NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4668 8.1927 116.8083 58.2151 65.1206 173.4155 3 Q 4.1575 6.6731 125.0266 55.3873 30.2322 174.2087 4 P 4.4326 0.0000 0.0000 62.3453 32.9663 175.6924 5 D 4.4519 8.3989 121.4015 53.3643 41.8043 173.9129 6 P 4.7393 0.0000 0.0000 60.9559 32.6657 175.0390 7 K 4.4285 7.7394 118.1352 54.7745 34.4798 176.1556 8 P 4.0445 0.0000 0.0000 65.5827 31.6654 177.2381 9 D 4.2808 7.8389 114.4166 55.5921 41.6310 176.7991 10 E 4.1784 8.9471 119.7540 59.3219 29.7934 177.0872 11 L 4.6807 7.0611 117.7761 54.2368 42.5292 176.5647 12 H 4.6452 8.8483 119.5840 55.6554 29.6564 175.0223 13 K 4.8416 8.3585 121.1227 54.4579 34.2966 177.9995 14 S 4.3203 9.3476 118.6170 61.3896 63.1042 176.0250 15 S 4.6009 7.8781 113.6676 59.2395 62.7476 174.5218 16 K 4.3821 8.1341 120.1777 56.1687 33.5403 175.5862 17 F 4.6566 7.8854 121.8132 57.5333 38.8852 175.2170 18 T 3.8272 8.2491 126.6724 65.8865 68.5278 175.8048 19 G 3.4519 6.2460 109.2427 44.0523 0.0000 172.6863 20 L 3.8762 8.0206 119.6941 56.1723 40.7042 177.8836 21 M 4.3467 8.3921 121.3349 56.7389 32.1781 178.0927 22 E 3.8904 7.7772 119.7107 59.5300 29.3186 178.2937 23 N 4.5683 8.0643 114.7917 55.6385 38.8322 175.9239 24 M 3.9259 7.8421 119.7947 56.9388 32.6492 177.4329 25 K 3.8047 7.7679 119.4420 60.0539 32.0325 178.8689 26 V 4.1537 7.9406 112.1206 63.6220 31.4819 178.1199 27 L 4.2231 7.9595 117.6724 56.4393 41.6799 176.9973 28 Y 4.8852 8.2259 114.9139 57.3763 39.8872 175.3237 29 D 5.0303 8.0939 120.8882 53.3739 41.7107 176.1148 30 D 4.2855 8.1136 115.3560 58.1290 41.4823 176.8305 31 N 4.4550 8.0139 117.0078 53.9893 39.1716 174.0774 32 H 5.0096 7.8022 116.1514 55.4325 31.3524 173.3738 33 V 3.7151 7.9589 119.8041 62.2327 32.8164 175.2968 34 S 4.7448 8.1749 120.3595 57.6262 64.8902 173.4863 35 A 4.6701 9.2736 129.7948 50.5378 22.5660 174.3665 36 I 4.2987 8.4699 123.6397 59.9179 38.8024 175.3108 37 N 4.2110 8.2765 125.6177 54.7718 37.3818 173.9528 38 V 4.4223 7.6324 116.1101 59.9308 33.8930 174.5796 39 K 4.6974 8.2037 120.1881 54.3331 34.7428 175.2847 40 S 3.1315 8.4400 119.9538 58.8403 62.3269 173.7371 41 I 4.0396 7.8326 120.8586 61.9921 38.7605 174.3961 42 D 4.4558 7.1440 118.1896 54.0693 43.7186 173.2492 43 Q 4.7584 8.2375 116.8718 54.7142 32.8013 174.1294 44 F 4.8598 9.2891 122.1037 59.5114 40.7540 175.8189 45 L 4.4247 7.4329 118.4273 52.0495 44.8039 177.2338 46 Y 4.2273 7.9849 118.0179 59.1739 38.0588 176.9464 47 F 5.0233 6.7599 115.1944 56.3276 38.3645 174.2162 48 D 5.5175 7.8576 119.5126 52.1651 42.5232 174.6053 49 L 4.8884 9.1995 119.6483 53.0707 45.5568 175.3647 50 I 4.7288 8.4973 122.8927 59.7484 39.9715 174.4089 51 Y 4.6633 9.1602 124.1855 56.3568 41.3928 174.9474 52 S 5.2161 8.7015 117.2119 56.8843 61.8670 171.5968 53 I 4.3436 8.3661 123.0766 58.6804 37.4777 175.2518 54 K 4.0686 8.5976 128.6592 56.2353 32.7895 175.6859 55 D 4.7815 8.3538 124.1955 52.8578 43.9440 174.9385 56 T 4.5875 8.2409 113.2038 61.2383 70.0696 174.8724 57 K 4.1016 8.5336 124.1488 59.0493 32.3619 177.8335 58 L 4.4683 7.1958 114.0574 54.1237 43.0751 175.8344 59 G 3.5131 8.2063 107.1555 46.3211 0.0000 173.9622 60 N 4.2412 7.6787 113.9472 54.6142 39.7924 173.0385 61 Y 4.7483 6.4788 114.2705 57.5096 41.4783 173.5977 62 D 4.7349 8.6721 115.7301 55.4925 44.7846 174.3652 63 N 5.4945 8.3858 115.9477 51.6341 40.9789 174.0416 64 V 4.4694 8.6104 123.8051 60.9383 34.5911 173.9784 65 R 4.3485 7.9415 127.5950 54.3284 32.2059 174.5882 66 V 4.5493 8.6489 126.5175 61.0946 34.1489 173.9267 67 E 5.1598 8.4216 127.1312 54.7572 32.2890 175.0712 68 F 5.2131 9.3477 121.1434 55.2579 42.1698 175.6185 69 K 4.0923 8.8203 120.7568 59.4684 32.3184 175.6827 70 N 4.9752 7.6979 113.6772 50.8696 39.7439 174.2358 71 K 4.3205 8.8696 117.4031 59.7067 32.1039 178.6445 72 D 4.3620 8.3229 119.0614 57.5192 40.8736 178.8532 73 L 3.7933 7.7906 118.0416 57.7560 41.4305 179.3470 74 A 3.6090 7.0803 118.6391 55.2492 18.6033 179.1545 75 D 4.3719 8.2651 117.4012 57.0748 40.6896 178.7115 76 K 3.5264 7.7613 118.5021 59.6912 31.9724 177.3791 77 Y 4.5460 7.2070 111.8296 57.2855 38.2270 176.6673 78 K 3.4414 7.2941 118.0337 60.2005 32.3430 177.5239 79 D 4.6524 8.1708 119.8439 52.7177 40.1937 175.5080 80 K 4.8437 7.2509 118.2274 55.0082 37.2977 176.2054 81 Y 4.7474 8.9023 119.7372 57.3882 39.1279 175.4304 82 V 4.9133 9.0407 116.7791 59.7702 36.8874 173.8393 83 D 5.2707 9.6651 122.4049 52.8459 42.9476 176.0228 84 V 4.5768 8.6283 123.8129 61.3068 34.2194 174.3585 85 F 5.1281 7.3202 125.2495 58.2375 43.5788 173.1925 86 G 4.1652 7.3120 111.8392 45.9043 0.0000 171.1560 87 A 4.5535 8.4361 122.2749 51.1549 19.4580 176.8487 88 N 5.2746 8.5777 119.6444 51.1764 40.9737 173.0555 89 Y 5.0262 8.1760 116.9213 55.9405 41.5881 175.2686 90 Y 4.1366 8.5600 117.2733 60.0383 39.5367 177.6146 91 Y 4.1090 6.7584 114.3351 58.8672 40.6360 175.7439 92 Q 4.1793 7.6951 121.4743 55.2389 30.1746 176.7243 93 C 4.3235 7.6424 118.8463 56.2774 44.0106 172.1097 94 Y 4.7611 8.0899 124.1561 55.9191 41.2211 174.6491 95 F 3.2189 7.5734 116.3682 56.7544 39.7926 174.2491 96 S 4.4599 7.5859 115.4020 56.7973 63.8533 173.6383 *111 K 4.3399 8.3068 122.5737 55.5048 33.5178 177.0388 112 T 4.3885 5.7900 115.8598 60.9577 72.1471 171.8023 113 C 5.2410 7.6505 121.5297 55.5890 45.7042 172.6913 114 M 4.9962 7.9622 116.8025 55.1908 34.6287 172.6871 115 Y 4.9250 8.4396 115.8368 56.0994 41.2844 177.8320 116 G 3.8218 9.3127 111.7032 46.1748 0.0000 176.9069 117 G 4.0980 8.5436 110.4958 45.6389 0.0000 173.1578 118 V 4.3573 7.0990 112.7874 61.4261 32.9193 175.6528 119 T 4.4629 8.2561 114.5388 60.7194 71.1422 172.3133 120 E 4.0264 9.2985 129.3727 57.7611 29.7819 175.8893 121 H 4.6141 9.6509 126.9361 58.4874 30.6812 174.6446 122 N 4.2177 7.8381 116.9834 54.7196 39.3077 174.0295 123 G 4.2196 9.0203 111.0954 45.8900 0.0000 173.9093 124 N 4.5170 7.8292 117.0038 53.7889 38.6532 173.9463 125 Q 5.1730 7.1781 115.4295 53.4382 32.0720 174.6930 126 L 4.3565 7.7093 114.2852 55.3018 42.1790 174.2748 127 D 4.3805 9.0608 122.0526 56.6128 41.0380 176.8932 128 K 4.5996 7.5499 116.0406 54.5147 34.5286 175.1348 129 Y 4.4827 8.3705 118.6461 58.0507 38.8031 175.7307 130 R 4.5758 9.3414 122.7105 55.4625 32.6737 175.3223 131 S 5.2077 8.5247 116.2832 56.9382 65.6091 173.5846 132 I 4.4433 8.7603 125.7439 59.7715 39.5587 175.2079 133 T 4.7705 8.2545 123.3969 62.6761 70.2418 173.9772 134 V 4.0761 8.5434 125.0393 59.8998 34.2350 174.1367 135 R 4.4855 7.8958 127.8008 54.7975 31.8258 175.6264 136 V 4.1888 9.0122 125.2607 61.5672 33.3691 174.7269 137 F 5.2465 9.1777 128.5414 56.2177 39.7349 174.2244 138 E 4.6020 9.0665 124.1766 55.0191 29.7874 176.5650 139 D 4.5914 10.0907 128.6560 55.4019 38.2935 176.1781 140 G 4.0157 8.3244 104.2766 45.6413 0.0000 172.9199 141 K 4.2750 7.4149 119.7377 54.2824 33.9629 175.6327 142 N 5.3995 8.0055 122.4115 52.7327 36.9391 174.0691 143 L 4.4534 8.0105 120.5939 54.3133 42.9723 176.6202 144 L 4.5651 7.5177 121.3114 54.2269 45.3696 173.7447 145 S 5.2671 8.8774 122.4336 56.7419 65.9306 173.2474 146 F 4.9407 8.7143 118.3708 55.9555 41.8304 172.5907 147 D 5.4088 8.6590 118.2288 52.6874 43.9742 175.8616 148 V 4.6538 8.4899 114.1170 59.7958 35.1895 175.0320 149 Q 5.6002 8.3335 122.0936 54.4672 31.5337 174.6660 150 T 4.6582 8.1926 112.5396 61.1464 70.8173 173.0868 151 N 5.0247 8.8644 124.1049 52.4001 37.8792 174.1422 152 K 5.0638 7.2997 115.7324 54.2785 35.2806 176.4656 153 K 4.1952 8.8678 122.9837 58.3367 33.0676 176.4979 154 K 5.0194 8.6381 120.6697 54.5388 33.8890 175.4174 155 V 4.6332 8.8431 127.4817 61.0802 34.4773 175.0008 156 T 4.4907 8.2533 114.3861 60.8578 70.1350 175.6800 157 A 3.9472 8.6390 125.2522 55.1684 18.2171 179.9428 158 Q 3.4921 8.0867 117.7495 59.2819 28.9788 178.1839 159 E 3.8146 8.1481 120.0207 59.2878 29.5294 178.8203 160 L 4.0765 7.6491 117.9379 57.7920 41.7330 178.8154 161 D 4.6709 9.1587 118.3945 57.8048 41.2432 177.7550 162 Y 4.5119 8.5881 119.9757 60.9155 38.9807 177.9886 163 L 4.1243 8.4020 119.8620 58.1391 41.7650 179.6974 164 T 4.0795 8.2665 115.5892 66.9766 68.4156 177.0404 165 R 3.9486 8.2342 119.9263 59.5099 30.1594 178.6272 166 H 4.4900 8.6088 119.8800 58.8598 29.6978 176.7550 167 Y 3.8586 7.9844 121.1471 60.6049 38.5763 177.9001 168 L 3.8922 8.0342 119.8370 57.5196 41.4703 179.6461 169 V 3.8128 7.9651 111.7682 63.4618 31.5888 177.9974 170 K 4.1704 7.3226 116.5616 57.9554 32.4678 177.8046 171 N 4.6279 7.8279 114.0831 52.8301 39.5195 175.2412 172 K 4.4602 7.5916 118.6184 54.5648 33.7183 175.5121 173 K 4.0182 8.0748 115.3891 57.5634 29.6106 176.3699 174 L 3.7349 8.3096 121.2631 57.8030 41.8112 176.4796 175 Y 4.6466 7.6091 117.6077 55.9142 39.0586 175.0256 176 E 4.5078 8.5282 123.6744 54.8455 31.7836 176.8334 177 F 4.3293 8.9183 119.8625 61.3575 39.6218 176.3898 178 N 4.4230 8.3674 117.4952 55.4231 40.3385 173.3860 179 N 4.9051 8.0136 120.1464 52.3606 40.3238 173.1740 180 S 4.9771 8.5115 109.1105 55.8983 64.6748 173.2617 181 P 4.4178 0.0000 0.0000 63.7091 30.8802 174.9745 182 Y 4.4427 7.8103 115.6805 56.2475 41.0759 174.5152 183 E 4.3730 10.1812 124.2125 56.4936 29.8382 175.8947 184 T 5.0919 7.7827 108.0721 60.2288 72.7978 172.7558 185 G 4.6925 8.4806 107.9071 45.6691 0.0000 171.5393 186 Y 5.3973 8.8741 120.3917 55.6330 41.9720 173.2125 187 I 4.8119 8.8214 123.9319 59.2994 39.9495 174.2625 188 K 5.1735 9.1984 128.6992 55.1324 35.9072 174.8176 189 F 4.9459 9.1774 121.1520 55.6983 41.8547 174.5463 190 I 4.8257 8.7534 123.5806 59.6410 40.7295 174.6034 191 E 4.3569 9.5809 127.9770 57.0115 31.2666 178.4522 192 N 3.8739 9.3530 123.1392 54.5523 39.1115 176.0855 193 E 4.0726 9.1551 121.6260 60.0344 30.9454 177.2883 194 N 4.8433 8.3042 116.9759 53.0190 39.5998 174.0987 195 S 5.6691 9.1669 115.3419 58.8648 66.2907 174.1349 196 F 5.5451 8.3577 119.6785 54.5894 41.5610 173.5061 197 W 5.6784 8.1364 115.3704 55.4449 31.6922 173.5110 198 Y 4.8020 9.4130 117.0884 56.1871 41.7422 174.8826 199 D 5.2235 8.9767 122.8791 53.8960 41.3118 175.3402 200 M 4.7934 8.8105 125.1944 55.9059 32.4632 175.6491 201 M 4.9222 8.6759 117.0125 52.8514 35.2670 173.8957 202 P 4.1678 0.0000 0.0000 62.2829 32.1189 176.2352 203 A 4.3641 8.3778 122.8379 51.0602 19.1646 175.8350 204 P 4.4050 0.0000 0.0000 61.9144 32.0860 176.5541 205 G 4.3904 7.4869 111.3173 44.9313 0.0000 172.5167 206 D 4.5267 8.1738 118.1956 54.8758 41.5987 175.8672 207 K 4.8124 7.7084 115.6993 55.7245 36.1988 174.8517 208 F 4.8129 8.8792 122.6189 56.3640 41.2671 175.1637 209 D 4.4764 8.0236 127.9896 52.8635 40.8503 176.1578 210 Q 3.4707 8.0800 126.7405 58.6290 28.6417 178.5261 211 S 3.1551 7.5604 113.3566 61.2515 62.1708 176.3772 212 K 3.8135 8.2764 119.9508 59.2773 31.8400 178.6078 213 Y 4.0104 7.6266 119.8209 60.6459 38.8565 177.8630 214 L 3.9263 8.0480 119.4407 57.0607 41.6252 178.9154 215 M 2.5500 6.8481 118.6815 57.7210 31.6933 177.6738 216 M 3.8039 6.7493 116.2651 58.2203 30.8437 176.7420 217 Y 4.5161 7.0121 115.6786 58.2018 38.2318 176.7618 218 N 4.5419 8.3241 120.3258 54.9626 37.7516 176.1621 219 D 4.6632 8.0794 116.7956 52.9681 39.9990 175.3213 220 N 4.2112 8.0625 117.2889 54.1119 38.3250 173.3593 221 K 4.1408 8.0037 114.3368 57.2825 33.0160 176.0363 222 M 5.3862 8.5958 122.5888 53.8180 35.9934 174.7192 223 V 4.6349 9.3192 113.8040 59.9462 37.4917 173.6974 224 D 5.2126 8.5946 121.8866 53.2502 41.6806 177.3479 225 S 4.3899 9.5691 120.9108 59.7885 63.2088 175.4381 226 K 4.3072 7.9074 121.2183 57.1330 32.7261 176.2538 227 D 4.8606 7.9340 116.3707 54.4341 42.9253 176.8233 228 V 4.2022 7.5430 118.9425 61.4489 32.1862 175.8576 229 K 4.6024 9.0409 125.1295 54.5915 35.4803 174.5522 230 I 4.6019 7.9423 126.0323 59.4759 40.4373 174.4661 231 E 4.2122 8.6888 124.3961 54.3678 33.6899 174.5086 232 V 4.3270 7.4724 123.6337 61.0430 34.3453 173.6454 233 Y 4.9240 8.1329 125.2784 56.1850 40.3264 174.8065 234 L 5.2684 9.1559 123.9109 53.1859 46.5381 176.1597 235 T 5.0789 8.9986 117.1437 60.5627 71.5120 173.7664 236 T 4.2071 8.8679 117.3696 61.2661 69.7261 174.1904 237 K 4.1220 7.7928 123.5831 56.6040 33.2063 176.9720 238 K 4.0908 8.5894 125.4655 56.4490 32.2115 176.2353 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 2 S 8.19 4.47 0.00 4.15 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 3 Q 6.67 4.16 0.00 2.09 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.82 0.00 0.00 0.00 0.00 0.00 2.57 2.46 0.00 4 P 0.00 4.43 0.00 2.16 2.01 0.00 3.84 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 2.08 2.12 0.00 5 D 8.40 4.45 0.00 2.58 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 6 P 0.00 4.74 0.00 1.33 0.68 0.00 2.69 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.44 0.00 7 K 7.74 4.43 0.00 1.63 1.76 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.26 1.47 7.81 8 P 0.00 4.04 0.00 2.14 1.98 0.00 3.81 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 2.06 1.97 0.00 9 D 7.84 4.28 0.00 2.61 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 10 E 8.95 4.18 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 11 L 7.06 4.68 0.00 1.49 1.64 1.00 0.47 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 12 H 8.85 4.65 0.00 3.27 3.34 0.00 5.63 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 13 K 8.36 4.84 0.00 1.86 2.00 0.00 1.71 0.00 0.00 2.09 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.45 7.81 14 S 9.35 4.32 0.00 4.08 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 15 S 7.88 4.60 0.00 4.42 3.98 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 16 K 8.13 4.38 0.00 2.05 1.88 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.39 7.81 17 F 7.89 4.66 0.00 2.92 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 18 T 8.25 3.83 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 1.14 0.00 0.00 19 G 6.25 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.02 3.88 0.00 1.43 1.52 0.93 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 21 M 8.39 4.35 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.02 0.00 22 E 7.78 3.89 0.00 1.39 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 2.53 2.55 0.00 23 N 8.06 4.57 0.00 2.82 3.14 0.00 0.00 6.77 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 M 7.84 3.93 0.00 1.29 0.90 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.81 0.00 25 K 7.77 3.80 0.00 1.92 1.98 0.00 2.23 0.00 0.00 2.15 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.62 1.69 7.81 26 V 7.94 4.15 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 1.25 0.00 0.00 1.09 0.00 0.00 27 L 7.96 4.22 0.00 1.46 1.43 1.21 0.75 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 28 Y 8.23 4.89 0.00 3.18 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 29 D 8.09 5.03 0.00 2.96 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 30 D 8.11 4.29 0.00 2.80 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 31 N 8.01 4.46 0.00 2.80 2.88 0.00 0.00 6.71 8.16 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 32 H 7.80 5.01 0.00 2.31 2.54 0.00 5.32 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.96 3.72 1.75 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 0.78 0.00 0.00 0.51 0.00 0.00 34 S 8.17 4.74 0.00 3.68 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 35 A 9.27 4.67 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 36 I 8.47 4.30 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.97 0.87 0.00 0.00 37 N 8.28 4.21 0.00 2.87 3.00 0.00 0.00 7.19 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 38 V 7.63 4.42 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 0.71 0.00 0.00 1.15 0.00 0.00 39 K 8.20 4.70 0.00 0.86 1.36 0.00 0.96 0.00 0.00 1.22 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.06 1.23 7.81 40 S 8.44 3.13 0.00 3.43 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 41 I 7.83 4.04 1.81 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 1.26 0.69 0.89 0.00 0.00 42 D 7.14 4.46 0.00 2.64 2.49 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 43 Q 8.24 4.76 0.00 1.99 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.28 0.00 44 F 9.29 4.86 0.00 2.87 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 45 L 7.43 4.42 0.00 0.30 0.24 0.40 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 7.98 4.23 0.00 2.99 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 47 F 6.76 5.02 0.00 3.45 3.32 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 48 D 7.86 5.52 0.00 2.74 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 49 L 9.20 4.89 0.00 1.88 1.46 1.22 0.70 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 50 I 8.50 4.73 1.74 0.00 0.00 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 0.79 0.58 0.77 0.00 0.00 51 Y 9.16 4.66 0.00 2.81 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.70 5.22 0.00 3.88 3.80 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 53 I 8.37 4.34 2.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.78 1.02 0.00 0.00 54 K 8.60 4.07 0.00 1.73 1.71 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.43 7.81 55 D 8.35 4.78 0.00 2.19 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 0.00 0.00 0.00 0.00 56 T 8.24 4.59 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 1.18 0.00 0.00 57 K 8.53 4.10 0.00 1.78 1.82 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.50 7.81 58 L 7.20 4.47 0.00 1.65 1.65 0.88 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.21 3.51 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 N 7.68 4.24 0.00 2.70 3.17 0.00 0.00 7.14 7.54 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 61 Y 6.48 4.75 0.00 3.07 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 62 D 8.67 4.73 0.00 2.74 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 63 N 8.39 5.49 0.00 2.93 3.01 0.00 0.00 6.55 7.68 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 64 V 8.61 4.47 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 0.49 0.00 0.00 0.67 0.00 0.00 65 R 7.94 4.35 0.00 0.67 1.29 0.00 3.25 0.00 0.00 3.06 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.24 0.00 66 V 8.65 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 0.49 0.00 0.00 0.76 0.00 0.00 67 E 8.42 5.16 0.00 1.64 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 2.24 1.99 0.00 68 F 9.35 5.21 0.00 3.20 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 69 K 8.82 4.09 0.00 1.96 1.92 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.36 7.81 70 N 7.70 4.98 0.00 3.02 2.95 0.00 0.00 5.92 7.20 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 71 K 8.87 4.32 0.00 2.09 1.91 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.82 1.86 7.81 72 D 8.32 4.36 0.00 3.03 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 73 L 7.79 3.79 0.00 1.74 1.16 0.95 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 74 A 7.08 3.61 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 D 8.27 4.37 0.00 2.76 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 76 K 7.76 3.53 0.00 1.29 0.84 0.00 1.46 0.00 0.00 1.31 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.21 1.39 7.81 77 Y 7.21 4.55 0.00 2.97 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 78 K 7.29 3.44 0.00 1.87 1.62 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.18 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.40 7.81 79 D 8.17 4.65 0.00 2.66 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.25 4.84 0.00 1.83 1.79 0.00 1.83 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.49 7.81 81 Y 8.90 4.75 0.00 2.92 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 82 V 9.04 4.91 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 0.94 0.00 0.00 1.05 0.00 0.00 83 D 9.67 5.27 0.00 2.54 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.63 4.58 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 0.69 0.00 0.00 0.34 0.00 0.00 85 F 7.32 5.13 0.00 3.19 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 86 G 7.31 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 0.00 0.00 0.00 0.00 87 A 8.44 4.55 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 88 N 8.58 5.27 0.00 2.23 2.50 0.00 0.00 5.75 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 89 Y 8.18 5.03 0.00 3.13 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 90 Y 8.56 4.14 0.00 3.11 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 91 Y 6.76 4.11 0.00 3.02 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 92 Q 7.70 4.18 0.00 1.82 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.75 0.00 0.00 0.00 0.00 0.00 1.98 1.16 0.00 93 C 7.64 4.32 0.00 2.51 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 94 Y 8.09 4.76 0.00 2.91 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 95 F 7.57 3.22 0.00 2.62 2.65 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 96 S 7.59 4.46 0.00 3.67 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 *111 K 8.31 4.34 0.00 2.21 1.79 0.00 1.88 0.00 0.00 1.72 0.00 0.00 2.71 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.65 7.81 112 T 5.79 4.39 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 0.01 0.00 0.00 113 C 7.65 5.24 0.00 1.23 2.33 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 0.00 114 M 7.96 5.00 0.00 1.83 2.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.83 4.52 0.00 2.81 3.10 0.00 0.00 6.93 6.55 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 0.00 125 Q 7.18 5.17 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.48 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 126 L 7.71 4.36 0.00 1.65 1.55 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 127 D 9.06 4.38 0.00 2.64 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 0.00 128 K 7.55 4.60 0.00 1.72 1.74 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.43 7.81 129 Y 8.37 4.48 0.00 2.85 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 0.00 130 R 9.34 4.58 0.00 1.75 1.86 0.00 3.23 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 131 S 8.52 5.21 0.00 3.72 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 0.00 132 I 8.76 4.44 1.84 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.69 0.88 0.00 0.00 133 T 8.25 4.77 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 1.06 0.00 0.00 134 V 8.54 4.08 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 0.13 0.00 0.00 0.56 0.00 0.00 135 R 7.90 4.49 0.00 1.38 1.94 0.00 3.20 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.44 0.00 136 V 9.01 4.19 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 0.99 0.00 0.00 1.09 0.00 0.00 137 F 9.18 5.25 0.00 2.72 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 0.00 138 E 9.07 4.60 0.00 2.08 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 2.58 2.74 0.00 139 D 10.09 4.59 0.00 2.86 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 0.00 140 G 8.32 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 0.00 141 K 7.41 4.28 0.00 1.86 1.63 0.00 1.59 0.00 0.00 1.46 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.43 7.81 142 N 8.01 5.40 0.00 2.13 2.59 0.00 0.00 7.31 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 0.00 143 L 8.01 4.45 0.00 1.71 1.72 0.94 0.97 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 0.00 144 L 7.52 4.57 0.00 1.83 1.61 1.07 1.02 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 0.00 145 S 8.88 5.27 0.00 3.76 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 0.00 146 F 8.71 4.94 0.00 2.61 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 0.00 147 D 8.66 5.41 0.00 2.57 2.65 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 0.00 148 V 8.49 4.65 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 0.90 0.00 0.00 149 Q 8.33 5.60 0.00 1.81 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.73 0.00 0.00 0.00 0.00 0.00 2.19 2.37 0.00 150 T 8.19 4.66 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 1.25 0.00 0.00 151 N 8.86 5.02 0.00 2.55 1.85 0.00 0.00 5.88 7.13 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 0.00 152 K 7.30 5.06 0.00 1.76 1.99 0.00 1.63 0.00 0.00 1.55 0.00 0.00 3.16 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.31 7.81 153 K 8.87 4.20 0.00 1.72 1.87 0.00 1.89 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.29 7.81 154 K 8.64 5.02 0.00 1.74 1.70 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.43 7.81 155 V 8.84 4.63 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 0.98 0.00 0.00 156 T 8.25 4.49 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 1.18 0.00 0.00 157 A 8.64 3.95 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 0.00 158 Q 8.09 3.49 0.00 1.43 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.84 0.00 0.00 0.00 0.00 0.00 2.11 1.16 0.00 159 E 8.15 3.81 0.00 1.72 1.69 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 1.58 1.47 0.00 160 L 7.65 4.08 0.00 2.33 1.95 1.10 0.96 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 0.00 161 D 9.16 4.67 0.00 3.40 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 0.00 162 Y 8.59 4.51 0.00 3.38 3.51 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 0.00 0.00 0.00 0.00 163 L 8.40 4.12 0.00 2.01 1.82 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 164 T 8.27 4.08 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 1.25 0.00 0.00 165 R 8.23 3.95 0.00 1.83 1.87 0.00 2.21 0.00 0.00 2.79 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.07 0.00 166 H 8.61 4.49 0.00 2.68 3.31 0.00 5.65 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 0.00 167 Y 7.98 3.86 0.00 3.16 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 L 8.03 3.89 0.00 1.79 1.57 0.89 0.80 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 0.00 169 V 7.97 3.81 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 1.00 0.00 0.00 1.04 0.00 0.00 170 K 7.32 4.17 0.00 1.56 1.69 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.75 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.57 7.81 171 N 7.83 4.63 0.00 2.15 2.52 0.00 0.00 6.74 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 0.00 172 K 7.59 4.46 0.00 1.59 1.72 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.16 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.53 7.81 173 K 8.07 4.02 0.00 1.98 1.93 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.48 7.81 174 L 8.31 3.73 0.00 1.39 1.46 0.35 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 175 Y 7.61 4.65 0.00 2.98 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 0.00 176 E 8.53 4.51 0.00 2.23 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 0.00 2.39 2.53 0.00 177 F 8.92 4.33 0.00 3.19 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 0.00 178 N 8.37 4.42 0.00 2.88 2.91 0.00 0.00 6.63 7.79 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 0.00 179 N 8.01 4.91 0.00 2.87 2.51 0.00 0.00 6.81 7.05 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 0.00 180 S 8.51 4.98 0.00 4.25 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 0.00 181 P 0.00 4.42 0.00 1.93 1.93 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 2.22 2.28 0.00 182 Y 7.81 4.44 0.00 2.76 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 E 10.18 4.37 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.20 0.00 184 T 7.78 5.09 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 1.27 0.00 0.00 185 G 8.48 4.69 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 0.00 0.00 0.00 186 Y 8.87 5.40 0.00 3.45 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 0.00 187 I 8.82 4.81 1.88 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 0.77 1.28 1.32 0.00 0.00 188 K 9.20 5.17 0.00 2.06 2.18 0.00 1.67 0.00 0.00 2.03 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.33 7.81 189 F 9.18 4.95 0.00 1.62 2.65 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 0.00 190 I 8.75 4.83 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.67 0.92 0.00 0.00 191 E 9.58 4.36 0.00 2.06 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 2.25 2.34 0.00 192 N 9.35 3.87 0.00 2.85 2.63 0.00 0.00 7.21 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 E 9.16 4.07 0.00 1.99 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 2.33 2.32 0.00 194 N 8.30 4.84 0.00 2.83 2.80 0.00 0.00 6.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 9.17 5.67 0.00 3.98 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 0.00 196 F 8.36 5.55 0.00 2.94 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 0.00 197 W 8.14 5.68 0.00 3.78 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 0.00 198 Y 9.41 4.80 0.00 3.17 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 0.00 199 D 8.98 5.22 0.00 3.16 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 0.00 200 M 8.81 4.79 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.38 0.00 201 M 8.68 4.92 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.80 0.00 202 P 0.00 4.17 0.00 1.04 0.87 0.00 3.70 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.24 0.00 203 A 8.38 4.36 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 0.00 204 P 0.00 4.40 0.00 2.11 2.09 0.00 3.81 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 2.06 2.17 0.00 205 G 7.49 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 0.00 0.00 0.00 0.00 206 D 8.17 4.53 0.00 2.62 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 K 7.71 4.81 0.00 1.84 1.78 0.00 1.81 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.48 7.81 208 F 8.88 4.81 0.00 2.82 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 0.00 209 D 8.02 4.48 0.00 2.73 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 0.00 0.00 0.00 210 Q 8.08 3.47 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.66 0.00 0.00 0.00 0.00 0.00 2.80 2.53 0.00 211 S 7.56 3.16 0.00 3.37 3.80 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 0.00 212 K 8.28 3.81 0.00 1.57 1.74 0.00 1.69 0.00 0.00 1.54 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.51 7.81 213 Y 7.63 4.01 0.00 2.95 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 0.00 214 L 8.05 3.93 0.00 1.89 1.88 1.18 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 215 M 6.85 2.55 0.00 1.75 1.42 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 216 M 6.75 3.80 0.00 1.64 1.46 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 217 Y 7.01 4.52 0.00 3.14 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 0.00 218 N 8.32 4.54 0.00 2.99 3.06 0.00 0.00 6.74 7.81 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 0.00 219 D 8.08 4.66 0.00 2.81 2.79 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 0.00 220 N 8.06 4.21 0.00 3.24 3.02 0.00 0.00 7.14 6.07 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 0.00 221 K 8.00 4.14 0.00 1.79 1.64 0.00 1.06 0.00 0.00 1.39 0.00 0.00 2.54 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.47 1.06 7.81 222 M 8.60 5.39 0.00 1.88 1.96 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.55 0.00 223 V 9.32 4.63 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 0.88 0.00 0.00 1.02 0.00 0.00 224 D 8.59 5.21 0.00 3.04 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 0.00 225 S 9.57 4.39 0.00 4.01 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 0.00 226 K 7.91 4.31 0.00 1.74 1.87 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.45 7.81 227 D 7.93 4.86 0.00 2.70 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 0.00 228 V 7.54 4.20 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 0.75 0.00 0.00 1.08 0.00 0.00 229 K 9.04 4.60 0.00 1.75 1.57 0.00 1.48 0.00 0.00 1.57 0.00 0.00 2.74 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.15 1.23 7.81 230 I 7.94 4.60 1.48 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.16 0.26 0.00 0.00 231 E 8.69 4.21 0.00 1.40 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 0.00 0.00 0.00 1.66 1.89 0.00 232 V 7.47 4.33 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 0.76 0.00 0.00 0.70 0.00 0.00 233 Y 8.13 4.92 0.00 1.65 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 L 9.16 5.27 0.00 1.84 1.53 0.73 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 235 T 9.00 5.08 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 236 T 8.87 4.21 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 237 K 7.79 4.12 0.00 1.86 2.02 0.00 1.58 0.00 0.00 1.63 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.35 7.81 238 K 8.59 4.09 0.00 1.74 1.72 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.42 7.81 * Residues marked with a * may have inaccurate shift predictions.