637 8.2018 120.8220 59.7994 39.9937 175.5375 30 I 4.6828 9.0127 126.5074 59.5039 41.5089 174.6671 31 K 4.5113 8.8057 125.9167 55.2361 32.1332 176.6366 32 G 4.6496 9.4320 113.8550 48.1708 0.0000 172.6191 33 S 4.3983 8.2296 114.1356 58.2457 63.7216 174.0360 34 S 4.4901 8.7976 117.7114 55.0691 62.8715 173.3486 35 F 4.1195 9.0006 128.1880 61.1451 39.4655 175.5798 36 E 3.9247 8.2626 118.1093 59.6085 29.0691 178.7764 37 L 3.9972 8.1712 119.8635 56.7997 41.5725 178.7578 38 A 3.7861 8.4697 119.5908 52.9261 17.7949 178.5160 39 K 4.4114 7.3198 117.7227 57.7111 33.3740 177.7034 40 S 3.8707 7.4547 112.2277 59.9566 63.2673 174.2839 41 G 4.5002 7.4363 106.6748 43.2823 0.0000 173.7419 42 N 4.3281 8.3883 118.1191 56.3263 38.8736 176.7151 43 E 4.0134 8.0857 118.8888 59.5110 30.0450 179.1823 44 K 4.0118 8.0010 119.9270 57.9957 32.2138 179.0270 45 L 3.8840 7.5858 121.3549 57.8690 42.0883 178.6020 46 F 4.4739 8.4231 120.6957 61.2067 39.3708 176.5340 47 E 3.7164 8.5578 119.3980 59.9788 29.4804 177.6701 48 H 3.9009 7.9745 117.1935 59.9915 29.7468 176.8141 49 F 4.3840 7.9854 118.9435 60.5274 38.5580 177.4894 50 N 4.2779 7.7667 116.2499 56.3899 38.8955 176.4084 51 K 4.0300 8.0981 121.1015 59.6722 32.3000 178.7844 52 L 4.0314 7.9766 118.4508 57.4972 41.3395 179.1255 53 A 4.2223 7.9934 119.8645 54.7575 18.2917 178.8108 54 D 4.4762 7.6804 117.0317 55.9049 41.3504 177.1499 55 E 4.1153 7.0989 117.1934 56.8472 30.0707 175.3700 56 D 4.4509 8.0733 118.1882 54.1859 44.1957 173.7930 57 N 3.1400 8.1104 116.8985 53.4507 36.2782 174.3366 58 V 4.6639 6.7770 108.4006 60.3759 37.3033 174.0571 59 I 5.0519 8.8106 122.7188 59.7972 39.7682 174.9322 60 I 4.8647 8.8612 128.1086 59.6633 39.8312 174.4147 61 D 4.7997 9.6154 128.7399 53.7325 41.8389 171.4922 62 R 4.9718 9.6517 134.1311 55.8900 30.9887 174.4486 63 F 5.8372 10.9756 128.0913 57.3934 40.8689 176.8812 64 V 2.4639 7.1262 108.3499 64.3809 30.9660 177.5090 65 Y 4.1502 7.4023 114.6914 61.2013 37.8982 178.4081 66 S 4.2811 8.3783 114.0891 61.4206 62.4835 175.7063 67 N 4.7059 8.2716 119.3692 56.5993 38.5757 175.9228 68 L 4.3287 7.9460 117.6581 55.9222 42.0909 176.1741 69 V 3.9302 7.4933 115.2727 64.9274 32.8186 177.1651 70 Y 4.1372 7.8158 116.4821 59.8414 38.2843 178.4549 71 A 4.1065 7.9359 123.1750 54.8359 18.7872 178.4015 72 K 4.4803 7.6841 114.1134 56.7214 32.0486 178.0445 73 K 4.2856 7.7104 117.6005 56.5803 35.8848 176.8911 74 F 5.1539 7.0343 115.6171 55.2765 40.7162 175.9900 75 K 4.1849 8.7630 123.9728 57.4479 33.0627 176.3551 76 D 4.3511 8.7690 118.8677 55.8137 38.0466 173.5882 77 Y 4.8353 7.5479 117.1664 55.8285 41.6884 175.9912 78 S 4.5423 9.3846 124.3786 58.7600 63.8101 173.8185 79 I 5.3074 7.9051 120.8332 58.4776 41.0933 175.2222 80 L 4.4040 8.6061 124.4138 54.4346 42.7032 177.8391 81 T 4.2152 8.7392 113.5415 61.1490 71.1310 175.7698 82 E 3.9416 8.6733 121.9178 59.6648 29.4792 179.9560 83 R 3.9373 7.8211 115.5273 59.5590 29.7013 178.8860 84 Q 3.8578 7.7887 118.3975 58.0417 28.5106 178.5858 85 L 3.8813 7.9666 121.6555 58.3594 42.3145 179.1349 86 R 4.3194 8.1479 117.9270 59.1359 30.0360 178.9964 87 F 4.1735 8.4109 120.5738 61.4716 39.1261 177.3379 88 I 3.7918 7.9634 118.9954 64.4869 36.9911 178.3410 89 E 4.0648 8.8689 119.7857 59.2769 28.9861 178.9710 90 D 4.2895 7.9367 117.5529 57.2011 41.4511 178.0032 91 K 4.0441 7.6798 117.9695 57.9656 32.5043 177.4712 92 I 4.4619 7.3029 110.9229 60.3490 38.4510 177.0277 93 K 3.8268 8.1532 120.2229 59.9103 32.2298 177.5511 94 A 3.9638 7.8715 120.4071 52.6650 19.4766 177.3582 95 K 4.7497 8.1431 115.0521 56.5191 33.8146 175.4768 96 A 5.3034 8.2875 121.0987 50.8828 21.9398 176.8660 97 K 4.5884 9.0125 120.7184 54.6540 35.4269 175.5935 98 V 4.4748 8.6519 126.4849 61.9621 32.9237 174.5569 99 V 5.1809 9.5337 129.3939 61.3657 34.1805 173.5591 100 Y 5.3419 9.8176 129.7193 56.1827 41.2075 173.8864 101 L 5.0979 8.9685 128.5359 53.6647 43.9938 175.8180 102 H 4.9365 8.0087 118.7058 55.9520 32.0542 171.8365 103 A 4.6719 8.0718 118.3700 50.7334 21.5522 176.5489 104 D 4.5747 8.0982 119.3467 53.5931 42.7964 176.0085 105 P 4.2599 0.0000 0.0000 65.8313 31.4233 179.1163 106 S 4.0848 8.0188 112.3280 61.6088 62.8411 176.5414 107 V 3.5809 7.7310 121.8525 65.5283 31.2416 177.8563 108 I 3.6624 8.0634 119.8236 64.2974 36.8816 178.6053 109 K 3.9232 8.2424 119.4781 59.1171 31.7760 179.2200 110 K 3.8624 8.1022 119.9090 59.8053 32.1962 179.1384 111 R 3.9680 8.1947 118.2534 58.9837 29.8636 179.1867 112 L 3.9573 8.0313 119.1650 57.8163 41.4299 179.6267 113 R 3.8811 8.3635 117.1181 59.3396 30.0958 178.9702 114 V 3.7029 7.9386 117.2315 65.9263 31.5157 177.6145 115 R 4.1628 7.7398 117.4222 57.0039 30.1866 176.5346 116 G 3.9754 7.9285 106.5098 45.8164 0.0000 173.5220 117 D 4.7013 7.9167 117.8134 54.0086 41.6231 176.3685 118 E 4.5900 8.8608 120.0017 56.8411 31.7061 176.6779 119 Y 4.3253 8.2221 114.3927 56.7195 38.7617 173.8683 120 I 2.9836 7.0829 121.5497 60.4853 36.6738 174.3674 121 E 3.6585 7.9172 125.9286 56.7451 29.7314 176.9379 122 G 3.4789 7.2036 114.3676 45.6124 0.0000 173.8241 123 K 5.3675 7.7710 117.4758 55.2423 35.8346 177.1371 124 D 4.4135 8.2883 117.7001 57.2544 40.9182 178.1261 125 I 3.7364 7.7173 120.0628 64.3880 37.1712 177.5261 126 D 4.4027 7.9297 119.7409 57.6231 40.6276 179.1351 127 S 4.0665 8.0023 112.6810 61.4132 62.4346 175.8403 128 I 3.6949 8.0144 122.7586 64.6117 36.9938 178.4411 129 L 4.1869 8.6089 119.9142 57.9030 41.2539 179.2538 130 E 3.9989 8.4794 118.6507 58.9784 29.7950 178.3828 131 L 4.0330 8.5102 121.0985 58.0900 42.2665 178.3970 132 Y 3.7620 8.2782 117.2660 61.0353 37.7393 178.8415 133 R 3.8872 7.7433 114.3425 58.1308 29.5383 177.9883 134 E 4.0877 7.2914 119.4798 59.0468 30.0577 179.4539 135 V 3.6819 7.5466 116.4203 63.4405 31.2769 177.4227 *137 S 4.3044 8.0575 113.3493 57.3024 63.8737 173.4977 138 N 4.8674 7.7478 116.5924 52.9032 38.8844 174.6298 139 A 4.7480 7.7879 120.0935 50.9126 20.6407 178.5396 140 G 4.0697 8.9929 109.3145 46.6592 0.0000 174.5063 141 L 4.6060 7.7006 118.7542 53.5155 43.3131 175.6689 142 H 4.5069 8.5923 117.1576 55.8093 29.4657 175.1566 143 T 4.9325 7.9117 111.6278 60.1096 71.7820 172.5413 144 Y 4.6241 9.2856 121.2533 56.1424 41.1433 174.8304 145 S 5.4090 8.2501 117.4474 56.3771 66.6088 173.2632 146 W 4.8685 9.1984 121.7809 54.8692 32.9975 174.0855 147 D 4.3472 9.1496 124.7061 53.6292 41.1863 176.2509 148 T 4.5912 9.2277 115.8714 62.8870 68.4587 175.3770 149 G 3.9464 8.8127 111.5247 46.0084 0.0000 174.5453 150 Q 4.1632 8.1138 119.7700 55.7595 30.5905 175.4682 151 W 4.9805 7.7731 115.9809 54.3696 32.0942 176.0102 152 S 4.4162 8.9732 117.3079 57.8419 64.8147 175.4046 153 S 4.0469 8.2968 116.2005 61.4600 61.9251 175.9429 154 D 4.1880 7.8318 120.2616 57.3888 41.1804 177.8981 155 E 3.9617 8.0941 119.0703 59.2672 29.3785 179.5678 156 I 2.8509 7.6742 119.6080 64.1413 37.1198 178.1897 157 A 3.7740 7.6845 121.4706 55.0382 18.0489 179.8829 158 K 3.8080 7.9008 116.8109 59.5949 32.1349 178.9962 159 D 4.2957 7.6407 119.0716 57.6270 40.7281 179.1419 160 I 3.5837 7.0761 119.7935 64.4385 37.1423 178.4276 161 I 3.5739 7.7927 120.7726 64.4099 36.6796 178.2683 162 F 3.9144 8.1216 120.2994 61.0653 39.4480 176.9105 163 L 4.1624 8.0006 118.6290 57.8265 41.4702 179.3503 164 V 3.5848 7.9720 118.4632 66.3635 31.2476 177.6806 165 E 4.0179 7.7831 114.8974 57.6501 29.5946 177.7149 166 L 4.3500 7.7008 120.1888 55.1275 42.6134 177.4501 167 E 4.0676 7.9666 118.3947 60.4439 29.1087 178.4417 168 H 4.2975 8.2705 115.2080 58.8891 28.7759 176.1124 169 H 4.6973 7.9269 115.0268 54.9581 29.1508 174.3707 170 H 4.5294 8.1052 122.4000 55.1566 30.2247 173.9052 171 H 4.7283 8.3602 124.2718 54.0854 29.6634 173.5423 172 H 4.3209 8.7446 122.8314 55.6544 29.0602 175.6156 173 H 4.6347 8.6075 120.8305 56.0212 29.4221 173.3782 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 T 8.03 4.33 4.51 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 0.00 0.00 0.00 1.33 0.00 0.00 3 L 9.10 4.30 0.00 1.69 1.75 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 4 I 9.35 4.73 2.01 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 1.34 0.65 0.99 0.00 0.00 5 I 9.29 4.96 2.07 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 1.05 1.05 1.20 0.00 0.00 6 L 9.55 5.33 0.00 1.75 1.69 0.99 0.83 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 7 E 10.78 5.21 0.00 2.18 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 2.56 2.75 0.00 8 G 8.89 4.50 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 0.00 9 P 0.00 4.72 0.00 2.23 2.10 0.00 3.74 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 10 D 8.57 4.50 0.00 2.87 2.69 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 11 C 8.53 3.69 0.00 3.01 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 12 C 7.03 4.32 0.00 2.89 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 13 F 7.62 4.20 0.00 3.30 3.09 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 0.00 0.00 0.00 0.00 14 K 7.63 3.99 0.00 1.94 1.87 0.00 1.95 0.00 0.00 1.85 0.00 0.00 3.15 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.53 1.55 7.81 15 S 8.11 4.22 0.00 4.14 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 16 T 7.82 3.85 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 1.18 0.00 0.00 17 V 8.28 3.56 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 1.01 0.00 0.00 18 A 8.24 3.97 1.47 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 19 A 7.96 3.94 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 20 K 8.01 3.89 0.00 1.91 1.80 0.00 1.60 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.60 7.81 21 L 8.01 3.91 0.00 1.82 1.62 0.87 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.19 4.24 0.00 3.91 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 23 K 7.91 3.91 0.00 1.85 1.79 0.00 1.83 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.43 7.81 24 E 7.96 4.03 0.00 2.12 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 25 L 8.13 3.84 0.00 0.93 0.66 0.46 0.74 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 26 K 7.83 3.94 0.00 1.94 1.95 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.54 7.81 27 Y 7.30 5.20 0.00 2.79 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 28 P 0.00 4.61 0.00 2.08 2.00 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 29 I 8.20 5.06 1.91 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 1.40 0.66 0.96 0.00 0.00 30 I 9.01 4.68 1.89 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 1.25 1.01 0.96 0.00 0.00 31 K 8.81 4.51 0.00 1.70 1.88 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.56 7.81 32 G 9.43 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 33 S 8.23 4.40 0.00 4.18 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.80 4.49 0.00 3.59 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 F 9.00 4.12 0.00 3.05 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 E 8.26 3.92 0.00 2.09 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 2.31 2.38 0.00 37 L 8.17 4.00 0.00 1.58 1.48 0.82 0.56 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 38 A 8.47 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.32 4.41 0.00 1.71 1.65 0.00 1.04 0.00 0.00 1.10 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 0.71 7.81 40 S 7.45 3.87 0.00 3.93 4.01 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 0.00 41 G 7.44 4.50 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 0.00 42 N 8.39 4.33 0.00 2.75 2.80 0.00 0.00 6.63 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 43 E 8.09 4.01 0.00 2.22 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 2.36 2.34 0.00 44 K 8.00 4.01 0.00 1.78 1.87 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.51 1.49 7.81 45 L 7.59 3.88 0.00 1.74 1.85 0.91 0.87 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 46 F 8.42 4.47 0.00 3.18 3.23 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 47 E 8.56 3.72 0.00 2.06 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 0.00 2.27 2.29 0.00 48 H 7.97 3.90 0.00 3.27 3.18 0.00 5.85 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 7.99 4.38 0.00 3.06 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 50 N 7.77 4.28 0.00 2.43 2.76 0.00 0.00 7.13 6.00 0.00 0.00 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 K 8.10 4.03 0.00 1.88 1.95 0.00 1.56 0.00 0.00 1.64 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.52 7.81 52 L 7.98 4.03 0.00 2.31 1.75 0.78 1.22 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 53 A 7.99 4.22 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 54 D 7.68 4.48 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 55 E 7.10 4.12 0.00 1.98 1.82 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 2.32 2.37 0.00 56 D 8.07 4.45 0.00 2.49 2.38 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 57 N 8.11 3.14 0.00 2.63 2.34 0.00 0.00 6.74 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 58 V 6.78 4.66 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 0.67 0.00 0.00 0.84 0.00 0.00 59 I 8.81 5.05 1.95 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 1.38 0.90 0.98 0.00 0.00 60 I 8.86 4.86 1.72 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.86 1.01 0.00 0.00 61 D 9.62 4.80 0.00 2.81 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 62 R 9.65 4.97 0.00 2.33 2.36 0.00 3.58 0.00 0.00 3.43 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.77 0.00 63 F 10.98 5.84 0.00 3.11 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 64 V 7.13 2.46 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 -0.84 0.00 0.00 -0.10 0.00 0.00 65 Y 7.40 4.15 0.00 3.24 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 66 S 8.38 4.28 0.00 4.50 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 N 8.27 4.71 0.00 3.18 2.98 0.00 0.00 6.82 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 68 L 7.95 4.33 0.00 1.71 1.71 0.88 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 69 V 7.49 3.93 1.46 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 -0.02 0.00 0.00 0.17 0.00 0.00 70 Y 7.82 4.14 0.00 3.17 2.96 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 71 A 7.94 4.11 1.61 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 72 K 7.68 4.48 0.00 1.67 1.76 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.47 7.81 73 K 7.71 4.29 0.00 1.06 1.12 0.00 1.56 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.14 1.32 7.81 74 F 7.03 5.15 0.00 2.97 3.03 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 75 K 8.76 4.18 0.00 1.86 1.82 0.00 1.96 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.55 7.81 76 D 8.77 4.35 0.00 2.89 2.67 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 0.00 0.00 0.00 0.00 77 Y 7.55 4.84 0.00 3.18 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 78 S 9.38 4.54 0.00 3.58 3.76 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 79 I 7.91 5.31 1.89 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 1.49 1.71 1.00 0.00 0.00 80 L 8.61 4.40 0.00 1.55 1.54 0.66 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 81 T 8.74 4.22 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 1.12 0.00 0.00 82 E 8.67 3.94 0.00 2.00 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 0.00 2.38 2.36 0.00 83 R 7.82 3.94 0.00 1.98 2.15 0.00 2.85 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 84 Q 7.79 3.86 0.00 2.16 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.86 0.00 0.00 0.00 0.00 0.00 1.16 1.77 0.00 85 L 7.97 3.88 0.00 1.82 1.79 0.65 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 86 R 8.15 4.32 0.00 1.97 2.03 0.00 3.21 0.00 0.00 3.11 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.82 0.00 87 F 8.41 4.17 0.00 3.29 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 I 7.96 3.79 2.02 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 1.67 1.27 0.91 0.00 0.00 89 E 8.87 4.06 0.00 2.01 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 0.00 2.36 2.52 0.00 90 D 7.94 4.29 0.00 2.69 2.81 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 91 K 7.68 4.04 0.00 1.53 1.84 0.00 1.77 0.00 0.00 1.90 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.33 7.81 92 I 7.30 4.46 1.93 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.89 1.03 0.00 0.00 93 K 8.15 3.83 0.00 1.91 2.22 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.64 1.42 7.81 94 A 7.87 3.96 1.20 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 0.00 0.00 95 K 8.14 4.75 0.00 1.95 1.94 0.00 1.36 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.34 7.81 96 A 8.29 5.30 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 97 K 9.01 4.59 0.00 1.76 1.82 0.00 1.47 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.51 7.81 98 V 8.65 4.47 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.20 0.00 0.00 99 V 9.53 5.18 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 1.19 0.00 0.00 1.19 0.00 0.00 100 Y 9.82 5.34 0.00 2.98 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 0.00 101 L 8.97 5.10 0.00 1.60 1.57 0.99 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 102 H 8.01 4.94 0.00 2.97 2.42 0.00 5.30 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 0.00 103 A 8.07 4.67 1.16 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 0.00 104 D 8.10 4.57 0.00 2.73 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.26 0.00 2.16 2.28 0.00 3.61 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 106 S 8.02 4.08 0.00 4.04 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 7.73 3.58 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 1.13 0.00 0.00 0.92 0.00 0.00 108 I 8.06 3.66 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.52 0.90 0.00 0.00 109 K 8.24 3.92 0.00 1.91 1.83 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.50 7.81 110 K 8.10 3.86 0.00 1.79 2.08 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.63 7.81 111 R 8.19 3.97 0.00 1.96 1.91 0.00 3.11 0.00 0.00 2.98 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 112 L 8.03 3.96 0.00 1.89 1.64 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.36 3.88 0.00 1.94 1.98 0.00 3.16 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 114 V 7.94 3.70 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.97 0.00 0.00 115 R 7.74 4.16 0.00 2.03 2.06 0.00 3.31 0.00 0.00 3.24 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 116 G 7.93 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 7.92 4.70 0.00 2.57 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 0.00 0.00 0.00 0.00 118 E 8.86 4.59 0.00 2.02 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 2.23 2.29 0.00 119 Y 8.22 4.33 0.00 3.14 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 0.00 120 I 7.08 2.98 1.60 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.95 0.81 0.00 0.00 121 E 7.92 3.66 0.00 1.95 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 2.36 2.43 0.00 122 G 7.20 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.77 5.37 0.00 1.70 1.72 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.32 7.81 124 D 8.29 4.41 0.00 2.84 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 0.00 125 I 7.72 3.74 1.88 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.33 0.94 0.00 0.00 126 D 7.93 4.40 0.00 2.89 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 0.00 127 S 8.00 4.07 0.00 3.88 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 0.00 128 I 8.01 3.69 2.14 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 1.56 0.79 1.21 0.00 0.00 129 L 8.61 4.19 0.00 1.99 1.80 1.05 0.90 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 0.00 130 E 8.48 4.00 0.00 2.06 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 0.00 2.32 2.46 0.00 131 L 8.51 4.03 0.00 1.96 1.63 0.84 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 0.00 132 Y 8.28 3.76 0.00 3.37 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 0.00 133 R 7.74 3.89 0.00 1.96 2.08 0.00 3.06 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.71 0.00 134 E 7.29 4.09 0.00 2.30 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 2.27 2.31 0.00 135 V 7.55 3.68 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 1.03 0.00 0.00 0.85 0.00 0.00 *137 S 8.06 4.30 0.00 4.02 4.01 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 0.00 138 N 7.75 4.87 0.00 2.77 2.80 0.00 0.00 6.92 7.36 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 0.00 139 A 7.79 4.75 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 0.00 140 G 8.99 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 7.70 4.61 0.00 1.79 1.76 1.16 1.26 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 0.00 142 H 8.59 4.51 0.00 3.13 3.11 0.00 5.83 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 T 7.91 4.93 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 1.07 0.00 0.00 144 Y 9.29 4.62 0.00 3.07 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 S 8.25 5.41 0.00 4.04 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 0.00 146 W 9.20 4.87 0.00 3.37 3.03 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 0.00 147 D 9.15 4.35 0.00 2.84 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 0.00 148 T 9.23 4.59 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 149 G 8.81 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 8.11 4.16 0.00 1.80 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 1.93 2.09 0.00 151 W 7.77 4.98 0.00 3.37 3.13 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 0.00 152 S 8.97 4.42 0.00 3.97 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 S 8.30 4.05 0.00 3.59 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 0.00 154 D 7.83 4.19 0.00 2.68 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 0.00 155 E 8.09 3.96 0.00 2.19 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 2.39 2.41 0.00 156 I 7.67 2.85 1.78 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 1.14 0.79 0.17 0.00 0.00 157 A 7.68 3.77 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 K 7.90 3.81 0.00 1.89 1.80 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.62 7.81 159 D 7.64 4.30 0.00 2.37 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 0.00 160 I 7.08 3.58 1.60 0.00 0.00 0.60 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 -0.31 0.82 0.00 0.00 161 I 7.79 3.57 2.03 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 1.26 0.99 0.83 0.00 0.00 162 F 8.12 3.91 0.00 3.11 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 0.00 163 L 8.00 4.16 0.00 1.89 1.59 0.37 0.84 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 0.00 164 V 7.97 3.58 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 1.04 0.00 0.00 0.93 0.00 0.00 165 E 7.78 4.02 0.00 1.74 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 166 L 7.70 4.35 0.00 1.69 1.74 0.95 1.05 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 0.00 167 E 7.97 4.07 0.00 2.28 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 2.36 2.59 0.00 168 H 8.27 4.30 0.00 2.91 3.24 0.00 5.70 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 H 7.93 4.70 0.00 3.13 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 H 8.11 4.53 0.00 2.98 3.48 0.00 5.72 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 H 8.36 4.73 0.00 3.04 3.00 0.00 5.75 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 H 8.74 4.32 0.00 3.05 3.24 0.00 5.84 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 H 8.61 4.63 0.00 3.09 3.12 0.00 5.75 0.00 0.00 0.00 0.00 6.91 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.