NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.3357 8.4444 120.2349 56.4606 30.7214 174.5637 2 V 4.1695 8.4030 120.5795 63.2076 32.8852 175.4898 3 K 4.8328 9.8472 125.0372 54.8573 37.1188 174.7448 4 L 5.2057 8.7469 123.6940 52.9947 45.4390 175.4266 5 S 4.6854 8.8566 117.6507 56.5998 65.4396 172.9881 6 E 5.4220 9.1336 127.1000 56.1416 30.9946 175.9454 7 S 4.7675 8.1919 115.1048 57.5214 66.5101 173.3945 8 G 4.5164 8.6812 107.1367 42.2282 0.0000 171.2794 9 P 4.2408 0.0000 0.0000 62.8021 31.7551 177.0130 10 G 3.9686 8.5679 108.5272 45.9654 0.0000 172.4865 11 L 5.3216 7.6207 122.1179 53.1731 45.1274 175.6717 12 V 4.5025 8.8712 125.5776 61.0437 35.1457 174.4417 13 K 5.2013 8.9541 127.0316 54.6927 33.2963 174.7802 14 P 4.6221 0.0000 0.0000 64.5138 31.6773 176.9737 15 S 4.0952 9.7337 114.8285 58.6665 63.3598 169.6616 16 Q 4.8584 7.4151 120.2984 54.9551 31.4046 173.9605 17 S 5.0663 8.4267 113.8771 57.2413 64.2945 173.3245 18 L 4.6455 8.4416 127.8571 53.5205 44.3495 175.3698 19 S 4.9235 8.3183 120.4733 56.9707 66.1519 173.2048 20 L 4.9423 8.3784 124.3953 53.0525 45.4908 175.8363 21 T 5.0987 8.9825 117.5726 62.0007 72.4345 172.4838 22 C 5.1987 8.5242 123.5345 55.2932 44.9893 172.6158 23 T 4.6828 8.5225 123.9689 62.0732 70.0116 173.9622 24 V 5.0761 7.9241 126.2076 61.3358 33.4587 174.9563 25 T 4.6134 9.0890 117.5538 61.2394 71.5199 175.1437 26 G 4.0530 10.9804 112.3016 45.6110 0.0000 172.7502 27 Y 4.8064 7.1522 118.4084 56.2354 41.7278 173.8901 28 S 4.1930 7.8981 121.9664 58.1924 63.2622 173.7699 29 I 3.0582 7.9283 119.1227 61.3193 37.9328 176.7142 30 T 4.0391 7.4163 111.2930 62.3162 68.6764 174.5960 31 T 4.3493 7.7554 113.1437 61.3207 71.3188 173.8016 32 N 5.3587 8.1911 121.9837 51.7768 36.7680 173.1299 33 Y 4.6631 7.6518 118.5513 55.4264 43.5887 174.5665 34 A 3.9206 8.6112 124.6023 50.9534 19.7545 177.1955 35 W 4.4064 9.0289 124.7519 56.5118 29.7105 176.3172 35A T 5.2063 8.6288 115.7948 59.8277 71.7147 173.4113 36 W 5.2404 8.8401 121.4630 55.1526 32.4705 175.0438 37 I 5.3825 9.4283 124.1028 59.9140 41.8109 174.2867 38 R 4.9378 8.9863 119.6565 54.6239 33.3054 173.4848 39 Q 4.9753 8.8618 122.7589 54.4619 31.6032 175.2486 40 F 5.0523 9.0822 125.8230 55.8912 41.1903 173.3957 41 P 4.5611 0.0000 0.0000 64.0477 31.5587 176.9223 42 G 4.0404 9.6565 110.4571 44.9011 0.0000 174.6021 43 N 4.4101 8.4736 115.6066 52.8800 37.4564 174.4461 44 K 4.1051 7.5937 120.2427 57.0343 33.2987 175.2338 45 L 5.2387 8.6048 126.4676 53.1567 43.9601 175.4230 46 E 4.8126 9.2993 123.7507 54.1309 33.2707 173.9916 47 W 4.7694 9.1293 135.0000 57.7981 31.1675 175.2443 48 M 4.0698 8.7400 127.4727 55.9885 33.2269 176.5475 49 G 3.5253 6.5028 102.8522 47.0790 0.0000 170.3738 50 Y 5.5293 7.3780 115.7267 56.1649 41.6300 173.3509 51 I 5.1029 8.8361 120.9573 59.4957 41.3872 174.2513 52 R 5.2608 8.8738 127.6693 54.7752 33.9943 175.0054 53 S 3.9074 9.7338 121.0900 59.8121 61.2267 175.7372 54 S 4.2358 8.4651 116.6317 59.0364 61.9565 173.2501 55 V 4.2945 8.1299 109.6912 60.7433 32.8626 175.4976 56 I 4.4224 7.9848 122.8424 60.1286 37.7736 174.3871 57 T 4.8688 8.2392 117.0629 59.8017 71.1960 174.2641 58 R 4.2342 7.4234 121.8194 54.7151 34.3617 173.8385 59 Y 5.0195 8.1453 119.7869 55.6208 42.4450 174.5555 60 N 4.9111 8.5638 119.4792 52.7716 39.8939 174.1934 61 P 4.3967 0.0000 0.0000 65.7870 31.2240 178.9279 62 S 4.2444 8.2044 112.0933 61.1740 63.2025 175.7266 63 L 4.2470 7.8964 120.0879 54.3932 41.5379 177.8276 64 K 3.6562 8.1799 120.0306 58.2146 31.4564 175.9314 65 S 4.6728 8.6918 120.2050 59.1225 63.1747 174.8633 66 R 4.2947 7.7891 116.0493 56.6578 29.9465 175.0350 67 I 4.7597 7.0985 118.9323 59.6427 40.3875 174.5893 68 S 4.3154 8.6500 122.1069 56.8878 66.1412 172.4924 69 I 5.2752 9.3422 128.2056 59.2599 39.4779 174.6484 70 T 5.1899 8.4639 118.8033 60.8226 72.0375 172.1978 71 Q 4.9462 8.4758 116.9590 56.1230 32.4510 173.0880 72 D 4.8317 9.2766 118.7901 52.6258 42.7906 176.2058 73 T 3.8478 8.7344 124.2875 66.6361 68.7923 176.2209 74 S 4.2412 8.2579 114.3452 61.0377 62.7936 175.3302 75 K 4.1033 8.5509 118.3399 55.6379 32.6404 175.5458 76 N 4.0553 8.1741 117.2000 53.9278 37.3621 173.0382 77 Q 4.6796 7.2539 116.0200 54.5848 33.0375 175.3037 78 F 4.9364 8.1582 115.8957 55.1829 41.1760 174.2082 79 F 5.4811 9.0507 117.4762 55.6770 43.5223 173.6042 80 L 4.4520 8.2661 122.2982 53.1141 44.7535 174.9538 81 Q 4.8147 8.6010 126.2876 54.1881 32.6784 173.4193 82 L 5.0020 8.5671 127.6976 53.1677 44.5858 175.4831 82A N 4.6464 9.2012 124.4508 52.6458 39.4404 175.5588 82B S 4.0441 8.1380 114.0956 58.8185 60.5517 172.8313 82C V 4.0502 8.0061 115.2351 61.5329 32.6709 176.0560 83 T 4.8996 9.3625 111.8256 59.5680 72.0742 174.8036 84 T 4.2041 8.5859 110.6674 64.9832 68.3963 175.9275 85 E 3.9664 7.7397 119.4624 58.6984 29.4678 177.3043 86 D 4.9352 8.3048 117.3930 54.6150 41.3890 176.8840 87 T 4.1288 8.2042 117.7232 63.6596 68.9545 173.3652 88 A 4.4139 8.2328 127.1253 52.3077 23.7615 174.6212 89 T 4.8414 7.9744 116.0143 62.7759 70.3493 174.0279 90 Y 5.0621 8.9357 124.6792 56.7045 40.0422 174.5417 91 Y 5.5322 9.6174 122.3853 56.3643 41.5986 172.3478 92 C 5.2406 8.9004 115.0689 53.9238 46.3022 172.4103 93 A 4.6895 8.3103 120.5453 51.0709 23.2885 174.9271 94 R 4.2799 8.0874 118.8784 54.8932 32.1089 174.0354 95 Y 4.8391 8.6283 125.3002 56.3415 40.7159 175.3122 96 D 5.0497 8.2448 123.0666 51.5339 42.4825 176.3492 97 Y 3.7289 8.7484 118.9211 61.1327 38.2849 176.7865 98 Y 4.3502 8.0351 113.4591 58.2440 38.1140 176.4035 99 G 4.0793 8.4451 108.9439 45.0386 0.0000 173.0797 100 N 4.6028 8.2404 119.3647 52.9437 39.8714 175.2291 100A T 4.8041 7.7285 113.7654 59.7074 71.7792 175.3082 100B G 3.5532 7.7824 109.7146 47.1534 0.0000 173.7947 101 D 4.7079 7.6855 124.6757 54.2345 41.6474 177.1373 102 Y 4.7376 6.9321 119.6893 56.6700 36.3356 174.5775 103 W 5.1564 7.7810 119.5024 54.4773 33.1041 176.3150 104 G 4.5119 8.9433 111.2768 44.5116 0.0000 173.9114 105 Q 4.2242 8.6784 117.4852 56.6290 29.1423 177.3873 106 G 3.5094 8.8584 105.6891 45.7785 0.0000 172.8540 107 T 4.5159 8.4846 116.3793 59.8464 70.0554 172.9429 108 S 4.7597 8.6931 124.0941 58.3225 64.1492 172.7368 109 V 4.7920 8.8658 125.6914 61.4735 34.7915 174.0250 110 T 4.9200 8.7919 123.8839 61.7145 71.7006 173.2646 111 V 5.1917 8.2403 125.8342 61.2120 32.9505 174.4655 112 S 4.6460 8.3668 120.9328 58.1457 65.3334 175.4514 113 S 4.3496 8.8180 118.1822 59.9508 63.3486 175.2410 114 A 4.0348 7.3347 122.5796 52.3111 18.5381 176.9990 115 K 4.5400 8.1569 118.8950 55.3864 33.5379 177.2789 116 T 4.4919 8.3896 118.4302 64.6208 69.4459 174.0884 117 T 4.8110 9.7031 122.4610 61.3398 72.7265 171.9902 118 P 4.8420 0.0000 0.0000 62.2067 32.3070 174.2611 119 P 5.0407 0.0000 0.0000 62.2890 33.3181 174.8701 120 S 4.6612 8.7322 115.1824 56.4711 65.5140 172.9183 121 V 4.5706 8.0084 122.9056 61.3096 33.1718 174.0998 122 Y 5.1387 8.3088 125.4333 55.4116 40.7268 173.7341 123 P 4.7603 0.0000 0.0000 62.8759 32.4931 176.2330 124 L 4.7576 9.0810 120.9816 53.1805 43.7123 175.3963 125 A 4.8247 8.4186 124.9465 48.9414 21.8915 174.2651 126 P 4.4843 0.0000 0.0000 62.1924 32.3698 177.1092 127 G 3.8494 8.6381 109.0905 48.8241 0.0000 173.5868 128 T 4.1444 7.4612 110.5634 61.1625 70.7461 171.3907 129 A 4.7619 8.2456 124.6491 50.8341 21.8939 174.4461 130 A 4.2388 7.8208 119.5177 51.5733 21.1774 175.8923 128 L 4.1344 7.4712 118.7634 54.4625 43.3461 174.2907 129 K 4.7619 8.2956 121.2491 54.5341 35.8939 173.2461 130 S 4.3888 7.8908 111.4177 57.3733 65.8774 172.6923 136 S 4.3188 9.6423 122.1566 58.7303 69.8148 175.2282 137 M 5.1529 8.8312 119.0654 53.2914 34.1124 175.5493 138 V 4.4604 8.9359 122.9357 60.1528 34.5535 174.4445 139 T 4.7628 8.3635 119.9862 61.9812 70.4707 173.7874 140 L 4.4604 8.3888 126.1954 53.2288 45.6891 174.8454 141 G 4.5294 8.0656 104.6357 46.7089 0.0000 171.7776 142 C 5.5996 9.2354 116.0492 55.1705 44.7829 173.6897 143 L 4.7384 9.0113 124.0503 53.4293 44.3921 175.4572 144 V 4.4761 8.6813 128.2738 61.7246 32.6506 174.6296 145 K 4.7639 8.6886 129.3106 54.6493 35.8260 175.7423 146 G 4.0502 8.4356 112.6618 47.3043 0.0000 171.8649 147 Y 5.0869 6.5643 115.5301 55.0796 42.3744 175.4998 148 F 5.0696 8.7134 117.7963 57.2628 43.6819 171.8487 149 P 3.8268 0.0000 0.0000 60.9680 33.4501 175.0745 150 E 4.2023 8.3735 118.8720 55.9719 29.8578 174.7430 151 P 4.9587 0.0000 0.0000 61.1217 33.9666 174.2392 152 V 4.6868 7.8016 115.9929 60.3779 34.6707 174.7333 153 T 4.5874 8.9652 112.1216 59.9097 71.7499 172.7393 154 V 5.2882 8.4404 124.9143 60.4396 34.6659 174.4477 *156 T 4.9455 8.1603 115.9821 61.6746 70.9155 172.1271 157 W 5.4442 8.2463 120.1172 53.4593 33.0242 176.3584 *162 N 4.6739 8.4081 121.0812 53.6721 39.4088 175.6967 163 S 3.8033 9.4919 110.5027 59.4162 60.0153 173.0324 164 G 4.1362 8.5333 111.2108 45.5468 0.0000 176.4093 165 S 4.0983 7.7598 112.9297 59.7364 63.2478 173.7747 166 L 4.6528 7.3641 123.3037 53.3361 42.5456 175.5497 167 S 4.6809 8.4986 119.1072 57.4891 64.6891 174.3472 168 S 4.3187 8.0604 115.8674 58.5173 64.4148 173.7118 169 G 3.4106 8.3047 109.9894 46.3662 0.0000 172.9931 *171 V 4.3312 7.3744 116.1941 62.9618 33.3444 175.0740 172 H 4.5805 8.8026 122.4312 54.6316 32.4980 172.4076 173 T 4.7387 8.3192 120.8620 61.8644 69.6360 174.7885 174 F 4.5203 8.7189 125.4779 55.8131 40.1479 174.3581 175 P 4.3159 0.0000 0.0000 62.9711 31.7860 176.2923 176 A 4.5778 8.4941 123.0670 52.2270 19.2363 176.8961 177 V 4.5635 9.5275 120.9008 61.0033 35.1711 173.9779 178 L 4.6959 8.4709 127.6107 53.6395 43.3643 175.6596 179 Q 4.0632 9.1307 128.8653 54.7443 31.2078 174.4538 180 S 3.4390 8.1353 125.1153 59.5486 59.1781 171.8518 *183 D 4.3750 7.7868 116.0415 53.3677 43.0791 174.1295 184 L 4.7068 7.0569 117.2686 53.6025 45.7577 175.4665 185 Y 4.7294 8.3553 119.2647 57.9120 39.7710 174.7969 186 T 5.3476 8.8772 117.2322 62.7034 73.6885 172.6743 187 L 4.9012 9.1965 125.2722 54.4858 46.3738 173.7343 188 T 5.3263 8.6714 112.8657 60.1650 72.8463 172.3125 189 S 5.4821 8.9874 115.4225 57.0038 66.5063 172.7384 190 S 5.5644 9.3247 120.0021 56.6731 66.8598 173.1420 191 V 4.5035 8.0882 119.8535 60.3773 34.5412 173.8620 192 T 4.8002 8.3526 121.6915 61.9385 70.0443 174.1790 193 V 4.5443 8.3783 119.3178 58.3270 36.0048 173.4974 194 P 4.7855 0.0000 0.0000 62.7573 31.8313 177.4972 195 S 4.1524 9.5195 120.7962 61.6913 63.2783 177.1497 196 S 4.0958 7.9724 114.7421 60.9650 63.1449 175.7516 *199 T 4.5797 7.7462 109.4791 60.6263 70.0875 172.6897 200 W 5.0529 7.9182 130.8413 55.7786 33.7471 172.8058 *202 P 3.1143 0.0000 0.0000 61.8003 32.1335 177.2439 203 S 4.1026 8.0255 115.0994 61.3954 62.7943 174.3664 204 Q 4.7489 7.6595 119.8996 53.7563 29.8739 176.1136 205 T 4.2957 8.6449 114.9427 61.7027 70.1124 173.8948 206 V 4.8536 8.7461 123.6801 61.6234 34.7251 174.1608 207 T 5.4624 9.8166 123.7879 62.0170 73.1258 170.2742 208 C 4.4913 8.8817 119.6799 53.4535 40.3919 172.2190 209 N 5.4345 8.8194 118.9840 51.4290 41.2307 173.4877 210 V 4.6398 8.9750 123.8142 60.8884 34.4090 173.8372 211 A 4.9386 8.8077 129.9298 50.5184 21.6492 174.5049 212 H 4.8312 8.7206 123.4573 53.0803 30.1246 172.2707 213 P 4.0936 0.0000 0.0000 65.1713 31.6049 178.3703 214 A 3.8317 7.8036 118.9229 54.6896 18.0966 178.1839 215 S 4.6102 7.7923 107.2050 57.2999 63.5275 174.1882 216 S 3.7266 8.0494 115.7748 60.4411 60.8402 172.1171 217 T 4.8057 7.4328 107.7463 59.9093 72.6300 173.4391 218 K 5.0301 8.4668 123.5008 55.0658 35.4095 175.2030 219 V 4.5046 8.9357 127.0755 61.0933 34.8218 173.6548 220 D 5.3294 8.6595 125.9815 52.3456 43.8309 175.2579 221 K 4.5036 8.8018 123.8367 54.5128 35.3258 174.7738 222 K 4.8107 8.8230 129.1479 55.8772 33.7185 175.8241 223 I 4.2655 8.6369 128.4460 60.4424 38.2825 175.5813 *226 V 4.7413 8.1437 119.4571 60.3657 32.7087 173.6760 227 P 4.4637 0.0000 0.0000 63.2297 31.8915 176.5063 228 R 4.2248 8.6293 118.8543 56.6039 30.1445 176.5273 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 1 E 8.44 4.34 0.00 2.06 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 0.00 2.28 2.34 0.00 2 V 8.40 4.17 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 0.76 0.00 0.00 0.35 0.00 0.00 3 K 9.85 4.83 0.00 1.75 1.68 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.47 7.81 4 L 8.75 5.21 0.00 1.71 1.60 1.06 1.02 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 5 S 8.86 4.69 0.00 3.89 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 6 E 9.13 5.42 0.00 2.10 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 2.72 2.24 0.00 7 S 8.19 4.77 0.00 3.86 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 8 G 8.68 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.24 0.00 1.98 1.95 0.00 3.71 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.03 0.00 10 G 8.57 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.62 5.32 0.00 1.53 1.49 1.04 1.03 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 V 8.87 4.50 2.06 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 0.94 0.00 0.00 0.87 0.00 0.00 13 K 8.95 5.20 0.00 1.76 1.72 0.00 2.03 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.56 1.29 7.81 14 P 0.00 4.62 0.00 2.08 2.10 0.00 3.86 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.00 0.00 15 S 9.73 4.10 0.00 4.17 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 7.42 4.86 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 17 S 8.43 5.07 0.00 3.81 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 18 L 8.44 4.65 0.00 1.68 1.49 0.66 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.32 4.92 0.00 3.60 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.38 4.94 0.00 0.88 1.34 0.35 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.98 5.10 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 1.33 0.00 0.00 22 C 8.52 5.20 0.00 2.41 1.58 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 23 T 8.52 4.68 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 24 V 7.92 5.08 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.94 0.00 0.00 25 T 9.09 4.61 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 1.22 0.00 0.00 26 G 10.98 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 0.00 0.00 0.00 27 Y 7.15 4.81 0.00 2.73 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 28 S 7.90 4.19 0.00 3.68 3.39 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 29 I 7.93 3.06 0.70 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.19 -0.20 0.00 0.00 30 T 7.42 4.04 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 nan 0.00 0.00 31 T 7.76 4.35 4.53 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 1.06 0.00 0.00 32 N 8.19 5.36 0.00 2.66 2.59 0.00 0.00 7.11 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 33 Y 7.65 4.66 0.00 2.29 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 0.00 0.00 0.00 34 A 8.61 3.92 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 W 9.03 4.41 0.00 2.84 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35A T 8.63 5.21 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 1.31 0.00 0.00 36 W 8.84 5.24 0.00 3.42 3.29 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 37 I 9.43 5.38 2.17 0.00 0.00 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 1.51 0.84 1.22 0.00 0.00 38 R 8.99 4.94 0.00 0.84 1.05 0.00 2.21 0.00 0.00 2.69 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.63 0.00 39 Q 8.86 4.98 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.32 2.57 0.00 40 F 9.08 5.05 0.00 3.07 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.56 0.00 2.13 2.10 0.00 3.88 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.21 0.00 42 G 9.66 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 N 8.47 4.41 0.00 2.96 3.04 0.00 0.00 6.85 7.21 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 44 K 7.59 4.11 0.00 2.10 1.95 0.00 1.71 0.00 0.00 2.11 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.66 1.58 7.81 45 L 8.60 5.24 0.00 1.64 1.67 0.92 0.89 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 46 E 9.30 4.81 0.00 2.14 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 47 W 9.13 4.77 0.00 3.29 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 48 M 8.74 4.07 0.00 2.03 2.28 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 2.59 2.51 0.00 49 G 6.50 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 50 Y 7.38 5.53 0.00 3.08 3.15 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 51 I 8.84 5.10 2.05 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 1.22 1.80 0.98 0.00 0.00 52 R 8.87 5.26 0.00 1.98 1.90 0.00 3.20 0.00 0.00 3.03 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 53 S 9.73 3.91 0.00 4.12 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 54 S 8.47 4.24 0.00 4.04 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 55 V 8.13 4.29 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 0.74 0.00 0.00 1.01 0.00 0.00 56 I 7.98 4.42 2.19 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 1.33 0.70 1.04 0.00 0.00 57 T 8.24 4.87 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 1.30 0.00 0.00 58 R 7.42 4.23 0.00 0.67 1.61 0.00 3.15 0.00 0.00 3.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.61 0.00 59 Y 8.15 5.02 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 60 N 8.56 4.91 0.00 3.03 2.76 0.00 0.00 7.63 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 61 P 0.00 4.40 0.00 2.27 2.15 0.00 3.81 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 62 S 8.20 4.24 0.00 4.12 4.08 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 63 L 7.90 4.25 0.00 1.83 1.69 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.18 3.66 0.00 1.85 1.41 0.00 1.67 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.56 7.81 65 S 8.69 4.67 0.00 3.91 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 66 R 7.79 4.29 0.00 2.12 2.15 0.00 2.92 0.00 0.00 3.08 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.51 0.00 67 I 7.10 4.76 1.72 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.75 0.47 0.00 0.00 68 S 8.65 4.32 0.00 3.76 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 0.00 69 I 9.34 5.28 2.26 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.98 1.38 0.00 0.00 70 T 8.46 5.19 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 71 Q 8.48 4.95 0.00 2.21 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 72 D 9.28 4.83 0.00 3.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.73 3.85 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 74 S 8.26 4.24 0.00 3.97 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.55 4.10 0.00 1.81 1.93 0.00 1.88 0.00 0.00 1.92 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.55 7.81 76 N 8.17 4.06 0.00 2.90 2.74 0.00 0.00 6.52 6.29 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 77 Q 7.25 4.68 0.00 1.76 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.57 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 78 F 8.16 4.94 0.00 3.33 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 F 9.05 5.48 0.00 2.99 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 80 L 8.27 4.45 0.00 0.27 0.13 0.69 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 8.60 4.81 0.00 2.04 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.52 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 82 L 8.57 5.00 0.00 1.66 1.38 0.90 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 82A N 9.20 4.65 0.00 2.57 2.69 0.00 0.00 7.29 7.12 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 82B S 8.14 4.04 0.00 3.91 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 82C V 8.01 4.05 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 0.84 0.00 0.00 0.97 0.00 0.00 83 T 9.36 4.90 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 1.23 0.00 0.00 84 T 8.59 4.20 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 85 E 7.74 3.97 0.00 2.04 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 2.35 2.43 0.00 86 D 8.30 4.94 0.00 2.85 2.88 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 87 T 8.20 4.13 4.45 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 1.35 0.00 0.00 88 A 8.23 4.41 0.95 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 89 T 7.97 4.84 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 90 Y 8.94 5.06 0.00 2.98 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 9.62 5.53 0.00 3.14 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 92 C 8.90 5.24 0.00 2.66 1.62 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 93 A 8.31 4.69 0.07 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 0.00 0.00 94 R 8.09 4.28 0.00 1.35 1.35 0.00 2.21 0.00 0.00 2.25 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.50 0.00 95 Y 8.63 4.84 0.00 2.71 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 D 8.24 5.05 0.00 2.87 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.75 3.73 0.00 2.66 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 8.04 4.35 0.00 3.12 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 99 G 8.45 4.08 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 0.00 0.00 0.00 100 N 8.24 4.60 0.00 2.85 3.12 0.00 0.00 6.72 7.22 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 100A T 7.73 4.80 3.78 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 -0.17 0.00 0.00 100B G 7.78 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 7.69 4.71 0.00 2.30 2.53 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 0.00 102 Y 6.93 4.74 0.00 2.96 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 0.00 103 W 7.78 5.16 0.00 3.16 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 0.00 104 G 8.94 4.51 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 0.00 105 Q 8.68 4.22 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.41 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 106 G 8.86 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 0.00 107 T 8.48 4.52 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 1.35 0.00 0.00 108 S 8.69 4.76 0.00 3.93 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 0.00 109 V 8.87 4.79 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.76 0.00 0.00 110 T 8.79 4.92 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 111 V 8.24 5.19 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 0.92 0.00 0.00 0.99 0.00 0.00 112 S 8.37 4.65 0.00 4.10 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 0.00 113 S 8.82 4.35 0.00 3.89 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.33 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.16 4.54 0.00 1.79 1.79 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.41 7.81 116 T 8.39 4.49 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 1.43 0.00 0.00 117 T 9.70 4.81 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 118 P 0.00 4.84 0.00 2.09 2.10 0.00 3.81 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 119 P 0.00 5.04 0.00 2.08 2.12 0.00 3.68 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.71 0.00 120 S 8.73 4.66 0.00 3.49 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 0.00 121 V 8.01 4.57 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 0.72 0.00 0.00 0.79 0.00 0.00 122 Y 8.31 5.14 0.00 2.99 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 0.00 123 P 0.00 4.76 0.00 2.19 2.15 0.00 3.91 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 2.10 2.10 0.00 124 L 9.08 4.76 0.00 1.67 1.66 0.99 0.78 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 0.00 125 A 8.42 4.82 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 0.00 126 P 0.00 4.48 0.00 2.40 2.07 0.00 3.78 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.02 0.00 127 G 8.64 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 0.00 128 T 7.46 4.14 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 1.23 0.00 0.00 129 A 8.25 4.76 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 0.00 130 A 7.82 4.24 1.23 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 0.00 0.00 128 L 7.47 4.13 0.00 1.72 1.35 0.92 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.30 4.76 0.00 1.64 1.62 0.00 0.61 0.00 0.00 1.71 0.00 0.00 2.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.34 7.81 130 S 7.89 4.39 0.00 3.62 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 0.00 136 S 9.64 4.32 0.00 3.91 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 0.00 137 M 8.83 5.15 0.00 1.87 1.99 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 138 V 8.94 4.46 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 0.81 0.00 0.00 0.83 0.00 0.00 139 T 8.36 4.76 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 140 L 8.39 4.46 0.00 1.03 1.29 0.09 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 141 G 8.07 4.53 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 0.00 142 C 9.24 5.60 0.00 2.78 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 0.00 143 L 9.01 4.74 0.00 1.84 1.70 1.07 1.12 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 0.00 144 V 8.68 4.48 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.85 0.00 0.00 145 K 8.69 4.76 0.00 1.94 1.64 0.00 2.02 0.00 0.00 1.88 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.43 7.81 146 G 8.44 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 0.00 0.00 0.00 147 Y 6.56 5.09 0.00 2.90 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 F 8.71 5.07 0.00 3.17 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 0.00 149 P 0.00 3.83 0.00 1.71 1.04 0.00 3.80 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.78 0.00 150 E 8.37 4.20 0.00 1.71 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 0.00 1.47 1.47 0.00 151 P 0.00 4.96 0.00 2.10 2.02 0.00 3.64 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 1.83 1.87 0.00 152 V 7.80 4.69 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 0.54 0.00 0.00 0.53 0.00 0.00 153 T 8.97 4.59 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 1.16 0.00 0.00 154 V 8.44 5.29 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 0.75 0.00 0.00 0.82 0.00 0.00 *156 T 8.16 4.95 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 0.00 157 W 8.25 5.44 0.00 3.43 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 *162 N 8.41 4.67 0.00 3.06 2.94 0.00 0.00 7.17 7.08 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 0.00 163 S 9.49 3.80 0.00 4.05 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 0.00 164 G 8.53 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 S 7.76 4.10 0.00 4.04 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 0.00 166 L 7.36 4.65 0.00 1.78 1.82 0.91 0.77 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 0.00 167 S 8.50 4.68 0.00 3.96 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 S 8.06 4.32 0.00 3.96 3.87 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 0.00 169 G 8.30 3.41 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 0.00 *171 V 7.37 4.33 2.06 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 0.96 0.00 0.00 0.82 0.00 0.00 172 H 8.80 4.58 0.00 3.09 2.50 0.00 5.84 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.32 4.74 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 174 F 8.72 4.52 0.00 3.01 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 P 0.00 4.32 0.00 2.14 2.08 0.00 3.89 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 2.11 2.16 0.00 176 A 8.49 4.58 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 0.00 177 V 9.53 4.56 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 1.06 0.00 0.00 1.00 0.00 0.00 178 L 8.47 4.70 0.00 1.62 1.52 0.35 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 179 Q 9.13 4.06 0.00 1.91 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.31 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 180 S 8.14 3.44 0.00 4.03 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 *183 D 7.79 4.37 0.00 2.44 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 0.00 184 L 7.06 4.71 0.00 1.42 1.28 0.89 1.06 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 0.00 185 Y 8.36 4.73 0.00 1.50 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 T 8.88 5.35 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 1.35 0.00 0.00 187 L 9.20 4.90 0.00 1.87 1.72 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 188 T 8.67 5.33 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 1.25 0.00 0.00 189 S 8.99 5.48 0.00 4.07 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 9.32 5.56 0.00 4.04 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 0.00 191 V 8.09 4.50 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 -0.46 0.00 0.00 0.34 0.00 0.00 192 T 8.35 4.80 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 193 V 8.38 4.54 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 0.56 0.00 0.00 0.91 0.00 0.00 194 P 0.00 4.79 0.00 2.09 2.00 0.00 3.62 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 2.11 2.08 0.00 195 S 9.52 4.15 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 0.00 196 S 7.97 4.10 0.00 3.99 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 *199 T 7.75 4.58 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 200 W 7.92 5.05 0.00 3.26 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 *202 P 0.00 3.11 0.00 1.57 0.49 0.00 3.51 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.30 0.00 203 S 8.03 4.10 0.00 3.97 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 0.00 204 Q 7.66 4.75 0.00 2.37 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 205 T 8.64 4.30 4.34 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 1.25 0.00 0.00 206 V 8.75 4.85 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 1.08 0.00 0.00 1.14 0.00 0.00 207 T 9.82 5.46 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 1.26 0.00 0.00 208 C 8.88 4.49 0.00 1.42 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 N 8.82 5.43 0.00 2.54 2.74 0.00 0.00 6.36 7.56 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 0.00 210 V 8.97 4.64 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 0.86 0.00 0.00 0.73 0.00 0.00 211 A 8.81 4.94 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 0.00 212 H 8.72 4.83 0.00 3.05 3.10 0.00 5.65 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 P 0.00 4.09 0.00 2.11 2.06 0.00 3.72 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 2.06 2.06 0.00 214 A 7.80 3.83 1.11 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 0.00 0.00 215 S 7.79 4.61 0.00 4.04 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 0.00 216 S 8.05 3.73 0.00 3.98 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 0.00 217 T 7.43 4.81 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 218 K 8.47 5.03 0.00 1.69 1.63 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.26 1.33 7.81 219 V 8.94 4.50 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 0.86 0.00 0.00 0.88 0.00 0.00 220 D 8.66 5.33 0.00 2.54 2.51 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 0.00 221 K 8.80 4.50 0.00 1.79 1.54 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.45 7.81 222 K 8.82 4.81 0.00 1.88 1.76 0.00 1.90 0.00 0.00 1.77 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.53 1.77 7.81 223 I 8.64 4.27 2.08 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.37 0.99 0.00 0.00 *226 V 8.14 4.74 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 1.04 0.00 0.00 1.02 0.00 0.00 227 P 0.00 4.46 0.00 1.94 1.90 0.00 3.58 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.21 0.00 228 R 8.63 4.22 0.00 1.86 1.89 0.00 3.47 0.00 0.00 3.49 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.00 0.00 * Residues marked with a * may have inaccurate shift predictions.