NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1664 8.2649 123.5845 51.8667 18.9364 175.5158 *2 I 3.9878 7.8413 121.6258 62.1198 39.0614 174.6344 3 I 4.8355 8.5479 127.5044 59.7444 38.7917 175.0461 4 A 4.8860 9.5518 130.5870 50.5763 20.5039 176.2589 5 D 5.1390 9.5085 121.0612 54.7999 41.6316 176.1464 6 N 5.2420 7.6532 116.6242 50.5448 41.2863 175.2862 7 I 3.6643 8.3505 121.2791 64.5274 37.2626 178.4104 8 K 4.1508 8.1785 118.7201 59.9765 31.4814 178.7970 9 Q 3.9951 8.7480 119.6055 59.2164 28.8225 178.2502 10 F 4.0141 8.3795 121.7728 61.3263 39.3800 176.8871 11 H 4.0260 8.9911 117.1029 59.2166 28.2493 177.2522 12 S 4.0075 7.8480 115.4625 62.2393 63.1091 176.4177 13 I 4.0113 7.3888 121.2344 63.5194 37.9029 178.1438 14 R 3.5530 7.5060 119.8383 59.3868 29.6733 177.8813 15 N 4.5380 8.1822 114.1363 54.6364 39.0604 176.4859 16 S 4.3732 7.6597 115.1721 58.1626 63.7563 173.8556 17 L 4.3794 7.0174 123.0573 54.2545 42.4328 176.5729 18 I 4.1185 8.0324 122.7187 59.8453 38.8925 176.7834 19 K 4.0688 8.5096 124.1705 59.7323 32.5337 178.3599 20 Q 4.0233 8.0594 117.7343 58.2584 28.7998 176.2463 21 Q 4.4934 7.8458 117.5340 54.4663 29.2172 175.6795 22 K 4.3707 9.4006 124.4877 56.5574 33.4488 176.1084 23 I 4.8716 9.7513 126.6889 59.6564 39.4590 174.7982 24 G 4.7092 9.6163 115.1221 44.5003 0.0000 171.9515 25 F 5.8114 9.7401 126.1719 56.3072 42.9070 173.8529 26 V 4.0785 9.1986 126.5608 60.1736 33.1109 172.4442 27 P 4.9656 0.0000 0.0000 62.0313 32.2127 176.0273 28 T 4.0747 8.4624 121.0873 63.2103 75.1981 172.6614 *30 G 3.8474 8.5251 117.2881 47.6873 0.0000 170.6270 31 A 4.0131 9.0806 117.2524 52.0954 16.1453 178.2959 32 L 4.1008 8.5217 121.4956 54.6836 42.7818 177.1142 33 H 5.1146 8.3700 117.4271 52.9394 31.9002 173.7779 34 N 4.4157 8.8724 115.6105 56.3283 37.6253 177.4924 35 G 3.7045 8.3745 106.8723 48.3959 0.0000 175.1468 36 H 4.2075 7.8813 118.8162 58.4355 28.7078 177.9075 37 I 3.7892 8.1317 122.1246 64.1991 36.8719 178.6566 38 S 4.1278 8.2110 115.4098 61.2749 62.7901 176.5828 39 L 3.9935 7.6739 122.2089 57.6136 41.3074 179.4449 40 I 3.6011 7.8168 119.6694 64.3698 37.0537 178.6526 41 K 3.9040 8.2145 119.3858 59.1105 31.6150 179.3017 42 K 3.8043 7.8300 118.6398 59.4871 32.4723 178.1186 43 A 3.1941 7.4513 121.1509 55.0839 17.8964 179.8284 44 K 3.9572 7.9138 116.0999 59.3383 32.2315 179.2198 45 S 4.3827 7.9587 112.3558 59.7534 63.2251 174.3463 46 E 4.7074 7.8825 119.8792 56.0559 31.0724 174.9990 47 N 5.1512 7.6941 114.5864 51.8492 42.8430 173.7542 48 D 4.6571 8.6573 119.1871 55.9529 42.2121 177.2846 49 V 4.6293 8.2469 118.5139 60.9039 34.9182 174.5782 50 V 4.9335 9.4221 127.9541 61.1780 34.3591 174.0242 51 I 5.1589 9.2227 128.5066 59.5520 40.2449 174.5576 52 V 5.0865 8.9737 126.6040 61.1703 34.2130 174.4346 53 S 5.4703 8.9535 122.0803 57.1503 65.9201 173.2726 54 I 4.9732 8.4527 121.7663 59.9353 40.6092 174.7444 55 F 4.7011 8.7561 130.0199 57.4963 41.9206 174.5279 56 V 3.5597 8.1304 127.7120 61.8174 30.2267 174.5850 57 N 4.1025 8.2482 126.2473 52.1104 38.8926 173.9952 58 P 3.8545 0.0000 0.0000 65.3652 31.6465 178.7012 59 T 3.9975 8.0737 107.5530 63.1091 69.0314 175.3398 60 Q 4.4128 7.7074 119.1500 55.9157 29.3310 175.5012 61 F 4.2773 8.0253 118.7597 56.5250 38.5934 175.4785 62 N 4.4769 8.7055 123.9352 54.0148 38.0128 174.9958 63 N 4.9722 7.9827 117.9449 51.0087 41.2935 172.6898 64 P 4.3127 0.0000 0.0000 65.6986 31.5324 178.1551 65 N 4.3386 8.2878 115.4671 56.5729 38.7281 175.9851 66 D 4.5119 8.5416 118.6756 57.7783 41.5503 177.5387 67 Y 3.3981 8.0595 119.6651 60.6131 38.5351 177.9052 68 Q 3.8663 8.3039 118.3355 58.7720 28.9709 178.1916 69 T 4.2490 7.8084 107.5216 60.8791 69.7585 174.4621 70 Y 3.9990 6.9622 123.3358 57.2829 39.3107 174.2275 71 P 4.2180 0.0000 0.0000 62.5172 32.0288 175.2976 72 N 4.9331 8.2671 119.9282 52.0474 41.5813 175.2237 73 Q 4.7003 8.1347 122.2136 54.3067 29.6695 174.5257 74 L 3.9827 7.8198 123.8703 59.0412 42.7493 177.8637 75 Q 4.0205 8.0024 117.5287 58.9518 28.7262 178.3391 76 Q 3.9772 8.0047 120.1219 59.1769 29.1696 177.7458 77 D 4.3623 8.2840 120.0066 57.4307 40.8157 178.7885 78 I 3.7131 8.1686 120.5799 64.5830 37.2183 178.3669 79 Q 3.9989 8.1245 118.6967 59.0473 28.4005 179.1222 80 I 3.6857 7.8709 120.5735 64.4271 37.2229 178.4706 81 L 3.9757 8.0697 119.4105 57.8439 41.5501 179.3257 82 A 4.0425 8.2342 121.0665 55.2920 18.0847 179.5447 83 S 4.3043 7.9447 110.6072 60.2790 63.3810 175.4903 84 L 4.3962 7.3636 121.3531 53.6980 41.7124 175.8213 85 D 4.4277 7.8638 117.4214 54.8179 39.0705 174.1138 86 V 3.7134 7.5153 118.2154 63.4751 32.0864 175.5884 87 D 4.6007 8.8728 127.2204 56.9056 41.5849 176.9576 88 V 4.6782 8.0042 117.8536 60.9903 35.1144 173.7748 89 L 4.9913 9.1898 130.7128 53.7949 43.8867 174.6627 90 F 5.3660 9.3947 130.0697 56.8258 41.1755 173.7110 91 N 5.7538 9.0617 126.3339 49.9489 38.5778 171.5308 92 P 5.2191 0.0000 0.0000 60.6394 33.7050 176.3334 93 S 4.8063 8.8626 115.2369 56.8531 65.0743 175.0543 94 E 4.4525 9.1273 120.3670 60.0634 28.6679 179.9759 95 K 4.1547 8.1275 117.7030 59.4199 31.9399 178.8226 96 D 4.3816 7.8105 118.2458 57.6124 40.8575 178.6548 97 I 3.8063 7.2236 118.1084 62.3903 38.9010 176.0120 98 Y 4.7277 8.2365 117.9748 54.6414 37.8332 173.9512 99 P 4.4873 0.0000 0.0000 64.4508 31.6924 178.0012 100 D 4.8062 8.2845 115.2928 53.5035 41.7031 176.7223 101 G 3.7942 7.9507 107.9701 44.8451 0.0000 173.8869 102 N 4.7469 8.1181 115.0815 52.2763 37.2517 174.6139 103 L 4.3683 7.9391 120.5403 55.0550 43.2618 177.2591 104 L 4.7710 7.8541 117.7543 52.7906 43.8404 175.8582 105 R 4.7229 8.3353 121.7674 54.1339 33.5972 175.0620 106 I 4.0092 8.7034 123.0617 60.6994 37.7228 174.6940 107 E 4.6684 8.7474 126.4315 53.5217 31.1991 173.0047 108 P 4.6443 0.0000 0.0000 61.8628 32.3369 176.2670 109 K 4.4741 8.0888 123.5742 53.3854 32.2803 174.8101 110 L 4.4022 7.4575 121.3404 53.3693 43.2979 176.5958 111 E 3.8955 8.7287 119.1636 59.8223 29.1994 179.5004 112 I 3.8684 7.7936 116.0335 63.6919 38.2097 176.6870 113 A 4.4319 7.9625 119.9745 53.2813 18.5885 177.9029 114 N 4.8045 8.3884 113.8906 52.2533 39.6240 174.1923 115 I 4.4860 7.0004 113.4714 58.6954 41.9978 178.8205 116 L 2.4400 7.7032 121.7701 55.0014 41.2316 176.8220 117 E 4.0283 9.0043 128.8621 60.2952 28.9074 177.9374 118 G 4.0709 7.9048 106.2199 46.9794 0.0000 175.1633 119 K 4.1060 7.7196 120.4465 59.0750 32.5201 178.4284 120 S 4.4142 8.1707 112.8605 59.7049 63.7377 174.1853 121 R 4.4780 8.1732 121.4374 52.7129 29.8683 171.6563 122 P 4.4090 0.0000 0.0000 63.7912 32.0702 177.3009 123 G 3.9788 8.9394 111.0351 46.1401 0.0000 174.7130 124 H 4.1781 8.0416 118.8629 59.5137 29.9063 176.9346 125 F 4.6616 7.8684 117.6308 60.3137 39.0974 177.3039 126 S 4.6937 7.6281 114.1616 60.7257 62.2996 176.4719 127 G 3.9107 7.5291 105.3581 45.1340 0.0000 174.7431 *129 L 4.3413 7.8202 122.5515 54.9296 44.0382 179.4739 130 T 3.8829 8.0642 115.3503 66.6789 68.3075 177.2648 131 V 3.6965 7.9080 121.1485 64.6920 31.3882 178.5985 132 V 3.6294 7.7963 118.4625 65.6103 31.5534 177.3434 133 L 3.9315 8.0942 120.2398 58.2727 41.8509 179.1209 134 K 3.8660 8.0259 118.0647 59.6007 31.9290 179.3681 135 L 3.9681 8.2050 119.3503 57.7668 41.4397 179.6284 136 L 4.0080 8.2395 119.1418 57.6922 41.3487 179.4321 137 Q 3.9995 7.7195 117.2937 58.5120 28.6910 178.4331 138 I 3.8860 7.5791 120.6128 64.4617 37.3693 178.0196 139 T 4.1273 7.7769 108.8565 61.6807 70.2077 174.9097 140 K 3.8029 7.8399 120.1792 56.6218 29.9298 172.0202 141 P 4.7294 0.0000 0.0000 62.0548 33.4979 176.6212 142 N 4.6644 8.6975 116.0817 55.5369 40.0557 175.1951 143 N 5.3785 8.7132 115.6700 51.1844 42.8229 173.3913 144 L 5.1426 9.0041 125.6527 53.4449 44.7755 174.3269 145 Y 4.9959 8.4685 123.8562 56.2688 39.7446 175.2516 146 L 4.8517 8.8424 123.6078 52.7508 45.9623 175.9135 147 G 4.1253 8.5432 109.1387 45.3812 0.0000 174.3356 148 E 4.1376 9.2471 125.9581 58.9084 29.6817 177.9848 149 K 4.0172 7.6867 120.0720 59.2704 32.7971 177.0333 150 D 4.8377 7.6185 119.6138 52.8114 39.3944 176.1704 151 Y 3.9983 8.2675 123.2541 60.7321 39.6784 177.3729 152 Q 4.1276 8.5593 117.0407 59.0343 29.3352 177.1589 153 Q 3.9415 8.5353 118.6940 59.4102 29.0536 179.3048 154 V 3.5453 7.7070 113.3492 64.1208 31.4365 177.1637 *156 L 4.1282 7.9604 119.9278 54.5667 43.5010 179.2651 157 I 3.7254 7.9027 119.5238 64.0674 37.0118 178.6632 158 K 3.9459 8.1549 119.7737 59.2608 31.7173 179.2111 159 Q 3.8351 7.7535 119.5350 58.8347 29.0940 177.4890 160 L 4.0004 8.1142 121.7780 58.4522 42.0891 179.2979 161 V 3.6310 7.9036 118.0035 65.6050 30.8800 178.0185 162 K 3.6949 7.7724 119.1016 59.6372 31.8857 178.7380 163 D 3.7663 7.8084 117.8850 56.1456 40.7556 177.1701 164 F 4.9527 7.3688 116.3958 56.8980 39.6837 175.3807 165 F 3.7053 6.5840 115.4455 58.4858 36.7971 176.3738 166 I 4.2601 7.8064 120.2419 60.3825 38.0450 177.2826 167 N 4.7238 8.5227 126.3448 52.4272 37.3059 172.8497 168 T 4.8524 7.4488 115.6648 61.1657 73.0188 173.4947 169 K 4.2740 9.1763 127.9361 55.9865 33.9560 175.2766 170 I 4.6663 8.1639 126.7525 59.6877 39.2176 174.8751 171 I 4.2374 8.4897 128.8342 59.5379 38.8732 174.9417 172 V 4.6087 8.3080 127.6440 62.1383 32.6878 174.8310 173 C 5.0754 8.8714 124.5861 57.0948 31.7733 171.9118 174 P 4.7058 0.0000 0.0000 62.7552 31.9462 176.3123 175 T 4.1052 8.4253 120.1328 63.6592 69.0431 174.4122 176 Q 4.2940 8.7413 125.9757 55.4645 29.8307 175.3064 177 R 4.9468 8.0503 119.6495 54.0159 34.1166 175.4111 178 Q 4.1957 8.7621 119.9843 55.1393 29.3599 175.9096 179 P 4.4054 0.0000 0.0000 65.8261 31.4093 178.4205 180 S 4.1809 7.8917 111.4752 59.5271 63.2101 174.6414 181 G 4.0033 8.5042 109.0539 45.3780 0.0000 173.8206 182 L 2.4988 7.2052 122.1100 54.4253 42.1703 174.4659 183 P 4.6823 0.0000 0.0000 62.6911 31.9875 176.2969 184 L 4.0836 8.3770 124.1455 55.0848 42.3026 176.5852 185 S 4.4864 8.1165 115.9268 56.1393 65.5985 175.1797 186 S 4.1796 9.0763 122.2744 61.9069 62.6126 177.2402 187 R 3.8358 7.9541 119.7953 58.7667 29.7818 178.3637 188 N 4.2613 7.9744 116.6666 56.1937 38.2505 176.9698 189 K 4.1273 7.8798 118.4599 58.3186 32.2019 177.9397 190 N 4.6387 7.9725 115.6244 52.5640 39.1936 175.0937 191 L 4.3404 7.2993 122.1347 54.3251 42.4620 177.7760 192 T 4.2887 8.5360 114.3493 60.8291 70.9293 175.6730 193 S 4.1074 8.4934 115.5989 61.9951 62.8505 176.5801 194 T 3.9304 7.8600 113.1272 64.2491 68.5804 176.0793 195 D 4.3769 8.0527 121.5519 57.4602 40.9233 178.6740 196 I 3.7435 8.0132 120.5331 64.5257 37.1032 178.2164 197 E 4.0863 7.9041 117.8371 59.1100 29.5812 179.2506 198 I 3.6774 7.8466 120.6465 64.0962 37.1069 177.9782 199 A 4.0995 8.3756 121.9929 55.5262 18.2313 179.4459 200 N 4.3652 8.2885 114.7660 56.4267 38.5874 177.7316 201 K 3.9536 8.2084 119.8586 59.4897 32.0407 179.1871 202 I 3.5253 7.8728 120.0345 64.7949 37.0729 177.8962 203 Y 3.7323 7.9706 116.2037 59.9761 37.5380 177.6081 204 E 3.9904 7.9495 120.2778 58.9816 29.7309 178.5244 205 I 3.7840 7.6887 120.0016 64.2767 37.2455 178.2795 206 L 3.8557 7.8535 119.9668 57.9716 41.2152 179.9315 207 R 3.9276 7.6819 116.5947 58.7699 30.0311 178.1403 208 Q 4.2323 7.4208 115.0771 55.1869 29.3323 175.0051 209 D 4.5770 7.0006 120.1841 52.6015 42.6622 175.6617 210 D 4.6493 8.0967 121.8919 52.5326 40.4653 176.8143 211 F 3.9623 8.1017 117.8953 58.5409 36.7617 176.2031 212 S 4.3375 8.5846 116.6877 60.1701 63.4748 174.6577 213 N 4.8221 7.6783 118.8289 51.1355 39.9221 173.9041 214 L 4.1593 8.3654 127.7059 56.8388 42.0091 178.4956 215 E 3.9189 8.2492 119.2935 59.5442 29.7144 178.6488 216 E 4.0182 8.3026 118.0252 59.0900 29.4425 179.1517 217 L 3.9333 7.8502 120.2852 58.2712 42.0628 179.1485 218 T 3.8751 8.3438 116.1840 66.7753 68.5467 176.3614 219 N 4.3493 8.0920 118.2112 56.2479 38.2872 177.7048 220 K 3.9806 7.8232 119.0735 59.4100 32.5378 179.2047 221 I 3.7517 7.8116 120.0900 64.5175 37.1860 178.3526 222 N 4.9333 8.8129 119.0123 55.3383 38.1190 176.8836 223 S 4.4363 7.6237 113.6385 59.8110 63.4989 175.5446 224 T 4.1588 7.6055 112.8686 62.6332 69.0406 175.3910 225 G 3.9729 7.9128 109.0698 45.2725 0.0000 173.9911 226 A 4.3493 7.8698 122.5239 52.0154 19.1403 176.3567 227 K 4.9146 9.0354 119.4195 54.2813 34.7465 175.8169 228 L 4.3798 9.4461 129.1477 55.6506 42.0862 176.7440 229 Q 4.4823 9.2387 127.0354 58.4886 29.2469 175.6819 230 Y 5.0171 7.1636 115.0059 56.0405 41.4543 172.8005 231 I 5.2885 8.3625 120.1825 59.9191 41.2539 174.0298 232 Q 4.7394 9.5894 127.0331 54.6175 33.8679 173.5575 233 K 4.8519 8.6218 121.5817 55.1317 33.6342 175.8572 234 L 4.5613 8.6884 127.4430 53.9469 44.7572 176.1395 235 N 4.1238 8.5052 125.1976 54.9336 37.3697 174.6132 236 N 5.0498 8.8905 123.9583 53.5784 38.5422 172.6540 237 R 4.9181 8.1454 117.6716 55.1341 33.9801 174.7565 238 I 4.6606 8.0989 122.8335 59.9982 39.1157 174.7206 239 F 5.1515 9.4935 125.9416 55.5912 41.8241 174.6160 240 L 5.2980 9.0253 121.5860 54.8126 44.4422 174.2549 241 A 4.9389 7.6620 119.4647 50.8968 22.5519 175.0965 242 F 5.2990 8.3722 114.6308 56.1936 41.9899 172.4746 243 Y 5.0527 9.2988 117.8544 56.4907 40.6770 174.9739 244 I 4.7841 8.7625 123.9702 59.1251 40.1644 176.1770 245 G 3.7457 9.0346 117.4589 47.1793 0.0000 173.8435 246 K 4.4145 8.9571 123.1836 55.8317 32.2525 175.4236 247 V 4.2330 8.1151 121.4271 61.5028 32.9743 174.5370 248 R 4.0983 8.4484 128.9247 54.7612 30.7847 175.0805 249 L 4.7356 7.9791 126.8460 52.6917 44.9672 175.6305 250 I 4.9598 7.7972 113.7349 59.6602 41.1906 173.5409 251 D 4.9072 8.8833 120.8726 53.6756 44.9990 173.5465 252 N 4.8836 8.3724 119.0614 51.5814 40.2566 173.1868 253 F 4.8202 7.4412 114.2785 55.5267 41.9773 173.5025 254 L 4.3887 8.5623 119.8281 54.7211 40.9461 178.5372 255 K 3.7429 9.0384 124.4493 59.6233 31.8892 178.9617 256 E 4.1954 8.2199 118.2037 59.0212 29.6405 177.9264 257 T 4.3058 7.3730 112.2009 64.1755 69.7472 176.2510 258 G 3.6352 8.3062 109.2636 43.9688 0.0000 171.8611 259 P 4.3300 0.0000 0.0000 61.2999 29.8578 175.8098 260 S 4.2637 7.3472 117.3072 59.6177 64.5494 175.0710 261 C 4.1084 8.7690 117.9873 60.3184 27.4739 173.5580 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 0 A 8.26 4.17 1.30 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 0.00 0.00 *2 I 7.84 3.99 1.91 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 1.36 0.67 0.95 0.00 0.00 3 I 8.55 4.84 1.92 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 1.33 0.59 1.03 0.00 0.00 4 A 9.55 4.89 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 D 9.51 5.14 0.00 2.81 2.72 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 6 N 7.65 5.24 0.00 2.99 2.92 0.00 0.00 6.22 7.73 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 7 I 8.35 3.66 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.09 0.79 0.00 0.00 8 K 8.18 4.15 0.00 2.02 1.91 0.00 1.61 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.61 7.81 9 Q 8.75 4.00 0.00 2.43 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 10 F 8.38 4.01 0.00 3.02 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 11 H 8.99 4.03 0.00 3.22 3.25 0.00 5.70 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 12 S 7.85 4.01 0.00 4.00 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 13 I 7.39 4.01 1.77 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 2.20 0.68 0.00 0.00 14 R 7.51 3.55 0.00 0.84 1.62 0.00 3.02 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 15 N 8.18 4.54 0.00 2.68 2.78 0.00 0.00 7.08 7.27 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 16 S 7.66 4.37 0.00 4.03 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.02 4.38 0.00 1.63 1.60 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 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0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.91 3.96 0.00 1.82 1.86 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.24 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.56 7.81 45 S 7.96 4.38 0.00 4.04 4.06 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 46 E 7.88 4.71 0.00 2.15 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 2.29 2.29 0.00 47 N 7.69 5.15 0.00 2.78 2.91 0.00 0.00 6.99 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 48 D 8.66 4.66 0.00 2.58 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 49 V 8.25 4.63 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 0.97 0.00 0.00 0.94 0.00 0.00 50 V 9.42 4.93 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 0.95 0.00 0.00 0.89 0.00 0.00 51 I 9.22 5.16 2.14 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.66 1.09 0.00 0.00 52 V 8.97 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0.00 0.00 0.00 0.00 7.27 6.93 0.00 0.00 0.00 0.00 0.00 2.54 2.02 0.00 61 F 8.03 4.28 0.00 2.94 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 62 N 8.71 4.48 0.00 2.83 3.07 0.00 0.00 6.02 8.04 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 63 N 7.98 4.97 0.00 2.83 2.83 0.00 0.00 7.23 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.31 0.00 2.23 2.11 0.00 3.70 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 65 N 8.29 4.34 0.00 2.87 3.00 0.00 0.00 6.80 8.49 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 66 D 8.54 4.51 0.00 2.89 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 67 Y 8.06 3.40 0.00 2.72 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 68 Q 8.30 3.87 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.62 0.00 0.00 0.00 0.00 0.00 2.44 2.65 0.00 69 T 7.81 4.25 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 1.22 0.00 0.00 70 Y 6.96 4.00 0.00 3.03 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 71 P 0.00 4.22 0.00 1.78 1.80 0.00 2.20 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 72 N 8.27 4.93 0.00 2.56 2.60 0.00 0.00 6.88 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 73 Q 8.13 4.70 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.68 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 74 L 7.82 3.98 0.00 1.78 1.71 1.00 0.84 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 75 Q 8.00 4.02 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 76 Q 8.00 3.98 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.90 0.00 0.00 0.00 0.00 0.00 2.64 2.51 0.00 77 D 8.28 4.36 0.00 2.91 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 78 I 8.17 3.71 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.74 0.93 0.00 0.00 79 Q 8.12 4.00 0.00 2.28 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.54 0.00 80 I 7.87 3.69 2.04 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 1.53 1.08 0.92 0.00 0.00 81 L 8.07 3.98 0.00 1.85 1.74 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 82 A 8.23 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 83 S 7.94 4.30 0.00 4.08 4.01 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 84 L 7.36 4.40 0.00 1.75 1.73 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 85 D 7.86 4.43 0.00 2.84 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 86 V 7.52 3.71 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 0.86 0.00 0.00 0.95 0.00 0.00 87 D 8.87 4.60 0.00 2.79 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 88 V 8.00 4.68 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.98 0.00 0.00 89 L 9.19 4.99 0.00 1.81 1.61 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 90 F 9.39 5.37 0.00 2.87 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 N 9.06 5.75 0.00 2.78 2.61 0.00 0.00 6.79 7.27 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 92 P 0.00 5.22 0.00 1.62 1.34 0.00 3.18 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.44 0.00 93 S 8.86 4.81 0.00 4.08 4.06 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 94 E 9.13 4.45 0.00 2.19 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 0.00 2.70 2.61 0.00 95 K 8.13 4.15 0.00 1.84 1.90 0.00 1.71 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.59 7.81 96 D 7.81 4.38 0.00 2.75 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 97 I 7.22 3.81 1.40 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 -0.36 0.19 0.00 0.00 98 Y 8.24 4.73 0.00 3.09 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 99 P 0.00 4.49 0.00 2.19 2.21 0.00 3.39 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 100 D 8.28 4.81 0.00 2.68 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 0.00 101 G 7.95 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 0.00 102 N 8.12 4.75 0.00 2.35 2.65 0.00 0.00 6.81 7.78 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 0.00 103 L 7.94 4.37 0.00 1.70 1.72 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.85 4.77 0.00 1.60 1.56 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 105 R 8.34 4.72 0.00 1.77 1.81 0.00 3.21 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 106 I 8.70 4.01 1.90 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.89 0.99 0.00 0.00 107 E 8.75 4.67 0.00 1.90 1.85 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 2.20 2.34 0.00 108 P 0.00 4.64 0.00 2.21 2.04 0.00 3.56 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 2.06 2.17 0.00 109 K 8.09 4.47 0.00 1.73 1.78 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.33 7.81 110 L 7.46 4.40 0.00 1.77 1.68 0.85 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.73 3.90 0.00 1.97 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 2.38 2.29 0.00 112 I 7.79 3.87 1.81 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.53 0.80 0.00 0.00 113 A 7.96 4.43 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.39 4.80 0.00 2.78 2.85 0.00 0.00 6.76 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 0.00 115 I 7.00 4.49 1.70 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.68 0.83 0.00 0.00 116 L 7.70 2.44 0.00 1.78 0.44 0.22 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 117 E 9.00 4.03 0.00 2.39 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 2.33 2.15 0.00 118 G 7.90 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 0.00 119 K 7.72 4.11 0.00 1.91 1.85 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.45 7.81 120 S 8.17 4.41 0.00 4.11 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 R 8.17 4.48 0.00 1.62 1.83 0.00 3.08 0.00 0.00 2.77 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.42 0.00 122 P 0.00 4.41 0.00 2.02 1.99 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 123 G 8.94 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 0.00 124 H 8.04 4.18 0.00 2.96 3.20 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 7.87 4.66 0.00 3.04 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 0.00 126 S 7.63 4.69 0.00 4.04 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 7.53 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 *129 L 7.82 4.34 0.00 1.86 1.81 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 130 T 8.06 3.88 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 1.38 0.00 0.00 131 V 7.91 3.70 2.35 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 0.99 0.00 0.00 1.19 0.00 0.00 132 V 7.80 3.63 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 1.16 0.00 0.00 0.99 0.00 0.00 133 L 8.09 3.93 0.00 1.84 1.77 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 134 K 8.03 3.87 0.00 1.93 1.70 0.00 1.47 0.00 0.00 1.31 0.00 0.00 2.88 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.32 1.49 7.81 135 L 8.20 3.97 0.00 1.99 1.96 1.14 1.04 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 0.00 136 L 8.24 4.01 0.00 1.94 1.75 0.99 1.14 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 0.00 137 Q 7.72 4.00 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.98 0.00 0.00 0.00 0.00 0.00 2.57 2.49 0.00 138 I 7.58 3.89 1.69 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.51 0.32 0.00 0.00 139 T 7.78 4.13 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 140 K 7.84 3.80 0.00 1.83 1.83 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.21 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.40 1.49 7.81 141 P 0.00 4.73 0.00 2.48 2.17 0.00 3.78 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 142 N 8.70 4.66 0.00 2.96 2.93 0.00 0.00 6.56 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 0.00 143 N 8.71 5.38 0.00 2.83 2.47 0.00 0.00 6.45 6.34 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 0.00 144 L 9.00 5.14 0.00 1.73 1.53 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 145 Y 8.47 5.00 0.00 2.91 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 0.00 146 L 8.84 4.85 0.00 1.52 1.48 0.87 0.51 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 0.00 147 G 8.54 4.13 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 0.00 0.00 0.00 148 E 9.25 4.14 0.00 2.02 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 2.49 2.50 0.00 149 K 7.69 4.02 0.00 1.75 1.88 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.47 7.81 150 D 7.62 4.84 0.00 2.85 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 0.00 151 Y 8.27 4.00 0.00 3.01 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 0.00 152 Q 8.56 4.13 0.00 2.37 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.54 0.00 153 Q 8.54 3.94 0.00 2.22 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 7.09 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 154 V 7.71 3.55 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 0.71 0.00 0.00 0.92 0.00 0.00 *156 L 7.96 4.13 0.00 1.69 1.53 -0.27 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 157 I 7.90 3.73 1.86 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 1.52 0.83 0.90 0.00 0.00 158 K 8.15 3.95 0.00 1.70 1.77 0.00 1.54 0.00 0.00 1.49 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.54 7.81 159 Q 7.75 3.84 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 160 L 8.11 4.00 0.00 1.92 1.89 1.11 1.12 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 0.00 161 V 7.90 3.63 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 1.01 0.00 0.00 0.99 0.00 0.00 162 K 7.77 3.69 0.00 1.85 1.78 0.00 1.57 0.00 0.00 1.50 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.17 1.31 7.81 163 D 7.81 3.77 0.00 2.26 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 0.00 164 F 7.37 4.95 0.00 3.19 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 0.00 165 F 6.58 3.71 0.00 3.25 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 7.81 4.26 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.84 0.95 0.00 0.00 167 N 8.52 4.72 0.00 2.72 2.77 0.00 0.00 6.99 7.70 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 0.00 168 T 7.45 4.85 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 169 K 9.18 4.27 0.00 1.79 1.81 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.36 7.81 170 I 8.16 4.67 1.79 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.68 0.81 0.00 0.00 171 I 8.49 4.24 1.21 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.64 1.01 0.00 0.00 172 V 8.31 4.61 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.86 0.00 0.00 173 C 8.87 5.08 0.00 2.92 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 0.00 174 P 0.00 4.71 0.00 1.96 2.01 0.00 3.71 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 2.05 2.15 0.00 175 T 8.43 4.11 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 1.24 0.00 0.00 176 Q 8.74 4.29 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.83 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 177 R 8.05 4.95 0.00 1.70 1.79 0.00 3.37 0.00 0.00 3.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.77 0.00 178 Q 8.76 4.20 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 179 P 0.00 4.41 0.00 2.02 2.12 0.00 3.65 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 180 S 7.89 4.18 0.00 4.01 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 0.00 181 G 8.50 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 0.00 0.00 0.00 182 L 7.21 2.50 0.00 1.25 1.34 0.87 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 183 P 0.00 4.68 0.00 1.93 1.97 0.00 3.47 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.42 0.00 184 L 8.38 4.08 0.00 1.39 1.33 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 185 S 8.12 4.49 0.00 3.78 3.74 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 0.00 186 S 9.08 4.18 0.00 3.94 3.76 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 0.00 187 R 7.95 3.84 0.00 1.81 1.94 0.00 3.26 0.00 0.00 3.37 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 188 N 7.97 4.26 0.00 2.95 2.84 0.00 0.00 6.84 7.53 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 0.00 189 K 7.88 4.13 0.00 1.73 1.82 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.44 1.44 7.81 190 N 7.97 4.64 0.00 2.83 2.85 0.00 0.00 7.01 8.16 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 0.00 191 L 7.30 4.34 0.00 1.73 1.62 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 192 T 8.54 4.29 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 0.00 193 S 8.49 4.11 0.00 4.07 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 0.00 194 T 7.86 3.93 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 0.00 195 D 8.05 4.38 0.00 3.06 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 0.00 196 I 8.01 3.74 2.10 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 1.88 1.19 0.91 0.00 0.00 197 E 7.90 4.09 0.00 2.21 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 2.31 2.41 0.00 198 I 7.85 3.68 2.08 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 1.60 0.77 0.99 0.00 0.00 199 A 8.38 4.10 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 0.00 200 N 8.29 4.37 0.00 2.91 2.90 0.00 0.00 7.08 6.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 K 8.21 3.95 0.00 1.96 1.84 0.00 1.67 0.00 0.00 1.64 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.64 7.81 202 I 7.87 3.53 1.97 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 1.24 0.65 0.29 0.00 0.00 203 Y 7.97 3.73 0.00 2.99 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 0.00 204 E 7.95 3.99 0.00 2.12 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 2.29 2.33 0.00 205 I 7.69 3.78 1.95 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.67 0.79 0.00 0.00 206 L 7.85 3.86 0.00 1.37 1.60 0.13 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 207 R 7.68 3.93 0.00 1.87 1.96 0.00 3.16 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 208 Q 7.42 4.23 0.00 1.91 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 209 D 7.00 4.58 0.00 2.35 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 0.00 210 D 8.10 4.65 0.00 2.81 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 0.00 211 F 8.10 3.96 0.00 3.30 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 0.00 212 S 8.58 4.34 0.00 3.99 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 0.00 213 N 7.68 4.82 0.00 2.72 2.67 0.00 0.00 7.24 6.66 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 0.00 214 L 8.37 4.16 0.00 1.79 1.78 0.99 1.06 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 0.00 215 E 8.25 3.92 0.00 2.09 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 2.39 2.36 0.00 216 E 8.30 4.02 0.00 2.07 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 2.32 2.31 0.00 217 L 7.85 3.93 0.00 1.96 1.78 0.99 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 218 T 8.34 3.88 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 1.24 0.00 0.00 219 N 8.09 4.35 0.00 2.92 2.86 0.00 0.00 7.08 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 K 7.82 3.98 0.00 1.83 1.81 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.44 7.81 221 I 7.81 3.75 1.93 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.06 0.72 0.00 0.00 222 N 8.81 4.93 0.00 2.77 2.87 0.00 0.00 6.33 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 S 7.62 4.44 0.00 4.05 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 T 7.61 4.16 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 225 G 7.91 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 A 7.87 4.35 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 0.00 227 K 9.04 4.91 0.00 1.78 1.82 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.39 7.81 228 L 9.45 4.38 0.00 1.80 1.65 1.04 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 9.24 4.48 0.00 1.91 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.40 0.00 0.00 0.00 0.00 0.00 2.56 2.40 0.00 230 Y 7.16 5.02 0.00 2.98 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 0.00 231 I 8.36 5.29 1.93 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 1.44 1.09 0.99 0.00 0.00 232 Q 9.59 4.74 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.62 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 233 K 8.62 4.85 0.00 1.64 1.75 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.80 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.45 7.81 234 L 8.69 4.56 0.00 1.36 1.40 0.63 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 235 N 8.51 4.12 0.00 2.93 1.90 0.00 0.00 7.02 8.00 0.00 0.00 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 N 8.89 5.05 0.00 2.81 2.99 0.00 0.00 5.76 7.66 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 0.00 237 R 8.15 4.92 0.00 1.71 1.42 0.00 2.79 0.00 0.00 2.46 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.45 0.00 238 I 8.10 4.66 0.78 0.00 0.00 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 0.66 -0.33 0.58 0.00 0.00 239 F 9.49 5.15 0.00 2.89 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 0.00 240 L 9.03 5.30 0.00 1.79 1.70 1.03 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 241 A 7.66 4.94 0.68 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 0.00 0.00 242 F 8.37 5.30 0.00 3.24 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 0.00 243 Y 9.30 5.05 0.00 2.94 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 0.00 244 I 8.76 4.78 2.01 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.19 1.00 0.00 0.00 245 G 9.03 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 0.00 246 K 8.96 4.41 0.00 1.79 1.93 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.46 7.81 247 V 8.12 4.23 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 1.01 0.00 0.00 0.96 0.00 0.00 248 R 8.45 4.10 0.00 0.67 1.46 0.00 2.85 0.00 0.00 3.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.95 0.00 249 L 7.98 4.74 0.00 0.42 1.14 1.00 0.62 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 0.00 250 I 7.80 4.96 1.94 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 1.20 0.68 0.84 0.00 0.00 251 D 8.88 4.91 0.00 3.07 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 0.00 252 N 8.37 4.88 0.00 1.44 1.99 0.00 0.00 5.87 7.43 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 0.00 253 F 7.44 4.82 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 0.00 254 L 8.56 4.39 0.00 1.77 1.65 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 255 K 9.04 3.74 0.00 1.65 1.79 0.00 1.71 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.49 0.00 0.00 0.00 0.00 1.47 1.62 7.81 256 E 8.22 4.20 0.00 2.01 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 2.31 2.49 0.00 257 T 7.37 4.31 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 1.21 0.00 0.00 258 G 8.31 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 P 0.00 4.33 0.00 2.29 1.90 0.00 3.42 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.65 0.00 260 S 7.35 4.26 0.00 3.98 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 0.00 261 C 8.77 4.11 0.00 3.04 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 * Residues marked with a * may have inaccurate shift predictions.