NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 D 4.6219 8.3649 120.5321 54.3083 43.7485 174.9542 7 I 3.7351 7.4315 118.2610 61.1886 38.4533 173.3796 8 K 5.0387 9.2442 126.9331 54.5413 34.7910 176.4463 9 V 4.1097 8.6428 116.9298 61.9484 32.2235 175.7586 10 T 4.7948 8.7680 113.4579 59.3180 71.3948 172.6569 11 P 4.5929 0.0000 0.0000 64.1922 31.8855 177.8640 12 G 3.8454 7.7223 106.8145 47.4842 0.0000 176.0846 13 T 4.0999 7.9313 117.5483 66.8496 68.4292 176.3626 14 S 4.1870 8.1884 115.5939 61.5435 62.8947 175.8725 15 E 3.9700 8.2793 122.3907 59.0047 29.3716 178.4756 16 L 4.0900 7.9092 119.9730 58.1876 42.1311 179.0004 17 V 3.7404 8.2391 118.4646 66.2734 31.4398 177.9248 18 E 4.1414 8.4594 118.3165 59.4287 29.1482 179.3516 19 Q 4.1317 8.4290 118.3245 58.9509 28.3755 178.8102 20 I 3.9852 8.2058 120.9373 64.6015 37.1567 178.5793 21 L 4.3817 8.5872 119.7914 57.6832 41.3832 179.4410 22 A 4.1106 8.3952 121.1383 54.9725 18.2544 179.5561 23 L 4.0744 7.9793 117.7763 57.9785 41.6882 179.4249 24 L 3.9864 7.9397 118.9073 58.3139 41.9643 178.7617 25 S 4.1187 8.4602 113.3318 61.6424 62.2871 176.2379 26 R 4.0030 8.1663 121.2824 59.4534 29.5776 177.8856 27 Y 4.2751 8.3386 119.4787 60.6871 38.7183 177.9379 28 L 4.1377 8.2989 120.0905 58.1952 41.8289 179.7352 29 S 4.2491 8.8812 115.2752 61.6861 62.7708 177.0822 30 S 4.3750 8.3842 117.8317 62.0007 62.7060 176.3372 31 Y 3.9403 8.4671 119.3332 61.0029 37.6423 178.4073 32 I 3.7620 8.2315 120.9667 64.8257 37.1639 177.7144 33 H 4.1501 8.4505 118.8512 59.5074 29.7515 177.7099 34 V 3.6557 7.7107 120.6748 64.6547 31.2332 178.2793 35 L 4.0931 8.5099 120.0114 57.3323 41.4428 178.8345 36 N 4.3342 8.7229 117.0821 56.3990 38.5196 177.4901 37 K 4.0351 7.8774 119.6760 59.4847 32.2329 179.1992 38 F 3.6621 8.4228 120.9082 61.2305 39.0078 177.1696 39 I 3.4026 7.9070 118.7206 64.2069 37.1468 178.0844 40 S 4.1491 8.1383 113.9997 61.6718 62.2646 175.6094 41 H 4.1078 8.1372 120.8836 59.2215 29.5709 176.6370 42 L 3.8488 7.5157 119.4053 55.8564 41.1470 179.0762 43 R 3.8759 7.5751 116.3661 58.9113 29.3411 178.2686 44 R 4.3128 7.7748 116.8204 55.9234 30.5745 176.2354 45 V 4.0272 7.2607 119.6421 60.7711 32.0318 175.9670 46 A 3.9857 8.3169 131.8006 54.7293 18.5646 178.5290 47 T 4.2054 7.7080 103.6740 62.6779 69.5722 175.5834 48 L 5.2387 7.3433 123.2522 54.1034 41.7886 177.8909 49 R 3.6478 6.9358 120.0938 59.6413 29.9356 178.4691 50 F 4.7310 7.1220 117.0613 58.8731 39.2838 177.8967 51 E 4.4176 8.1236 119.5512 58.8274 29.2475 179.0556 52 R 3.8286 8.0580 119.1256 59.5837 29.7212 178.7446 53 T 3.9937 7.7572 109.4350 64.9624 68.7638 176.7277 54 T 3.8098 8.0989 118.6284 66.5032 68.4880 176.5437 55 L 4.3003 8.2991 120.9241 57.9534 41.5603 179.5889 56 I 3.8017 8.2920 120.2759 63.9895 37.0961 178.0658 57 K 3.6975 8.1326 120.6255 59.8049 31.9433 178.7859 58 F 3.9210 8.0416 117.5978 60.5502 38.7161 178.0889 59 V 3.6992 8.5272 112.4245 64.4422 31.2813 178.6768 60 K 3.9024 8.3387 118.4693 59.2908 31.8358 179.3267 61 K 3.6916 7.7138 119.4107 59.3641 32.0242 178.9357 62 L 3.7707 7.7047 119.2572 57.7785 41.4945 179.7623 63 R 3.9191 8.2987 118.3831 58.9802 29.9269 178.7193 64 F 4.1383 8.3185 120.5910 61.7131 39.3142 176.7164 65 Y 4.0749 8.1882 116.5758 61.0443 37.6108 178.3936 66 N 4.2767 8.4902 118.0644 56.9247 38.9420 176.5791 67 D 4.3990 8.2439 119.2321 57.4811 41.0070 178.9167 68 S 4.1127 7.8775 115.5431 61.5880 62.8763 176.7197 69 V 3.5637 7.8588 121.0804 66.1251 31.0279 177.6427 70 L 4.3182 7.8750 116.2084 56.4142 41.7436 178.3453 71 S 4.6522 7.5339 113.8444 57.9187 63.3882 173.3969 72 Y 4.2534 7.3631 123.8688 57.1791 39.1624 174.6662 73 N 4.5932 8.4153 126.4094 51.5733 38.3862 174.5311 74 A 3.7926 8.7622 128.9796 55.0987 19.2336 179.8410 75 S 4.0852 8.3799 111.5305 61.9066 62.9625 176.4950 76 E 3.6653 7.7013 118.8443 58.4295 29.1923 177.3282 77 F 4.5738 8.0699 114.6744 56.8639 39.5449 175.0419 78 I 4.3853 7.4830 122.0145 59.6369 39.2077 175.2295 79 N 4.6565 9.9873 128.9012 52.1854 39.0987 174.5322 80 E 4.4804 8.5837 127.0167 55.7352 31.6540 175.9635 81 G 4.5964 8.4238 110.5686 45.9390 0.0000 174.3975 82 K 4.3483 8.4232 118.7922 56.6254 33.7484 175.8278 83 N 4.5639 8.3341 114.3050 53.7282 37.6431 173.3910 84 E 3.5932 8.6325 124.4494 57.4235 26.9820 174.3296 85 L 3.9474 7.9869 118.4699 56.0969 41.8300 178.9100 86 D 3.7376 7.6186 118.4683 55.5547 41.7722 175.9669 87 P 4.4894 0.0000 0.0000 64.4326 32.6827 177.2963 88 E 4.4398 7.9030 116.6036 56.5327 31.3464 176.0486 89 A 4.3106 7.7347 121.4549 51.8003 18.9087 177.4468 90 D 4.5090 9.7273 124.2482 54.3988 42.2179 176.3935 91 S 4.6040 8.6524 118.7072 58.5171 63.9915 174.9678 92 F 4.1139 9.5366 127.3640 61.6103 39.1742 177.2057 93 D 4.1494 8.2578 118.4497 56.5424 38.6000 178.6627 94 K 3.9627 7.7963 118.5861 59.4626 32.8239 178.9669 95 V 3.6855 7.0130 119.1277 65.8257 31.6576 177.8520 96 I 3.5977 7.2650 119.4739 63.4659 36.7408 177.8991 97 L 3.7829 7.4310 121.3601 57.9478 41.8757 177.3958 98 P 4.2198 0.0000 0.0000 65.3820 31.1657 178.7685 99 I 3.5817 7.5006 117.9451 64.3237 37.1104 177.9575 100 A 3.8588 8.0568 121.9083 55.2022 18.1201 179.3621 101 S 3.9717 8.3681 111.9387 61.9858 62.3233 176.2632 102 M 3.8741 8.0695 120.5761 58.4164 31.8643 178.1779 103 F 3.8409 8.5839 118.1269 60.4727 39.1811 177.6789 104 V 3.6081 8.1994 118.1954 65.9991 31.3778 177.9706 105 K 3.9296 8.1016 119.2708 59.5990 32.0220 179.0349 106 S 3.9660 8.1301 115.6823 61.3827 62.6426 176.6673 107 V 3.9688 8.5684 121.3637 66.3943 31.2814 178.0110 108 E 4.1278 8.4862 118.1517 59.5905 29.2310 179.5315 109 T 3.9781 7.9860 115.8973 66.7884 68.5587 176.8036 110 F 4.2282 8.2989 119.6383 60.1653 38.8884 177.2438 111 D 4.1018 8.6809 118.3704 57.2967 41.0449 178.4486 112 L 4.0559 7.8495 118.9307 57.7337 41.6804 179.2633 113 L 3.1060 8.3268 120.6063 57.9384 41.9020 178.4437 114 N 4.3797 8.6457 116.8818 56.7473 38.5207 176.7263 115 Y 3.8142 7.9821 120.4949 60.6899 38.7868 177.2823 116 Y 4.1086 8.2600 120.5191 60.7864 38.7246 177.8620 117 L 3.8750 8.4712 121.8472 57.3098 42.0310 178.0323 118 T 4.2577 7.9561 107.7991 62.7396 70.0435 174.5772 119 Q 4.1588 7.7164 119.5213 57.0771 30.2591 177.6904 120 S 3.9463 7.0692 115.1486 61.9237 63.4720 176.7255 121 L 3.7128 7.7832 123.1897 57.8866 41.7155 178.9480 122 Q 3.9143 7.2528 118.7063 58.9305 28.6566 178.8674 123 K 3.9069 7.8418 119.3971 59.5129 32.0531 179.0193 124 E 3.9244 8.1394 119.4842 59.3214 29.5215 178.9644 125 I 3.7308 8.2519 120.3471 64.2641 37.0566 178.4581 126 L 4.0145 7.9153 119.9781 57.7947 41.2381 179.4688 127 S 4.1158 8.1087 112.3105 60.9887 62.3727 175.7573 128 K 4.2809 8.1155 120.4381 57.8313 32.2156 177.6080 129 T 4.4487 7.5874 105.9103 59.7938 70.1746 174.1578 130 L 3.5617 8.1446 120.0701 55.3440 40.1666 174.0300 131 N 4.7505 7.8934 118.5402 51.8453 38.3928 175.2581 132 E 4.1492 8.5207 126.1279 58.7855 29.9885 179.3715 133 D 4.5185 8.0672 117.8824 56.9102 40.8801 177.1829 134 L 4.6460 7.9627 117.1589 55.1973 42.0252 176.6292 135 T 4.6388 7.4375 109.2763 59.8168 70.6021 174.5841 136 L 4.2685 8.5765 122.7553 54.5596 42.6719 178.2419 137 T 4.1055 7.7468 117.7135 63.2874 70.4187 176.0768 138 A 4.0576 8.4559 124.7116 55.2651 18.3956 180.0697 139 E 4.0149 8.1068 117.1705 59.1716 29.5551 179.3299 140 S 4.0877 7.9509 114.1690 61.4491 63.2099 176.4879 141 I 3.7115 7.6709 123.0819 63.9053 36.8254 178.1966 142 L 3.9708 7.9037 119.6329 58.0415 41.5023 179.6263 143 A 4.0220 8.1742 120.4691 54.9927 18.2374 179.8107 144 I 3.7667 8.0088 118.7683 64.8405 37.1750 178.4468 145 D 4.5634 8.6624 120.1638 57.2568 40.5825 178.4423 146 D 4.4305 8.2661 118.8014 57.6734 41.3166 178.4732 147 T 3.9523 8.2025 116.4008 66.6670 68.3567 176.0382 148 Y 4.3716 8.2332 122.7913 60.4514 38.8105 177.9575 149 N 4.5958 8.9374 117.6981 56.9122 38.5748 177.1384 150 H 4.3812 8.5222 117.5639 58.7128 28.7924 177.8803 151 F 3.9155 8.5650 119.9345 60.0832 38.6091 177.8748 152 V 3.5282 8.0778 118.2592 65.9759 31.3256 178.0282 153 K 4.0655 8.5010 119.5656 59.4187 31.9984 178.3312 154 F 2.8273 8.1452 121.2755 60.9992 39.2183 177.3529 155 S 3.6062 8.0767 114.5777 61.4596 62.5996 176.2637 156 Q 3.8414 8.2093 122.5916 58.8787 28.6231 178.2262 157 W 3.9795 8.1801 129.5164 60.7903 30.5760 177.6097 158 M 3.0571 7.3433 118.4275 58.1876 31.2105 179.0302 159 I 3.5978 7.1799 119.3994 64.4550 37.3796 178.4483 160 E 3.8995 8.2644 120.0638 59.1564 29.0868 179.4980 161 S 4.0596 7.7369 112.9398 60.4252 63.0798 174.8538 162 L 4.3671 7.2071 117.4976 53.6803 41.8932 176.2146 163 R 3.7437 7.5084 117.1135 57.3595 28.0651 176.6160 164 I 4.2105 7.8218 107.9273 60.4813 38.0150 176.0121 165 G 3.7929 7.6765 109.8644 45.9732 0.0000 173.0047 166 S 4.5344 8.1332 112.5770 57.0709 65.1421 175.7889 167 N 4.5327 8.6602 117.9082 55.9063 38.2457 176.9946 168 L 4.2037 7.5295 115.4220 55.7769 41.9259 177.0181 169 L 4.6064 7.5750 118.7955 54.3976 42.9845 175.9811 170 D 4.5137 7.5745 118.1487 54.8158 41.6474 175.2396 171 L 4.6594 8.1764 122.6516 53.3371 43.9305 177.0934 172 E 3.9477 9.2760 125.7391 59.8812 29.6084 180.0991 173 V 3.7718 7.7678 118.1767 64.5541 31.4606 178.3921 174 V 3.3491 7.4334 118.4247 65.9513 31.5925 177.7905 175 Q 4.0731 8.0951 117.7994 58.8884 28.4911 178.7623 176 F 4.1951 8.7480 121.7898 61.3275 39.2717 177.0103 177 A 3.9629 7.9802 118.9262 55.7566 18.5260 179.0352 178 I 3.6623 8.3587 118.8078 63.9904 36.9058 178.1501 179 K 4.0816 8.6425 123.0810 59.7735 32.0720 178.1728 180 S 4.3782 7.5558 113.5594 58.2143 64.5589 175.2564 181 A 4.4895 7.9100 126.2670 51.2413 17.0012 177.7765 182 D 5.1033 7.6425 116.7641 52.8696 44.4755 176.4229 183 E 4.6428 8.4478 118.4296 57.4465 32.5224 176.1685 *192 D 4.4732 9.2534 120.7166 54.7908 43.7148 176.4422 193 N 4.6505 7.7710 117.3661 51.0133 36.1859 175.0397 194 I 3.5473 7.4309 121.8570 64.6745 38.5352 176.3983 195 F 4.9482 7.5708 115.7520 58.1251 40.7616 175.8400 196 L 3.9288 8.4650 123.5470 56.5132 40.0431 176.8267 197 Q 4.5727 9.0513 112.4956 55.7691 30.1540 174.7754 198 E 4.1991 8.0858 116.8919 55.6680 27.9312 176.5895 199 I 4.3601 7.8634 125.2914 60.1941 38.9775 174.9552 200 L 4.7707 7.9835 119.8233 54.4768 42.8609 173.0600 201 P 4.7518 0.0000 0.0000 63.9581 33.3829 175.0371 202 V 4.4087 7.5489 111.0356 60.0171 33.7232 175.1096 203 N 5.0470 8.4447 117.3579 52.9374 40.4377 174.2747 204 S 4.5548 7.5124 112.7933 56.1887 66.9262 174.7829 205 E 3.3630 8.4031 122.0055 59.1152 29.3535 178.2233 206 E 3.9519 8.1309 118.2509 59.6587 29.6565 178.9404 207 E 4.0417 8.3107 119.1196 58.9960 29.6878 178.3850 208 F 4.3746 8.6452 121.1361 61.7235 39.3837 177.2248 209 Q 4.2983 8.5830 117.8280 59.1744 28.4920 178.9164 210 T 3.8609 7.9205 116.5251 66.7829 68.5211 176.8914 211 L 3.8782 7.9112 120.6746 57.2070 41.4753 179.3698 212 S 4.1697 7.9703 113.8853 60.4368 63.1371 176.4123 213 A 3.9399 8.2298 124.9870 54.8970 18.1216 179.3004 214 A 3.7665 7.7397 119.1368 55.2142 18.4521 179.8073 215 W 3.8149 7.9574 117.4512 60.0454 28.9631 178.0460 216 H 3.8821 8.5196 118.5102 59.4544 29.2202 177.2609 217 S 4.0442 7.7164 114.7803 61.2674 62.1284 176.1227 218 I 3.5218 7.6202 122.5346 64.3645 36.7246 178.4916 219 L 3.7949 8.1543 120.2465 57.5755 41.3788 178.9468 220 D 4.3542 8.3548 118.6273 57.2100 41.1261 178.6440 221 G 3.5174 7.9772 106.1776 47.6840 0.0000 175.6635 222 K 3.8660 8.1589 121.5304 59.3291 32.1053 179.4260 223 L 4.0130 8.2090 119.3090 57.8716 41.4842 179.8196 224 S 4.1356 8.2380 115.0402 61.3275 62.7115 176.5091 225 A 3.9299 8.0193 123.6580 54.8122 18.0968 179.4115 226 L 3.5318 7.8791 118.7931 58.4360 42.1190 178.8674 227 D 4.5335 8.0040 118.7181 57.3669 40.6946 178.7329 228 E 3.8819 8.0040 119.6875 59.3628 29.7114 178.6327 229 E 3.9290 8.1718 118.6844 59.4858 29.5249 179.4162 230 F 4.5132 8.6009 118.1516 60.8024 38.7058 177.4907 231 D 4.3884 8.1604 117.8973 57.0938 40.7229 178.8040 232 V 3.6319 7.6204 118.8376 66.1492 31.6403 178.6307 233 V 3.2941 7.7565 111.9375 64.0125 31.4147 178.0668 234 A 2.9145 7.4355 119.3097 53.5363 17.9624 179.3777 235 T 3.7199 6.9196 114.1915 66.7159 68.6940 176.2091 236 K 4.0765 7.3464 117.5752 57.6805 32.0261 177.1631 237 W 4.3014 7.4395 124.0173 56.6533 29.3507 175.3249 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 6 D 8.36 4.62 0.00 2.69 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 7 I 7.43 3.74 1.92 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 1.31 0.64 0.73 0.00 0.00 8 K 9.24 5.04 0.00 1.62 1.73 0.00 1.93 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.39 7.81 9 V 8.64 4.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.01 0.00 0.00 10 T 8.77 4.79 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 1.29 0.00 0.00 11 P 0.00 4.59 0.00 2.08 2.16 0.00 3.74 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 12 G 7.72 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 13 T 7.93 4.10 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 14 S 8.19 4.19 0.00 4.10 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 0.00 15 E 8.28 3.97 0.00 2.11 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 2.51 2.44 0.00 16 L 7.91 4.09 0.00 2.01 2.01 1.18 1.19 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 17 V 8.24 3.74 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 1.28 0.00 0.00 1.04 0.00 0.00 18 E 8.46 4.14 0.00 2.18 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 2.49 2.80 0.00 19 Q 8.43 4.13 0.00 2.38 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 20 I 8.21 3.99 2.22 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.52 1.13 0.00 0.00 21 L 8.59 4.38 0.00 1.84 1.84 0.96 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.40 4.11 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 23 L 7.98 4.07 0.00 2.13 1.99 0.72 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 24 L 7.94 3.99 0.00 1.33 1.79 0.68 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.46 4.12 0.00 3.98 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 26 R 8.17 4.00 0.00 2.04 2.23 0.00 3.21 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 27 Y 8.34 4.28 0.00 2.71 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.30 4.14 0.00 1.94 1.75 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.88 4.25 0.00 3.95 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 30 S 8.38 4.37 0.00 4.50 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 31 Y 8.47 3.94 0.00 3.32 3.20 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 32 I 8.23 3.76 2.14 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.70 0.98 0.00 0.00 33 H 8.45 4.15 0.00 3.46 3.57 0.00 5.78 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.71 3.66 1.56 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 -0.11 0.00 0.00 0.75 0.00 0.00 35 L 8.51 4.09 0.00 1.84 1.83 1.09 0.68 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 36 N 8.72 4.33 0.00 2.95 2.90 0.00 0.00 6.95 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 K 7.88 4.04 0.00 2.15 2.14 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.51 1.55 7.81 38 F 8.42 3.66 0.00 2.53 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 39 I 7.91 3.40 1.91 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 1.36 0.69 0.85 0.00 0.00 40 S 8.14 4.15 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 41 H 8.14 4.11 0.00 3.37 3.12 0.00 5.83 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 7.52 3.85 0.00 1.45 1.30 0.07 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 43 R 7.58 3.88 0.00 1.89 2.03 0.00 3.01 0.00 0.00 3.33 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 44 R 7.77 4.31 0.00 1.65 1.93 0.00 3.04 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 45 V 7.26 4.03 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 0.87 0.00 0.00 0.76 0.00 0.00 46 A 8.32 3.99 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 7.71 4.21 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 1.15 0.00 0.00 48 L 7.34 5.24 0.00 1.49 1.53 0.81 1.36 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 49 R 6.94 3.65 0.00 0.90 0.97 0.00 2.86 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.58 0.00 50 F 7.12 4.73 0.00 3.12 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 51 E 8.12 4.42 0.00 2.22 2.10 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 2.44 2.46 0.00 52 R 8.06 3.83 0.00 1.77 2.00 0.00 2.80 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.48 0.00 53 T 7.76 3.99 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 1.32 0.00 0.00 54 T 8.10 3.81 4.48 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 0.85 0.00 0.00 55 L 8.30 4.30 0.00 1.94 1.84 1.10 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 56 I 8.29 3.80 2.01 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.83 0.89 0.00 0.00 57 K 8.13 3.70 0.00 1.72 1.77 0.00 1.36 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.14 1.18 7.81 58 F 8.04 3.92 0.00 3.38 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 59 V 8.53 3.70 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 0.99 0.00 0.00 1.04 0.00 0.00 60 K 8.34 3.90 0.00 1.85 1.80 0.00 1.61 0.00 0.00 1.51 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.54 7.81 61 K 7.71 3.69 0.00 1.63 1.68 0.00 1.29 0.00 0.00 1.33 0.00 0.00 2.80 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.03 0.41 7.81 62 L 7.70 3.77 0.00 1.84 1.62 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 63 R 8.30 3.92 0.00 2.09 2.01 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 64 F 8.32 4.14 0.00 3.08 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 65 Y 8.19 4.07 0.00 3.03 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 66 N 8.49 4.28 0.00 2.90 2.97 0.00 0.00 7.22 9.28 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 67 D 8.24 4.40 0.00 2.76 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 68 S 7.88 4.11 0.00 3.68 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 69 V 7.86 3.56 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 1.10 0.00 0.00 0.82 0.00 0.00 70 L 7.87 4.32 0.00 1.78 1.75 1.02 0.83 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 71 S 7.53 4.65 0.00 3.96 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 72 Y 7.36 4.25 0.00 3.02 3.07 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 73 N 8.42 4.59 0.00 2.81 2.63 0.00 0.00 7.05 8.75 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 74 A 8.76 3.79 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.38 4.09 0.00 4.01 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 76 E 7.70 3.67 0.00 1.65 1.68 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 1.47 1.73 0.00 77 F 8.07 4.57 0.00 3.14 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 78 I 7.48 4.39 1.91 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 1.19 0.94 0.96 0.00 0.00 79 N 9.99 4.66 0.00 2.80 2.80 0.00 0.00 6.87 7.06 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 80 E 8.58 4.48 0.00 1.98 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 2.42 2.33 0.00 81 G 8.42 4.60 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 82 K 8.42 4.35 0.00 1.74 1.85 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.39 7.81 83 N 8.33 4.56 0.00 2.81 2.82 0.00 0.00 6.30 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.63 3.59 0.00 2.03 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 2.24 2.37 0.00 85 L 7.99 3.95 0.00 1.71 1.66 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 86 D 7.62 3.74 0.00 2.67 2.46 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 87 P 0.00 4.49 0.00 2.18 2.17 0.00 3.73 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 1.98 1.98 0.00 88 E 7.90 4.44 0.00 1.95 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 2.21 2.27 0.00 89 A 7.73 4.31 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 90 D 9.73 4.51 0.00 2.66 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 91 S 8.65 4.60 0.00 3.78 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 92 F 9.54 4.11 0.00 2.98 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 93 D 8.26 4.15 0.00 2.86 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.80 3.96 0.00 1.90 1.94 0.00 1.57 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.45 7.81 95 V 7.01 3.69 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.94 0.00 0.00 96 I 7.26 3.60 1.30 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 0.11 -0.36 0.62 0.00 0.00 97 L 7.43 3.78 0.00 1.77 1.57 0.83 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 98 P 0.00 4.22 0.00 1.99 1.94 0.00 3.53 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 2.06 2.11 0.00 99 I 7.50 3.58 1.88 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.86 0.97 0.00 0.00 100 A 8.06 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.37 3.97 0.00 3.82 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 0.00 102 M 8.07 3.87 0.00 2.27 1.86 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 103 F 8.58 3.84 0.00 3.29 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.20 3.61 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 0.99 0.00 0.00 0.94 0.00 0.00 105 K 8.10 3.93 0.00 1.77 1.57 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.48 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.05 1.43 7.81 106 S 8.13 3.97 0.00 3.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.57 3.97 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 1.16 0.00 0.00 1.19 0.00 0.00 108 E 8.49 4.13 0.00 2.09 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 2.57 2.53 0.00 109 T 7.99 3.98 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 1.20 0.00 0.00 110 F 8.30 4.23 0.00 3.48 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 0.00 111 D 8.68 4.10 0.00 3.09 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.85 4.06 0.00 2.09 1.93 1.01 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.33 3.11 0.00 1.10 1.51 0.17 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.65 4.38 0.00 2.92 2.88 0.00 0.00 6.71 7.49 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 0.00 115 Y 7.98 3.81 0.00 3.22 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 0.00 116 Y 8.26 4.11 0.00 3.15 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.47 3.88 0.00 1.82 1.76 0.86 0.62 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 0.00 118 T 7.96 4.26 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 119 Q 7.72 4.16 0.00 1.02 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.83 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 120 S 7.07 3.95 0.00 3.80 3.88 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 0.00 121 L 7.78 3.71 0.00 0.84 1.53 0.83 0.85 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 0.00 122 Q 7.25 3.91 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.57 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 123 K 7.84 3.91 0.00 1.89 1.84 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.56 7.81 124 E 8.14 3.92 0.00 2.14 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 2.47 2.39 0.00 125 I 8.25 3.73 2.01 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 1.54 0.63 0.95 0.00 0.00 126 L 7.92 4.01 0.00 1.83 1.71 0.92 0.79 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 0.00 127 S 8.11 4.12 0.00 3.86 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.12 4.28 0.00 1.85 1.82 0.00 1.68 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.66 7.81 129 T 7.59 4.45 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 1.18 0.00 0.00 130 L 8.14 3.56 0.00 1.77 1.78 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 131 N 7.89 4.75 0.00 2.84 2.74 0.00 0.00 7.23 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.52 4.15 0.00 2.09 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 2.41 2.34 0.00 133 D 8.07 4.52 0.00 2.99 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 0.00 134 L 7.96 4.65 0.00 1.87 1.84 0.92 0.71 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 0.00 135 T 7.44 4.64 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 1.29 0.00 0.00 136 L 8.58 4.27 0.00 1.62 1.62 0.87 0.97 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 0.00 137 T 7.75 4.11 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 1.24 0.00 0.00 138 A 8.46 4.06 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 8.11 4.01 0.00 2.16 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 140 S 7.95 4.09 0.00 4.14 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 0.00 141 I 7.67 3.71 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.65 0.92 0.00 0.00 142 L 7.90 3.97 0.00 2.02 1.72 0.94 0.91 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 0.00 143 A 8.17 4.02 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 I 8.01 3.77 2.14 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 1.72 1.03 1.11 0.00 0.00 145 D 8.66 4.56 0.00 2.87 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 0.00 146 D 8.27 4.43 0.00 2.98 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 0.00 147 T 8.20 3.95 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 148 Y 8.23 4.37 0.00 3.30 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.94 4.60 0.00 3.01 2.90 0.00 0.00 7.11 7.87 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 0.00 150 H 8.52 4.38 0.00 3.43 3.49 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 F 8.56 3.92 0.00 3.17 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 0.00 152 V 8.08 3.53 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.28 0.00 0.00 153 K 8.50 4.07 0.00 2.17 2.07 0.00 1.92 0.00 0.00 1.95 0.00 0.00 3.20 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.84 1.90 7.81 154 F 8.15 2.83 0.00 2.09 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 0.00 155 S 8.08 3.61 0.00 4.07 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 0.00 156 Q 8.21 3.84 0.00 2.07 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 157 W 8.18 3.98 0.00 3.48 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 0.00 158 M 7.34 3.06 0.00 1.71 1.68 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.02 0.00 159 I 7.18 3.60 1.92 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 1.36 0.53 0.80 0.00 0.00 160 E 8.26 3.90 0.00 1.95 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 2.34 2.43 0.00 161 S 7.74 4.06 0.00 3.85 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 L 7.21 4.37 0.00 1.53 1.61 0.46 0.95 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 0.00 163 R 7.51 3.74 0.00 1.90 1.95 0.00 3.13 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 164 I 7.82 4.21 1.77 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.46 0.86 0.00 0.00 165 G 7.68 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 0.00 0.00 0.00 166 S 8.13 4.53 0.00 3.93 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 0.00 167 N 8.66 4.53 0.00 2.76 2.94 0.00 0.00 7.64 6.74 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 0.00 168 L 7.53 4.20 0.00 1.59 1.69 0.90 0.85 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 0.00 169 L 7.57 4.61 0.00 1.51 1.56 0.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 170 D 7.57 4.51 0.00 2.87 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 0.00 171 L 8.18 4.66 0.00 1.59 1.51 0.85 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 172 E 9.28 3.95 0.00 2.03 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 2.33 2.38 0.00 173 V 7.77 3.77 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 0.32 0.00 0.00 1.19 0.00 0.00 174 V 7.43 3.35 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 1.07 0.00 0.00 0.54 0.00 0.00 175 Q 8.10 4.07 0.00 2.29 2.19 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 2.52 2.53 0.00 176 F 8.75 4.20 0.00 3.21 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 A 7.98 3.96 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 0.00 0.00 0.00 0.00 0.00 178 I 8.36 3.66 2.01 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 1.44 0.61 0.92 0.00 0.00 179 K 8.64 4.08 0.00 1.87 1.81 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.52 7.81 180 S 7.56 4.38 0.00 3.85 3.68 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 0.00 181 A 7.91 4.49 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 0.00 182 D 7.64 5.10 0.00 2.60 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 E 8.45 4.64 0.00 1.89 1.56 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 2.19 2.30 0.00 *192 D 9.25 4.47 0.00 2.67 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 0.00 193 N 7.77 4.65 0.00 2.94 2.97 0.00 0.00 5.75 7.84 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 0.00 194 I 7.43 3.55 1.67 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 1.10 0.77 0.21 0.00 0.00 195 F 7.57 4.95 0.00 3.18 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 L 8.46 3.93 0.00 1.78 1.44 1.02 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 197 Q 9.05 4.57 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.06 0.00 0.00 0.00 0.00 0.00 2.25 2.29 0.00 198 E 8.09 4.20 0.00 2.19 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 2.34 2.48 0.00 199 I 7.86 4.36 1.91 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 1.75 0.80 0.95 0.00 0.00 200 L 7.98 4.77 0.00 1.95 1.80 1.06 0.61 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 0.00 201 P 0.00 4.75 0.00 2.20 2.20 0.00 3.89 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.00 0.00 202 V 7.55 4.41 2.55 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 0.82 0.00 0.00 1.13 0.00 0.00 203 N 8.44 5.05 0.00 2.79 2.80 0.00 0.00 6.75 8.92 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 0.00 204 S 7.51 4.55 0.00 3.98 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 0.00 205 E 8.40 3.36 0.00 1.39 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 2.08 1.47 0.00 206 E 8.13 3.95 0.00 2.02 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 0.00 2.38 2.32 0.00 207 E 8.31 4.04 0.00 2.11 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 2.43 2.38 0.00 208 F 8.65 4.37 0.00 3.37 3.24 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 0.00 209 Q 8.58 4.30 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.58 2.65 0.00 210 T 7.92 3.86 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 211 L 7.91 3.88 0.00 1.62 1.01 1.21 0.59 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 0.00 212 S 7.97 4.17 0.00 4.34 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 0.00 213 A 8.23 3.94 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 0.00 214 A 7.74 3.77 1.08 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 0.00 215 W 7.96 3.81 0.00 3.23 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 0.00 216 H 8.52 3.88 0.00 3.29 3.45 0.00 5.58 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 7.72 4.04 0.00 3.83 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 0.00 218 I 7.62 3.52 1.75 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.33 0.70 0.00 0.00 219 L 8.15 3.79 0.00 1.35 1.23 -0.22 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 220 D 8.35 4.35 0.00 2.75 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 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 0.00 222 K 8.16 3.87 0.00 1.87 1.84 0.00 1.70 0.00 0.00 1.52 0.00 0.00 2.60 0.00 0.00 2.48 0.00 0.00 0.00 0.00 1.53 1.51 7.81 223 L 8.21 4.01 0.00 1.86 1.76 1.17 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 224 S 8.24 4.14 0.00 3.85 3.88 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 0.00 225 A 8.02 3.93 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 L 7.88 3.53 0.00 1.77 1.55 1.08 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 227 D 8.00 4.53 0.00 2.89 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 0.00 228 E 8.00 3.88 0.00 2.06 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 2.27 2.35 0.00 229 E 8.17 3.93 0.00 1.99 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 2.37 2.61 0.00 230 F 8.60 4.51 0.00 3.13 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 D 8.16 4.39 0.00 2.77 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 0.00 232 V 7.62 3.63 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 0.94 0.00 0.00 0.93 0.00 0.00 233 V 7.76 3.29 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 0.74 0.00 0.00 0.64 0.00 0.00 234 A 7.44 2.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 T 6.92 3.72 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 1.12 0.00 0.00 236 K 7.35 4.08 0.00 1.39 1.86 0.00 1.47 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.25 7.81 237 W 7.44 4.30 0.00 3.27 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 * Residues marked with a * may have inaccurate shift predictions.