NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.1957 7.8827 121.4417 61.2261 38.4953 173.7861 17 V 4.3033 8.7315 126.6795 61.9260 32.4514 174.5882 18 G 3.9900 8.5850 114.5540 46.9205 0.0000 173.1338 19 G 4.1991 7.6806 109.7647 44.1704 0.0000 172.6591 20 Y 4.9717 7.6601 116.3535 55.1223 42.1672 174.9431 21 T 4.1741 8.5873 117.2475 64.1507 68.3770 175.2810 22 C 4.2771 8.7448 125.3087 59.1272 36.2321 175.5424 23 G 3.9914 8.4119 105.2584 44.9110 0.0000 172.5594 24 A 4.2867 8.4289 125.3262 53.5396 18.6295 176.9558 25 N 4.2692 8.9460 119.1403 54.4763 36.1652 175.4712 26 T 4.1101 7.7375 108.1035 63.0844 69.8012 174.9562 27 V 4.0536 7.0681 121.8803 60.4579 31.2826 173.7387 28 P 4.5051 0.0000 0.0000 64.1508 32.0950 178.1312 29 Y 5.2316 6.9109 116.2374 57.0830 38.8764 174.7211 30 Q 4.5986 7.4978 123.5305 56.2320 29.5915 175.4912 31 V 4.8792 8.9880 118.9796 59.6587 36.1140 174.1612 32 S 5.0925 8.8453 117.0067 56.6176 64.8901 172.6976 33 L 4.7034 8.7257 127.5361 53.5585 43.1918 175.0339 34 N 5.9179 9.2396 122.7020 50.0914 41.9047 174.9922 *37 S 4.1374 8.4229 120.9126 58.4825 64.1401 174.4019 38 G 3.9697 9.4194 108.8075 46.4793 0.0000 173.1793 39 Y 4.6329 6.5689 115.1421 55.9183 40.1657 173.0734 40 H 4.6084 8.8636 121.9024 56.5903 30.3201 174.8262 41 F 5.0784 8.0879 119.0246 56.4334 39.4902 173.7025 42 C 4.8045 6.9264 114.8649 56.2627 44.4727 173.5997 43 G 4.3189 9.0209 110.1947 45.9718 0.0000 172.3337 44 G 4.5005 8.3403 105.5743 46.1640 0.0000 172.4603 45 S 5.4198 9.0053 115.7879 56.3031 66.6456 173.7417 46 L 4.6167 9.2245 128.1457 55.1021 42.3194 177.1674 47 I 4.6076 8.4766 119.5780 61.0093 39.1026 174.4137 48 N 4.6551 7.5244 117.2385 52.3747 39.4134 174.8203 49 S 4.2753 8.6129 111.6466 60.5404 63.3127 175.1448 50 Q 4.5040 8.8729 118.9722 55.2718 30.3655 174.7943 51 W 5.6048 8.1845 118.1298 54.8016 33.7727 174.2309 52 V 5.0092 9.1541 123.3569 61.1775 34.2513 174.1536 53 V 4.8164 8.9013 127.6704 61.8111 33.6558 174.7259 54 S 4.8946 8.8088 120.6627 57.2602 66.5093 172.0460 55 A 4.5758 8.7594 121.0898 50.5238 19.4354 178.4328 56 A 3.7636 8.4797 125.1936 55.4031 18.3342 179.3104 57 H 4.5004 8.5589 109.9421 57.7692 28.6695 175.5411 58 C 4.6821 7.9180 116.9430 57.6738 40.4459 173.3353 59 Y 4.4029 7.8124 122.3997 57.7610 38.8186 175.1369 60 K 3.3968 7.2661 123.3516 55.6856 34.8340 174.8996 61 S 4.3326 7.9192 115.0482 58.4431 64.2746 173.3380 62 G 3.7228 8.4401 106.1870 46.6808 0.0000 173.6651 63 I 4.1595 7.5999 119.8880 60.4318 38.9721 174.8151 64 Q 4.7537 8.9078 127.8585 54.2493 31.5401 174.2107 65 V 4.3456 8.7632 127.0586 61.9266 33.4685 174.6566 66 R 5.1521 8.8555 126.6654 54.6940 32.6733 174.7418 67 L 4.7366 9.0402 124.6863 52.6254 44.7556 177.6524 *69 G 4.1966 8.2738 108.3501 44.6724 0.0000 172.7560 70 E 4.3391 8.2967 118.6066 55.6073 29.6349 174.1123 71 D 4.8349 8.0749 118.5807 55.2491 44.4143 174.7842 72 N 4.9362 8.5604 119.8321 53.3792 39.3781 175.9063 73 I 4.0024 8.4167 119.7679 62.0881 37.9833 176.2161 74 N 4.7413 8.5816 118.0319 53.0700 39.2869 174.7921 75 V 4.3175 7.4543 118.4782 60.6201 34.0314 174.9321 76 V 4.0938 8.4696 126.9848 62.7285 31.3135 175.0836 77 E 4.4504 9.2029 127.0712 55.3794 30.8443 176.8134 78 G 3.9843 8.0265 105.1874 45.5553 0.0000 174.2519 79 N 4.8675 8.1351 115.9291 52.8074 39.5476 173.9946 80 E 4.5042 7.7816 118.0889 56.3932 30.6341 176.2180 81 Q 4.4348 9.1095 121.5192 54.1810 32.4284 174.2041 82 F 5.5597 8.7454 122.9120 56.0318 40.9120 175.4011 83 I 4.6928 8.8811 124.5874 59.4756 41.3644 175.1955 84 S 4.7131 8.7669 122.7510 58.2135 64.1111 173.5157 85 A 4.5815 8.6093 126.3807 52.3125 18.1526 177.7963 86 S 4.5494 8.9472 117.2045 59.9614 64.4942 174.4063 87 K 4.6559 7.5159 117.2365 55.9688 35.4346 174.7528 88 S 5.3182 8.7159 116.5103 57.0046 66.8004 174.0382 89 I 4.5622 9.1568 123.5611 59.4434 40.2679 174.8998 90 V 3.9986 8.3973 127.5856 62.4031 32.5250 175.1965 91 H 3.5921 8.6626 127.3234 55.9338 29.9478 174.3601 92 P 4.2742 0.0000 0.0000 65.3786 31.1714 177.1083 93 S 4.6521 7.8397 112.3374 57.9627 62.9314 173.2351 94 Y 4.3036 7.9557 123.5184 57.8952 38.9817 174.6152 95 N 4.5484 8.3028 125.7148 51.2585 40.0667 175.0405 96 S 3.8394 7.7874 120.8159 60.4151 63.3817 175.5465 97 N 4.3679 8.3834 118.8304 55.2475 38.1064 175.8672 98 T 4.0694 7.6801 105.9576 60.3106 70.3049 175.0091 99 L 4.2408 8.0584 120.9177 55.4105 40.0092 173.8932 100 N 4.3466 7.4219 117.8574 54.8642 39.4859 174.6320 101 N 4.8337 8.7249 121.7693 54.1939 35.4294 175.7140 102 D 4.7178 7.6617 118.6709 52.6691 40.3973 174.4385 103 I 4.8623 7.1229 120.9511 59.5004 42.1576 172.8189 104 M 5.4675 9.1372 124.4795 54.0500 35.3030 173.3504 105 L 5.4454 9.1058 119.9357 53.3367 44.7797 175.6149 106 I 5.0672 8.9638 123.1911 59.4921 40.7731 174.2759 107 K 3.9187 8.5255 128.7197 54.7015 33.7694 175.2868 108 L 4.4151 7.8934 127.6098 53.9336 41.7446 177.1281 109 K 4.1258 8.9999 126.4086 58.8517 32.6552 177.0754 110 S 4.6302 7.7489 111.6235 55.6434 66.0758 173.2515 111 A 4.3179 8.4776 123.8763 51.8884 18.6451 177.4043 112 A 4.0551 8.6922 124.6367 52.2333 19.4694 177.4003 113 S 4.5100 8.9624 116.6040 56.7999 62.7559 174.0037 114 L 4.4730 8.4741 128.1458 54.6859 42.4251 176.3777 115 N 4.7494 8.5395 118.5646 52.4353 39.9441 174.9298 116 S 4.2993 8.6927 111.6907 60.5507 63.5999 174.7672 117 R 4.3961 8.5785 119.6583 56.1403 30.8315 175.8492 118 V 4.6294 7.8546 117.5248 60.7926 32.4209 173.2346 119 A 5.2217 8.7222 127.0481 49.6860 22.9465 175.2198 120 S 5.0552 8.7546 114.2320 57.9129 64.7710 173.0790 121 I 4.4435 8.4325 121.6870 59.1823 39.4493 175.4435 122 S 4.4216 8.3889 124.3109 58.2945 64.0133 173.9724 123 L 4.2237 8.3856 123.5469 53.4812 42.3730 175.2949 124 P 4.4842 0.0000 0.0000 63.0596 32.1762 176.4597 125 T 4.1198 8.2294 108.9844 62.7092 69.7724 174.6764 *127 S 4.4117 7.5622 114.9619 57.9600 63.9823 174.0297 128 C 4.4097 8.4497 118.3481 56.9005 40.6553 173.2063 129 A 4.5204 7.8912 123.8546 51.1726 20.1621 177.2109 130 S 4.3275 8.0244 114.9664 57.3731 64.3782 173.7026 *132 A 4.1798 8.2464 124.7448 53.4921 19.2410 177.3767 133 G 3.9809 9.0612 111.5567 45.2850 0.0000 174.1937 134 T 4.0197 7.5617 117.4494 63.7140 69.4897 173.7790 135 Q 4.5133 8.5753 124.9102 55.8656 29.9056 175.7596 136 C 5.2374 9.3107 119.9789 55.1055 43.8471 172.3489 137 L 5.2014 8.8320 122.2014 53.6044 43.8847 174.9656 138 I 5.3663 8.9472 127.3223 58.8277 40.0409 174.9001 139 S 4.8834 8.5556 119.3573 56.3508 66.5124 173.2506 140 G 3.8273 7.3724 109.0121 46.1615 0.0000 172.7145 141 W 4.7527 8.4752 116.8569 56.2734 29.3108 177.0429 142 G 4.0576 8.6877 109.6111 44.3579 0.0000 173.4120 143 N 3.6555 7.9241 118.1954 53.9067 38.9837 174.7274 144 T 4.7493 8.3070 115.7510 61.1081 69.5271 174.9438 145 K 4.6423 7.9371 123.6793 53.0153 34.0470 181.2093 146 S 4.4618 8.5558 116.4685 58.7984 63.8646 174.3261 147 S 4.4594 8.1668 116.4355 58.7301 65.0324 173.1977 148 G 3.8561 9.6592 112.3754 44.2714 0.0000 171.3468 149 T 4.8352 8.0255 114.3183 62.0940 72.3605 174.0474 150 S 4.5992 9.6853 121.7492 57.4085 66.0937 171.9931 151 Y 4.8839 8.8498 125.3186 55.6521 39.4040 174.1511 152 P 4.6880 0.0000 0.0000 62.6762 32.8511 175.4070 153 D 4.9285 8.6059 117.2455 54.8344 42.7594 176.8699 154 V 5.0564 7.7382 110.8139 58.8534 33.9708 175.5112 155 L 3.2884 8.3849 124.3658 54.8757 43.0361 175.8732 156 K 4.9193 8.0958 124.5229 54.8256 35.3133 174.5488 157 C 5.2757 8.3868 119.5783 55.1480 45.1148 172.9353 158 L 5.0256 8.8311 122.9649 53.6839 45.5522 174.7604 159 K 5.0233 9.0126 125.5410 55.5843 33.4091 176.0514 160 A 4.7185 9.1464 126.6900 49.8279 23.0423 173.4142 161 P 4.9828 0.0000 0.0000 61.6519 33.9936 175.3410 162 I 4.3056 8.4359 123.2435 61.7122 37.8268 175.6957 163 L 4.7938 8.6417 127.6074 53.2080 43.2123 177.1092 164 S 4.2937 8.5636 115.4723 58.5336 63.7312 175.2042 165 D 4.4376 8.7851 122.1583 57.6586 40.5747 179.2993 166 S 4.2127 8.0487 114.6357 61.4274 63.0912 176.5755 167 S 4.1549 7.9803 117.9791 61.0216 62.8645 175.7330 168 C 4.2726 8.2182 122.1527 59.7090 43.2824 175.8355 169 K 4.0250 8.2894 118.9861 59.5118 31.6557 179.3221 170 S 4.2630 8.1119 114.7228 61.4630 62.7816 176.2416 171 A 4.0284 7.7735 122.7819 53.9438 19.7497 177.4164 172 Y 4.8813 7.6385 113.7178 55.3968 38.6165 172.4859 173 P 4.5446 0.0000 0.0000 63.6949 32.3673 177.1820 174 G 3.9966 9.0156 109.5751 46.2392 0.0000 173.8036 175 Q 4.5736 8.1621 115.9196 55.1567 30.5981 175.4028 176 I 4.4937 7.8802 119.5071 59.8865 38.8262 175.2040 177 T 4.6266 8.1834 114.8866 59.4281 71.0912 175.1809 178 S 4.3096 8.5585 115.2611 60.5416 63.1490 174.4893 179 N 4.9370 7.9437 117.4674 53.3657 38.4840 173.9001 180 M 5.6025 7.9428 117.0215 53.6728 36.1242 174.6112 181 F 5.1267 8.6572 115.2828 55.6805 42.2048 172.7057 182 C 5.8511 9.2017 116.2455 55.2427 41.7531 172.6096 183 A 5.0544 9.0477 121.9623 50.5999 22.3182 173.9390 184 G 4.1513 7.3598 106.7800 44.3655 0.0000 174.6955 184A Y 4.6924 8.4494 121.7631 56.2648 41.4537 176.0009 185 L 4.1705 8.8139 127.0919 57.5622 42.1416 179.2548 186 E 3.7467 8.2146 113.4673 56.6392 30.1855 182.5079 187 G 3.8331 7.5521 103.8530 45.4887 0.0000 172.6501 188 G 4.0792 9.3379 106.2566 44.9462 0.0000 173.4914 188A K 5.1583 7.4091 117.4833 55.0308 35.5618 175.1923 189 D 4.6916 8.8997 123.1492 53.5956 45.5808 174.8633 190 S 4.8378 8.1379 114.6246 58.2581 65.1369 171.5755 191 C 4.7006 9.1342 121.1191 56.0523 47.4913 173.0849 192 Q 4.4640 8.5166 119.2283 56.9096 27.8013 174.9405 193 G 4.3880 9.2060 110.2544 45.1061 0.0000 174.0483 194 D 4.6650 8.2565 118.5292 55.2838 41.6176 176.5940 195 S 4.4195 8.0939 115.3731 60.5364 63.1929 175.5680 196 G 4.0096 8.7279 112.9049 46.2863 0.0000 173.5453 197 G 4.3629 7.8824 107.7958 44.7152 0.0000 171.1796 198 P 5.1278 0.0000 0.0000 62.2949 33.5094 175.6961 199 V 4.5092 8.5836 121.7065 61.4458 33.8590 174.0292 200 V 4.8070 8.8675 129.2231 61.2922 33.9900 173.7774 201 C 5.0128 8.6924 124.5180 55.4804 43.8949 174.6097 202 S 3.3171 9.7067 121.0880 59.7848 59.9382 173.3393 203 G 3.9295 8.4342 104.6029 45.6280 0.0000 173.7350 204 K 4.7145 7.4822 117.7405 52.9761 35.4399 175.5550 *209 L 4.2671 8.2539 122.3338 55.4985 42.0168 175.9441 210 Q 4.5634 8.6617 125.6383 56.3348 30.8494 175.8487 211 G 5.2748 8.0279 104.8035 45.6508 0.0000 171.4579 212 I 5.2594 8.2162 120.2581 58.7868 41.1691 175.0406 213 V 3.7410 8.8403 127.1351 64.2448 31.8157 174.2137 214 S 4.8158 8.4971 120.5660 58.6315 64.4645 174.2326 215 W 4.9074 7.2849 114.2556 56.2347 31.8798 172.0407 216 G 3.7324 8.0371 105.0490 47.0843 0.0000 171.9170 217 S 4.7767 8.0687 116.7521 56.8510 64.0853 173.5432 *219 G 4.4536 8.1030 115.4872 45.5883 0.0000 171.2749 220 C 4.9169 8.0717 115.6152 56.3945 43.6991 173.9627 221 A 3.9581 9.2250 125.4850 53.1908 16.5168 177.1603 221A Q 4.4815 7.5156 120.2295 56.9410 29.6341 176.7954 222 K 4.2150 8.4621 122.5842 56.1461 32.1591 176.7493 223 N 4.3448 9.4772 120.2121 53.4573 36.8619 175.5942 224 K 4.3007 7.5923 115.9764 54.0729 32.6391 173.8591 225 P 4.6493 0.0000 0.0000 61.8167 33.3285 177.4162 226 G 3.6157 8.4632 106.4397 46.1320 0.0000 172.7518 227 V 4.3620 7.7643 121.8872 60.6351 34.1951 174.0557 228 Y 4.9722 8.2154 124.5306 55.8752 41.8751 175.1315 229 T 4.3603 8.5309 120.3617 64.0420 69.9523 173.7795 230 K 5.0098 9.2272 128.7387 55.0350 31.3358 177.0017 231 V 3.9977 9.1354 127.4758 65.5164 31.9376 175.9459 232 C 4.3078 8.3489 113.4366 58.3066 41.4474 174.5501 233 N 4.0857 8.1171 116.5378 55.0866 38.3356 175.1332 234 Y 4.8270 8.0869 115.2881 57.5853 39.0259 177.6205 235 V 3.7104 7.9936 121.5885 66.1576 31.4789 178.0757 236 S 4.1091 8.0897 114.3910 61.3913 62.7329 176.1550 237 W 4.2097 8.3804 130.5270 60.6287 30.3910 177.9048 238 I 3.0275 8.2512 120.0060 64.1904 36.4602 178.6608 239 K 3.8081 8.1791 119.5625 59.3747 31.5811 179.5663 240 Q 3.9049 7.9725 117.9760 58.9535 29.0259 178.5411 241 T 3.7239 7.5458 117.1926 66.4548 67.9812 176.9998 242 I 2.5697 7.0832 114.7389 63.4180 37.1086 177.9313 243 A 4.0555 7.4249 121.0574 53.8249 18.2456 178.6136 244 S 4.6701 7.3480 111.3342 58.3402 63.4285 173.9987 245 N 4.6743 7.9347 124.7576 53.6248 39.5823 174.1168 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 16 I 7.88 4.20 1.78 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 1.47 0.96 0.85 0.00 0.00 17 V 8.73 4.30 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 1.03 0.00 0.00 0.97 0.00 0.00 18 G 8.59 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 0.00 0.00 0.00 19 G 7.68 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 0.00 0.00 0.00 0.00 20 Y 7.66 4.97 0.00 2.98 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.59 4.17 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 1.25 0.00 0.00 22 C 8.74 4.28 0.00 2.74 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 23 G 8.41 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 0.00 0.00 0.00 24 A 8.43 4.29 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 25 N 8.95 4.27 0.00 2.87 2.91 0.00 0.00 7.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.74 4.11 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 1.22 0.00 0.00 27 V 7.07 4.05 1.73 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 0.25 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.51 0.00 2.28 2.37 0.00 3.60 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.97 0.00 29 Y 6.91 5.23 0.00 3.15 3.39 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 30 Q 7.50 4.60 0.00 1.83 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.73 0.00 0.00 0.00 0.00 0.00 1.87 2.47 0.00 31 V 8.99 4.88 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 1.03 0.00 0.00 0.99 0.00 0.00 32 S 8.85 5.09 0.00 3.29 3.25 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 33 L 8.73 4.70 0.00 0.32 1.12 0.75 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.24 5.92 0.00 2.44 2.50 0.00 0.00 6.78 7.29 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 *37 S 8.42 4.14 0.00 3.68 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.42 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 0.00 0.00 0.00 39 Y 6.57 4.63 0.00 3.07 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 40 H 8.86 4.61 0.00 2.90 3.19 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.09 5.08 0.00 3.13 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 42 C 6.93 4.80 0.00 2.04 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 43 G 9.02 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.34 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 9.01 5.42 0.00 3.80 3.83 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 46 L 9.22 4.62 0.00 1.87 1.68 1.08 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.48 4.61 1.90 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 1.56 0.92 0.95 0.00 0.00 48 N 7.52 4.66 0.00 2.98 3.00 0.00 0.00 6.02 8.03 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 49 S 8.61 4.28 0.00 4.23 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 0.00 50 Q 8.87 4.50 0.00 2.31 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.80 0.00 0.00 0.00 0.00 0.00 2.22 2.32 0.00 51 W 8.18 5.60 0.00 3.29 3.01 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 52 V 9.15 5.01 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 1.14 0.00 0.00 0.99 0.00 0.00 53 V 8.90 4.82 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 1.04 0.00 0.00 1.01 0.00 0.00 54 S 8.81 4.89 0.00 3.94 3.71 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 55 A 8.76 4.58 1.21 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 0.00 0.00 56 A 8.48 3.76 0.11 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 57 H 8.56 4.50 0.00 3.37 3.60 0.00 5.56 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.92 4.68 0.00 3.24 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 59 Y 7.81 4.40 0.00 2.89 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.27 3.40 0.00 1.42 1.29 0.00 0.67 0.00 0.00 1.21 0.00 0.00 2.22 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.82 1.02 7.81 61 S 7.92 4.33 0.00 3.96 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 62 G 8.44 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.60 4.16 1.90 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.68 0.96 0.00 0.00 64 Q 8.91 4.75 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 65 V 8.76 4.35 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 1.00 0.00 0.00 0.92 0.00 0.00 66 R 8.86 5.15 0.00 1.72 1.85 0.00 2.69 0.00 0.00 2.46 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 1.26 0.00 67 L 9.04 4.74 0.00 1.67 1.62 0.99 1.05 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 *69 G 8.27 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 0.00 0.00 0.00 0.00 70 E 8.30 4.34 0.00 2.18 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 2.41 2.11 0.00 71 D 8.07 4.83 0.00 2.75 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 72 N 8.56 4.94 0.00 2.82 2.81 0.00 0.00 7.20 8.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.42 4.00 1.43 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.50 -0.45 0.00 0.00 74 N 8.58 4.74 0.00 2.82 2.89 0.00 0.00 6.64 7.69 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 75 V 7.45 4.32 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.47 4.09 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 0.79 0.00 0.00 0.98 0.00 0.00 77 E 9.20 4.45 0.00 1.98 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 2.27 2.48 0.00 78 G 8.03 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 79 N 8.14 4.87 0.00 2.77 2.80 0.00 0.00 7.15 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 80 E 7.78 4.50 0.00 1.42 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 2.40 2.43 0.00 81 Q 9.11 4.43 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 82 F 8.75 5.56 0.00 2.80 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 83 I 8.88 4.69 1.88 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 1.24 0.83 0.94 0.00 0.00 84 S 8.77 4.71 0.00 3.75 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.61 4.58 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.95 4.55 0.00 3.77 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 87 K 7.52 4.66 0.00 1.85 1.90 0.00 1.58 0.00 0.00 1.89 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.26 1.45 7.81 88 S 8.72 5.32 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 89 I 9.16 4.56 2.03 0.00 0.00 1.00 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 0.90 1.10 0.00 0.00 90 V 8.40 4.00 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 0.63 0.00 0.00 0.71 0.00 0.00 91 H 8.66 3.59 0.00 2.87 3.04 0.00 5.65 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.27 0.00 2.17 2.18 0.00 2.42 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.94 0.00 93 S 7.84 4.65 0.00 3.93 3.92 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 94 Y 7.96 4.30 0.00 2.96 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 95 N 8.30 4.55 0.00 2.58 2.45 0.00 0.00 6.61 7.41 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 96 S 7.79 3.84 0.00 3.94 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 97 N 8.38 4.37 0.00 2.75 2.79 0.00 0.00 6.86 7.86 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 98 T 7.68 4.07 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 1.09 0.00 0.00 99 L 8.06 4.24 0.00 1.48 1.85 0.77 0.97 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 0.00 100 N 7.42 4.35 0.00 2.64 2.67 0.00 0.00 7.25 6.59 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 0.00 101 N 8.72 4.83 0.00 2.97 2.70 0.00 0.00 7.22 8.06 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 0.00 102 D 7.66 4.72 0.00 3.22 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 0.00 103 I 7.12 4.86 1.50 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 1.49 1.23 0.04 0.00 0.00 104 M 9.14 5.47 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.60 0.00 105 L 9.11 5.45 0.00 1.73 1.93 0.10 0.78 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 0.00 106 I 8.96 5.07 1.93 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 1.22 0.98 0.91 0.00 0.00 107 K 8.53 3.92 0.00 0.79 1.12 0.00 1.07 0.00 0.00 1.30 0.00 0.00 2.59 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.70 0.21 7.81 108 L 7.89 4.42 0.00 1.48 1.60 0.93 0.72 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 0.00 109 K 9.00 4.13 0.00 1.92 1.80 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.35 7.81 110 S 7.75 4.63 0.00 3.93 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 0.00 111 A 8.48 4.32 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.69 4.06 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.96 4.51 0.00 3.88 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 0.00 114 L 8.47 4.47 0.00 1.70 1.61 0.96 1.13 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 0.00 115 N 8.54 4.75 0.00 2.91 2.92 0.00 0.00 6.60 6.97 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 0.00 116 S 8.69 4.30 0.00 4.01 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 0.00 117 R 8.58 4.40 0.00 1.96 1.99 0.00 3.07 0.00 0.00 3.10 7.27 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.41 0.00 4.00 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 0.00 128 C 8.45 4.41 0.00 2.93 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 0.00 129 A 7.89 4.52 1.05 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 0.00 130 S 8.02 4.33 0.00 3.84 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 *132 A 8.25 4.18 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 0.00 133 G 9.06 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 0.00 134 T 7.56 4.02 4.19 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 1.15 0.00 0.00 135 Q 8.58 4.51 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 136 C 9.31 5.24 0.00 2.79 3.02 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 0.00 137 L 8.83 5.20 0.00 1.78 1.57 1.00 1.35 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 0.00 138 I 8.95 5.37 1.86 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 0.72 1.54 0.94 0.00 0.00 139 S 8.56 4.88 0.00 3.60 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 0.00 140 G 7.37 3.83 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 0.00 0.00 0.00 141 W 8.48 4.75 0.00 3.24 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.69 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 0.00 0.00 0.00 143 N 7.92 3.66 0.00 1.82 2.47 0.00 0.00 7.12 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.31 4.75 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 1.20 0.00 0.00 145 K 7.94 4.64 0.00 1.77 1.60 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 0.96 7.81 146 S 8.56 4.46 0.00 4.22 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 0.00 147 S 8.17 4.46 0.00 3.83 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 0.00 148 G 9.66 3.86 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 0.00 0.00 0.00 149 T 8.03 4.84 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 150 S 9.69 4.60 0.00 3.83 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.85 4.88 0.00 2.92 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.69 0.00 2.43 2.07 0.00 4.05 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.00 0.00 153 D 8.61 4.93 0.00 2.68 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 0.00 154 V 7.74 5.06 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 0.94 0.00 0.00 0.97 0.00 0.00 155 L 8.38 3.29 0.00 1.27 1.21 -0.74 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.10 4.92 0.00 1.68 1.49 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.45 7.81 157 C 8.39 5.28 0.00 1.70 2.29 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 0.00 158 L 8.83 5.03 0.00 1.66 1.45 1.04 0.96 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 0.00 159 K 9.01 5.02 0.00 1.82 1.84 0.00 1.86 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.56 7.81 160 A 9.15 4.72 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 4.98 0.00 2.02 2.09 0.00 3.06 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 1.82 1.74 0.00 162 I 8.44 4.31 1.90 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.53 0.75 0.00 0.00 163 L 8.64 4.79 0.00 1.57 1.60 0.93 0.76 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 0.00 164 S 8.56 4.29 0.00 4.01 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 0.00 165 D 8.79 4.44 0.00 2.77 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 0.00 166 S 8.05 4.21 0.00 4.06 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 0.00 167 S 7.98 4.15 0.00 4.02 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 0.00 168 C 8.22 4.27 0.00 3.24 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.29 4.02 0.00 1.78 1.91 0.00 1.91 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.55 7.81 170 S 8.11 4.26 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 0.00 171 A 7.77 4.03 1.05 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 0.00 172 Y 7.64 4.88 0.00 3.10 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 0.00 173 P 0.00 4.54 0.00 2.09 2.03 0.00 3.87 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 2.05 2.21 0.00 174 G 9.02 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 0.00 175 Q 8.16 4.57 0.00 2.47 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.60 6.57 0.00 0.00 0.00 0.00 0.00 2.25 2.55 0.00 176 I 7.88 4.49 1.98 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.93 1.00 0.00 0.00 177 T 8.18 4.63 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 1.29 0.00 0.00 178 S 8.56 4.31 0.00 4.01 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 0.00 179 N 7.94 4.94 0.00 3.11 3.09 0.00 0.00 6.60 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.94 5.60 0.00 1.85 1.99 0.00 0.00 0.00 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.61 0.00 181 F 8.66 5.13 0.00 3.03 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 0.00 182 C 9.20 5.85 0.00 2.98 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 0.00 183 A 9.05 5.05 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 7.36 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 0.00 0.00 0.00 184A Y 8.45 4.69 0.00 2.97 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.81 4.17 0.00 1.74 1.72 0.92 1.00 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 0.00 186 E 8.21 3.75 0.00 1.99 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 2.23 1.87 0.00 187 G 7.55 3.83 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 0.00 0.00 0.00 188 G 9.34 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 188A K 7.41 5.16 0.00 1.52 1.73 0.00 1.52 0.00 0.00 1.77 0.00 0.00 2.52 0.00 0.00 2.61 0.00 0.00 0.00 0.00 1.36 1.23 7.81 189 D 8.90 4.69 0.00 2.79 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.14 4.84 0.00 4.14 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 0.00 191 C 9.13 4.70 0.00 2.95 3.02 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 0.00 192 Q 8.52 4.46 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.24 0.00 0.00 0.00 0.00 0.00 2.37 1.95 0.00 193 G 9.21 4.39 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 0.00 194 D 8.26 4.66 0.00 2.96 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 8.09 4.42 0.00 3.99 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 0.00 196 G 8.73 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 0.00 197 G 7.88 4.36 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 0.00 198 P 0.00 5.13 0.00 2.33 2.37 0.00 3.77 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 2.20 2.24 0.00 199 V 8.58 4.51 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 0.83 0.00 0.00 0.54 0.00 0.00 200 V 8.87 4.81 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 0.96 0.00 0.00 0.59 0.00 0.00 201 C 8.69 5.01 0.00 2.79 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 0.00 202 S 9.71 3.32 0.00 3.96 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 0.00 203 G 8.43 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 0.00 0.00 0.00 204 K 7.48 4.71 0.00 1.72 1.65 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.25 4.27 0.00 1.51 1.64 0.96 0.75 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 0.00 210 Q 8.66 4.56 0.00 2.01 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.43 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 211 G 8.03 5.27 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 0.00 212 I 8.22 5.26 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.80 0.99 0.00 0.00 213 V 8.84 3.74 2.39 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 0.95 0.00 0.00 1.17 0.00 0.00 214 S 8.50 4.82 0.00 4.02 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.28 4.91 0.00 3.30 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.04 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 0.00 217 S 8.07 4.78 0.00 4.06 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 *219 G 8.10 4.45 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 0.00 0.00 0.00 220 C 8.07 4.92 0.00 2.94 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 0.00 221 A 9.23 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.52 4.48 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.93 0.00 0.00 0.00 0.00 0.00 2.40 2.47 0.00 222 K 8.46 4.22 0.00 1.77 1.61 0.00 1.96 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.04 7.81 223 N 9.48 4.34 0.00 2.77 2.85 0.00 0.00 6.77 6.11 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 0.00 224 K 7.59 4.30 0.00 1.65 1.76 0.00 1.73 0.00 0.00 1.29 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.49 7.81 225 P 0.00 4.65 0.00 2.12 2.10 0.00 3.65 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 2.05 1.98 0.00 226 G 8.46 3.62 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 0.00 0.00 0.00 227 V 7.76 4.36 0.67 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 0.31 0.00 0.00 -0.77 0.00 0.00 228 Y 8.22 4.97 0.00 1.43 2.32 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 0.00 229 T 8.53 4.36 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 1.21 0.00 0.00 230 K 9.23 5.01 0.00 2.21 1.95 0.00 1.82 0.00 0.00 1.86 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.55 7.81 231 V 9.14 4.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.10 0.00 0.00 232 C 8.35 4.31 0.00 3.12 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.12 4.09 0.00 2.21 2.37 0.00 0.00 6.84 7.62 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 0.00 234 Y 8.09 4.83 0.00 3.26 3.25 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 0.00 235 V 7.99 3.71 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.08 0.00 0.00 236 S 8.09 4.11 0.00 3.98 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 0.00 237 W 8.38 4.21 0.00 3.51 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 0.00 238 I 8.25 3.03 1.96 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.97 0.73 0.00 0.00 239 K 8.18 3.81 0.00 1.71 1.77 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.58 7.81 240 Q 7.97 3.90 0.00 1.88 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.53 0.00 241 T 7.55 3.72 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 0.75 0.00 0.00 242 I 7.08 2.57 0.62 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.47 -0.43 0.00 0.00 243 A 7.42 4.06 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 0.00 244 S 7.35 4.67 0.00 3.81 3.86 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 0.00 245 N 7.93 4.67 0.00 2.98 2.94 0.00 0.00 6.75 7.44 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 * Residues marked with a * may have inaccurate shift predictions.