NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.3623 8.1849 120.6392 54.3395 43.0896 176.4247 5 T 3.7589 8.4835 119.7901 62.7452 68.8048 171.8483 6 P 4.6976 0.0000 0.0000 63.0978 33.0955 175.5826 7 R 4.8716 8.9688 120.6127 54.6128 34.9598 173.7484 8 C 5.0708 9.2198 122.6743 57.9175 33.5608 172.6059 9 I 4.6681 8.7897 128.9544 59.9464 37.7547 175.3170 10 I 4.2524 8.3353 122.1491 59.4426 39.8460 175.0046 11 V 4.5463 8.4864 125.2689 60.9193 34.6147 174.1490 12 R 4.7451 8.6993 128.6285 55.2994 31.5195 175.2811 13 A 4.2810 8.7122 127.8075 52.4734 19.7372 177.7457 14 G 4.0247 8.4129 108.0663 45.5425 0.0000 173.0359 15 Q 4.2564 9.2368 121.0175 56.5622 29.6002 175.4966 16 T 5.1045 8.8182 114.4791 59.1375 73.0561 174.8492 17 E 4.0543 8.6562 119.3652 59.6538 29.3041 179.7471 18 W 4.5685 8.2476 118.6133 59.7144 29.0876 178.7437 19 S 4.2674 8.5000 114.6873 61.3003 62.2536 176.7031 20 K 4.1796 8.1561 122.0099 59.1863 32.5812 178.4619 21 S 4.5547 7.7756 111.4612 58.0419 63.4967 174.9769 22 G 3.9522 7.5889 109.4602 45.7552 0.0000 173.3867 23 Q 4.2777 8.0554 118.5084 55.1486 29.9440 175.4437 24 Y 4.2375 8.4921 121.0303 58.1603 39.0801 174.4969 25 T 5.2717 9.1093 122.1092 63.8968 70.0730 173.2286 26 G 3.7964 10.3069 116.3601 45.9466 0.0000 173.8683 27 L 4.1034 9.1434 123.7487 57.1622 42.9169 177.5798 28 T 3.7614 8.2224 115.2328 64.0957 68.9050 174.6221 29 D 4.6238 8.3369 130.3088 53.1364 40.0400 176.1090 30 L 3.9619 7.1746 120.4772 54.0883 42.7660 175.9999 31 P 4.7643 0.0000 0.0000 61.2514 32.8170 175.6377 32 L 4.2967 8.5958 119.6540 54.5814 42.2257 177.8918 33 T 4.1177 8.3164 113.1067 61.0668 69.4947 173.1999 34 P 4.2673 0.0000 0.0000 66.1762 31.2177 178.2688 35 Y 4.1067 8.1696 117.7580 60.7033 38.5973 178.1494 36 G 3.8427 8.3423 105.7000 47.7262 0.0000 175.3293 37 E 4.2063 7.9694 119.7438 59.3244 29.9031 179.1443 38 G 3.7775 7.7297 105.3166 47.7792 0.0000 175.7491 39 Q 3.6908 7.9388 118.2404 56.6394 28.6759 177.7216 *41 L 4.2687 7.8101 119.5846 54.5365 43.6805 179.5137 42 R 4.1411 7.9285 117.3382 59.2977 29.7716 179.3524 43 T 3.9618 7.9743 115.8893 66.6397 68.5240 176.9023 44 G 3.8180 8.0108 108.4239 47.2666 0.0000 175.3531 45 E 4.0382 8.2557 120.9978 59.1641 29.5157 179.1335 46 S 3.9954 8.2466 113.3123 61.8438 62.4837 176.8526 47 V 3.5649 7.9548 114.7130 63.5957 31.0133 178.1463 48 F 4.6497 7.9208 116.1682 59.0926 39.6793 176.0988 49 R 4.2822 8.3692 116.2101 57.4335 31.3045 177.1690 50 N 4.3693 8.2704 120.0978 55.8072 39.3934 175.0428 51 N 4.7393 7.5927 113.3254 51.4504 41.6163 174.6976 52 Q 4.6731 7.5741 116.2713 54.5764 28.8684 175.7967 53 F 4.6232 7.5870 118.3036 59.3514 39.8831 176.3795 54 L 4.7136 7.7617 119.3752 52.6200 44.1368 175.2089 55 N 4.9656 8.5613 121.1486 51.1679 40.2929 173.3670 56 P 4.3605 0.0000 0.0000 65.8274 31.6416 178.3557 57 D 4.4289 8.3621 116.5055 57.0232 40.9948 177.0456 58 N 4.6868 8.2542 115.0455 53.6026 39.2620 174.7303 59 I 5.0637 7.9561 120.2078 60.6552 38.1180 174.7026 60 T 4.4464 8.8574 114.4888 63.0851 70.8545 173.7704 61 Y 5.1168 8.0972 119.4931 55.3587 42.2815 174.3463 62 I 4.7990 9.0675 123.2299 59.7433 40.4998 174.4053 63 F 5.1729 9.0909 125.7753 56.1690 41.4516 174.8244 64 T 5.2637 8.7466 116.7348 60.0056 70.8696 173.0572 65 S 4.7980 9.0892 123.5613 58.2648 62.6785 172.8053 66 P 4.4786 0.0000 0.0000 64.4023 31.9333 177.6399 67 R 4.1772 8.0086 119.7868 56.1049 31.6580 176.8587 68 L 3.9588 9.3499 125.5977 58.4760 42.0270 179.7076 69 R 3.9327 8.1247 115.1626 59.4331 29.1789 178.4963 70 A 4.0684 7.9950 120.7965 55.1040 18.5643 179.7346 71 R 3.8354 8.1647 116.6313 59.3093 30.1393 179.1655 72 Q 4.0147 8.8982 118.6629 59.4056 28.6985 179.2081 73 T 4.0158 7.6872 116.8082 66.2998 68.4692 177.0557 74 V 2.6609 7.5782 120.2571 65.6280 31.2409 177.3456 75 D 4.2352 7.6724 116.1914 57.5345 41.2313 178.1547 76 L 4.1375 7.9644 119.1591 57.8671 41.1749 179.6100 77 V 3.7865 8.0448 118.1448 65.6252 31.4666 177.0511 78 L 4.4752 8.0055 116.5660 54.4425 41.5704 178.3965 79 K 3.8602 7.4801 119.5957 59.2414 32.2235 176.2187 80 P 4.3519 0.0000 0.0000 64.4409 31.5608 176.9240 81 L 4.1508 7.2377 118.4923 54.1775 42.2826 177.4432 82 S 4.4846 8.5921 116.7112 57.7638 65.6486 175.2556 83 D 4.3228 8.4420 121.7923 57.1450 40.2284 178.8167 84 E 3.8489 7.9471 118.8783 59.3788 29.9892 178.1891 85 Q 4.0980 7.7302 117.7492 59.2524 28.8276 179.3431 86 R 3.8356 8.0996 118.6214 59.1133 29.8102 178.9927 87 A 4.0422 7.7618 119.5838 54.2973 18.3682 178.7463 88 K 4.3603 7.3887 114.7803 55.3365 32.5875 176.0688 89 I 4.5635 7.0041 120.7808 59.4681 39.6507 175.1798 90 R 4.3296 8.3351 126.2292 54.7470 31.8736 175.4228 91 V 4.6148 8.2100 123.3164 61.0091 33.8812 174.7306 92 V 4.3434 8.4937 127.4890 60.9577 34.3875 174.3390 93 V 4.3654 8.5923 128.6966 62.5536 32.3794 174.4527 94 D 5.1901 9.1512 128.2977 52.4966 43.3378 176.1737 95 D 4.4743 9.4379 127.0024 57.1810 41.4918 177.6207 96 D 4.5460 8.3708 117.9129 56.2296 40.7709 176.7610 97 L 4.5504 7.5944 118.2711 54.1575 41.9896 176.6823 98 R 4.2400 7.5869 115.9845 55.4987 29.9842 175.9137 99 E 4.1814 8.3180 119.2073 55.0839 30.2659 175.9304 100 W 3.9631 8.9621 132.2500 57.9138 31.0030 175.6224 101 E 4.1164 9.3687 125.7290 56.2071 28.4813 177.2881 102 Y 4.5784 8.4709 122.9678 58.6910 40.1035 178.5773 103 G 3.9086 8.0090 107.3665 45.2593 0.0000 176.7954 104 D 4.2807 7.9266 124.8087 56.8791 40.5824 176.5051 105 Y 4.5236 7.2761 114.5552 57.4504 38.0257 175.2193 106 E 3.9789 7.8868 121.8737 57.9419 30.4651 176.6702 107 G 2.0214 8.6236 114.5641 45.9937 0.0000 173.3963 *109 L 4.0603 7.1776 117.6418 54.2003 44.6469 177.6227 110 T 3.8260 8.4887 118.2127 67.2791 68.4751 176.9442 111 R 3.8645 7.9054 116.9041 59.2615 29.4281 178.5313 112 E 3.8418 7.8971 118.9208 58.9654 29.4354 178.9323 113 I 2.9757 7.6794 120.2250 64.2307 37.0013 178.1743 114 I 3.4802 7.5399 120.6700 64.6261 36.9735 178.0497 115 E 3.8252 7.9693 119.7632 59.0096 29.2853 178.6492 116 L 3.8227 7.7137 120.4178 58.1933 42.1826 179.1633 117 R 3.8091 7.8508 118.2384 58.9243 29.9387 178.8763 118 K 3.8838 8.1226 119.8064 59.6132 32.0104 179.0421 119 S 4.2150 7.8137 112.8324 60.8008 62.9869 175.5642 120 R 4.3633 7.4257 119.8072 55.5180 30.0960 176.3883 121 G 3.7728 8.0058 106.8158 46.6006 0.0000 173.5828 122 L 4.6440 7.7805 118.7212 52.9830 44.2803 175.9498 123 D 4.7211 8.5774 115.0881 54.7787 38.2570 176.3831 124 K 4.1435 7.6167 116.0875 59.8029 32.2697 178.8640 125 E 4.2607 8.1766 116.5221 58.5228 29.6068 177.1394 126 R 4.7201 7.5242 113.0221 53.5508 32.3095 172.5687 127 P 4.3655 0.0000 0.0000 62.2450 31.8429 175.9452 128 W 4.4653 8.7200 129.8176 58.3593 31.1511 175.9064 129 N 4.2566 8.7976 122.5142 50.9292 40.8307 174.5878 130 I 3.1060 6.8978 128.8045 63.8660 37.6427 177.4258 131 W 4.8154 7.6666 117.8704 58.8016 28.8430 177.4195 132 R 4.5274 8.1141 116.9417 57.9499 30.8278 176.8684 133 D 4.7966 8.7767 116.9428 55.5787 41.9916 178.3794 134 G 4.2839 8.9127 108.0078 45.6012 0.0000 171.9291 135 C 5.0334 8.4546 116.2538 57.4853 31.5203 173.4526 136 E 3.9958 8.6172 123.3013 58.2959 29.3902 177.1564 137 N 4.3720 9.0937 118.3806 53.7922 36.9135 173.6077 138 G 4.8236 7.9296 106.8637 45.0349 0.0000 172.7540 139 E 4.8349 9.1211 120.5010 56.1868 30.8839 177.2323 140 T 4.8518 8.8968 114.0513 61.3628 70.5565 175.5221 141 T 3.9744 8.8504 115.1991 64.8160 67.2495 175.9332 142 Q 4.1892 8.0555 119.5328 59.0177 28.8695 177.9919 143 Q 3.8088 7.7464 120.0989 58.7652 28.7758 178.7758 144 I 3.3809 7.0303 119.2603 63.7583 38.0258 178.0909 145 G 3.6941 7.6285 106.5321 47.4751 0.0000 175.5265 146 L 3.5704 7.9986 122.9030 58.0066 42.1508 179.2654 147 R 3.9095 7.5058 115.9798 59.2143 29.2358 178.7714 148 L 4.1173 7.9683 119.7438 57.5110 41.5745 179.3160 149 S 4.0703 7.9402 114.7974 61.6839 62.7738 176.9829 150 R 3.7507 7.9383 120.2231 59.2657 29.8315 178.7881 151 A 3.8422 7.7382 119.9310 55.3014 18.3290 179.7574 152 I 3.6351 7.9647 117.9633 64.4748 37.1783 178.4876 153 A 3.8705 7.9669 121.6115 55.2334 18.2613 179.8589 154 R 3.7370 7.9257 116.5197 59.2950 30.0427 179.4993 155 I 3.5477 7.6569 119.5747 64.5389 37.1593 178.5833 156 Q 4.2677 8.4689 120.5720 58.2121 28.3458 178.4438 157 N 4.2072 8.1170 118.2701 56.5468 38.9613 176.7418 158 L 3.8141 7.6240 120.1270 58.1824 41.6492 179.0507 159 H 4.3068 8.2269 115.9046 59.1393 28.7460 177.7113 160 R 3.7871 8.1097 120.2253 59.3241 30.0056 178.3528 161 K 3.9335 8.2071 119.5561 59.8858 32.1313 178.5268 162 H 4.3916 8.4581 116.6167 58.8753 28.7160 177.4392 163 Q 4.0534 8.5053 122.0545 59.3315 28.6400 178.6568 164 S 4.2644 8.0655 114.0814 61.0049 63.2176 175.3779 165 E 4.3617 7.9428 119.6928 55.9520 29.2516 177.0125 166 G 3.9448 7.8816 107.2430 46.0447 0.0000 173.6168 167 R 4.8298 8.1223 115.1684 53.3778 31.9159 175.6910 168 A 4.1404 8.6045 122.4777 52.8781 19.4948 177.6953 169 S 4.5723 8.6176 115.5347 57.1690 65.1343 171.5338 170 D 5.3670 9.5977 127.8902 53.4399 42.5330 176.0982 171 I 5.6369 8.6615 124.5286 58.4863 41.6837 174.1105 *173 V 4.4419 8.0910 121.2052 63.4941 32.7669 174.4271 174 F 5.1974 9.5318 127.6877 54.8845 40.9961 173.2414 175 A 4.8588 8.7529 130.5004 51.6156 25.0249 176.9262 176 H 5.2247 8.9286 115.3947 55.8690 33.1880 174.2883 177 G 3.8475 9.0765 109.7196 49.6396 0.0000 175.8518 178 H 4.5733 9.1562 117.8596 58.6226 28.8257 177.7431 179 A 4.2147 8.5659 122.0848 55.4321 18.1309 179.4676 180 L 4.2925 8.4668 117.4292 57.6821 41.7303 179.8731 181 R 4.2455 8.0973 116.9660 59.3709 30.0689 178.3064 182 Y 4.1902 8.9343 119.5251 60.8414 38.9478 177.5142 183 F 4.2219 9.2119 121.8332 61.7894 39.5588 177.0364 184 A 4.2484 8.8732 119.9912 55.1263 18.1633 179.4327 185 A 4.2470 8.5806 119.5863 55.5161 18.6659 179.9680 186 I 3.6569 7.9945 111.6315 63.3001 37.5567 177.8130 187 W 4.1330 7.8838 130.0562 59.9190 30.4917 176.6142 188 F 4.9665 7.6159 109.1969 56.8125 37.5136 176.0012 189 G 3.9598 7.5508 108.5370 45.7765 0.0000 174.3512 190 L 3.9350 7.1119 119.6601 54.8112 42.6507 178.3178 191 G 3.7247 8.2282 106.8101 45.0270 0.0000 172.9102 192 V 4.4204 7.8690 112.0322 59.3303 35.5154 175.0387 193 Q 4.4809 8.4525 125.0954 55.6039 30.0226 174.8766 194 K 4.5237 8.5868 127.0529 54.1579 35.5559 175.5724 195 K 4.5445 8.6730 126.3881 56.7076 33.0692 176.5410 196 C 4.6484 9.0070 122.4917 59.8432 27.7973 172.9315 197 E 4.4354 9.5971 122.8465 57.4294 32.0650 177.4677 198 T 4.3109 7.8762 108.4871 60.8214 71.3945 175.4420 199 I 3.7346 8.1036 120.8107 64.5727 36.8766 178.3608 200 E 3.9526 8.0981 117.6276 59.6333 29.4599 178.9911 201 E 3.9745 7.8079 115.9322 58.2014 29.5734 177.6784 202 I 4.3893 6.9353 117.5541 61.4200 39.4104 176.3320 203 Q 4.1111 7.8301 118.1509 55.6088 29.0287 175.3083 204 N 4.6307 8.4594 118.7890 53.0010 39.2587 175.1117 205 V 3.9502 8.3885 118.1242 60.5814 33.1450 175.5895 206 K 3.6190 7.9535 119.0608 57.2761 29.1365 175.5776 207 S 4.5060 7.6992 113.7338 59.4815 64.8010 174.1632 208 Y 5.3008 7.4362 118.1107 55.4664 40.8896 173.6931 209 D 4.5853 8.4826 119.1745 52.2762 42.0406 172.8206 210 D 4.6759 8.2518 123.1242 52.6188 43.6907 175.5701 211 D 4.6868 8.9105 126.8092 56.3047 41.0855 177.1552 212 T 4.2245 8.4014 108.6184 62.0827 69.3536 174.9617 213 V 4.1271 7.5462 122.4243 60.3088 31.1646 173.1902 214 P 4.3919 0.0000 0.0000 62.7634 31.8084 176.0263 215 Y 4.2963 8.7889 123.5909 56.7971 39.4088 174.3056 216 V 4.1229 7.3238 126.6955 60.6148 32.2289 175.2701 217 K 4.0958 8.3616 127.9875 55.9103 31.9425 177.2069 218 L 4.2125 8.2515 124.7670 54.6399 42.5711 177.0709 219 E 4.3923 8.7403 121.5535 57.7487 30.4839 176.0190 220 S 5.2863 7.6750 110.8317 56.8790 66.4466 172.8704 221 Y 4.9839 9.0299 118.3803 55.5954 41.7249 173.9897 222 R 5.1687 8.3846 119.0719 54.9742 32.5055 175.4338 223 H 5.3847 8.5758 116.5415 54.2577 32.4555 172.7785 224 L 4.5942 9.1523 120.1790 54.3428 42.5217 177.4443 225 V 4.4631 7.9374 111.9984 61.1328 32.8553 174.5171 226 D 4.5227 7.4571 117.8055 52.8573 43.8706 173.9548 227 N 3.1400 8.3454 121.0475 52.4895 39.0099 173.0503 228 P 3.6584 0.0000 0.0000 63.4236 32.2265 175.2758 229 C 3.4767 7.8034 115.5361 60.8542 24.9689 172.7064 230 F 5.3639 7.5538 116.4762 55.7634 41.6062 175.6783 231 L 4.7464 8.2313 122.7524 53.1016 43.8104 176.7133 232 L 4.1701 8.0710 124.1151 54.3856 43.0784 174.5247 233 D 4.5546 8.5458 126.2712 53.2257 41.6561 175.8602 234 A 4.1218 8.5422 122.9341 54.2851 18.4099 178.2193 235 G 4.3330 8.7746 110.6178 45.6592 0.0000 174.0119 236 G 3.8815 8.2213 107.6745 45.9156 0.0000 173.1934 237 I 5.0436 8.1828 121.4838 59.2046 40.0806 175.2321 238 G 4.0973 8.9366 114.0389 44.2623 0.0000 171.9849 239 V 4.7169 7.8146 118.7991 60.8272 34.8337 173.9015 240 L 4.7671 8.5434 127.8169 52.6690 44.2625 174.6014 241 S 4.2132 9.0032 120.4557 57.5596 66.9935 172.3537 242 Y 5.3911 8.5078 113.5025 56.1111 42.5561 174.1736 243 A 4.2536 9.3099 125.0299 52.0566 20.3688 177.3208 244 H 4.0956 8.9953 116.6121 58.4884 26.3483 174.2921 245 H 3.9906 8.3185 108.7003 56.7973 26.8104 174.9108 246 N 4.8340 7.8932 117.1522 51.5443 40.3996 174.6064 247 I 2.9424 8.2888 127.5270 64.2455 37.2061 176.8914 248 D 4.6002 8.3390 117.5736 55.1009 41.4548 176.1157 249 E 4.9959 8.4379 119.4201 54.4383 28.8977 174.2120 250 P 4.9342 0.0000 0.0000 63.1018 32.7194 177.4464 251 A 4.9042 9.5226 123.6567 50.2170 23.2174 174.4511 252 L 4.2356 8.0399 121.7617 53.9987 43.2941 175.7640 253 E 4.1304 8.5615 127.9707 55.3129 29.7518 177.2664 254 L 3.8023 8.5541 127.8437 57.3834 42.1604 177.9364 255 A 4.2879 8.3883 120.4452 51.2606 19.4502 178.3469 256 G 3.5442 7.0822 107.3892 46.7168 0.0000 174.0103 257 P 4.2734 0.0000 0.0000 62.9330 31.7826 176.2870 258 F 3.2552 7.6903 122.9576 58.0300 39.6950 174.6410 259 V 4.2570 6.8669 119.9408 58.8747 35.4167 175.4472 260 S 4.0456 8.2590 117.7741 57.4736 63.4595 172.5417 261 P 4.3091 0.0000 0.0000 61.7584 31.7097 174.7169 262 P 4.4244 0.0000 0.0000 62.0604 32.1149 175.9724 263 E 4.0678 8.7539 118.8323 56.8985 29.3841 176.7221 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 L 8.18 4.36 0.00 1.70 1.71 0.95 0.60 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 5 T 8.48 3.76 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 1.37 0.00 0.00 6 P 0.00 4.70 0.00 1.88 2.01 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.17 0.00 7 R 8.97 4.87 0.00 1.93 1.71 0.00 3.03 0.00 0.00 3.07 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.72 0.00 8 C 9.22 5.07 0.00 2.77 2.05 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 9 I 8.79 4.67 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.98 0.83 0.00 0.00 10 I 8.34 4.25 1.63 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 0.97 1.07 0.60 0.00 0.00 11 V 8.49 4.55 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.24 0.00 0.00 12 R 8.70 4.75 0.00 1.95 1.90 0.00 3.24 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 13 A 8.71 4.28 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.41 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 15 Q 9.24 4.26 0.00 2.30 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.50 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 16 T 8.82 5.10 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 1.29 0.00 0.00 17 E 8.66 4.05 0.00 2.06 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 0.00 2.44 2.36 0.00 18 W 8.25 4.57 0.00 3.42 3.48 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 19 S 8.50 4.27 0.00 4.17 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 0.00 20 K 8.16 4.18 0.00 1.97 2.11 0.00 1.59 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.49 7.81 21 S 7.78 4.55 0.00 4.11 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 G 7.59 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 23 Q 8.06 4.28 0.00 1.59 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.84 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 24 Y 8.49 4.24 0.00 2.64 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 9.11 5.27 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 26 G 10.31 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 0.00 0.00 0.00 27 L 9.14 4.10 0.00 1.72 1.78 0.95 0.84 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 28 T 8.22 3.76 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 29 D 8.34 4.62 0.00 2.60 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.36 0.00 2.16 1.92 0.00 3.72 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.89 0.00 57 D 8.36 4.43 0.00 2.68 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 58 N 8.25 4.69 0.00 2.96 2.90 0.00 0.00 6.87 7.36 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 59 I 7.96 5.06 2.03 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 1.13 1.63 1.06 0.00 0.00 60 T 8.86 4.45 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 61 Y 8.10 5.12 0.00 3.13 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 9.07 4.80 1.83 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.93 0.92 0.00 0.00 63 F 9.09 5.17 0.00 3.11 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 64 T 8.75 5.26 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 1.26 0.00 0.00 65 S 9.09 4.80 0.00 4.18 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 66 P 0.00 4.48 0.00 2.25 2.21 0.00 3.91 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 2.03 2.19 0.00 67 R 8.01 4.18 0.00 2.02 1.98 0.00 3.46 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.80 0.00 68 L 9.35 3.96 0.00 1.82 1.77 0.91 0.86 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 69 R 8.12 3.93 0.00 2.13 2.43 0.00 3.10 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.84 0.00 70 A 8.00 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.16 3.84 0.00 1.86 1.94 0.00 3.13 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 72 Q 8.90 4.01 0.00 2.31 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 73 T 7.69 4.02 4.59 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 1.46 0.00 0.00 74 V 7.58 2.66 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 0.57 0.00 0.00 0.19 0.00 0.00 75 D 7.67 4.24 0.00 2.64 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 76 L 7.96 4.14 0.00 1.78 1.71 0.99 0.61 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 77 V 8.04 3.79 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 1.16 0.00 0.00 78 L 8.01 4.48 0.00 1.77 1.60 0.87 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.48 3.86 0.00 1.90 1.92 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.48 1.67 7.81 80 P 0.00 4.35 0.00 2.01 2.15 0.00 3.72 0.00 0.00 3.72 0.00 0.00 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1.38 1.42 7.81 89 I 7.00 4.56 1.92 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.66 0.86 0.00 0.00 90 R 8.34 4.33 0.00 0.85 1.52 0.00 2.41 0.00 0.00 2.80 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.29 0.00 91 V 8.21 4.61 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.83 0.00 0.00 92 V 8.49 4.34 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 1.04 0.00 0.00 0.91 0.00 0.00 93 V 8.59 4.37 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.94 0.00 0.00 94 D 9.15 5.19 0.00 2.99 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 95 D 9.44 4.47 0.00 2.92 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 96 D 8.37 4.55 0.00 2.94 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 L 7.59 4.55 0.00 1.88 1.73 1.03 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.59 4.24 0.00 1.98 1.99 0.00 3.07 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 99 E 8.32 4.18 0.00 1.77 1.81 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 2.70 2.19 0.00 100 W 8.96 3.96 0.00 3.29 2.30 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 0.00 101 E 9.37 4.12 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 2.31 2.38 0.00 102 Y 8.47 4.58 0.00 3.37 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 0.00 103 G 8.01 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 0.00 104 D 7.93 4.28 0.00 2.13 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 0.00 105 Y 7.28 4.52 0.00 2.82 2.43 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.52 0.71 0.89 0.00 0.00 115 E 7.97 3.83 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 116 L 7.71 3.82 0.00 1.73 1.54 0.87 0.88 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 0.00 117 R 7.85 3.81 0.00 1.78 1.91 0.00 2.21 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.17 0.00 118 K 8.12 3.88 0.00 1.96 1.87 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.43 7.81 119 S 7.81 4.21 0.00 4.05 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 7.43 4.36 0.00 1.84 1.99 0.00 3.20 0.00 0.00 3.38 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.71 0.00 121 G 8.01 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 0.00 122 L 7.78 4.64 0.00 1.70 1.61 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 123 D 8.58 4.72 0.00 2.86 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 0.00 124 K 7.62 4.14 0.00 1.81 1.88 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.20 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.57 7.81 125 E 8.18 4.26 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 126 R 7.52 4.72 0.00 1.96 1.99 0.00 3.00 0.00 0.00 3.41 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 127 P 0.00 4.37 0.00 2.25 2.15 0.00 3.81 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 128 W 8.72 4.47 0.00 3.51 3.16 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 0.00 129 N 8.80 4.26 0.00 2.67 2.56 0.00 0.00 6.68 7.42 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 0.00 130 I 6.90 3.11 0.72 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.59 -0.39 0.00 0.00 131 W 7.67 4.82 0.00 3.35 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 R 8.11 4.53 0.00 2.06 2.12 0.00 3.28 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 133 D 8.78 4.80 0.00 2.92 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 0.00 134 G 8.91 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 C 8.45 5.03 0.00 3.06 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.62 4.00 0.00 1.73 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 137 N 9.09 4.37 0.00 2.98 2.84 0.00 0.00 6.80 7.98 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 0.00 138 G 7.93 4.82 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 0.00 139 E 9.12 4.83 0.00 1.90 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 2.24 2.23 0.00 140 T 8.90 4.85 4.36 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 1.30 0.00 0.00 141 T 8.85 3.97 4.72 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 1.49 0.00 0.00 142 Q 8.06 4.19 0.00 2.42 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.67 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 143 Q 7.75 3.81 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 144 I 7.03 3.38 0.87 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.81 -0.52 0.00 0.00 145 G 7.63 3.69 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 0.00 146 L 8.00 3.57 0.00 0.76 1.51 0.26 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 147 R 7.51 3.91 0.00 2.13 2.09 0.00 2.75 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.54 0.00 148 L 7.97 4.12 0.00 1.70 1.88 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 149 S 7.94 4.07 0.00 4.12 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 0.00 150 R 7.94 3.75 0.00 2.12 1.91 0.00 3.23 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.83 0.00 151 A 7.74 3.84 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 7.96 3.64 1.82 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.24 0.48 0.00 0.00 153 A 7.97 3.87 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 7.93 3.74 0.00 1.72 1.69 0.00 2.71 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 155 I 7.66 3.55 2.11 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 1.12 0.16 1.10 0.00 0.00 156 Q 8.47 4.27 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.31 1.98 0.00 157 N 8.12 4.21 0.00 2.85 2.87 0.00 0.00 7.12 6.65 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 0.00 158 L 7.62 3.81 0.00 1.86 1.57 0.46 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 159 H 8.23 4.31 0.00 3.35 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 R 8.11 3.79 0.00 1.94 2.01 0.00 3.05 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 161 K 8.21 3.93 0.00 1.84 2.03 0.00 1.71 0.00 0.00 1.62 0.00 0.00 3.05 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.63 7.81 162 H 8.46 4.39 0.00 3.48 3.38 0.00 5.70 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.51 4.05 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 164 S 8.07 4.26 0.00 4.08 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 E 7.94 4.36 0.00 2.21 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 2.38 2.41 0.00 166 G 7.88 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 0.00 167 R 8.12 4.83 0.00 1.77 1.92 0.00 3.04 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00 168 A 8.60 4.14 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 0.00 169 S 8.62 4.57 0.00 4.04 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 D 9.60 5.37 0.00 2.80 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 0.00 171 I 8.66 5.64 2.07 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 1.46 1.94 1.28 0.00 0.00 *173 V 8.09 4.44 1.73 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 0.59 0.00 0.00 0.91 0.00 0.00 174 F 9.53 5.20 0.00 2.96 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 0.00 175 A 8.75 4.86 1.04 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 0.00 176 H 8.93 5.22 0.00 3.31 3.35 0.00 5.64 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 0.00 177 G 9.08 3.85 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 0.00 0.00 0.00 178 H 9.16 4.57 0.00 3.95 3.74 0.00 5.83 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 A 8.57 4.21 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 8.47 4.29 0.00 1.85 1.74 0.87 0.49 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 0.00 181 R 8.10 4.25 0.00 2.60 2.36 0.00 3.40 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.02 0.00 182 Y 8.93 4.19 0.00 3.76 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 F 9.21 4.22 0.00 3.38 3.34 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 0.00 184 A 8.87 4.25 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 0.00 185 A 8.58 4.25 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 I 7.99 3.66 1.89 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.59 1.02 0.00 0.00 187 W 7.88 4.13 0.00 3.51 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 F 7.62 4.97 0.00 3.40 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 G 7.55 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 L 7.11 3.93 0.00 1.43 1.33 0.63 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 191 G 8.23 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 V 7.87 4.42 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 0.63 0.00 0.00 0.68 0.00 0.00 193 Q 8.45 4.48 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 194 K 8.59 4.52 0.00 1.62 0.84 0.00 1.54 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.20 1.36 7.81 195 K 8.67 4.54 0.00 1.75 1.75 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.46 7.81 196 C 9.01 4.65 0.00 2.87 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 E 9.60 4.44 0.00 1.93 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 2.25 2.23 0.00 198 T 7.88 4.31 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 0.00 199 I 8.10 3.73 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.85 0.91 0.00 0.00 200 E 8.10 3.95 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 201 E 7.81 3.97 0.00 2.11 2.05 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 2.26 2.35 0.00 202 I 6.94 4.39 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.62 0.93 0.00 0.00 203 Q 7.83 4.11 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.61 2.28 0.00 204 N 8.46 4.63 0.00 2.44 2.58 0.00 0.00 7.30 7.71 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 0.00 205 V 8.39 3.95 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 0.78 0.00 0.00 0.96 0.00 0.00 206 K 7.95 3.62 0.00 1.81 1.70 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.29 1.22 7.81 207 S 7.70 4.51 0.00 4.18 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 0.00 208 Y 7.44 5.30 0.00 3.31 3.16 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 0.00 209 D 8.48 4.59 0.00 2.50 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 0.00 210 D 8.25 4.68 0.00 2.86 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 0.00 211 D 8.91 4.69 0.00 2.76 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 0.00 212 T 8.40 4.22 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 213 V 7.55 4.13 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 0.68 0.00 0.00 1.00 0.00 0.00 214 P 0.00 4.39 0.00 2.10 2.05 0.00 3.73 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 2.05 2.14 0.00 215 Y 8.79 4.30 0.00 3.18 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 V 7.32 4.12 1.83 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 0.76 0.00 0.00 0.87 0.00 0.00 217 K 8.36 4.10 0.00 1.83 1.81 0.00 1.92 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.67 1.84 7.81 218 L 8.25 4.21 0.00 1.64 1.78 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 219 E 8.74 4.39 0.00 2.02 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 2.34 2.27 0.00 220 S 7.67 5.29 0.00 3.83 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 0.00 221 Y 9.03 4.98 0.00 2.93 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 0.00 222 R 8.38 5.17 0.00 1.67 1.82 0.00 3.02 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 223 H 8.58 5.38 0.00 3.67 3.60 0.00 5.45 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 L 9.15 4.59 0.00 1.53 1.62 0.30 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 225 V 7.94 4.46 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.91 0.00 0.00 226 D 7.46 4.52 0.00 2.53 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 N 8.35 3.14 0.00 2.54 2.45 0.00 0.00 6.99 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 P 0.00 3.66 0.00 0.65 1.39 0.00 2.20 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 1.01 1.03 0.00 229 C 7.80 3.48 0.00 2.91 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 0.00 230 F 7.55 5.36 0.00 2.97 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 0.00 231 L 8.23 4.75 0.00 1.62 1.58 0.93 0.92 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 0.00 232 L 8.07 4.17 0.00 1.55 1.60 0.85 1.24 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 0.00 233 D 8.55 4.55 0.00 2.76 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 A 8.54 4.12 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 0.00 235 G 8.77 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 0.00 0.00 0.00 0.00 236 G 8.22 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 0.00 0.00 0.00 237 I 8.18 5.04 1.77 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.64 0.76 0.00 0.00 238 G 8.94 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 0.00 0.00 0.00 239 V 7.81 4.72 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 0.87 0.00 0.00 0.80 0.00 0.00 240 L 8.54 4.77 0.00 0.27 0.13 0.68 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 241 S 9.00 4.21 0.00 3.69 3.42 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 0.00 242 Y 8.51 5.39 0.00 2.94 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 0.00 243 A 9.31 4.25 1.19 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 0.00 244 H 9.00 4.10 0.00 3.32 3.41 0.00 6.05 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 0.00 245 H 8.32 3.99 0.00 3.27 3.37 0.00 5.64 0.00 0.00 0.00 0.00 7.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 N 7.89 4.83 0.00 2.85 2.96 0.00 0.00 7.25 7.87 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 0.00 247 I 8.29 2.94 1.67 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 1.14 0.68 0.70 0.00 0.00 248 D 8.34 4.60 0.00 2.81 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 0.00 249 E 8.44 5.00 0.00 2.21 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 250 P 0.00 4.93 0.00 1.81 1.58 0.00 3.79 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.74 0.00 251 A 9.52 4.90 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 L 8.04 4.24 0.00 0.78 0.67 0.52 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 253 E 8.56 4.13 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 254 L 8.55 3.80 0.00 1.59 1.63 0.86 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 255 A 8.39 4.29 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 G 7.08 3.54 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 0.00 257 P 0.00 4.27 0.00 1.96 2.03 0.00 3.60 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 1.68 1.80 0.00 258 F 7.69 3.26 0.00 2.62 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 V 6.87 4.26 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.94 0.00 0.00 260 S 8.26 4.05 0.00 3.96 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 0.00 261 P 0.00 4.31 0.00 2.05 2.00 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.08 0.00 262 P 0.00 4.42 0.00 2.16 2.04 0.00 3.75 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 263 E 8.75 4.07 0.00 1.94 1.90 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 2.30 2.33 0.00 * Residues marked with a * may have inaccurate shift predictions.