NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 E 4.1929 8.3033 118.7978 55.2663 31.3245 176.2652 10 N 4.2329 8.3591 114.2627 53.6523 36.1284 172.7417 11 A 4.1895 7.6753 123.5528 51.3837 20.0296 177.9613 12 A 4.1820 8.3019 123.5566 51.3150 19.1339 176.2273 13 P 4.4252 0.0000 0.0000 61.9648 32.2485 176.2971 14 A 4.1495 8.3470 123.0803 52.6556 18.8697 177.2798 15 Q 4.5086 8.2916 119.9861 53.7793 32.9058 174.9704 16 A 4.2259 8.4684 124.4893 51.1843 19.4109 176.0781 17 P 4.3871 0.0000 0.0000 62.7702 33.1743 178.2540 18 V 3.6531 8.4366 121.5553 65.1105 31.1559 178.5282 19 S 4.1770 8.1497 113.1786 61.4473 62.2734 175.8127 20 D 4.5003 8.1539 121.0024 57.3974 40.6345 178.8772 21 R 3.9718 8.2175 118.4863 59.1159 30.1235 178.9350 22 A 3.9245 8.3981 121.0179 55.0654 18.3367 179.8101 23 W 4.3165 8.5312 117.2595 59.4352 28.9827 178.7655 24 A 4.1276 8.2271 121.3307 54.9618 17.9368 179.3590 25 L 3.8932 8.1076 118.8679 58.1896 42.2056 178.6922 26 F 4.1170 8.2756 120.5378 61.7627 39.2410 177.4090 27 R 3.9606 8.7841 117.5982 59.0751 29.6068 178.9662 28 A 3.9703 8.1389 120.2744 55.0515 18.7069 179.4546 29 L 4.0193 7.7008 116.9907 57.8844 41.7505 179.0787 30 D 4.2123 8.1512 118.5148 57.1395 40.8698 178.2148 31 G 3.7074 8.1542 104.5035 46.2003 0.0000 174.5855 32 K 4.5021 7.5727 119.1544 55.5441 32.5503 176.8535 33 G 3.8686 7.9348 107.3256 46.0604 0.0000 174.6423 34 L 4.1793 7.6983 117.5808 54.5169 42.2049 176.5608 35 V 4.0630 7.2509 118.5713 59.9443 32.5500 173.2714 36 P 4.4222 0.0000 0.0000 62.2690 31.8966 175.8527 37 D 4.6331 8.6162 120.2843 56.3125 41.1796 177.6847 38 G 4.0137 9.1267 110.5443 46.1828 0.0000 174.7186 39 Y 3.9528 8.3030 121.2533 61.0216 38.8556 178.3934 40 V 3.9511 8.1397 112.6317 64.1661 31.7965 178.3627 41 E 4.0888 8.3133 118.4921 59.1289 29.3085 179.2960 42 G 3.4632 8.2283 106.0341 47.5143 0.0000 175.8591 43 W 3.5039 7.7110 121.5337 58.9825 28.9638 178.4527 44 K 4.0497 8.2123 119.7595 59.3872 31.5469 178.7409 45 K 3.8398 7.8948 119.7971 59.6905 32.1390 178.7603 46 T 3.6398 7.5553 116.0104 66.7559 68.0763 176.5437 47 F 4.2625 7.6646 118.3801 60.4752 38.9241 177.1394 48 E 4.2388 8.1910 117.1728 58.1784 29.6335 177.8257 49 E 4.5413 8.4500 116.6112 56.2842 31.5580 176.7375 50 D 4.5904 7.6985 116.8427 55.9024 42.1020 176.9638 51 F 4.7801 7.9218 118.3067 57.6955 39.2293 174.8944 52 S 4.6287 8.3960 119.3469 55.3115 65.5697 173.4223 53 P 4.6571 0.0000 0.0000 65.0230 31.1394 178.7539 54 R 3.8848 8.0558 118.6360 59.0548 29.8282 179.1004 55 R 3.8108 7.8697 118.3183 59.1765 29.9896 179.1044 56 G 3.6022 7.9532 105.2833 47.7779 0.0000 175.4215 57 A 3.8496 8.1662 123.1576 54.8613 18.3695 179.3119 58 E 3.7973 8.1284 117.7993 59.3840 29.6375 179.1068 59 L 3.6916 7.7060 119.0274 57.5429 41.5750 179.6768 60 V 3.1760 7.7763 118.0786 65.8362 31.1986 177.9407 61 A 3.9655 7.5975 119.2830 54.9775 18.5614 179.3119 62 R 4.0327 8.0406 116.9805 59.6241 30.2616 178.6076 63 A 4.3157 8.2811 120.7065 55.2088 18.1547 179.6774 64 W 4.6304 8.5564 117.1450 59.1212 29.1892 177.7222 65 T 4.8842 7.7386 106.5997 60.6902 69.4117 174.1846 66 D 4.6190 7.9534 120.3852 51.2419 42.6139 173.4018 67 P 4.3098 0.0000 0.0000 65.4050 31.3874 177.8858 68 E 3.9548 8.2980 117.5498 59.3848 29.6507 178.5794 69 F 4.0946 8.7534 120.6762 61.0450 39.4468 176.8694 70 R 3.9021 8.4429 118.7077 59.7747 29.6282 178.4921 71 Q 3.9784 8.2014 117.6189 58.7413 28.6781 178.6015 72 L 3.8314 7.7146 121.2807 58.0504 41.9303 178.6028 73 L 3.6722 7.4925 119.2055 58.1544 42.0151 178.5349 74 L 4.1936 7.8500 116.8781 56.2679 41.7818 177.5922 75 T 4.4217 7.2401 107.7304 62.3195 70.8969 174.6640 76 D 4.6022 8.5176 121.5042 51.2966 41.8731 175.3009 77 G 3.5187 7.9829 110.2299 47.5536 0.0000 172.4720 78 T 3.7337 7.6024 117.2231 66.5000 68.5198 176.2726 79 A 3.9333 8.1789 122.2915 54.9459 17.5647 179.5371 80 A 3.9259 7.8230 119.2745 55.4212 18.5933 180.0862 81 V 3.9116 8.1394 116.8707 66.1164 31.5766 178.1041 82 A 4.0838 8.3384 120.6508 55.1304 17.9326 179.5712 83 Q 3.9192 7.8829 115.4980 59.1043 28.8774 177.2143 84 Y 3.7029 7.5154 113.7829 57.6330 38.1241 175.9106 85 G 3.8640 7.8924 107.8820 46.9733 0.0000 173.7829 86 Y 5.0145 7.6451 114.0672 57.3288 38.1679 176.3845 87 L 4.3192 8.1034 120.0949 55.0338 42.5268 176.8369 88 G 4.0743 8.1716 107.7645 44.9685 0.0000 170.6190 89 P 5.0819 0.0000 0.0000 63.7610 31.8889 176.2645 90 Q 3.2478 8.8945 120.1047 56.3619 26.4121 174.7375 91 G 4.4572 7.7188 102.9443 44.3362 0.0000 175.8140 92 E 4.2246 8.1479 120.0686 56.5778 31.0994 175.0449 93 Y 4.3586 7.7445 119.0703 55.8312 41.1788 173.8614 94 I 4.8008 8.0693 127.7395 59.3655 39.5978 175.6422 95 V 4.3223 8.3264 125.6676 60.9699 34.2533 173.8949 96 A 5.1082 8.6019 129.5062 50.7654 20.5537 176.3735 97 V 4.3629 8.4856 115.0177 59.3738 35.0318 174.3349 98 E 4.8513 8.7139 126.0938 54.9727 30.1127 175.4718 99 D 4.9879 8.9267 127.4607 54.8963 42.6222 175.3512 100 T 4.6812 8.7632 110.4967 59.8084 72.5537 172.8912 101 P 4.4137 0.0000 0.0000 64.8624 31.4683 177.2912 102 T 4.6875 8.0688 107.6874 60.8822 70.4849 173.1649 103 L 5.0213 8.2768 124.6583 53.9341 45.9966 174.2686 104 K 4.9909 9.5222 127.9100 54.7919 34.4326 174.3240 105 N 5.5908 9.4627 125.0992 52.1102 41.1448 174.3131 106 V 4.8147 8.8152 121.1566 61.4904 35.4685 173.8706 107 I 5.2862 8.7721 127.6422 59.8776 39.8418 175.1154 108 V 4.4472 8.7962 123.6275 60.8296 34.6216 173.2211 109 C 5.2213 7.8371 121.4040 57.3013 31.9734 174.4092 110 S 4.3344 9.6202 121.4669 60.4872 63.0093 176.2767 111 L 4.0816 7.2267 120.9413 56.4705 41.8704 177.1900 *113 S 4.2904 7.6770 111.1564 58.2753 63.9993 173.1833 *115 T 4.0791 8.1376 117.3387 63.4402 69.6979 175.2216 116 A 4.8003 7.9799 127.0727 50.5846 16.5397 177.7881 117 W 4.6035 8.2098 123.5231 58.9898 29.7133 177.4710 118 P 3.9673 0.0000 0.0000 64.2116 31.1339 177.6752 119 I 4.2753 7.6483 109.4761 60.3955 39.0560 176.5059 120 L 4.3583 8.0341 119.5717 53.6094 42.9755 177.3816 121 G 4.1155 8.0120 104.6792 44.5126 0.0000 173.4071 122 L 3.6575 8.1142 118.9604 53.7604 42.0654 176.0086 123 P 4.0570 0.0000 0.0000 61.8641 32.2394 174.4464 124 P 4.4450 0.0000 0.0000 62.1325 32.6548 177.0917 125 T 3.8228 8.5974 116.0455 66.8493 68.2521 176.6634 126 W 4.2437 8.0628 117.8239 59.7741 27.9522 177.5804 127 Y 3.2689 6.4726 119.1819 59.4733 38.1739 176.9446 128 K 4.3232 7.4966 117.4130 55.8755 33.0944 177.3413 129 S 4.2712 7.2501 114.9400 57.8179 63.8662 175.4958 130 F 4.5668 8.4210 120.8449 60.7507 38.5832 177.8627 131 E 4.0483 8.3107 118.0152 59.6549 29.4103 178.6178 132 Y 4.1911 8.2430 119.4971 60.8428 38.7140 177.8728 133 R 3.7986 8.0816 117.6767 59.1084 30.1976 178.6062 134 A 4.1248 8.0888 119.7586 54.7747 18.9106 179.1562 135 R 4.2345 7.9320 116.1022 58.0556 30.5867 179.4527 136 V 3.7917 7.4538 117.7508 64.0677 31.6519 177.9574 137 V 3.6397 7.6116 119.5630 63.7551 31.6002 176.7843 138 R 4.2705 7.8617 119.1578 57.0085 31.5736 175.8965 139 E 4.7631 8.4788 115.1018 53.4961 29.4095 174.5812 140 P 4.2211 0.0000 0.0000 66.4964 31.8198 178.4997 141 R 3.8610 7.9068 118.1464 59.1047 30.0072 178.2817 142 K 3.9266 7.9517 119.0089 59.3480 32.3091 178.7097 143 V 3.6048 7.9941 118.6832 66.1578 31.4005 178.0157 144 L 4.0003 8.2573 118.9601 57.7545 41.4297 179.3938 145 S 4.3663 8.1670 114.4803 61.0340 62.1233 176.1332 146 E 3.9985 8.2191 120.1276 59.6031 29.2682 178.8138 147 M 4.2000 7.7160 117.1402 55.7878 32.1351 177.0795 148 G 4.0589 7.4521 107.1744 45.3538 0.0000 173.5849 149 T 4.4054 8.5043 117.6032 61.4589 69.6911 173.1467 150 E 4.1613 8.6524 127.1471 55.2632 30.2095 175.6641 151 I 4.3722 8.1377 125.0567 58.9803 38.5758 175.5751 152 A 4.1751 8.5938 128.9885 52.1153 19.0843 178.3683 153 S 4.0517 8.6608 116.3406 61.6076 63.0761 175.8814 154 D 4.5290 8.0802 117.4033 53.7665 39.2267 175.3912 155 I 4.6492 7.5393 121.6044 59.2908 39.7042 175.1014 156 E 4.0930 9.1213 129.1312 56.3826 30.6311 175.4104 157 I 4.8256 8.3235 127.6675 60.1688 39.0559 174.9449 158 R 4.4561 9.0965 127.2612 54.5089 32.6418 174.0989 159 V 4.7225 8.3018 126.6304 61.7792 33.1680 174.3695 160 Y 4.1489 9.1605 126.7320 56.6510 39.2118 174.1484 161 D 5.0432 8.5412 125.2267 53.5406 42.2791 176.7309 162 T 4.7058 9.2159 124.9792 63.1298 67.0566 174.5751 163 T 4.5437 8.5654 113.8757 61.2473 71.3100 175.0477 164 A 4.5849 7.3636 127.1770 52.1068 18.8490 177.6383 165 E 4.3884 8.6784 116.8377 58.6952 30.5031 176.3302 166 T 4.1866 7.6748 116.0130 63.8252 69.3521 173.7125 167 R 4.4974 8.7612 124.4474 54.5838 33.1248 174.4695 168 Y 5.9246 8.9100 120.9825 55.9014 40.7668 174.9130 169 M 4.9066 8.2834 117.6231 53.6414 35.1593 174.0183 170 V 4.3356 8.5588 121.5292 62.2383 33.1418 175.5476 171 L 4.5274 8.8440 131.0823 52.9745 42.2364 173.9604 172 P 5.2330 0.0000 0.0000 61.5427 32.6298 176.2086 173 Q 4.2821 8.6671 119.4821 56.0436 29.5220 176.1735 174 R 2.8330 8.0719 123.1688 54.3339 30.9918 174.5023 175 P 4.2426 0.0000 0.0000 61.6903 32.3787 175.6856 176 A 3.9363 8.0452 123.0285 53.7887 18.6620 178.2009 177 G 3.8507 8.7830 108.6146 45.4846 0.0000 174.3109 178 T 2.5144 6.7141 107.7854 60.2754 68.8805 173.8124 179 E 4.0674 7.6442 121.9610 58.2140 29.6942 177.5500 180 G 4.0779 8.9377 111.6001 45.1118 0.0000 173.7816 181 W 4.6009 7.9812 119.6516 56.6593 29.7619 176.7003 182 S 4.5535 9.2204 117.0624 58.0732 64.6798 175.5299 183 Q 4.1039 8.6314 121.0794 59.1352 28.1084 178.7752 184 E 3.9912 8.1800 119.8836 59.3996 29.5452 178.7289 185 Q 3.9382 7.9540 117.0926 58.9263 29.1145 178.4976 186 L 4.6817 8.5481 120.1937 58.1144 41.8011 179.3480 187 Q 4.0394 8.6992 118.4963 59.1800 28.4028 178.8388 188 E 4.0719 7.9940 119.3656 58.4221 29.7551 177.8396 189 I 4.5792 7.7043 110.3542 59.9924 38.4044 175.8274 190 V 4.0170 7.4972 121.7872 62.2734 30.8559 175.8217 191 T 4.4946 7.9968 118.4575 59.7811 72.0665 175.0412 192 K 3.8288 8.5284 121.2647 60.1709 32.0369 178.2402 193 D 4.6198 8.1720 118.2078 57.4710 40.5282 178.4000 194 C 4.7577 7.5660 118.3299 62.2779 28.3223 175.7348 195 L 4.1637 7.9883 120.5936 57.7448 41.1867 179.5471 196 I 3.9128 7.9910 120.1106 63.0290 36.9128 177.6031 197 G 4.3304 8.0849 104.9302 46.2298 0.0000 174.6634 198 V 3.9566 7.8985 111.6246 62.1202 32.3379 175.7587 199 A 4.8919 7.6869 121.5463 49.1237 21.8608 174.5705 200 I 4.6358 8.0002 120.4588 58.5863 39.1268 174.4300 201 P 4.4279 0.0000 0.0000 63.0981 31.7855 175.6230 202 Q 4.6305 8.5980 120.7419 54.0025 31.1579 175.0600 203 V 4.3330 8.1457 121.8317 60.3457 32.6945 173.8456 204 P 4.5014 0.0000 0.0000 63.4862 31.9320 176.4023 205 T 4.2560 8.1678 115.6414 64.0005 69.4394 174.0573 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 9 E 8.30 4.19 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.41 0.00 10 N 8.36 4.23 0.00 2.99 2.98 0.00 0.00 7.02 6.46 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 11 A 7.68 4.19 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 12 A 8.30 4.18 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 13 P 0.00 4.43 0.00 2.20 2.07 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 14 A 8.35 4.15 1.27 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 15 Q 8.29 4.51 0.00 2.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 16 A 8.47 4.23 1.27 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 17 P 0.00 4.39 0.00 2.33 2.03 0.00 3.76 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.18 0.00 18 V 8.44 3.65 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 0.98 0.00 0.00 0.92 0.00 0.00 19 S 8.15 4.18 0.00 4.02 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 20 D 8.15 4.50 0.00 3.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.22 3.97 0.00 2.02 1.99 0.00 3.14 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 22 A 8.40 3.92 1.10 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 23 W 8.53 4.32 0.00 3.58 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 24 A 8.23 4.13 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.11 3.89 0.00 1.80 1.90 0.93 0.66 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 26 F 8.28 4.12 0.00 3.15 3.46 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 27 R 8.78 3.96 0.00 2.00 2.04 0.00 3.29 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.18 0.00 28 A 8.14 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 L 7.70 4.02 0.00 1.73 1.62 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.15 4.21 0.00 1.64 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 0.00 0.00 0.00 0.00 31 G 8.15 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 0.00 0.00 0.00 32 K 7.57 4.50 0.00 1.83 1.80 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.14 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.54 7.81 33 G 7.93 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.70 4.18 0.00 1.68 1.65 0.88 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.25 4.06 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 1.05 0.00 0.00 0.84 0.00 0.00 36 P 0.00 4.42 0.00 2.36 2.01 0.00 3.16 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 1.95 2.02 0.00 37 D 8.62 4.63 0.00 2.69 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 38 G 9.13 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 39 Y 8.30 3.95 0.00 3.35 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.14 3.95 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.96 0.00 0.00 41 E 8.31 4.09 0.00 2.20 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 2.42 2.47 0.00 42 G 8.23 3.46 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 0.00 43 W 7.71 3.50 0.00 3.26 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 44 K 8.21 4.05 0.00 1.97 1.98 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.59 1.50 7.81 45 K 7.89 3.84 0.00 1.78 1.76 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.40 7.81 46 T 7.56 3.64 3.70 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 0.18 0.00 0.00 47 F 7.66 4.26 0.00 3.01 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 48 E 8.19 4.24 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.50 0.00 49 E 8.45 4.54 0.00 1.90 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 50 D 7.70 4.59 0.00 2.59 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 51 F 7.92 4.78 0.00 3.00 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 52 S 8.40 4.63 0.00 3.75 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 53 P 0.00 4.66 0.00 2.29 2.39 0.00 3.74 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 54 R 8.06 3.88 0.00 1.81 2.00 0.00 3.27 0.00 0.00 3.16 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 55 R 7.87 3.81 0.00 1.73 1.42 0.00 3.05 0.00 0.00 2.47 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.24 0.00 56 G 7.95 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 8.17 3.85 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.13 3.80 0.00 2.18 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.40 0.00 59 L 7.71 3.69 0.00 1.83 1.70 0.96 0.52 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 60 V 7.78 3.18 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 -0.38 0.00 0.00 0.75 0.00 0.00 61 A 7.60 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 R 8.04 4.03 0.00 1.91 1.79 0.00 3.05 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.24 0.00 63 A 8.28 4.32 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 64 W 8.56 4.63 0.00 3.53 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.74 4.88 4.33 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 1.41 0.00 0.00 66 D 7.95 4.62 0.00 2.79 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 67 P 0.00 4.31 0.00 2.24 2.14 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 68 E 8.30 3.95 0.00 2.09 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 69 F 8.75 4.09 0.00 3.23 3.22 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 70 R 8.44 3.90 0.00 2.27 2.20 0.00 3.49 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 71 Q 8.20 3.98 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.61 2.53 0.00 72 L 7.71 3.83 0.00 1.66 1.46 0.84 0.45 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 73 L 7.49 3.67 0.00 1.11 1.64 0.82 1.05 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 74 L 7.85 4.19 0.00 1.64 1.69 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 75 T 7.24 4.42 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 76 D 8.52 4.60 0.00 2.51 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 G 7.98 3.52 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 0.00 0.00 0.00 78 T 7.60 3.73 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 1.21 0.00 0.00 79 A 8.18 3.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 7.82 3.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.14 3.91 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 1.11 0.00 0.00 1.01 0.00 0.00 82 A 8.34 4.08 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 83 Q 7.88 3.92 0.00 2.40 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.66 0.00 84 Y 7.52 3.70 0.00 2.78 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 85 G 7.89 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 86 Y 7.65 5.01 0.00 3.03 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.10 4.32 0.00 1.69 1.65 0.94 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4.18 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 *115 T 8.14 4.08 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 116 A 7.98 4.80 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 0.00 117 W 8.21 4.60 0.00 3.12 2.67 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 0.00 118 P 0.00 3.97 0.00 2.28 2.03 0.00 3.38 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.64 0.00 119 I 7.65 4.28 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 1.38 0.82 0.95 0.00 0.00 120 L 8.03 4.36 0.00 1.77 1.65 0.90 0.72 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 0.00 121 G 8.01 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.11 3.66 0.00 1.37 1.22 0.11 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.06 0.00 2.07 1.65 0.00 3.58 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.23 0.00 124 P 0.00 4.44 0.00 2.03 2.11 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 0.64 1.65 0.00 125 T 8.60 3.82 4.27 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 1.20 0.00 0.00 126 W 8.06 4.24 0.00 3.52 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 0.00 127 Y 6.47 3.27 0.00 1.43 2.42 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.50 4.32 0.00 1.81 1.85 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.55 1.62 7.81 129 S 7.25 4.27 0.00 4.21 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 0.00 130 F 8.42 4.57 0.00 3.03 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 0.00 131 E 8.31 4.05 0.00 2.19 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 2.47 2.51 0.00 132 Y 8.24 4.19 0.00 3.32 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 0.00 133 R 8.08 3.80 0.00 1.98 2.14 0.00 3.28 0.00 0.00 3.51 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.82 0.00 134 A 8.09 4.12 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 R 7.93 4.23 0.00 2.02 1.97 0.00 3.16 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 136 V 7.45 3.79 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 0.90 0.00 0.00 137 V 7.61 3.64 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 0.86 0.00 0.00 138 R 7.86 4.27 0.00 1.74 1.94 0.00 3.15 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 139 E 8.48 4.76 0.00 2.07 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.21 0.00 140 P 0.00 4.22 0.00 2.30 2.50 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 141 R 7.91 3.86 0.00 1.90 1.97 0.00 3.18 0.00 0.00 3.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 142 K 7.95 3.93 0.00 1.86 1.92 0.00 1.78 0.00 0.00 1.99 0.00 0.00 3.06 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.50 7.81 143 V 7.99 3.60 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 1.16 0.00 0.00 0.98 0.00 0.00 144 L 8.26 4.00 0.00 1.93 1.92 1.08 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 145 S 8.17 4.37 0.00 3.94 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 0.00 146 E 8.22 4.00 0.00 2.12 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 2.35 2.49 0.00 147 M 7.72 4.20 0.00 1.78 2.15 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.36 0.00 148 G 7.45 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 0.00 149 T 8.50 4.41 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 1.23 0.00 0.00 150 E 8.65 4.16 0.00 1.99 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 151 I 8.14 4.37 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.88 0.93 0.00 0.00 152 A 8.59 4.18 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 0.00 153 S 8.66 4.05 0.00 3.99 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 0.00 154 D 8.08 4.53 0.00 2.81 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 0.00 155 I 7.54 4.65 2.00 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 1.28 0.68 0.97 0.00 0.00 156 E 9.12 4.09 0.00 2.05 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 2.30 2.28 0.00 157 I 8.32 4.83 1.87 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 1.25 0.71 0.93 0.00 0.00 158 R 9.10 4.46 0.00 1.80 1.93 0.00 3.15 0.00 0.00 2.84 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.28 0.00 159 V 8.30 4.72 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 0.80 0.00 0.00 0.90 0.00 0.00 160 Y 9.16 4.15 0.00 2.55 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 0.00 0.00 0.00 161 D 8.54 5.04 0.00 2.65 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 T 9.22 4.71 4.40 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 1.34 0.00 0.00 163 T 8.57 4.54 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 1.27 0.00 0.00 164 A 7.36 4.58 1.02 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 0.00 0.00 165 E 8.68 4.39 0.00 1.81 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 2.15 2.16 0.00 166 T 7.67 4.19 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 0.56 0.00 0.00 167 R 8.76 4.50 0.00 1.56 1.68 0.00 3.24 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 168 Y 8.91 5.92 0.00 2.84 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 M 8.28 4.91 0.00 2.01 2.07 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 2.51 2.48 0.00 170 V 8.56 4.34 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.07 0.00 0.00 171 L 8.84 4.53 0.00 1.77 1.59 0.77 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 172 P 0.00 5.23 0.00 2.40 2.18 0.00 3.11 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 173 Q 8.67 4.28 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.95 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 174 R 8.07 2.83 0.00 0.67 1.10 0.00 2.50 0.00 0.00 2.79 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.50 0.00 175 P 0.00 4.24 0.00 2.05 2.02 0.00 3.03 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 2.02 0.00 176 A 8.05 3.94 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 0.00 177 G 8.78 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 0.00 178 T 6.71 2.51 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 -0.06 0.00 0.00 179 E 7.64 4.07 0.00 1.91 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 2.24 2.25 0.00 180 G 8.94 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 0.00 181 W 7.98 4.60 0.00 3.40 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 S 9.22 4.55 0.00 4.07 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 Q 8.63 4.10 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.94 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 184 E 8.18 3.99 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 185 Q 7.95 3.94 0.00 2.29 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.01 2.23 0.00 186 L 8.55 4.68 0.00 2.11 2.23 1.27 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 187 Q 8.70 4.04 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.53 2.65 0.00 188 E 7.99 4.07 0.00 2.15 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 189 I 7.70 4.58 2.20 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.09 1.31 0.00 0.00 190 V 7.50 4.02 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 0.70 0.00 0.00 0.81 0.00 0.00 191 T 8.00 4.49 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 1.26 0.00 0.00 192 K 8.53 3.83 0.00 1.86 1.93 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.70 7.81 193 D 8.17 4.62 0.00 2.81 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 0.00 194 C 7.57 4.76 0.00 3.13 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 0.00 195 L 7.99 4.16 0.00 1.87 1.70 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 196 I 7.99 3.91 2.11 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.92 1.29 0.00 0.00 197 G 8.08 4.33 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 0.00 198 V 7.90 3.96 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 1.01 0.00 0.00 0.97 0.00 0.00 199 A 7.69 4.89 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 0.00 200 I 8.00 4.64 1.90 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 1.46 0.70 0.94 0.00 0.00 201 P 0.00 4.43 0.00 2.19 2.38 0.00 3.75 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 202 Q 8.60 4.63 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.45 2.27 0.00 203 V 8.15 4.33 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.80 0.00 0.00 204 P 0.00 4.50 0.00 2.17 2.05 0.00 4.01 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 205 T 8.17 4.26 4.26 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 1.23 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.