NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.3087 8.3449 119.6282 55.7178 30.0425 174.4744 4 L 4.4794 7.9482 124.2344 54.0803 42.8545 175.3067 5 Q 4.7664 9.8249 124.3443 53.8878 30.0561 175.7094 6 K 3.5428 8.6555 122.9186 55.2484 32.9741 176.8839 7 R 3.8974 8.6867 124.9833 56.9018 30.3164 176.2443 8 K 4.2967 8.5539 125.4694 55.8558 33.0572 177.9923 9 I 3.5457 8.5373 124.1685 63.2560 38.3518 175.2060 10 Y 4.7558 7.2795 119.1058 57.0396 42.2090 173.4783 11 D 4.1729 8.4089 127.4629 52.8974 42.4129 175.5721 12 T 3.7162 7.7215 117.9406 64.1199 68.9351 175.7866 13 T 3.9356 7.9201 110.9900 62.6632 69.2765 174.3051 14 A 4.5859 7.3344 124.7045 50.3973 21.3776 176.1222 15 S 4.6424 7.9072 113.6654 56.7305 65.0034 175.2908 16 N 4.1223 8.5622 118.6073 56.1053 38.4791 176.0563 17 A 4.0432 7.5614 120.4662 51.1824 19.2560 177.0721 18 S 4.3604 8.2733 117.8887 58.5266 63.0402 174.0818 19 T 4.1794 8.0712 115.6603 62.0136 69.7451 175.0791 20 G 4.0059 7.5689 109.1888 44.9591 0.0000 174.7293 21 I 3.9481 8.9019 123.5757 63.5221 37.4407 176.6325 22 L 4.9109 7.3413 117.6977 54.1952 45.2526 175.5083 23 N 4.1868 8.9377 118.1817 54.3623 36.2218 174.2918 24 G 4.1819 7.5687 105.3510 44.1247 0.0000 173.3736 25 K 4.7640 8.7523 118.9901 54.5532 34.6678 176.0246 26 S 4.9942 8.2996 118.6021 56.8945 65.0265 174.1813 27 S 4.2338 8.7968 122.0222 59.5781 63.7958 175.4892 28 N 4.3598 7.9606 115.5470 53.0537 38.2635 173.4044 29 V 3.9451 7.4399 117.0007 61.8840 32.2314 174.7187 30 L 4.0062 8.2445 129.6715 53.4030 42.3604 174.9972 31 N 4.6326 8.0496 125.9448 51.4239 39.1803 175.4275 32 W 3.8267 8.4901 126.6275 59.2888 29.2296 176.9184 33 D 4.5992 7.7422 116.2452 54.5281 40.6454 176.5245 34 D 4.6952 7.7630 118.5910 52.0893 40.9807 174.4468 35 V 4.3585 7.2010 113.5703 58.5581 35.9744 176.1133 36 R 3.6155 8.3773 122.3257 58.4415 30.3769 176.8443 37 F 4.6850 7.3315 117.0478 55.2734 40.3881 176.6033 38 S 4.3540 8.7322 120.6790 60.0505 63.4105 175.0015 39 W 4.6731 7.8050 117.3869 57.7626 29.0975 178.2660 40 A 4.0848 7.8378 122.1916 55.5628 17.7538 178.9859 41 Y 4.3088 8.2270 117.6266 60.5662 39.0566 175.8372 42 P 4.1768 0.0000 0.0000 65.5033 31.1954 178.2744 43 L 4.0696 8.0709 118.2527 58.2651 42.1795 177.9012 44 Y 4.2717 8.0617 118.2588 60.8807 38.9806 178.0149 45 K 3.7735 8.0640 119.1869 59.3667 31.8541 179.5775 46 N 4.1626 7.9669 112.8603 54.1840 38.1301 176.4849 *48 L 4.0651 7.9382 124.6724 54.9896 43.7472 178.6234 49 A 4.0596 7.8927 120.2064 54.5014 18.3926 177.6038 50 N 4.8426 7.7303 111.8419 52.9456 38.7832 175.1383 51 F 4.1156 7.6439 121.5410 58.6880 39.7948 174.4465 52 W 4.6872 6.5911 122.1586 55.0993 30.9267 173.5784 53 T 4.0067 7.8087 113.8219 59.1001 69.4849 173.2197 54 P 4.2184 0.0000 0.0000 65.4939 31.3353 178.0570 55 F 4.0850 7.2277 116.0297 59.2701 38.7942 175.5950 56 E 4.4235 7.8904 118.6683 56.2620 29.6570 175.7545 57 I 4.3240 7.6142 121.4442 59.5936 38.2195 175.4277 58 N 4.7199 8.5145 124.4883 52.7615 40.8952 174.4573 *60 S 4.5470 8.4556 113.4970 59.0325 64.8098 176.4390 61 H 4.3827 7.9428 116.6645 58.7654 28.3622 177.5001 62 D 4.4080 8.1936 120.1980 57.3621 40.5260 178.4301 63 A 4.0024 7.9466 119.5614 55.2161 18.4939 179.3910 64 K 4.1072 7.7782 115.5806 59.5763 32.1303 179.1071 65 Q 4.1098 8.2181 119.9112 58.5285 28.9396 177.4900 66 F 4.1058 8.4359 122.3071 61.1155 39.1704 175.5323 67 P 4.1941 0.0000 0.0000 64.8100 31.2177 177.7636 68 T 4.1624 7.6253 107.0935 61.7728 69.3234 174.8846 69 L 4.1787 6.8672 122.2295 54.2936 42.4770 177.0241 70 T 4.1737 8.7078 111.8404 61.2009 70.8986 175.6538 71 E 3.8515 8.4386 120.4116 59.8933 29.3786 179.7584 72 T 3.8541 7.7645 115.2436 66.4714 68.5367 176.4070 73 E 4.1416 8.1052 120.4429 59.6423 29.5399 179.4809 74 Q 3.8821 8.2885 118.3778 59.0065 28.7220 178.7503 75 E 3.9400 8.7674 119.7639 59.1986 29.4400 179.2225 76 A 3.6636 8.1991 121.2174 54.7973 18.3715 179.2652 77 F 3.9646 8.1754 119.0882 61.5387 39.5450 177.4215 78 K 4.0769 8.3121 117.8808 59.6953 31.9337 179.5777 79 K 4.0539 8.0348 118.6144 59.3789 31.9363 179.6055 80 I 3.9238 7.9580 120.2873 64.4276 36.9775 178.5167 81 I 3.5469 7.8889 120.7655 64.1460 36.9820 178.2508 82 G 3.8953 7.9566 106.5541 48.0854 0.0000 175.0694 83 L 3.7778 8.0856 123.1049 57.6964 42.0112 179.2386 84 L 3.4876 7.5867 118.4592 57.3709 41.3496 179.2379 85 A 4.3983 7.9461 121.2209 55.2255 18.2550 179.3966 86 F 3.7779 8.1275 118.8273 61.3201 39.4618 177.0818 87 L 4.0300 8.2811 118.6054 58.3463 41.6256 179.5939 88 D 4.5387 8.7876 118.4416 57.0377 40.6991 179.0731 89 S 4.1087 8.1292 116.1063 61.7169 62.8554 176.8673 90 V 3.5666 7.5279 120.8521 65.9635 31.1188 177.8520 91 Q 4.2957 8.5899 119.8081 59.3525 28.6634 178.0710 92 T 3.8854 7.8678 116.2521 66.5996 68.5436 175.7856 93 D 4.4229 7.5549 117.2690 57.4763 41.2123 176.9750 94 Y 4.3557 8.3839 120.7890 60.7556 38.5314 179.4340 95 S 4.2697 8.2266 114.3958 58.5598 63.1915 176.5162 *97 R 4.1225 7.9664 121.2864 57.0548 31.7208 176.4270 98 A 3.7788 8.2837 120.0061 53.5980 18.9210 177.3903 99 A 3.8565 9.9148 125.4220 52.4596 15.1172 177.5290 100 E 4.4705 7.8845 120.5598 57.9948 34.3384 175.9481 101 Y 3.7859 7.9463 113.1746 58.5231 38.5384 175.3483 102 L 4.2728 7.9784 120.6698 55.0502 41.5677 176.9837 103 T 4.4754 8.5673 117.8565 61.6501 69.6076 175.2524 104 D 4.6142 7.7657 120.5075 52.9457 44.4557 174.3066 105 S 4.0200 8.6100 123.7943 61.7054 62.9060 176.8302 106 S 3.4731 8.0022 116.8637 61.2116 62.5074 176.6147 107 L 4.0508 8.0250 121.0666 57.2018 41.5320 178.6858 108 A 4.1398 7.9408 119.7614 55.1752 18.6330 179.1756 109 A 4.2465 8.0952 119.1840 55.1904 18.5283 181.1619 110 L 4.1477 8.1602 116.8052 55.1717 41.8105 179.3648 *112 S 4.4269 8.1168 115.6573 58.4086 64.4715 175.8745 113 V 3.7839 8.0468 119.5994 65.7597 31.2155 177.8422 114 L 3.9816 8.1540 120.1896 58.2076 41.9676 178.7922 115 S 4.3072 8.0885 113.9605 60.7021 62.3542 175.6307 116 F 4.1587 8.2528 123.0680 61.5209 39.0900 176.7918 117 Q 3.5303 8.2009 117.5136 59.2115 28.4916 179.1466 118 E 3.8437 8.1861 119.1456 59.3370 29.4096 179.6382 119 V 3.4960 7.5168 118.2262 66.0194 31.6084 178.3402 120 V 3.2233 7.2094 117.8481 65.9318 31.1062 177.6697 121 H 4.1066 8.0793 116.2630 58.9012 28.2041 177.2429 122 N 4.5725 8.3367 118.9321 56.9248 38.7761 176.6762 123 Q 4.0547 8.2492 120.9188 59.2512 28.9988 178.4195 124 S 4.0669 7.9188 116.3751 61.5833 62.8016 176.1951 125 Y 4.4268 7.5226 119.3829 61.2641 37.6149 178.6869 126 S 4.5225 8.2490 115.8120 61.6641 62.7165 176.0159 127 Y 3.9804 8.1172 121.5427 60.6221 38.9718 178.0701 128 V 3.7597 8.2059 119.1478 66.0980 31.6583 177.7664 129 L 4.0350 8.1019 118.8581 57.9981 41.3734 179.7621 130 S 4.3259 8.3563 113.7518 60.2709 62.9488 175.8074 131 S 4.3359 7.5443 117.4954 59.4824 63.0186 174.6808 132 L 4.5409 7.6565 118.9809 54.4513 43.8313 176.8176 133 V 4.5485 7.6416 110.1757 57.8980 35.2672 174.3734 134 P 4.4557 0.0000 0.0000 62.1454 33.2557 177.4696 135 K 3.8569 8.7629 120.7099 59.9104 31.9962 178.6122 136 A 4.0285 8.1203 120.2407 55.7116 18.2219 179.6895 137 T 3.8379 7.7589 113.3643 66.8498 68.3183 176.4277 138 Q 4.1206 8.5060 121.9194 59.5375 28.7584 178.3705 139 D 4.5953 8.5490 118.7743 57.5960 41.1707 178.3618 140 E 4.1946 8.2670 118.8482 59.5332 29.6123 179.3611 141 I 3.7318 8.2928 120.1587 64.5924 37.0658 178.0990 142 F 4.7291 8.3314 115.5089 59.0659 39.1980 176.2388 143 E 4.5334 8.5084 118.1987 56.1786 30.0362 176.7810 144 Y 4.4913 8.0571 121.0436 60.8863 38.6205 178.1437 145 W 3.9985 8.4555 115.2909 59.4872 27.9818 177.4720 146 K 3.2628 6.6362 118.8547 57.9121 31.5286 176.9218 147 H 4.6283 7.7934 113.7939 55.9159 31.3330 173.5150 148 D 4.6728 8.1065 120.2686 53.4891 41.5174 176.7550 149 D 4.3200 8.7410 127.1163 57.0253 40.8388 178.9859 150 V 3.3778 7.6855 118.6248 65.8889 31.6329 177.6098 151 L 3.6363 8.6436 120.5440 57.7454 41.7457 178.7316 152 K 3.7200 8.0362 119.6316 59.4550 32.2654 178.1420 153 E 3.8954 8.0595 119.6604 59.4401 29.1980 179.1210 154 R 3.8967 7.7007 115.4867 59.2416 29.4740 178.4995 155 N 4.2291 8.0606 117.2603 56.1768 38.3941 177.2896 156 E 3.9858 8.6346 120.2540 58.8327 28.9719 178.9447 157 F 4.1500 8.1476 120.9567 61.5437 39.5056 177.1905 158 I 3.4599 7.5721 118.7231 64.3934 36.8262 178.5467 159 I 3.5787 7.8273 120.6954 64.2834 36.9118 177.8874 160 D 4.2945 8.3025 119.3598 57.1649 41.0307 178.6589 161 G 2.2452 6.7960 105.2267 47.6874 0.0000 175.2841 162 Y 4.2049 7.3391 119.7937 60.7126 37.8214 178.7864 163 E 4.0664 8.5033 119.6969 59.1125 29.4981 179.4023 164 K 4.0400 8.1033 121.2578 59.9940 31.8268 180.0501 *165 F 4.0402 7.4568 118.5576 61.7863 38.0972 179.7134 166 V 3.9972 7.6394 117.9431 66.0825 31.4970 177.6303 167 D 4.7648 8.5298 117.4756 55.5970 41.5630 176.0378 168 N 4.7044 8.0774 117.1353 50.8342 39.1899 169.8519 169 P 4.3707 0.0000 0.0000 61.5123 32.0452 176.1050 170 T 4.6632 8.1489 113.2106 58.5542 73.5039 172.7944 171 P 3.9472 0.0000 0.0000 64.9557 30.9841 179.0794 172 K 3.8093 7.6868 118.6080 59.6728 32.3653 178.9463 173 T 3.8746 7.5378 109.7755 64.2549 68.6825 176.5500 174 F 4.0324 8.2901 123.8863 61.1871 39.3970 176.7041 175 L 4.1291 7.9770 119.8210 58.4431 41.6809 178.8256 176 E 4.1861 8.4445 118.7130 59.5545 29.3375 179.5638 177 S 4.3451 8.3501 114.1999 61.3448 63.0108 176.5573 178 I 3.7016 7.9778 123.7339 64.1358 36.8987 178.3822 179 V 3.4982 7.8207 119.2207 66.3331 31.3767 177.6886 180 Y 3.7723 7.8889 116.5268 60.8770 37.5650 178.0911 181 D 4.7511 8.4316 120.6456 56.9531 41.1921 178.5201 182 V 3.5631 7.8044 118.6458 66.0626 31.3358 178.0899 183 I 3.6611 7.5401 119.4910 64.0276 36.7593 178.1884 184 L 3.9941 7.9832 121.2174 58.3687 41.8219 178.7722 185 E 4.2398 8.5584 117.2721 57.9706 29.7212 177.6913 186 G 3.9694 8.2665 105.9620 45.3644 0.0000 173.7162 187 L 4.5359 7.8318 119.4176 56.3395 44.6590 178.0075 188 N 4.5380 8.4973 117.2959 56.1137 38.4906 177.6301 189 F 3.6354 8.1480 118.9935 60.3830 38.3773 177.4858 190 Y 3.6814 8.0039 116.2214 60.5840 37.8243 177.8519 191 S 4.3906 8.2335 114.1410 61.4089 62.7414 176.1358 192 G 3.9446 7.7712 108.5400 48.2256 0.0000 175.1826 193 F 4.4092 7.6441 119.8907 60.2425 38.8122 177.3725 194 A 4.1143 8.1218 120.1295 55.4802 18.2357 179.4070 195 F 4.1102 7.9190 117.7189 61.6439 39.4408 177.4241 196 F 4.0193 7.9233 116.8022 60.6749 38.6390 177.2030 197 Y 4.6102 8.2328 116.6673 61.1267 37.5314 177.9452 198 N 4.1339 8.8199 118.3025 56.4981 38.9989 176.9700 199 L 3.8459 7.6596 119.6718 57.8076 41.7951 179.3013 200 A 4.2568 8.3755 122.2597 54.5629 18.1184 179.6991 201 R 4.0334 8.1752 113.2592 58.3343 29.4611 177.6606 202 N 4.7388 7.7653 116.3475 52.2139 39.2831 174.4338 203 Q 3.5232 7.9864 117.2391 57.4151 27.0993 174.4957 204 K 4.9871 7.5595 110.7931 54.1715 32.7226 177.2286 *206 V 4.1508 7.4137 120.2619 63.0256 33.8454 177.4687 207 S 4.2723 8.4829 115.2034 61.6855 62.9589 175.7231 208 T 4.0602 8.5922 116.7494 66.6363 68.6328 175.6472 209 S 4.2813 8.2606 115.6066 61.7377 62.8357 176.2584 210 T 3.9024 7.8022 113.1122 64.5485 67.6202 175.8963 *212 I 3.9320 7.7655 125.0556 61.3287 39.2980 177.6090 213 N 4.2890 7.8744 119.6589 56.0611 38.7367 176.6113 214 Y 3.7189 7.2779 118.0834 60.8563 37.6449 178.5492 215 I 3.6223 7.1623 120.0996 64.4068 37.2744 177.6026 216 N 4.0087 7.7038 117.9696 56.6377 38.3049 176.7330 217 R 3.8681 7.9013 119.8388 59.6034 30.2629 178.2249 218 D 4.3681 8.0487 118.2030 57.4110 40.8430 178.3957 219 E 3.9878 8.6137 120.1211 59.2919 29.7590 178.6479 220 Q 4.3559 8.2278 119.5051 58.6319 28.8266 179.2416 221 L 4.2503 7.7375 119.2981 57.8297 41.6635 179.2267 222 H 4.3805 8.3374 116.3116 59.0602 28.6878 177.9251 223 V 3.8125 8.1576 120.0527 66.1543 31.3410 177.4074 224 Y 4.0237 8.0040 118.8663 60.4674 38.6671 177.7756 225 L 3.6599 8.2101 121.2205 58.2507 42.2049 179.0094 226 F 4.2553 8.2497 117.9295 60.7612 38.8298 177.8553 227 T 3.9016 8.4533 109.9604 64.7819 68.5210 176.4085 228 N 3.9427 7.8033 119.2574 55.8915 38.2687 177.3647 229 I 3.7248 7.7465 121.1473 64.2970 37.3744 177.9341 230 F 4.1412 8.5107 121.5918 61.6873 39.0449 177.4720 231 K 4.1428 8.2900 117.7803 59.5174 31.7198 179.3197 232 E 4.1142 8.3771 119.0308 59.2642 29.2760 179.3235 233 L 4.1897 8.3564 119.5197 57.8269 41.4500 179.5309 234 L 3.9918 7.5720 117.7773 57.4703 41.5411 179.4879 235 V 3.7379 7.3995 117.7120 66.1536 31.6269 177.7360 236 E 3.9541 8.3076 117.2402 57.7367 30.6966 177.3812 237 F 4.9370 8.2038 118.1068 54.4000 39.1547 173.8514 238 P 4.3829 0.0000 0.0000 65.1957 31.7880 179.3112 239 E 3.9906 8.4318 118.0692 59.5249 29.3813 178.2287 240 L 4.1508 8.0562 117.1620 56.7222 42.1489 177.5640 241 N 4.6657 7.7689 118.8710 52.5250 37.1701 173.7320 242 T 4.7847 7.4001 112.5448 58.6469 73.8826 174.5962 243 E 4.0089 8.6173 120.1549 59.3382 29.3277 179.1206 244 E 3.9607 8.1966 118.9677 59.7093 29.7532 178.8345 245 T 3.9633 7.8147 115.1513 66.6239 68.5253 176.6517 246 K 4.0334 8.0228 119.9016 59.9430 32.0372 179.4846 247 T 3.8801 8.3382 116.2929 66.4683 68.2569 176.3891 248 F 4.1013 8.5226 122.6837 61.3544 39.4476 177.3443 249 V 3.3653 8.0242 117.7517 65.7285 31.1014 177.8680 250 K 3.7480 7.7060 118.0700 59.8976 32.1541 178.6574 251 T 3.9178 7.7686 114.9035 66.8078 68.5987 176.6914 252 T 3.9438 7.7059 117.9059 66.1998 68.2539 177.6341 253 L 4.1462 7.5852 119.4252 54.8532 41.5466 179.0585 *255 K 3.9937 8.1168 121.9956 56.3662 34.2208 177.5127 256 A 3.5235 8.0114 120.2616 54.9359 18.1506 179.5061 257 A 3.9039 8.2454 119.5625 55.3722 18.5111 179.5195 258 D 4.2702 7.9973 116.9016 57.6064 40.8914 178.9809 259 L 3.9300 7.7298 119.4090 57.6010 41.0842 179.2122 260 E 3.9891 8.1877 119.3291 59.2181 29.6271 179.0265 261 K 4.1420 8.3050 118.6961 59.5181 32.1266 178.9724 262 D 4.4063 8.2305 119.1460 57.1574 40.8005 178.6842 263 W 4.3070 8.4624 128.7871 60.5031 30.6989 177.6100 264 F 3.8888 8.6815 120.6981 61.5188 38.6311 177.3360 265 R 3.7878 8.2384 117.5353 59.1748 29.5546 178.5035 266 Y 4.1026 7.8765 118.9728 60.3734 38.9187 177.4044 267 I 3.5647 6.9790 111.7248 61.4963 38.4142 175.6987 268 I 3.9913 6.9182 118.9989 62.4452 40.0501 176.0219 269 G 3.5897 5.9309 110.2827 47.1943 0.0000 173.8222 270 D 4.8525 8.6604 123.8369 53.0250 39.3565 177.2722 271 K 4.1430 7.8085 118.2434 57.4500 32.5353 176.8089 272 I 4.4082 7.3980 120.1780 58.3819 38.9607 173.0176 273 P 4.2942 0.0000 0.0000 64.2619 31.5235 176.8858 274 G 4.1086 9.8711 110.2662 46.3501 0.0000 173.8842 275 I 4.7703 7.2031 111.8032 58.8931 37.1300 174.6173 276 N 4.6390 7.9773 123.4822 52.6936 38.3969 175.5025 277 P 4.4781 0.0000 0.0000 66.4631 32.1777 178.3245 278 E 4.1601 7.9752 112.4684 59.1434 29.7596 183.4412 279 D 4.6312 8.2608 119.2458 54.5117 40.5803 178.5273 *281 E 4.1950 8.3814 120.1561 56.8526 31.5922 178.5371 282 T 3.8302 7.9072 115.2944 66.7577 68.3373 176.0384 283 Y 4.2317 8.3382 121.6779 60.7934 38.7885 178.2234 284 I 3.5337 7.6819 120.2372 64.3400 37.2046 178.3886 285 S 3.9391 7.8675 115.9990 61.4291 62.6347 176.3145 286 F 4.0179 8.4721 123.6643 61.5935 39.0691 177.2993 287 I 3.4062 7.8140 119.0347 64.0604 36.8256 178.2473 288 A 3.8858 8.0313 121.6819 55.1407 18.2110 179.3138 289 N 4.1231 8.2205 115.0802 56.3517 38.6135 177.4438 290 K 3.6416 7.5337 120.7295 59.5961 32.2226 179.0565 291 R 3.7674 7.9402 118.0542 59.0100 29.6817 178.8939 292 A 3.8390 7.6698 119.9293 54.9784 18.5461 179.5911 293 V 3.6131 7.8054 116.8316 66.2500 31.4093 178.3684 294 Q 3.9495 7.9133 116.6803 58.5631 28.5944 177.9635 295 L 4.1000 7.6087 117.6843 54.0568 42.8188 176.2208 296 G 3.5696 7.7764 106.6511 46.1243 0.0000 173.6723 *298 E 4.0236 7.6922 116.7306 55.2253 31.0676 175.1747 299 K 4.0064 8.4179 124.9226 55.8645 32.6224 175.6932 300 P 4.0523 0.0000 0.0000 64.9183 32.2222 176.1989 301 Y 4.9885 7.8988 116.0499 55.3812 37.8744 174.4296 302 P 4.2771 0.0000 0.0000 65.6039 31.8614 178.4775 303 E 3.9804 8.2190 115.6751 58.2920 29.7105 176.7144 304 I 4.2220 7.9532 120.9941 60.2425 36.2174 175.1365 305 K 4.4632 8.4728 124.5501 56.4648 33.4546 176.7649 306 H 4.9233 7.8621 114.6540 53.3914 31.9723 172.5994 307 N 3.4220 8.0944 121.9977 52.4620 38.9290 173.4500 308 P 4.4859 0.0000 0.0000 62.7740 31.7610 177.1203 *310 K 4.1993 7.9613 119.0869 56.9728 34.3027 178.4733 311 W 4.3319 8.2824 114.9114 59.4977 27.7982 177.3364 312 I 3.2935 6.7280 120.9948 64.3997 36.7145 176.5991 313 R 4.0686 7.8135 122.8661 56.4047 29.0907 179.6761 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 3 Q 8.34 4.31 0.00 1.94 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.88 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 4 L 7.95 4.48 0.00 1.41 1.74 0.71 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 9.82 4.77 0.00 1.82 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.87 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 6 K 8.66 3.54 0.00 1.46 1.47 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.30 1.17 7.81 7 R 8.69 3.90 0.00 1.84 1.81 0.00 3.44 0.00 0.00 3.33 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 8 K 8.55 4.30 0.00 1.81 1.70 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.73 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.52 1.00 7.81 9 I 8.54 3.55 1.86 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 1.28 0.62 0.94 0.00 0.00 10 Y 7.28 4.76 0.00 2.59 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 D 8.41 4.17 0.00 2.64 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.72 3.72 4.09 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 0.82 0.00 0.00 13 T 7.92 3.94 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 1.14 0.00 0.00 14 A 7.33 4.59 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 7.91 4.64 0.00 3.92 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 16 N 8.56 4.12 0.00 2.77 2.88 0.00 0.00 6.92 7.35 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 17 A 7.56 4.04 1.14 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 0.00 0.00 18 S 8.27 4.36 0.00 3.73 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.07 4.18 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 1.18 0.00 0.00 20 G 7.57 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 21 I 8.90 3.95 2.06 0.00 0.00 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 1.54 0.94 0.97 0.00 0.00 22 L 7.34 4.91 0.00 1.92 1.46 0.42 0.41 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 23 N 8.94 4.19 0.00 2.99 2.94 0.00 0.00 6.88 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.57 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 0.00 0.00 0.00 25 K 8.75 4.76 0.00 1.55 1.63 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.44 7.81 26 S 8.30 4.99 0.00 3.87 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 27 S 8.80 4.23 0.00 3.83 4.14 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 28 N 7.96 4.36 0.00 2.96 3.22 0.00 0.00 7.07 7.59 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 29 V 7.44 3.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.94 0.00 0.00 30 L 8.24 4.01 0.00 1.31 1.32 -0.08 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.05 4.63 0.00 2.71 2.53 0.00 0.00 7.16 7.95 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 32 W 8.49 3.83 0.00 2.88 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 0.00 0.00 0.00 0.00 33 D 7.74 4.60 0.00 2.56 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 34 D 7.76 4.70 0.00 2.47 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 7.20 4.36 1.85 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 0.47 0.00 0.00 0.93 0.00 0.00 36 R 8.38 3.62 0.00 1.38 1.46 0.00 3.00 0.00 0.00 2.68 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.13 0.00 37 F 7.33 4.69 0.00 2.27 1.60 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 38 S 8.73 4.35 0.00 4.08 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 39 W 7.81 4.67 0.00 3.83 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.84 4.08 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 41 Y 8.23 4.31 0.00 3.22 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 42 P 0.00 4.18 0.00 2.36 2.16 0.00 3.96 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.27 0.00 43 L 8.07 4.07 0.00 2.23 2.33 1.14 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 44 Y 8.06 4.27 0.00 2.77 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 45 K 8.06 3.77 0.00 1.80 1.66 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.12 1.08 7.81 46 N 7.97 4.16 0.00 3.07 2.83 0.00 0.00 6.65 6.32 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 *48 L 7.94 4.07 0.00 1.25 1.47 0.75 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.89 4.06 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 50 N 7.73 4.84 0.00 2.83 3.03 0.00 0.00 6.89 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 7.64 4.12 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 52 W 6.59 4.69 0.00 2.70 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 0.00 0.00 0.00 0.00 53 T 7.81 4.01 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 54 P 0.00 4.22 0.00 0.98 2.05 0.00 3.29 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.57 0.00 55 F 7.23 4.09 0.00 3.05 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 56 E 7.89 4.42 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 57 I 7.61 4.32 2.07 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 1.27 0.58 1.05 0.00 0.00 58 N 8.51 4.72 0.00 2.76 2.81 0.00 0.00 7.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *60 S 8.46 4.55 0.00 3.87 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 61 H 7.94 4.38 0.00 3.22 3.35 0.00 5.62 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 62 D 8.19 4.41 0.00 2.83 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 7.95 4.00 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 64 K 7.78 4.11 0.00 2.20 1.92 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.47 1.31 7.81 65 Q 8.22 4.11 0.00 2.33 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 66 F 8.44 4.11 0.00 3.12 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 67 P 0.00 4.19 0.00 2.03 2.07 0.00 3.98 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.21 0.00 68 T 7.63 4.16 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 1.18 0.00 0.00 69 L 6.87 4.18 0.00 1.36 1.71 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.71 4.17 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 1.16 0.00 0.00 71 E 8.44 3.85 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 1.97 0.00 72 T 7.76 3.85 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 1.10 0.00 0.00 73 E 8.11 4.14 0.00 2.27 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 0.00 2.40 2.37 0.00 74 Q 8.29 3.88 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 1.23 2.19 0.00 75 E 8.77 3.94 0.00 1.80 1.84 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 2.47 2.36 0.00 76 A 8.20 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 F 8.18 3.96 0.00 3.72 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 78 K 8.31 4.08 0.00 2.05 1.86 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.26 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.61 1.99 7.81 79 K 8.03 4.05 0.00 1.82 2.12 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.35 7.81 80 I 7.96 3.92 1.85 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 1.54 0.49 1.02 0.00 0.00 81 I 7.89 3.55 2.00 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 1.74 0.99 0.88 0.00 0.00 82 G 7.96 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 8.09 3.78 0.00 1.52 1.75 0.34 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.59 3.49 0.00 0.68 0.81 0.73 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.95 4.40 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 86 F 8.13 3.78 0.00 3.12 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 87 L 8.28 4.03 0.00 1.99 2.10 0.72 1.17 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 88 D 8.79 4.54 0.00 3.25 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 89 S 8.13 4.11 0.00 3.82 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 90 V 7.53 3.57 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 1.04 0.00 0.00 0.14 0.00 0.00 91 Q 8.59 4.30 0.00 2.44 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.55 0.00 0.00 0.00 0.00 0.00 2.51 2.64 0.00 92 T 7.87 3.89 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 1.29 0.00 0.00 93 D 7.55 4.42 0.00 2.71 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 94 Y 8.38 4.36 0.00 2.75 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 95 S 8.23 4.27 0.00 4.15 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 0.00 *97 R 7.97 4.12 0.00 1.94 1.99 0.00 3.28 0.00 0.00 3.33 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 98 A 8.28 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 9.91 3.86 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 0.00 100 E 7.88 4.47 0.00 1.87 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.07 0.00 101 Y 7.95 3.79 0.00 3.16 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.98 4.27 0.00 1.68 1.67 1.02 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.57 4.48 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 1.25 0.00 0.00 104 D 7.77 4.61 0.00 2.70 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 0.00 0.00 0.00 0.00 105 S 8.61 4.02 0.00 3.64 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 0.00 106 S 8.00 3.47 0.00 3.63 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.03 4.05 0.00 1.69 1.84 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.94 4.14 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 0.00 109 A 8.10 4.25 1.53 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 0.00 0.00 110 L 8.16 4.15 0.00 2.04 1.87 1.23 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 *112 S 8.12 4.43 0.00 3.93 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 8.05 3.78 2.41 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 1.07 0.00 0.00 1.25 0.00 0.00 114 L 8.15 3.98 0.00 1.90 1.66 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.09 4.31 0.00 3.97 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 F 8.25 4.16 0.00 3.20 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 0.00 117 Q 8.20 3.53 0.00 2.37 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.55 0.00 0.00 0.00 0.00 0.00 2.45 2.88 0.00 118 E 8.19 3.84 0.00 2.15 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 2.58 2.54 0.00 119 V 7.52 3.50 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 0.95 0.00 0.00 0.99 0.00 0.00 120 V 7.21 3.22 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 -0.02 0.00 0.00 0.05 0.00 0.00 121 H 8.08 4.11 0.00 3.37 3.36 0.00 5.69 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 8.34 4.57 0.00 3.02 3.01 0.00 0.00 6.92 7.50 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 0.00 123 Q 8.25 4.05 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 124 S 7.92 4.07 0.00 3.90 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 7.52 4.43 0.00 3.29 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 0.00 126 S 8.25 4.52 0.00 4.22 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 0.00 127 Y 8.12 3.98 0.00 2.88 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 0.00 128 V 8.21 3.76 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.11 0.00 0.00 129 L 8.10 4.03 0.00 2.06 1.82 0.94 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.36 4.33 0.00 3.98 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 7.54 4.34 0.00 3.89 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 0.00 132 L 7.66 4.54 0.00 1.23 0.99 0.52 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.64 4.55 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 0.57 0.00 0.00 0.98 0.00 0.00 134 P 0.00 4.46 0.00 2.18 1.99 0.00 3.66 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 2.14 2.16 0.00 135 K 8.76 3.86 0.00 1.85 1.86 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.58 7.81 136 A 8.12 4.03 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 0.00 137 T 7.76 3.84 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 1.25 0.00 0.00 138 Q 8.51 4.12 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.79 0.00 0.00 0.00 0.00 0.00 2.66 2.76 0.00 139 D 8.55 4.60 0.00 2.96 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 0.00 140 E 8.27 4.19 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 141 I 8.29 3.73 2.01 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 1.49 1.16 0.87 0.00 0.00 142 F 8.33 4.73 0.00 3.33 3.28 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 0.00 143 E 8.51 4.53 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 144 Y 8.06 4.49 0.00 3.08 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 0.00 145 W 8.46 4.00 0.00 3.21 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 0.00 146 K 6.64 3.26 0.00 0.79 1.33 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.84 0.78 7.81 147 H 7.79 4.63 0.00 3.13 3.30 0.00 5.94 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 D 8.11 4.67 0.00 2.99 2.44 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 0.00 149 D 8.74 4.32 0.00 2.82 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 0.00 150 V 7.69 3.38 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.05 0.00 0.00 151 L 8.64 3.64 0.00 1.56 1.46 0.08 -0.39 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 0.00 152 K 8.04 3.72 0.00 1.93 1.89 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.61 1.44 7.81 153 E 8.06 3.90 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 154 R 7.70 3.90 0.00 1.91 2.02 0.00 2.51 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.36 0.00 155 N 8.06 4.23 0.00 2.60 2.44 0.00 0.00 7.01 7.18 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 0.00 156 E 8.63 3.99 0.00 2.04 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 2.37 2.42 0.00 157 F 8.15 4.15 0.00 3.11 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 I 7.57 3.46 1.95 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 1.66 1.09 0.28 0.00 0.00 159 I 7.83 3.58 1.88 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 1.74 1.10 0.96 0.00 0.00 160 D 8.30 4.29 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 0.00 161 G 6.80 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 0.00 0.00 0.00 0.00 0.00 0.00 162 Y 7.34 4.20 0.00 2.78 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 0.00 163 E 8.50 4.07 0.00 2.04 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 2.47 0.00 164 K 8.10 4.04 0.00 1.99 1.82 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.46 1.33 7.81 *165 F 7.46 4.04 0.00 2.43 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 V 7.64 4.00 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 1.04 0.00 0.00 1.07 0.00 0.00 167 D 8.53 4.76 0.00 2.74 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 0.00 168 N 8.08 4.70 0.00 2.57 2.73 0.00 0.00 7.22 7.25 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 0.00 169 P 0.00 4.37 0.00 0.55 1.93 0.00 3.61 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.87 0.00 170 T 8.15 4.66 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 1.12 0.00 0.00 171 P 0.00 3.95 0.00 1.51 0.77 0.00 3.37 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.52 0.00 172 K 7.69 3.81 0.00 1.69 1.68 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.36 7.81 173 T 7.54 3.87 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 1.20 0.00 0.00 174 F 8.29 4.03 0.00 3.18 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 0.00 175 L 7.98 4.13 0.00 1.96 1.82 0.30 0.78 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 0.00 176 E 8.44 4.19 0.00 2.19 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 1.47 2.14 0.00 177 S 8.35 4.35 0.00 3.98 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 I 7.98 3.70 2.32 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.57 1.24 0.00 0.00 179 V 7.82 3.50 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 0.79 0.00 0.00 1.24 0.00 0.00 180 Y 7.89 3.77 0.00 3.23 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 0.00 181 D 8.43 4.75 0.00 2.26 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 V 7.80 3.56 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 0.96 0.00 0.00 0.93 0.00 0.00 183 I 7.54 3.66 1.97 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.26 0.95 0.00 0.00 184 L 7.98 3.99 0.00 1.79 1.86 1.16 0.81 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 0.00 185 E 8.56 4.24 0.00 2.08 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 2.36 2.67 0.00 186 G 8.27 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 L 7.83 4.54 0.00 1.62 1.78 0.84 0.63 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 0.00 188 N 8.50 4.54 0.00 3.04 2.72 0.00 0.00 6.58 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 F 8.15 3.64 0.00 3.18 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 Y 8.00 3.68 0.00 3.20 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 0.00 191 S 8.23 4.39 0.00 3.98 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 0.00 192 G 7.77 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 F 7.64 4.41 0.00 2.98 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 0.00 0.00 0.00 194 A 8.12 4.11 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 F 7.92 4.11 0.00 3.22 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 0.00 196 F 7.92 4.02 0.00 3.07 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 0.00 197 Y 8.23 4.61 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 0.00 198 N 8.82 4.13 0.00 3.14 2.96 0.00 0.00 7.19 6.37 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 0.00 199 L 7.66 3.85 0.00 1.91 1.89 1.02 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 200 A 8.38 4.26 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 0.00 201 R 8.18 4.03 0.00 1.84 2.12 0.00 2.21 0.00 0.00 2.67 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.39 0.00 202 N 7.77 4.74 0.00 2.77 2.79 0.00 0.00 7.02 7.21 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 0.00 203 Q 7.99 3.52 0.00 2.44 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.15 7.29 0.00 0.00 0.00 0.00 0.00 2.30 2.18 0.00 204 K 7.56 4.99 0.00 1.90 1.74 0.00 1.93 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.53 7.81 *206 V 7.41 4.15 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 1.03 0.00 0.00 0.97 0.00 0.00 207 S 8.48 4.27 0.00 4.22 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 0.00 208 T 8.59 4.06 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 209 S 8.26 4.28 0.00 4.01 4.14 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 0.00 210 T 7.80 3.90 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 *212 I 7.77 3.93 1.78 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.14 0.62 0.00 0.00 213 N 7.87 4.29 0.00 2.85 2.51 0.00 0.00 6.96 7.18 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 0.00 214 Y 7.28 3.72 0.00 1.50 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 I 7.16 3.62 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.60 1.10 0.00 0.00 216 N 7.70 4.01 0.00 1.44 2.43 0.00 0.00 6.91 8.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 R 7.90 3.87 0.00 1.93 2.06 0.00 3.18 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 218 D 8.05 4.37 0.00 3.11 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 0.00 219 E 8.61 3.99 0.00 2.44 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.78 0.00 220 Q 8.23 4.36 0.00 2.46 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.68 2.71 0.00 221 L 7.74 4.25 0.00 2.07 1.88 0.98 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 222 H 8.34 4.38 0.00 3.61 3.95 0.00 5.64 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 0.00 223 V 8.16 3.81 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 1.05 0.00 0.00 1.09 0.00 0.00 224 Y 8.00 4.02 0.00 3.14 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 0.00 225 L 8.21 3.66 0.00 1.87 1.76 1.15 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 226 F 8.25 4.26 0.00 3.17 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 0.00 227 T 8.45 3.90 4.37 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 1.18 0.00 0.00 228 N 7.80 3.94 0.00 1.98 1.74 0.00 0.00 6.99 6.77 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 0.00 229 I 7.75 3.72 2.17 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 1.52 0.88 1.20 0.00 0.00 230 F 8.51 4.14 0.00 3.23 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 K 8.29 4.14 0.00 1.88 1.89 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.13 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.61 1.68 7.81 232 E 8.38 4.11 0.00 2.17 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 0.00 2.52 2.25 0.00 233 L 8.36 4.19 0.00 1.84 1.82 1.25 1.06 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 0.00 234 L 7.57 3.99 0.00 1.75 1.71 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.40 3.74 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 0.84 0.00 0.00 0.98 0.00 0.00 236 E 8.31 3.95 0.00 1.89 1.14 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 2.19 2.47 0.00 237 F 8.20 4.94 0.00 3.10 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 0.00 238 P 0.00 4.38 0.00 2.22 2.32 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 239 E 8.43 3.99 0.00 2.00 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 2.36 2.46 0.00 240 L 8.06 4.15 0.00 1.71 1.66 0.82 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 241 N 7.77 4.67 0.00 2.69 2.89 0.00 0.00 6.94 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 T 7.40 4.78 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 1.29 0.00 0.00 243 E 8.62 4.01 0.00 2.02 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 0.00 2.41 2.32 0.00 244 E 8.20 3.96 0.00 2.05 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 2.40 2.44 0.00 245 T 7.81 3.96 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 246 K 8.02 4.03 0.00 2.06 1.88 0.00 1.88 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.68 7.81 247 T 8.34 3.88 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 1.23 0.00 0.00 248 F 8.52 4.10 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 0.00 249 V 8.02 3.37 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.21 0.00 0.00 250 K 7.71 3.75 0.00 1.93 1.81 0.00 1.76 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.25 1.49 7.81 251 T 7.77 3.92 4.14 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 1.17 0.00 0.00 252 T 7.71 3.94 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 253 L 7.59 4.15 0.00 1.72 1.55 0.82 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 *255 K 8.12 3.99 0.00 1.96 1.77 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.02 7.81 256 A 8.01 3.52 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 0.00 257 A 8.25 3.90 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 D 8.00 4.27 0.00 2.77 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 0.00 259 L 7.73 3.93 0.00 1.58 1.53 0.21 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 260 E 8.19 3.99 0.00 2.15 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 2.33 2.48 0.00 261 K 8.31 4.14 0.00 1.99 1.88 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.98 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.43 1.59 7.81 262 D 8.23 4.41 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 W 8.46 4.31 0.00 3.42 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 F 8.68 3.89 0.00 3.32 3.29 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 0.00 265 R 8.24 3.79 0.00 2.09 1.97 0.00 3.22 0.00 0.00 3.33 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.97 0.00 266 Y 7.88 4.10 0.00 2.83 2.93 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 0.00 267 I 6.98 3.56 1.28 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.10 -0.36 0.00 0.00 268 I 6.92 3.99 0.70 0.00 0.00 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 0.97 0.20 0.75 0.00 0.00 269 G 5.93 3.59 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 0.00 270 D 8.66 4.85 0.00 2.79 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 271 K 7.81 4.14 0.00 1.81 1.82 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.31 7.81 272 I 7.40 4.41 1.95 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.96 0.00 0.00 273 P 0.00 4.29 0.00 1.99 1.97 0.00 3.62 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 2.00 2.07 0.00 274 G 9.87 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 275 I 7.20 4.77 2.11 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.96 1.17 0.00 0.00 276 N 7.98 4.64 0.00 3.02 3.03 0.00 0.00 5.86 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 277 P 0.00 4.48 0.00 2.34 2.55 0.00 3.85 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 278 E 7.98 4.16 0.00 1.98 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 2.24 2.16 0.00 279 D 8.26 4.63 0.00 2.75 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 *281 E 8.38 4.19 0.00 2.23 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 2.28 2.46 0.00 282 T 7.91 3.83 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 283 Y 8.34 4.23 0.00 3.03 2.93 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 0.00 284 I 7.68 3.53 1.92 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 1.62 0.44 0.89 0.00 0.00 285 S 7.87 3.94 0.00 3.86 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 0.00 286 F 8.47 4.02 0.00 3.17 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 0.00 287 I 7.81 3.41 1.62 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.24 0.72 0.00 0.00 288 A 8.03 3.89 1.44 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 0.00 0.00 0.00 289 N 8.22 4.12 0.00 2.67 2.70 0.00 0.00 6.68 7.93 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 0.00 290 K 7.53 3.64 0.00 1.30 1.60 0.00 1.51 0.00 0.00 1.48 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.24 1.29 7.81 291 R 7.94 3.77 0.00 1.71 1.81 0.00 3.19 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 292 A 7.67 3.84 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 0.00 293 V 7.81 3.61 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 1.05 0.00 0.00 0.91 0.00 0.00 294 Q 7.91 3.95 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 295 L 7.61 4.10 0.00 1.52 1.06 0.52 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 296 G 7.78 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *298 E 7.69 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 2.17 2.26 0.00 299 K 8.42 4.01 0.00 1.72 1.84 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.36 7.81 300 P 0.00 4.05 0.00 1.04 1.91 0.00 3.68 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 301 Y 7.90 4.99 0.00 3.13 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 0.00 302 P 0.00 4.28 0.00 2.17 2.19 0.00 3.84 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 303 E 8.22 3.98 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 304 I 7.95 4.22 2.05 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 1.35 0.83 1.05 0.00 0.00 305 K 8.47 4.46 0.00 1.52 1.71 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.57 7.81 306 H 7.86 4.92 0.00 3.09 3.10 0.00 5.70 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 307 N 8.09 3.42 0.00 1.44 2.32 0.00 0.00 7.07 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 308 P 0.00 4.49 0.00 2.21 2.09 0.00 3.84 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 *310 K 7.96 4.20 0.00 1.83 1.90 0.00 1.69 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.51 7.81 311 W 8.28 4.33 0.00 3.40 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 0.00 312 I 6.73 3.29 1.40 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.04 -0.36 0.90 0.00 0.00 313 R 7.81 4.07 0.00 1.81 1.71 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.45 0.00 * Residues marked with a * may have inaccurate shift predictions.