NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.1776 8.4444 121.4845 56.0626 30.9825 175.5275 3 N 4.5521 8.2541 121.6545 51.6620 39.6589 174.0726 4 L 3.9053 8.2986 129.9093 57.8230 42.3024 179.0676 5 S 4.1757 8.2479 113.7550 61.3084 62.8322 176.1070 6 D 4.2533 8.4384 121.6391 57.1514 40.9093 178.1540 7 V 3.1665 7.2839 117.6380 65.5371 31.3400 176.6797 8 F 4.6829 8.0139 115.2817 56.3704 39.5536 175.9815 9 D 4.1228 7.5041 119.5524 55.1810 38.5344 173.7539 10 I 4.5093 7.9329 120.1217 60.5332 38.8969 176.4556 11 Y 5.6586 8.9013 125.0540 56.1842 41.6772 174.7254 12 A 5.6485 9.4930 123.6863 50.5069 22.2569 175.4772 13 I 5.4887 8.9140 120.5849 59.7659 41.3841 174.0255 14 C 5.0415 9.3108 122.6316 57.5192 33.7190 172.2436 15 A 4.9169 8.4178 119.5639 50.5810 21.6161 175.4090 16 C 5.9573 9.1344 119.6691 57.0989 32.8114 173.4048 17 C 5.7324 8.8299 116.6475 55.6708 33.1710 172.6713 18 K 4.8185 8.9071 117.7785 55.4211 33.2374 176.5954 19 V 4.7269 8.1999 122.1953 61.8046 32.8651 175.1569 20 A 4.4141 8.8268 130.6628 50.5246 18.9234 175.7800 21 P 4.4061 0.0000 0.0000 63.2208 31.9716 175.6240 22 T 4.7001 7.9152 114.1965 61.9134 71.9612 174.6318 23 S 4.3587 8.7161 118.3819 59.1090 63.9192 173.5534 24 A 4.6457 7.5996 122.5462 51.0036 21.9629 176.2131 25 G 4.0723 8.7666 104.0991 46.2361 0.0000 173.5531 26 T 4.4297 8.1991 106.6315 61.4041 68.8957 175.3262 27 K 4.3618 7.7965 119.2966 56.4218 32.6545 175.7324 28 N 4.5184 7.9023 118.8218 53.3885 40.1555 174.9844 29 E 4.7293 8.2663 124.0574 54.1731 29.9227 174.9536 30 P 4.0663 0.0000 0.0000 64.7360 31.7934 177.8582 31 F 4.9004 7.5302 116.1167 56.9383 39.5642 174.9284 32 S 4.0744 7.8597 115.2895 58.5676 62.2452 173.1794 33 P 4.3628 0.0000 0.0000 64.2577 31.3200 176.5499 34 R 4.5033 7.5206 116.9261 54.0956 30.3873 175.5657 35 T 3.7990 8.5165 119.6666 66.4430 68.5669 175.1306 36 F 4.9710 8.0134 124.2468 56.3708 37.7288 175.2821 37 R 4.9713 8.3891 118.0564 55.2254 32.0155 174.8821 38 G 4.2579 8.8382 109.5041 46.4147 0.0000 173.9530 39 L 4.6470 8.9640 128.1493 56.4761 44.0849 176.1779 40 G 4.0741 7.5367 103.3038 45.3979 0.0000 171.5184 41 N 5.7613 9.0382 118.6477 52.5606 42.5098 174.6407 42 K 3.8354 10.7800 127.9581 57.5773 30.2915 176.6056 43 G 3.8918 8.4346 105.5353 45.6533 0.0000 173.1281 44 T 4.5859 7.4062 109.3035 59.1857 71.6689 173.0685 45 L 3.9113 7.6800 120.0576 53.7303 42.1189 176.7659 46 P 4.0232 0.0000 0.0000 64.2653 31.4703 176.6078 47 W 4.1054 5.4244 111.1056 53.9331 30.1716 175.1913 48 K 4.1785 8.5958 119.3333 55.7043 32.5149 175.4608 49 C 3.4653 7.6284 122.8505 58.5267 31.1146 173.7976 50 N 4.8386 8.8652 127.3977 51.9763 39.5197 174.7851 51 S 4.2018 8.4983 124.6843 61.0461 63.2924 176.4825 52 V 3.5800 7.8045 121.6834 66.0853 31.3797 177.3952 53 D 4.6313 8.6968 117.9698 57.3926 41.0186 177.6502 54 M 4.0805 8.2964 118.9299 58.6122 32.2263 178.2011 55 K 3.9119 8.3336 119.7768 59.5470 32.4291 177.8963 56 Y 3.7890 7.9161 119.8025 60.6854 38.6285 177.6930 57 F 3.8045 9.0355 121.9444 61.6373 39.3143 177.2684 58 S 3.9298 8.2652 114.4217 61.5580 62.4848 177.0599 59 S 3.9582 7.8810 117.6920 61.4223 62.3898 176.6397 60 V 3.1738 6.7170 119.5035 66.1699 31.2595 177.9933 61 T 2.9272 6.7282 106.7899 63.5190 68.5943 175.5434 62 T 4.3179 6.8503 117.6684 63.6595 69.8797 174.6795 63 Y 4.0939 7.7413 122.5742 57.6038 39.2344 175.3491 64 V 3.4907 7.1759 125.5452 60.4969 34.7882 174.2130 65 D 4.3387 6.0500 124.3313 51.7507 42.4452 175.8041 66 E 3.8217 8.5905 127.8248 59.6434 29.2361 179.5524 67 S 4.1941 8.0994 112.8198 60.6487 63.4378 175.6622 68 K 4.4045 8.0435 120.3608 56.6132 32.1255 177.7903 69 Y 4.2519 7.8249 121.7460 60.5856 38.7352 176.8242 70 E 3.1210 7.9914 119.8001 59.0839 29.4978 178.5731 71 K 3.8718 7.6175 118.7660 59.5521 32.2474 178.5954 72 L 3.8476 7.1642 117.9554 57.2971 41.4733 179.2229 73 K 3.5332 7.7181 120.3801 59.1658 31.9937 178.8526 74 W 4.3777 8.1638 119.4220 59.8517 28.9504 178.2230 75 K 3.9076 8.1398 119.5113 59.7303 31.3733 178.8544 76 R 3.8824 7.9615 117.9872 58.9995 30.1764 178.5895 77 E 4.0419 8.6987 118.8231 59.3593 29.3358 179.4702 78 R 3.8361 8.4934 119.0511 59.6534 30.1686 177.7532 79 Y 4.0037 7.7890 118.9378 60.9695 38.5256 178.3494 80 L 3.9976 8.3080 118.8206 57.3672 41.8663 179.2774 81 R 3.9831 8.0462 119.1512 59.7713 29.9244 178.3504 82 M 3.9574 8.0288 117.7796 58.4310 32.0294 178.2132 83 E 3.8318 8.1122 118.5352 58.6009 29.7573 176.7470 84 A 4.1697 8.1237 119.4126 51.7039 20.4155 176.1619 *106 K 3.8585 7.5704 116.3222 54.5870 33.9461 175.6642 107 L 3.9371 8.2768 128.1005 55.3106 42.6329 175.6674 108 Q 4.7026 8.2368 123.0201 54.3547 33.8278 173.9420 109 N 5.3372 8.7478 117.7492 52.8413 41.1154 174.1525 110 V 4.7780 8.8355 120.5498 61.5119 34.2422 174.8517 111 V 5.0634 8.8661 119.7482 59.5871 35.1767 174.5840 112 V 5.0188 9.3722 125.6829 61.2842 34.0977 174.1968 113 M 5.3437 8.9900 124.0783 53.5052 35.2890 174.8835 114 G 4.0006 8.8696 108.5140 45.8331 0.0000 174.8777 115 R 4.0582 8.3472 118.3692 59.6166 30.0035 178.7449 116 S 4.2146 8.0978 114.4125 61.7260 62.5879 176.8019 117 S 4.0822 7.9458 116.4307 61.2468 63.0028 175.9460 118 W 4.3564 8.2027 130.9506 60.7503 30.2898 177.9438 119 E 3.9686 8.6801 117.5694 58.8308 28.9595 178.7562 120 S 4.2914 7.7524 112.6354 58.6117 63.6162 174.0559 121 I 4.0971 6.7999 124.5376 59.2420 38.0267 173.9756 122 P 4.1860 0.0000 0.0000 62.5828 32.1008 177.1165 123 K 3.6955 8.7756 122.9875 59.6444 32.0607 178.8328 124 Q 3.7714 7.6588 114.4377 58.5861 28.2339 176.6287 125 Y 4.7561 7.6849 114.5871 57.4636 38.3859 175.2623 126 K 4.6057 7.6094 119.9568 53.6630 34.5985 174.3982 127 P 4.7513 0.0000 0.0000 61.6656 32.4680 175.9213 128 L 4.0850 8.8425 120.4847 54.3011 41.4471 175.9878 129 P 4.3149 0.0000 0.0000 64.0866 31.8275 176.7934 130 N 4.6213 8.9944 116.1502 53.6812 36.0601 174.1087 131 R 4.9019 7.3182 115.7782 54.2887 34.4107 175.0607 132 I 4.1693 8.6902 123.4721 61.0622 38.3278 174.8244 133 N 5.2620 8.8206 125.0624 52.3494 40.6798 174.4046 134 V 4.9657 8.8457 122.6182 61.0369 35.2158 174.2607 135 V 4.8250 8.7444 127.6434 59.7946 34.2775 174.4794 136 L 4.8699 8.7901 125.6279 54.0915 42.8840 175.7444 137 S 4.5621 8.7420 115.9970 57.6557 65.7988 175.4645 138 K 4.6750 8.8798 124.7187 56.3594 32.3546 176.9521 139 T 4.4796 7.5602 108.7785 62.1369 70.7876 174.7862 140 L 4.1924 7.8300 121.2510 54.6814 42.5230 176.3226 141 T 4.7267 7.9691 110.4284 59.3926 71.6920 175.1962 142 K 4.0075 8.6117 121.9904 59.3612 32.4785 178.6015 143 E 4.0959 8.2799 117.8244 59.3894 29.4165 177.7573 144 D 4.4744 7.5832 114.8239 55.0093 41.3946 176.9181 145 V 4.2023 7.3066 118.7664 61.1732 30.4392 175.3068 146 K 4.1696 8.4357 126.8822 58.4439 32.5093 178.1475 147 E 4.0891 8.1066 117.2568 56.0099 29.8865 177.0805 148 K 4.1387 8.4184 122.7550 56.2675 31.1304 176.1596 149 V 4.5064 7.4258 123.6604 60.2278 34.4583 173.4479 150 F 4.4969 9.0593 122.1837 56.8439 40.4103 174.6802 151 I 4.6525 8.3537 124.5858 59.9456 38.5036 175.0354 152 I 4.5043 8.7253 128.2022 59.5752 39.4583 176.3721 153 D 4.5222 8.8795 125.4942 55.9349 41.7911 176.0558 154 S 4.5512 7.2807 111.9398 56.7844 66.1577 176.7820 155 I 3.6375 7.9023 122.9968 64.5644 36.7887 178.1898 156 D 4.3435 8.0947 119.1907 57.7985 40.6372 178.6913 157 D 4.3825 7.9661 118.6857 56.6225 40.6438 178.6749 158 L 3.7846 7.8572 121.4890 58.0901 42.1109 178.9225 159 L 3.6960 7.9851 119.0947 57.6758 41.2725 179.4869 160 L 3.8921 7.4499 118.0155 57.5204 41.8194 179.1098 161 L 3.8680 7.8655 120.4103 58.1770 41.8480 179.0509 162 L 3.8676 7.5657 117.6092 57.6402 41.5210 179.4688 163 K 4.2639 7.6702 117.6466 57.7652 32.1002 177.2998 164 K 4.7443 7.8454 118.6564 56.0842 32.9865 175.7745 165 L 4.7286 7.8727 119.3727 54.1972 45.2051 174.7929 166 K 4.4937 8.7069 126.8011 55.5549 32.9250 174.8597 167 Y 4.4542 7.9354 122.7067 57.1339 40.2974 172.3374 168 Y 4.4891 9.3484 121.9777 57.6856 38.1763 175.0883 169 K 4.5024 8.9711 116.1872 54.4950 37.1793 174.6655 170 C 4.9625 8.3777 122.6610 57.8698 33.6510 172.3987 171 F 5.3266 9.3645 126.2567 56.0450 41.0409 175.1480 172 I 4.7284 9.5404 126.0343 60.3734 37.9986 175.9857 173 I 4.6744 10.2393 120.8530 60.1865 38.4710 174.9094 174 G 3.6880 7.5459 108.6870 43.4019 0.0000 173.0318 175 G 4.0141 7.8792 109.6174 44.4963 0.0000 174.8065 176 A 4.1393 8.8855 120.8209 55.7827 18.3645 179.6309 177 Q 3.9278 8.0510 115.6801 59.3223 28.8897 179.4339 178 V 3.5923 7.5356 118.5722 66.0277 31.5390 177.5672 179 Y 4.3244 7.9472 116.8716 60.9034 37.6863 178.2876 180 R 3.8127 8.3225 120.0134 59.4245 30.2713 177.9516 181 E 3.9118 8.1420 118.9034 59.6943 29.5702 178.6861 182 C 4.1928 8.0097 116.2700 62.8260 28.2030 176.1883 183 L 4.0175 8.1967 120.8026 57.8959 40.9993 179.4039 184 S 4.3145 8.5034 112.2168 61.0432 62.2725 175.4399 185 R 4.4087 7.6675 118.0928 54.6766 30.3331 175.5461 186 N 4.2615 8.3647 116.4460 55.0589 37.8483 174.3382 187 L 4.6960 8.4034 112.8654 54.1238 42.1584 176.4421 188 I 4.7639 7.7896 119.8287 59.6349 39.2452 175.2002 189 K 4.4391 9.6133 127.9080 58.5888 33.6222 176.4869 190 Q 5.2644 8.2658 116.6718 54.3045 33.8012 174.0388 191 I 5.0762 9.0412 123.0483 59.9496 40.5317 174.2594 192 Y 4.8488 9.9328 126.5529 56.8214 39.2353 174.8361 193 F 4.9628 9.5253 129.1293 56.6426 41.5765 174.1703 194 T 4.6135 8.6338 124.2806 62.8657 70.2230 174.2674 195 R 4.5557 8.5054 125.7081 54.5287 32.4678 175.3688 196 I 4.0161 8.5092 126.8358 58.9910 38.1813 176.4624 197 N 5.3559 8.3610 131.5584 52.5187 36.2301 174.6490 198 G 4.2699 7.8332 106.9486 44.7878 0.0000 170.9896 199 A 5.5500 7.9660 123.6182 49.6221 20.7186 175.8792 200 Y 4.9168 8.4342 118.5557 55.3905 43.0985 172.9473 201 P 4.7641 0.0000 0.0000 63.2539 32.0596 175.9222 202 C 4.9395 8.6126 119.5895 58.4646 32.3817 173.4898 203 D 4.7539 9.0008 119.3417 52.5431 41.3602 174.8754 204 V 4.3852 6.9695 119.5198 61.1359 34.6228 174.0337 205 F 5.5996 8.5128 124.8719 55.1495 42.9790 174.4910 206 F 4.4601 9.3616 124.4512 57.6732 39.5650 173.5913 207 P 4.4894 0.0000 0.0000 62.5441 31.8884 175.7546 208 E 4.5314 8.5301 118.1132 56.1873 30.7543 175.2090 209 F 4.6777 7.5979 113.8634 56.1069 40.5109 173.5385 210 D 4.4655 8.6431 120.0708 53.5578 39.8069 176.2204 211 E 4.0501 8.1301 126.9218 58.2200 29.7774 179.4323 212 S 4.2755 7.8996 112.5844 60.2788 63.2652 174.9640 213 E 4.0843 8.2906 121.7345 57.5588 29.6869 175.7193 214 F 5.3107 8.1272 115.8874 55.9425 42.5248 174.4424 215 R 5.0269 8.9284 120.2955 54.3286 34.5327 175.1721 216 V 4.0775 8.7581 123.3363 62.0767 31.6801 175.8175 217 T 4.5742 9.1107 114.8065 61.5200 70.3131 174.4338 218 S 4.6016 7.4528 118.3503 57.4522 67.6987 173.2851 219 V 4.5420 8.2228 123.9254 61.1521 33.7648 175.0942 220 S 4.6715 8.6736 123.3764 57.4063 64.6053 173.5753 221 E 4.1999 8.6151 120.3640 55.8407 30.0671 176.6940 222 V 3.9665 7.7661 119.5094 63.1515 32.5055 174.3706 223 Y 4.7575 9.1676 122.8993 56.1017 42.5367 173.8090 224 N 5.2595 8.7914 118.2293 52.0912 41.9824 173.6329 225 S 4.5027 9.6511 122.1457 56.9392 62.7889 173.3658 226 K 3.9985 9.8569 128.0154 57.3848 29.5143 176.6777 227 G 4.0458 8.6931 107.8748 45.4755 0.0000 174.5009 228 T 4.4155 8.0892 117.9109 62.2910 69.8580 174.5095 229 T 4.9112 8.1479 116.6802 61.3145 71.3124 173.2088 230 L 4.7154 8.4124 120.6525 55.3360 44.0976 172.9680 231 D 4.5139 7.9123 118.3922 51.9607 43.8870 173.7439 232 F 5.0187 8.6610 117.1974 55.6685 41.6474 174.7785 233 L 5.1794 9.0086 123.5607 52.7993 45.4015 175.6936 234 V 4.6371 8.3506 120.9328 61.3114 34.7872 173.7301 235 Y 5.1963 9.2451 125.3144 56.3472 40.9695 174.7989 236 S 5.3389 9.3185 119.3702 56.1961 66.3886 173.6527 237 K 3.3611 8.8226 126.0516 55.9978 32.7145 177.2015 238 V 3.7522 8.5991 120.0581 61.7882 31.3751 176.0705 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 E 8.44 4.18 0.00 2.08 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 2.37 0.00 3 N 8.25 4.55 0.00 2.86 2.67 0.00 0.00 6.95 5.78 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 4 L 8.30 3.91 0.00 1.79 1.84 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.25 4.18 0.00 4.24 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 D 8.44 4.25 0.00 2.81 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 7 V 7.28 3.17 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 0.57 0.00 0.00 8 F 8.01 4.68 0.00 3.09 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 9 D 7.50 4.12 0.00 2.55 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 0.00 0.00 0.00 10 I 7.93 4.51 2.05 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 1.22 0.77 0.99 0.00 0.00 11 Y 8.90 5.66 0.00 2.65 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 12 A 9.49 5.65 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.91 5.49 2.12 0.00 0.00 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 1.63 1.49 1.27 0.00 0.00 14 C 9.31 5.04 0.00 2.99 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 15 A 8.42 4.92 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 16 C 9.13 5.96 0.00 2.88 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 17 C 8.83 5.73 0.00 3.64 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 18 K 8.91 4.82 0.00 1.82 1.65 0.00 1.52 0.00 0.00 1.47 0.00 0.00 2.38 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.88 0.79 7.81 19 V 8.20 4.73 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 1.01 0.00 0.00 1.21 0.00 0.00 20 A 8.83 4.41 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 21 P 0.00 4.41 0.00 2.14 2.02 0.00 3.69 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 1.96 1.95 0.00 22 T 7.92 4.70 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 23 S 8.72 4.36 0.00 3.97 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 24 A 7.60 4.65 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 25 G 8.77 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 26 T 8.20 4.43 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 27 K 7.80 4.36 0.00 1.80 1.91 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.40 7.81 28 N 7.90 4.52 0.00 2.67 2.69 0.00 0.00 6.86 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 29 E 8.27 4.73 0.00 1.90 1.75 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 2.24 2.16 0.00 30 P 0.00 4.07 0.00 1.13 1.80 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.66 0.00 31 F 7.53 4.90 0.00 3.03 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 32 S 7.86 4.07 0.00 3.90 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 33 P 0.00 4.36 0.00 2.08 2.09 0.00 3.67 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 2.02 2.11 0.00 34 R 7.52 4.50 0.00 1.85 1.94 0.00 3.32 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.73 0.00 35 T 8.52 3.80 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 0.49 0.00 0.00 36 F 8.01 4.97 0.00 3.27 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 37 R 8.39 4.97 0.00 2.12 2.30 0.00 2.89 0.00 0.00 3.51 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.86 0.00 38 G 8.84 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 39 L 8.96 4.65 0.00 1.89 1.72 1.24 1.42 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 40 G 7.54 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 41 N 9.04 5.76 0.00 2.74 2.52 0.00 0.00 7.21 6.46 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 42 K 10.78 3.84 0.00 1.81 1.81 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.33 7.81 43 G 8.43 3.89 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 0.00 0.00 0.00 44 T 7.41 4.59 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 45 L 7.68 3.91 0.00 0.99 0.13 0.68 0.63 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 46 P 0.00 4.02 0.00 2.07 2.33 0.00 2.20 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.73 0.00 47 W 5.42 4.11 0.00 2.99 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 0.00 0.00 0.00 0.00 48 K 8.60 4.18 0.00 1.79 1.82 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.50 7.81 49 C 7.63 3.47 0.00 2.99 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 50 N 8.87 4.84 0.00 2.78 2.77 0.00 0.00 6.91 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.50 4.20 0.00 4.11 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 52 V 7.80 3.58 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 1.13 0.00 0.00 1.00 0.00 0.00 53 D 8.70 4.63 0.00 2.88 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 54 M 8.30 4.08 0.00 2.37 2.16 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 55 K 8.33 3.91 0.00 1.93 1.94 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.42 7.81 56 Y 7.92 3.79 0.00 2.47 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 57 F 9.04 3.80 0.00 3.28 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.27 3.93 0.00 4.01 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 59 S 7.88 3.96 0.00 3.68 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 V 6.72 3.17 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 0.00 0.00 -0.21 0.00 0.00 -0.23 0.00 0.00 61 T 6.73 2.93 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 -0.13 0.00 0.00 62 T 6.85 4.32 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 63 Y 7.74 4.09 0.00 2.89 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 64 V 7.18 3.49 1.67 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 0.18 0.00 0.00 0.93 0.00 0.00 65 D 6.05 4.34 0.00 2.65 2.46 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 0.00 66 E 8.59 3.82 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.31 0.00 67 S 8.10 4.19 0.00 4.03 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 68 K 8.04 4.40 0.00 2.24 2.03 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.48 1.66 7.81 69 Y 7.82 4.25 0.00 3.11 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 70 E 7.99 3.12 0.00 1.67 1.41 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 1.47 1.47 0.00 71 K 7.62 3.87 0.00 1.80 1.73 0.00 1.82 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.63 7.81 72 L 7.16 3.85 0.00 1.62 1.45 0.71 0.46 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 73 K 7.72 3.53 0.00 0.79 1.31 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.34 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.40 7.81 74 W 8.16 4.38 0.00 3.54 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 75 K 8.14 3.91 0.00 1.89 1.90 0.00 1.51 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.29 1.44 7.81 76 R 7.96 3.88 0.00 2.08 2.01 0.00 3.03 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.41 0.00 77 E 8.70 4.04 0.00 2.21 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 2.41 2.53 0.00 78 R 8.49 3.84 0.00 1.92 2.14 0.00 3.06 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 79 Y 7.79 4.00 0.00 3.03 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 80 L 8.31 4.00 0.00 1.89 1.79 1.13 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.05 3.98 0.00 2.08 2.05 0.00 3.07 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 82 M 8.03 3.96 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.51 0.00 83 E 8.11 3.83 0.00 1.44 1.94 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 2.24 2.19 0.00 84 A 8.12 4.17 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 *106 K 7.57 3.86 0.00 1.69 1.73 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.42 7.81 107 L 8.28 3.94 0.00 1.32 1.32 0.46 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 8.24 4.70 0.00 2.02 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.67 0.00 0.00 0.00 0.00 0.00 2.31 2.57 0.00 109 N 8.75 5.34 0.00 2.96 3.16 0.00 0.00 6.32 7.68 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 0.00 110 V 8.84 4.78 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 0.72 0.00 0.00 0.54 0.00 0.00 111 V 8.87 5.06 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 0.71 0.00 0.00 1.11 0.00 0.00 112 V 9.37 5.02 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 0.97 0.00 0.00 0.89 0.00 0.00 113 M 8.99 5.34 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.61 0.00 114 G 8.87 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 0.00 115 R 8.35 4.06 0.00 1.95 1.96 0.00 3.46 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.69 0.00 116 S 8.10 4.21 0.00 3.89 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.95 4.08 0.00 4.03 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 W 8.20 4.36 0.00 3.47 3.26 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 0.00 119 E 8.68 3.97 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.69 0.00 120 S 7.75 4.29 0.00 4.03 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 0.00 121 I 6.80 4.10 1.64 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.66 0.86 0.00 0.00 122 P 0.00 4.19 0.00 2.19 2.01 0.00 3.81 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 2.28 2.12 0.00 123 K 8.78 3.70 0.00 1.62 1.76 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.33 7.81 124 Q 7.66 3.77 0.00 1.59 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.98 0.00 0.00 0.00 0.00 0.00 1.16 1.61 0.00 125 Y 7.68 4.76 0.00 2.91 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 0.00 126 K 7.61 4.61 0.00 1.37 1.08 0.00 0.61 0.00 0.00 1.01 0.00 0.00 2.51 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.91 1.08 7.81 127 P 0.00 4.75 0.00 2.41 2.36 0.00 3.84 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 128 L 8.84 4.09 0.00 1.87 1.78 1.14 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.31 0.00 2.24 2.21 0.00 3.84 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 130 N 8.99 4.62 0.00 2.91 3.01 0.00 0.00 6.74 7.66 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 0.00 131 R 7.32 4.90 0.00 1.51 1.84 0.00 3.14 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.58 0.00 132 I 8.69 4.17 1.94 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 1.33 0.95 1.12 0.00 0.00 133 N 8.82 5.26 0.00 2.73 2.79 0.00 0.00 6.48 7.68 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 0.00 134 V 8.85 4.97 2.16 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 0.94 0.00 0.00 0.93 0.00 0.00 135 V 8.74 4.82 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 0.41 0.00 0.00 0.79 0.00 0.00 136 L 8.79 4.87 0.00 1.54 1.59 0.88 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 137 S 8.74 4.56 0.00 3.74 3.59 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 0.00 138 K 8.88 4.68 0.00 1.76 1.78 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.62 1.38 7.81 139 T 7.56 4.48 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 1.20 0.00 0.00 140 L 7.83 4.19 0.00 1.60 1.57 0.83 0.67 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 0.00 141 T 7.97 4.73 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 1.20 0.00 0.00 142 K 8.61 4.01 0.00 1.74 1.89 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.40 1.44 7.81 143 E 8.28 4.10 0.00 1.93 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 2.31 2.39 0.00 144 D 7.58 4.47 0.00 2.72 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 0.00 145 V 7.31 4.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.97 0.00 0.00 146 K 8.44 4.17 0.00 1.82 1.86 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.41 7.81 147 E 8.11 4.09 0.00 2.32 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 2.61 2.47 0.00 148 K 8.42 4.14 0.00 1.68 1.75 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.28 7.81 149 V 7.43 4.51 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 0.29 0.00 0.00 0.54 0.00 0.00 150 F 9.06 4.50 0.00 2.97 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 0.00 151 I 8.35 4.65 1.81 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 1.13 0.36 0.83 0.00 0.00 152 I 8.73 4.50 1.81 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 1.08 1.03 0.91 0.00 0.00 153 D 8.88 4.52 0.00 2.61 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 7.28 4.55 0.00 4.00 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 0.00 155 I 7.90 3.64 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 1.69 0.93 0.90 0.00 0.00 156 D 8.09 4.34 0.00 2.69 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 0.00 157 D 7.97 4.38 0.00 2.89 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 0.00 158 L 7.86 3.78 0.00 1.67 1.74 0.77 0.39 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 0.00 159 L 7.99 3.70 0.00 1.79 1.53 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.45 3.89 0.00 1.72 1.66 0.89 0.97 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 0.00 161 L 7.87 3.87 0.00 1.56 1.60 -0.05 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 162 L 7.57 3.87 0.00 1.14 1.61 0.74 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 163 K 7.67 4.26 0.00 1.82 1.91 0.00 1.65 0.00 0.00 1.80 0.00 0.00 3.48 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.57 0.98 7.81 164 K 7.85 4.74 0.00 1.83 1.83 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.27 7.81 165 L 7.87 4.73 0.00 1.71 1.60 0.88 0.36 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 0.00 166 K 8.71 4.49 0.00 1.82 1.73 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.38 0.00 0.00 2.43 0.00 0.00 0.00 0.00 1.16 1.33 7.81 167 Y 7.94 4.45 0.00 3.16 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 Y 9.35 4.49 0.00 2.84 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 0.00 169 K 8.97 4.50 0.00 1.24 0.74 0.00 1.15 0.00 0.00 0.95 0.00 0.00 2.45 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.75 1.37 7.81 170 C 8.38 4.96 0.00 2.61 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 0.00 171 F 9.36 5.33 0.00 3.11 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 0.00 172 I 9.54 4.73 2.18 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 1.58 1.08 1.01 0.00 0.00 173 I 10.24 4.67 2.17 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.73 1.32 0.00 0.00 174 G 7.55 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 0.00 0.00 0.00 175 G 7.88 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 0.00 0.00 0.00 176 A 8.89 4.14 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 Q 8.05 3.93 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.86 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 178 V 7.54 3.59 1.94 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 1.01 0.00 0.00 0.92 0.00 0.00 179 Y 7.95 4.32 0.00 3.00 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 0.00 180 R 8.32 3.81 0.00 1.84 2.11 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 181 E 8.14 3.91 0.00 2.25 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 2.32 2.51 0.00 182 C 8.01 4.19 0.00 3.14 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 0.00 183 L 8.20 4.02 0.00 1.66 1.63 0.31 0.43 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 0.00 184 S 8.50 4.31 0.00 3.82 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 0.00 185 R 7.67 4.41 0.00 1.89 1.97 0.00 3.39 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.91 0.00 186 N 8.36 4.26 0.00 2.82 2.90 0.00 0.00 6.98 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 8.40 4.70 0.00 1.83 1.70 0.94 0.64 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 0.00 188 I 7.79 4.76 2.09 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.95 1.13 0.00 0.00 189 K 9.61 4.44 0.00 2.15 2.32 0.00 1.51 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.61 1.58 7.81 190 Q 8.27 5.26 0.00 1.46 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.62 0.00 0.00 0.00 0.00 0.00 2.22 1.99 0.00 191 I 9.04 5.08 1.93 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.53 1.02 0.00 0.00 192 Y 9.93 4.85 0.00 3.22 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 0.00 193 F 9.53 4.96 0.00 3.10 2.94 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 0.00 194 T 8.63 4.61 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 195 R 8.51 4.56 0.00 1.43 0.66 0.00 2.21 0.00 0.00 2.95 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.53 0.00 196 I 8.51 4.02 1.49 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 -0.36 0.55 0.00 0.00 197 N 8.36 5.36 0.00 2.83 2.92 0.00 0.00 6.96 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 0.00 198 G 7.83 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 A 7.97 5.55 1.11 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 0.00 200 Y 8.43 4.92 0.00 2.99 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 0.00 201 P 0.00 4.76 0.00 1.99 2.03 0.00 3.81 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 202 C 8.61 4.94 0.00 3.11 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 D 9.00 4.75 0.00 2.58 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 6.97 4.39 1.99 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 1.04 0.00 0.00 0.81 0.00 0.00 205 F 8.51 5.60 0.00 3.05 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 0.00 206 F 9.36 4.46 0.00 3.25 3.28 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 0.00 207 P 0.00 4.49 0.00 2.16 1.99 0.00 2.55 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 1.28 1.81 0.00 208 E 8.53 4.53 0.00 2.12 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 2.26 0.00 209 F 7.60 4.68 0.00 3.25 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 0.00 210 D 8.64 4.47 0.00 2.76 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 0.00 211 E 8.13 4.05 0.00 1.81 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.47 0.00 212 S 7.90 4.28 0.00 4.03 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 0.00 213 E 8.29 4.08 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 2.21 2.29 0.00 214 F 8.13 5.31 0.00 3.08 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 0.00 215 R 8.93 5.03 0.00 1.73 1.81 0.00 3.32 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 216 V 8.76 4.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.47 0.00 0.00 217 T 9.11 4.57 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 218 S 7.45 4.60 0.00 3.66 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 V 8.22 4.54 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 0.77 0.00 0.00 0.82 0.00 0.00 220 S 8.67 4.67 0.00 4.26 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 0.00 221 E 8.62 4.20 0.00 1.78 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 2.29 2.16 0.00 222 V 7.77 3.97 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 0.70 0.00 0.00 0.86 0.00 0.00 223 Y 9.17 4.76 0.00 2.92 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 0.00 224 N 8.79 5.26 0.00 2.65 2.66 0.00 0.00 6.70 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 S 9.65 4.50 0.00 3.78 3.70 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 0.00 226 K 9.86 4.00 0.00 1.96 1.89 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.44 7.81 227 G 8.69 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 0.00 228 T 8.09 4.42 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 0.00 229 T 8.15 4.91 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 0.00 230 L 8.41 4.72 0.00 1.42 1.49 0.70 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 231 D 7.91 4.51 0.00 2.62 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 0.00 232 F 8.66 5.02 0.00 2.72 2.46 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 0.00 233 L 9.01 5.18 0.00 1.42 1.07 0.84 0.47 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 0.00 234 V 8.35 4.64 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 0.38 0.00 0.00 0.80 0.00 0.00 235 Y 9.25 5.20 0.00 2.88 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 0.00 236 S 9.32 5.34 0.00 3.71 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 0.00 237 K 8.82 3.36 0.00 1.38 1.49 0.00 2.09 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.16 0.83 7.81 238 V 8.60 3.75 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 0.72 0.00 0.00 0.90 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.