NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.3966 8.3193 115.2838 58.1893 62.3612 172.3503 5 I 4.5827 7.7904 119.8813 57.2066 40.6918 173.1061 6 P 4.6089 0.0000 0.0000 62.6668 32.8000 177.2415 7 L 4.8432 8.8704 121.1360 52.4555 44.0589 176.4528 8 I 3.9445 8.3157 122.6298 63.5117 37.3729 176.6639 9 G 3.9842 9.3380 113.5903 45.1667 0.0000 173.3402 10 E 4.4446 8.1887 120.0394 55.1629 31.2838 176.0487 11 R 4.3526 8.4750 123.5228 56.1375 30.8850 175.9349 12 F 3.8467 8.8900 128.8055 58.0405 39.9545 173.2618 13 P 4.1093 0.0000 0.0000 62.2118 31.5408 175.7684 14 E 4.4668 9.0379 123.9309 56.5350 30.0722 175.5917 15 M 4.5226 8.2318 120.0773 54.7454 34.0645 173.2193 16 E 4.9843 8.8600 120.3342 55.4149 31.3943 175.8843 17 V 4.5642 8.7163 116.4705 59.8741 36.1186 174.5081 18 T 4.9417 8.3772 119.8566 62.3493 70.6308 173.8950 19 T 5.1649 8.5561 115.5999 59.3362 72.7036 173.9691 20 D 4.7598 8.6938 118.9347 54.7562 39.2164 176.7140 21 H 4.6487 9.1784 115.9220 55.2607 30.1683 173.4379 22 G 3.8125 7.2896 105.7168 43.3416 0.0000 172.3056 23 V 4.6431 7.9492 119.9798 61.9393 32.3982 175.5651 24 I 4.6259 8.4777 119.8891 59.1104 41.6524 173.5215 25 K 4.8407 8.3769 124.1853 55.0077 34.3330 174.8167 26 L 5.0565 8.7209 127.0593 52.3674 44.7122 175.3617 27 P 4.6534 0.0000 0.0000 63.2496 31.8210 177.4915 28 D 4.3820 8.1351 120.0930 58.4399 40.5261 178.1468 29 H 3.8941 8.0960 117.0323 58.8102 29.8249 176.1813 30 Y 4.3107 7.4764 117.3549 60.1191 38.6101 177.5238 31 V 3.7856 8.0666 119.7269 66.4250 31.3508 177.8243 32 S 4.3470 8.0907 110.9130 59.9289 63.1906 175.0677 33 Q 4.5081 8.0685 120.8073 54.8072 29.1080 175.6336 34 G 3.9690 7.9381 107.9684 46.3586 0.0000 173.5235 35 K 4.9842 7.8691 118.1709 54.4717 34.5486 176.4794 36 W 4.6998 9.2134 124.0665 56.5703 30.9738 175.1867 37 F 5.2667 8.8068 115.7656 55.4258 41.3238 173.4288 38 V 4.6150 8.5710 121.5000 61.3200 33.3427 174.0112 39 L 4.8400 8.7294 131.2699 53.5372 43.7632 174.8890 40 F 5.5074 7.6896 121.8695 55.0335 40.5023 174.3248 41 S 5.4962 9.1888 117.8961 57.2627 65.8029 172.7388 42 H 5.0526 9.6862 118.7012 53.6447 32.0716 172.8802 43 P 4.3156 0.0000 0.0000 65.4804 31.4639 176.3129 44 A 4.4374 7.1342 116.2118 51.1487 21.8658 175.4396 45 D 3.3700 8.5546 120.0831 53.9779 41.5652 176.3813 46 F 3.4218 4.0000 116.4622 58.9016 36.4535 175.7790 47 T 4.5770 6.2967 105.9263 58.8925 71.7348 172.5657 48 P 4.3559 0.0000 0.0000 66.2227 31.7991 179.3871 49 V 3.5073 7.8289 115.6167 63.7573 31.3846 177.2406 *51 T 4.2208 8.0635 116.6322 63.3999 70.4574 176.1170 52 T 3.9608 8.0915 111.9781 65.1852 68.3560 176.1595 53 E 4.0042 8.4214 121.2949 59.0949 29.4941 179.2678 54 F 4.4092 8.6300 117.4147 60.8177 39.0051 177.7512 55 V 3.6796 8.2388 117.9222 66.0219 31.0726 178.0696 56 S 4.1315 8.0336 112.2274 61.2130 62.4998 175.9035 57 F 4.3131 8.5240 120.5183 60.5631 38.5536 177.3936 58 A 4.3148 8.5963 120.5747 55.4709 17.9714 179.6345 59 R 4.0212 8.5117 116.3318 58.7690 30.3427 177.9144 60 R 4.5544 7.8556 116.0435 55.8237 30.4341 176.8543 61 Y 4.3927 7.8737 122.2140 61.3314 38.7073 178.2906 62 E 3.8527 8.3652 119.2899 58.9966 29.7384 178.1040 63 D 4.3038 8.0838 118.6787 57.4305 40.8337 178.6184 64 F 4.0468 7.9286 117.9421 60.7051 38.8638 177.7019 65 Q 3.9082 8.0645 117.6175 59.1564 28.2539 179.3163 66 R 3.9467 7.9611 117.9702 58.7689 30.1512 178.1672 67 L 4.3106 7.4491 116.0831 54.2454 41.9927 177.1247 68 G 3.8645 8.2606 107.8890 46.3059 0.0000 172.8629 69 V 4.8999 8.0305 119.6970 60.9303 33.2501 174.7996 70 D 4.9455 9.4629 127.9964 53.1245 43.2153 175.2895 71 L 4.7636 8.2032 120.2272 52.9540 44.4045 175.9549 72 I 4.3397 7.8693 122.6223 59.3201 41.5586 175.0012 73 G 3.5309 8.4507 116.9511 45.4119 0.0000 172.2209 74 L 5.0996 8.6230 121.5273 53.7617 45.7079 174.5864 75 S 5.6449 9.0116 120.1061 55.6852 66.3577 173.2832 76 V 4.4061 8.4902 126.4731 61.2922 29.7341 174.2238 77 D 4.7345 7.8144 121.9580 52.8223 45.2401 175.3549 78 S 4.3580 8.4388 115.6664 57.7809 64.1705 175.7130 79 V 3.4196 7.9400 120.9423 64.8197 30.9314 178.3601 80 F 4.2242 7.1822 117.8677 60.5189 38.8091 177.6304 81 S 4.3736 8.0275 114.4762 61.8531 62.5992 176.0951 82 H 4.4719 8.1824 118.8252 59.3495 28.5138 177.7627 83 I 3.7628 7.8738 121.0285 64.4061 36.9664 178.5654 84 K 4.1325 8.2468 119.3439 59.3321 31.9627 179.0330 85 W 3.8538 8.7783 128.7773 60.5531 30.5765 178.1513 86 K 3.8068 8.5015 118.7143 59.2582 31.3978 179.0721 87 E 3.9371 8.4634 119.8031 58.8838 29.5870 178.3831 88 W 4.2287 8.6060 128.5435 60.8329 30.7858 177.8111 89 I 3.9531 8.2540 119.5831 64.6656 36.7210 178.1048 90 E 4.1109 8.1763 121.3488 58.4557 29.1736 178.8793 91 R 3.8324 7.6565 118.1876 59.2135 30.3202 177.4031 92 H 4.2645 7.7692 113.9850 56.2080 29.3045 175.9519 93 I 4.1783 7.5770 119.5700 60.2969 38.6422 176.1512 94 G 3.7730 7.6526 106.7453 46.2032 0.0000 173.3637 95 V 4.2776 7.4684 118.4549 60.3635 34.0186 174.2821 96 R 4.1219 8.5314 127.6956 55.8110 30.6427 175.6086 97 I 3.8698 7.9178 126.5376 59.2724 36.7512 173.8088 98 P 4.2380 0.0000 0.0000 63.0932 31.8450 176.0513 99 F 4.9822 6.3777 113.7102 53.9077 40.4961 173.3345 100 P 4.3719 0.0000 0.0000 62.9273 32.9729 174.9222 101 I 4.8366 8.6446 121.4059 59.3479 40.9672 175.0065 102 I 4.3413 9.0200 128.5449 61.3282 38.1576 174.9262 103 A 4.7146 8.9869 130.3633 50.2787 19.4567 177.2730 104 D 4.9561 8.3531 124.7812 53.0206 41.6452 174.0699 105 P 4.5974 0.0000 0.0000 64.1562 32.3658 176.5225 106 Q 4.0190 8.8693 119.0912 54.7444 27.4140 174.4660 107 G 4.2718 8.4457 105.4387 46.6492 0.0000 175.9785 108 T 3.8461 7.4854 118.3729 66.3115 68.2706 176.4257 109 V 3.5141 8.4653 119.9673 65.9779 31.7022 177.5358 110 A 4.0639 8.5677 120.9391 55.4894 18.1217 179.6644 111 R 3.7741 8.1741 116.6874 59.7568 30.0851 178.5129 112 R 3.8595 7.8304 117.0529 58.9496 29.9600 177.1328 113 L 4.5303 7.5188 115.8404 53.5480 42.4280 176.8306 114 G 3.9077 8.1929 107.6938 46.6087 0.0000 174.7246 115 L 4.7078 8.6229 118.1100 54.5697 41.7876 176.9594 116 L 4.5081 7.1974 120.8750 54.0822 40.4106 176.6938 117 H 4.6686 8.2661 123.1415 54.9368 30.8401 175.3143 118 A 4.4725 8.5327 121.7109 53.1049 20.2666 177.5675 119 E 4.2299 8.1126 112.2906 57.5951 30.1495 177.9796 120 S 4.2221 7.8336 116.5852 59.4116 62.9617 173.7081 121 A 3.9810 7.2789 125.1385 51.8893 17.9448 178.2296 122 T 4.5100 7.6228 106.3527 60.6239 71.3451 174.1057 123 H 4.9771 7.6968 119.4861 53.6749 30.4024 174.5300 124 T 4.0401 8.8075 120.4548 64.1121 68.6858 174.0902 125 V 3.8364 8.5266 126.9333 62.2612 32.4041 177.1167 126 R 4.7105 8.0499 118.9886 54.2774 28.2064 174.7077 127 G 4.1949 8.9408 113.8240 45.3450 0.0000 170.2424 128 V 5.0054 8.3367 122.5035 60.7366 34.9692 174.1165 129 F 5.1778 9.3808 126.3804 55.8272 41.8108 174.3004 130 I 4.6571 8.6765 125.6730 59.9095 38.7195 174.8787 131 V 4.5226 8.2994 128.3593 60.7521 34.0370 175.5974 132 D 3.3700 8.1843 127.7017 51.2717 40.4370 176.6685 133 A 4.2693 6.7512 119.9232 53.5890 18.3392 178.3991 134 R 4.0847 7.7154 113.9103 56.3465 30.6293 177.4894 135 G 3.8923 8.4420 107.4226 45.3769 0.0000 172.6346 136 V 4.5306 7.4158 119.1956 60.4990 33.2058 174.8949 137 I 4.2312 8.6521 128.9063 61.8380 37.3090 176.7101 138 R 4.6659 8.9113 125.5705 57.3052 32.7699 176.5151 139 T 4.8134 7.6323 113.1568 62.4295 73.3235 172.9775 140 M 4.9363 8.4769 123.0966 53.5749 35.9965 174.5397 141 L 4.7452 8.3252 122.6389 53.0725 45.6354 175.2891 142 Y 5.1389 8.6937 120.2381 56.6113 39.8012 174.6212 143 Y 4.5358 8.8329 122.0391 56.0060 39.8894 174.2029 144 P 4.6873 0.0000 0.0000 62.0917 32.7954 177.1620 145 M 4.1060 8.5549 118.6704 58.3345 31.7718 177.6261 146 E 4.3973 8.1132 113.6610 55.8128 30.0344 175.4892 147 L 4.6446 7.9848 121.2378 53.1128 44.0026 176.3803 148 G 3.7606 8.7162 115.5913 45.3648 0.0000 172.7888 149 R 3.2272 9.2094 122.5797 55.6875 30.8763 176.7477 150 L 4.3273 7.7097 121.5523 53.5570 41.8823 176.9792 151 V 3.3183 7.8169 126.6803 65.5561 31.5963 177.1745 152 D 4.2025 7.9321 118.1653 56.9089 40.5411 178.0296 153 E 4.0341 8.0430 119.6856 58.9466 29.5705 178.7778 154 I 3.7756 7.4911 119.8618 64.1441 37.0895 178.3420 155 L 3.5729 7.5028 119.5217 57.2711 41.3248 179.1764 156 R 4.1020 7.6881 118.4098 59.6362 30.0027 178.2040 157 I 3.6831 7.8415 119.5203 64.9008 37.1329 178.7937 158 V 3.3155 7.7068 112.6918 63.9817 31.3222 178.3311 159 K 3.7101 8.0669 119.2944 59.7950 31.9802 178.6504 160 A 3.6170 8.4572 121.1202 54.6848 18.2000 179.3968 161 L 3.8575 8.0551 119.1287 58.2015 42.2391 179.2160 162 K 3.9369 8.0355 118.7962 59.4985 31.9335 179.0163 163 L 4.0108 7.7682 119.2144 57.9429 41.5423 180.0449 164 G 3.4682 8.0930 105.4145 47.6740 0.0000 175.3409 165 D 4.4277 8.5074 122.1639 57.3777 40.7587 179.2161 166 S 4.3704 8.0785 112.6451 60.4421 63.3641 175.3000 167 L 4.3422 7.9813 120.3049 53.2177 43.1011 176.2002 168 K 3.8754 7.4916 116.4874 57.4954 29.7732 174.3983 169 R 4.9092 8.2195 115.3743 54.4729 34.9816 176.5622 170 A 4.5975 8.9524 123.3089 50.7008 21.7150 176.1857 171 V 4.4725 7.8912 119.1494 60.0900 33.5300 173.9967 172 P 4.4111 0.0000 0.0000 61.8670 32.1322 175.4081 173 A 3.9817 8.3528 121.8376 54.0415 18.7206 177.2098 174 D 4.4982 9.0198 119.1212 54.6380 38.6186 173.5633 175 W 4.3674 7.8101 129.2581 57.5417 30.9606 173.6989 176 P 3.2038 0.0000 0.0000 62.3280 30.7904 175.9367 177 N 4.8725 7.7391 115.6266 53.0639 39.1934 174.7130 178 N 4.6104 8.0730 116.8154 53.4060 39.8717 175.5591 179 E 3.9690 8.6373 123.5998 58.9695 30.1266 178.4871 180 I 3.9469 7.9865 119.3757 63.1438 37.6968 176.8075 181 I 4.2557 7.3240 110.0661 59.2439 39.7818 176.9868 182 G 3.7884 8.2257 114.9483 47.3239 0.0000 175.7182 183 E 4.3475 9.1929 121.4562 55.2780 30.3387 176.3926 184 G 4.1314 8.0263 109.3064 46.5935 0.0000 172.7765 185 L 4.8729 8.7185 120.9377 52.6743 45.3936 175.5607 186 I 4.6587 8.6355 123.1831 60.3673 38.8043 175.3570 187 V 3.9591 8.4348 127.9993 61.6144 31.9477 174.1522 188 P 4.1938 0.0000 0.0000 62.3236 31.6682 174.5060 189 P 4.5920 0.0000 0.0000 61.8663 31.9832 174.3596 190 P 4.5333 0.0000 0.0000 63.1600 31.7591 176.6367 191 T 4.6403 8.5533 110.8050 61.6066 69.5663 174.5533 192 T 4.7011 7.3152 112.0715 59.1396 73.2698 174.0697 193 E 3.6881 8.6634 122.1773 59.9278 29.5596 179.4063 194 D 4.3173 8.0300 117.9157 57.5321 40.8929 178.7422 195 Q 3.9923 8.0750 118.0471 58.9589 28.7850 178.5206 196 A 4.0817 7.8256 121.6316 55.4522 18.1938 179.6169 197 R 3.7699 7.8576 116.3182 59.4759 30.1980 178.3156 198 A 3.9712 7.9821 120.4944 55.2697 18.4903 179.2645 199 R 3.9249 8.4017 117.4114 60.3127 29.9365 178.6750 200 M 4.2573 8.0457 116.5816 58.2194 31.9477 178.4830 201 E 4.1230 8.3505 118.7916 59.3284 29.7456 178.7041 202 S 4.2589 8.5212 114.9759 60.0959 62.4133 175.9862 203 G 4.1319 7.3754 106.7533 46.0764 0.0000 174.0404 204 Q 4.0219 7.2571 115.9165 56.7673 28.9894 175.2799 205 Y 4.9089 7.1580 115.3781 55.8730 42.0196 175.4272 206 R 3.8674 8.1079 121.1744 56.9891 31.1071 175.6910 207 S 5.1747 8.0771 114.9725 57.8134 65.2806 174.2112 208 L 4.3473 8.3110 120.5043 54.7568 42.9457 175.6362 209 D 4.2687 6.9793 116.7284 52.9937 43.5087 176.3058 210 W 4.3847 8.7617 118.9429 58.3512 28.0574 176.7742 211 W 4.5945 6.4740 113.9661 56.2145 28.3921 176.2700 212 F 4.5209 7.3127 122.0687 55.8763 38.6341 172.2770 213 C 5.6235 8.0205 121.6125 57.3497 31.8380 172.4728 214 W 5.6141 8.4241 118.2850 55.7633 31.6961 172.9822 215 D 4.7355 8.8377 118.1221 52.1554 42.3369 174.2626 216 T 5.2952 8.3667 103.1465 60.0252 68.1506 171.5768 217 P 4.5408 0.0000 0.0000 63.8097 32.6927 177.2882 218 A 4.3129 7.8379 122.7490 51.6775 19.3616 178.0544 219 S 4.3361 8.5058 116.5122 58.0249 65.1720 175.2901 220 R 3.8593 8.7243 124.0019 60.1973 29.6656 178.4028 221 D 4.3251 8.0754 117.6953 57.5666 40.9824 178.4389 222 D 4.3752 8.3042 119.3957 57.2783 40.7942 179.0593 223 V 3.4072 7.8873 118.8264 65.9809 31.4956 178.0241 224 E 3.8111 8.2455 118.4659 59.2352 29.3129 178.8911 225 E 3.6068 8.2048 119.2214 58.8688 29.4784 178.8421 226 A 3.5272 7.5110 120.2233 55.1786 18.5303 179.6446 227 R 3.7048 7.6703 116.5916 59.4613 30.0504 179.1901 228 R 3.7883 8.0644 118.6712 59.4837 30.1255 178.0480 229 Y 4.3042 7.1589 116.2883 61.3544 37.9525 178.8703 230 L 4.0364 7.7582 119.5559 57.6541 41.7418 179.5164 231 R 3.8448 8.5621 119.0697 59.4481 29.7979 178.4501 232 R 3.8754 7.9752 117.1853 59.4723 30.0786 178.0406 233 A 4.0950 7.6674 119.1243 55.0474 18.4609 179.1857 234 A 4.0683 7.9143 118.3354 53.6428 18.9156 177.8238 235 E 4.2780 7.4871 116.7672 54.9375 30.5688 176.4644 236 K 4.0414 8.5061 124.8255 55.6151 32.8267 174.8151 237 P 4.2952 0.0000 0.0000 62.4799 31.9942 175.7321 238 A 4.1096 8.3733 123.9408 52.5313 18.6686 174.3795 239 K 4.1773 8.8250 128.0582 56.7182 31.1361 176.1008 240 L 4.5168 8.4028 124.3576 53.3397 42.6011 178.1626 241 L 4.3266 8.8970 125.0078 57.1546 41.4721 179.3229 242 Y 4.3282 8.0006 117.6490 60.0744 37.8600 177.7732 243 E 3.3840 6.6801 118.9791 58.8109 29.3828 178.4754 244 E 4.1796 7.4893 116.1522 56.7724 29.5073 176.8218 245 A 4.1327 7.6824 127.6842 52.4188 18.4184 177.3295 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 S 8.32 4.40 0.00 3.83 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 7.79 4.58 2.07 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 1.46 1.07 0.94 0.00 0.00 6 P 0.00 4.61 0.00 2.23 1.96 0.00 3.92 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.99 0.00 7 L 8.87 4.84 0.00 1.68 1.56 0.99 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.32 3.94 1.90 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 1.38 0.51 0.96 0.00 0.00 9 G 9.34 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 0.00 0.00 0.00 10 E 8.19 4.44 0.00 2.19 1.82 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 2.30 2.26 0.00 11 R 8.47 4.35 0.00 1.83 1.85 0.00 3.28 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.94 0.00 12 F 8.89 3.85 0.00 3.11 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.11 0.00 1.69 1.80 0.00 2.20 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00 14 E 9.04 4.47 0.00 1.92 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 2.31 2.35 0.00 15 M 8.23 4.52 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.87 0.00 16 E 8.86 4.98 0.00 1.86 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 2.24 2.32 0.00 17 V 8.72 4.56 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 0.85 0.00 0.00 0.91 0.00 0.00 18 T 8.38 4.94 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 1.15 0.00 0.00 19 T 8.56 5.16 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 1.15 0.00 0.00 20 D 8.69 4.76 0.00 2.74 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 21 H 9.18 4.65 0.00 3.06 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.29 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.95 4.64 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 0.80 0.00 0.00 0.90 0.00 0.00 24 I 8.48 4.63 1.44 0.00 0.00 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 0.96 0.64 0.63 0.00 0.00 25 K 8.38 4.84 0.00 2.01 1.65 0.00 1.73 0.00 0.00 1.81 0.00 0.00 3.33 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.50 7.81 26 L 8.72 5.06 0.00 1.77 1.44 0.83 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.65 0.00 2.49 2.56 0.00 4.03 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.23 0.00 28 D 8.14 4.38 0.00 2.75 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 37 F 8.81 5.27 0.00 2.54 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.57 4.61 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 1.06 0.00 0.00 0.89 0.00 0.00 39 L 8.73 4.84 0.00 1.86 1.68 0.97 0.58 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 40 F 7.69 5.51 0.00 3.13 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 41 S 9.19 5.50 0.00 4.04 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 42 H 9.69 5.05 0.00 3.29 3.40 0.00 5.63 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 P 0.00 4.32 0.00 2.01 2.16 0.00 3.82 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.34 0.00 44 A 7.13 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.55 3.37 0.00 2.48 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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 55 V 8.24 3.68 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 1.09 0.00 0.00 1.02 0.00 0.00 56 S 8.03 4.13 0.00 3.98 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 57 F 8.52 4.31 0.00 3.34 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 58 A 8.60 4.31 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.51 4.02 0.00 2.08 2.09 0.00 3.33 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 60 R 7.86 4.55 0.00 2.06 1.73 0.00 3.31 0.00 0.00 2.92 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 61 Y 7.87 4.39 0.00 3.35 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.37 3.85 0.00 2.25 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 2.43 2.48 0.00 63 D 8.08 4.30 0.00 2.63 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 7.93 4.05 0.00 3.23 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 65 Q 8.06 3.91 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 1.63 2.12 0.00 66 R 7.96 3.95 0.00 1.91 1.98 0.00 3.15 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 67 L 7.45 4.31 0.00 1.69 1.54 0.72 1.30 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 68 G 8.26 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 69 V 8.03 4.90 2.40 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 0.89 0.00 0.00 0.87 0.00 0.00 70 D 9.46 4.95 0.00 2.47 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 71 L 8.20 4.76 0.00 0.89 0.66 0.79 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.87 4.34 1.65 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 0.93 1.40 0.59 0.00 0.00 73 G 8.45 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 74 L 8.62 5.10 0.00 1.64 1.50 1.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 75 S 9.01 5.64 0.00 4.18 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 76 V 8.49 4.41 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 0.94 0.00 0.00 1.02 0.00 0.00 77 D 7.81 4.73 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 78 S 8.44 4.36 0.00 4.11 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.94 3.42 1.82 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 -0.10 0.00 0.00 0.81 0.00 0.00 80 F 7.18 4.22 0.00 3.25 3.22 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 81 S 8.03 4.37 0.00 4.10 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 8.18 4.47 0.00 3.54 3.62 0.00 5.82 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.87 3.76 1.98 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.78 0.98 0.00 0.00 84 K 8.25 4.13 0.00 2.30 2.29 0.00 2.00 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.90 1.81 7.81 85 W 8.78 3.85 0.00 2.75 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.50 3.81 0.00 2.03 1.78 0.00 1.66 0.00 0.00 1.44 0.00 0.00 2.52 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.25 1.42 7.81 87 E 8.46 3.94 0.00 2.38 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 88 W 8.61 4.23 0.00 3.90 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 89 I 8.25 3.95 1.99 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.85 0.99 0.00 0.00 90 E 8.18 4.11 0.00 2.00 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 0.00 2.26 2.12 0.00 91 R 7.66 3.83 0.00 1.75 1.78 0.00 3.23 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.48 0.00 92 H 7.77 4.26 0.00 1.61 2.74 0.00 5.67 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 7.58 4.18 2.07 0.00 0.00 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 1.33 0.57 0.97 0.00 0.00 94 G 7.65 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 0.00 0.00 0.00 95 V 7.47 4.28 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 1.01 0.00 0.00 0.95 0.00 0.00 96 R 8.53 4.12 0.00 1.99 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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 0.00 105 P 0.00 4.60 0.00 2.24 2.06 0.00 3.96 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 106 Q 8.87 4.02 0.00 2.28 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.40 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 107 G 8.45 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 0.00 108 T 7.49 3.85 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 109 V 8.47 3.51 2.21 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 1.04 0.00 0.00 0.95 0.00 0.00 110 A 8.57 4.06 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 R 8.17 3.77 0.00 2.10 2.10 0.00 3.13 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 112 R 7.83 3.86 0.00 1.90 2.10 0.00 3.28 0.00 0.00 3.18 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 113 L 7.52 4.53 0.00 1.79 1.74 0.79 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.19 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 0.00 115 L 8.62 4.71 0.00 1.95 1.89 1.20 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.20 4.51 0.00 1.59 1.67 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.27 4.67 0.00 3.25 3.26 0.00 5.77 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.53 4.47 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 0.00 119 E 8.11 4.23 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 120 S 7.83 4.22 0.00 4.12 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 0.00 121 A 7.28 3.98 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 0.00 122 T 7.62 4.51 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 123 H 7.70 4.98 0.00 3.12 3.25 0.00 5.71 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 T 8.81 4.04 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 1.39 0.00 0.00 125 V 8.53 3.84 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.89 0.00 0.00 126 R 8.05 4.71 0.00 2.00 2.23 0.00 3.53 0.00 0.00 3.36 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.64 0.00 127 G 8.94 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 8.34 5.01 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 1.03 0.00 0.00 0.95 0.00 0.00 129 F 9.38 5.18 0.00 3.02 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 0.00 130 I 8.68 4.66 1.94 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 1.16 0.70 1.14 0.00 0.00 131 V 8.30 4.52 0.67 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 0.82 0.00 0.00 0.40 0.00 0.00 132 D 8.18 3.37 0.00 1.58 1.54 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 0.00 133 A 6.75 4.27 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 R 7.72 4.08 0.00 1.85 1.91 0.00 3.15 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.50 0.00 135 G 8.44 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 0.00 0.00 0.00 136 V 7.42 4.53 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 1.08 0.00 0.00 0.93 0.00 0.00 137 I 8.65 4.23 2.18 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.53 1.07 0.00 0.00 138 R 8.91 4.67 0.00 1.85 2.02 0.00 3.25 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 139 T 7.63 4.81 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 1.22 0.00 0.00 140 M 8.48 4.94 0.00 1.31 1.85 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 1.95 0.00 141 L 8.33 4.75 0.00 1.55 1.72 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 142 Y 8.69 5.14 0.00 2.79 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 0.00 143 Y 8.83 4.54 0.00 2.88 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 P 0.00 4.69 0.00 2.66 2.22 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 145 M 8.55 4.11 0.00 2.04 2.23 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.58 0.00 146 E 8.11 4.40 0.00 2.10 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 2.27 2.25 0.00 147 L 7.98 4.64 0.00 1.68 1.74 1.05 1.17 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 0.00 148 G 8.72 3.76 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 0.00 0.00 0.00 149 R 9.21 3.23 0.00 1.57 1.42 0.00 2.99 0.00 0.00 2.94 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 150 L 7.71 4.33 0.00 1.72 1.55 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.82 3.32 1.72 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 0.41 0.00 0.00 0.05 0.00 0.00 152 D 7.93 4.20 0.00 2.68 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 0.00 153 E 8.04 4.03 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 154 I 7.49 3.78 2.12 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.40 1.12 0.00 0.00 155 L 7.50 3.57 0.00 0.93 0.13 0.06 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.69 4.10 0.00 2.16 2.15 0.00 3.45 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 157 I 7.84 3.68 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.68 0.96 0.00 0.00 158 V 7.71 3.32 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 0.84 0.00 0.00 0.90 0.00 0.00 159 K 8.07 3.71 0.00 2.09 2.26 0.00 1.59 0.00 0.00 1.94 0.00 0.00 3.14 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.70 1.68 7.81 160 A 8.46 3.62 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 0.00 161 L 8.06 3.86 0.00 2.04 1.75 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 162 K 8.04 3.94 0.00 1.63 1.72 0.00 0.61 0.00 0.00 0.89 0.00 0.00 2.91 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.24 0.65 7.81 163 L 7.77 4.01 0.00 1.67 1.48 0.77 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 164 G 8.09 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.51 4.43 0.00 2.93 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 0.00 166 S 8.08 4.37 0.00 4.05 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 0.00 167 L 7.98 4.34 0.00 1.67 1.75 1.02 0.78 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 0.00 168 K 7.49 3.88 0.00 1.93 1.84 0.00 1.67 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.41 7.81 169 R 8.22 4.91 0.00 1.55 1.69 0.00 3.35 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.69 0.00 170 A 8.95 4.60 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 V 7.89 4.47 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 0.51 0.00 0.00 0.70 0.00 0.00 172 P 0.00 4.41 0.00 2.29 2.14 0.00 3.66 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 173 A 8.35 3.98 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 0.00 174 D 9.02 4.50 0.00 2.89 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 0.00 175 W 7.81 4.37 0.00 3.38 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 P 0.00 3.20 0.00 1.45 0.49 0.00 3.43 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.24 0.00 177 N 7.74 4.87 0.00 2.59 2.73 0.00 0.00 6.82 7.90 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 0.00 178 N 8.07 4.61 0.00 2.92 2.81 0.00 0.00 7.29 7.16 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 0.00 179 E 8.64 3.97 0.00 1.95 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 2.29 2.36 0.00 180 I 7.99 3.95 1.82 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.45 0.56 0.00 0.00 181 I 7.32 4.26 0.58 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.64 -0.76 0.00 0.00 182 G 8.23 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 0.00 183 E 9.19 4.35 0.00 1.97 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 2.23 2.38 0.00 184 G 8.03 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.72 4.87 0.00 1.64 1.48 0.82 -0.08 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 0.00 186 I 8.64 4.66 1.89 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.51 0.74 0.00 0.00 187 V 8.43 3.96 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 0.50 0.00 0.00 -0.05 0.00 0.00 188 P 0.00 4.19 0.00 2.09 2.02 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 189 P 0.00 4.59 0.00 2.38 2.39 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 190 P 0.00 4.53 0.00 2.25 2.10 0.00 4.22 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.30 0.00 191 T 8.55 4.64 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 1.28 0.00 0.00 192 T 7.32 4.70 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 1.27 0.00 0.00 193 E 8.66 3.69 0.00 1.99 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 2.30 2.29 0.00 194 D 8.03 4.32 0.00 2.66 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 0.00 195 Q 8.08 3.99 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 196 A 7.83 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 R 7.86 3.77 0.00 1.84 2.04 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 1.71 1.63 0.00 198 A 7.98 3.97 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 0.00 199 R 8.40 3.92 0.00 2.17 2.29 0.00 3.59 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.01 0.00 200 M 8.05 4.26 0.00 2.11 2.29 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 3.07 0.00 201 E 8.35 4.12 0.00 2.15 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 2.32 0.00 202 S 8.52 4.26 0.00 3.92 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 0.00 203 G 7.38 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 Q 7.26 4.02 0.00 1.71 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.12 6.59 0.00 0.00 0.00 0.00 0.00 1.75 1.16 0.00 205 Y 7.16 4.91 0.00 2.72 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 0.00 206 R 8.11 3.87 0.00 0.67 0.66 0.00 2.78 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.23 0.00 207 S 8.08 5.17 0.00 4.00 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 0.00 208 L 8.31 4.35 0.00 1.03 1.41 0.87 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 209 D 6.98 4.27 0.00 2.14 1.54 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 0.00 210 W 8.76 4.38 0.00 3.67 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 0.00 211 W 6.47 4.59 0.00 3.18 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 0.00 0.00 0.00 0.00 212 F 7.31 4.52 0.00 1.60 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 0.00 0.00 0.00 213 C 8.02 5.62 0.00 2.72 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 0.00 214 W 8.42 5.61 0.00 3.58 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 0.00 215 D 8.84 4.74 0.00 2.86 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 0.00 216 T 8.37 5.30 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 217 P 0.00 4.54 0.00 2.25 2.26 0.00 3.88 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 218 A 7.84 4.31 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 S 8.51 4.34 0.00 4.08 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 0.00 220 R 8.72 3.86 0.00 1.89 2.00 0.00 3.17 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 221 D 8.08 4.33 0.00 2.72 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 0.00 222 D 8.30 4.38 0.00 2.95 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 0.00 223 V 7.89 3.41 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 0.86 0.00 0.00 1.11 0.00 0.00 224 E 8.25 3.81 0.00 2.01 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 2.23 2.47 0.00 225 E 8.20 3.61 0.00 2.08 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.19 0.00 226 A 7.51 3.53 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 0.00 227 R 7.67 3.70 0.00 1.82 1.86 0.00 2.99 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.57 0.00 228 R 8.06 3.79 0.00 1.78 1.83 0.00 3.04 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 229 Y 7.16 4.30 0.00 3.18 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 0.00 230 L 7.76 4.04 0.00 1.60 1.69 0.87 1.28 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 0.00 231 R 8.56 3.84 0.00 1.87 1.88 0.00 3.06 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 232 R 7.98 3.88 0.00 1.85 2.13 0.00 3.31 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 233 A 7.67 4.10 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 0.00 234 A 7.91 4.07 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 0.00 235 E 7.49 4.28 0.00 2.00 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 2.51 2.37 0.00 236 K 8.51 4.04 0.00 1.70 1.73 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.17 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.50 7.81 237 P 0.00 4.30 0.00 2.23 2.05 0.00 3.83 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 2.01 1.98 0.00 238 A 8.37 4.11 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 0.00 239 K 8.83 4.18 0.00 1.91 2.13 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.29 1.40 7.81 240 L 8.40 4.52 0.00 1.55 1.69 1.16 0.58 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 0.00 241 L 8.90 4.33 0.00 1.75 1.77 0.96 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 242 Y 8.00 4.33 0.00 3.33 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 0.00 243 E 6.68 3.38 0.00 1.71 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 0.00 1.81 1.49 0.00 244 E 7.49 4.18 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 245 A 7.68 4.13 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 * Residues marked with a * may have inaccurate shift predictions.