NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4137 8.1933 115.2888 58.7169 64.5217 175.6157 3 T 3.6643 7.9604 116.6713 66.4071 68.1858 174.4135 4 D 4.3927 8.3698 120.4817 57.6272 41.1883 178.8951 5 R 3.8476 7.8608 118.0935 59.7504 30.1917 178.4378 6 T 3.9221 8.2069 115.9241 66.5091 68.4150 176.6003 7 G 3.7657 8.3407 108.0049 48.0948 0.0000 175.2286 8 N 4.3262 8.4491 119.5648 55.9759 38.6033 177.7021 9 I 3.6704 8.0066 121.2726 64.4694 37.2499 178.7461 10 V 3.6904 8.1424 119.5931 65.8699 31.2898 178.2677 11 G 3.6119 8.3094 105.6612 47.7827 0.0000 175.8830 12 K 4.0195 8.0633 120.9575 59.3519 32.0507 179.4878 13 M 4.0805 8.1243 119.0266 58.3753 31.8181 178.8397 14 I 3.7036 8.1511 120.1216 64.3860 37.2252 178.3103 15 A 3.9625 8.2223 121.4289 55.1715 18.2603 179.5564 16 A 3.9518 8.1303 119.2426 55.2380 18.4318 179.9709 17 I 3.6876 7.8966 118.3237 64.7738 37.3271 178.5384 18 N 4.4028 8.5489 117.1780 55.9630 38.2796 177.4241 19 A 4.0129 8.3592 122.9741 54.9727 18.3502 179.8085 20 V 3.5474 7.7697 116.6536 66.1386 31.5775 178.2216 21 I 3.6577 7.7566 119.5619 64.2334 36.8276 178.3286 22 K 3.8590 7.8343 119.7110 59.5685 31.9066 178.2162 23 D 4.3281 7.9136 116.8073 57.1883 41.2851 177.3369 24 E 4.2929 8.3342 115.6330 54.9844 30.8344 175.9166 25 K 3.7740 7.6463 117.6942 57.1535 30.0310 176.2834 26 V 3.7935 7.8598 117.8847 63.0999 32.4639 176.2081 27 S 4.6205 8.8909 122.4624 57.5274 65.7625 175.0029 28 Y 4.1952 8.4282 119.5123 61.2712 37.4772 179.0722 29 S 4.2122 8.1884 115.7782 61.6926 63.0454 176.3469 30 E 3.9695 8.2731 121.3272 59.5424 29.0991 178.7812 31 Y 4.1831 8.2744 119.7096 60.5324 38.8770 178.0768 32 K 3.8383 8.6287 120.6462 59.4871 32.2942 178.6428 33 A 4.0403 8.2465 121.2015 55.3689 18.1859 179.8542 34 S 4.1177 8.2655 113.7064 61.7382 62.8821 176.8851 35 T 3.8692 8.0847 118.9643 66.6734 68.2313 176.7038 36 G 3.6670 8.0949 107.4189 47.5660 0.0000 175.4303 37 W 4.0301 8.4639 130.9094 60.2032 30.5806 178.0909 38 L 3.6782 8.3784 119.1335 57.7572 41.0872 179.4080 39 I 3.7237 7.8017 120.0186 64.5320 36.9504 178.6293 40 S 3.9904 7.7859 114.9899 61.0215 62.7198 176.4840 41 V 2.9177 7.0303 122.0120 65.5094 30.9541 178.2396 42 G 3.7504 7.5105 105.0548 48.0873 0.0000 175.5040 43 E 4.0293 7.9360 120.0018 58.4715 29.4855 178.6457 44 K 4.2496 7.9479 116.1016 55.0762 32.7069 176.1706 45 N 4.2057 7.8529 115.7192 54.6699 36.6985 175.0645 46 E 4.5578 8.0119 113.9751 55.9688 29.9569 177.2873 47 W 4.3597 7.9100 121.3228 59.6623 29.1257 176.4140 48 P 4.3656 0.0000 0.0000 65.4052 30.8263 178.3039 49 L 3.8685 7.9651 118.6196 58.1394 41.9868 178.5372 50 F 4.4136 8.7095 120.7807 61.5074 39.4267 177.0541 51 L 4.2889 8.5633 118.6898 58.2025 41.2901 179.4044 52 D 4.6095 8.3091 117.7803 56.9585 40.9800 178.7932 53 V 3.4282 7.7890 119.0941 65.5439 31.2723 177.5472 54 F 4.3627 7.2408 114.8606 57.7718 39.8776 176.7168 55 F 4.8328 8.3426 115.8581 57.5263 41.5606 176.9004 56 E 4.0107 8.4116 121.0029 59.5190 29.2087 178.2831 57 H 4.1846 8.2760 114.5215 58.6595 28.5302 177.3888 58 A 3.9294 7.6371 123.3397 54.8542 18.2491 179.5340 59 I 3.6573 7.7306 117.8954 64.6704 37.2522 178.1468 60 E 3.9675 8.5692 120.4462 59.2702 29.2381 178.7229 61 S 4.1990 8.1202 112.5885 61.1523 62.8250 176.0553 62 V 3.7193 7.7470 120.3259 66.0435 31.3430 177.8871 63 A 4.0168 8.0094 120.2331 55.1350 18.3651 179.3867 64 A 4.2134 8.5996 119.2568 54.8952 18.1398 179.5739 65 E 4.0448 7.9655 116.3390 58.8997 29.4633 177.9196 66 S 4.6800 7.6247 112.9979 58.0854 63.0938 173.9977 67 N 4.4732 7.8566 118.5391 53.8572 38.5464 175.2495 68 R 4.5777 8.6748 119.7835 55.9970 32.2954 176.4976 69 G 4.5428 7.7181 106.2729 45.5941 0.0000 172.0044 70 S 4.7450 8.5084 118.9680 57.2791 65.0888 174.2162 71 Q 4.3463 8.7385 121.1219 56.4633 29.3806 175.2274 72 S 5.0515 8.4932 118.8336 57.1830 66.5696 171.9538 73 S 4.8506 8.5327 114.0163 57.3388 65.4405 173.4948 74 I 3.9761 8.2922 113.9948 60.9672 37.5769 176.3232 75 Q 4.0516 9.3743 125.8636 57.3936 29.1107 177.5938 76 G 3.8875 8.1928 106.9614 44.2311 0.0000 171.1767 77 P 4.5792 0.0000 0.0000 62.9942 31.6089 175.6600 78 Y 4.8325 7.3879 115.4303 57.8393 38.3076 175.3055 79 F 2.9172 8.0140 122.1691 57.5200 39.9580 174.4804 80 I 3.7981 6.0428 127.0139 58.1873 39.5845 173.9184 81 P 3.9647 0.0000 0.0000 63.6938 31.7138 176.3328 82 G 3.7592 8.7041 107.7117 45.9348 0.0000 173.6833 83 A 4.0524 7.6887 120.0722 50.9962 19.3953 176.6191 84 P 4.1424 0.0000 0.0000 62.9041 32.6278 176.4206 *85 E 4.3289 8.7001 122.8138 56.9464 30.0618 174.2500 86 L 4.7116 8.6335 126.1055 52.7853 43.7018 176.1146 87 S 4.9744 8.4091 113.2482 56.0982 66.0759 173.5485 88 I 3.4521 8.0426 122.6441 60.7170 37.2695 174.1300 89 P 4.3634 0.0000 0.0000 61.9156 32.2605 175.4743 90 Y 4.7067 8.3420 120.3809 58.4254 38.8988 175.4268 91 T 5.1002 8.5358 120.1177 61.7421 71.9914 173.8836 92 M 4.2118 9.0030 126.9384 54.8693 33.0599 174.7715 93 P 4.3177 0.0000 0.0000 63.1099 32.3470 175.5757 94 M 4.5896 8.1371 122.7825 53.4853 36.3636 174.9813 95 R 4.2879 9.0410 120.7711 55.3701 31.1504 177.8278 96 D 4.4118 8.6637 119.4169 55.8160 39.4195 176.8609 97 D 4.8904 7.7415 117.8887 52.2176 39.9160 175.6576 98 E 3.9320 7.8141 120.9738 57.7307 29.8572 176.9866 99 S 4.2910 8.4853 122.1950 59.0488 63.6471 172.4741 100 G 3.9107 8.4638 107.9081 43.8118 0.0000 172.7674 101 D 4.8445 8.5842 118.9662 53.4581 42.4751 176.7570 102 T 4.5091 8.7365 120.2367 63.8039 69.9408 172.7427 103 L 5.3635 9.2033 127.9593 53.4110 45.3027 174.8884 104 I 4.9515 9.4474 127.7095 59.8977 39.2556 174.2396 105 F 5.1327 9.5924 131.1466 56.6351 41.5963 174.3929 106 R 4.9585 8.7652 126.3426 54.5466 32.0674 175.5765 107 G 3.9934 8.3673 111.5670 44.1118 0.0000 171.2269 108 E 5.3413 8.7173 121.1204 54.3238 33.6137 174.4278 109 V 5.1588 9.1826 119.5648 59.7929 35.1922 175.1603 110 V 4.9891 8.7407 117.7809 59.4194 36.2685 175.6060 111 D 5.2934 8.5941 121.7712 51.8462 41.1086 177.1124 112 Q 4.1117 8.6737 116.9586 59.0064 28.6933 177.7986 113 E 4.0914 8.2924 115.9820 57.3109 29.8935 177.4489 114 G 3.9393 8.2209 106.1956 44.7916 0.0000 173.4670 115 A 4.2690 8.1733 123.4715 50.7539 19.2573 175.6145 116 P 4.6392 0.0000 0.0000 62.7675 32.6269 175.7042 117 L 4.7147 8.8859 123.1030 52.9981 43.9109 175.7801 118 A 5.4162 8.5815 125.2079 50.3654 20.8938 175.7924 119 D 4.3913 8.2249 117.0210 55.2116 39.4455 174.6655 120 V 3.8107 8.2159 118.5750 62.8294 33.0286 174.2602 121 L 4.9592 8.7168 129.5737 53.8386 43.7865 174.8624 122 L 5.1406 8.7221 126.4386 53.1086 44.4991 175.0551 123 D 5.2768 9.2417 124.5256 53.3007 43.0089 175.2621 124 M 5.0949 9.2081 122.9601 53.4650 35.6101 174.0759 125 W 6.1276 8.7260 121.1445 55.1054 32.1811 173.4262 126 Q 4.8096 8.6368 117.5938 55.3413 30.8968 173.4667 127 A 3.5860 7.6509 123.0993 50.9415 19.7645 177.0228 128 D 3.8845 8.2485 119.2324 51.9653 41.5150 176.9742 129 A 3.9247 8.4792 120.4278 54.5962 18.3811 178.0993 130 A 4.5147 8.2083 117.2198 51.2935 19.3004 176.8153 131 G 3.9834 8.1091 104.5482 47.5921 0.0000 174.0224 132 E 4.9302 8.6496 117.7739 54.2732 32.8221 175.0843 133 Y 4.9840 8.1792 118.5121 55.7288 40.6031 175.9834 134 S 4.3291 8.5726 117.8007 59.6567 63.8874 173.7511 135 F 4.1144 8.3460 125.2358 58.6042 37.1734 176.7446 136 I 3.5727 7.8922 118.6167 63.8532 37.0795 175.8592 137 N 4.6812 8.3491 122.8644 51.2421 38.5050 173.2219 138 P 4.4207 0.0000 0.0000 63.9532 31.7466 176.9909 139 T 4.2118 8.1332 109.0030 62.2667 69.4511 175.1855 140 L 4.2756 7.4266 122.6013 53.3723 42.6934 175.0244 141 P 4.2323 0.0000 0.0000 62.3077 31.9057 175.9918 142 D 3.4361 8.1381 121.9851 55.9034 41.1065 176.4844 143 Y 3.9031 7.7688 119.0802 57.9299 35.5646 168.8243 144 L 3.9824 7.5215 122.0950 56.8019 42.5627 176.7402 145 F 4.0165 8.6972 123.9529 58.5050 37.1216 174.9405 146 R 5.1847 7.8635 117.4902 54.9416 34.0292 175.2769 147 G 4.0735 8.6749 109.2158 45.8605 0.0000 171.8332 148 K 5.3017 9.0645 119.3010 54.4089 35.5922 175.9807 149 I 4.5028 8.5837 116.7613 59.1272 41.5479 173.8703 150 R 5.8764 8.1008 119.3669 53.3221 33.5841 176.0649 151 T 4.6870 8.4673 111.3379 61.3179 70.8848 173.8860 152 D 4.6443 9.4474 124.0106 54.1903 41.4543 177.7222 153 E 4.0196 8.7139 117.4767 59.3051 28.4989 177.3907 154 N 4.7300 8.3097 116.0307 52.5913 38.8362 175.3016 155 G 4.2782 8.0921 105.2674 46.8982 0.0000 173.6700 156 R 5.3380 7.2910 114.6807 54.3114 34.0623 174.7591 157 F 5.4101 8.4328 114.0077 56.4930 41.7094 173.0093 158 T 5.3855 8.9629 115.9997 61.8820 71.5739 173.2585 159 L 5.2569 9.7199 127.6943 53.4872 45.7310 174.7440 160 R 5.1155 9.1692 126.8630 55.6352 32.1402 174.9902 161 T 4.9047 9.0897 120.4725 61.4597 70.8290 171.8553 162 I 5.1357 8.6387 112.5507 58.8986 40.9785 175.5118 163 V 3.7537 8.5168 124.4377 62.2146 31.4457 174.2699 164 P 4.3900 0.0000 0.0000 62.5708 32.1771 175.8816 165 A 4.4913 8.2772 122.5024 50.6241 19.7380 175.5844 166 P 4.7535 0.0000 0.0000 63.5425 32.5353 175.1040 167 Y 4.7722 9.0866 123.0952 55.8590 41.4999 173.7274 168 E 3.9457 7.3944 127.2548 53.7781 30.9949 175.3399 169 I 3.7054 7.9297 127.8527 61.2314 38.1652 174.2990 170 P 4.1113 0.0000 0.0000 62.9066 31.5059 177.4882 171 K 4.0780 8.5806 122.1495 59.1640 33.0502 177.7624 172 N 4.7387 8.1245 116.0583 52.6010 37.3771 174.1504 173 G 4.4873 7.8908 106.9919 41.3790 0.0000 172.4366 174 P 4.3513 0.0000 0.0000 66.0904 30.9711 178.8179 175 T 4.3734 8.7373 116.0385 66.6076 68.4669 176.8811 176 G 4.0220 8.4435 108.2607 47.2197 0.0000 175.3587 177 A 4.0612 8.5326 123.5847 54.8634 18.3102 179.5467 178 L 3.6477 8.4089 118.9127 58.0880 42.1055 179.0237 179 L 4.1383 8.1887 118.7373 57.8806 41.6359 179.4273 180 A 3.9346 8.1078 120.1889 55.2671 18.1721 179.5973 181 A 3.8611 8.0747 117.9272 54.6711 18.4582 178.7133 182 A 3.7950 7.7280 117.1115 50.9908 18.8351 177.3822 183 G 3.8755 7.5455 105.1904 46.2817 0.0000 173.7595 184 W 5.1294 7.9770 119.0225 54.4448 31.1851 176.2289 185 H 4.5407 8.8531 117.5322 55.9063 28.9232 174.6124 186 A 4.6145 8.4351 121.3118 51.6379 20.5247 175.5334 187 W 4.6960 8.0074 118.3810 56.5185 31.3411 175.5334 188 R 5.3253 9.3162 123.8431 53.7583 32.1768 174.3763 189 P 5.3055 0.0000 0.0000 62.4567 32.5233 175.7588 190 A 4.5354 8.8680 122.6775 52.9827 18.8634 176.5287 191 H 4.6626 8.4666 114.4832 54.7128 31.4005 172.8026 192 L 4.3832 8.2304 120.3578 53.3420 43.9443 175.3694 193 H 4.5505 8.1978 121.4956 54.2778 30.4437 174.4351 194 W 5.5173 8.8614 121.1526 54.9795 33.5993 174.2411 195 I 5.0167 9.0983 124.1216 59.6614 39.9739 174.4507 196 I 5.0338 9.0904 128.1086 59.4167 40.0627 174.6966 197 A 5.0010 9.0494 127.9373 50.4768 23.2483 174.7863 198 K 4.6304 8.4434 119.1099 55.1393 35.8034 174.6673 199 E 4.0769 9.0593 128.6044 58.2220 30.0049 176.9969 200 G 3.8909 9.3315 113.8572 45.2240 0.0000 172.2353 201 Y 5.0242 7.7807 116.2287 55.6789 41.1963 175.0394 202 E 4.2951 8.7723 122.5227 56.2782 30.0208 177.4813 203 S 4.5733 8.7936 120.1121 58.6143 64.3229 173.1580 204 L 4.7837 9.1542 123.9384 53.6837 44.8369 175.0626 205 T 5.1580 8.4748 122.4851 62.2643 71.1724 173.3583 206 T 5.0954 9.0009 120.0823 61.4502 71.7669 171.7551 207 Q 4.9336 8.4901 121.1112 53.8916 32.7650 174.9449 208 L 4.5725 8.5065 121.8619 53.2553 45.0644 175.7563 209 Y 4.9043 8.6998 121.4811 56.2305 41.7853 173.8607 210 F 5.2905 8.4575 117.8856 55.4739 41.9900 175.6447 211 E 4.0824 9.2484 122.3625 58.0807 29.7032 177.2730 212 N 4.2533 9.0257 116.7915 53.8043 36.6768 174.6867 213 G 3.7878 8.1504 108.5364 44.8632 0.0000 173.5041 214 Q 3.7392 8.4445 123.0829 57.2904 29.4284 177.4619 215 W 3.9161 8.1791 121.5635 57.3769 27.5032 176.2083 216 T 4.0208 7.9729 108.8278 63.9383 68.1259 175.2472 217 G 4.0276 7.9651 108.3795 45.4087 0.0000 173.6253 218 S 4.6395 8.3496 115.1768 57.0172 62.9632 173.6334 219 D 4.4848 8.4095 119.6890 53.8056 41.2014 176.4684 220 V 3.3799 8.2897 127.6149 64.5344 31.0909 176.9785 221 A 4.6047 8.1233 119.7039 50.5468 19.1863 176.2689 222 N 4.0043 8.0103 112.3810 54.5280 36.5629 174.6691 223 A 4.6788 8.5193 117.9321 51.6382 20.0417 177.7524 224 V 3.5860 7.3080 116.2301 61.1217 32.7680 175.7709 225 K 4.7192 8.0945 120.2366 53.8753 36.4175 175.7385 226 P 4.3044 0.0000 0.0000 65.9151 31.4915 177.9829 227 E 4.2265 8.2415 115.7831 57.7503 29.6304 176.7908 228 L 4.6946 7.9866 118.3732 54.3831 43.2296 175.3804 229 L 5.0232 7.5324 118.9979 53.4777 43.0265 176.0754 230 L 4.8096 8.6452 123.8053 53.3006 44.0190 175.6274 231 S 5.3557 8.5186 117.2445 56.7311 64.6701 173.4115 232 L 4.8732 8.4677 123.8050 53.1210 42.9723 175.7290 233 D 4.5978 9.1359 128.0871 54.1189 42.0384 178.3468 *234 K 4.7596 8.7907 127.8034 54.9101 32.6700 173.9716 *235 I 4.3073 7.5079 123.5983 60.6133 37.7045 176.7504 *241 P 4.5060 0.0000 0.0000 61.8646 32.4064 175.7412 242 H 4.7805 7.6707 113.4572 54.7627 31.8529 171.9918 243 F 5.2738 9.3518 117.6133 55.9019 41.6983 174.9950 244 E 5.4500 9.4234 121.6166 55.3625 33.2292 174.7330 245 T 4.8189 8.7521 115.5902 61.4916 71.6717 171.9308 246 S 5.0451 8.0332 116.9790 56.3288 65.9905 172.1106 247 Y 4.4336 7.7044 123.5676 56.1905 42.1832 172.7955 248 K 4.6769 7.0731 126.3423 54.5744 34.2945 175.1624 249 F 4.8465 9.3231 126.7565 56.8174 41.2224 174.9475 250 T 5.6884 9.1384 118.3090 60.9910 71.6736 173.0052 251 L 5.0019 8.6313 125.0449 53.0282 44.8716 175.6425 252 G 4.3929 8.5349 108.9467 44.2346 0.0000 173.4372 253 K 4.0992 8.7307 121.2533 56.5484 32.7885 177.7820 254 V 3.6298 8.0516 119.9189 63.2641 33.2262 170.4260 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 S 8.19 4.41 0.00 3.86 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 3 T 7.96 3.66 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 1.21 0.00 0.00 4 D 8.37 4.39 0.00 2.71 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 5 R 7.86 3.85 0.00 1.87 2.03 0.00 3.18 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 6 T 8.21 3.92 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 1.19 0.00 0.00 7 G 8.34 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 8 N 8.45 4.33 0.00 3.07 2.88 0.00 0.00 7.12 6.92 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 9 I 8.01 3.67 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.89 0.89 0.00 0.00 10 V 8.14 3.69 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 1.06 0.00 0.00 0.91 0.00 0.00 11 G 8.31 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 12 K 8.06 4.02 0.00 2.06 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.56 7.81 13 M 8.12 4.08 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.56 0.00 14 I 8.15 3.70 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 1.47 0.77 0.96 0.00 0.00 15 A 8.22 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.13 3.95 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 17 I 7.90 3.69 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.84 0.97 0.00 0.00 18 N 8.55 4.40 0.00 2.86 2.85 0.00 0.00 6.96 8.84 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 19 A 8.36 4.01 1.38 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 0.00 0.00 0.00 20 V 7.77 3.55 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.02 0.00 0.00 21 I 7.76 3.66 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.56 0.82 0.00 0.00 22 K 7.83 3.86 0.00 1.95 1.92 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.42 7.81 23 D 7.91 4.33 0.00 2.72 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 24 E 8.33 4.29 0.00 2.05 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 2.29 2.48 0.00 25 K 7.65 3.77 0.00 1.83 1.83 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.43 7.81 26 V 7.86 3.79 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 0.84 0.00 0.00 0.92 0.00 0.00 27 S 8.89 4.62 0.00 4.14 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 28 Y 8.43 4.20 0.00 3.10 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 29 S 8.19 4.21 0.00 3.92 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 30 E 8.27 3.97 0.00 2.22 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 31 Y 8.27 4.18 0.00 3.05 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 32 K 8.63 3.84 0.00 2.14 1.97 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.49 7.81 33 A 8.25 4.04 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.27 4.12 0.00 4.02 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 35 T 8.08 3.87 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 1.11 0.00 0.00 36 G 8.09 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 0.00 0.00 0.00 37 W 8.46 4.03 0.00 3.38 3.30 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 38 L 8.38 3.68 0.00 1.96 1.87 1.10 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 39 I 7.80 3.72 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.04 0.88 0.00 0.00 40 S 7.79 3.99 0.00 3.86 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 41 V 7.03 2.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 -1.12 0.00 0.00 42 G 7.51 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 0.00 0.00 0.00 43 E 7.94 4.03 0.00 2.00 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 2.32 2.48 0.00 44 K 7.95 4.25 0.00 1.53 1.74 0.00 1.78 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.51 7.81 45 N 7.85 4.21 0.00 2.85 2.89 0.00 0.00 6.81 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.01 4.56 0.00 1.68 1.78 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 2.23 2.40 0.00 47 W 7.91 4.36 0.00 3.48 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 P 0.00 4.37 0.00 2.21 2.16 0.00 3.72 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 2.20 2.26 0.00 49 L 7.97 3.87 0.00 1.80 1.89 0.93 0.99 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 50 F 8.71 4.41 0.00 3.10 3.18 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 51 L 8.56 4.29 0.00 1.99 1.94 1.15 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.31 4.61 0.00 2.66 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 53 V 7.79 3.43 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.83 0.00 0.00 54 F 7.24 4.36 0.00 1.88 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.34 4.83 0.00 3.17 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 56 E 8.41 4.01 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 2.51 2.55 0.00 99 S 8.49 4.29 0.00 3.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.46 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 0.00 101 D 8.58 4.84 0.00 2.76 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 T 8.74 4.51 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 103 L 9.20 5.36 0.00 1.88 1.67 1.17 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 104 I 9.45 4.95 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.75 1.02 0.00 0.00 105 F 9.59 5.13 0.00 3.37 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 R 8.77 4.96 0.00 1.63 1.72 0.00 3.10 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 107 G 8.37 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 0.00 108 E 8.72 5.34 0.00 2.04 1.61 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 2.19 2.14 0.00 109 V 9.18 5.16 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 0.91 0.00 0.00 0.92 0.00 0.00 110 V 8.74 4.99 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 0.79 0.00 0.00 0.95 0.00 0.00 111 D 8.59 5.29 0.00 3.07 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 8.67 4.11 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 7.11 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 113 E 8.29 4.09 0.00 2.15 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 2.38 0.00 114 G 8.22 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 0.00 115 A 8.17 4.27 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 0.00 116 P 0.00 4.64 0.00 1.96 2.10 0.00 3.64 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 117 L 8.89 4.71 0.00 1.43 1.36 0.38 0.90 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 0.00 118 A 8.58 5.42 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 0.00 119 D 8.22 4.39 0.00 2.79 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 0.00 120 V 8.22 3.81 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.91 0.00 0.00 121 L 8.72 4.96 0.00 1.80 1.50 0.92 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.72 5.14 0.00 1.48 1.63 0.54 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 123 D 9.24 5.28 0.00 2.89 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 M 9.21 5.09 0.00 1.58 1.11 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.94 0.00 125 W 8.73 6.13 0.00 3.54 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 0.00 126 Q 8.64 4.81 0.00 1.77 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 7.06 0.00 0.00 0.00 0.00 0.00 2.23 1.90 0.00 127 A 7.65 3.59 0.65 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 0.00 0.00 128 D 8.25 3.88 0.00 3.11 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 0.00 129 A 8.48 3.92 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 0.00 130 A 8.21 4.51 1.31 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 0.00 0.00 131 G 8.11 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 E 8.65 4.93 0.00 2.08 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 133 Y 8.18 4.98 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.57 4.33 0.00 3.66 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 0.00 135 F 8.35 4.11 0.00 3.15 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 0.00 136 I 7.89 3.57 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 -0.36 0.36 0.00 0.00 137 N 8.35 4.68 0.00 2.83 2.83 0.00 0.00 7.05 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 0.00 138 P 0.00 4.42 0.00 2.17 2.11 0.00 3.78 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 139 T 8.13 4.21 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 1.21 0.00 0.00 140 L 7.43 4.28 0.00 1.78 1.56 0.92 1.14 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 0.00 141 P 0.00 4.23 0.00 2.09 1.90 0.00 3.55 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 142 D 8.14 3.44 0.00 2.44 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 0.00 0.00 0.00 143 Y 7.77 3.90 0.00 3.25 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 0.00 144 L 7.52 3.98 0.00 1.72 1.65 0.79 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 145 F 8.70 4.02 0.00 3.44 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 0.00 146 R 7.86 5.18 0.00 1.96 1.94 0.00 3.52 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.03 0.00 147 G 8.67 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 0.00 0.00 0.00 148 K 9.06 5.30 0.00 1.65 1.60 0.00 1.57 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.41 7.81 149 I 8.58 4.50 0.56 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.33 0.05 0.00 0.00 150 R 8.10 5.88 0.00 1.83 1.89 0.00 3.31 0.00 0.00 3.13 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 151 T 8.47 4.69 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 1.47 0.00 0.00 152 D 9.45 4.64 0.00 3.02 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 0.00 153 E 8.71 4.02 0.00 2.35 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 0.00 2.28 1.91 0.00 154 N 8.31 4.73 0.00 2.87 2.85 0.00 0.00 7.05 8.68 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 0.00 155 G 8.09 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 0.00 156 R 7.29 5.34 0.00 1.96 1.81 0.00 3.15 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.78 0.00 157 F 8.43 5.41 0.00 3.46 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 0.00 158 T 8.96 5.39 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 159 L 9.72 5.26 0.00 2.13 2.04 1.05 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 160 R 9.17 5.12 0.00 2.03 1.87 0.00 3.18 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 161 T 9.09 4.90 4.42 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 1.40 0.00 0.00 162 I 8.64 5.14 2.02 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.10 1.07 0.00 0.00 163 V 8.52 3.75 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 0.11 0.00 0.00 0.71 0.00 0.00 164 P 0.00 4.39 0.00 1.99 1.89 0.00 3.89 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 2.16 2.12 0.00 165 A 8.28 4.49 1.38 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 0.00 0.00 0.00 166 P 0.00 4.75 0.00 2.33 2.67 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 167 Y 9.09 4.77 0.00 3.23 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 0.00 168 E 7.39 3.95 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.47 0.00 169 I 7.93 3.71 1.78 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.96 0.00 0.00 170 P 0.00 4.11 0.00 2.19 2.08 0.00 3.69 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.11 0.00 171 K 8.58 4.08 0.00 2.00 2.00 0.00 1.61 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 0.99 7.81 172 N 8.12 4.74 0.00 2.84 2.93 0.00 0.00 5.75 7.00 0.00 0.00 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 G 7.89 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 0.00 174 P 0.00 4.35 0.00 1.46 1.74 0.00 3.94 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 1.65 1.69 0.00 175 T 8.74 4.37 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 176 G 8.44 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 0.00 177 A 8.53 4.06 1.49 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 0.00 178 L 8.41 3.65 0.00 1.84 2.05 0.98 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 179 L 8.19 4.14 0.00 2.02 2.02 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 180 A 8.11 3.93 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 0.00 181 A 8.07 3.86 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 0.00 182 A 7.73 3.79 -0.32 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 0.00 183 G 7.55 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 0.00 184 W 7.98 5.13 0.00 3.44 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 0.00 185 H 8.85 4.54 0.00 3.39 3.49 0.00 5.50 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 A 8.44 4.61 1.03 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 0.00 0.00 187 W 8.01 4.70 0.00 1.78 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 0.00 188 R 9.32 5.33 0.00 2.02 2.02 0.00 3.14 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 189 P 0.00 5.31 0.00 2.36 2.33 0.00 4.07 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.94 0.00 190 A 8.87 4.54 1.61 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 0.00 191 H 8.47 4.66 0.00 2.54 3.07 0.00 5.49 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 0.00 192 L 8.23 4.38 0.00 1.60 1.13 1.17 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 193 H 8.20 4.55 0.00 1.40 1.31 0.00 5.56 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 0.00 194 W 8.86 5.52 0.00 3.11 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 0.00 195 I 9.10 5.02 1.87 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.07 0.83 0.00 0.00 196 I 9.09 5.03 1.77 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.58 0.74 0.00 0.00 197 A 9.05 5.00 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 0.00 0.00 198 K 8.44 4.63 0.00 1.75 1.58 0.00 1.75 0.00 0.00 1.34 0.00 0.00 2.75 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.44 7.81 199 E 9.06 4.08 0.00 2.01 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 2.33 2.35 0.00 200 G 9.33 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 0.00 201 Y 7.78 5.02 0.00 3.05 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 0.00 202 E 8.77 4.30 0.00 1.91 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 2.36 2.31 0.00 203 S 8.79 4.57 0.00 3.76 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 0.00 204 L 9.15 4.78 0.00 1.66 1.49 1.10 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 205 T 8.47 5.16 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 0.00 206 T 9.00 5.10 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 1.39 0.00 0.00 207 Q 8.49 4.93 0.00 1.65 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.45 0.00 0.00 0.00 0.00 0.00 1.92 2.35 0.00 208 L 8.51 4.57 0.00 1.65 1.32 0.07 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 209 Y 8.70 4.90 0.00 2.78 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 0.00 210 F 8.46 5.29 0.00 3.07 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 0.00 211 E 9.25 4.08 0.00 2.15 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 2.47 2.33 0.00 212 N 9.03 4.25 0.00 2.90 2.94 0.00 0.00 6.96 7.65 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 0.00 213 G 8.15 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 0.00 214 Q 8.44 3.74 0.00 1.78 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.02 0.00 0.00 0.00 0.00 0.00 1.16 1.70 0.00 215 W 8.18 3.92 0.00 3.79 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 0.00 216 T 7.97 4.02 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 1.34 0.00 0.00 217 G 7.97 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 0.00 0.00 0.00 218 S 8.35 4.64 0.00 3.89 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 D 8.41 4.48 0.00 2.75 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 V 8.29 3.38 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 0.67 0.00 0.00 0.79 0.00 0.00 221 A 8.12 4.60 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 0.00 222 N 8.01 4.00 0.00 2.32 2.54 0.00 0.00 6.69 6.89 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 0.00 223 A 8.52 4.68 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 0.00 224 V 7.31 3.59 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 0.42 0.00 0.00 0.72 0.00 0.00 225 K 8.09 4.72 0.00 1.84 1.88 0.00 1.86 0.00 0.00 1.91 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.43 1.43 7.81 226 P 0.00 4.30 0.00 2.22 2.30 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.99 0.00 227 E 8.24 4.23 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 228 L 7.99 4.69 0.00 1.97 1.88 1.12 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 229 L 7.53 5.02 0.00 1.68 1.64 0.92 0.96 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 0.00 230 L 8.65 4.81 0.00 1.80 1.68 0.90 0.49 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 0.00 231 S 8.52 5.36 0.00 3.89 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 0.00 232 L 8.47 4.87 0.00 1.51 1.70 1.16 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 233 D 9.14 4.60 0.00 2.67 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 *234 K 8.79 4.76 0.00 1.76 1.66 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.28 0.98 7.81 *235 I 7.51 4.31 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 1.27 1.23 0.91 0.00 0.00 *241 P 0.00 4.51 0.00 1.83 1.89 0.00 3.60 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.08 0.00 242 H 7.67 4.78 0.00 3.07 3.22 0.00 5.45 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 0.00 243 F 9.35 5.27 0.00 3.17 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 0.00 244 E 9.42 5.45 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.27 0.00 245 T 8.75 4.82 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 1.22 0.00 0.00 246 S 8.03 5.05 0.00 3.71 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 0.00 247 Y 7.70 4.43 0.00 2.74 2.36 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 0.00 248 K 7.07 4.68 0.00 1.49 1.25 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.55 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.12 1.30 7.81 249 F 9.32 4.85 0.00 3.05 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 0.00 250 T 9.14 5.69 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 251 L 8.63 5.00 0.00 1.54 1.66 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 252 G 8.53 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 K 8.73 4.10 0.00 1.93 1.58 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.47 1.25 7.81 254 V 8.05 3.63 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 0.63 0.00 0.00 0.87 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.