NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1443 8.2649 123.5705 51.1904 19.4682 175.1392 2 P 4.1997 0.0000 0.0000 62.6038 31.5347 174.4904 3 R 4.2784 9.2979 118.1958 58.2901 31.0805 176.7631 4 S 4.7801 7.6596 113.1106 56.4490 66.6824 173.6017 5 V 3.8590 7.9286 122.4308 61.0737 35.0360 174.1410 6 D 4.7905 7.8124 126.5393 51.6851 42.8904 175.4266 7 W 4.0540 9.1997 127.5093 58.9741 29.0733 178.3542 8 R 4.0395 8.2010 118.5154 59.3221 29.2106 178.6810 9 E 4.0597 8.0988 117.4098 58.3563 29.4866 178.3438 10 K 4.5790 7.8022 115.9847 55.8506 32.6336 177.1563 11 G 3.7154 7.8945 107.2885 45.8083 0.0000 174.2127 12 Y 3.5145 7.8933 116.7922 58.1228 38.5012 175.1066 13 V 4.3718 7.3991 119.6642 60.7981 33.9383 175.2026 14 T 4.2764 8.3796 116.9700 60.2464 69.7234 172.3020 15 P 4.5004 0.0000 0.0000 62.2807 31.9414 176.5789 16 V 3.7636 8.2789 120.1736 63.3729 32.3465 175.3653 17 K 4.6381 8.5187 125.8403 54.6827 35.9303 174.2616 18 N 5.1615 8.1727 118.6514 52.0057 40.6056 174.2911 19 Q 3.7324 8.8705 126.2188 56.6022 29.8927 177.7193 20 G 3.7992 8.0442 107.9660 47.0776 0.0000 174.5438 21 Q 4.1894 8.6914 123.0926 56.1856 29.0628 175.8360 22 C 4.7385 7.5486 117.7293 54.9412 43.9306 174.7162 23 G 3.8750 8.6068 117.0093 45.6644 0.0000 174.9488 24 S 4.0737 7.7060 114.2469 55.8341 64.0258 174.6539 *26 W 4.7098 8.3447 124.0039 56.4505 30.0389 177.9089 27 A 3.5245 6.4873 120.7548 54.5183 17.5267 179.6781 28 F 3.5861 7.6704 115.9233 60.3992 39.0523 177.7155 29 S 4.0791 8.0320 112.1837 61.2350 62.1829 175.9614 30 A 4.1004 7.9746 123.7283 55.4804 18.1657 179.8064 31 T 3.9636 8.2330 108.7709 64.6200 68.7489 177.0968 32 G 3.5889 8.3030 108.5593 47.0440 0.0000 175.6285 33 A 4.0884 8.2644 123.7317 54.7634 18.3794 179.5398 34 L 3.9628 8.4256 119.0876 58.1124 41.6077 178.9418 35 E 4.0711 8.9667 119.2682 59.3727 29.4227 179.6377 36 G 3.6722 7.9973 105.2026 47.8259 0.0000 175.9177 37 Q 4.0056 8.2196 120.7204 58.8285 28.7462 178.7055 38 M 4.0837 8.8306 120.3143 57.9580 31.9342 178.5963 39 F 4.0536 8.1970 122.3144 60.7914 39.3903 176.9550 40 R 3.7311 7.5082 116.7736 59.1883 29.8677 177.7332 41 K 4.2836 7.7340 115.6546 57.0189 32.5933 177.1773 42 T 4.3197 7.1667 106.6164 59.7365 70.0211 175.0103 43 G 3.2313 8.1654 109.9918 45.4299 0.0000 173.2289 44 R 4.5419 7.4483 119.6892 53.9470 32.6653 173.8521 45 L 4.9222 8.7644 126.6313 53.7273 42.9601 175.3355 46 I 4.6753 8.1285 126.2451 59.2365 40.6018 175.2285 47 S 4.4392 8.8080 122.2041 58.5105 63.3302 173.3700 48 L 4.7856 9.1223 127.6772 53.3035 44.2519 176.4482 49 S 4.4933 8.5314 115.4266 57.3892 61.9601 174.6703 50 E 3.6379 8.2655 129.0910 59.1265 29.0405 178.9291 51 Q 3.8820 7.9136 119.2647 59.0571 29.0814 177.7401 52 N 3.3164 7.6099 118.2487 56.0934 38.8617 176.9677 53 L 3.6680 7.0975 119.3327 57.6188 41.4967 179.5222 54 V 3.8395 7.5357 117.2783 66.1411 31.5161 177.3489 55 D 4.6882 8.3092 117.7070 56.0480 41.0244 177.0367 56 C 4.9124 7.9432 114.4453 56.4111 37.2952 174.4615 57 S 4.8959 6.8961 114.7198 57.0443 63.0908 176.2949 58 G 3.8955 8.0311 112.9725 48.6087 0.0000 174.5969 59 P 4.2066 0.0000 0.0000 64.9387 31.5169 177.0392 60 Q 4.0375 7.7696 115.9645 55.6378 28.9146 176.8996 61 G 3.6847 7.6690 105.7371 45.0341 0.0000 174.1733 62 N 4.2860 7.7676 117.2146 53.0448 39.3061 174.6077 63 E 4.9373 8.2155 118.2627 56.1038 31.7729 178.9567 64 G 4.0956 8.0830 113.6649 47.5610 0.0000 176.5885 65 C 4.7166 9.0933 123.6639 57.5336 40.2331 173.6451 66 N 4.6208 8.4089 117.2743 53.1430 38.4866 174.5269 67 G 3.8670 8.1352 104.8104 44.3638 0.0000 173.2326 68 G 3.0548 6.7389 105.7976 44.1795 0.0000 172.4260 69 L 4.5150 7.6431 118.1784 52.0776 46.0365 177.8215 70 M 3.6890 8.2667 121.9555 58.5439 31.8382 178.8002 71 D 3.6776 7.3993 118.3342 57.3171 40.7930 178.3268 72 Y 4.3763 7.3891 116.4260 60.9494 37.8467 178.2702 73 A 4.0921 7.7060 121.2248 55.3573 18.5300 179.6744 74 F 4.6780 7.8491 116.5772 61.0297 38.8816 177.9520 75 Q 4.2231 8.6643 118.1632 59.0706 28.4555 178.1772 76 Y 4.0353 8.3226 120.7758 60.7866 38.4742 178.3321 77 V 3.3401 8.1834 119.2305 65.7366 31.5901 177.7609 78 Q 4.5664 8.0679 120.6764 58.9624 28.7957 177.8492 79 D 4.2751 8.0328 117.8452 57.0898 41.3472 177.1156 80 N 4.2881 8.0254 116.4249 53.6641 38.8987 175.7553 81 G 3.7903 7.4177 106.9443 44.9587 0.0000 173.0359 82 G 4.4887 6.5977 105.9864 46.0927 0.0000 172.3379 83 L 4.9472 7.9332 120.1821 53.6830 45.9752 174.7495 84 D 5.4080 9.2482 125.8247 53.9456 42.2432 176.3329 85 S 4.6721 8.4022 116.3810 58.0633 64.0285 174.6703 86 E 4.1093 9.2650 123.1144 59.6174 29.0543 179.2094 87 E 4.0377 8.1414 116.3284 59.2632 29.8160 178.5860 88 S 4.3311 7.8641 113.1815 59.3918 64.5599 174.3525 89 Y 4.8078 7.5159 122.8448 55.6561 39.3743 172.2716 90 P 4.6421 0.0000 0.0000 61.6787 32.6380 175.6679 91 Y 4.5777 8.5567 121.7786 57.7867 37.9914 175.7875 92 E 4.3796 9.3067 124.7795 54.8459 31.4980 176.3588 93 A 3.2534 6.3832 119.1094 51.4772 16.1277 176.6900 94 T 4.5168 6.8014 109.1327 62.0874 70.6378 172.7310 95 E 4.1240 8.6772 128.4546 56.0286 30.0960 175.5688 96 E 4.8412 8.9364 125.2568 53.8028 33.3230 175.5934 97 S 4.2807 8.3728 114.0662 58.2747 63.5245 174.6056 98 C 4.6167 8.7522 122.7611 57.0467 43.5936 173.4317 99 K 4.6453 9.0599 127.7283 55.8732 32.7621 175.7774 100 Y 4.6233 8.4974 120.0050 58.2512 39.3182 174.4885 101 N 4.6587 8.7505 124.8573 50.6366 41.1105 173.1556 102 P 4.1751 0.0000 0.0000 64.4589 31.5725 178.4095 103 K 3.6880 7.7917 120.0023 58.9793 32.1345 176.7836 104 Y 4.8637 7.3424 114.8188 57.5537 37.9414 174.8524 105 S 4.6805 7.7905 116.0416 58.7459 62.5473 174.1822 106 V 4.4530 8.5834 119.3632 60.7898 32.8700 174.8434 107 A 4.7437 7.6274 122.0466 51.5145 22.0664 175.1016 108 N 5.1856 8.2700 115.2904 52.8519 42.8319 173.6519 109 D 4.7099 8.2740 117.5584 52.7755 42.0990 175.4099 110 A 4.5508 10.4222 121.9794 51.1738 20.0403 177.9140 111 G 3.7211 6.3588 105.3880 45.6256 0.0000 172.4844 112 F 4.9402 7.2190 116.6098 55.7686 40.8649 173.2687 113 V 4.2075 8.2263 121.2484 61.0809 34.0128 173.7764 114 D 5.2658 8.6671 127.5444 53.2177 42.0914 176.2162 115 I 4.1832 8.4164 124.9207 60.0368 37.9005 174.5873 116 P 4.3571 0.0000 0.0000 62.9306 32.3244 177.1019 117 K 5.0427 8.1847 120.1159 55.1650 30.9604 177.7739 118 Q 4.6375 7.3878 118.0356 53.3276 34.4110 175.9858 119 E 4.2290 8.9325 123.2487 59.2735 29.6273 179.6051 120 K 3.9763 8.1537 119.3826 59.3950 32.3616 178.6047 121 A 4.0545 7.9975 120.6749 54.9979 18.3750 179.1015 122 L 3.9293 8.1211 118.9392 58.5097 42.1070 178.8509 123 M 4.3552 8.7434 118.5226 58.6903 32.1184 178.0437 124 K 4.0050 8.2751 119.5582 59.5365 32.3451 178.6748 125 A 4.0055 8.2805 121.0754 55.1124 18.1708 179.7354 126 V 4.0785 8.7538 118.4058 65.7514 31.4227 178.1750 127 A 4.1397 8.5454 120.0203 54.6687 18.3603 178.7942 128 T 4.4385 8.2575 106.5773 62.2199 69.8632 175.7512 129 V 3.7970 9.2013 120.5772 64.9503 32.7539 175.1345 130 G 2.2849 6.7967 104.5920 42.7169 0.0000 170.3590 131 P 4.7313 0.0000 0.0000 63.1977 32.0263 176.1788 132 I 4.7155 8.6532 123.6932 59.4833 40.8134 175.0729 133 S 4.8895 8.8856 122.6157 58.7075 64.0729 173.8231 134 V 4.9955 8.9933 115.7910 58.9483 36.4109 173.7242 135 A 5.2177 8.4697 124.3151 50.3021 21.0249 176.1072 136 I 4.7185 8.6902 114.7911 58.8224 41.8566 174.4250 137 D 4.4989 9.0481 123.7070 53.4553 40.7616 175.4650 138 A 4.0111 9.1274 130.2993 51.7784 19.2414 177.0356 139 G 4.0152 8.3101 106.3037 47.2781 0.0000 174.1462 140 H 5.0216 7.8095 116.5939 53.4097 31.2885 175.3490 141 E 4.2363 9.0969 122.5989 59.8957 29.0782 179.4944 142 S 4.4920 8.4432 112.8800 61.5516 63.3585 175.9005 143 F 4.1526 8.8053 124.3498 60.9828 38.9464 177.1806 144 L 4.5575 8.4937 117.3821 57.8050 41.6065 178.4599 145 F 4.5062 8.2932 114.4462 56.4470 39.5315 175.4281 146 Y 4.1292 7.5087 121.3430 58.0676 39.0426 176.8260 147 K 3.6789 7.3178 122.7697 56.9803 35.8569 175.8437 148 E 4.2283 6.9318 113.1992 55.8319 32.3685 175.7568 149 G 3.7705 8.3794 107.5406 44.7828 0.0000 171.7774 150 I 4.5677 8.1157 119.5847 60.0848 38.5600 175.3231 151 Y 4.5113 9.5834 129.9681 57.5342 39.8714 174.0975 152 F 4.6913 8.3782 128.1439 56.3414 42.7821 173.1122 153 E 4.2051 7.8691 126.3666 53.2055 30.8936 174.0535 154 P 3.9895 0.0000 0.0000 65.6347 31.1478 176.5519 155 D 4.5788 8.1516 116.0217 54.0360 41.2715 175.3829 156 C 4.4323 7.6464 118.3643 57.3551 38.6802 172.5798 157 S 4.7938 9.3332 121.0085 57.0631 63.2612 174.6157 158 S 4.8663 8.5246 119.5622 58.3861 63.5325 174.1689 159 E 4.5235 8.0121 118.2293 55.8174 31.4689 175.3110 160 D 4.7542 8.1574 118.4439 52.6845 40.9777 174.5182 161 M 4.7226 8.2315 123.2797 53.5154 33.6555 175.6633 162 D 4.9733 8.6044 120.8747 53.2216 40.9017 175.1000 163 H 4.9605 8.0250 118.6506 54.8693 33.6878 171.7701 164 G 4.3642 8.6075 111.5583 44.8570 0.0000 172.8283 165 V 4.4525 8.5986 117.4591 60.0103 36.6133 173.2052 166 L 5.0896 8.0603 122.4940 54.1728 45.4445 176.4883 167 V 4.5790 9.0072 127.6344 62.6360 32.4239 176.3679 168 V 4.5510 9.4102 121.0007 60.8062 33.2970 176.3510 169 G 3.8069 7.6288 107.9129 46.8270 0.0000 170.5473 170 Y 4.9371 6.7909 115.9570 56.7080 41.7892 174.2767 171 G 3.6150 7.6361 104.6506 46.4794 0.0000 172.1653 172 F 5.6449 7.7332 114.0364 55.6335 40.8579 173.8565 173 E 4.7650 9.6081 118.4091 54.7831 32.8134 174.6522 174 S 4.2187 9.1880 120.8513 59.1362 62.9087 173.0547 175 T 4.7725 8.0296 122.0647 61.2737 72.2369 174.4117 176 E 3.9012 9.0222 121.1171 60.2073 29.2144 178.7964 177 S 4.4005 7.9420 109.0152 57.9684 63.4116 174.1321 178 D 4.4206 7.9370 118.7140 55.1556 38.4984 173.8214 179 D 4.6940 7.5677 119.4844 53.1939 40.3437 175.5137 180 N 5.2009 8.3866 120.7221 51.9381 41.6062 174.4870 181 K 5.0936 7.9912 118.8376 55.0678 34.6296 175.0061 182 Y 5.4160 8.0901 120.5854 55.4744 42.1560 173.6697 183 W 5.1244 9.6843 120.7280 55.7021 31.4947 175.4303 184 L 4.9891 9.4975 127.2475 54.2771 42.8333 175.1988 185 V 4.9317 8.9507 127.1828 60.9699 34.3708 174.0837 186 K 3.4558 9.2158 130.0760 55.4058 33.3057 175.7542 187 N 4.7399 8.0492 127.0391 51.5078 41.4198 173.9467 188 S 4.6661 7.5955 112.3470 57.6745 62.8728 175.1015 189 W 4.6797 8.1028 115.1217 57.3056 28.5904 177.3888 190 G 4.1791 8.1836 103.4122 45.6211 0.0000 175.2280 191 E 4.2322 8.4856 117.6748 58.2735 29.9257 179.2168 192 E 4.0129 8.2385 119.3709 58.3627 30.2358 176.9794 193 W 4.1612 7.8612 128.0937 58.0986 32.1069 176.3852 194 G 3.0212 7.1792 111.4995 45.1919 0.0000 175.3945 195 M 4.1419 8.6348 118.1491 54.5356 30.9962 176.2078 196 G 3.9929 9.2661 113.1084 45.9273 0.0000 172.5157 197 G 4.1625 8.9440 107.9421 45.0513 0.0000 173.3005 198 Y 5.1806 8.0407 117.3458 56.1578 41.5417 175.0815 199 V 4.4822 8.7657 120.0454 60.0034 35.2206 174.5387 200 K 4.8951 8.6322 123.9562 56.0119 33.0952 175.6125 201 M 5.1689 9.3102 125.7485 53.3302 34.4528 175.8622 202 A 4.6175 8.8431 124.7188 52.6084 19.0915 176.8367 203 K 4.6868 8.6082 123.3123 54.9319 34.7990 175.4188 204 D 4.5933 9.1652 124.3971 56.2132 38.3664 174.7325 205 R 4.6397 7.5667 112.3855 55.9913 30.8714 176.3278 206 R 3.7340 8.6459 114.3826 57.6293 28.7328 176.3953 207 N 4.2668 8.8450 110.6231 54.4013 37.6316 173.5803 208 H 4.2678 7.8139 115.4695 58.1914 30.8445 174.3814 209 C 4.2792 9.0879 121.2965 57.0721 36.8986 174.2623 210 G 3.8900 8.4254 107.6251 45.8489 0.0000 175.6489 211 I 3.5229 7.3479 120.5362 63.4824 38.1449 176.5191 212 A 4.4259 8.8806 121.3195 52.1001 18.8162 178.4620 213 S 4.3517 8.1609 113.7297 60.7669 63.9511 174.8433 214 A 4.7399 7.5129 122.2044 50.3944 18.4994 175.4090 215 A 5.0225 7.7446 124.2998 50.9565 21.9047 177.9877 216 S 5.1650 8.9414 114.8776 58.2343 67.0528 173.2951 217 Y 5.1913 8.0836 117.4120 54.7670 41.4470 172.5303 218 P 4.4730 0.0000 0.0000 62.6492 32.8834 175.6306 219 T 4.4093 8.6852 113.7550 60.7476 70.2279 175.4283 220 V 3.9876 8.2861 119.0532 61.2737 32.1177 175.6730 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 A 8.26 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 4.20 0.00 2.21 2.25 0.00 3.95 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 3 R 9.30 4.28 0.00 2.03 2.17 0.00 3.05 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 4 S 7.66 4.78 0.00 3.51 3.44 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 5 V 7.93 3.86 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 0.00 0.00 0.15 0.00 0.00 0.37 0.00 0.00 6 D 7.81 4.79 0.00 2.52 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 7 W 9.20 4.05 0.00 3.38 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.20 4.04 0.00 1.98 1.96 0.00 2.91 0.00 0.00 2.77 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 9 E 8.10 4.06 0.00 1.95 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 0.00 2.27 2.25 0.00 10 K 7.80 4.58 0.00 2.02 2.24 0.00 1.56 0.00 0.00 1.92 0.00 0.00 3.00 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.33 7.81 11 G 7.89 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 12 Y 7.89 3.51 0.00 3.20 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 13 V 7.40 4.37 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.11 0.00 0.00 14 T 8.38 4.28 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 1.34 0.00 0.00 15 P 0.00 4.50 0.00 2.11 2.09 0.00 3.72 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 2.07 2.12 0.00 16 V 8.28 3.76 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 0.82 0.00 0.00 0.96 0.00 0.00 17 K 8.52 4.64 0.00 1.77 1.81 0.00 1.92 0.00 0.00 1.96 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.62 7.81 18 N 8.17 5.16 0.00 2.62 2.63 0.00 0.00 6.94 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 19 Q 8.87 3.73 0.00 2.18 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.59 0.00 0.00 0.00 0.00 0.00 2.42 2.18 0.00 20 G 8.04 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 21 Q 8.69 4.19 0.00 2.02 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.72 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 22 C 7.55 4.74 0.00 3.19 3.24 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 23 G 8.61 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 0.00 0.00 0.00 24 S 7.71 4.07 0.00 3.69 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *26 W 8.34 4.71 0.00 3.48 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 27 A 6.49 3.52 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 28 F 7.67 3.59 0.00 3.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.03 4.08 0.00 3.81 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 30 A 7.97 4.10 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 31 T 8.23 3.96 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 1.09 0.00 0.00 32 G 8.30 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.26 4.09 1.52 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 34 L 8.43 3.96 0.00 2.00 1.78 0.99 1.20 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 35 E 8.97 4.07 0.00 2.23 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 2.58 2.44 0.00 36 G 8.00 3.67 0.00 0.00 0.00 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0.00 0.00 78 Q 8.07 4.57 0.00 2.43 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 79 D 8.03 4.28 0.00 2.67 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.03 4.29 0.00 1.65 1.97 0.00 0.00 7.26 7.52 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 81 G 7.42 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 82 G 6.60 4.49 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 0.00 83 L 7.93 4.95 0.00 1.87 1.56 1.05 1.35 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 84 D 9.25 5.41 0.00 3.01 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 85 S 8.40 4.67 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 86 E 9.26 4.11 0.00 2.19 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 2.34 2.42 0.00 87 E 8.14 4.04 0.00 2.12 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 2.26 2.41 0.00 88 S 7.86 4.33 0.00 3.79 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 89 Y 7.52 4.81 0.00 3.03 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.64 0.00 2.16 2.04 0.00 3.81 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 2.06 2.11 0.00 91 Y 8.56 4.58 0.00 2.93 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 92 E 9.31 4.38 0.00 1.82 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 2.36 2.51 0.00 93 A 6.38 3.25 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 6.80 4.52 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.91 1.87 0.00 103 K 7.79 3.69 0.00 1.35 1.02 0.00 1.56 0.00 0.00 1.27 0.00 0.00 2.97 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.91 1.18 7.81 104 Y 7.34 4.86 0.00 3.22 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 0.00 105 S 7.79 4.68 0.00 4.12 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 0.00 106 V 8.58 4.45 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 0.89 0.00 0.00 1.02 0.00 0.00 107 A 7.63 4.74 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 0.00 108 N 8.27 5.19 0.00 2.67 2.69 0.00 0.00 6.72 8.06 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 0.00 109 D 8.27 4.71 0.00 3.04 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 0.00 110 A 10.42 4.55 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 0.00 111 G 6.36 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 0.00 112 F 7.22 4.94 0.00 3.20 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 0.00 113 V 8.23 4.21 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 0.89 0.00 0.00 0.66 0.00 0.00 114 D 8.67 5.27 0.00 2.66 2.64 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 0.00 115 I 8.42 4.18 2.04 0.00 0.00 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 1.44 0.64 0.98 0.00 0.00 116 P 0.00 4.36 0.00 2.07 2.03 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 117 K 8.18 5.04 0.00 1.76 1.80 0.00 1.75 0.00 0.00 2.48 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.43 7.81 118 Q 7.39 4.64 0.00 2.07 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 119 E 8.93 4.23 0.00 2.18 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.54 0.00 120 K 8.15 3.98 0.00 1.85 1.85 0.00 1.73 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.52 7.81 121 A 8.00 4.05 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 0.00 122 L 8.12 3.93 0.00 1.68 1.83 0.76 -0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 123 M 8.74 4.36 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 2.38 0.00 124 K 8.28 4.01 0.00 1.95 2.04 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.53 7.81 125 A 8.28 4.01 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 0.00 126 V 8.75 4.08 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 1.25 0.00 0.00 127 A 8.55 4.14 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 T 8.26 4.44 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 1.33 0.00 0.00 129 V 9.20 3.80 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.51 0.00 0.00 130 G 6.80 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 0.00 0.00 0.00 131 P 0.00 4.73 0.00 1.97 2.09 0.00 3.41 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.19 0.00 132 I 8.65 4.72 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.17 1.07 0.00 0.00 133 S 8.89 4.89 0.00 4.16 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.99 5.00 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 0.70 0.00 0.00 0.88 0.00 0.00 135 A 8.47 5.22 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.69 4.72 1.74 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 0.91 0.48 0.83 0.00 0.00 137 D 9.05 4.50 0.00 2.74 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 9.13 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.31 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 0.00 140 H 7.81 5.02 0.00 3.46 3.39 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 9.10 4.24 0.00 2.24 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 0.00 2.46 2.78 0.00 142 S 8.44 4.49 0.00 4.49 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 0.00 143 F 8.81 4.15 0.00 3.31 3.40 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 0.00 144 L 8.49 4.56 0.00 1.98 1.69 1.04 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 145 F 8.29 4.51 0.00 3.30 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 0.00 146 Y 7.51 4.13 0.00 2.90 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 7.32 3.68 0.00 1.40 1.45 0.00 1.42 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.30 1.20 7.81 148 E 6.93 4.23 0.00 1.87 1.65 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 1.95 2.16 0.00 149 G 8.38 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 0.00 150 I 8.12 4.57 1.99 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.70 1.15 0.00 0.00 151 Y 9.58 4.51 0.00 2.82 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 F 8.38 4.69 0.00 2.93 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 7.87 4.21 0.00 1.59 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 2.07 2.07 0.00 154 P 0.00 3.99 0.00 2.24 2.33 0.00 3.70 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 1.99 2.04 0.00 155 D 8.15 4.58 0.00 2.67 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 0.00 156 C 7.65 4.43 0.00 2.91 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 0.00 157 S 9.33 4.79 0.00 3.86 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 0.00 158 S 8.52 4.87 0.00 4.03 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 0.00 159 E 8.01 4.52 0.00 1.92 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 2.19 2.23 0.00 160 D 8.16 4.75 0.00 2.62 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 M 8.23 4.72 0.00 1.88 1.92 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.64 0.00 162 D 8.60 4.97 0.00 2.65 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 0.00 163 H 8.03 4.96 0.00 3.05 2.90 0.00 5.64 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 0.00 164 G 8.61 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 0.00 0.00 0.00 0.00 165 V 8.60 4.45 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 0.41 0.00 0.00 0.80 0.00 0.00 166 L 8.06 5.09 0.00 1.66 1.45 1.01 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 167 V 9.01 4.58 2.12 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 1.23 0.00 0.00 0.77 0.00 0.00 168 V 9.41 4.55 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.25 0.00 0.00 169 G 7.63 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 0.00 170 Y 6.79 4.94 0.00 2.74 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 0.00 171 G 7.64 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 F 7.73 5.64 0.00 3.06 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 0.00 173 E 9.61 4.77 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 174 S 9.19 4.22 0.00 3.95 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 0.00 175 T 8.03 4.77 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 0.00 176 E 9.02 3.90 0.00 1.95 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 2.32 2.33 0.00 177 S 7.94 4.40 0.00 3.94 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 0.00 178 D 7.94 4.42 0.00 2.86 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 0.00 179 D 7.57 4.69 0.00 2.56 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 0.00 180 N 8.39 5.20 0.00 2.67 3.01 0.00 0.00 7.53 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 7.99 5.09 0.00 1.74 1.48 0.00 1.45 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.37 7.81 182 Y 8.09 5.42 0.00 3.22 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 0.00 183 W 9.68 5.12 0.00 3.50 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 0.00 184 L 9.50 4.99 0.00 2.04 1.88 1.01 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 185 V 8.95 4.93 2.34 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 0.95 0.00 0.00 1.11 0.00 0.00 186 K 9.22 3.46 0.00 1.72 1.53 0.00 1.72 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.08 0.74 7.81 187 N 8.05 4.74 0.00 2.48 2.46 0.00 0.00 7.04 7.67 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 0.00 188 S 7.60 4.67 0.00 2.95 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 W 8.10 4.68 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 0.00 190 G 8.18 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 0.00 0.00 0.00 0.00 191 E 8.49 4.23 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 2.48 2.35 0.00 192 E 8.24 4.01 0.00 1.98 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 2.33 2.31 0.00 193 W 7.86 4.16 0.00 3.62 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 G 7.18 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 0.00 0.00 0.00 195 M 8.63 4.14 0.00 2.22 1.97 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 196 G 9.27 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 0.00 0.00 0.00 197 G 8.94 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 Y 8.04 5.18 0.00 3.18 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 0.00 199 V 8.77 4.48 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 0.81 0.00 0.00 -0.10 0.00 0.00 200 K 8.63 4.90 0.00 1.85 1.42 0.00 1.41 0.00 0.00 0.91 0.00 0.00 2.13 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.54 1.21 7.81 201 M 9.31 5.17 0.00 2.27 2.34 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.78 0.00 202 A 8.84 4.62 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 0.00 203 K 8.61 4.69 0.00 0.93 1.34 0.00 0.61 0.00 0.00 0.82 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.76 0.21 7.81 204 D 9.17 4.59 0.00 2.78 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 0.00 205 R 7.57 4.64 0.00 2.01 1.96 0.00 3.12 0.00 0.00 3.26 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.79 0.00 206 R 8.65 3.73 0.00 2.02 2.04 0.00 3.41 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 207 N 8.84 4.27 0.00 3.02 2.87 0.00 0.00 6.89 8.36 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 0.00 208 H 7.81 4.27 0.00 3.59 3.56 0.00 5.96 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 C 9.09 4.28 0.00 3.17 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 0.00 210 G 8.43 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 0.00 211 I 7.35 3.52 1.84 0.00 0.00 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 0.74 0.66 0.83 0.00 0.00 212 A 8.88 4.43 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 0.00 213 S 8.16 4.35 0.00 3.91 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 0.00 214 A 7.51 4.74 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 0.00 215 A 7.74 5.02 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 0.00 216 S 8.94 5.16 0.00 4.11 4.12 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 0.00 217 Y 8.08 5.19 0.00 3.02 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 P 0.00 4.47 0.00 1.83 1.01 0.00 3.66 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.62 0.00 219 T 8.69 4.41 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 1.10 0.00 0.00 220 V 8.29 3.99 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 0.75 0.00 0.00 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.