NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.3655 8.3349 115.2892 57.9735 63.7143 172.7857 *2 I 4.0752 7.8893 125.4096 61.1605 38.8627 174.0946 3 L 4.7727 8.4876 129.0185 53.8546 43.6396 174.9418 4 E 5.8111 9.2770 125.5272 53.7744 33.1368 175.0377 5 L 5.6171 8.6469 121.4899 53.2714 46.8738 175.1430 6 D 5.1157 9.6757 121.3321 52.8649 43.9017 174.4615 7 C 4.6749 9.3088 126.1207 58.8284 29.0706 173.9477 8 G 4.2765 8.7477 113.7166 44.6089 0.0000 172.0770 9 N 4.6872 8.8469 116.0154 54.6431 37.7737 175.9801 10 S 4.6546 8.0536 112.8900 58.5744 65.6616 173.5372 11 L 5.1639 7.5886 117.7084 52.9626 46.6333 175.5066 12 I 4.9438 8.9405 121.5071 59.6324 40.1195 174.5426 13 K 5.1837 9.2272 129.7311 54.6604 34.1253 175.1686 14 W 5.9357 8.7721 123.5427 55.2250 32.2683 173.9974 15 R 4.6949 8.8648 115.5918 55.1732 32.6710 173.6409 16 V 4.9472 8.6654 120.9483 61.0884 34.1325 174.3411 17 I 4.9889 8.5199 120.8887 59.0675 40.4839 174.2204 18 E 4.4059 9.1054 125.4513 55.5717 31.7357 177.0793 19 G 3.9603 8.7113 113.6843 45.6746 0.0000 173.3158 20 A 4.0591 8.7700 121.0472 55.4627 18.5697 179.2623 21 A 4.3034 7.4618 113.6550 52.7433 20.4853 175.8163 22 R 4.1142 7.8325 120.7769 56.4861 29.7847 175.8385 23 S 4.5823 8.5181 121.2216 58.4588 62.7741 173.7851 24 V 4.4619 8.1918 119.5827 61.1414 33.3590 175.2175 25 A 4.3417 6.8666 120.2578 50.8913 22.4170 175.4138 26 G 2.5592 7.5600 106.3950 45.8190 0.0000 171.4177 27 G 3.9444 5.4516 105.5966 45.9692 0.0000 171.9801 28 L 5.4848 8.7290 118.9362 52.8271 44.3629 176.3166 29 A 4.9225 9.2426 126.1574 50.2780 21.5685 176.6924 30 E 4.2748 8.9888 120.0186 56.8938 30.3889 176.5984 31 S 4.5881 7.3433 112.9688 56.4888 66.4987 175.7277 32 D 4.3793 8.4487 121.9674 57.5661 40.4090 178.8684 33 D 4.2880 8.0481 118.5913 57.4520 40.9699 178.5197 34 A 3.9841 7.9239 120.9661 54.8818 18.2025 179.5683 35 L 3.8327 7.9677 118.9594 58.4389 42.4060 179.3021 36 V 3.4786 7.9455 118.4503 65.7797 31.2152 177.5589 37 E 3.8824 8.3931 119.2591 59.5386 29.3446 178.9130 38 Q 4.0932 7.9507 116.5727 58.9748 28.8535 178.5426 39 L 3.8161 7.9921 119.5561 56.4319 41.7242 178.3396 40 T 4.4469 7.4050 107.0435 61.5906 69.3246 175.6309 41 S 4.4875 7.9001 120.1862 60.5324 63.8593 175.1243 42 Q 4.4040 7.7090 121.9297 53.8177 29.2642 178.6235 43 Q 4.1544 8.4576 114.4008 56.0456 28.5192 174.9788 44 A 4.2492 8.5908 125.7505 51.5951 19.0641 176.7493 45 L 4.8498 8.2392 121.6610 52.1563 44.9942 175.7966 46 P 4.5855 0.0000 0.0000 62.3663 29.4220 176.5789 47 V 3.6209 7.4661 119.0348 63.7395 32.0636 175.3684 48 R 4.5911 8.4422 123.8977 55.6224 31.7457 174.6333 49 A 4.7233 7.4097 118.7326 51.3328 23.0116 174.9713 50 C 5.2058 8.3484 118.4260 58.2598 35.3642 172.9295 51 R 5.3686 8.9320 121.6261 54.8633 32.9862 173.7372 52 L 5.2345 9.0036 120.0322 54.8592 44.4380 174.2832 53 V 4.7940 8.7462 119.3717 60.1199 34.4091 174.4696 54 S 5.0380 8.6104 116.6314 56.7535 65.5423 173.5357 55 V 4.4037 8.4026 118.0575 61.3624 32.5553 176.1236 56 R 4.3719 7.9416 121.4943 54.6965 31.6312 176.7349 57 S 4.3591 8.5018 113.9948 58.3544 64.7778 174.8217 58 E 3.9058 8.6374 123.0111 59.6909 29.4104 179.1479 59 Q 4.0512 7.9927 117.6200 58.9448 28.8732 178.3439 60 E 4.0108 8.1765 119.5363 59.5638 29.3786 179.5866 61 T 3.9153 8.1623 116.0007 66.8193 68.5870 177.0730 62 S 4.1320 8.5078 117.5320 61.4034 62.6460 176.5599 63 Q 3.9448 8.2199 122.3975 59.1186 28.8659 178.1358 64 L 3.9544 7.9854 121.3265 58.1771 42.0709 178.9945 65 V 3.6135 8.2097 118.3602 65.9232 31.5098 177.7786 66 A 3.9855 8.1329 120.4917 55.1491 18.2024 179.8450 67 R 3.8931 7.7443 116.5482 59.4889 30.1345 179.2196 68 L 4.1011 7.9800 118.6514 57.9923 41.4841 179.2469 69 E 4.2293 8.3673 116.4306 58.1894 29.4613 178.0433 70 Q 4.2469 7.2741 118.1314 57.7285 29.6720 176.7492 71 L 3.8405 7.6213 120.8170 56.0119 42.4713 176.7672 72 F 4.9599 7.6795 115.8381 54.8119 42.9932 173.8171 73 P 4.6770 0.0000 0.0000 62.3229 29.5667 175.1040 74 V 4.4789 7.2487 112.1928 60.2937 36.1091 176.0331 75 S 4.6008 8.3051 115.1820 55.8818 62.6094 172.8634 76 A 4.3671 8.6488 129.4525 52.1853 18.9088 176.3814 77 L 4.5600 9.0904 123.0162 53.3382 43.7800 175.7427 78 V 4.8203 8.2413 123.2108 60.6753 33.3056 175.1430 79 A 4.4329 8.9002 130.6676 52.2502 18.9912 176.4821 80 S 4.7508 8.4206 113.5068 56.0142 66.5266 174.0767 81 S 4.2393 8.4753 116.8115 59.0887 63.0981 174.2552 82 G 4.3125 7.7012 109.9306 44.5770 0.0000 173.5988 83 K 3.7855 8.1288 120.4173 58.0197 32.6277 176.9264 84 Q 5.2784 7.6210 117.5257 54.8064 32.1654 173.3536 85 L 4.3152 9.4605 124.2348 55.3408 45.5190 175.0124 86 A 3.7547 9.7779 129.3651 53.3446 16.0724 177.5968 87 G 3.9339 8.5147 105.5367 46.5733 0.0000 173.7506 88 V 4.5653 7.7710 120.1213 60.9367 34.2308 174.4467 89 R 5.1834 8.8425 126.8477 54.1648 32.3908 175.2131 90 N 4.6533 9.2217 124.0321 54.1357 39.0636 174.9370 91 G 4.2655 9.0784 113.0494 45.1168 0.0000 173.3696 92 Y 4.4106 7.8333 117.7260 57.3695 38.7493 175.7563 93 L 3.9837 8.4377 123.3448 57.0310 42.0722 176.5957 94 D 4.8346 7.7986 119.2418 51.9512 41.0481 175.3868 95 Y 4.1129 8.7393 126.0637 59.9285 37.9040 178.5557 96 Q 3.7022 6.9483 117.5014 57.0511 28.8135 176.8090 97 R 4.2302 7.7648 116.3330 56.5831 30.8212 176.5018 98 L 3.3836 7.1737 120.4638 53.7685 42.5474 177.2804 99 G 3.7421 8.5156 112.5744 45.3485 0.0000 174.3429 100 L 4.1829 8.5958 124.9908 57.5294 41.7535 179.4804 101 D 4.2980 8.0351 118.9884 56.4543 39.3777 178.6947 102 R 3.8548 7.9110 119.1682 58.5355 30.1939 178.4159 103 W 4.4394 8.2764 128.0928 60.8531 30.7087 178.0160 104 L 3.6454 8.2543 118.7320 57.4596 40.9804 179.4909 105 A 3.8691 7.8674 121.0437 54.9597 18.3620 179.7087 106 L 3.8167 7.9427 118.5193 58.6984 40.4514 179.7320 107 V 3.1743 7.3846 118.9001 65.5221 31.3913 177.8306 108 A 3.8128 7.7225 120.2882 54.9213 18.1291 179.3468 109 A 2.8390 7.6203 119.1467 55.3722 18.2736 179.4585 110 H 3.9951 7.8872 116.6115 59.4327 29.6638 176.7671 111 H 3.9751 8.1382 119.6023 59.3181 29.6848 176.9009 112 L 4.0843 7.7567 119.4318 57.3834 41.6641 178.6622 113 A 4.2787 8.1485 119.5298 52.4284 19.1892 177.6861 114 K 3.5689 8.4731 115.1747 56.8031 30.2633 174.6256 115 K 4.7505 7.6217 114.6899 54.7323 36.9389 175.9995 116 A 4.4323 8.6569 122.7169 52.8514 19.4082 176.5046 117 C 5.4593 9.4866 118.6279 57.9144 33.2504 172.7725 118 L 5.0815 9.1968 124.2205 53.3243 44.4500 175.1160 119 V 5.0048 9.1970 126.6307 61.3009 34.3450 174.0277 120 I 5.0684 8.9957 129.2283 59.5771 40.2744 174.0178 121 D 5.1229 9.4815 127.6573 52.9425 42.8842 175.2737 122 L 4.7081 9.2422 128.7827 52.6286 40.7452 176.3907 123 G 4.3454 8.6450 118.3576 44.7757 0.0000 172.6009 124 T 4.0367 9.1754 116.0972 65.6327 69.5227 173.9821 125 A 5.1131 7.9823 120.9371 50.0246 22.9980 174.7779 126 V 4.9724 8.9281 119.4081 61.3506 34.3305 174.6708 127 T 5.3174 8.7535 116.8388 60.1502 72.5992 172.7118 128 S 5.3530 9.2711 117.4276 57.1441 66.2227 172.3714 129 D 5.5027 9.5955 125.9639 52.6228 45.4463 174.2947 130 L 5.2548 8.7587 121.2556 53.0210 45.0916 175.6675 131 V 4.9361 8.8054 122.4305 60.9036 34.7141 175.2453 132 A 4.4694 9.1233 130.6715 51.4433 19.0745 178.0338 133 A 3.9834 8.6386 122.7495 55.3420 18.3956 178.5705 134 D 4.5870 8.0882 112.6033 53.6128 39.7725 177.2422 135 G 3.4969 8.5252 109.2149 45.3400 0.0000 173.2728 136 V 4.1323 7.7968 120.8058 61.5759 31.9819 174.7226 137 H 4.7723 9.0529 128.4851 56.2623 30.0303 176.0304 138 L 3.9936 8.9068 128.3266 56.5712 42.1509 176.6547 139 G 3.7174 6.9611 103.7194 44.8296 0.0000 170.7780 140 G 4.5226 7.4577 105.0412 47.2272 0.0000 172.2811 141 Y 5.2354 9.3243 116.4284 56.4603 42.8410 174.7763 142 I 5.2435 8.4832 120.6899 60.1310 40.8859 174.5072 143 C 4.8662 9.1676 123.3618 57.4272 33.1894 171.5443 144 P 4.4183 0.0000 0.0000 64.3838 31.5992 175.7628 145 G 3.7253 9.1999 111.2223 46.1619 0.0000 175.8827 *147 T 4.3025 8.9118 112.1626 61.6588 71.5850 176.9143 148 L 4.0791 7.3982 119.8358 55.0543 41.3454 179.2197 *150 R 4.2601 8.1685 119.3917 56.4545 32.2614 177.9804 151 S 4.0569 8.1257 112.0500 61.4934 62.3352 176.2908 152 Q 4.0499 8.2287 120.2814 59.1753 28.4388 178.4337 153 L 4.0589 7.8350 120.6030 57.4138 41.5528 179.0640 154 R 3.8781 8.0182 118.1243 59.8907 30.1187 178.5376 155 T 4.0428 7.8396 114.2931 66.6125 68.4501 176.0616 156 H 4.3616 8.0072 119.8477 58.1888 30.5874 175.4582 157 T 4.5917 7.5465 113.6666 60.5286 70.3595 174.2729 158 R 4.2371 8.5287 126.1693 57.8471 30.3646 177.9219 159 R 3.9969 8.1439 117.3152 58.0312 30.1958 176.7251 160 I 4.3867 7.2822 118.3540 59.8123 36.3914 174.7775 161 R 4.4836 8.1725 123.3612 54.8857 33.9531 174.4116 162 Y 4.7751 7.4466 118.8514 54.9009 40.5468 174.2439 163 D 4.6828 8.4638 120.8709 54.0548 43.0573 177.4633 164 D 4.4485 8.5836 120.2839 57.2964 40.8398 178.9086 165 A 3.9906 7.9981 120.9978 55.2564 18.4746 179.1420 166 E 3.8828 8.2517 117.0979 59.2168 29.5499 178.6500 167 A 4.0306 7.9775 119.9148 55.3565 18.5401 179.5251 168 R 4.0472 8.6581 117.0176 59.5475 30.2745 179.5808 169 R 3.9238 8.2333 117.6455 59.1306 29.7904 178.9334 170 A 4.0414 7.7977 119.8678 54.8242 18.7285 178.7543 171 L 4.2805 7.6006 115.0086 55.3349 41.5745 178.1996 172 A 4.2488 7.7000 120.4671 52.7704 18.7319 177.3449 173 S 4.5308 6.9752 109.3013 57.3801 65.6079 173.9565 174 L 4.6129 8.2633 123.9426 54.5093 41.9827 176.8397 175 Q 4.2312 7.7642 118.4131 54.6349 29.2429 174.3450 176 P 4.2319 0.0000 0.0000 63.1549 31.7809 176.8409 177 G 3.8309 8.4747 111.3211 45.6015 0.0000 173.2742 178 Q 4.5732 9.0672 120.5506 54.7877 29.6250 175.8286 179 A 4.5933 7.4677 118.2399 49.8675 23.1803 177.7040 180 T 3.7507 8.5550 118.8480 66.9690 68.6017 176.6550 181 A 2.5869 7.6439 121.6693 54.8328 18.2228 179.4444 182 E 3.7918 7.8559 116.1753 59.3390 29.6740 179.1749 183 A 3.9422 8.1076 121.0696 55.1041 18.3685 179.9465 184 V 3.5304 7.9680 116.8502 66.2827 31.7374 178.1206 185 E 4.0129 8.0898 118.3013 59.6302 29.3139 179.7138 186 R 4.0956 8.1352 118.2613 58.8683 29.8752 179.3749 187 G 3.5883 7.9293 104.9078 48.1404 0.0000 175.3379 188 C 4.3232 8.1786 118.6727 62.2781 28.3812 175.7097 189 L 4.1914 8.0455 122.1145 57.7121 41.6350 179.3787 190 L 4.3723 8.0066 119.1040 54.5392 41.6373 179.0567 *192 L 4.2874 7.9178 121.7103 55.3044 44.1203 178.8650 193 R 4.5563 7.9493 119.3820 58.6817 29.8655 179.3652 194 G 3.6360 8.5565 106.1420 47.5997 0.0000 175.6029 195 F 4.1283 8.2303 122.5951 61.0715 39.4843 177.1628 196 V 3.4801 7.9220 117.8874 66.1565 31.3186 178.2881 197 R 3.9779 7.9167 117.3381 59.1648 29.6424 178.8690 198 E 3.9198 7.9189 117.7419 59.3900 29.4639 179.0923 199 Q 3.8483 7.6162 117.4276 58.9591 28.9845 177.7839 200 Y 4.1962 8.1609 120.4076 60.3807 38.7736 178.1503 201 A 4.1664 7.9548 119.0885 52.4771 18.2291 178.9886 *203 A 4.1679 7.9417 125.0965 53.9882 20.5934 179.8557 204 C 3.9300 7.7568 113.4281 62.9465 28.4785 176.1927 205 E 3.8698 8.0445 119.4467 59.0275 29.3010 177.6954 206 L 4.3293 7.7916 116.2520 55.8167 42.2854 177.2755 207 L 4.4975 8.7657 116.7958 53.8353 43.4966 177.5758 208 G 4.0315 7.7906 105.3095 44.7056 0.0000 173.0181 209 P 4.1798 0.0000 0.0000 64.6256 31.4783 176.9833 210 D 4.8368 7.8884 116.7092 53.0856 39.5845 176.1456 211 C 4.4770 7.4670 114.6610 58.7109 30.6417 172.9845 212 E 4.3955 9.1406 120.5631 56.0892 31.0072 175.5518 213 I 5.0529 8.2049 123.5187 59.5983 40.3807 174.2495 214 F 5.2598 9.6442 126.0278 55.6006 41.9044 174.4348 215 L 5.3310 8.9966 123.0481 53.4431 45.3005 175.5802 216 T 4.8803 8.9562 116.5216 60.9765 72.0261 173.4440 217 G 4.3170 8.3975 107.5706 46.4652 0.0000 174.9665 218 G 3.6519 8.4606 109.1063 47.9804 0.0000 174.1720 219 D 4.7410 8.4040 118.7581 54.1852 41.1880 178.1803 220 A 4.0840 7.8918 123.9377 55.0648 17.9334 179.9519 221 E 3.9194 8.1485 116.9540 59.4308 29.8004 178.5158 222 L 4.2304 7.8110 117.6267 56.5071 42.0459 177.8558 223 V 4.5575 7.5244 109.5989 59.9894 33.8593 177.3844 224 R 4.0008 8.0625 118.1315 58.9405 28.8134 178.3425 225 D 4.4155 8.0033 118.6826 56.0813 39.6741 177.7727 226 E 4.2104 8.3470 119.9610 57.5051 30.5457 175.9477 227 L 4.7260 7.5772 118.5469 51.6014 42.3484 176.2448 228 A 3.8612 8.3673 124.6415 55.1021 18.6023 179.1706 229 G 3.8620 7.8762 100.9087 45.5209 0.0000 173.5620 230 A 4.2143 7.8943 121.9532 51.8674 19.4507 178.2247 231 R 4.2573 8.7833 120.2426 54.8852 31.2609 176.6556 232 I 5.0183 7.9814 124.8409 59.3791 38.3564 174.3879 *234 P 4.4797 0.0000 0.0000 62.3406 33.1861 177.6411 235 D 5.0999 7.7491 116.5130 53.8699 41.8965 177.9778 236 L 3.9611 8.3052 123.5082 58.5828 41.8208 178.7322 237 V 3.5164 7.6190 118.2441 64.8725 31.2233 178.1827 238 F 4.3679 7.8881 117.9833 59.9993 38.1912 177.8587 239 V 3.7426 7.7848 118.3373 65.8779 31.2490 178.3464 240 G 3.4928 7.8370 105.1253 47.4771 0.0000 175.2536 241 L 3.9391 8.1191 122.6160 57.9897 41.8804 178.9642 242 A 4.1335 7.8066 119.6889 55.1334 18.3399 179.3301 243 L 4.0256 7.3012 115.4655 57.7538 41.7715 179.1886 244 A 4.2644 8.0910 120.1563 53.8215 19.7324 177.5348 245 C 4.8149 8.2266 114.1631 56.7837 28.4560 171.9101 246 P 4.4997 0.0000 0.0000 62.7947 31.9346 176.8951 247 I 4.5211 7.7898 120.2434 60.6768 40.6978 175.3902 248 E 4.1291 8.9322 121.9596 57.0503 29.5683 174.8049 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 0 S 8.33 4.37 0.00 3.84 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *2 I 7.89 4.08 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.45 0.92 0.00 0.00 3 L 8.49 4.77 0.00 1.40 1.30 1.00 0.40 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 4 E 9.28 5.81 0.00 1.36 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.95 0.00 5 L 8.65 5.62 0.00 1.71 1.66 0.98 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 6 D 9.68 5.12 0.00 2.25 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 C 9.31 4.67 0.00 2.93 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 8 G 8.75 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 0.00 0.00 0.00 0.00 9 N 8.85 4.69 0.00 2.83 2.97 0.00 0.00 5.72 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.05 4.65 0.00 3.84 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 11 L 7.59 5.16 0.00 1.57 1.54 0.94 0.88 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 12 I 8.94 4.94 1.99 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.91 1.05 0.00 0.00 13 K 9.23 5.18 0.00 1.87 1.75 0.00 1.61 0.00 0.00 1.74 0.00 0.00 3.30 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.42 7.81 14 W 8.77 5.94 0.00 3.58 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 15 R 8.86 4.69 0.00 1.65 1.61 0.00 2.39 0.00 0.00 2.59 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.09 0.00 16 V 8.67 4.95 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 1.10 0.00 0.00 1.08 0.00 0.00 17 I 8.52 4.99 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.80 0.82 0.00 0.00 18 E 9.11 4.41 0.00 2.01 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 19 G 8.71 3.96 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 0.00 0.00 0.00 20 A 8.77 4.06 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.46 4.30 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.83 4.11 0.00 1.87 1.93 0.00 3.08 0.00 0.00 3.08 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 23 S 8.52 4.58 0.00 3.77 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 24 V 8.19 4.46 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 0.74 0.00 0.00 0.98 0.00 0.00 25 A 6.87 4.34 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.56 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 0.00 0.00 0.00 27 G 5.45 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 28 L 8.73 5.48 0.00 1.53 1.61 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 29 A 9.24 4.92 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 30 E 8.99 4.27 0.00 2.00 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 2.31 2.32 0.00 31 S 7.34 4.59 0.00 3.99 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 32 D 8.45 4.38 0.00 2.74 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 33 D 8.05 4.29 0.00 2.72 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 34 A 7.92 3.98 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 35 L 7.97 3.83 0.00 1.87 1.88 0.67 0.69 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 36 V 7.95 3.48 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 0.86 0.00 0.00 0.95 0.00 0.00 37 E 8.39 3.88 0.00 2.22 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 0.00 2.32 2.41 0.00 38 Q 7.95 4.09 0.00 2.32 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 39 L 7.99 3.82 0.00 1.54 1.65 0.79 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 40 T 7.41 4.45 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 1.12 0.00 0.00 41 S 7.90 4.49 0.00 4.02 4.20 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 42 Q 7.71 4.40 0.00 2.09 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.94 0.00 0.00 0.00 0.00 0.00 2.26 1.92 0.00 43 Q 8.46 4.15 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.28 1.93 0.00 44 A 8.59 4.25 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 45 L 8.24 4.85 0.00 1.65 1.58 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.59 0.00 2.18 2.11 0.00 3.78 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 47 V 7.47 3.62 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 0.37 0.00 0.00 0.57 0.00 0.00 48 R 8.44 4.59 0.00 1.78 1.88 0.00 3.46 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 49 A 7.41 4.72 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 50 C 8.35 5.21 0.00 2.91 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 R 8.93 5.37 0.00 1.92 1.96 0.00 2.88 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 52 L 9.00 5.23 0.00 1.93 1.83 0.96 1.11 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 53 V 8.75 4.79 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 0.88 0.00 0.00 0.95 0.00 0.00 54 S 8.61 5.04 0.00 3.86 3.72 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 55 V 8.40 4.40 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 0.78 0.00 0.00 0.97 0.00 0.00 56 R 7.94 4.37 0.00 1.82 2.06 0.00 3.19 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 57 S 8.50 4.36 0.00 4.07 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 58 E 8.64 3.91 0.00 2.09 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 2.38 2.47 0.00 59 Q 7.99 4.05 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 60 E 8.18 4.01 0.00 2.20 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 2.33 2.35 0.00 61 T 8.16 3.92 4.39 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 1.23 0.00 0.00 62 S 8.51 4.13 0.00 3.83 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 63 Q 8.22 3.94 0.00 2.28 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 64 L 7.99 3.95 0.00 1.83 1.84 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 65 V 8.21 3.61 2.23 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 1.05 0.00 0.00 1.02 0.00 0.00 66 A 8.13 3.99 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 67 R 7.74 3.89 0.00 2.01 1.96 0.00 3.11 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 1.63 1.76 0.00 68 L 7.98 4.10 0.00 1.89 1.84 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.37 4.23 0.00 2.01 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 2.48 0.00 70 Q 7.27 4.25 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 71 L 7.62 3.84 0.00 1.67 1.22 0.70 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 72 F 7.68 4.96 0.00 3.02 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.68 0.00 2.21 2.13 0.00 3.93 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 2.06 2.04 0.00 74 V 7.25 4.48 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 0.80 0.00 0.00 1.00 0.00 0.00 75 S 8.31 4.60 0.00 3.79 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.65 4.37 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 77 L 9.09 4.56 0.00 1.59 1.61 0.93 0.57 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 78 V 8.24 4.82 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 0.82 0.00 0.00 0.96 0.00 0.00 79 A 8.90 4.43 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 80 S 8.42 4.75 0.00 3.96 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 81 S 8.48 4.24 0.00 3.79 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 82 G 7.70 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.13 3.79 0.00 1.54 1.61 0.00 1.33 0.00 0.00 1.47 0.00 0.00 2.53 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.53 0.21 7.81 84 Q 7.62 5.28 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.62 0.00 0.00 0.00 0.00 0.00 2.30 2.59 0.00 85 L 9.46 4.32 0.00 1.95 1.26 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 86 A 9.78 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 G 8.51 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 7.77 4.57 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 0.99 0.00 0.00 0.84 0.00 0.00 89 R 8.84 5.18 0.00 1.83 1.86 0.00 3.20 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 90 N 9.22 4.65 0.00 2.18 2.52 0.00 0.00 7.14 7.88 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 91 G 9.08 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 0.00 0.00 0.00 0.00 92 Y 7.83 4.41 0.00 2.83 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 93 L 8.44 3.98 0.00 1.55 1.70 0.85 0.92 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 94 D 7.80 4.83 0.00 2.65 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.74 4.11 0.00 3.12 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 96 Q 6.95 3.70 0.00 1.65 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.88 0.00 0.00 0.00 0.00 0.00 1.33 1.16 0.00 97 R 7.76 4.23 0.00 2.12 2.10 0.00 3.29 0.00 0.00 3.11 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 98 L 7.17 3.38 0.00 0.69 1.28 0.27 0.92 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 99 G 8.52 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 0.00 0.00 0.00 100 L 8.60 4.18 0.00 1.73 1.81 0.97 1.09 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 0.00 101 D 8.04 4.30 0.00 2.85 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 0.00 102 R 7.91 3.85 0.00 2.05 2.16 0.00 3.16 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 103 W 8.28 4.44 0.00 3.22 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 0.00 104 L 8.25 3.65 0.00 1.61 1.56 0.93 0.97 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 0.00 105 A 7.87 3.87 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 0.00 106 L 7.94 3.82 0.00 1.84 1.87 0.79 0.58 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 0.00 107 V 7.38 3.17 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 -0.64 0.00 0.00 108 A 7.72 3.81 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.62 2.84 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.89 4.00 0.00 3.16 3.22 0.00 5.60 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 H 8.14 3.98 0.00 3.11 3.50 0.00 6.00 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.76 4.08 0.00 1.89 1.81 0.99 0.63 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 0.00 113 A 8.15 4.28 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 0.00 114 K 8.47 3.57 0.00 1.81 1.84 0.00 1.68 0.00 0.00 1.57 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.48 7.81 115 K 7.62 4.75 0.00 1.63 1.72 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.59 7.81 116 A 8.66 4.43 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 C 9.49 5.46 0.00 2.85 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 0.00 118 L 9.20 5.08 0.00 1.78 1.59 1.00 0.86 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 0.00 119 V 9.20 5.00 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 1.02 0.00 0.00 0.86 0.00 0.00 120 I 9.00 5.07 1.98 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.80 1.16 0.00 0.00 121 D 9.48 5.12 0.00 2.68 2.57 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 0.00 122 L 9.24 4.71 0.00 1.63 1.62 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 123 G 8.64 4.35 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 0.00 124 T 9.18 4.04 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 1.21 0.00 0.00 125 A 7.98 5.11 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 0.00 126 V 8.93 4.97 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 0.92 0.00 0.00 0.92 0.00 0.00 127 T 8.75 5.32 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 128 S 9.27 5.35 0.00 4.25 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 0.00 129 D 9.60 5.50 0.00 2.62 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.76 5.25 0.00 1.69 1.59 1.12 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 131 V 8.81 4.94 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 0.98 0.00 0.00 0.96 0.00 0.00 132 A 9.12 4.47 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 0.00 133 A 8.64 3.98 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 0.00 134 D 8.09 4.59 0.00 2.79 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 8.53 3.50 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 0.00 136 V 7.80 4.13 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 1.02 0.00 0.00 1.03 0.00 0.00 137 H 9.05 4.77 0.00 3.38 3.60 0.00 5.83 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 8.91 3.99 0.00 1.63 1.69 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 139 G 6.96 3.72 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 0.00 0.00 0.00 140 G 7.46 4.52 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 0.00 141 Y 9.32 5.24 0.00 3.19 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 0.00 142 I 8.48 5.24 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.70 0.93 0.00 0.00 143 C 9.17 4.87 0.00 2.35 2.47 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 0.00 144 P 0.00 4.42 0.00 2.04 2.01 0.00 3.64 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.93 0.00 145 G 9.20 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *147 T 8.91 4.30 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 148 L 7.40 4.08 0.00 2.10 1.70 0.92 0.93 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 *150 R 8.17 4.26 0.00 2.03 1.97 0.00 3.13 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 151 S 8.13 4.06 0.00 3.97 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 0.00 152 Q 8.23 4.05 0.00 2.33 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.49 2.39 0.00 153 L 7.84 4.06 0.00 1.89 1.80 0.96 0.87 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 0.00 154 R 8.02 3.88 0.00 1.89 2.12 0.00 3.22 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 155 T 7.84 4.04 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 1.22 0.00 0.00 156 H 8.01 4.36 0.00 3.24 3.55 0.00 5.94 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 T 7.55 4.59 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 158 R 8.53 4.24 0.00 1.84 1.96 0.00 3.25 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 159 R 8.14 4.00 0.00 1.82 2.02 0.00 3.32 0.00 0.00 3.23 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 160 I 7.28 4.39 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.60 1.04 0.00 0.00 161 R 8.17 4.48 0.00 1.77 1.77 0.00 3.36 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 162 Y 7.45 4.78 0.00 3.03 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 D 8.46 4.68 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 D 8.58 4.45 0.00 2.74 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 0.00 165 A 8.00 3.99 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 E 8.25 3.88 0.00 2.11 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 0.00 2.30 2.36 0.00 167 A 7.98 4.03 1.63 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 176 P 0.00 4.23 0.00 2.02 2.00 0.00 3.66 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 2.03 2.10 0.00 177 G 8.47 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 Q 9.07 4.57 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 179 A 7.47 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 0.00 180 T 8.55 3.75 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 181 A 7.64 2.59 0.72 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 0.00 0.00 182 E 7.86 3.79 0.00 2.10 1.95 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 2.33 2.28 0.00 183 A 8.11 3.94 1.34 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 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1.87 2.01 0.00 3.20 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.67 0.00 194 G 8.56 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 F 8.23 4.13 0.00 3.06 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 0.00 196 V 7.92 3.48 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 0.98 0.00 0.00 1.12 0.00 0.00 197 R 7.92 3.98 0.00 2.06 1.97 0.00 3.17 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 2.03 0.00 198 E 7.92 3.92 0.00 1.82 1.79 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 2.51 2.44 0.00 199 Q 7.62 3.85 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.96 0.00 0.00 0.00 0.00 0.00 1.17 1.89 0.00 200 Y 8.16 4.20 0.00 2.97 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 0.00 201 A 7.95 4.17 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 *203 A 7.94 4.17 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 C 7.76 3.93 0.00 2.91 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 E 8.04 3.87 0.00 2.00 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 2.31 2.31 0.00 206 L 7.79 4.33 0.00 1.68 1.71 0.96 0.91 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 0.00 207 L 8.77 4.50 0.00 1.65 1.69 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 208 G 7.79 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 0.00 0.00 0.00 209 P 0.00 4.18 0.00 2.05 2.13 0.00 3.65 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 2.01 2.03 0.00 210 D 7.89 4.84 0.00 2.76 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 0.00 211 C 7.47 4.48 0.00 3.13 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 E 9.14 4.40 0.00 2.11 1.87 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 2.36 2.50 0.00 213 I 8.20 5.05 1.88 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.75 0.99 0.00 0.00 214 F 9.64 5.26 0.00 2.86 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 0.00 215 L 9.00 5.33 0.00 1.58 1.56 0.94 0.66 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 0.00 216 T 8.96 4.88 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 217 G 8.40 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 G 8.46 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 D 8.40 4.74 0.00 2.93 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 0.00 220 A 7.89 4.08 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 0.00 221 E 8.15 3.92 0.00 1.96 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 2.47 0.00 222 L 7.81 4.23 0.00 1.81 1.73 0.94 0.81 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 0.00 223 V 7.52 4.56 2.23 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 0.96 0.00 0.00 1.00 0.00 0.00 224 R 8.06 4.00 0.00 2.04 2.29 0.00 2.76 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.63 0.00 225 D 8.00 4.42 0.00 2.83 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 0.00 226 E 8.35 4.21 0.00 2.08 1.95 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 2.29 2.40 0.00 227 L 7.58 4.73 0.00 1.61 1.46 0.94 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 228 A 8.37 3.86 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 0.00 229 G 7.88 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 0.00 230 A 7.89 4.21 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 R 8.78 4.26 0.00 1.07 1.62 0.00 2.67 0.00 0.00 2.25 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.24 0.00 232 I 7.98 5.02 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.46 0.92 0.00 0.00 *234 P 0.00 4.48 0.00 2.09 2.17 0.00 3.67 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 1.94 2.13 0.00 235 D 7.75 5.10 0.00 2.83 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 0.00 236 L 8.31 3.96 0.00 1.79 1.67 0.82 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 237 V 7.62 3.52 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 0.13 0.00 0.00 0.73 0.00 0.00 238 F 7.89 4.37 0.00 3.34 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 0.00 239 V 7.78 3.74 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 1.01 0.00 0.00 0.97 0.00 0.00 240 G 7.84 3.49 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 0.00 241 L 8.12 3.94 0.00 1.92 2.00 1.01 1.26 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 0.00 242 A 7.81 4.13 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 0.00 243 L 7.30 4.03 0.00 1.72 1.62 0.66 0.57 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 0.00 244 A 8.09 4.26 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 0.00 245 C 8.23 4.81 0.00 2.89 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 0.00 246 P 0.00 4.50 0.00 2.17 2.05 0.00 3.80 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 1.99 1.99 0.00 247 I 7.79 4.52 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.88 0.91 0.00 0.00 248 E 8.93 4.13 0.00 2.04 1.87 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 2.23 2.28 0.00 * Residues marked with a * may have inaccurate shift predictions.