NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2675 8.1685 120.0358 56.2728 33.9286 173.9836 4 A 4.7815 8.6019 127.1589 48.7641 22.7381 172.7789 5 K 4.8453 8.6812 121.9703 54.6138 35.6150 173.2387 6 V 4.2885 8.8784 128.9581 61.4524 32.3246 176.8945 7 I 3.7563 8.3229 121.9185 63.1515 38.5159 176.5877 8 D 4.6698 7.5018 121.4538 52.2352 38.5886 175.8795 9 A 4.1853 8.1621 126.6569 54.7469 18.5714 179.6223 10 V 3.7270 7.8711 115.9259 66.0356 32.0292 177.9662 11 S 4.4510 8.5104 114.0553 61.6220 62.9608 176.0058 12 F 4.1937 8.3056 124.8387 61.0396 39.1606 176.7341 13 S 4.1805 8.8397 112.9267 61.9087 62.0396 175.7130 14 Y 4.0422 8.3481 118.9116 60.1071 37.8732 177.8602 15 I 3.6950 7.6065 120.5045 64.5595 37.4922 178.2477 16 L 4.1281 7.5125 118.7875 57.0288 41.1659 179.2387 17 R 3.9834 7.2008 116.8521 59.1150 29.8117 178.1187 18 T 4.0250 7.9164 115.8512 66.2150 68.4141 177.0069 19 V 4.0535 7.9632 120.0810 66.1234 31.4575 178.3248 20 G 4.0791 7.8277 103.5003 47.3416 0.0000 174.9430 21 D 4.3022 7.4938 119.1065 56.1934 40.6951 176.9123 22 F 4.8056 7.7808 115.5791 58.6868 40.7750 175.6592 23 L 4.6494 8.3603 121.2361 53.3408 43.0892 177.7414 24 S 4.2991 8.5352 117.4306 60.6357 64.5624 173.8755 25 E 4.8550 7.8132 116.9210 54.5854 33.7471 174.8310 26 A 4.3987 7.4307 122.8689 50.9655 23.3005 173.9672 27 N 5.5104 8.3327 113.4139 51.5061 42.0393 174.8829 28 F 4.4637 9.1691 123.5392 58.2428 40.2978 174.8148 29 I 4.5980 9.1103 126.9683 60.0170 37.5192 174.2346 30 V 4.6274 9.2696 128.0928 61.9998 32.4646 174.6293 31 T 5.0203 8.8271 118.2463 59.5889 71.9614 175.3028 32 K 4.1296 8.8642 123.6469 59.6662 32.5006 176.9134 33 E 4.3367 9.0349 114.3009 56.4471 30.3010 176.2519 34 G 3.6201 7.3792 107.3964 43.8287 0.0000 171.4419 35 I 4.8334 8.1945 121.7957 59.8202 38.9162 175.1974 36 R 5.2311 9.0502 128.2724 54.6162 32.3632 174.6500 37 V 5.0508 9.1998 127.0679 61.2089 33.8946 174.4098 38 S 5.2831 8.7455 121.4169 56.6180 66.4910 173.2159 39 G 4.0418 7.6345 107.9298 47.0152 0.0000 171.5403 40 I 4.8804 7.8042 120.3591 58.4776 40.5640 175.0809 41 D 4.6999 8.5874 128.2341 52.3170 40.1899 175.4994 42 P 4.2166 0.0000 0.0000 65.7845 29.9877 178.0092 43 S 4.3249 8.4122 110.7328 58.6033 63.3800 174.5086 44 R 3.9690 7.9271 119.3727 57.5656 28.1608 177.0078 45 V 4.0728 7.4109 117.8720 63.3747 33.9142 175.4071 46 V 4.6549 8.3944 121.1939 60.8316 33.8288 174.3248 47 F 5.1357 9.6171 130.7726 56.3066 41.6588 173.8700 48 L 5.0166 8.6895 126.5861 54.2156 43.4867 175.5566 49 D 4.7117 9.0880 121.3543 53.5321 44.1029 173.4481 50 I 4.9125 9.3872 128.2227 59.5703 39.9008 174.8082 51 F 5.0878 8.9721 128.8232 56.3973 42.2730 173.6016 52 L 3.8306 8.4011 127.5802 52.0434 43.1233 174.9770 53 P 4.1748 0.0000 0.0000 61.3948 32.4289 177.7500 54 S 3.4454 8.3109 114.5710 61.7862 62.0696 177.1385 55 S 4.2200 7.9105 113.4864 61.1166 62.8629 175.0502 56 Y 3.9537 7.6269 121.2546 59.5922 38.6313 175.8343 57 F 4.4733 7.4904 118.7089 55.6587 40.0834 175.0509 58 E 3.9977 8.4465 127.0649 56.6008 28.7107 173.7489 59 G 3.5785 8.8247 118.9581 45.1218 0.0000 168.9685 60 F 5.0120 8.3888 125.0805 56.5140 41.4619 173.6489 61 E 4.5054 8.5064 126.0958 54.4329 32.1424 176.0002 62 V 4.1705 7.9809 116.8395 59.7659 33.0564 176.3237 63 S 4.3298 8.6181 118.5346 59.6959 63.7705 173.4519 64 Q 4.5684 7.4497 116.8610 54.6216 31.3046 174.1527 65 E 4.0165 8.7691 117.5803 59.0780 29.4741 177.6927 66 K 4.5834 7.7268 120.0815 55.2831 34.7207 174.7015 67 E 4.5927 9.2593 129.9838 54.7382 31.6077 174.5612 68 I 4.8716 8.4790 127.7483 60.0602 38.9829 175.4512 69 I 4.3976 9.0226 130.5680 59.4072 38.4853 175.5732 70 G 4.6425 8.9347 115.3679 45.6150 0.0000 171.0159 71 F 5.0777 8.2603 116.3090 55.4183 41.9133 173.3248 72 K 4.3914 8.7014 123.2197 55.9389 32.9190 177.8134 73 L 4.2381 9.0232 127.2735 57.4255 41.4589 179.2478 74 E 3.8917 8.1059 119.2283 59.4333 29.6089 178.2045 75 D 4.4278 8.1356 118.3335 57.6229 40.9538 179.0866 76 V 3.7322 8.1533 118.5768 66.0738 31.5363 177.8706 77 N 4.4759 8.4374 116.2148 55.9749 38.0993 177.1560 78 D 4.3658 8.4375 120.6904 57.3160 41.2483 178.4422 79 I 3.6583 7.6171 113.2108 63.3935 37.8999 178.1022 80 L 4.3899 7.9513 120.7792 57.1815 41.2916 178.8809 81 K 4.1441 8.2679 117.6390 58.1065 31.9260 177.5625 82 R 4.2050 7.0902 117.5615 55.6282 30.1832 176.8248 83 V 2.8321 7.0137 118.2565 62.5139 32.0362 175.2594 84 L 4.7124 8.1817 125.3140 52.3759 44.2145 177.5619 85 K 3.9234 8.5298 122.6450 59.5194 32.1853 177.0224 86 D 4.6881 7.8493 115.9596 55.2117 41.5728 176.2820 87 D 4.9308 7.7186 118.9153 53.6131 41.0566 175.3960 88 T 4.8462 8.7326 109.2558 59.8643 71.9693 173.2644 89 L 4.5165 8.5814 126.3770 54.0565 43.1958 175.4574 90 I 4.5369 8.7645 131.1748 59.8667 36.3201 173.4247 91 L 4.5874 8.4959 124.6567 54.9454 41.6265 176.8705 92 S 5.0927 8.3607 119.1381 56.6317 66.5109 172.8029 93 S 4.9993 8.1004 111.6919 57.8647 64.6963 175.4524 94 N 4.9994 8.2742 121.1014 52.5879 38.0286 175.1800 95 E 4.4688 8.7659 117.2819 56.8914 30.6687 176.1248 96 S 4.6939 8.3496 115.2543 59.8528 65.4216 174.0456 97 K 4.9268 9.7092 119.3804 54.3116 36.0090 175.2983 98 L 4.3065 9.5866 128.7057 54.9471 43.1864 175.5430 99 T 4.8269 8.9806 123.7057 60.6586 68.8418 173.0990 100 L 4.6671 9.0148 130.8516 53.6707 43.5641 175.9422 101 T 4.9204 7.9795 121.2589 61.7315 71.1643 173.4190 102 F 5.0934 9.5765 127.3338 56.7457 40.9411 174.8671 103 D 4.5403 8.5630 123.0045 53.5552 43.5660 173.7862 104 G 4.3796 8.7455 118.7581 46.6900 0.0000 173.4278 105 E 4.1714 8.4378 121.6894 58.4233 30.4565 176.7956 106 F 4.8230 7.3324 111.1567 56.2576 40.3897 172.1013 107 T 4.5627 8.5923 117.7230 62.9895 69.3156 175.2915 108 R 4.6169 9.5741 125.6481 54.7642 33.8549 173.9866 109 S 5.2580 8.6578 118.9872 56.5186 65.4611 173.5728 110 F 4.6395 9.6585 122.7818 55.6589 41.5046 173.8062 111 E 4.6504 8.8493 125.6470 55.1375 30.7541 175.2527 112 L 4.7075 8.9134 128.6284 52.4883 44.8829 173.5580 113 P 4.8771 0.0000 0.0000 62.8504 31.8472 176.7453 114 L 4.8427 9.0044 123.9796 54.3801 42.7162 176.3940 115 I 4.7218 7.9824 112.7795 58.9416 41.5197 174.6591 116 Q 3.9516 8.8702 122.7780 56.5382 28.2269 175.8111 117 V 4.3259 8.0056 123.0918 60.0382 33.6261 175.1748 118 E 3.8047 8.7605 124.3663 57.1574 29.4208 177.2376 119 S 4.3983 8.4710 119.6256 57.4554 62.1141 173.3666 120 T 4.0736 8.1215 116.8502 60.6770 69.4360 174.2049 121 Q 4.3220 8.5751 124.7721 54.8130 29.1833 174.2422 122 P 4.7369 0.0000 0.0000 61.5874 32.4131 175.5861 123 P 4.2627 0.0000 0.0000 62.5861 29.1483 176.3461 124 S 4.4894 8.0633 117.5801 59.0088 63.4008 174.8850 125 V 4.3155 6.9996 113.2566 59.6613 33.6634 174.7479 126 N 4.7829 8.4434 121.4428 51.1605 39.0434 174.2064 127 L 4.4217 8.0437 120.1773 52.8917 44.0902 175.6325 128 E 4.2714 8.0940 121.1955 54.8116 30.5227 175.4960 129 F 4.8845 8.5124 123.0624 55.2020 40.9257 173.9540 130 P 4.6582 0.0000 0.0000 63.8407 32.6854 175.3236 131 F 4.9750 8.3374 123.6396 56.4865 43.0870 172.9990 132 K 4.7422 7.7589 125.5821 54.3656 35.7784 174.6877 133 A 4.7147 8.4450 127.8310 50.3301 22.5194 174.9343 134 Q 4.3543 8.8768 123.0484 55.4318 30.1257 175.2361 135 L 4.9073 8.1150 124.9621 53.2203 45.5217 175.3142 136 L 4.0744 8.6640 125.8268 55.0683 42.4502 177.9625 137 T 3.9685 8.8012 117.8408 65.5697 67.0728 176.4778 138 I 3.8265 7.7604 121.4074 64.5812 37.4311 178.3321 139 T 3.9079 7.9557 110.1444 64.5063 68.5410 176.2589 140 F 4.2761 8.2640 123.2325 61.3165 39.5829 176.8204 141 A 4.0716 8.4018 120.4269 55.6058 18.0383 179.3252 142 D 4.2448 8.3997 117.4859 57.4068 40.8788 178.9045 143 I 4.0642 7.2073 113.2924 63.7567 37.5628 178.0867 144 I 3.3500 7.2560 122.0277 63.8667 36.5922 178.0406 145 D 4.2983 7.4689 117.9319 57.5911 40.8728 178.5881 146 E 4.0827 8.1450 118.8725 59.0252 29.3752 179.1056 147 L 4.1744 8.7159 120.3217 56.7067 41.7674 178.8562 148 S 4.1642 8.2483 112.7160 60.2734 62.8848 174.4803 149 D 4.8411 7.9158 119.7164 54.0822 40.8031 176.5359 150 L 4.6041 7.8426 119.9103 54.1537 43.8080 176.8566 151 G 4.0884 7.2595 106.2054 45.2264 0.0000 173.1820 152 E 3.9387 8.8442 119.7919 57.7949 29.7899 177.0531 153 V 4.3352 7.5064 118.1839 60.8156 33.1660 175.1478 154 L 4.1405 9.0098 132.7115 54.6993 42.9255 175.1712 155 N 4.7824 9.4541 128.1271 52.2864 38.9091 172.0507 156 I 5.1220 8.4470 125.1024 59.5428 40.0852 173.7475 157 H 5.8348 9.3109 124.0205 54.1983 32.4091 172.1695 158 S 5.1676 9.7232 114.6269 56.6808 66.3602 173.3092 159 K 4.5682 8.8497 123.3643 55.3948 34.9939 175.7946 160 E 4.0463 10.3153 130.2684 58.0330 27.3502 174.8927 161 N 4.5536 8.0659 111.4346 53.9855 37.3214 174.3532 162 K 4.8351 7.7621 117.6068 54.8227 34.8927 175.1938 163 L 4.5771 8.8376 125.5937 53.5022 44.6670 174.5279 164 Y 4.8073 9.0757 124.9236 56.3564 40.1513 174.7112 165 F 5.4320 8.5695 123.8462 56.3219 41.0814 174.9227 166 E 5.8065 9.1250 122.4401 53.7334 33.5605 175.2065 167 V 4.5141 8.1329 122.8481 61.0115 32.0363 172.3073 168 I 4.1527 8.1326 122.9442 60.5475 37.5687 175.0675 169 G 4.1169 8.4905 116.8954 43.1446 0.0000 171.6048 170 D 4.3957 8.4456 117.8991 57.5187 41.4888 177.5714 171 L 4.1287 7.8972 118.4643 57.4122 42.0228 176.9452 172 S 4.5538 7.4572 110.1589 57.6962 65.4764 172.0286 173 T 5.0661 8.2670 113.5539 60.3258 70.3349 172.9769 174 A 4.7337 8.5045 129.6298 50.1374 21.2878 175.0224 175 K 5.0311 8.7559 123.7265 54.8823 34.9657 175.4055 176 V 4.3092 8.9693 126.9739 61.0815 34.4730 173.8167 177 E 3.8176 8.8092 129.9245 55.0788 30.2254 175.0525 178 L 4.5380 8.2039 128.6048 53.2397 43.8103 176.1889 179 S 4.9718 8.4145 118.8173 56.5697 67.0372 175.5722 180 T 4.7561 8.7281 110.3911 64.1079 68.8642 176.2165 181 D 4.3646 7.9167 119.5099 54.6530 40.1323 177.1235 182 N 4.2868 7.9040 117.3239 54.6222 38.6767 176.0917 183 G 3.9417 7.8875 104.7512 45.6022 0.0000 173.7511 184 T 4.3835 7.6890 109.6554 61.1161 70.7788 174.2513 185 L 4.6623 7.7621 122.5889 52.7455 43.7860 177.7590 186 L 4.0842 8.7030 124.7323 57.7432 42.1944 177.4289 187 E 4.8114 7.8873 115.4113 55.3287 34.3149 174.5816 188 A 4.7491 8.1765 123.0553 51.1457 22.3359 175.8859 189 S 5.2994 8.0398 116.6512 55.2715 66.8964 174.1927 190 G 4.4268 8.7539 111.5664 45.0485 0.0000 171.3015 191 A 4.1783 8.2086 122.2276 52.0838 19.2221 178.4903 192 D 4.9015 8.4255 119.8612 52.7659 39.2239 176.5838 193 V 4.5764 8.3679 116.0721 59.6562 34.9173 174.9872 194 S 5.2742 8.6848 116.2873 57.3177 66.4273 172.9727 195 S 4.7794 9.6809 118.3562 56.9173 66.2767 172.6235 196 S 5.1697 8.2608 118.2503 56.8161 66.1951 172.3091 197 Y 5.0175 9.0653 118.3307 56.1070 42.6039 175.7383 198 G 4.0364 8.9737 109.3966 46.8594 0.0000 173.2570 *200 E 4.2241 8.7705 118.2471 56.4277 31.1747 177.6697 201 Y 4.5348 7.4511 114.9371 61.3381 38.3832 178.1503 202 V 3.8886 8.0729 118.5340 65.6703 31.6839 177.5047 203 A 3.9174 8.0545 120.2249 55.5491 17.9155 178.9704 204 N 4.1372 8.1123 114.5579 56.8706 38.3832 176.9358 205 T 3.4946 7.5840 111.6738 63.8229 67.4543 175.9065 206 T 4.1700 7.8286 117.2076 66.7528 69.2443 174.0236 207 K 3.8199 7.4314 122.5150 56.8323 33.3123 178.2752 *209 R 4.2432 8.0124 119.5479 56.5497 31.7109 176.0703 210 R 4.1271 7.4977 112.7038 56.4623 30.3995 176.7626 211 A 4.5958 7.8778 120.4451 52.2412 20.7950 176.6692 212 S 4.9622 7.8598 107.7068 56.8000 66.4198 172.9154 213 D 4.7734 8.4929 118.1495 55.7346 43.0616 176.0239 214 S 5.1448 7.6468 112.4190 56.4553 66.0271 172.1287 *216 E 4.0057 8.4840 116.7345 56.1929 31.2316 174.8659 217 L 4.8341 8.1147 124.4432 53.4599 45.0051 174.5674 218 Y 5.2608 9.0346 125.0298 56.1324 40.7904 175.0208 219 F 5.6209 8.5116 118.0536 56.8708 42.2802 172.8164 220 G 3.9906 8.7528 103.9764 45.2097 0.0000 172.8199 221 S 4.4655 8.8360 116.3385 58.2653 63.3334 174.3471 222 Q 3.5747 8.9336 127.5497 56.8613 27.1679 172.6761 223 I 4.9552 7.8343 107.3298 57.9929 40.9378 173.1567 224 P 4.8894 0.0000 0.0000 63.2543 32.9579 175.3081 225 L 4.4372 8.8108 124.7277 53.7675 42.9828 175.1953 226 K 4.3055 9.1390 130.4019 55.3376 33.9161 175.2630 227 L 4.4799 8.3273 127.4670 53.0408 44.0365 175.7479 228 R 4.2514 8.5656 126.7597 54.8421 30.9193 176.1340 229 F 4.4834 9.1669 127.6901 55.7685 39.8189 174.9502 230 K 4.1538 8.5428 123.9179 56.8486 31.9445 176.8006 231 L 4.6015 8.5065 125.3130 53.1517 43.2309 175.3869 232 P 4.2352 0.0000 0.0000 63.8724 32.3299 176.1843 233 Q 3.3800 9.1614 116.8141 57.6722 25.6135 173.7773 234 E 3.8723 8.2893 109.8068 57.2851 27.5035 175.6821 235 G 3.9932 7.6098 106.3955 46.4556 0.0000 172.8156 236 Y 5.2207 8.3876 117.4563 55.4788 42.0329 174.3696 237 G 4.5852 9.2206 108.8082 44.9240 0.0000 171.2053 238 D 5.2735 9.4846 127.6164 52.9100 43.2687 176.4967 239 F 5.0616 8.5764 120.2808 56.1605 42.0389 172.1223 240 Y 4.7639 9.6517 122.4285 57.1935 39.3300 174.4280 241 I 4.9292 8.7077 118.7475 58.5847 39.9937 175.2190 242 A 4.6217 9.2463 129.9894 51.5973 19.1510 175.5095 243 P 4.7820 0.0000 0.0000 62.2520 33.7823 174.9772 244 R 4.4994 7.7965 118.2041 54.1638 31.5350 176.6257 245 A 4.1809 8.8270 124.4460 52.8183 18.2052 177.0113 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 3 K 8.17 4.27 0.00 1.54 1.71 0.00 1.55 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.33 7.81 4 A 8.60 4.78 0.62 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 0.00 0.00 5 K 8.68 4.85 0.00 1.81 1.95 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.29 7.81 6 V 8.88 4.29 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 0.80 0.00 0.00 0.59 0.00 0.00 7 I 8.32 3.76 1.81 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.88 0.93 0.00 0.00 8 D 7.50 4.67 0.00 2.68 2.57 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 9 A 8.16 4.19 1.64 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 0.00 0.00 10 V 7.87 3.73 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 1.06 0.00 0.00 1.02 0.00 0.00 11 S 8.51 4.45 0.00 4.33 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 12 F 8.31 4.19 0.00 3.40 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 13 S 8.84 4.18 0.00 4.09 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 8.35 4.04 0.00 3.25 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 15 I 7.61 3.70 1.76 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.95 0.88 0.00 0.00 16 L 7.51 4.13 0.00 1.48 1.88 0.62 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.20 3.98 0.00 1.84 1.71 0.00 3.09 0.00 0.00 2.97 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 18 T 7.92 4.03 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 1.10 0.00 0.00 19 V 7.96 4.05 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 1.01 0.00 0.00 1.12 0.00 0.00 20 G 7.83 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 21 D 7.49 4.30 0.00 2.46 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 0.00 0.00 0.00 22 F 7.78 4.81 0.00 3.13 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 23 L 8.36 4.65 0.00 1.61 1.63 0.86 0.93 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 24 S 8.54 4.30 0.00 3.86 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 25 E 7.81 4.86 0.00 1.66 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 2.09 2.20 0.00 26 A 7.43 4.40 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.33 5.51 0.00 2.59 2.78 0.00 0.00 6.83 7.45 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 28 F 9.17 4.46 0.00 3.15 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 29 I 9.11 4.60 2.14 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.14 1.02 0.00 0.00 30 V 9.27 4.63 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 1.10 0.00 0.00 0.99 0.00 0.00 31 T 8.83 5.02 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 1.40 0.00 0.00 32 K 8.86 4.13 0.00 1.81 2.00 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.56 7.81 33 E 9.03 4.34 0.00 2.39 2.29 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 2.46 2.51 0.00 34 G 7.38 3.62 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 0.00 0.00 0.00 35 I 8.19 4.83 2.02 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.59 1.13 0.00 0.00 36 R 9.05 5.23 0.00 2.34 2.00 0.00 3.39 0.00 0.00 3.46 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.76 0.00 37 V 9.20 5.05 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 1.00 0.00 0.00 1.20 0.00 0.00 38 S 8.75 5.28 0.00 4.08 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 39 G 7.63 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 40 I 7.80 4.88 1.24 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.10 0.69 0.00 0.00 41 D 8.59 4.70 0.00 3.11 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 42 P 0.00 4.22 0.00 2.11 2.19 0.00 3.78 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 43 S 8.41 4.32 0.00 4.15 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 0.00 44 R 7.93 3.97 0.00 1.96 2.03 0.00 3.25 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 45 V 7.41 4.07 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.98 0.00 0.00 46 V 8.39 4.65 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 0.18 0.00 0.00 0.58 0.00 0.00 47 F 9.62 5.14 0.00 3.08 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.69 5.02 0.00 1.20 1.38 0.90 0.79 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 49 D 9.09 4.71 0.00 2.94 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 9.39 4.91 1.92 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 1.16 0.38 0.90 0.00 0.00 51 F 8.97 5.09 0.00 2.38 1.45 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 0.00 52 L 8.40 3.83 0.00 1.52 0.90 1.24 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.17 0.00 2.06 1.93 0.00 3.33 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.84 0.00 54 S 8.31 3.45 0.00 3.86 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 55 S 7.91 4.22 0.00 3.90 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 56 Y 7.63 3.95 0.00 2.62 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 57 F 7.49 4.47 0.00 3.03 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.45 4.00 0.00 1.87 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 2.31 2.23 0.00 59 G 8.82 3.58 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 0.00 0.00 0.00 60 F 8.39 5.01 0.00 3.01 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 61 E 8.51 4.51 0.00 1.60 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 2.12 2.13 0.00 62 V 7.98 4.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 0.85 0.00 0.00 63 S 8.62 4.33 0.00 3.92 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 64 Q 7.45 4.57 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 7.09 0.00 0.00 0.00 0.00 0.00 2.21 2.38 0.00 65 E 8.77 4.02 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.31 0.00 66 K 7.73 4.58 0.00 1.75 1.69 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.50 7.81 67 E 9.26 4.59 0.00 2.08 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 68 I 8.48 4.87 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.81 0.97 0.00 0.00 69 I 9.02 4.40 2.25 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 1.25 0.89 1.13 0.00 0.00 70 G 8.93 4.64 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 0.00 0.00 0.00 71 F 8.26 5.08 0.00 3.23 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 72 K 8.70 4.39 0.00 1.82 1.88 0.00 1.72 0.00 0.00 2.20 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.50 1.42 7.81 73 L 9.02 4.24 0.00 1.79 1.71 0.73 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 74 E 8.11 3.89 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 75 D 8.14 4.43 0.00 2.96 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.15 3.73 2.57 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 1.17 0.00 0.00 1.02 0.00 0.00 77 N 8.44 4.48 0.00 2.95 2.82 0.00 0.00 7.01 7.81 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 78 D 8.44 4.37 0.00 2.87 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 79 I 7.62 3.66 1.19 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.70 1.05 0.00 0.00 80 L 7.95 4.39 0.00 1.97 1.82 1.07 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.27 4.14 0.00 1.83 1.80 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.62 7.81 82 R 7.09 4.21 0.00 1.52 1.70 0.00 3.27 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.45 0.00 83 V 7.01 2.83 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 0.81 0.00 0.00 1.10 0.00 0.00 84 L 8.18 4.71 0.00 1.83 1.47 0.85 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.53 3.92 0.00 1.71 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.52 7.81 86 D 7.85 4.69 0.00 2.70 2.70 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 87 D 7.72 4.93 0.00 2.95 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 88 T 8.73 4.85 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 1.28 0.00 0.00 89 L 8.58 4.52 0.00 1.76 1.41 0.83 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.76 4.54 1.78 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 1.23 0.49 0.83 0.00 0.00 91 L 8.50 4.59 0.00 1.51 1.58 0.45 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 92 S 8.36 5.09 0.00 3.78 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 93 S 8.10 5.00 0.00 3.83 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 94 N 8.27 5.00 0.00 2.76 2.78 0.00 0.00 6.88 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 95 E 8.77 4.47 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 96 S 8.35 4.69 0.00 3.88 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 97 K 9.71 4.93 0.00 1.50 1.67 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.37 7.81 98 L 9.59 4.31 0.00 1.79 1.82 0.85 -0.45 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 99 T 8.98 4.83 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 0.00 100 L 9.01 4.67 0.00 1.53 1.23 0.98 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 101 T 7.98 4.92 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 1.23 0.00 0.00 102 F 9.58 5.09 0.00 3.00 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 0.00 103 D 8.56 4.54 0.00 2.73 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 0.00 104 G 8.75 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 0.00 0.00 0.00 0.00 105 E 8.44 4.17 0.00 2.06 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 106 F 7.33 4.82 0.00 3.26 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 T 8.59 4.56 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 1.24 0.00 0.00 108 R 9.57 4.62 0.00 1.85 2.08 0.00 3.18 0.00 0.00 2.94 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.09 0.00 109 S 8.66 5.26 0.00 3.83 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 0.00 110 F 9.66 4.64 0.00 3.07 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 0.00 111 E 8.85 4.65 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 112 L 8.91 4.71 0.00 1.83 1.65 1.03 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.88 0.00 2.02 2.01 0.00 3.79 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 2.07 2.16 0.00 114 L 9.00 4.84 0.00 1.55 1.66 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 115 I 7.98 4.72 1.88 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 1.39 0.76 0.94 0.00 0.00 116 Q 8.87 3.95 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.73 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 117 V 8.01 4.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.90 0.00 0.00 118 E 8.76 3.80 0.00 2.08 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 119 S 8.47 4.40 0.00 3.88 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 0.00 120 T 8.12 4.07 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 121 Q 8.58 4.32 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.07 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 122 P 0.00 4.74 0.00 2.12 2.15 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 123 P 0.00 4.26 0.00 1.69 1.03 0.00 3.72 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.35 0.00 124 S 8.06 4.49 0.00 3.96 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 0.00 125 V 7.00 4.32 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 0.67 0.00 0.00 0.74 0.00 0.00 126 N 8.44 4.78 0.00 2.72 2.71 0.00 0.00 6.05 7.79 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 0.00 127 L 8.04 4.42 0.00 1.24 0.83 0.83 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.09 4.27 0.00 1.80 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 0.00 2.13 2.18 0.00 129 F 8.51 4.88 0.00 3.21 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.66 0.00 2.13 2.30 0.00 3.88 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 131 F 8.34 4.98 0.00 2.90 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 0.00 132 K 7.76 4.74 0.00 1.74 1.29 0.00 1.65 0.00 0.00 1.50 0.00 0.00 2.65 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.82 0.34 7.81 133 A 8.45 4.71 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 0.00 134 Q 8.88 4.35 0.00 1.91 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.67 0.00 0.00 0.00 0.00 0.00 2.23 2.12 0.00 135 L 8.11 4.91 0.00 1.56 1.42 1.05 1.09 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 0.00 136 L 8.66 4.07 0.00 1.77 1.62 0.93 0.65 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 0.00 137 T 8.80 3.97 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 1.36 0.00 0.00 138 I 7.76 3.83 1.91 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 1.71 0.34 0.93 0.00 0.00 139 T 7.96 3.91 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 140 F 8.26 4.28 0.00 3.18 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 0.00 141 A 8.40 4.07 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 D 8.40 4.24 0.00 2.93 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 0.00 143 I 7.21 4.06 1.90 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 1.60 1.92 0.94 0.00 0.00 144 I 7.26 3.35 1.18 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.73 0.00 0.00 145 D 7.47 4.30 0.00 2.86 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 0.00 146 E 8.15 4.08 0.00 2.19 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 2.31 2.35 0.00 147 L 8.72 4.17 0.00 1.47 1.64 0.90 0.75 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 0.00 148 S 8.25 4.16 0.00 3.88 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 0.00 149 D 7.92 4.84 0.00 2.62 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 0.00 150 L 7.84 4.60 0.00 1.66 1.66 0.97 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 151 G 7.26 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 E 8.84 3.94 0.00 1.96 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 2.27 2.27 0.00 153 V 7.51 4.34 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 0.78 0.00 0.00 0.94 0.00 0.00 154 L 9.01 4.14 0.00 1.76 1.70 0.61 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 155 N 9.45 4.78 0.00 2.78 2.81 0.00 0.00 6.42 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 0.00 156 I 8.45 5.12 2.20 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.86 1.14 0.00 0.00 157 H 9.31 5.83 0.00 3.41 3.39 0.00 5.26 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 S 9.72 5.17 0.00 3.32 3.05 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 0.00 159 K 8.85 4.57 0.00 1.82 1.74 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.42 7.81 160 E 10.32 4.05 0.00 2.17 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 2.29 2.30 0.00 161 N 8.07 4.55 0.00 2.98 3.18 0.00 0.00 6.90 6.96 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 0.00 162 K 7.76 4.84 0.00 1.96 1.40 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.63 7.81 163 L 8.84 4.58 0.00 1.55 1.11 0.82 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 164 Y 9.08 4.81 0.00 2.62 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 0.00 165 F 8.57 5.43 0.00 2.97 2.81 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 0.00 166 E 9.13 5.81 0.00 2.14 1.84 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 2.32 2.22 0.00 167 V 8.13 4.51 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.92 0.00 0.00 168 I 8.13 4.15 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.67 0.91 0.00 0.00 169 G 8.49 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 0.00 0.00 0.00 170 D 8.45 4.40 0.00 2.63 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 0.00 171 L 7.90 4.13 0.00 1.67 1.71 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 172 S 7.46 4.55 0.00 3.95 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 0.00 173 T 8.27 5.07 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 1.22 0.00 0.00 174 A 8.50 4.73 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 0.00 175 K 8.76 5.03 0.00 1.80 1.75 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.48 7.81 176 V 8.97 4.31 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 0.86 0.00 0.00 0.98 0.00 0.00 177 E 8.81 3.82 0.00 1.88 1.71 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 1.88 1.47 0.00 178 L 8.20 4.54 0.00 1.40 1.38 0.57 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 179 S 8.41 4.97 0.00 3.90 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 0.00 180 T 8.73 4.76 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 1.19 0.00 0.00 181 D 7.92 4.36 0.00 2.80 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 0.00 182 N 7.90 4.29 0.00 2.80 2.87 0.00 0.00 7.11 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 0.00 183 G 7.89 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 0.00 184 T 7.69 4.38 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 1.18 0.00 0.00 185 L 7.76 4.66 0.00 1.74 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.41 0.00 0.00 194 S 8.68 5.27 0.00 3.94 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 0.00 195 S 9.68 4.78 0.00 4.10 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 0.00 196 S 8.26 5.17 0.00 3.84 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 0.00 197 Y 9.07 5.02 0.00 2.98 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 0.00 198 G 8.97 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 *200 E 8.77 4.22 0.00 1.77 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.18 0.00 201 Y 7.45 4.53 0.00 3.21 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 V 8.07 3.89 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.12 0.00 0.00 203 A 8.05 3.92 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 0.00 204 N 8.11 4.14 0.00 2.85 2.59 0.00 0.00 6.77 7.07 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 0.00 205 T 7.58 3.49 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 1.70 0.00 0.00 206 T 7.83 4.17 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 1.34 0.00 0.00 207 K 7.43 3.82 0.00 1.80 1.97 0.00 1.73 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.51 7.81 *209 R 8.01 4.24 0.00 1.90 2.03 0.00 3.17 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.68 0.00 210 R 7.50 4.13 0.00 1.01 1.47 0.00 2.90 0.00 0.00 2.40 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.31 0.00 211 A 7.88 4.60 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 0.00 212 S 7.86 4.96 0.00 4.20 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 0.00 213 D 8.49 4.77 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 S 7.65 5.14 0.00 3.89 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 *216 E 8.48 4.01 0.00 1.90 1.40 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 2.13 2.22 0.00 217 L 8.11 4.83 0.00 1.49 1.52 1.08 0.86 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 0.00 218 Y 9.03 5.26 0.00 1.97 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 0.00 0.00 0.00 0.00 219 F 8.51 5.62 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 0.00 220 G 8.75 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 0.00 221 S 8.84 4.47 0.00 3.79 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 0.00 222 Q 8.93 3.57 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 223 I 7.83 4.96 1.97 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.14 0.94 0.00 0.00 224 P 0.00 4.89 0.00 2.53 2.28 0.00 3.79 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 2.29 2.27 0.00 225 L 8.81 4.44 0.00 0.27 0.97 0.63 0.45 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 0.00 226 K 9.14 4.31 0.00 0.96 0.87 0.00 1.20 0.00 0.00 0.77 0.00 0.00 2.39 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.93 0.26 7.81 227 L 8.33 4.48 0.00 1.65 0.93 1.01 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 228 R 8.57 4.25 0.00 1.75 1.79 0.00 3.43 0.00 0.00 3.38 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.78 0.00 229 F 9.17 4.48 0.00 3.36 3.06 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 0.00 0.00 0.00 0.00 230 K 8.54 4.15 0.00 1.91 1.85 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.46 7.81 231 L 8.51 4.60 0.00 1.46 1.54 0.83 0.95 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 0.00 232 P 0.00 4.24 0.00 2.15 2.03 0.00 4.04 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 233 Q 9.16 3.38 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 234 E 8.29 3.87 0.00 2.16 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 2.28 2.43 0.00 235 G 7.61 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 0.00 236 Y 8.39 5.22 0.00 3.16 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 0.00 237 G 9.22 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 0.00 0.00 0.00 0.00 238 D 9.48 5.27 0.00 2.84 2.24 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 0.00 239 F 8.58 5.06 0.00 3.07 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 0.00 240 Y 9.65 4.76 0.00 3.02 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 0.00 241 I 8.71 4.93 1.88 0.00 0.00 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 1.22 0.82 0.99 0.00 0.00 242 A 9.25 4.62 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 0.00 243 P 0.00 4.78 0.00 2.05 2.17 0.00 3.87 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 2.06 2.06 0.00 244 R 7.80 4.50 0.00 1.73 1.89 0.00 3.41 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 245 A 8.83 4.18 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 * Residues marked with a * may have inaccurate shift predictions.