NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 A 4.2760 8.2649 123.5762 51.0891 18.7267 176.4825 5 P 4.1849 0.0000 0.0000 60.6177 32.1164 175.3165 6 I 3.8190 7.7881 114.2659 60.8807 39.1509 175.8201 7 D 4.5324 8.2466 121.6822 52.6725 41.7220 177.0726 8 I 3.5329 7.8948 119.7797 64.4814 37.8056 178.0253 9 F 4.4907 7.5094 117.9592 60.6010 38.7419 177.2283 10 Q 4.0011 8.9319 119.7350 59.1083 28.9342 178.3064 11 S 4.0552 8.1812 114.0992 61.4971 62.2459 176.2154 12 I 3.8225 7.5362 120.9253 64.5294 36.9736 178.1246 13 L 4.2454 7.9740 118.5698 57.1803 41.6973 179.0154 14 S 4.3134 8.2451 113.2127 59.1114 63.6183 174.8147 15 R 3.9602 7.1342 123.6559 56.4058 30.2420 175.4265 16 K 4.5135 8.0124 122.3324 55.3064 35.5446 175.7102 17 S 4.4382 8.4086 116.0836 58.3875 62.6149 173.9061 18 I 4.2959 8.1890 127.1976 59.8402 38.2147 176.1595 19 R 4.0020 8.3030 122.9586 54.9587 31.0363 175.1183 20 A 4.7163 6.9723 118.4874 51.0907 22.3658 176.2068 21 F 5.4210 8.9100 120.5035 55.5806 43.0549 174.9681 22 T 4.4578 8.8715 112.3788 61.0841 69.9346 174.0541 23 D 4.7164 8.5797 119.1115 53.4006 39.6238 176.0610 24 Q 4.0644 7.9583 122.6663 55.4880 29.2938 174.2634 25 P 4.5511 0.0000 0.0000 62.4910 32.3884 175.3519 26 V 4.3710 7.9563 119.1802 61.1490 33.0631 176.4197 27 T 4.0431 8.2864 117.6910 61.8233 70.5675 175.3081 28 Q 3.9518 8.5990 121.9408 59.2166 28.7185 179.0302 29 E 3.9044 8.0837 119.0935 59.8358 29.5165 179.4464 30 T 3.4333 7.8552 115.6381 66.3102 68.3945 176.9496 31 I 3.5268 7.5846 121.8025 64.3412 37.0341 178.6847 32 R 3.8787 8.1042 119.0660 59.2520 29.8920 178.8973 33 E 3.9547 8.1912 118.4252 59.4547 29.3878 179.4748 34 I 3.7015 7.6135 119.6978 64.5533 37.1996 178.6027 35 L 3.9068 7.9873 119.6806 57.5773 41.1637 179.7188 36 K 4.0522 8.2075 118.2641 59.3102 32.2523 179.1363 37 L 4.1128 8.0323 119.1255 57.7980 41.5370 179.3474 38 A 3.6670 8.0834 120.5777 54.8995 17.8779 179.4301 39 A 4.2190 7.9887 118.4867 55.1272 18.4885 179.0972 40 R 4.2836 7.7229 114.0118 55.6944 30.5998 176.7599 41 A 4.1352 7.2924 122.9162 51.7053 18.9284 175.9620 42 P 4.8002 0.0000 0.0000 62.6967 32.7545 175.6956 43 S 4.8641 8.2420 111.8521 56.6793 65.6815 174.0148 44 G 3.8354 8.9595 111.5622 47.6745 0.0000 173.8443 45 T 3.5932 9.4228 113.4213 62.6214 67.8159 171.2975 46 N 4.1809 8.2271 115.5897 55.4908 38.0469 175.1655 47 L 3.8325 7.9757 118.0755 55.5055 42.1683 177.5012 48 Q 2.0000 7.6172 117.4069 55.7133 26.1476 172.9805 49 P 3.8301 0.0000 0.0000 63.9455 32.4330 177.6381 50 W 4.2603 6.0399 117.1631 56.7868 28.5549 175.7534 51 Q 4.7677 8.9374 120.6497 54.2050 32.5149 174.3812 52 V 4.8185 8.4418 121.2260 61.1965 35.0831 174.3393 53 I 4.4077 8.5206 127.8447 59.4734 39.6699 174.4810 54 V 4.4153 8.3182 127.0358 61.0895 33.1357 174.4745 55 L 4.7924 8.6673 128.7708 53.1658 44.0833 175.8301 56 T 4.7630 7.8525 112.4977 59.5821 73.0498 174.6139 57 G 3.7488 8.7419 109.3399 46.5588 0.0000 176.5428 58 K 3.9674 8.6328 119.2441 59.4952 31.9296 178.6798 59 I 3.7033 7.6621 118.4765 63.7071 38.0009 177.4710 60 L 3.9139 7.6818 121.4258 58.1320 41.8247 178.6761 61 Q 4.0019 8.1365 119.4372 59.1184 28.9143 178.3381 62 K 3.9298 8.2546 120.6306 59.4489 32.2096 178.8479 63 V 3.7432 8.2365 119.0637 66.0474 31.4172 178.1610 64 G 4.1595 8.3166 105.3555 47.7230 0.0000 175.2931 65 Q 3.9675 8.4040 122.4879 58.8553 29.2181 177.9946 66 E 3.8442 8.4602 120.5043 59.4240 29.6714 178.8626 67 L 3.6580 8.1614 119.3839 57.5552 41.7091 179.5696 68 S 4.1582 8.2877 114.3866 61.6648 62.8571 176.6629 69 Q 3.9619 8.1202 121.5443 58.3355 28.2852 178.6046 70 L 3.7483 7.4164 120.0248 57.6116 41.5608 179.5545 71 V 3.5498 7.1732 117.5526 66.2238 31.3122 178.1867 72 L 4.1072 7.8213 116.6654 57.1665 41.5131 178.7531 73 S 4.5023 7.8649 113.3049 58.5975 63.1719 174.9497 74 G 3.9654 7.7877 110.2793 45.0732 0.0000 173.4211 75 I 4.0189 7.6092 121.1979 60.4434 37.5748 176.1581 76 K 4.3132 8.5442 125.1781 55.6138 32.9413 177.1020 77 G 3.5297 8.3718 111.5104 47.0510 0.0000 174.0351 78 E 4.6863 8.8981 119.2400 54.8725 32.5448 176.2580 79 R 4.8013 8.6488 124.8796 54.6950 31.1989 176.9266 80 E 4.1989 8.7969 118.8555 56.6512 30.5853 175.2746 81 Y 4.7727 7.5759 115.9132 56.3400 41.5298 174.4530 82 H 4.7763 8.5704 118.8796 55.3641 29.3235 175.0612 83 Y 3.9734 9.0995 122.7381 59.9524 38.4310 175.6546 84 Y 4.6069 7.6846 114.5513 55.0731 40.4103 173.6611 85 P 4.0841 0.0000 0.0000 62.9253 31.7454 177.3317 86 R 4.0409 8.2732 120.4056 57.7416 30.4954 176.3792 87 Q 4.5093 7.7003 118.4185 53.8418 30.1947 174.2885 88 W 4.6582 8.8078 125.9125 55.6630 30.5024 176.0346 89 R 4.9032 8.4409 120.6462 54.0522 33.8874 174.4457 90 E 4.5216 8.6325 118.9702 56.0343 30.2560 176.3183 91 P 4.4603 0.0000 0.0000 64.1576 31.8279 177.9514 92 Y 4.2575 7.4993 117.4439 61.0997 37.8777 177.5562 93 L 4.1085 8.4554 121.4003 58.4891 42.1379 179.3343 94 S 4.1404 8.2541 114.6785 61.5640 62.6799 176.8271 95 R 3.9389 7.9263 120.3347 59.2894 29.8654 179.0828 96 R 3.8928 8.2132 118.3252 59.5837 30.0703 178.7837 97 R 3.7895 8.0093 117.8477 58.8978 29.9507 179.0156 98 K 3.8721 8.3314 119.7413 59.7352 32.2397 179.4086 99 V 3.7909 7.6981 112.5079 64.1412 31.3621 178.9544 100 G 3.2461 7.9147 105.5749 47.7512 0.0000 175.8752 101 L 3.9117 8.0969 122.3047 57.4230 41.5763 179.4399 102 D 4.0778 8.1487 119.0763 56.7307 40.5583 178.4367 103 L 3.3764 7.5948 120.9630 58.2993 42.1013 178.6835 104 Y 4.3361 7.9067 116.6236 60.9485 37.7990 178.4888 105 K 3.8836 8.2771 121.0112 59.6276 32.1852 178.9588 106 S 4.1305 7.9446 114.3101 61.0509 62.5732 175.6848 107 L 4.4219 7.5532 120.2895 54.0602 41.7689 177.2385 108 G 3.7867 7.6293 106.6680 46.2572 0.0000 173.5214 109 I 3.9080 7.7011 121.1960 60.0962 37.4968 176.0868 110 Q 4.3994 9.1177 127.8725 54.3403 30.2815 176.1722 111 K 4.0641 8.3802 120.9754 56.7259 31.7468 177.8222 112 G 4.0436 9.0158 112.6550 44.4859 0.0000 173.8996 113 D 4.6192 7.6542 121.4470 53.0658 39.2537 176.7495 114 Q 4.0642 7.9003 122.5417 59.0089 30.1207 177.2726 115 E 4.1386 8.2073 117.1698 59.4361 29.8518 179.7842 116 K 4.3304 7.5688 115.4119 56.6357 31.5272 178.7555 *118 L 4.2297 8.0908 122.6244 55.4699 44.1162 177.9616 119 H 4.1924 8.5225 117.8973 59.6254 29.4690 177.0021 120 Q 3.9856 8.0294 119.7759 58.8570 29.2642 177.6080 121 K 4.1165 8.1471 120.0928 59.6060 32.3784 178.4832 122 A 4.2764 8.4329 121.1490 55.1435 18.2338 179.6424 123 K 3.9430 8.0570 116.6415 59.4723 32.0041 178.8180 124 N 3.1400 7.5345 116.7037 56.1252 38.4232 176.7610 125 F 3.8236 7.7833 116.9606 58.5135 39.0551 176.5085 126 L 4.4899 7.6121 118.5870 53.3060 42.0392 176.2361 127 F 4.2457 8.5645 116.3866 58.2009 37.0699 175.5320 128 Y 3.9597 8.7113 111.9289 59.2161 36.0931 172.0766 129 G 4.0160 8.5571 105.2645 45.6673 0.0000 174.6316 130 A 3.7346 7.7011 122.2098 51.0678 18.6164 176.7016 131 P 4.4458 0.0000 0.0000 63.6916 32.3996 176.3956 132 V 4.3429 7.3824 119.5922 60.9894 34.9654 174.0746 133 G 2.8198 8.4142 114.5889 43.6791 0.0000 171.5843 134 L 4.9882 7.9174 123.8059 52.6781 44.5540 175.3076 135 L 4.8973 8.3281 122.5320 52.7862 45.3876 175.3121 136 F 5.4541 9.0417 121.6397 55.9452 42.0060 174.7587 137 T 5.8933 9.2705 112.5967 58.9507 72.5502 172.6647 138 I 4.9407 8.0079 114.1476 58.9123 41.1203 173.8947 139 D 4.9664 8.6671 123.1099 54.6434 41.7892 176.7220 140 H 4.4327 9.3945 120.5758 58.3130 28.9768 176.2072 141 D 4.4495 7.1811 120.9639 52.9562 39.4753 175.5210 *143 E 4.1309 7.9652 120.9746 56.0520 31.8695 178.1613 *145 G 3.9435 8.4510 112.1344 46.1935 0.0000 175.2533 146 S 4.4344 8.0852 115.5921 60.6704 62.7035 176.6741 147 W 3.9844 8.3638 121.9613 59.2901 28.6542 178.1801 148 L 4.0562 8.0188 117.7727 58.0201 41.2445 178.6967 149 D 4.7131 7.8461 117.0861 57.5522 40.9007 178.4831 150 L 4.4320 8.1156 119.6840 57.8937 42.0840 179.7704 151 G 3.7093 7.7710 101.7560 45.3276 0.0000 173.4767 *153 F 4.0315 7.8280 120.6434 57.5048 40.5632 176.1125 *155 Q 4.1933 8.0782 121.2964 55.9337 30.7247 176.3920 156 T 3.8751 7.6524 114.0667 66.7428 68.6766 176.4996 157 I 3.4756 7.3372 118.3871 62.5131 36.9904 177.5836 *159 L 4.2524 8.2860 121.7129 54.8601 43.7003 178.9542 160 A 3.9644 8.3365 120.3857 55.1174 18.0969 179.3430 161 A 4.0714 8.3814 119.5944 55.6459 18.4405 179.9827 162 R 4.0976 7.8561 116.3612 59.4699 29.8968 179.4714 163 G 3.5495 7.7504 104.0073 46.9317 0.0000 174.6458 164 F 4.7728 7.8623 117.3037 56.5887 39.2783 176.0763 165 G 3.9538 7.9166 106.2114 46.1699 0.0000 173.4428 166 L 4.6229 7.9080 118.9190 52.8476 44.7431 174.9093 167 D 5.0890 9.1244 119.2214 53.4100 46.0387 174.6186 168 T 5.9169 8.2828 108.3350 59.8562 73.0313 172.3718 169 C 5.1231 8.7311 121.2573 57.5658 34.0772 173.3718 170 A 4.3945 8.8857 128.5354 52.4562 18.8627 177.0178 171 Q 4.4674 9.3923 119.9688 54.5507 32.2789 175.8689 172 A 4.0920 8.9737 127.7292 53.6267 19.2679 178.8082 173 A 3.8443 8.0247 118.1422 55.4272 18.1038 179.5980 174 F 4.2561 7.9273 114.9903 60.4149 38.7173 177.3585 175 A 4.2102 8.0123 119.9418 55.1847 18.2498 178.6559 176 D 4.3836 8.0768 117.5726 56.8146 40.9389 177.5864 177 Y 5.5071 8.2258 116.4215 56.1505 39.1799 177.5569 178 H 4.2964 8.7606 118.2229 59.0445 28.5525 176.3282 179 K 3.9364 7.6614 120.4087 59.4108 31.8714 179.2323 180 Q 4.0493 8.0707 117.8052 58.8977 28.7099 178.6497 181 I 3.7895 8.0822 121.0155 64.3480 37.1578 178.3851 182 R 3.9387 8.2272 119.5942 59.5153 29.6481 178.8306 183 S 4.0844 7.9665 114.4079 61.6440 62.6886 176.4883 184 L 3.8909 7.9830 121.6238 57.1783 41.9239 177.8896 185 L 4.5036 7.8205 115.5947 53.1030 43.3381 176.1492 186 S 3.6919 7.5305 114.1709 59.4308 60.8138 173.4450 187 V 3.7287 7.7438 118.9369 61.8753 32.3007 173.9350 188 P 4.4399 0.0000 0.0000 62.4892 31.8130 177.6109 189 S 4.1618 8.5602 115.7039 61.0393 63.2556 174.7510 190 D 4.5455 8.0377 118.9444 53.4862 39.7256 175.3271 191 R 5.1747 7.6704 118.9529 54.9930 32.8804 174.9984 192 H 5.0350 9.0082 119.2792 53.9720 31.9754 173.3980 193 I 4.4391 8.6223 123.9318 61.7518 37.1386 175.3763 194 I 4.4633 8.7138 128.6695 62.4865 38.5996 175.3092 195 C 4.8566 7.4257 114.3293 58.3177 32.1524 171.7572 196 G 4.6473 8.7510 106.6716 44.7615 0.0000 171.7481 *198 A 4.5839 8.4853 122.2910 51.9761 20.4149 176.0237 199 L 4.9894 8.0563 121.4008 53.1681 46.0875 175.9481 200 G 3.9106 8.2058 111.1455 46.7988 0.0000 170.2664 201 Y 4.9712 8.0600 117.6999 56.4949 39.2225 176.2418 202 R 3.9671 8.7264 121.2461 56.0453 30.5860 176.1412 203 D 4.5482 8.2978 120.1623 53.6656 42.5211 176.2900 *205 N 4.6843 8.4416 115.6206 52.5084 40.5526 174.9807 206 A 4.2141 7.7412 122.9080 50.9153 19.2691 176.8359 207 P 4.3338 0.0000 0.0000 65.6445 31.5154 178.2824 208 E 4.5382 8.0904 114.5874 57.7250 29.6549 176.8606 209 N 4.6233 7.9903 115.9785 53.3820 38.8521 174.8849 210 N 5.0000 8.1642 116.0328 52.7738 39.3655 173.8843 211 F 5.0863 7.9669 111.8619 54.9891 40.9289 173.6665 212 E 4.6604 8.7705 119.8715 54.6487 31.8095 175.8122 213 T 4.6893 8.0494 111.7054 59.8718 71.0358 174.2836 214 E 4.3913 8.4704 122.6754 56.2056 30.5428 176.2395 215 R 4.7776 7.9958 118.1389 54.0766 34.1493 175.3980 216 E 4.1928 8.7084 120.2072 55.5386 30.3721 175.5837 217 P 4.5000 0.0000 0.0000 62.6848 32.0088 177.4566 218 I 3.1724 8.2084 112.9597 63.3944 37.7521 177.4117 219 D 4.4866 7.9137 119.4712 56.0189 41.0649 177.1347 220 N 4.5710 8.2905 117.4957 55.6969 38.5288 175.9413 221 F 4.9199 7.5253 107.7409 55.6096 39.5119 174.3083 222 V 3.9183 7.3541 122.1889 61.2301 32.4333 174.1149 223 H 4.8198 8.4322 126.4780 54.3434 31.0382 173.0018 224 F 4.6064 8.8406 126.1742 56.2389 39.9140 175.4109 225 I 4.6938 8.2796 125.9055 59.3430 40.1777 175.3474 226 K 4.5516 8.6600 121.1422 56.5489 34.4287 176.4840 227 S 4.6899 7.9874 114.7726 57.1670 64.1824 172.7873 228 Y 4.6407 8.2153 124.0284 55.2468 41.0578 173.2792 229 P 3.9291 0.0000 0.0000 62.6087 31.4266 176.1830 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 4 A 8.26 4.28 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 5 P 0.00 4.18 0.00 2.01 1.81 0.00 3.62 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.99 0.00 6 I 7.79 3.82 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.47 0.89 0.00 0.00 7 D 8.25 4.53 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 8 I 7.89 3.53 1.66 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 1.51 1.09 0.18 0.00 0.00 9 F 7.51 4.49 0.00 3.22 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 8.93 4.00 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 11 S 8.18 4.06 0.00 3.90 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 12 I 7.54 3.82 2.09 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.81 0.96 0.00 0.00 13 L 7.97 4.25 0.00 1.65 1.74 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.25 4.31 0.00 4.00 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 15 R 7.13 3.96 0.00 1.89 1.88 0.00 3.25 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 16 K 8.01 4.51 0.00 1.70 1.62 0.00 1.52 0.00 0.00 1.58 0.00 0.00 2.68 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.21 1.32 7.81 17 S 8.41 4.44 0.00 3.83 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 18 I 8.19 4.30 1.66 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.66 0.04 0.00 0.00 19 R 8.30 4.00 0.00 1.36 0.66 0.00 3.03 0.00 0.00 2.78 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.15 0.00 20 A 6.97 4.72 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 21 F 8.91 5.42 0.00 2.96 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.87 4.46 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 23 D 8.58 4.72 0.00 2.83 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 24 Q 7.96 4.06 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.17 0.00 25 P 0.00 4.55 0.00 2.24 2.05 0.00 3.81 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 26 V 7.96 4.37 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 0.73 0.00 0.00 0.80 0.00 0.00 27 T 8.29 4.04 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 1.23 0.00 0.00 28 Q 8.60 3.95 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 29 E 8.08 3.90 0.00 2.01 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 2.39 2.44 0.00 30 T 7.86 3.43 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 31 I 7.58 3.53 1.89 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 1.38 0.69 0.81 0.00 0.00 32 R 8.10 3.88 0.00 1.93 1.95 0.00 3.10 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 1.62 1.78 0.00 33 E 8.19 3.95 0.00 1.84 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.54 0.00 34 I 7.61 3.70 1.87 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.30 0.82 0.00 0.00 35 L 7.99 3.91 0.00 1.81 1.78 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.21 4.05 0.00 1.88 1.90 0.00 1.84 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.66 7.81 37 L 8.03 4.11 0.00 1.88 1.68 1.09 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 38 A 8.08 3.67 0.43 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 0.00 0.00 39 A 7.99 4.22 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.72 4.28 0.00 2.02 2.01 0.00 3.39 0.00 0.00 3.29 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 41 A 7.29 4.14 1.15 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 0.00 0.00 0.00 42 P 0.00 4.80 0.00 2.27 2.13 0.00 3.86 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 43 S 8.24 4.86 0.00 4.07 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.96 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 0.00 0.00 0.00 45 T 9.42 3.59 4.22 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 1.19 0.00 0.00 46 N 8.23 4.18 0.00 2.81 2.86 0.00 0.00 7.06 7.30 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 47 L 7.98 3.83 0.00 1.50 1.54 0.85 0.78 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 48 Q 7.62 2.00 0.00 1.76 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 49 P 0.00 3.83 0.00 2.02 1.98 0.00 2.72 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.90 0.00 50 W 6.04 4.26 0.00 2.33 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 51 Q 8.94 4.77 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 52 V 8.44 4.82 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 0.65 0.00 0.00 1.32 0.00 0.00 53 I 8.52 4.41 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.55 0.84 0.00 0.00 54 V 8.32 4.42 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 0.67 0.00 0.00 0.84 0.00 0.00 55 L 8.67 4.79 0.00 1.32 1.39 0.89 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.85 4.76 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 1.15 0.00 0.00 57 G 8.74 3.75 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 0.00 58 K 8.63 3.97 0.00 1.77 1.87 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.44 7.81 59 I 7.66 3.70 1.85 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 1.51 1.49 0.94 0.00 0.00 60 L 7.68 3.91 0.00 1.60 1.73 0.77 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 61 Q 8.14 4.00 0.00 2.19 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 62 K 8.25 3.93 0.00 1.92 1.93 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.50 7.81 63 V 8.24 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 1.25 0.00 0.00 1.02 0.00 0.00 64 G 8.32 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 0.00 0.00 0.00 65 Q 8.40 3.97 0.00 2.16 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 66 E 8.46 3.84 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 67 L 8.16 3.66 0.00 1.83 1.58 1.32 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 68 S 8.29 4.16 0.00 4.09 4.22 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 69 Q 8.12 3.96 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.83 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 70 L 7.42 3.75 0.00 0.99 1.13 0.11 0.47 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 71 V 7.17 3.55 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.76 0.00 0.00 72 L 7.82 4.11 0.00 1.64 1.71 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 73 S 7.86 4.50 0.00 3.83 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 74 G 7.79 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 75 I 7.61 4.02 1.90 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 1.24 0.77 0.95 0.00 0.00 76 K 8.54 4.31 0.00 1.77 1.74 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.19 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.39 7.81 77 G 8.37 3.53 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 0.00 78 E 8.90 4.69 0.00 1.67 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.15 0.00 79 R 8.65 4.80 0.00 1.81 2.23 0.00 3.33 0.00 0.00 3.38 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.67 0.00 80 E 8.80 4.20 0.00 1.74 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 1.74 1.47 0.00 81 Y 7.58 4.77 0.00 2.70 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 82 H 8.57 4.78 0.00 3.09 3.23 0.00 5.69 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 9.10 3.97 0.00 2.92 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 84 Y 7.68 4.61 0.00 3.22 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 85 P 0.00 4.08 0.00 0.73 1.46 0.00 2.86 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.51 0.00 86 R 8.27 4.04 0.00 1.71 1.94 0.00 2.77 0.00 0.00 3.01 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.44 0.00 87 Q 7.70 4.51 0.00 2.21 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.81 0.00 0.00 0.00 0.00 0.00 2.23 1.90 0.00 88 W 8.81 4.66 0.00 3.36 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 89 R 8.44 4.90 0.00 1.98 1.87 0.00 3.13 0.00 0.00 3.34 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 90 E 8.63 4.52 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 91 P 0.00 4.46 0.00 2.04 2.13 0.00 3.14 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.72 0.00 92 Y 7.50 4.26 0.00 3.37 3.23 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 93 L 8.46 4.11 0.00 2.12 2.07 0.76 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.25 4.14 0.00 4.08 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 95 R 7.93 3.94 0.00 2.17 2.07 0.00 3.16 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.84 0.00 96 R 8.21 3.89 0.00 1.94 1.93 0.00 2.55 0.00 0.00 2.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.47 0.00 97 R 8.01 3.79 0.00 1.97 1.89 0.00 3.13 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 98 K 8.33 3.87 0.00 1.79 1.80 0.00 1.64 0.00 0.00 1.86 0.00 0.00 3.19 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.55 7.81 99 V 7.70 3.79 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 0.77 0.00 0.00 1.05 0.00 0.00 100 G 7.91 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 0.00 0.00 0.00 101 L 8.10 3.91 0.00 1.63 1.67 0.88 0.99 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 0.00 102 D 8.15 4.08 0.00 2.48 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 0.00 103 L 7.59 3.38 0.00 1.81 1.67 1.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 7.91 4.34 0.00 3.11 3.06 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 0.00 105 K 8.28 3.88 0.00 1.80 1.90 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.41 7.81 106 S 7.94 4.13 0.00 4.31 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 0.00 107 L 7.55 4.42 0.00 1.74 1.74 1.11 1.24 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 0.00 108 G 7.63 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.70 3.91 1.41 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.46 0.16 0.00 0.00 110 Q 9.12 4.40 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.93 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 111 K 8.38 4.06 0.00 1.77 1.64 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.03 7.81 112 G 9.02 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.65 4.62 0.00 2.73 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 0.00 114 Q 7.90 4.06 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.52 7.07 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 115 E 8.21 4.14 0.00 2.15 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 1.90 0.00 116 K 7.57 4.33 0.00 1.91 1.71 0.00 1.77 0.00 0.00 1.50 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.34 7.81 *118 L 8.09 4.23 0.00 1.85 1.84 1.00 0.91 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 0.00 119 H 8.52 4.19 0.00 3.27 3.48 0.00 5.66 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 0.00 120 Q 8.03 3.99 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.56 2.60 0.00 121 K 8.15 4.12 0.00 1.95 2.05 0.00 1.84 0.00 0.00 1.89 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.69 1.61 7.81 122 A 8.43 4.28 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.06 3.94 0.00 2.08 1.99 0.00 1.95 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.54 1.68 7.81 124 N 7.53 3.14 0.00 1.98 1.54 0.00 0.00 6.91 7.83 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 0.00 125 F 7.78 3.82 0.00 3.15 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 7.61 4.49 0.00 1.84 1.78 1.01 1.31 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 0.00 127 F 8.56 4.25 0.00 3.18 3.06 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 0.00 128 Y 8.71 3.96 0.00 3.53 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 0.00 129 G 8.56 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 0.00 0.00 0.00 130 A 7.70 3.73 0.57 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 0.00 131 P 0.00 4.45 0.00 2.16 2.18 0.00 3.54 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.16 0.00 132 V 7.38 4.34 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 0.72 0.00 0.00 0.78 0.00 0.00 133 G 8.41 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 0.00 0.00 0.00 134 L 7.92 4.99 0.00 1.34 0.94 0.96 0.39 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 0.00 135 L 8.33 4.90 0.00 1.38 1.41 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 136 F 9.04 5.45 0.00 3.00 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 0.00 137 T 9.27 5.89 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 1.24 0.00 0.00 138 I 8.01 4.94 1.82 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.70 0.79 0.00 0.00 139 D 8.67 4.97 0.00 2.82 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 0.00 140 H 9.39 4.43 0.00 3.27 3.66 0.00 5.80 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 D 7.18 4.45 0.00 2.91 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *143 E 7.97 4.13 0.00 2.01 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 0.00 2.29 2.25 0.00 *145 G 8.45 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 0.00 146 S 8.09 4.43 0.00 4.09 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 W 8.36 3.98 0.00 3.26 3.23 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 0.00 148 L 8.02 4.06 0.00 1.81 1.79 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 149 D 7.85 4.71 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.12 4.43 0.00 1.62 1.57 0.85 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 151 G 7.77 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *153 F 7.83 4.03 0.00 2.06 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *155 Q 8.08 4.19 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.29 6.82 0.00 0.00 0.00 0.00 0.00 2.22 2.41 0.00 156 T 7.65 3.88 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 1.11 0.00 0.00 157 I 7.34 3.48 1.68 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 0.89 0.13 0.85 0.00 0.00 *159 L 8.29 4.25 0.00 1.68 1.72 0.90 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 160 A 8.34 3.96 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 0.00 161 A 8.38 4.07 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 0.00 162 R 7.86 4.10 0.00 1.94 1.99 0.00 3.53 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.97 0.00 163 G 7.75 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 F 7.86 4.77 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 0.00 165 G 7.92 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 7.91 4.62 0.00 1.62 1.44 0.72 -0.18 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 0.00 167 D 9.12 5.09 0.00 2.58 2.52 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 0.00 168 T 8.28 5.92 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 169 C 8.73 5.12 0.00 3.38 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 0.00 170 A 8.89 4.39 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 0.00 171 Q 9.39 4.47 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.46 2.79 0.00 172 A 8.97 4.09 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 A 8.02 3.84 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 0.00 174 F 7.93 4.26 0.00 3.15 3.23 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 0.00 175 A 8.01 4.21 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 0.00 176 D 8.08 4.38 0.00 2.43 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 Y 8.23 5.51 0.00 3.05 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 H 8.76 4.30 0.00 3.54 3.72 0.00 5.66 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 0.00 179 K 7.66 3.94 0.00 1.78 1.87 0.00 1.64 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.20 7.81 180 Q 8.07 4.05 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.91 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 181 I 8.08 3.79 2.12 0.00 0.00 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 1.58 1.25 0.98 0.00 0.00 182 R 8.23 3.94 0.00 1.93 2.12 0.00 3.11 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.86 0.00 183 S 7.97 4.08 0.00 4.09 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 L 7.98 3.89 0.00 1.75 1.72 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 185 L 7.82 4.50 0.00 1.75 1.66 0.92 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 0.00 186 S 7.53 3.69 0.00 4.05 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 7.74 3.73 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 0.77 0.00 0.00 0.95 0.00 0.00 188 P 0.00 4.44 0.00 2.39 1.95 0.00 3.65 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 189 S 8.56 4.16 0.00 3.95 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 D 8.04 4.55 0.00 2.78 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 0.00 191 R 7.67 5.17 0.00 1.83 1.88 0.00 3.11 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 192 H 9.01 5.03 0.00 3.25 3.48 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 I 8.62 4.44 2.05 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.56 1.07 0.00 0.00 194 I 8.71 4.46 1.77 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 1.31 0.34 0.20 0.00 0.00 195 C 7.43 4.86 0.00 3.28 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 0.00 196 G 8.75 4.65 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 *198 A 8.49 4.58 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 0.00 0.00 199 L 8.06 4.99 0.00 1.68 1.28 0.88 0.95 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 0.00 200 G 8.21 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 0.00 0.00 0.00 201 Y 8.06 4.97 0.00 3.05 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 0.00 202 R 8.73 3.97 0.00 1.71 1.91 0.00 3.00 0.00 0.00 3.07 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 203 D 8.30 4.55 0.00 2.73 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 *205 N 8.44 4.68 0.00 2.91 2.91 0.00 0.00 6.80 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 0.00 206 A 7.74 4.21 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 0.00 207 P 0.00 4.33 0.00 2.48 2.35 0.00 3.72 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 2.10 1.98 0.00 208 E 8.09 4.54 0.00 2.20 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 2.23 2.16 0.00 209 N 7.99 4.62 0.00 2.79 2.76 0.00 0.00 6.75 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 N 8.16 5.00 0.00 2.85 2.80 0.00 0.00 6.70 6.79 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 0.00 211 F 7.97 5.09 0.00 3.06 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 E 8.77 4.66 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 213 T 8.05 4.69 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 214 E 8.47 4.39 0.00 2.02 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 2.34 2.36 0.00 215 R 8.00 4.78 0.00 1.78 1.83 0.00 3.38 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 216 E 8.71 4.19 0.00 2.18 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.28 0.00 217 P 0.00 4.50 0.00 2.23 2.21 0.00 3.76 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 1.99 0.00 218 I 8.21 3.17 1.52 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.07 0.93 0.00 0.00 219 D 7.91 4.49 0.00 2.69 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 0.00 220 N 8.29 4.57 0.00 2.99 2.97 0.00 0.00 6.70 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 0.00 221 F 7.53 4.92 0.00 3.03 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 V 7.35 3.92 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.29 0.00 0.00 223 H 8.43 4.82 0.00 3.06 3.10 0.00 5.79 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 F 8.84 4.61 0.00 3.02 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 I 8.28 4.69 1.84 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.40 0.91 0.00 0.00 226 K 8.66 4.55 0.00 1.83 1.90 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.44 7.81 227 S 7.99 4.69 0.00 3.90 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 0.00 228 Y 8.22 4.64 0.00 2.88 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 0.00 229 P 0.00 3.93 0.00 1.84 1.52 0.00 3.50 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.34 0.00 * Residues marked with a * may have inaccurate shift predictions.