NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3151 8.4449 120.2352 56.0362 31.7134 176.3777 3 N 4.3632 7.6500 116.1896 51.9441 38.6921 174.6796 4 L 3.9225 8.2040 125.5136 58.2775 42.7189 178.5975 5 K 3.8746 8.0861 117.7961 59.6137 32.0251 179.0258 6 K 3.9698 7.7263 119.0331 59.6329 32.2147 178.2065 7 Y 4.6067 8.0529 117.5230 61.0988 37.7841 178.3499 8 L 4.0781 8.5739 121.4907 58.5052 42.2130 178.8234 9 E 3.7808 8.3380 118.4357 59.3513 29.2098 179.7640 10 V 3.2493 7.9964 118.1186 65.5123 31.6562 177.8242 11 A 4.2164 8.3722 120.5889 55.2747 18.2812 179.7800 12 K 3.8878 8.1462 116.8042 59.6365 32.0560 179.6100 13 I 3.5369 7.3613 119.5559 64.3716 37.0422 178.3248 14 A 3.9240 8.2081 121.5980 55.1369 18.0598 179.5836 15 A 4.0675 8.1436 119.2796 55.2715 18.5400 179.9113 16 L 3.5423 7.9275 117.4112 57.4117 41.1997 179.5660 17 A 4.0432 8.2805 121.4402 55.3023 18.5438 180.0495 18 G 3.5958 8.3021 104.3577 47.7156 0.0000 176.2277 19 G 4.0438 8.7036 108.4022 47.7518 0.0000 175.6308 20 Q 4.0923 8.2262 121.7249 59.0122 28.8333 178.4861 21 V 3.6708 7.3781 119.3135 65.9337 31.4042 178.0938 22 L 4.2767 7.9803 118.7906 57.4651 41.2213 179.6242 23 K 4.2497 8.4167 118.7406 59.8697 32.9635 178.7042 24 E 4.2691 8.2281 116.3981 57.6160 30.1785 177.3990 25 N 4.8865 7.9725 115.4297 52.4083 39.8796 174.4604 26 F 3.8952 7.4900 123.1731 59.6958 39.8198 174.9390 27 G 3.5647 7.6661 115.5598 45.2744 0.0000 173.9288 28 K 4.1736 7.7953 118.4990 55.7124 30.5297 176.1654 29 V 3.1774 7.0315 116.5160 57.6361 33.6739 176.2006 *43 V 3.8569 7.9933 121.2433 61.9053 32.9679 176.1742 44 S 4.7475 8.1905 118.7745 56.8270 61.9562 173.6425 45 Y 4.2580 7.8500 123.6810 59.8342 39.1059 176.5694 46 V 3.2256 7.7926 119.2233 65.9669 31.6376 176.8674 47 D 4.1896 7.5863 117.6544 57.5650 41.0399 178.6828 48 K 3.8843 7.4688 117.4241 59.6685 31.9730 179.6097 49 T 3.6851 7.7378 116.2123 66.3773 68.2968 176.6906 50 S 3.9847 8.2213 115.4816 61.4030 62.3363 175.7370 51 E 3.8686 8.1817 121.9153 59.3911 29.3457 178.5168 52 E 3.8937 8.1666 118.4429 59.5628 29.5203 179.6945 53 R 3.9032 7.9312 117.9199 59.2984 30.1166 179.0004 54 I 3.6293 7.7241 119.5404 64.3263 37.0894 178.3253 55 K 3.7287 8.2360 119.2941 59.6394 31.7271 178.8630 56 E 3.8313 7.8963 118.1107 59.2224 29.7274 178.8085 57 V 3.7571 7.7732 118.0382 66.1588 31.6400 177.8631 58 I 3.3213 7.5500 119.4522 64.2590 36.7095 177.7845 59 L 4.4306 7.7648 116.3980 55.7463 41.7199 178.3470 60 K 4.1236 7.5651 118.4406 57.9651 32.5412 178.2554 61 F 4.0103 7.8374 116.7385 58.1589 40.3479 175.8703 62 F 4.9074 7.8150 117.0911 54.4504 39.6721 173.1058 63 P 4.3653 0.0000 0.0000 65.2654 31.5595 177.6041 64 D 4.6271 8.0725 115.3085 55.1051 40.0792 176.3274 65 H 4.6663 7.8767 117.6615 56.0793 29.6856 174.4761 66 E 4.5657 9.1975 122.7053 55.0983 31.5095 174.8685 67 V 4.8218 8.3428 125.6225 61.2287 33.7458 174.6424 68 V 4.3082 10.2188 128.1718 60.9418 34.3919 173.2112 69 G 3.0982 7.6325 110.8276 43.8026 0.0000 171.9187 70 E 4.1963 5.9000 123.0198 56.8722 35.8075 175.7742 *79 S 4.3106 7.8127 114.1197 58.3935 63.5651 172.0827 80 E 4.2172 7.9014 123.4302 56.9561 32.1439 175.1217 81 Y 4.8074 7.7105 117.4753 56.2077 40.1872 174.9684 82 R 4.8495 8.9227 123.6424 54.1183 33.4595 174.6429 83 W 5.0447 9.4203 124.9716 55.3813 31.0586 175.2504 84 F 5.3878 9.7013 125.1343 55.9372 40.2369 175.0524 85 I 5.2156 8.5697 116.9711 59.1083 40.6905 174.8043 86 D 4.8617 9.3616 124.7773 52.0217 42.4651 174.6614 87 P 4.2177 0.0000 0.0000 65.1565 31.5844 176.8756 88 L 4.3341 7.6428 119.2190 54.3999 43.0306 173.0244 89 D 4.6633 9.4605 127.2570 54.5261 42.0080 177.2065 90 G 4.3405 8.9914 116.6627 46.1328 0.0000 175.4373 91 T 3.8627 8.4208 117.0883 66.4975 68.6592 175.4791 92 K 3.9071 8.2413 119.5535 59.8837 32.0136 178.7330 93 N 4.4918 8.3025 115.6696 56.6402 38.7318 176.4884 94 Y 4.0234 8.3712 120.9248 60.9568 38.5700 178.4326 95 I 3.9297 8.1121 119.6979 64.5828 37.3412 177.9964 96 N 4.5724 8.1180 115.9923 54.4707 38.3629 176.2554 97 G 3.8006 7.6291 106.9846 45.1342 0.0000 172.5557 98 F 4.8629 8.7734 122.9689 55.7955 40.0806 174.8792 99 P 3.3194 0.0000 0.0000 65.3911 31.0624 176.8514 100 I 3.9785 6.1045 118.6758 60.3239 35.2299 174.6619 101 F 5.2874 7.4225 117.7002 56.0183 41.3229 173.1606 102 A 5.1422 9.4251 120.8033 51.8542 23.2085 174.9910 103 V 4.9258 8.4512 115.8478 60.5142 34.7903 174.7074 104 S 5.3578 9.1821 120.8338 56.6983 66.3534 173.5492 105 V 4.8189 9.5572 123.4734 61.4359 34.3702 174.1821 106 G 4.7084 9.6115 115.6727 44.2640 0.0000 170.2343 107 L 4.7434 8.9222 125.0451 52.6869 44.9212 175.1554 108 V 4.7321 8.6086 125.7161 60.9682 34.8346 173.8811 109 K 4.0431 9.0799 130.2266 57.1477 33.1262 177.4273 110 G 3.7758 9.3681 121.7142 46.0594 0.0000 172.8097 111 E 4.7844 9.0499 121.7961 55.5039 32.9123 175.5614 112 E 4.2940 8.1248 121.2290 54.4915 30.1934 173.6015 113 P 4.8597 0.0000 0.0000 62.5222 32.0648 175.8485 114 I 4.6077 8.8611 116.0556 60.5766 40.4785 175.4795 115 V 4.9510 7.7066 122.3730 61.2066 35.2297 174.0147 116 G 4.6828 9.5807 113.8907 44.6261 0.0000 171.4144 117 A 5.4637 9.1570 125.0303 50.5431 22.8545 175.1929 118 V 4.9952 9.5326 123.0825 61.3736 34.9977 173.5203 119 Y 5.3938 9.3079 129.0096 56.1191 41.7053 174.3957 120 L 4.5823 8.9534 127.7983 52.3705 41.6670 175.2018 121 P 3.6264 0.0000 0.0000 65.4359 31.6245 178.5782 122 Y 3.5763 7.2820 117.0085 59.5216 38.6932 176.0748 123 F 4.4491 7.9656 115.3616 56.2679 40.3409 174.4558 124 D 4.5966 7.1680 118.7628 54.3393 40.1220 173.6298 125 K 4.7332 8.1155 117.6851 54.6055 35.5307 176.5359 126 L 5.4148 9.5188 128.5692 53.6777 43.9216 174.5715 127 Y 5.1196 9.3678 126.0236 57.2519 39.4071 175.0520 128 W 5.8763 9.1564 120.5568 55.7384 32.2792 173.6867 129 G 4.7043 9.2018 105.9858 45.5153 0.0000 172.1184 130 A 5.3327 8.2663 120.7783 49.5012 23.2277 175.4919 131 K 3.9922 8.4118 120.9467 57.3070 32.2444 177.4437 132 G 3.9759 9.4187 113.5845 46.0174 0.0000 173.2714 133 L 4.4702 8.5398 118.5667 54.1201 42.6288 176.8823 134 G 3.7262 9.1890 105.6314 44.6531 0.0000 171.8099 135 A 4.7894 7.4394 118.9928 50.1600 21.9265 175.1614 136 Y 4.8958 8.6327 118.0006 56.2058 43.3959 175.1246 137 V 4.3714 8.3615 120.3266 59.9053 34.0337 175.3381 138 N 4.2384 10.0867 126.4114 54.2976 36.6107 175.1435 139 G 4.1630 8.9750 105.9756 45.0317 0.0000 173.9355 140 K 4.4434 7.7628 120.8868 54.4574 33.3723 175.6992 141 R 4.0372 8.5671 126.6479 56.1651 30.6283 175.0120 142 I 4.7135 7.3961 117.8459 59.1258 40.7448 174.2586 143 K 4.5506 7.9265 118.3073 56.0041 34.4343 175.6055 144 V 4.1588 8.2581 115.7934 60.9567 32.2407 176.5576 145 K 4.2106 8.4287 121.9576 56.7092 33.4875 176.8230 146 D 4.3702 8.6795 119.7867 57.0606 41.5085 176.4040 147 N 4.0701 7.8267 115.3222 53.9972 39.2088 173.4966 148 E 4.5525 8.6248 120.4833 55.7825 30.5791 175.2528 149 S 4.4314 7.8173 115.5636 57.2989 62.9875 174.4241 150 L 3.9071 8.6046 128.8543 57.7379 41.2036 179.6459 151 K 4.1019 7.9134 116.0491 58.6499 32.6358 177.4134 152 H 4.7244 7.7200 115.0855 56.1829 30.0380 175.6370 153 A 4.4605 8.0184 120.7575 51.9508 19.8403 176.3383 154 G 4.5526 10.1140 108.6213 44.4910 0.0000 172.5837 155 V 5.1741 8.9235 124.3936 61.2013 34.5441 174.9482 156 V 4.6395 8.4113 120.4087 59.8395 33.7983 174.4153 157 Y 4.9312 8.1189 121.4594 55.5430 41.9900 174.5750 158 G 4.2225 8.5075 101.3433 46.1627 0.0000 172.7808 159 F 5.2177 7.9396 119.7129 54.0751 41.0436 172.7618 160 P 4.5247 0.0000 0.0000 62.8159 32.3522 176.7963 161 S 4.4296 8.1509 115.5221 56.7555 60.7006 173.0230 *163 S 4.4530 7.5924 116.5982 57.5140 63.6851 173.6406 164 R 4.0385 9.8480 126.2425 58.7296 29.9873 177.0554 165 R 4.5157 7.4020 111.1827 53.5698 31.8331 175.2390 166 D 4.2211 8.2824 117.8273 54.5848 41.6671 176.9131 167 I 3.5580 8.5442 126.2793 64.3112 37.6926 177.5625 168 S 3.9420 8.4351 115.2967 61.7585 62.5232 176.7497 169 I 3.3562 7.2835 122.9467 64.2434 36.6746 178.0445 170 Y 3.7517 6.7137 116.8995 60.7250 37.6832 177.9930 171 L 3.8488 7.6525 119.9243 57.6681 41.4988 179.3564 172 N 3.9870 7.9219 116.8625 55.9986 38.2057 177.6053 173 I 3.7557 7.2224 121.1088 63.9124 37.1641 178.3212 174 F 4.0066 8.3000 121.9849 60.9798 39.2812 177.1151 175 K 3.8216 8.0776 118.4982 60.2426 32.3290 178.4971 176 D 4.3951 7.6297 118.8179 57.1278 40.7621 179.0800 177 V 4.1389 7.5812 118.6242 66.0907 31.2975 177.5939 178 F 3.9799 8.2566 119.9471 61.5659 39.1047 176.2081 179 Y 3.9063 7.9657 117.9960 59.6467 38.9790 176.1895 180 E 4.2412 7.7702 118.0280 58.3417 30.4004 177.2347 181 V 4.7761 7.1830 110.1319 60.0883 32.4160 176.5413 182 G 3.7324 8.4808 109.6090 49.2749 0.0000 173.3911 183 S 4.6219 7.5395 112.9351 57.8457 66.2724 174.3927 *185 R 4.3055 8.3931 116.9006 56.8716 31.7431 174.9885 186 R 4.1657 7.9747 120.6260 53.5075 29.9565 172.9997 187 P 4.3520 0.0000 0.0000 63.4007 31.8947 177.8594 188 G 3.8532 9.8240 104.7177 44.9881 0.0000 173.8742 189 A 4.3974 7.7249 122.7510 49.3783 20.0421 177.0149 190 A 3.9914 8.7146 123.9906 56.1114 18.3777 179.0746 191 A 3.8987 9.4084 120.0308 55.2492 18.1705 180.0465 192 V 3.4377 7.8325 116.4511 65.9340 31.6728 177.6528 193 D 4.3902 7.8130 117.4963 57.2051 40.8846 178.0793 194 L 4.0842 7.9658 120.8622 58.0251 42.0441 179.2901 195 C 4.2104 7.4771 115.6226 59.7743 27.9838 175.9442 *197 V 4.4367 8.0961 121.2471 63.0648 32.8664 177.2107 198 A 3.9997 8.0000 121.6101 54.9969 18.2295 177.9646 199 E 4.0968 8.4789 115.2666 56.8597 29.9075 176.8290 200 G 3.8453 7.9081 106.0017 47.1927 0.0000 174.8729 201 I 3.8818 7.8519 121.5313 61.9490 38.0971 176.4711 202 F 4.9475 7.5642 117.9194 55.3304 41.6885 176.1533 203 D 4.4154 9.2039 125.0914 57.5064 41.1617 176.0150 204 G 4.7145 7.6532 103.7817 45.0361 0.0000 171.5341 *207 E 4.5234 8.4783 119.2421 55.9392 30.9859 174.9239 208 F 5.1444 8.4505 124.3301 56.5824 42.2389 172.1779 209 E 3.5058 9.0672 128.2571 56.0128 27.5944 174.1802 *211 K 3.6652 8.0200 122.3103 54.7763 33.4188 175.6503 212 P 3.9715 0.0000 0.0000 65.4492 31.1677 177.9389 213 W 4.7556 7.2598 113.0975 57.3873 28.6888 176.5507 214 D 4.8222 7.6598 119.8382 56.1071 40.7932 177.0964 215 I 4.4227 7.2894 109.1219 60.1960 39.6070 177.2928 216 T 3.6960 8.1736 118.9539 66.7495 68.3484 175.9865 217 A 4.1408 8.0855 121.9958 55.3493 18.5592 179.8365 218 G 3.6234 8.1146 103.4843 47.5620 0.0000 175.4534 219 L 3.7259 7.8937 122.8673 57.8132 42.0821 178.9949 220 V 3.5920 7.6006 117.7714 66.1313 31.6160 177.7409 221 I 3.6730 7.6114 119.0693 64.4303 37.0006 177.7359 222 L 3.8979 8.0967 121.0862 58.4177 41.8563 179.0460 223 K 4.1475 8.2728 119.2454 59.7538 32.0446 178.4530 224 E 4.0942 8.4237 117.9886 58.4283 29.4164 178.1484 225 A 4.3595 7.7633 119.6797 52.3895 18.5163 178.4358 226 G 3.6875 7.9033 105.9726 44.9592 0.0000 173.9854 227 G 4.0494 7.6838 106.1114 45.2501 0.0000 173.9212 228 V 4.7051 8.5338 121.0743 61.2167 34.3780 174.0426 229 Y 5.5221 7.8200 122.3037 56.2379 41.2080 173.8125 230 T 4.6349 9.4326 117.8572 61.8226 71.6740 172.5997 231 L 5.0002 8.7269 128.7535 53.4701 43.9132 175.3109 232 V 4.1159 8.9223 127.1520 62.6290 33.2542 174.0375 233 G 4.0133 8.8951 114.1837 44.2868 0.0000 171.9193 234 E 4.2747 8.6548 120.7208 54.7086 30.1401 175.2620 235 P 4.0411 0.0000 0.0000 65.0415 31.3681 177.1476 236 F 4.9675 7.7402 114.1876 56.9924 39.5613 175.2156 237 G 4.2169 8.0120 109.4323 45.0257 0.0000 172.3429 238 V 3.9476 8.4673 120.9710 63.0714 32.0726 176.7534 239 S 4.9541 8.3962 121.0989 57.1826 66.8474 172.3532 240 D 5.0637 8.8457 118.7024 52.3978 44.1338 175.2328 241 I 4.8572 8.5614 122.6813 59.1850 40.8404 174.6394 242 I 4.5151 8.6785 129.2570 59.5735 40.1481 174.3118 243 A 5.1968 9.2236 127.8735 49.7304 23.2060 176.2278 244 G 4.1134 7.9459 105.0607 45.8689 0.0000 171.6932 245 N 5.0135 7.9037 118.4329 51.9166 38.5673 175.7861 246 K 3.8216 8.8069 117.8046 60.0001 31.9634 177.5948 247 A 4.0243 8.1859 120.0382 55.9187 18.1691 179.4196 248 L 4.1154 8.8186 116.4907 58.1434 41.9374 179.4369 249 H 4.2541 8.4663 118.2607 59.3125 29.9025 177.1570 250 D 4.4271 8.6294 121.2451 57.1078 40.6497 178.4577 251 F 4.2558 8.5093 121.3771 61.3989 39.4508 177.0626 252 I 3.3607 8.3588 119.6581 64.3481 36.9945 178.0934 253 L 3.8825 7.6421 120.5336 58.2193 41.6400 178.8215 254 Q 3.9037 7.6112 117.9126 59.0435 29.2255 178.1470 255 V 3.5902 7.4867 118.9969 65.8558 31.5394 177.6503 256 A 4.1244 8.2224 120.8962 55.3966 18.0671 179.6504 257 K 3.9825 7.9152 114.7211 58.6827 32.1065 178.9625 258 K 3.9936 7.7977 118.1700 57.6370 32.1257 177.0020 259 Y 4.5313 7.4220 114.2952 57.8820 38.7788 175.2601 *261 E 4.1520 7.8674 118.9091 56.2210 30.7099 175.5925 262 V 4.4589 8.1728 114.7266 59.6457 35.3102 175.4848 263 A 4.1713 8.4390 125.9592 52.6225 18.9807 175.6649 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 4.32 0.00 1.98 2.07 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 2.23 2.38 0.00 3 N 7.65 4.36 0.00 1.66 2.11 0.00 0.00 6.72 5.85 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 4 L 8.20 3.92 0.00 1.79 1.69 1.08 0.76 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 5 K 8.09 3.87 0.00 1.76 1.85 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.46 7.81 6 K 7.73 3.97 0.00 1.77 1.81 0.00 1.95 0.00 0.00 1.97 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.75 1.61 7.81 7 Y 8.05 4.61 0.00 3.14 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 8 L 8.57 4.08 0.00 1.96 1.81 1.21 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.34 3.78 0.00 1.95 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 2.47 2.37 0.00 10 V 8.00 3.25 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 0.75 0.00 0.00 0.61 0.00 0.00 11 A 8.37 4.22 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.15 3.89 0.00 1.58 1.61 0.00 0.64 0.00 0.00 0.61 0.00 0.00 2.28 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.36 1.49 7.81 13 I 7.36 3.54 1.77 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.68 0.80 0.00 0.00 14 A 8.21 3.92 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.14 4.07 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.93 3.54 0.00 1.75 1.52 0.72 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 17 A 8.28 4.04 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.30 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.70 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.23 4.09 0.00 2.43 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 21 V 7.38 3.67 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.96 0.00 0.00 22 L 7.98 4.28 0.00 2.19 2.07 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.42 4.25 0.00 2.00 2.07 0.00 1.97 0.00 0.00 2.22 0.00 0.00 3.15 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.78 1.55 7.81 24 E 8.23 4.27 0.00 2.26 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 0.00 2.74 2.44 0.00 25 N 7.97 4.89 0.00 3.17 3.10 0.00 0.00 6.48 8.01 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 26 F 7.49 3.90 0.00 3.03 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.67 3.56 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 0.00 28 K 7.80 4.17 0.00 1.93 1.81 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.51 7.81 29 V 7.03 3.18 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 0.66 0.00 0.00 0.91 0.00 0.00 *43 V 7.99 3.86 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 0.72 0.00 0.00 1.01 0.00 0.00 44 S 8.19 4.75 0.00 3.83 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.85 4.26 0.00 3.13 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 46 V 7.79 3.23 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 0.69 0.00 0.00 1.07 0.00 0.00 47 D 7.59 4.19 0.00 2.59 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.47 3.88 0.00 1.96 1.77 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.43 7.81 49 T 7.74 3.69 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 1.03 0.00 0.00 50 S 8.22 3.98 0.00 3.76 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 E 8.18 3.87 0.00 2.07 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 2.23 2.27 0.00 52 E 8.17 3.89 0.00 2.26 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 2.29 2.31 0.00 53 R 7.93 3.90 0.00 1.96 1.95 0.00 3.28 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.79 0.00 54 I 7.72 3.63 1.95 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 1.72 0.95 0.90 0.00 0.00 55 K 8.24 3.73 0.00 1.71 1.81 0.00 1.60 0.00 0.00 1.51 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.52 7.81 56 E 7.90 3.83 0.00 2.07 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 0.00 2.29 2.32 0.00 57 V 7.77 3.76 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 0.85 0.00 0.00 0.98 0.00 0.00 58 I 7.55 3.32 1.59 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.26 -0.35 0.00 0.00 59 L 7.76 4.43 0.00 1.62 1.66 0.88 1.02 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 60 K 7.57 4.12 0.00 1.52 1.55 0.00 1.57 0.00 0.00 1.59 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.51 7.81 61 F 7.84 4.01 0.00 2.19 1.66 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 62 F 7.82 4.91 0.00 2.93 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 P 0.00 4.37 0.00 2.05 2.11 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.15 0.00 64 D 8.07 4.63 0.00 2.88 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 65 H 7.88 4.67 0.00 3.40 3.73 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 E 9.20 4.57 0.00 2.06 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 67 V 8.34 4.82 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 0.82 0.00 0.00 0.89 0.00 0.00 68 V 10.22 4.31 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.59 0.00 0.00 69 G 7.63 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 0.00 0.00 0.00 70 E 5.90 4.20 0.00 1.56 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 2.08 2.20 0.00 *79 S 7.81 4.31 0.00 3.90 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 80 E 7.90 4.22 0.00 1.91 1.52 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 1.84 2.12 0.00 81 Y 7.71 4.81 0.00 2.50 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 R 8.92 4.85 0.00 1.47 1.21 0.00 2.79 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.40 0.00 83 W 9.42 5.04 0.00 3.17 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 84 F 9.70 5.39 0.00 3.17 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 85 I 8.57 5.22 1.95 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 1.29 0.64 1.07 0.00 0.00 86 D 9.36 4.86 0.00 3.16 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 87 P 0.00 4.22 0.00 2.19 2.22 0.00 3.72 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 1.93 2.02 0.00 88 L 7.64 4.33 0.00 1.46 1.58 0.45 1.16 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 89 D 9.46 4.66 0.00 2.80 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.99 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.42 3.86 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 92 K 8.24 3.91 0.00 1.88 1.92 0.00 1.59 0.00 0.00 1.84 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.65 7.81 93 N 8.30 4.49 0.00 3.19 3.50 0.00 0.00 6.66 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 94 Y 8.37 4.02 0.00 2.86 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 95 I 8.11 3.93 2.07 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 1.64 0.93 0.94 0.00 0.00 96 N 8.12 4.57 0.00 2.89 2.90 0.00 0.00 7.37 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 97 G 7.63 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 F 8.77 4.86 0.00 3.06 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 99 P 0.00 3.32 0.00 1.47 0.58 0.00 2.91 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.15 0.00 100 I 6.10 3.98 1.85 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 1.18 -0.06 0.97 0.00 0.00 101 F 7.42 5.29 0.00 3.20 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 0.00 102 A 9.43 5.14 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 8.45 4.93 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.11 0.00 0.00 104 S 9.18 5.36 0.00 3.93 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 9.56 4.82 2.28 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 1.32 0.00 0.00 1.05 0.00 0.00 106 G 9.61 4.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.92 4.74 0.00 0.30 1.00 -0.49 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.61 4.73 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.21 0.00 0.00 109 K 9.08 4.04 0.00 1.78 1.60 0.00 1.91 0.00 0.00 1.65 0.00 0.00 2.75 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.08 0.62 7.81 110 G 9.37 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 0.00 0.00 0.00 111 E 9.05 4.78 0.00 2.01 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 2.24 2.27 0.00 112 E 8.12 4.29 0.00 2.06 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 113 P 0.00 4.86 0.00 2.13 2.02 0.00 3.73 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 114 I 8.86 4.61 1.93 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 1.19 0.93 1.02 0.00 0.00 115 V 7.71 4.95 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 0.95 0.00 0.00 1.03 0.00 0.00 116 G 9.58 4.68 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 0.00 0.00 0.00 117 A 9.16 5.46 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 9.53 5.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.02 0.00 0.00 119 Y 9.31 5.39 0.00 3.12 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.95 4.58 0.00 1.63 1.63 1.01 0.82 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 0.00 121 P 0.00 3.63 0.00 2.34 2.37 0.00 3.16 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 2.38 1.98 0.00 122 Y 7.28 3.58 0.00 2.25 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 F 7.97 4.45 0.00 2.98 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 0.00 124 D 7.17 4.60 0.00 2.76 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 8.12 4.73 0.00 1.78 1.55 0.00 1.60 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.49 7.81 126 L 9.52 5.41 0.00 1.88 1.83 1.15 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 127 Y 9.37 5.12 0.00 3.16 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 0.00 128 W 9.16 5.88 0.00 3.52 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 G 9.20 4.70 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 0.00 0.00 0.00 130 A 8.27 5.33 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 0.00 131 K 8.41 3.99 0.00 1.71 1.85 0.00 1.67 0.00 0.00 1.60 0.00 0.00 3.10 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.64 1.47 7.81 132 G 9.42 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 0.00 133 L 8.54 4.47 0.00 1.87 1.88 1.03 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 134 G 9.19 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 0.00 0.00 0.00 135 A 7.44 4.79 1.07 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 0.00 136 Y 8.63 4.90 0.00 1.43 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 0.00 0.00 0.00 137 V 8.36 4.37 1.68 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 0.60 0.00 0.00 -0.08 0.00 0.00 138 N 10.09 4.24 0.00 2.84 2.95 0.00 0.00 7.28 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.98 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.76 4.44 0.00 1.84 1.66 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.36 7.81 141 R 8.57 4.04 0.00 1.88 1.76 0.00 3.25 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.15 0.00 142 I 7.40 4.71 1.83 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.74 0.89 0.00 0.00 143 K 7.93 4.55 0.00 1.74 1.69 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.19 1.36 7.81 144 V 8.26 4.16 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 0.75 0.00 0.00 0.98 0.00 0.00 145 K 8.43 4.21 0.00 1.84 1.79 0.00 1.98 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.48 7.81 146 D 8.68 4.37 0.00 2.62 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 0.00 147 N 7.83 4.07 0.00 2.68 2.73 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 0.00 148 E 8.62 4.55 0.00 2.06 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 2.13 2.23 0.00 149 S 7.82 4.43 0.00 3.83 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.60 3.91 0.00 1.59 1.63 0.76 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 151 K 7.91 4.10 0.00 1.81 1.98 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.21 7.81 152 H 7.72 4.72 0.00 3.09 3.38 0.00 5.86 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 8.02 4.46 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 G 10.11 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.92 5.17 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.08 0.00 0.00 156 V 8.41 4.64 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 -0.46 0.00 0.00 0.76 0.00 0.00 157 Y 8.12 4.93 0.00 3.11 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 0.00 158 G 8.51 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 F 7.94 5.22 0.00 2.40 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 0.00 160 P 0.00 4.52 0.00 2.26 2.12 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 161 S 8.15 4.43 0.00 3.88 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 *163 S 7.59 4.45 0.00 4.30 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 0.00 164 R 9.85 4.04 0.00 1.81 2.31 0.00 3.32 0.00 0.00 3.31 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 165 R 7.40 4.52 0.00 1.79 1.83 0.00 2.87 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.28 0.00 166 D 8.28 4.22 0.00 2.59 2.44 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 0.00 167 I 8.54 3.56 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.94 0.85 0.00 0.00 168 S 8.44 3.94 0.00 3.94 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 0.00 169 I 7.28 3.36 1.23 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 1.32 0.83 0.48 0.00 0.00 170 Y 6.71 3.75 0.00 2.07 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 0.00 171 L 7.65 3.85 0.00 1.66 1.60 0.83 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 172 N 7.92 3.99 0.00 2.38 1.42 0.00 0.00 6.94 8.19 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 0.00 173 I 7.22 3.76 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.09 1.07 0.00 0.00 174 F 8.30 4.01 0.00 2.98 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 0.00 175 K 8.08 3.82 0.00 2.12 2.25 0.00 1.38 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.51 7.81 176 D 7.63 4.40 0.00 2.91 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 0.00 177 V 7.58 4.14 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 1.32 0.00 0.00 0.92 0.00 0.00 178 F 8.26 3.98 0.00 1.93 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 0.00 179 Y 7.97 3.91 0.00 3.19 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 E 7.77 4.24 0.00 1.96 1.59 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 2.72 2.53 0.00 181 V 7.18 4.78 2.27 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 0.89 0.00 0.00 1.08 0.00 0.00 182 G 8.48 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 0.00 0.00 0.00 183 S 7.54 4.62 0.00 3.98 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 *185 R 8.39 4.31 0.00 1.46 1.85 0.00 3.33 0.00 0.00 3.39 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 186 R 7.97 4.17 0.00 0.67 1.39 0.00 2.82 0.00 0.00 2.92 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.17 0.00 187 P 0.00 4.35 0.00 2.16 2.12 0.00 3.56 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.97 0.00 188 G 9.82 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 0.00 189 A 7.72 4.40 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 A 8.71 3.99 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 0.00 191 A 9.41 3.90 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 0.00 0.00 0.00 0.00 0.00 192 V 7.83 3.44 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 0.71 0.00 0.00 0.88 0.00 0.00 193 D 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1.53 1.22 0.95 0.00 0.00 222 L 8.10 3.90 0.00 1.75 1.79 0.92 0.66 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 0.00 223 K 8.27 4.15 0.00 2.14 2.02 0.00 1.87 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.56 7.81 224 E 8.42 4.09 0.00 2.15 1.88 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 2.48 2.61 0.00 225 A 7.76 4.36 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 0.00 226 G 7.90 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 0.00 227 G 7.68 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 V 8.53 4.71 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 0.70 0.00 0.00 0.88 0.00 0.00 229 Y 7.82 5.52 0.00 2.97 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 0.00 230 T 9.43 4.63 4.30 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 1.24 0.00 0.00 231 L 8.73 5.00 0.00 1.77 1.56 0.79 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 232 V 8.92 4.12 2.23 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 0.98 0.00 0.00 0.97 0.00 0.00 233 G 8.90 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 0.00 234 E 8.65 4.27 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 235 P 0.00 4.04 0.00 1.12 1.57 0.00 3.47 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 1.80 1.94 0.00 236 F 7.74 4.97 0.00 3.11 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 0.00 237 G 8.01 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 V 8.47 3.95 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 0.83 0.00 0.00 0.92 0.00 0.00 239 S 8.40 4.95 0.00 3.91 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 0.00 240 D 8.85 5.06 0.00 2.74 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 0.00 241 I 8.56 4.86 1.70 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.63 0.77 0.00 0.00 242 I 8.68 4.52 1.85 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.40 0.87 0.00 0.00 243 A 9.22 5.20 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 G 7.95 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 N 7.90 5.01 0.00 2.98 3.12 0.00 0.00 7.04 6.27 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 0.00 246 K 8.81 3.82 0.00 1.85 1.87 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.74 1.52 7.81 247 A 8.19 4.02 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 L 8.82 4.12 0.00 1.90 1.86 1.11 1.36 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 0.00 249 H 8.47 4.25 0.00 3.27 3.46 0.00 5.58 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 250 D 8.63 4.43 0.00 3.02 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 0.00 251 F 8.51 4.26 0.00 3.14 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 0.00 252 I 8.36 3.36 1.92 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.82 0.94 0.00 0.00 253 L 7.64 3.88 0.00 1.68 1.63 0.90 0.48 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 0.00 254 Q 7.61 3.90 0.00 2.17 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.52 0.00 255 V 7.49 3.59 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 1.18 0.00 0.00 0.34 0.00 0.00 256 A 8.22 4.12 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 257 K 7.92 3.98 0.00 1.94 1.84 0.00 1.69 0.00 0.00 1.89 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.47 7.81 258 K 7.80 3.99 0.00 0.96 1.14 0.00 1.42 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.25 1.50 7.81 259 Y 7.42 4.53 0.00 2.87 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 *261 E 7.87 4.15 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 2.20 2.38 0.00 262 V 8.17 4.46 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 0.75 0.00 0.00 0.93 0.00 0.00 263 A 8.44 4.17 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.