NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4012 8.2893 120.3471 55.2622 33.4264 174.5228 2 R 4.4493 8.2548 120.6909 55.2783 31.0453 174.2207 3 S 4.7310 9.8905 118.0704 56.8199 67.8228 174.1244 4 I 4.4789 8.4736 124.9295 59.8585 39.1793 174.1388 5 Y 4.8750 9.0108 126.1203 56.6601 39.6656 174.7432 6 L 5.3625 8.9203 124.7208 53.1424 45.1541 175.4430 7 C 5.0139 8.8092 116.5310 56.8027 33.7254 176.2722 8 R 4.8559 7.9832 117.4290 55.4361 28.4142 179.8700 *10 G 3.7699 8.5684 114.4642 46.2574 0.0000 170.3656 11 E 4.0950 8.8162 120.4985 56.9974 30.6062 176.7671 12 S 4.9741 9.1725 121.9499 57.4271 65.2461 175.3534 13 E 3.9893 8.8375 120.0628 59.6381 29.0124 179.8571 14 L 4.0794 7.7280 118.4516 57.5453 41.5783 179.3368 15 N 4.3351 8.0069 116.7122 56.2419 38.2745 177.1815 16 L 4.0254 7.6824 120.2760 57.7386 42.2664 178.3491 17 R 4.3252 7.6835 115.2285 55.4829 30.4720 176.4461 18 G 3.8926 7.9474 106.8383 46.8407 0.0000 173.7719 19 R 4.6889 8.1195 117.9189 53.7303 32.9780 176.2501 20 I 4.1450 7.9554 114.6837 60.1975 39.8491 176.6380 21 G 3.5525 9.3009 109.4214 48.0837 0.0000 173.4847 22 G 3.8613 9.4212 113.3827 45.0167 0.0000 172.7507 23 D 4.7099 8.0958 114.4917 52.3282 40.8449 174.1387 24 S 4.7068 7.7717 116.3935 56.7172 66.2224 175.2639 25 G 4.0401 8.2873 108.1324 45.0397 0.0000 172.7367 26 L 4.8318 8.2727 119.8170 54.5149 42.6964 178.7467 27 S 4.6728 8.8434 118.0471 57.5731 66.2121 174.5664 28 A 3.9958 8.5001 122.4977 55.6360 17.8900 179.4135 29 R 4.2952 7.8485 112.3745 57.7007 30.0158 178.4480 30 G 3.7712 7.6738 106.4557 47.9209 0.0000 176.1507 31 K 3.8334 8.0105 120.9503 59.1486 32.0975 179.5114 32 Q 4.2275 7.9610 117.8103 58.7121 28.4761 178.0959 33 Y 3.9561 7.6813 120.6856 60.1757 38.8857 177.1558 34 A 3.7626 7.6621 121.3198 55.2924 18.5641 179.1202 35 Y 4.2528 7.4975 114.9494 61.2161 38.0007 178.3899 36 A 4.0061 7.8273 121.6783 54.8097 18.3091 179.5248 37 L 3.7107 7.8564 119.2618 58.1650 42.2597 178.9505 38 A 3.9555 7.8115 120.5653 55.1477 18.2388 179.4800 39 N 4.2287 8.0540 114.5469 56.4487 38.4975 177.3121 40 F 4.2767 7.8675 121.7872 60.7874 39.8280 176.8033 41 I 3.3172 7.9798 119.5803 64.2701 36.8986 178.5883 42 R 3.8209 7.6899 118.6381 59.2488 29.8480 179.2193 43 S 4.1927 8.0239 113.2136 60.7686 62.6865 176.0320 44 Q 3.8926 7.4987 120.9787 55.9182 29.3945 175.7401 45 G 3.9301 7.5810 108.1837 46.3457 0.0000 173.8176 46 I 3.9865 7.2794 117.5196 60.3665 38.4531 176.4403 47 S 4.3147 8.5980 119.8896 58.6330 64.0350 174.5216 48 S 3.5913 8.5477 120.9117 59.3365 59.6704 170.8722 49 L 4.3758 7.5406 121.2300 54.3674 43.2502 176.0829 50 K 4.5503 8.6641 127.9918 55.1647 34.2874 175.0853 51 V 4.9293 8.4830 125.9014 60.9508 34.5300 173.9721 52 W 5.8608 9.3691 127.6628 55.5181 32.9144 174.7065 53 T 5.5844 9.5649 112.6151 60.1273 72.5868 171.8315 54 S 5.7860 7.9280 116.1948 56.7071 65.3544 173.7434 55 H 4.6071 9.0973 115.5328 57.2773 29.2064 176.4265 56 M 4.4511 7.7982 121.3621 54.5514 33.4808 176.8767 57 K 3.9076 8.8608 124.2681 59.9191 32.4586 179.6537 58 R 4.0111 8.0873 115.7521 59.4398 29.1959 178.9166 59 T 3.9585 7.8063 109.8364 64.5738 69.1450 176.4377 60 I 3.4361 7.4973 122.7421 64.2575 37.0062 178.3583 61 Q 4.0245 8.2125 117.3575 59.3265 28.9049 179.0501 62 T 3.9690 7.4502 115.2555 66.4238 68.4327 176.7957 63 A 3.9451 7.7647 122.7207 54.8621 18.3614 179.2288 64 E 3.9574 8.0096 117.0703 59.8232 29.4258 179.3878 65 A 4.2886 7.3588 117.3416 54.3005 18.4268 179.0592 66 L 4.1215 7.9013 117.4592 55.5860 41.7822 176.8923 67 G 4.3769 8.0691 108.3794 45.6568 0.0000 174.7429 68 V 3.8896 7.2730 111.1779 59.8871 32.2507 174.2498 69 P 4.5088 0.0000 0.0000 63.0569 31.8983 174.6206 70 Y 5.2177 7.5265 116.7586 55.7462 41.7366 173.3076 71 E 4.8382 9.6913 119.6364 54.5360 33.2580 174.0988 72 Q 5.2495 8.7066 123.8365 54.1110 31.0850 174.8531 73 W 4.5392 9.3341 123.8141 54.6800 31.6975 176.8830 74 K 4.0595 8.9401 125.7518 59.3606 32.0141 178.4335 75 A 4.1090 8.1939 119.9679 54.2588 18.3473 177.5316 76 L 4.5205 7.8317 113.9219 54.4431 42.2611 176.7137 77 N 4.4947 8.0509 117.4506 52.8860 39.0110 174.7010 78 E 3.9835 8.1734 122.0125 55.7105 30.3571 176.4371 79 I 3.6960 8.0919 124.0367 61.1803 38.6395 175.0634 80 D 4.4308 8.9200 127.0883 53.7156 41.2599 176.5024 81 A 4.5007 9.3890 129.7221 52.0152 20.2141 178.1214 82 G 3.8991 8.0075 106.0848 46.0260 0.0000 178.3748 83 V 3.5167 8.8113 123.9811 64.3173 31.3279 176.7538 84 C 4.2348 7.4502 117.2311 59.3825 27.9924 173.0617 85 E 4.0209 7.7985 120.8374 58.0923 29.2383 177.1033 86 E 3.8886 8.6571 121.7377 57.0168 28.0868 174.3833 87 M 4.4908 7.5538 119.3113 54.5516 33.3901 175.9698 88 T 4.7125 7.8649 111.9684 60.9385 71.9213 175.6160 89 Y 4.1666 8.1888 117.9863 61.0374 37.8332 178.3687 90 E 3.9149 8.2253 119.1760 59.5931 29.6630 179.1039 91 E 4.0586 8.0542 117.9595 59.4392 29.3845 179.5885 92 I 3.9499 7.5221 120.0144 64.4011 37.2912 178.4442 93 Q 3.6792 7.8957 118.9877 58.6102 28.2007 178.5015 94 E 3.9054 7.8896 119.3904 59.4585 29.9082 178.0068 95 H 4.3678 7.9765 113.5877 56.7315 30.5140 175.3664 96 Y 5.0413 8.3460 118.1266 54.4224 38.9534 174.1040 97 P 4.4914 0.0000 0.0000 65.5749 32.0581 178.4814 98 E 4.1182 8.2609 117.8434 58.9602 29.4466 178.8978 99 E 4.1551 8.3656 118.3571 59.4430 29.6084 178.8223 100 F 4.2921 8.7610 120.6326 61.3462 39.2100 177.0225 101 A 3.9631 7.8006 119.2760 55.2110 18.0314 179.4140 102 L 3.8914 7.6988 117.0852 57.3520 41.3825 179.7590 103 R 3.2914 6.8113 119.0113 59.4025 29.8446 178.2578 104 D 4.3073 7.0110 116.6804 57.1132 40.7514 178.7260 105 Q 4.2955 7.1988 118.4073 57.8418 30.2572 176.5463 106 D 4.6134 7.7243 123.8035 52.3198 41.9290 175.1556 107 K 4.1419 8.4511 126.3132 58.5510 33.0761 177.6981 108 Y 4.2825 8.3399 120.3250 60.2788 38.7523 176.8615 109 R 4.3566 8.1719 114.8005 55.9624 31.3055 175.8638 110 Y 4.1710 7.7563 119.8837 57.3643 39.2699 175.0264 111 R 4.1083 7.0351 125.0080 54.0154 32.9578 175.4413 112 Y 4.2648 7.7364 119.8797 56.7199 38.8075 173.2220 113 P 4.2983 0.0000 0.0000 64.1427 31.3441 176.8372 114 K 4.0480 8.8655 122.5425 57.3706 29.2442 175.4722 115 G 4.3848 7.9476 107.1904 44.6893 0.0000 172.6770 116 E 5.0498 8.8870 119.1636 54.7589 32.0498 175.8633 117 S 4.7170 8.2250 115.3938 56.5520 65.9585 174.8858 118 Y 3.7286 8.4659 117.5580 60.9084 37.3804 178.6196 119 E 3.5555 7.4188 120.0641 59.0243 29.7293 178.5154 120 D 4.2604 7.6680 118.6012 57.2530 40.6803 178.4030 121 L 3.8784 7.6398 119.4912 58.3217 42.2102 178.9167 122 V 3.7703 8.0598 118.2367 65.8352 31.3320 177.8083 123 Q 3.9854 7.9270 119.3188 59.1072 28.8491 178.0278 124 R 4.2256 7.6476 113.3993 57.5885 30.0062 177.3364 125 L 4.4307 7.5226 119.5952 55.2014 42.1762 177.8697 126 E 3.9020 7.8583 119.7973 59.2022 29.4787 177.5509 127 P 4.3378 0.0000 0.0000 65.9072 31.2962 178.4939 128 V 3.1705 7.6377 117.7234 65.6403 31.4102 177.9769 129 I 3.6995 7.8155 119.8008 64.4486 36.6843 178.1391 130 M 4.0387 7.8712 118.5512 58.4323 31.9558 178.2106 131 E 4.2603 8.2090 119.0014 59.2328 29.7567 178.3531 132 L 3.8718 8.1225 120.4020 58.3237 41.8718 178.5965 133 E 4.1560 8.3596 118.3522 58.7168 29.7389 177.8530 134 R 4.6311 7.7030 114.4586 56.0447 31.3720 175.7164 135 Q 4.8171 7.2968 116.7575 55.2850 34.3188 176.3650 136 E 4.1164 9.0560 120.1732 57.2611 28.3901 178.0797 137 N 4.9886 9.1680 124.1653 53.1385 40.8016 175.0331 138 V 4.7670 8.3889 123.1016 60.9628 35.8351 173.3957 139 L 5.0921 8.8510 128.7194 53.2564 45.0153 174.9977 140 V 4.6880 8.8937 127.0976 61.4395 33.6747 174.6254 141 I 4.4982 8.7442 131.0873 59.6252 37.6609 173.7246 142 C 4.9192 9.0736 128.9499 58.2279 33.0668 173.4748 143 H 4.9523 8.6470 114.4480 52.8689 32.7535 173.9747 144 Q 3.9492 8.8219 119.8608 59.7231 28.7139 178.0916 145 A 4.1938 8.3145 121.5450 54.9905 18.3618 179.8348 146 V 3.5395 7.8727 116.3921 66.3935 31.7870 177.6689 147 M 4.0983 8.5830 118.3622 58.8858 32.0578 178.3261 148 R 4.0984 8.2692 118.0948 59.4625 30.1232 178.9298 149 C 4.3206 8.1159 116.2358 62.9266 28.3205 176.1828 150 L 4.1660 8.1179 120.6201 57.7775 41.1498 179.3535 151 L 4.1608 8.7205 120.5694 58.0765 41.9592 178.8349 152 A 4.0184 8.2862 120.8765 55.1635 17.7705 178.9260 153 Y 3.8030 7.9048 117.7369 61.0501 38.6977 178.5226 154 F 4.1778 8.0229 116.6793 59.8965 39.0712 176.7744 155 L 4.5123 8.1078 116.4705 52.8553 42.8940 176.6524 156 D 4.1251 7.0796 114.9314 54.9392 39.3301 172.5588 157 K 4.7054 8.6177 120.4558 53.9497 35.4601 176.8807 158 S 4.5346 8.5920 116.7265 57.2975 65.5927 175.5011 159 S 3.5967 8.1466 116.7293 60.8783 62.4933 176.0964 160 D 4.4192 7.6713 121.8279 57.4606 41.0373 177.9443 161 E 4.1105 7.9140 118.5974 59.3962 29.5062 178.8565 162 L 3.8392 8.0009 120.1730 58.0936 42.0258 177.1303 163 P 3.6039 0.0000 0.0000 63.8107 31.2387 176.2738 164 Y 4.6419 7.8004 114.3521 57.2133 39.0438 175.7868 165 L 4.0634 7.7346 120.7375 54.2852 42.1352 176.9534 166 K 4.1241 8.5695 124.0160 56.9628 32.2968 176.8891 167 C 4.8217 8.2089 125.0699 57.4313 28.5801 171.7012 168 P 4.5351 0.0000 0.0000 61.8792 31.2678 177.0104 169 L 4.1204 8.1200 118.2181 55.5038 42.4321 176.6662 170 H 3.3087 8.3416 114.6504 56.8584 26.2966 174.2243 171 T 5.1809 7.3916 114.6046 61.9165 71.7404 173.6269 172 V 4.5176 8.7346 126.5798 61.2723 33.9310 174.2556 173 L 4.9184 8.9517 128.4469 53.1230 43.8963 175.5934 174 K 4.2942 9.0799 127.6427 55.0566 33.2680 174.9263 175 L 4.8960 8.6332 129.1989 53.5475 43.7062 176.0584 176 T 4.6104 8.5084 121.4794 60.7835 70.2480 171.6227 177 P 4.6036 0.0000 0.0000 62.7555 32.2005 176.4150 178 V 4.3082 8.2691 117.0624 58.7476 35.0569 176.4839 179 A 3.9655 8.3637 123.0489 55.4981 18.1118 178.2011 180 Y 4.5678 7.7852 111.0045 57.2939 40.4107 174.8587 181 G 4.3076 5.9785 112.3514 45.1932 0.0000 175.1552 182 C 4.8957 8.3934 121.8586 57.8851 34.5547 171.8500 183 R 4.5408 8.9082 126.9857 55.6882 31.5361 175.0652 184 V 4.8796 8.2073 122.8417 61.1354 35.0022 174.1387 185 E 4.7122 8.8716 126.5145 54.4715 33.2006 173.7176 186 S 5.1706 8.8204 121.0030 56.5786 64.7250 172.9020 187 I 4.3925 8.7030 128.2146 59.6697 39.5910 173.9620 188 Y 4.8466 8.6380 129.3908 56.7880 39.5489 175.1800 189 L 4.1688 8.2128 128.2697 52.9485 41.7312 175.5290 190 N 3.9947 7.9613 122.0295 53.0930 38.6565 175.4166 191 V 4.0455 8.0485 118.3481 61.5290 32.5004 175.8522 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 4.40 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 2 R 8.25 4.45 0.00 2.02 2.08 0.00 3.08 0.00 0.00 3.54 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 3 S 9.89 4.73 0.00 3.68 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 4 I 8.47 4.48 1.41 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.34 0.59 0.00 0.00 5 Y 9.01 4.88 0.00 2.92 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 6 L 8.92 5.36 0.00 1.54 1.55 0.96 0.48 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 7 C 8.81 5.01 0.00 3.23 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.98 4.86 0.00 1.76 0.99 0.00 3.29 0.00 0.00 2.25 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 *10 G 8.57 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 0.00 0.00 0.00 11 E 8.82 4.10 0.00 2.01 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 2.38 2.31 0.00 12 S 9.17 4.97 0.00 3.95 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 13 E 8.84 3.99 0.00 2.02 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 0.00 2.51 2.50 0.00 14 L 7.73 4.08 0.00 1.69 1.87 0.97 0.56 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 15 N 8.01 4.34 0.00 3.06 2.86 0.00 0.00 6.52 6.64 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 16 L 7.68 4.03 0.00 1.82 1.87 1.01 0.89 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 17 R 7.68 4.33 0.00 1.83 1.95 0.00 3.30 0.00 0.00 3.22 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 18 G 7.95 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 19 R 8.12 4.69 0.00 1.72 1.91 0.00 3.14 0.00 0.00 3.47 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 20 I 7.96 4.14 1.82 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.56 0.62 0.00 0.00 21 G 9.30 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 9.42 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 23 D 8.10 4.71 0.00 2.56 2.53 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 0.00 0.00 0.00 0.00 24 S 7.77 4.71 0.00 3.91 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 25 G 8.29 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.27 4.83 0.00 1.53 1.60 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.84 4.67 0.00 4.05 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 8.50 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.85 4.30 0.00 2.04 2.11 0.00 3.28 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 30 G 7.67 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 0.00 0.00 0.00 31 K 8.01 3.83 0.00 1.95 1.59 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.35 1.60 7.81 32 Q 7.96 4.23 0.00 2.30 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.83 0.00 0.00 0.00 0.00 0.00 2.62 2.58 0.00 33 Y 7.68 3.96 0.00 2.64 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 34 A 7.66 3.76 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 35 Y 7.50 4.25 0.00 3.15 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 7.83 4.01 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 37 L 7.86 3.71 0.00 0.99 1.51 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 38 A 7.81 3.96 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 39 N 8.05 4.23 0.00 3.03 2.88 0.00 0.00 6.61 7.46 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 40 F 7.87 4.28 0.00 2.96 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.98 3.32 1.79 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.03 0.71 0.00 0.00 42 R 7.69 3.82 0.00 2.06 1.91 0.00 3.09 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 1.59 1.72 0.00 43 S 8.02 4.19 0.00 4.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 7.50 3.89 0.00 1.89 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 1.48 1.68 0.00 45 G 7.58 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 46 I 7.28 3.99 1.74 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.43 0.88 0.00 0.00 47 S 8.60 4.31 0.00 3.96 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 48 S 8.55 3.59 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 49 L 7.54 4.38 0.00 1.55 1.51 0.78 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.66 4.55 0.00 1.94 1.47 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.37 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.59 1.47 7.81 51 V 8.48 4.93 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 1.13 0.00 0.00 0.95 0.00 0.00 52 W 9.37 5.86 0.00 3.18 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 53 T 9.56 5.58 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 1.10 0.00 0.00 54 S 7.93 5.79 0.00 4.23 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 H 9.10 4.61 0.00 3.40 3.40 0.00 5.65 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 M 7.80 4.45 0.00 2.13 2.11 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 2.63 0.00 57 K 8.86 3.91 0.00 1.83 2.07 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.50 1.75 7.81 58 R 8.09 4.01 0.00 2.04 2.37 0.00 2.99 0.00 0.00 3.42 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 59 T 7.81 3.96 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 1.13 0.00 0.00 60 I 7.50 3.44 2.03 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.75 1.02 0.00 0.00 61 Q 8.21 4.02 0.00 1.96 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.98 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 62 T 7.45 3.97 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 1.28 0.00 0.00 63 A 7.76 3.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.01 3.96 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.53 0.00 65 A 7.36 4.29 1.33 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 0.00 0.00 66 L 7.90 4.12 0.00 1.74 1.74 0.89 1.08 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 67 G 8.07 4.38 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 0.00 0.00 0.00 68 V 7.27 3.89 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 0.76 0.00 0.00 0.97 0.00 0.00 69 P 0.00 4.51 0.00 2.16 2.03 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 70 Y 7.53 5.22 0.00 3.16 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 71 E 9.69 4.84 0.00 2.20 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 2.06 2.18 0.00 72 Q 8.71 5.25 0.00 1.92 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.45 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 73 W 9.33 4.54 0.00 3.10 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 74 K 8.94 4.06 0.00 1.94 1.85 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.48 7.81 75 A 8.19 4.11 1.48 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 0.00 0.00 76 L 7.83 4.52 0.00 1.91 1.78 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 N 8.05 4.49 0.00 2.79 2.75 0.00 0.00 6.85 8.52 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 78 E 8.17 3.98 0.00 1.41 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 0.00 2.22 2.28 0.00 79 I 8.09 3.70 1.61 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.71 0.77 0.00 0.00 80 D 8.92 4.43 0.00 2.76 2.48 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 81 A 9.39 4.50 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.01 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 83 V 8.81 3.52 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 0.15 0.00 0.00 0.96 0.00 0.00 84 C 7.45 4.23 0.00 2.43 2.53 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 0.00 0.00 0.00 0.00 85 E 7.80 4.02 0.00 1.94 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 2.52 2.40 0.00 86 E 8.66 3.89 0.00 2.12 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 2.19 2.23 0.00 87 M 7.55 4.49 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.44 0.00 88 T 7.86 4.71 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 89 Y 8.19 4.17 0.00 3.12 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.23 3.91 0.00 1.97 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 2.43 2.36 0.00 91 E 8.05 4.06 0.00 2.19 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 2.36 2.36 0.00 92 I 7.52 3.95 2.13 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.82 1.21 0.00 0.00 93 Q 7.90 3.68 0.00 2.02 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.83 0.00 0.00 0.00 0.00 0.00 1.16 1.68 0.00 94 E 7.89 3.91 0.00 1.85 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.18 0.00 95 H 7.98 4.37 0.00 3.08 2.87 0.00 5.67 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 Y 8.35 5.04 0.00 3.19 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 97 P 0.00 4.49 0.00 2.30 2.45 0.00 3.87 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.91 0.00 98 E 8.26 4.12 0.00 2.14 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 2.45 2.45 0.00 99 E 8.37 4.16 0.00 2.58 2.48 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 2.64 2.72 0.00 100 F 8.76 4.29 0.00 3.42 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.80 3.96 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 0.00 0.00 0.00 0.00 0.00 102 L 7.70 3.89 0.00 1.33 1.41 1.05 0.70 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 0.00 103 R 6.81 3.29 0.00 1.22 1.56 0.00 2.94 0.00 0.00 3.00 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.64 0.00 104 D 7.01 4.31 0.00 2.67 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 0.00 105 Q 7.20 4.30 0.00 2.03 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.98 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 106 D 7.72 4.61 0.00 2.73 2.53 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 0.00 0.00 0.00 0.00 107 K 8.45 4.14 0.00 1.72 1.76 0.00 1.36 0.00 0.00 0.68 0.00 0.00 2.45 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.23 1.33 7.81 108 Y 8.34 4.28 0.00 3.11 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 R 8.17 4.36 0.00 1.96 1.94 0.00 3.40 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.07 0.00 110 Y 7.76 4.17 0.00 3.02 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 0.00 111 R 7.04 4.11 0.00 1.47 1.53 0.00 3.14 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.41 0.00 112 Y 7.74 4.26 0.00 2.94 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 0.00 113 P 0.00 4.30 0.00 2.02 2.01 0.00 3.54 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.17 0.00 114 K 8.87 4.05 0.00 1.88 1.90 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.40 7.81 115 G 7.95 4.38 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 0.00 0.00 0.00 116 E 8.89 5.05 0.00 1.67 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 0.00 2.18 2.16 0.00 117 S 8.23 4.72 0.00 3.90 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 0.00 118 Y 8.47 3.73 0.00 3.07 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 0.00 119 E 7.42 3.56 0.00 1.31 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 120 D 7.67 4.26 0.00 2.90 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.64 3.88 0.00 1.54 1.83 0.86 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 122 V 8.06 3.77 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 1.04 0.00 0.00 1.18 0.00 0.00 123 Q 7.93 3.99 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.65 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 124 R 7.65 4.23 0.00 2.04 2.04 0.00 3.12 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 125 L 7.52 4.43 0.00 1.88 1.72 0.96 0.98 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 0.00 126 E 7.86 3.90 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.49 0.00 127 P 0.00 4.34 0.00 2.42 2.38 0.00 3.64 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 2.17 2.09 0.00 128 V 7.64 3.17 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 0.71 0.00 0.00 0.86 0.00 0.00 129 I 7.82 3.70 1.74 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.42 -0.05 0.00 0.00 130 M 7.87 4.04 0.00 2.04 2.31 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 2.81 2.56 0.00 131 E 8.21 4.26 0.00 2.47 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 3.01 0.00 132 L 8.12 3.87 0.00 2.25 2.00 0.51 1.07 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 0.00 133 E 8.36 4.16 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 134 R 7.70 4.63 0.00 2.02 2.06 0.00 3.16 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.77 0.00 135 Q 7.30 4.82 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.60 6.85 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 136 E 9.06 4.12 0.00 1.93 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.25 0.00 137 N 9.17 4.99 0.00 2.63 2.76 0.00 0.00 6.18 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 0.00 138 V 8.39 4.77 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.64 0.00 0.00 139 L 8.85 5.09 0.00 1.63 1.40 0.99 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 140 V 8.89 4.69 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 1.01 0.00 0.00 0.81 0.00 0.00 141 I 8.74 4.50 1.87 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 1.32 0.99 0.92 0.00 0.00 142 C 9.07 4.92 0.00 2.97 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 H 8.65 4.95 0.00 3.29 3.35 0.00 5.63 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 Q 8.82 3.95 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 145 A 8.31 4.19 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 0.00 146 V 7.87 3.54 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.00 0.00 0.00 147 M 8.58 4.10 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 148 R 8.27 4.10 0.00 2.33 2.24 0.00 3.36 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 1.81 1.94 0.00 149 C 8.12 4.32 0.00 3.23 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 0.00 150 L 8.12 4.17 0.00 1.98 1.94 0.99 0.45 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 0.00 151 L 8.72 4.16 0.00 1.96 1.77 0.98 1.16 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 0.00 152 A 8.29 4.02 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Y 7.90 3.80 0.00 2.99 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 0.00 154 F 8.02 4.18 0.00 3.18 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 0.00 155 L 8.11 4.51 0.00 1.71 1.71 0.96 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 156 D 7.08 4.13 0.00 2.64 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 8.62 4.71 0.00 1.73 1.66 0.00 2.07 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.49 7.81 158 S 8.59 4.53 0.00 3.95 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 0.00 159 S 8.15 3.60 0.00 2.72 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 D 7.67 4.42 0.00 2.60 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 0.00 161 E 7.91 4.11 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 162 L 8.00 3.84 0.00 1.83 1.68 1.10 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 0.00 163 P 0.00 3.60 0.00 1.50 1.11 0.00 3.89 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 1.93 1.71 0.00 164 Y 7.80 4.64 0.00 2.91 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 L 7.73 4.06 0.00 1.72 1.65 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 166 K 8.57 4.12 0.00 1.73 1.77 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.46 7.81 167 C 8.21 4.82 0.00 2.98 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 0.00 168 P 0.00 4.54 0.00 2.15 2.04 0.00 3.77 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 1.99 1.96 0.00 169 L 8.12 4.12 0.00 1.59 1.33 0.84 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 170 H 8.34 3.31 0.00 3.39 3.40 0.00 5.58 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 0.00 171 T 7.39 5.18 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 1.28 0.00 0.00 172 V 8.73 4.52 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 1.34 0.00 0.00 0.95 0.00 0.00 173 L 8.95 4.92 0.00 1.61 1.56 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 174 K 9.08 4.29 0.00 1.66 1.61 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.75 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.06 0.47 7.81 175 L 8.63 4.90 0.00 1.29 1.41 0.78 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 176 T 8.51 4.61 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 1.14 0.00 0.00 177 P 0.00 4.60 0.00 1.93 2.08 0.00 3.65 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 178 V 8.27 4.31 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 -0.23 0.00 0.00 179 A 8.36 3.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 Y 7.79 4.57 0.00 3.02 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 0.00 181 G 5.98 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 0.00 0.00 0.00 0.00 182 C 8.39 4.90 0.00 2.97 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 0.00 183 R 8.91 4.54 0.00 1.92 1.74 0.00 3.11 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 184 V 8.21 4.88 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.94 0.00 0.00 185 E 8.87 4.71 0.00 2.07 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 0.00 2.22 2.25 0.00 186 S 8.82 5.17 0.00 3.90 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 0.00 187 I 8.70 4.39 1.45 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.42 0.53 0.00 0.00 188 Y 8.64 4.85 0.00 2.90 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 0.00 189 L 8.21 4.17 0.00 1.63 1.51 0.66 0.69 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 0.00 190 N 7.96 3.99 0.00 2.53 2.68 0.00 0.00 7.02 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 0.00 191 V 8.05 4.05 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 0.79 0.00 0.00 1.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.