NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3133 8.2931 120.3581 56.6133 33.4045 175.7581 2 G 3.9726 8.7439 109.7399 43.0435 0.0000 170.7573 3 P 4.5457 0.0000 0.0000 62.0867 33.3509 173.9439 4 N 4.6611 8.7415 118.4627 52.4031 39.0294 173.9813 5 P 3.8386 0.0000 0.0000 64.5800 31.4175 176.8311 6 M 4.2478 8.8034 118.4537 56.2287 32.5074 176.7405 7 K 4.2220 7.8915 119.4982 56.3706 32.9556 177.0681 8 M 4.0885 8.9377 123.7559 57.9110 32.4906 175.1642 9 Y 4.6474 7.5368 118.0973 54.6210 38.2883 173.9268 10 P 3.9002 0.0000 0.0000 65.0444 31.4355 177.3143 11 I 3.9957 6.7709 118.1928 59.2371 36.6463 175.1302 12 E 3.6518 8.8343 126.3810 57.7763 30.1212 177.1328 13 G 3.6694 8.6693 114.7464 44.9604 0.0000 174.1781 14 N 4.1894 7.2880 108.7111 53.6270 40.6303 173.0284 15 K 4.2472 8.6035 124.7389 56.5765 32.7374 178.1345 16 S 4.5345 8.7712 117.7129 60.9163 64.0599 174.4753 17 V 4.6454 7.9317 118.3478 62.3909 32.1738 174.9581 18 Q 4.6872 9.2518 125.9862 54.0574 33.6609 174.2922 19 F 5.2544 8.4717 121.1457 56.9620 39.5965 176.9199 20 I 3.7562 8.5611 126.2369 64.5541 37.2110 177.7083 21 K 3.7975 8.1494 119.7746 59.5057 31.6811 176.4661 22 P 4.2413 0.0000 0.0000 66.2002 31.0013 178.3950 23 I 3.8450 7.3433 117.1683 62.9026 37.0718 176.7789 24 L 4.6504 7.5023 118.2931 54.1959 42.1163 177.6200 25 E 3.9539 7.9266 122.3811 59.1190 29.6326 178.5483 26 K 4.1229 7.9776 116.8441 59.4587 33.0019 177.5887 27 L 4.1547 7.4679 118.0533 54.4184 42.1241 175.7182 28 E 4.5650 8.3348 121.0173 55.6719 31.6517 174.9853 29 N 4.2763 8.7203 119.2576 54.4418 36.0558 173.6411 30 V 4.9686 7.8233 116.2614 61.1893 34.6355 174.1832 31 E 4.7593 9.4124 126.9886 54.5694 32.8092 175.0449 32 V 4.8527 8.3283 123.2494 60.8801 34.6193 175.2191 33 G 3.9878 8.7855 113.6714 45.1288 0.0000 174.5689 34 E 3.4157 8.7195 120.4911 59.1012 29.4006 178.1711 35 Y 3.6800 6.9449 111.7026 57.1803 38.5948 175.8387 36 S 4.7231 7.2501 117.9847 59.0786 64.0195 173.0477 37 Y 5.4302 8.8222 121.2215 55.6139 41.9775 173.2923 38 Y 4.9550 9.3816 121.0345 55.8919 42.4821 174.0668 39 D 4.8962 7.6516 125.2643 51.9153 42.2594 174.6149 40 S 4.1535 8.2738 120.0349 58.7513 62.4851 174.1468 41 K 4.1340 9.1765 128.8048 59.2224 32.1526 177.8726 42 N 5.0014 9.1076 113.3492 52.9833 39.8765 175.5839 43 G 4.0955 8.6150 108.7852 45.0392 0.0000 174.8323 44 E 4.1953 7.8919 117.2500 56.4809 30.3951 176.6622 45 T 4.6494 8.2291 110.4164 60.7911 70.4001 175.6352 46 F 3.7829 8.7577 124.8742 61.0562 39.3651 177.2264 47 D 4.1771 8.0568 118.3262 55.9457 38.8880 177.8755 48 K 4.1432 7.6910 118.0350 57.6648 32.5152 177.9432 49 Q 4.2290 7.6730 118.3300 54.8661 28.7722 174.7490 50 I 4.3627 6.3254 120.7323 59.5699 38.1183 175.0983 51 L 4.2625 8.4883 125.8463 53.5280 44.3821 175.6953 52 Y 3.1324 7.1224 115.1372 59.4446 35.3626 171.5159 53 H 4.8295 7.4217 118.6337 54.6588 30.1748 172.1189 54 Y 4.8390 7.6601 124.4369 55.2650 39.9391 175.1166 55 P 4.3060 0.0000 0.0000 65.8696 31.8515 178.3112 56 I 3.6956 8.1445 117.5322 64.6129 36.9272 177.3483 57 L 3.9996 8.2548 119.4513 55.8558 41.5621 178.1196 58 N 4.3907 8.5067 115.4606 54.0081 37.9337 173.3371 59 D 4.8930 7.4247 115.6358 52.7840 40.7854 175.7284 60 K 4.9629 9.8845 119.4696 54.5999 36.4791 174.6257 61 L 5.0946 8.5747 124.3800 53.3050 44.5318 175.1229 62 K 5.0758 8.9041 125.5952 54.6362 35.3266 175.1658 63 I 4.7669 9.1233 125.8938 59.4654 40.6186 176.5130 64 G 3.5766 8.5635 116.2787 46.1144 0.0000 172.4374 65 K 4.5241 8.8478 119.7120 54.7767 35.0465 176.5196 66 F 4.0244 7.8094 117.2292 59.1085 36.7552 174.8025 67 C 5.0341 7.8050 116.2656 58.5312 31.1818 174.6016 68 S 4.2938 8.9266 118.1324 56.9450 64.9146 173.2193 69 I 4.5100 7.6927 127.3809 59.3895 38.5756 176.4765 70 G 4.2927 9.2523 115.7964 44.9063 0.0000 170.7622 71 P 4.6714 0.0000 0.0000 63.3469 31.7595 177.6561 72 G 4.1949 8.9715 108.6344 46.1728 0.0000 173.8611 73 V 4.0195 7.4965 119.3935 63.5363 32.3573 175.3464 74 T 4.7272 9.1374 124.1462 61.7894 71.8650 172.8391 75 I 4.7100 8.4537 127.3510 59.7172 39.3947 174.6440 76 I 4.5660 8.4605 129.3089 60.4851 38.1386 176.0444 77 M 4.4927 8.4663 128.3638 54.1818 34.1794 175.8532 78 N 4.5003 9.1622 115.5097 55.5161 38.8940 177.3191 79 G 3.8939 8.1349 105.8856 46.8563 0.0000 173.8258 80 A 4.2315 7.5000 121.1456 51.6813 20.1869 177.1151 81 N 4.4284 7.9567 114.2516 53.4171 39.0537 174.7110 82 H 4.7632 8.3842 119.2915 53.9945 30.9738 174.6214 83 R 4.2040 8.1641 120.7203 56.7366 30.2163 176.3139 84 M 4.9276 8.4875 121.7840 55.0484 33.4329 176.3963 85 D 4.5937 8.2359 117.6159 54.2949 41.1456 176.4469 86 G 3.8536 7.0040 113.2496 44.8688 0.0000 174.7020 87 S 4.3051 8.7881 120.0348 58.4646 62.7490 173.7561 88 T 4.8363 8.2647 114.0039 60.9511 69.2739 174.1578 89 Y 4.0826 8.0947 125.4691 57.2255 39.5931 174.7989 90 P 4.5100 0.0000 0.0000 60.9346 30.5020 176.0016 91 F 4.2748 8.2120 125.2199 61.7442 39.2283 176.5653 92 N 4.5253 8.6338 115.8420 56.4387 36.4203 176.5163 93 L 3.8467 7.7344 121.5194 57.6392 42.1698 178.1447 94 F 4.4629 8.7727 115.4331 57.9673 39.8572 178.1000 95 G 3.6391 9.0853 108.5742 44.9832 0.0000 174.4975 96 N 4.1423 10.0560 111.9222 54.3920 35.9671 174.7762 97 G 4.1566 9.3849 106.9087 45.3109 0.0000 174.9872 98 W 4.8044 8.5077 119.4905 58.9670 29.7605 178.2082 99 E 4.2024 8.6783 118.3498 59.2121 29.0218 179.1792 100 K 3.9088 8.1820 116.7166 59.9975 32.4403 176.8062 101 H 4.6624 8.1706 116.0265 55.8520 28.4927 174.7137 102 M 4.2092 7.9119 120.6029 54.5181 32.4598 174.5815 103 P 4.5277 0.0000 0.0000 62.7200 32.1910 175.7093 104 K 4.4625 9.0946 121.1387 55.3957 33.5892 178.3437 105 L 4.1645 8.4275 124.4134 58.0024 41.7197 179.2018 106 D 4.4593 8.0249 115.4604 55.3572 39.3590 176.9516 107 Q 4.2037 8.9077 119.4912 57.2211 29.2740 175.8829 108 L 4.4133 7.7258 118.8356 52.6648 42.5579 175.0429 109 P 4.3185 0.0000 0.0000 63.4725 31.6932 176.7974 110 I 4.3123 7.6978 118.0114 60.9296 38.8029 175.2699 111 K 4.0537 8.7491 124.9042 57.1077 32.1585 176.9460 112 G 3.8577 7.4224 104.4086 43.8547 0.0000 172.9569 113 D 4.7471 8.4968 117.3608 54.3818 42.6701 175.7323 114 T 4.7775 8.5108 118.3322 62.3987 70.7183 173.9845 115 I 4.8911 8.9942 126.5830 59.6998 41.0239 174.2365 116 I 4.4463 8.8807 129.0760 59.3748 39.0734 177.2279 117 G 4.0106 8.7173 116.5330 46.2196 0.0000 172.0382 118 N 4.6210 8.7285 117.6063 51.5851 41.1515 174.7377 119 D 5.2196 8.2735 118.3223 54.3288 40.5824 172.9200 120 V 4.3616 7.4425 116.2573 61.0223 33.8366 173.9509 121 W 5.2380 9.0246 135.0000 56.0294 32.6906 174.4064 122 I 4.4904 8.9733 129.7357 59.2208 38.6986 176.2425 123 G 3.9086 8.6350 115.5383 45.3007 0.0000 172.5164 124 K 4.1776 8.6770 120.5545 57.4769 33.4137 176.1259 125 D 4.7543 8.9815 124.1478 55.0623 39.4944 173.5881 126 V 4.0645 7.5972 117.6946 62.8480 33.2136 174.5761 127 V 4.7482 8.8468 127.2724 61.2433 33.9929 174.1346 128 I 4.6222 8.8911 129.6289 59.8182 38.7799 175.7287 129 M 4.7657 8.4173 127.5337 54.1143 33.0449 174.5981 130 P 4.2160 0.0000 0.0000 63.1643 32.2497 177.0357 131 G 3.9948 7.9734 109.4154 45.3990 0.0000 173.4600 132 V 4.4506 7.4225 118.7510 60.9497 33.9703 174.3353 133 K 5.0139 9.2266 127.5073 54.6416 35.3389 174.5990 134 I 4.6705 9.1623 129.1564 59.1476 39.3051 175.6422 135 G 3.9715 9.1264 115.5746 46.0001 0.0000 172.0972 136 D 4.1754 8.6408 120.9013 55.1362 42.1993 177.7867 137 G 2.8271 8.4930 107.9841 44.9542 0.0000 173.6572 138 A 4.6755 7.1239 121.8230 51.6390 20.2938 177.0052 139 I 4.8601 8.5894 119.5786 59.5533 41.0693 174.7498 140 V 4.5921 8.5265 127.6831 60.6894 33.5931 174.9994 141 A 4.1504 8.5244 129.9582 51.2529 19.4935 176.7386 142 A 4.0262 8.3491 123.1833 53.9959 18.8427 177.2601 143 N 4.2855 9.3750 117.7582 54.3714 36.8593 174.8489 144 S 4.7540 7.3553 112.9343 57.7160 65.3390 173.8252 145 V 4.2348 8.5242 122.1985 61.1569 33.6970 174.8836 146 V 4.2357 8.6495 129.9996 62.6463 31.4793 176.3860 147 V 4.3785 8.5392 121.4889 61.3971 33.3411 175.6330 148 K 4.7585 7.7472 117.5343 54.4537 36.0943 175.7314 149 D 4.7259 8.7326 119.7774 54.8035 41.8036 176.3786 150 I 4.6966 8.5647 122.2163 59.1552 39.9097 175.3509 151 A 4.4118 9.5941 129.7617 51.2295 19.1304 175.3306 152 P 4.2347 0.0000 0.0000 63.4918 32.4839 176.0407 153 Y 4.1770 8.5194 119.1898 58.6580 36.3541 169.8875 154 M 5.1515 7.7949 116.4958 53.5263 35.9891 174.9700 155 L 4.9874 9.2178 124.0331 53.5805 44.1667 175.1963 156 A 5.1738 8.4440 127.1111 50.4340 23.2783 174.4801 157 G 4.3383 8.7418 105.0279 46.3530 0.0000 172.8564 158 G 4.0990 9.1039 105.5370 44.1825 0.0000 171.9900 159 N 5.0877 8.0355 116.7562 51.1758 40.5531 172.3054 160 P 4.7499 0.0000 0.0000 62.0623 32.5591 176.1827 161 A 4.3304 8.7909 124.8251 52.5265 19.0435 176.7027 162 N 5.0821 8.9236 118.2752 51.0749 43.1612 173.7650 163 E 4.2936 8.7258 121.2906 56.8465 29.4366 176.7469 164 I 4.1059 9.0379 127.1296 63.4977 38.2796 176.4352 165 K 4.4746 7.5347 119.8997 55.2452 35.5628 174.1160 166 Q 4.4338 8.5978 127.5086 55.7501 29.2612 175.6393 167 R 3.8929 8.8147 126.5258 58.8195 30.4806 176.4395 168 F 5.0990 7.5789 113.8592 54.7920 42.9665 174.5753 169 D 4.7197 8.4482 120.9288 52.9854 41.5175 176.6488 170 Q 3.9918 8.7349 121.0985 60.0197 28.8596 178.9418 171 D 4.3849 8.2562 119.0416 57.5157 40.8177 178.9160 172 T 3.8090 7.8160 115.9567 66.4068 68.4020 176.6598 173 I 3.4265 7.6818 121.6584 64.4635 37.1460 178.1892 174 N 4.3638 8.2722 117.2278 56.4406 38.2841 177.5151 175 Q 3.9675 8.0731 119.3631 59.0026 28.9497 178.8553 176 L 3.9467 7.9296 119.9746 57.8138 41.3859 179.6464 177 L 4.2846 8.0619 118.3369 57.6772 41.5904 178.8363 178 D 4.5373 8.0044 118.4188 56.9618 40.9524 178.5844 179 I 3.8165 7.9584 120.0644 62.8666 38.7550 176.5604 180 K 2.0000 7.2145 116.9249 56.3788 29.6915 175.8555 181 W 2.0000 5.7007 116.4532 57.5305 28.6341 178.9122 182 W 3.9332 5.3619 114.6225 57.9369 27.7531 176.2201 183 N 4.9012 7.0852 115.6763 52.8783 38.4371 175.1692 184 W 4.8038 7.7187 119.3119 55.2467 30.0424 175.0996 185 P 4.5104 0.0000 0.0000 63.2199 32.5210 177.2413 186 I 3.8291 8.6611 119.5572 64.4378 37.3430 177.6079 187 D 4.4531 8.3513 119.3818 57.9400 40.4598 179.2160 188 I 3.7900 7.7264 117.7866 64.1702 37.3588 178.1740 189 I 4.1688 7.7388 120.9679 64.6217 36.7778 178.0641 190 N 4.3087 8.6405 116.3931 56.2400 38.4714 176.4067 191 E 4.3891 7.7077 116.1868 56.9007 30.0428 176.5972 192 N 5.0109 8.1217 115.4858 52.0515 40.7271 175.8906 193 I 3.3974 7.9298 121.6254 64.9442 36.8585 177.6630 194 D 4.3258 7.8989 118.8337 57.0262 40.8979 178.6771 195 K 4.4474 7.7468 119.8557 58.5324 31.9937 179.3043 196 I 3.4145 7.7281 120.5630 63.9707 36.6143 178.3678 197 L 3.8877 7.5137 119.4561 56.4857 41.5148 178.0238 198 D 4.7599 7.5069 115.8989 52.5352 40.2927 176.7712 199 N 4.3337 7.6885 116.9662 54.1867 36.8826 175.7858 200 S 4.3109 9.1793 115.2191 60.0596 63.0327 175.9115 201 I 3.6921 7.5566 122.8938 64.0365 37.6525 177.7030 202 I 3.7351 7.6859 122.9361 65.0139 37.1150 179.0803 203 R 3.9492 7.9024 120.8832 61.5821 28.9851 180.3762 204 E 4.2434 7.6886 118.3988 59.2245 29.6022 179.2924 205 V 3.8640 7.9453 119.5187 65.9793 31.6642 178.4018 206 I 4.1070 7.8599 121.8459 64.0777 35.6522 180.4502 *207 W 4.4042 7.4479 123.7439 56.0657 28.8056 177.2701 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 1 M 8.29 4.31 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.58 0.00 2 G 8.74 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 3 P 0.00 4.55 0.00 2.59 2.23 0.00 3.95 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.31 0.00 4 N 8.74 4.66 0.00 2.83 2.84 0.00 0.00 6.65 7.71 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 5 P 0.00 3.84 0.00 1.57 0.71 0.00 3.81 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.70 0.00 6 M 8.80 4.25 0.00 1.99 2.33 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 2.58 2.61 0.00 7 K 7.89 4.22 0.00 2.01 1.78 0.00 1.76 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.48 7.81 8 M 8.94 4.09 0.00 1.66 2.11 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.47 0.00 9 Y 7.54 4.65 0.00 3.02 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 10 P 0.00 3.90 0.00 1.67 1.19 0.00 3.61 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.44 0.00 11 I 6.77 4.00 1.80 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.46 0.87 0.00 0.00 12 E 8.83 3.65 0.00 1.91 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 13 G 8.67 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 7.29 4.19 0.00 2.60 2.93 0.00 0.00 7.26 6.68 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 15 K 8.60 4.25 0.00 1.65 1.43 0.00 1.23 0.00 0.00 0.61 0.00 0.00 2.40 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.14 1.14 7.81 16 S 8.77 4.53 0.00 3.90 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 17 V 7.93 4.65 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 0.66 0.00 0.00 0.91 0.00 0.00 18 Q 9.25 4.69 0.00 2.02 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.69 0.00 0.00 0.00 0.00 0.00 2.11 2.55 0.00 19 F 8.47 5.25 0.00 3.09 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 20 I 8.56 3.76 1.77 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.46 0.91 0.00 0.00 21 K 8.15 3.80 0.00 1.84 1.63 0.00 1.71 0.00 0.00 1.66 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.44 7.81 22 P 0.00 4.24 0.00 2.30 2.41 0.00 3.78 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 2.28 2.27 0.00 23 I 7.34 3.84 2.02 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 1.47 0.80 0.93 0.00 0.00 24 L 7.50 4.65 0.00 1.71 1.64 1.06 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 25 E 7.93 3.95 0.00 1.87 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 2.32 2.25 0.00 26 K 7.98 4.12 0.00 1.90 1.93 0.00 1.63 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.45 7.81 27 L 7.47 4.15 0.00 1.61 1.63 0.86 1.27 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 28 E 8.33 4.57 0.00 1.89 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 29 N 8.72 4.28 0.00 2.98 3.05 0.00 0.00 6.40 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 30 V 7.82 4.97 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 0.81 0.00 0.00 0.94 0.00 0.00 31 E 9.41 4.76 0.00 1.86 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 2.19 2.20 0.00 32 V 8.33 4.85 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 0.75 0.00 0.00 0.93 0.00 0.00 33 G 8.79 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 34 E 8.72 3.42 0.00 1.18 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 2.20 2.24 0.00 35 Y 6.94 3.68 0.00 1.84 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 7.25 4.72 0.00 3.56 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 8.82 5.43 0.00 3.33 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 9.38 4.95 0.00 2.44 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 39 D 7.65 4.90 0.00 2.83 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.27 4.15 0.00 4.09 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 41 K 9.18 4.13 0.00 1.85 1.87 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.43 7.81 42 N 9.11 5.00 0.00 2.70 2.76 0.00 0.00 7.43 7.26 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 43 G 8.62 4.10 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 44 E 7.89 4.20 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 45 T 8.23 4.65 4.41 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 1.33 0.00 0.00 46 F 8.76 3.78 0.00 2.78 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 47 D 8.06 4.18 0.00 2.90 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 48 K 7.69 4.14 0.00 1.76 1.82 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.64 7.81 49 Q 7.67 4.23 0.00 1.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.79 0.00 0.00 0.00 0.00 0.00 2.01 2.23 0.00 50 I 6.33 4.36 1.60 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 -0.14 0.70 0.00 0.00 51 L 8.49 4.26 0.00 1.27 0.56 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 7.12 3.13 0.00 3.00 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 53 H 7.42 4.83 0.00 2.88 3.05 0.00 5.70 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Y 7.66 4.84 0.00 3.09 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 55 P 0.00 4.31 0.00 2.17 2.11 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 56 I 8.14 3.70 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.47 0.91 0.00 0.00 57 L 8.25 4.00 0.00 1.90 1.77 1.07 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 58 N 8.51 4.39 0.00 2.81 2.91 0.00 0.00 7.20 8.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 7.42 4.89 0.00 2.74 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 60 K 9.88 4.96 0.00 1.65 1.87 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.66 7.81 61 L 8.57 5.09 0.00 1.61 1.40 0.93 0.45 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 62 K 8.90 5.08 0.00 1.72 1.62 0.00 1.53 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.39 7.81 63 I 9.12 4.77 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 0.83 0.82 0.00 0.00 64 G 8.56 3.58 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 0.00 0.00 0.00 65 K 8.85 4.52 0.00 1.79 1.54 0.00 1.91 0.00 0.00 2.02 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.34 7.81 66 F 7.81 4.02 0.00 3.27 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 C 7.81 5.03 0.00 2.82 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 68 S 8.93 4.29 0.00 3.85 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 69 I 7.69 4.51 1.77 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.95 0.96 0.00 0.00 70 G 9.25 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 0.00 0.00 0.00 0.00 71 P 0.00 4.67 0.00 2.22 2.25 0.00 3.94 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 2.08 1.91 0.00 72 G 8.97 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 0.00 0.00 0.00 0.00 73 V 7.50 4.02 2.35 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 0.88 0.00 0.00 1.14 0.00 0.00 74 T 9.14 4.73 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 75 I 8.45 4.71 1.70 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.65 0.83 0.00 0.00 76 I 8.46 4.57 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.55 1.03 0.00 0.00 77 M 8.47 4.49 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.46 0.00 78 N 9.16 4.50 0.00 2.94 2.87 0.00 0.00 7.34 6.95 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 79 G 8.13 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 80 A 7.50 4.23 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 N 7.96 4.43 0.00 2.74 2.76 0.00 0.00 6.89 7.99 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 82 H 8.38 4.76 0.00 3.07 3.22 0.00 5.71 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.16 4.20 0.00 1.85 1.81 0.00 3.13 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.66 0.00 84 M 8.49 4.93 0.00 2.07 1.99 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.49 0.00 85 D 8.24 4.59 0.00 2.79 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 86 G 7.00 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 87 S 8.79 4.31 0.00 3.94 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.26 4.84 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 89 Y 8.09 4.08 0.00 2.72 2.50 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 90 P 0.00 4.51 0.00 2.03 1.92 0.00 2.68 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 1.74 1.75 0.00 91 F 8.21 4.27 0.00 2.90 2.60 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 92 N 8.63 4.53 0.00 3.02 3.27 0.00 0.00 5.80 6.67 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 93 L 7.73 3.85 0.00 1.43 1.36 0.73 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 94 F 8.77 4.46 0.00 3.26 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 95 G 9.09 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 0.00 0.00 0.00 96 N 10.06 4.14 0.00 2.68 2.70 0.00 0.00 7.00 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 97 G 9.38 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 98 W 8.51 4.80 0.00 3.81 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.68 4.20 0.00 2.12 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 2.45 2.48 0.00 100 K 8.18 3.91 0.00 1.80 1.94 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.97 1.18 7.81 101 H 8.17 4.66 0.00 3.27 3.28 0.00 5.66 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 M 7.91 4.21 0.00 1.99 2.17 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.50 0.00 103 P 0.00 4.53 0.00 2.07 1.97 0.00 3.71 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 2.02 2.12 0.00 104 K 9.09 4.46 0.00 1.81 1.71 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.54 7.81 105 L 8.43 4.16 0.00 1.72 1.71 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.02 4.46 0.00 2.76 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 0.00 107 Q 8.91 4.20 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 108 L 7.73 4.41 0.00 1.78 1.61 0.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.32 0.00 2.03 2.00 0.00 3.72 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.12 0.00 110 I 7.70 4.31 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 1.43 0.55 0.94 0.00 0.00 111 K 8.75 4.05 0.00 1.83 1.83 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.38 7.81 112 G 7.42 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 0.00 113 D 8.50 4.75 0.00 2.60 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 0.00 114 T 8.51 4.78 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 1.17 0.00 0.00 115 I 8.99 4.89 1.84 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 1.20 1.02 0.87 0.00 0.00 116 I 8.88 4.45 1.92 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 1.11 0.75 0.83 0.00 0.00 117 G 8.72 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 0.00 118 N 8.73 4.62 0.00 1.44 1.42 0.00 0.00 7.12 7.94 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 0.00 119 D 8.27 5.22 0.00 2.61 2.43 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 0.00 120 V 7.44 4.36 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 0.72 0.00 0.00 121 W 9.02 5.24 0.00 3.44 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 0.00 122 I 8.97 4.49 1.87 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 1.10 0.45 0.88 0.00 0.00 123 G 8.63 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 0.00 0.00 0.00 124 K 8.68 4.18 0.00 1.89 1.71 0.00 1.90 0.00 0.00 1.84 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.52 7.81 125 D 8.98 4.75 0.00 2.96 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 V 7.60 4.06 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 0.97 0.00 0.00 1.00 0.00 0.00 127 V 8.85 4.75 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 0.92 0.00 0.00 0.93 0.00 0.00 128 I 8.89 4.62 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.56 0.88 0.00 0.00 129 M 8.42 4.77 0.00 1.91 2.15 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.71 0.00 130 P 0.00 4.22 0.00 1.92 1.96 0.00 3.76 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.33 0.00 131 G 7.97 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 0.00 132 V 7.42 4.45 2.20 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 0.85 0.00 0.00 0.91 0.00 0.00 133 K 9.23 5.01 0.00 1.79 1.72 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.34 7.81 134 I 9.16 4.67 1.80 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 1.11 0.45 0.84 0.00 0.00 135 G 9.13 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 0.00 136 D 8.64 4.18 0.00 2.50 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 0.00 0.00 0.00 137 G 8.49 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 0.00 0.00 0.00 138 A 7.12 4.68 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 0.00 139 I 8.59 4.86 1.82 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.84 0.52 0.00 0.00 140 V 8.53 4.59 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 0.84 0.00 0.00 0.84 0.00 0.00 141 A 8.52 4.15 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.35 4.03 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 0.00 143 N 9.38 4.29 0.00 2.78 2.93 0.00 0.00 6.95 7.45 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 0.00 144 S 7.36 4.75 0.00 3.80 3.79 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 0.00 145 V 8.52 4.23 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 0.98 0.00 0.00 0.92 0.00 0.00 146 V 8.65 4.24 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 0.88 0.00 0.00 0.89 0.00 0.00 147 V 8.54 4.38 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 0.91 0.00 0.00 148 K 7.75 4.76 0.00 1.68 1.73 0.00 1.57 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.42 7.81 149 D 8.73 4.73 0.00 2.57 2.64 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 0.00 150 I 8.56 4.70 1.83 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 1.13 0.79 0.87 0.00 0.00 151 A 9.59 4.41 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.23 0.00 2.16 2.17 0.00 3.90 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 153 Y 8.52 4.18 0.00 3.32 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 0.00 154 M 7.79 5.15 0.00 1.90 2.09 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.64 0.00 155 L 9.22 4.99 0.00 1.67 1.57 0.83 0.76 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 0.00 156 A 8.44 5.17 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 G 8.74 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 0.00 158 G 9.10 4.10 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 0.00 159 N 8.04 5.09 0.00 2.64 2.68 0.00 0.00 6.91 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 0.00 160 P 0.00 4.75 0.00 2.10 2.02 0.00 3.81 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 161 A 8.79 4.33 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 0.00 162 N 8.92 5.08 0.00 2.59 2.65 0.00 0.00 6.83 7.27 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 0.00 163 E 8.73 4.29 0.00 1.84 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 2.30 2.32 0.00 164 I 9.04 4.11 1.97 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 1.09 0.62 0.89 0.00 0.00 165 K 7.53 4.47 0.00 1.77 1.56 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.74 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.40 7.81 166 Q 8.60 4.43 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.82 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 167 R 8.81 3.89 0.00 1.41 0.81 0.00 3.17 0.00 0.00 3.29 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 168 F 7.58 5.10 0.00 2.96 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 0.00 169 D 8.45 4.72 0.00 2.91 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 0.00 170 Q 8.73 3.99 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 171 D 8.26 4.38 0.00 2.88 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 T 7.82 3.81 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 173 I 7.68 3.43 2.09 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 1.60 0.86 1.04 0.00 0.00 174 N 8.27 4.36 0.00 2.92 2.88 0.00 0.00 7.10 7.55 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 0.00 175 Q 8.07 3.97 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 176 L 7.93 3.95 0.00 1.63 1.77 0.23 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 177 L 8.06 4.28 0.00 1.86 1.85 1.06 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 178 D 8.00 4.54 0.00 2.80 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 0.00 179 I 7.96 3.82 1.74 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 1.58 0.74 0.97 0.00 0.00 180 K 7.21 2.00 0.00 1.61 1.13 0.00 1.66 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.21 1.32 7.81 181 W 5.70 2.00 0.00 1.90 1.80 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 0.00 182 W 5.36 3.93 0.00 3.22 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 0.00 0.00 0.00 0.00 183 N 7.09 4.90 0.00 2.80 2.94 0.00 0.00 7.00 7.78 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 0.00 184 W 7.72 4.80 0.00 3.57 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 0.00 185 P 0.00 4.51 0.00 2.33 2.26 0.00 3.84 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 2.10 2.05 0.00 186 I 8.66 3.83 2.09 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 1.73 1.46 1.03 0.00 0.00 187 D 8.35 4.45 0.00 2.75 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 0.00 188 I 7.73 3.79 2.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.41 0.45 0.00 0.00 189 I 7.74 4.17 2.18 0.00 0.00 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 1.89 1.08 0.88 0.00 0.00 190 N 8.64 4.31 0.00 2.94 2.91 0.00 0.00 7.11 7.64 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 0.00 191 E 7.71 4.39 0.00 1.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 192 N 8.12 5.01 0.00 2.83 2.82 0.00 0.00 6.90 7.64 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 0.00 193 I 7.93 3.40 1.79 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 1.48 0.80 0.79 0.00 0.00 194 D 7.90 4.33 0.00 2.63 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 0.00 195 K 7.75 4.45 0.00 1.86 1.88 0.00 2.07 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.34 7.81 196 I 7.73 3.41 1.49 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.39 -0.62 0.00 0.00 197 L 7.51 3.89 0.00 1.72 1.66 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 198 D 7.51 4.76 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 0.00 199 N 7.69 4.33 0.00 3.04 2.85 0.00 0.00 6.73 6.95 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 0.00 200 S 9.18 4.31 0.00 3.94 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 0.00 201 I 7.56 3.69 1.82 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 1.71 1.50 0.83 0.00 0.00 202 I 7.69 3.74 1.77 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.50 0.83 0.00 0.00 203 R 7.90 3.95 0.00 1.81 1.94 0.00 3.25 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.30 0.00 204 E 7.69 4.24 0.00 1.91 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 2.49 2.44 0.00 205 V 7.95 3.86 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 0.90 0.00 0.00 1.15 0.00 0.00 206 I 7.86 4.11 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.91 0.00 0.00 *207 W 7.45 4.40 0.00 2.58 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.