NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2423 8.4444 118.8192 56.3364 30.8169 174.4298 3 N 4.4755 8.4251 117.6093 52.4025 39.9910 174.9164 4 L 3.9074 8.7037 128.9143 58.0077 42.2554 178.5694 5 S 4.2005 8.2611 112.5453 61.8246 62.0231 175.7438 6 D 4.3752 7.9540 119.5154 56.9873 40.8259 178.1832 7 V 3.2883 7.7398 118.2517 65.3666 31.3653 177.2621 8 F 4.7930 8.2163 114.0751 55.7773 40.5133 175.8422 9 D 4.4706 7.6148 117.4940 55.4950 38.5577 174.8034 10 I 4.5388 8.2062 120.1082 60.7648 37.9231 176.3117 11 Y 5.4447 8.5620 124.8944 56.4152 40.5777 174.5917 12 A 5.5907 9.5371 123.8053 50.3464 22.0820 175.0814 13 I 5.4824 9.1871 121.8303 59.6468 41.8056 173.9705 14 C 4.9111 9.1120 122.2560 57.5057 33.6857 172.2900 15 A 4.8173 8.4225 119.8491 50.4504 21.3227 175.2667 16 C 6.0525 8.5840 119.3755 57.0941 32.9440 172.7102 17 C 5.9106 8.6214 114.2449 55.0844 33.8035 173.1704 18 K 4.6474 8.5879 117.5634 56.0399 33.0363 176.6536 19 V 4.7188 8.1087 122.2792 61.1090 32.6722 175.3347 20 A 4.1865 8.6637 131.5261 51.4907 18.7541 176.0431 21 P 4.5116 0.0000 0.0000 62.5767 32.9367 174.2518 22 T 4.6986 7.9405 107.1144 61.3643 71.4938 173.2243 23 S 4.7190 8.0050 115.1679 57.8593 63.5807 174.0107 24 A 4.2661 7.9728 119.0595 52.6337 21.5560 177.7620 25 G 4.0144 8.5471 107.3273 46.1057 0.0000 174.5123 26 T 4.2127 8.1438 110.1602 61.9582 69.3598 175.7134 27 K 4.0839 7.7986 121.2187 58.0181 32.6042 176.6424 28 N 4.2725 7.5371 117.9813 53.9868 39.7370 175.0701 29 E 4.7368 8.3350 126.0878 54.4402 29.6742 175.2346 30 P 4.1524 0.0000 0.0000 64.5700 31.6811 177.1736 31 F 4.9831 7.4728 116.9443 57.1245 40.4572 174.5574 32 S 4.2174 8.0595 115.8018 57.8105 62.4976 172.7426 33 P 4.2674 0.0000 0.0000 64.6634 31.2719 176.3819 34 R 4.4888 7.3550 117.1553 54.4554 29.7966 175.9718 35 T 3.7931 8.4780 121.2978 65.6300 68.6275 173.9270 36 F 5.2726 8.0529 120.5000 55.6619 38.5268 174.7550 37 R 4.9826 8.3701 117.9116 55.1864 32.0603 175.0963 38 G 4.0754 8.7743 109.4313 46.8352 0.0000 173.7546 39 L 4.5912 8.6623 128.6180 56.3770 43.8804 176.1591 40 G 4.0319 7.3136 103.2933 45.6343 0.0000 171.0797 41 N 5.6749 9.5897 115.9445 54.0735 42.8169 174.6510 42 K 3.6601 10.2391 126.4811 57.6145 30.2486 175.6835 43 G 3.8498 8.3157 102.7104 46.0903 0.0000 172.4598 44 T 4.4891 7.8946 109.5718 59.3948 72.0794 172.8432 45 L 3.5910 7.9017 121.6434 53.8086 41.8322 175.2533 46 P 4.0603 0.0000 0.0000 65.3579 31.3367 177.0180 47 W 3.3346 6.6257 112.0755 55.1356 29.5733 174.7363 48 K 4.2377 8.3446 119.0296 55.0482 32.7672 175.4831 49 C 3.6290 8.0886 119.5089 57.6600 28.8499 173.7658 50 N 4.6699 9.0430 124.7278 52.2570 39.4246 174.4480 51 S 4.0981 8.8010 122.8149 61.9403 62.3721 175.8211 52 V 3.6373 7.9644 119.8288 66.3402 31.1047 177.1003 53 D 4.5999 8.3766 116.9371 57.7727 41.0734 177.7737 54 M 4.1028 8.1929 118.5831 58.9473 32.1192 178.2238 55 K 3.9618 8.2413 119.4306 59.7813 32.4122 177.7914 56 Y 3.7736 8.7450 120.2911 60.2614 38.6735 177.4388 57 F 3.9009 9.5458 122.5252 61.5844 39.3233 177.2737 58 S 3.8734 8.0561 110.8825 62.0533 62.4645 175.4907 59 S 3.9350 8.3358 115.8027 61.0991 61.4434 175.8496 60 V 3.3186 7.4667 120.3512 66.4125 31.1648 178.4796 61 T 2.8802 6.9733 106.5641 63.1777 68.6644 175.4076 62 T 4.3783 7.2686 111.0547 61.1441 70.3163 174.1381 63 Y 4.0409 7.0245 123.5077 57.5515 39.3124 175.2985 64 V 4.1345 7.3143 119.0450 58.8018 35.8324 175.4718 65 D 4.4857 6.0500 122.0900 51.4314 41.4269 176.2024 66 E 3.7190 8.2946 125.4834 59.8623 29.9160 178.5559 67 S 4.1637 8.0355 113.1367 60.4333 62.4985 176.2426 68 K 3.8635 8.2734 122.8569 58.6846 32.0262 178.2159 69 Y 4.2540 7.9748 119.6860 60.8769 38.4549 177.5376 70 E 3.3722 7.9995 118.7030 59.3266 29.7964 178.4154 71 K 3.8646 7.3692 118.0866 59.6915 32.2426 178.3377 72 L 3.8036 7.7520 118.3886 57.7775 41.4731 179.4107 73 K 3.3985 7.4926 119.5296 59.2873 31.9352 178.6456 74 W 4.4892 7.8505 120.3180 59.2954 29.0215 178.4639 75 K 4.1563 7.9567 118.8851 59.7587 31.8702 178.1979 76 R 3.6730 7.9296 118.1105 59.1437 30.1471 178.5306 77 E 4.0335 8.1374 118.2562 59.8906 29.5247 179.3019 78 R 3.9617 8.7163 118.5673 59.9779 30.0818 177.4850 79 Y 4.0278 8.1548 118.6727 60.7668 38.5556 178.0315 80 L 3.9746 8.4551 118.9168 58.1270 42.1034 179.7103 81 R 4.0431 8.2135 117.8766 59.4312 29.9644 178.9309 82 M 4.1144 7.9146 114.7892 57.3985 30.5235 177.3358 83 E 3.9448 7.6740 120.6307 58.6604 29.8903 177.7965 84 A 4.1263 7.6716 119.6299 53.4963 18.5705 177.7579 85 S 4.0261 6.7312 114.6593 59.2120 63.5709 175.2888 *86 Q 4.0851 8.2441 115.3705 54.6977 29.4569 175.6704 *106 K 3.9293 7.9964 119.4080 56.2461 33.1610 174.3680 107 L 4.3680 8.0917 122.0242 53.3922 42.5032 174.6584 108 Q 4.7874 8.2729 124.1570 54.0900 33.3441 174.4555 109 N 5.3398 8.6369 117.1903 52.7074 40.8115 174.3071 110 V 4.8726 8.2020 119.9642 61.3798 34.0135 174.7060 111 V 4.6698 8.8851 120.9601 59.6507 34.9812 174.8610 112 V 5.1411 8.8088 123.5417 61.4378 34.7765 174.0993 113 M 5.9999 8.6995 124.2654 53.4148 35.1047 174.7401 114 G 3.9381 8.5304 107.4839 45.9421 0.0000 174.3324 115 R 4.0744 8.5104 121.4486 60.1773 29.9922 178.3943 116 S 4.1276 8.3185 113.8786 62.2727 62.5659 176.7172 117 S 4.8513 7.9033 118.3564 60.6831 62.7870 176.0539 118 W 4.4091 7.9390 131.2493 60.5673 30.8381 177.5466 119 E 3.9036 8.7208 119.2142 59.0550 28.7685 179.3207 120 S 4.2488 8.3631 110.4967 58.3325 62.6774 173.1938 121 I 4.4828 7.2488 123.3212 58.7907 39.2677 173.4748 122 P 4.0575 0.0000 0.0000 63.3188 31.1637 177.8304 123 K 3.9892 8.0699 124.5982 59.2578 32.2812 178.3719 124 Q 4.0078 7.4717 114.6343 57.9414 28.2940 176.1262 125 Y 5.0091 7.9874 115.4800 57.4497 39.2090 175.0153 126 K 4.6623 7.9577 119.2744 53.7089 35.0147 174.6740 127 P 4.9429 0.0000 0.0000 61.9261 32.4283 175.5532 128 L 4.3039 9.4887 120.0229 53.4505 42.0979 175.9304 129 P 4.3188 0.0000 0.0000 64.1482 31.7243 175.7994 130 N 4.3585 8.8986 115.5562 53.9822 36.2732 174.0926 131 R 4.7769 7.5195 115.0718 54.5483 34.4394 175.0373 132 I 3.9230 8.7110 125.1100 61.6730 38.1125 174.9551 133 N 5.1466 8.7917 125.5638 52.6521 40.3618 174.6910 134 V 4.8317 8.7727 122.4867 61.2398 35.0466 173.9487 135 V 4.6752 8.8063 128.4179 61.1258 33.8830 174.2130 136 L 4.8593 8.7746 128.4328 53.9810 43.0311 175.7470 137 S 4.7943 8.2729 116.9888 58.1488 66.0906 176.0988 138 K 4.6258 8.8765 120.2955 56.1201 33.5435 176.7922 139 T 4.6487 8.3303 108.1677 60.9785 69.0471 173.5964 140 L 4.8989 7.7422 120.1339 53.6568 45.3571 175.6450 141 T 4.7642 7.9232 109.7048 59.4471 72.0869 174.9481 142 K 3.8861 8.7124 121.5496 59.6976 32.2933 178.4754 143 E 4.1063 8.2378 117.1316 59.6317 29.7028 178.2741 144 D 4.3320 7.5747 117.4100 57.1963 40.9834 177.0766 145 V 3.9889 7.7849 121.2193 62.2023 31.1111 175.6557 146 K 4.2527 8.6074 127.4794 58.1403 32.7307 177.7816 147 E 4.1488 8.1419 117.2290 56.3994 29.8906 177.4334 148 K 4.1750 8.2851 123.3476 55.5919 30.5918 175.7421 149 V 4.5775 7.3073 115.9066 59.3147 36.8526 173.7244 150 F 4.7077 9.2461 120.4149 56.1488 40.9338 175.4488 151 I 4.6606 8.4505 124.7145 59.9927 38.1443 174.9951 152 I 4.2607 8.5576 129.3315 59.8777 38.4473 177.1330 153 D 4.3921 8.8553 126.1063 57.0023 41.6627 176.6952 154 S 4.5605 7.6189 111.4972 56.2831 67.1367 176.9341 155 I 3.5922 8.0116 124.1502 64.9466 36.7681 177.7975 156 D 4.3477 8.1538 118.7851 57.8321 40.5879 178.6924 157 D 4.3054 7.6264 117.8362 57.0745 40.6503 178.4868 158 L 3.9514 7.9613 121.1036 58.1729 41.9423 179.0777 159 L 3.6766 8.0625 118.8993 57.8412 41.3927 179.2688 160 L 3.8880 7.8203 117.7372 57.8337 41.8490 179.2434 161 L 3.9118 8.5612 121.0210 58.0670 42.0333 178.7388 162 L 3.8671 7.8471 119.0047 58.0976 41.3981 179.6065 163 K 4.1457 7.5864 117.1774 58.5266 32.1635 177.6872 164 K 4.7107 7.8875 117.1367 56.2305 33.0647 175.6093 165 L 4.7417 8.4949 120.6045 54.1029 44.9162 175.1955 166 K 4.4484 8.7873 127.1681 55.6412 32.6258 174.9928 167 Y 4.8888 7.8214 122.6346 56.1446 39.9572 172.4321 168 Y 4.7015 8.5566 123.2944 58.6352 38.1732 175.0446 169 K 4.6479 8.4000 114.4676 54.4765 37.2241 175.2020 170 C 4.3501 8.5900 125.3245 59.2405 32.6596 172.0662 171 F 5.5554 10.2388 125.8438 56.0332 41.6033 175.0241 172 I 4.9739 8.9944 124.0164 59.7525 38.9242 175.5239 173 I 5.0590 8.9942 120.3667 59.2681 38.4936 174.9006 174 G 3.7835 7.6785 108.2910 43.6104 0.0000 173.4830 175 G 3.8874 7.8868 108.9734 43.9188 0.0000 173.7119 176 A 4.1212 8.7245 119.5955 55.8819 18.0344 180.2066 177 Q 3.9256 7.8768 115.6881 58.9658 29.0285 178.6253 178 V 3.5599 7.5310 118.7705 66.6679 31.5139 176.8055 179 Y 4.4194 7.9587 116.4976 60.9653 37.5057 178.3855 180 R 3.7479 8.3687 118.1649 59.8215 30.5100 177.8615 181 E 4.0222 8.8275 118.8871 59.9213 29.6947 179.1676 182 C 4.1801 8.2141 116.1311 62.8631 27.9258 176.0619 183 L 4.0327 8.7236 121.1374 57.9543 41.1030 179.6068 184 S 3.9843 8.6926 113.8263 61.1643 62.6006 175.8043 185 R 4.4677 7.5179 118.7677 54.5881 30.6153 175.6096 186 N 4.2786 9.1171 115.8543 54.6611 36.6191 174.7446 187 L 4.4946 8.1787 114.6690 54.6105 42.4171 176.9765 188 I 4.6391 7.5678 120.5379 59.5669 38.1144 175.3471 189 K 4.5489 9.9763 128.5545 58.5419 32.9721 176.5669 190 Q 5.2304 8.0327 116.1885 54.6626 32.7155 173.0681 191 I 5.0869 8.6816 121.0228 59.9864 40.5539 174.4073 192 Y 4.7442 9.9275 126.6559 56.8863 38.8704 174.2928 193 F 4.9152 8.9749 127.9262 56.7570 41.2324 174.8713 194 T 4.6262 8.2177 123.4650 62.6915 70.8364 174.3527 195 R 4.4888 7.9509 121.9477 54.4702 34.1811 174.4174 196 I 3.8166 8.6834 125.8690 59.4179 38.4121 175.0656 197 N 5.1267 8.7409 128.6193 51.9419 36.4009 173.5592 198 G 3.8994 7.7393 105.0315 44.7151 0.0000 169.4270 199 A 5.1363 8.1696 125.9248 50.5363 20.0082 176.2959 200 Y 5.0262 8.3030 118.2474 55.4486 42.9886 172.8679 201 P 4.7363 0.0000 0.0000 63.3540 31.9763 175.7808 202 C 4.8231 8.7482 120.9545 58.0880 32.0480 173.3640 203 D 4.9782 8.3653 121.0043 52.9992 41.5629 175.5056 204 V 4.6073 7.2782 119.9756 61.0471 34.5072 174.2497 205 F 5.5066 8.6484 124.3778 55.3557 43.0983 174.3479 206 F 4.5392 9.3402 124.9952 57.6488 39.5427 173.5681 207 P 4.3723 0.0000 0.0000 62.9215 31.6194 175.6527 208 E 4.5820 8.3566 119.4219 55.8644 30.6708 175.1653 209 F 4.6609 7.4948 113.5024 56.6381 40.1064 174.5486 210 D 4.5545 8.2100 121.5297 52.6483 39.3176 176.0374 211 E 4.0758 7.7757 123.4239 58.3397 30.0961 179.4675 212 S 4.3069 8.3411 112.6116 61.4324 62.6371 175.3177 213 E 4.1853 8.4711 118.7008 57.1793 29.6773 175.7542 214 F 5.2049 8.5717 117.9061 55.7340 41.9587 175.3493 215 R 4.9018 9.2320 120.6936 54.0299 34.1028 175.2175 216 V 3.6815 8.4931 123.7527 62.1764 31.3605 175.8601 217 T 4.5492 9.2076 113.6923 61.5421 71.1850 174.2766 218 S 4.4595 7.7575 118.2106 57.0011 67.0775 173.1054 219 V 4.7033 8.3815 125.5336 60.7652 32.9693 175.1122 220 S 4.6075 9.0834 123.9237 58.0631 64.3403 173.3480 221 E 4.4675 8.7956 120.1860 55.4581 30.9944 176.4033 222 V 4.1538 8.1973 120.8706 63.0844 32.2135 175.0271 223 Y 4.6193 9.7130 126.3157 56.5933 40.8123 174.0540 224 N 5.6524 8.5412 118.6479 52.1587 42.5283 173.9555 225 S 4.4629 8.9304 118.8281 58.2787 66.0122 175.3284 226 K 3.7701 9.9288 122.4106 56.3711 30.1215 175.9631 227 G 4.0948 8.1725 105.1911 45.4481 0.0000 173.6177 228 T 4.5387 8.4427 118.4600 61.7562 70.3855 174.3678 229 T 4.8761 8.2419 116.5737 61.7372 70.8268 173.1357 230 L 4.9871 8.6898 120.7946 56.3694 44.3431 172.6746 231 D 4.5360 7.4186 118.2543 52.2037 43.6251 173.4831 232 F 5.0092 8.7162 116.4853 55.5828 42.5283 174.7349 233 L 5.2427 8.9480 122.4631 53.0884 45.8375 176.2447 234 V 4.3646 8.4382 120.6049 62.0253 34.2688 173.2857 235 Y 4.9719 8.9923 126.6392 57.0795 39.7720 175.2571 236 S 5.1839 9.1956 118.7784 56.1785 67.1391 173.4665 237 K 3.6243 8.3138 124.0994 56.0389 32.6894 177.2844 238 V 3.8362 8.8737 120.2405 61.7001 31.0424 176.0595 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 4.24 0.00 2.08 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 2.23 0.00 3 N 8.43 4.48 0.00 2.87 2.71 0.00 0.00 6.94 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 8.70 3.91 0.00 1.77 1.87 1.02 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.26 4.20 0.00 3.98 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 6 D 7.95 4.38 0.00 2.84 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 7 V 7.74 3.29 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 -0.65 0.00 0.00 0.48 0.00 0.00 8 F 8.22 4.79 0.00 3.03 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 9 D 7.61 4.47 0.00 2.48 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 0.00 0.00 0.00 0.00 10 I 8.21 4.54 2.18 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 1.28 0.86 1.01 0.00 0.00 11 Y 8.56 5.44 0.00 2.38 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 12 A 9.54 5.59 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 13 I 9.19 5.48 2.27 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 1.64 2.04 1.28 0.00 0.00 14 C 9.11 4.91 0.00 3.02 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 15 A 8.42 4.82 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 16 C 8.58 6.05 0.00 2.73 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 17 C 8.62 5.91 0.00 3.58 3.36 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 18 K 8.59 4.65 0.00 1.75 1.63 0.00 1.51 0.00 0.00 1.46 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.92 1.02 7.81 19 V 8.11 4.72 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.32 0.00 0.00 20 A 8.66 4.19 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 4.51 0.00 2.14 2.04 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.88 0.00 22 T 7.94 4.70 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 1.24 0.00 0.00 23 S 8.00 4.72 0.00 3.84 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 24 A 7.97 4.27 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.55 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 26 T 8.14 4.21 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 4.08 0.00 1.76 1.90 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.49 7.81 28 N 7.54 4.27 0.00 2.80 2.72 0.00 0.00 6.95 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.34 4.74 0.00 1.89 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 2.22 2.27 0.00 30 P 0.00 4.15 0.00 1.19 1.85 0.00 3.75 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 31 F 7.47 4.98 0.00 3.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.06 4.22 0.00 3.93 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 33 P 0.00 4.27 0.00 2.08 2.11 0.00 3.71 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 2.03 2.12 0.00 34 R 7.36 4.49 0.00 1.81 2.01 0.00 3.33 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 35 T 8.48 3.79 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 0.29 0.00 0.00 36 F 8.05 5.27 0.00 3.32 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 37 R 8.37 4.98 0.00 2.17 2.34 0.00 2.96 0.00 0.00 3.56 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.89 0.00 38 G 8.77 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.66 4.59 0.00 1.84 1.81 1.24 1.27 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 40 G 7.31 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 0.00 0.00 0.00 41 N 9.59 5.67 0.00 2.63 2.46 0.00 0.00 7.35 7.08 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 42 K 10.24 3.66 0.00 1.74 1.74 0.00 1.86 0.00 0.00 1.67 0.00 0.00 2.79 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.47 7.81 43 G 8.32 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 44 T 7.89 4.49 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 1.08 0.00 0.00 45 L 7.90 3.59 0.00 0.84 0.13 0.81 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.06 0.00 2.10 2.23 0.00 2.47 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.83 0.00 47 W 6.63 3.33 0.00 3.08 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 48 K 8.34 4.24 0.00 1.71 1.77 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.40 7.81 49 C 8.09 3.63 0.00 3.15 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 N 9.04 4.67 0.00 2.64 2.68 0.00 0.00 6.73 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 8.80 4.10 0.00 3.96 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.96 3.64 2.31 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 1.17 0.00 0.00 1.03 0.00 0.00 53 D 8.38 4.60 0.00 2.80 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 54 M 8.19 4.10 0.00 2.42 2.19 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.62 0.00 55 K 8.24 3.96 0.00 2.02 2.04 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.45 7.81 56 Y 8.75 3.77 0.00 2.63 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 57 F 9.55 3.90 0.00 3.20 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 58 S 8.06 3.87 0.00 4.06 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 59 S 8.34 3.94 0.00 3.77 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 60 V 7.47 3.32 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 0.53 0.00 0.00 -0.12 0.00 0.00 61 T 6.97 2.88 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 62 T 7.27 4.38 4.18 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 1.14 0.00 0.00 63 Y 7.02 4.04 0.00 2.94 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 64 V 7.31 4.13 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 0.92 0.00 0.00 0.66 0.00 0.00 65 D 6.05 4.49 0.00 2.85 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 66 E 8.29 3.72 0.00 1.82 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 67 S 8.04 4.16 0.00 4.09 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 68 K 8.27 3.86 0.00 2.10 2.11 0.00 1.87 0.00 0.00 2.00 0.00 0.00 3.02 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.64 1.92 7.81 69 Y 7.97 4.25 0.00 3.02 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.00 3.37 0.00 1.90 1.38 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 2.04 1.71 0.00 71 K 7.37 3.86 0.00 1.89 1.92 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.62 7.81 72 L 7.75 3.80 0.00 1.64 1.44 0.94 0.51 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 73 K 7.49 3.40 0.00 0.79 1.38 0.00 1.65 0.00 0.00 1.78 0.00 0.00 2.46 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.39 1.33 7.81 74 W 7.85 4.49 0.00 3.66 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.96 4.16 0.00 1.81 1.90 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.82 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.52 7.81 76 R 7.93 3.67 0.00 1.83 1.96 0.00 3.00 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.45 0.00 77 E 8.14 4.03 0.00 2.36 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 0.00 2.41 2.51 0.00 78 R 8.72 3.96 0.00 2.02 2.11 0.00 3.29 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 1.62 1.79 0.00 79 Y 8.15 4.03 0.00 3.17 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 80 L 8.46 3.97 0.00 1.93 1.80 1.10 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.21 4.04 0.00 1.95 1.95 0.00 3.13 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 82 M 7.91 4.11 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 83 E 7.67 3.94 0.00 1.35 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 2.17 2.18 0.00 84 A 7.67 4.13 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 85 S 6.73 4.03 0.00 4.16 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 *86 Q 8.24 4.09 0.00 1.84 1.96 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 2.18 2.42 0.00 *106 K 8.00 3.93 0.00 1.66 1.77 0.00 1.48 0.00 0.00 1.54 0.00 0.00 2.82 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.41 7.81 107 L 8.09 4.37 0.00 1.25 1.28 0.55 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 108 Q 8.27 4.79 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.60 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 109 N 8.64 5.34 0.00 2.92 3.14 0.00 0.00 6.28 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 8.20 4.87 1.70 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 0.85 0.00 0.00 0.62 0.00 0.00 111 V 8.89 4.67 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 0.68 0.00 0.00 1.06 0.00 0.00 112 V 8.81 5.14 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 0.98 0.00 0.00 0.94 0.00 0.00 113 M 8.70 6.00 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.44 0.00 114 G 8.53 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 0.00 0.00 0.00 115 R 8.51 4.07 0.00 1.93 2.01 0.00 3.28 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.83 0.00 116 S 8.32 4.13 0.00 3.89 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 0.00 117 S 7.90 4.85 0.00 4.02 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 0.00 118 W 7.94 4.41 0.00 3.39 3.34 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 0.00 119 E 8.72 3.90 0.00 2.19 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 120 S 8.36 4.25 0.00 3.98 4.06 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 0.00 121 I 7.25 4.48 1.64 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.79 0.89 0.00 0.00 122 P 0.00 4.06 0.00 1.41 1.74 0.00 3.83 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.07 0.00 123 K 8.07 3.99 0.00 1.61 1.66 0.00 1.50 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.30 7.81 124 Q 7.47 4.01 0.00 1.79 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.32 0.00 0.00 0.00 0.00 0.00 1.16 1.70 0.00 125 Y 7.99 5.01 0.00 2.85 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 0.00 126 K 7.96 4.66 0.00 1.38 1.13 0.00 0.62 0.00 0.00 1.30 0.00 0.00 2.37 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 1.05 7.81 127 P 0.00 4.94 0.00 2.34 2.28 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 128 L 9.49 4.30 0.00 1.82 1.75 1.14 1.38 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 0.00 129 P 0.00 4.32 0.00 2.23 2.21 0.00 3.91 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 130 N 8.90 4.36 0.00 2.85 2.89 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 7.52 4.78 0.00 1.95 1.82 0.00 3.09 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 132 I 8.71 3.92 1.93 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 1.38 0.82 1.11 0.00 0.00 133 N 8.79 5.15 0.00 2.71 2.74 0.00 0.00 6.44 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 8.77 4.83 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 0.95 0.00 0.00 0.89 0.00 0.00 135 V 8.81 4.68 1.65 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 0.75 0.00 0.00 -0.20 0.00 0.00 136 L 8.77 4.86 0.00 1.55 1.53 0.89 0.48 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 0.00 137 S 8.27 4.79 0.00 3.77 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 K 8.88 4.63 0.00 1.72 1.74 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.49 7.81 139 T 8.33 4.65 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 140 L 7.74 4.90 0.00 1.55 1.53 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 141 T 7.92 4.76 4.63 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 0.00 0.00 0.00 1.20 0.00 0.00 142 K 8.71 3.89 0.00 1.75 1.90 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.44 7.81 143 E 8.24 4.11 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 144 D 7.57 4.33 0.00 2.71 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 0.00 145 V 7.78 3.99 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 0.80 0.00 0.00 0.91 0.00 0.00 146 K 8.61 4.25 0.00 1.82 1.86 0.00 1.83 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.41 7.81 147 E 8.14 4.15 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.51 0.00 148 K 8.29 4.18 0.00 1.69 1.72 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.38 7.81 149 V 7.31 4.58 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 0.76 0.00 0.00 0.51 0.00 0.00 150 F 9.25 4.71 0.00 3.09 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 0.00 151 I 8.45 4.66 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.41 0.85 0.00 0.00 152 I 8.56 4.26 1.81 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 1.04 0.94 0.88 0.00 0.00 153 D 8.86 4.39 0.00 2.62 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 0.00 154 S 7.62 4.56 0.00 4.20 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 8.01 3.59 1.86 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 1.63 0.82 0.90 0.00 0.00 156 D 8.15 4.35 0.00 2.66 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 0.00 157 D 7.63 4.31 0.00 2.88 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 0.00 158 L 7.96 3.95 0.00 1.66 1.89 0.77 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 159 L 8.06 3.68 0.00 1.79 1.53 0.90 0.43 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 0.00 160 L 7.82 3.89 0.00 1.67 1.71 0.90 0.89 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 0.00 161 L 8.56 3.91 0.00 1.47 1.72 0.11 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 162 L 7.85 3.87 0.00 1.43 1.70 0.70 0.62 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 0.00 163 K 7.59 4.15 0.00 1.88 2.01 0.00 1.66 0.00 0.00 1.87 0.00 0.00 3.36 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.66 1.35 7.81 164 K 7.89 4.71 0.00 1.89 1.89 0.00 1.56 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.51 1.45 7.81 165 L 8.49 4.74 0.00 1.74 1.70 0.88 0.41 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 0.00 166 K 8.79 4.45 0.00 1.84 1.77 0.00 1.85 0.00 0.00 1.69 0.00 0.00 2.35 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.35 1.55 7.81 167 Y 7.82 4.89 0.00 3.29 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 0.00 168 Y 8.56 4.70 0.00 2.90 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.40 4.65 0.00 1.23 0.74 0.00 1.28 0.00 0.00 1.15 0.00 0.00 2.47 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.79 0.40 7.81 170 C 8.59 4.35 0.00 2.54 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 0.00 171 F 10.24 5.56 0.00 3.20 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 0.00 172 I 8.99 4.97 2.22 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.36 1.10 0.00 0.00 173 I 8.99 5.06 2.09 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 1.40 1.14 1.29 0.00 0.00 174 G 7.68 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 0.00 175 G 7.89 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 0.00 176 A 8.72 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 177 Q 7.88 3.93 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 178 V 7.53 3.56 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 1.04 0.00 0.00 0.90 0.00 0.00 179 Y 7.96 4.42 0.00 3.10 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 0.00 180 R 8.37 3.75 0.00 2.02 2.08 0.00 3.14 0.00 0.00 3.11 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 181 E 8.83 4.02 0.00 2.25 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.54 0.00 182 C 8.21 4.18 0.00 3.38 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 0.00 183 L 8.72 4.03 0.00 1.82 1.75 0.51 0.53 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 0.00 184 S 8.69 3.98 0.00 4.02 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 R 7.52 4.47 0.00 1.99 2.02 0.00 3.34 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.96 0.00 186 N 9.12 4.28 0.00 2.71 2.92 0.00 0.00 6.82 7.73 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 0.00 187 L 8.18 4.49 0.00 1.86 1.75 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 188 I 7.57 4.64 2.06 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 1.40 0.88 1.05 0.00 0.00 189 K 9.98 4.55 0.00 2.21 1.89 0.00 1.62 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.56 1.51 7.81 190 Q 8.03 5.23 0.00 1.80 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.62 0.00 0.00 0.00 0.00 0.00 1.56 1.37 0.00 191 I 8.68 5.09 1.67 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.53 0.88 0.00 0.00 192 Y 9.93 4.74 0.00 3.16 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 F 8.97 4.92 0.00 2.98 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 0.00 194 T 8.22 4.63 3.96 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 0.76 0.00 0.00 195 R 7.95 4.49 0.00 1.11 0.66 0.00 2.21 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.45 0.00 196 I 8.68 3.82 1.65 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 -0.36 0.74 0.00 0.00 197 N 8.74 5.13 0.00 2.82 2.86 0.00 0.00 7.02 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 G 7.74 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 0.00 0.00 0.00 199 A 8.17 5.14 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 0.00 200 Y 8.30 5.03 0.00 2.98 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 0.00 201 P 0.00 4.74 0.00 1.97 2.04 0.00 3.77 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 2.09 2.19 0.00 202 C 8.75 4.82 0.00 2.82 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 0.00 0.00 0.00 0.00 203 D 8.37 4.98 0.00 2.71 2.86 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 0.00 0.00 0.00 204 V 7.28 4.61 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 0.96 0.00 0.00 0.85 0.00 0.00 205 F 8.65 5.51 0.00 3.03 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 0.00 206 F 9.34 4.54 0.00 3.20 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 4.37 0.00 2.10 1.98 0.00 2.22 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 2.06 0.00 208 E 8.36 4.58 0.00 2.03 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 2.37 2.27 0.00 209 F 7.49 4.66 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 0.00 210 D 8.21 4.55 0.00 2.82 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 0.00 211 E 7.78 4.08 0.00 1.87 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.76 0.00 212 S 8.34 4.31 0.00 3.99 4.09 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 0.00 213 E 8.47 4.19 0.00 2.12 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 2.35 2.43 0.00 214 F 8.57 5.20 0.00 3.15 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 0.00 215 R 9.23 4.90 0.00 1.66 1.77 0.00 3.31 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 216 V 8.49 3.68 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 0.55 0.00 0.00 0.55 0.00 0.00 217 T 9.21 4.55 4.18 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 1.25 0.00 0.00 218 S 7.76 4.46 0.00 3.74 3.77 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 0.00 219 V 8.38 4.70 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 0.81 0.00 0.00 0.83 0.00 0.00 220 S 9.08 4.61 0.00 4.09 4.21 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 0.00 221 E 8.80 4.47 0.00 1.93 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 2.34 2.24 0.00 222 V 8.20 4.15 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 0.77 0.00 0.00 0.93 0.00 0.00 223 Y 9.71 4.62 0.00 3.03 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 N 8.54 5.65 0.00 2.67 2.63 0.00 0.00 6.79 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 8.93 4.46 0.00 4.08 3.96 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 0.00 226 K 9.93 3.77 0.00 1.97 2.01 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.37 1.40 7.81 227 G 8.17 4.09 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 0.00 0.00 0.00 228 T 8.44 4.54 4.29 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 1.22 0.00 0.00 229 T 8.24 4.88 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 230 L 8.69 4.99 0.00 1.33 1.49 0.63 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 231 D 7.42 4.54 0.00 2.64 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 0.00 232 F 8.72 5.01 0.00 2.72 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 0.00 233 L 8.95 5.24 0.00 1.90 1.45 0.97 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 234 V 8.44 4.36 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 0.29 0.00 0.00 0.96 0.00 0.00 235 Y 8.99 4.97 0.00 2.89 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 0.00 236 S 9.20 5.18 0.00 3.66 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 K 8.31 3.62 0.00 1.77 1.49 0.00 1.82 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.00 0.44 7.81 238 V 8.87 3.84 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 0.66 0.00 0.00 0.86 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.