NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.4272 8.3149 120.1294 56.1305 33.6262 174.8121 4 I 4.1343 8.9457 123.8565 60.4304 38.3913 173.5015 5 L 4.6271 9.1436 128.4149 53.8741 43.8867 175.7862 6 G 4.3176 9.1807 112.0318 44.8675 0.0000 172.2801 7 L 5.1289 8.9630 127.6566 53.1367 44.0519 175.9520 8 I 4.7603 8.8431 125.2663 59.9919 39.0233 174.1049 9 G 3.6351 8.8750 118.4620 46.0777 0.0000 169.7739 10 G 4.3589 8.9080 102.5613 46.3455 0.0000 172.1949 *12 S 3.7604 7.6823 116.6848 57.3996 64.9153 175.6973 13 W 4.2498 8.3664 116.7992 59.8017 27.2246 177.9664 14 E 3.3778 6.4783 118.7000 59.1151 28.2071 179.2802 15 S 4.0566 7.6991 114.3327 61.1306 62.9444 176.6679 16 T 4.2151 7.7125 118.5153 66.1754 68.1474 176.7634 17 I 3.8725 7.4582 121.6804 64.2558 37.0004 176.6510 18 P 4.3726 0.0000 0.0000 65.5744 31.2022 177.9982 19 Y 4.1398 7.4505 111.7550 61.2176 38.2652 177.6949 20 Y 4.3940 8.3298 120.3243 60.7246 38.8315 178.2521 21 R 3.8736 8.3490 115.5954 57.7529 29.8090 177.6500 *23 I 4.1490 7.6056 119.3688 61.4306 39.3159 177.6169 24 N 4.2565 7.8602 117.0556 56.4362 38.2047 177.4692 25 Q 3.9585 8.3174 119.6817 59.2756 28.7820 178.6704 26 H 4.1583 8.0792 116.7279 58.8018 28.7361 177.9082 27 V 3.5909 7.8828 120.0885 65.8533 31.3029 178.0084 28 K 4.0040 8.2776 119.2922 59.4378 31.7950 178.6335 29 A 3.9558 7.9617 120.2973 55.0929 18.3544 179.1063 30 Q 4.0408 8.0006 117.0817 58.9084 29.3554 177.4747 31 L 4.3133 8.1748 118.1996 55.5705 42.8062 178.1688 32 G 3.8704 8.8079 108.3843 46.1060 0.0000 173.8359 33 G 3.6963 8.3876 108.6056 47.4260 0.0000 174.1315 34 L 4.5765 8.3419 124.3047 54.6682 41.9131 176.1490 35 H 4.3236 7.8170 116.6838 55.8767 28.9838 174.8167 36 S 4.7002 8.2102 116.4449 55.9737 66.2752 173.2275 37 A 4.1183 8.6587 123.3638 52.0401 18.6901 177.4550 38 K 4.5157 8.4603 119.9364 55.3061 33.4287 175.7282 39 I 5.0660 8.3890 125.5842 59.4061 40.6322 175.1062 40 I 4.5067 8.9918 127.6690 59.4401 39.6698 174.1233 41 L 5.0866 8.6353 129.2688 53.3965 44.1924 174.6718 42 Y 4.3057 9.3374 128.5316 56.2252 40.2575 174.0716 43 S 5.0835 8.3371 122.8403 56.9572 64.0615 174.1247 44 V 4.2467 8.4408 121.2530 60.3761 33.4308 175.6814 45 D 4.6382 8.6093 121.2165 53.4380 40.9494 176.2837 46 F 4.6284 9.1456 129.9999 61.8714 39.2653 176.0583 47 H 3.9662 8.6412 117.9002 59.3813 29.6879 177.0491 48 E 3.9661 8.3029 120.1937 59.3899 29.2990 179.4810 49 I 3.6382 7.6521 119.3079 64.3011 37.2625 177.7921 50 E 3.6343 8.2428 120.4285 59.3844 29.0180 178.9130 51 Q 3.8306 7.8421 117.8692 58.8489 28.6934 178.8572 52 L 3.8229 7.6209 119.6607 57.6728 41.6286 179.2746 53 Q 3.1025 8.1796 119.6747 58.9077 28.7283 178.2615 54 A 4.0255 7.9921 120.8164 54.1762 18.4503 178.6724 55 K 4.3060 7.2858 114.5629 55.3309 32.5109 176.9083 56 G 3.7968 7.3488 107.0890 46.8522 0.0000 175.3447 57 D 4.5675 7.4279 120.9838 52.5999 38.6851 176.1096 58 W 4.1882 7.9647 123.9305 58.8178 29.5883 177.4837 59 Q 3.9968 8.1547 119.3931 59.6868 28.5327 178.4272 60 T 3.8810 8.3263 116.4649 66.4326 68.4671 176.6003 61 A 3.9175 7.9212 122.2930 55.1281 18.3379 179.5112 62 A 3.9832 8.5547 119.6928 55.3412 18.3522 179.7025 63 Q 3.8859 8.0526 118.1335 59.0071 29.1243 178.0660 64 L 3.8775 8.1602 121.6921 58.3817 42.1631 179.1211 65 L 3.9740 7.9724 118.6817 57.5303 41.3234 179.6944 66 S 4.0591 8.4348 115.8658 61.6329 62.6728 176.3851 67 N 4.2468 8.4332 119.2841 56.0435 38.2032 177.2520 68 A 2.9472 7.7041 121.9424 54.8329 18.3392 179.5389 69 A 3.8838 7.9422 119.2598 55.3658 18.3376 179.9599 70 I 3.5760 7.9171 118.4917 64.4528 37.1629 178.7593 71 S 4.1315 8.2171 116.2785 61.7685 62.6515 176.8627 72 L 4.1153 8.1384 121.5985 57.4849 41.2908 179.5053 73 K 3.9333 8.1728 119.8009 59.9311 31.9578 178.4637 74 H 4.2673 8.2242 115.2305 58.8927 28.7184 177.0126 75 A 4.3362 7.6692 120.1318 52.2534 18.6471 177.4853 76 G 3.8377 7.7450 103.9275 44.9380 0.0000 174.5114 77 A 4.1684 8.1523 123.6332 52.6419 18.7550 177.4560 78 E 4.8665 8.8022 119.5688 56.1724 31.1513 176.3682 79 V 4.6757 7.5538 117.8463 60.7881 34.8083 172.2750 80 I 4.9725 8.7486 123.4321 59.6201 40.1323 174.7838 81 V 4.5029 8.8506 126.2439 61.0933 34.3367 174.1928 82 V 4.4159 8.4349 128.3243 61.1080 32.2804 175.8428 83 C 3.6127 8.3376 130.5142 58.6211 26.5163 173.2360 84 T 4.4935 7.3475 110.3526 61.4473 70.0109 172.2317 85 N 4.6990 8.7407 124.1684 56.6701 39.8003 178.5857 86 T 3.9054 7.5908 109.7167 61.4910 67.7029 175.0909 *88 H 4.4836 8.0511 118.0630 55.9985 31.0572 175.6886 89 K 3.4472 7.2580 120.7229 58.5808 32.0501 177.5408 90 V 4.3460 7.3750 110.2640 60.7569 32.4883 177.2808 91 A 3.9625 8.0125 125.3045 55.5848 18.0730 180.2881 92 D 4.3093 8.0847 116.7779 57.5785 40.9010 178.6353 93 D 4.3816 8.0106 119.0607 57.1901 40.8280 178.6521 94 I 3.7662 7.7393 121.7443 63.7178 37.1324 177.9530 95 E 3.8751 8.3969 120.0835 59.4017 29.2584 178.7628 96 A 3.9921 7.7914 119.1121 55.1382 18.4802 179.1800 97 A 4.0765 7.8691 118.8039 54.5946 18.5365 178.6745 98 C 4.4958 7.8459 110.6724 57.3819 30.6738 174.8058 99 G 3.9067 7.8742 108.7235 46.1466 0.0000 172.9859 100 L 4.9958 7.5557 117.8788 51.4640 44.6319 174.7268 101 P 4.5793 0.0000 0.0000 62.9854 32.7018 174.5829 102 L 4.9656 8.6638 123.9398 53.2673 44.3116 175.7593 103 L 4.2932 8.6155 129.4662 53.8942 42.1532 175.3428 104 H 4.4302 8.6169 126.9922 55.4496 30.8420 175.8305 105 I 3.3096 8.2376 126.1142 64.2975 37.6215 177.8701 106 A 3.4872 8.0072 120.9661 54.7607 18.1072 179.2288 107 D 4.1201 7.9980 116.9080 57.3565 40.8549 178.5277 108 A 3.9894 8.0607 121.2612 55.6391 17.9023 179.9093 109 T 3.9092 7.7995 113.6777 66.5248 68.4301 176.9318 110 A 3.8308 8.0063 122.9724 54.9952 18.2980 179.8293 111 V 3.4784 7.9089 116.8991 66.2954 31.4815 178.3330 112 Q 4.0849 7.8846 117.7723 58.9822 28.6063 178.7945 113 I 3.5001 7.8462 120.9311 64.3562 37.0511 178.7233 114 K 4.0037 8.2773 119.5501 59.4946 31.6608 179.5017 115 Q 4.0865 8.1586 117.2300 58.1092 28.5951 177.6322 116 Q 4.5697 7.5660 117.4881 54.7785 29.0375 175.6043 117 G 3.8983 7.9911 107.6595 46.6541 0.0000 173.7562 118 I 4.5890 7.5707 120.2700 59.5311 38.6317 175.4250 119 D 4.9075 9.3873 122.7808 52.6131 41.3309 174.9477 120 K 4.8714 8.0784 120.7313 55.1500 35.2803 174.4832 121 I 4.9153 9.1145 128.1168 59.1327 41.7334 174.3265 122 G 4.4090 9.1883 114.2898 44.8658 0.0000 172.4433 123 L 5.1287 8.4467 123.3458 53.0828 44.9355 175.5779 124 L 4.7191 9.1654 125.8744 52.5347 45.2500 177.0368 125 G 3.6285 7.9006 108.1196 46.1871 0.0000 172.3113 126 T 4.3102 8.2676 109.5763 61.3113 69.4863 174.4579 127 R 4.0598 9.3533 122.0682 59.6649 30.5581 178.1741 128 Y 4.4618 8.4401 115.3340 61.8791 37.2535 179.5643 129 T 3.6499 7.9733 112.8519 64.3334 67.7051 176.2433 *131 E 4.2948 8.1136 122.6240 55.9787 31.3628 176.0778 132 Q 4.5182 7.7294 118.0142 54.2684 30.6934 176.8639 133 G 3.6070 8.5145 105.3943 47.7831 0.0000 175.9696 134 F 4.3492 8.3299 115.7454 59.3397 38.1048 174.7702 135 Y 4.1307 6.6466 116.5984 58.7610 40.2783 177.0788 136 R 3.9784 7.5646 119.5796 59.6852 30.3363 179.1042 137 G 3.5950 7.7454 105.2075 47.6683 0.0000 175.5297 138 R 3.8409 7.7300 120.7473 59.0594 30.0562 178.4362 139 L 3.8962 7.6640 118.8411 58.1286 41.6206 179.6891 140 T 4.5675 7.4527 116.7852 66.1482 68.3169 176.9010 141 E 3.8666 8.1205 119.3435 59.5058 29.6881 178.6049 142 K 4.0104 7.8073 118.3934 58.5260 32.4139 177.0032 143 H 4.6574 7.9705 112.2594 54.6328 29.8435 174.4496 144 G 3.8740 8.0824 107.2775 46.2032 0.0000 173.2399 145 I 4.2598 7.4983 121.0405 59.5733 38.9752 174.8498 146 E 4.3775 9.1429 129.1727 55.9376 30.8465 175.3077 147 V 4.8036 8.3778 126.4352 61.2649 33.9480 174.2824 148 I 4.5860 8.9676 129.7778 59.8607 39.1265 175.1710 149 T 4.9146 8.2724 116.1676 58.8506 71.7390 171.9563 150 P 4.4024 0.0000 0.0000 61.9845 32.0969 176.3486 151 D 4.6291 8.2596 120.1488 52.8380 41.4760 176.7472 152 D 4.3785 8.6413 118.8449 58.1083 40.7313 179.5324 153 T 3.8345 7.8735 115.1296 66.9398 68.5161 176.4123 154 D 4.3659 8.6894 120.9464 57.1950 40.7007 179.0483 155 R 3.8672 8.3731 119.2411 59.1327 29.9655 178.6116 156 E 3.8963 8.2205 118.9003 59.1334 29.5346 178.7960 157 A 3.9672 7.9191 120.6111 55.1803 18.6128 179.5219 158 V 3.4097 7.9829 117.2253 66.2787 31.4789 177.7990 159 N 4.3661 8.3976 116.6589 56.6782 38.8908 176.7271 160 R 4.0086 8.3582 120.4479 59.6815 30.1166 178.5084 161 I 3.8029 8.1870 119.7843 64.3569 37.0901 178.5490 162 I 3.6045 7.7584 120.3696 64.6703 36.7403 178.2166 163 Y 4.1979 7.7314 116.0776 60.9852 37.8613 177.6631 164 E 4.3759 8.7701 117.9398 57.6274 30.1237 176.0497 165 E 4.5440 7.9009 115.3625 57.8398 32.5185 177.9872 166 L 3.9503 8.3070 118.4123 58.0504 41.8757 179.7265 167 C 4.1747 8.0856 115.1285 61.9768 28.0630 174.3718 168 L 4.3738 7.8170 117.1337 54.1023 41.7472 177.2280 169 G 3.8311 8.1060 107.1779 45.4194 0.0000 173.7107 170 I 3.8748 7.6775 121.1776 60.6048 37.0165 175.8524 171 I 4.1473 8.1995 127.5427 59.7893 37.4109 175.2216 172 S 4.6966 8.0789 120.0528 56.4710 64.5439 174.2686 173 E 4.0153 8.6958 128.7992 59.6468 29.3690 179.4898 174 T 3.8967 7.8548 109.4921 64.9283 68.8672 176.6692 175 S 4.1610 7.7664 116.6682 61.1920 62.8331 176.4648 176 R 3.7910 8.2485 121.8885 59.5278 29.8036 177.9900 177 D 4.3430 8.5205 117.8949 57.2427 41.1367 178.1076 178 A 4.0228 8.1137 121.2067 55.5362 18.4033 179.2046 179 Y 3.8647 8.3799 115.2448 61.2866 38.0174 179.1666 180 R 4.0037 8.2136 119.0421 59.2570 30.0868 179.3880 181 R 3.9336 8.1054 117.9332 59.2894 30.1330 179.2042 182 V 3.5460 7.9638 118.1109 66.0277 31.4108 178.1363 183 I 3.7710 8.0035 119.6794 64.3985 36.9378 178.6143 184 K 4.0703 8.0435 118.9993 59.2681 31.6020 179.6536 185 K 3.9999 8.1041 118.3537 59.3158 32.2678 179.0837 186 L 4.1450 8.0327 119.2928 57.9087 41.5519 179.4176 187 E 3.9916 8.2959 118.3316 59.3421 29.1401 179.2522 188 A 4.0264 8.0031 120.0814 55.1673 18.5222 179.2134 189 Q 4.1613 7.7571 114.8420 57.1820 28.8723 177.3266 190 G 3.9963 7.9015 108.3980 44.9450 0.0000 174.2489 191 V 3.8237 7.4395 112.4380 61.7839 31.9381 176.0695 192 Q 4.3734 9.1398 122.5962 56.3571 29.4789 175.2866 193 G 4.2591 7.3759 105.3430 45.9584 0.0000 172.3585 194 I 5.2812 8.5386 119.9763 59.5368 41.4272 174.9737 195 I 4.7407 9.1547 128.0954 60.5830 39.0615 174.8995 196 F 5.1350 9.3557 126.7355 56.3165 39.4065 177.0618 197 G 3.7510 9.2219 113.4141 48.4051 0.0000 172.6049 198 C 5.0017 7.8186 114.0066 56.4976 32.9458 174.9784 199 T 4.0264 8.4192 110.1882 64.1668 69.1145 176.4553 200 E 3.9215 8.2130 122.1881 59.4732 29.2334 178.9365 201 I 3.5356 7.4288 119.8216 64.4449 36.8509 178.4788 202 T 4.7830 7.5821 110.7959 64.1182 68.5547 176.2159 203 L 4.0400 7.4992 121.3826 56.9620 41.5988 178.2478 204 L 4.2823 7.3960 118.2538 55.4891 43.2653 176.3368 205 V 4.8183 7.4521 110.6125 59.8974 36.1899 174.2821 206 N 5.1721 9.1857 116.5721 52.4437 39.5712 174.6487 207 A 3.9938 8.8161 119.1071 55.7056 18.7479 180.0818 208 Q 4.0336 10.1790 113.5951 59.4649 28.5728 177.5581 209 D 4.5302 7.9837 115.6691 55.1378 41.1241 175.8885 210 A 4.9401 7.5833 121.7766 50.5396 21.4524 176.2973 211 S 4.5804 9.6342 116.5116 58.7245 63.4735 174.2979 212 V 4.7316 7.3085 112.8298 58.1020 35.5840 173.4731 213 P 4.2317 0.0000 0.0000 63.1522 32.1756 175.3779 214 V 4.3659 7.9972 123.0717 61.7377 33.1041 175.1128 215 F 4.4235 9.4044 126.7976 55.6477 41.1055 174.8150 216 D 4.8579 8.4828 125.1815 53.3615 40.5033 176.6543 217 T 4.0863 8.6168 124.2713 64.6909 67.2919 176.1923 218 T 3.8329 8.0377 117.2651 66.5230 68.6365 176.3411 219 A 3.9182 8.1342 122.6194 55.2733 18.2995 179.7530 220 I 3.7067 8.0171 118.4036 64.6215 37.1478 178.1854 221 H 4.2919 8.2568 118.9680 59.2451 29.7935 177.2083 222 A 4.0627 7.9162 122.5818 55.2315 18.1710 179.4383 223 S 3.7154 8.2013 111.4370 61.5047 62.3482 176.2917 224 A 4.0092 8.4208 123.4756 54.9764 18.1009 179.5284 225 A 3.9804 8.2805 119.1266 55.2593 18.5885 179.6541 226 A 3.9755 8.0804 119.3156 55.4239 18.2520 179.3161 227 D 4.2853 8.0691 115.3787 57.6627 41.7174 177.5375 228 Y 4.1761 8.4353 120.0319 60.6779 38.5997 177.7709 229 A 3.9860 8.0542 120.6440 54.8583 18.5646 178.8602 230 L 4.2195 7.4284 114.7169 55.8339 42.1260 177.3146 231 Q 4.1944 7.4595 124.0490 56.3662 29.1201 175.3336 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 8.31 4.43 0.00 1.76 1.84 0.00 1.31 0.00 0.00 1.58 0.00 0.00 2.19 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.46 7.81 4 I 8.95 4.13 2.04 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 1.00 0.96 0.00 0.00 5 L 9.14 4.63 0.00 1.67 1.65 1.03 0.77 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 6 G 9.18 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.96 5.13 0.00 1.68 1.58 0.98 0.66 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 8 I 8.84 4.76 1.81 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 1.13 0.65 0.87 0.00 0.00 9 G 8.88 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 10 G 8.91 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *12 S 7.68 3.76 0.00 3.82 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 W 8.37 4.25 0.00 3.58 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 14 E 6.48 3.38 0.00 1.67 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 15 S 7.70 4.06 0.00 4.05 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 16 T 7.71 4.22 4.50 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 1.27 0.00 0.00 17 I 7.46 3.87 2.12 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.99 1.03 0.00 0.00 18 P 0.00 4.37 0.00 2.00 2.10 0.00 3.88 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 2.04 2.19 0.00 19 Y 7.45 4.14 0.00 3.25 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 20 Y 8.33 4.39 0.00 3.12 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.35 3.87 0.00 1.97 2.06 0.00 3.19 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.69 0.00 *23 I 7.61 4.15 1.95 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 1.67 0.85 0.95 0.00 0.00 24 N 7.86 4.26 0.00 2.75 2.72 0.00 0.00 7.08 7.40 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 25 Q 8.32 3.96 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 26 H 8.08 4.16 0.00 3.33 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.88 3.59 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.00 0.00 0.00 28 K 8.28 4.00 0.00 2.01 1.77 0.00 1.81 0.00 0.00 1.64 0.00 0.00 3.14 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.47 7.81 29 A 7.96 3.96 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 30 Q 8.00 4.04 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 31 L 8.17 4.31 0.00 1.62 1.45 0.67 1.08 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 32 G 8.81 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.39 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.34 4.58 0.00 1.59 1.65 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 35 H 7.82 4.32 0.00 3.28 3.22 0.00 5.60 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.21 4.70 0.00 4.13 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 37 A 8.66 4.12 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 38 K 8.46 4.52 0.00 1.75 1.80 0.00 1.63 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.48 7.81 39 I 8.39 5.07 2.06 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 1.43 0.66 1.10 0.00 0.00 40 I 8.99 4.51 1.93 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 1.16 0.88 0.95 0.00 0.00 41 L 8.64 5.09 0.00 1.65 1.52 0.99 0.81 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 42 Y 9.34 4.31 0.00 3.04 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 43 S 8.34 5.08 0.00 3.93 3.68 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 44 V 8.44 4.25 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.09 0.00 0.00 45 D 8.61 4.64 0.00 2.82 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 9.15 4.63 0.00 3.29 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 47 H 8.64 3.97 0.00 3.31 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.30 3.97 0.00 2.24 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 2.36 2.40 0.00 49 I 7.65 3.64 2.18 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 1.60 0.92 0.98 0.00 0.00 50 E 8.24 3.63 0.00 1.17 1.53 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 2.01 2.13 0.00 51 Q 7.84 3.83 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.17 2.32 0.00 52 L 7.62 3.82 0.00 1.66 1.63 0.86 0.59 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 53 Q 8.18 3.10 0.00 1.73 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.11 0.00 54 A 7.99 4.03 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.29 4.31 0.00 1.72 1.77 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.52 7.81 56 G 7.35 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 D 7.43 4.57 0.00 2.62 2.41 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 58 W 7.96 4.19 0.00 3.48 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 59 Q 8.15 4.00 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 60 T 8.33 3.88 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 1.18 0.00 0.00 61 A 7.92 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 62 A 8.55 3.98 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 0.00 0.00 63 Q 8.05 3.89 0.00 2.25 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 64 L 8.16 3.88 0.00 1.83 1.78 0.92 0.74 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 65 L 7.97 3.97 0.00 1.71 1.63 0.91 0.66 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 66 S 8.43 4.06 0.00 3.97 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 67 N 8.43 4.25 0.00 2.81 2.79 0.00 0.00 6.93 7.84 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 68 A 7.70 2.95 0.71 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 0.00 0.00 69 A 7.94 3.88 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 70 I 7.92 3.58 1.91 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 1.47 0.70 0.73 0.00 0.00 71 S 8.22 4.13 0.00 4.11 4.15 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 72 L 8.14 4.12 0.00 1.88 1.76 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 73 K 8.17 3.93 0.00 1.81 1.94 0.00 1.89 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.50 7.81 74 H 8.22 4.27 0.00 3.38 3.37 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 A 7.67 4.34 1.39 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 76 G 7.75 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.15 4.17 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 78 E 8.80 4.87 0.00 1.88 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 2.27 2.41 0.00 79 V 7.55 4.68 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.83 0.00 0.00 80 I 8.75 4.97 1.85 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 1.11 0.96 0.88 0.00 0.00 81 V 8.85 4.50 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 0.81 0.00 0.00 0.94 0.00 0.00 82 V 8.43 4.42 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 0.73 0.00 0.00 0.82 0.00 0.00 83 C 8.34 3.61 0.00 2.53 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 0.00 0.00 0.00 0.00 84 T 7.35 4.49 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 1.22 0.00 0.00 85 N 8.74 4.70 0.00 2.82 2.92 0.00 0.00 7.03 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 86 T 7.59 3.91 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 *88 H 8.05 4.48 0.00 3.55 3.49 0.00 5.83 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 89 K 7.26 3.45 0.00 0.79 1.12 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.28 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.77 0.89 7.81 90 V 7.37 4.35 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 0.90 0.00 0.00 0.98 0.00 0.00 91 A 8.01 3.96 1.39 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 92 D 8.08 4.31 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 93 D 8.01 4.38 0.00 2.82 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 94 I 7.74 3.77 1.97 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 1.35 2.32 0.86 0.00 0.00 95 E 8.40 3.88 0.00 2.11 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 2.31 2.54 0.00 96 A 7.79 3.99 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 97 A 7.87 4.08 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 98 C 7.85 4.50 0.00 3.07 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 99 G 7.87 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 0.00 100 L 7.56 5.00 0.00 1.52 1.59 0.97 1.16 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 0.00 101 P 0.00 4.58 0.00 2.02 2.20 0.00 3.84 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 102 L 8.66 4.97 0.00 1.63 1.55 0.88 0.90 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 0.00 103 L 8.62 4.29 0.00 1.48 1.58 0.86 1.16 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 0.00 104 H 8.62 4.43 0.00 3.22 3.24 0.00 5.74 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.24 3.31 1.57 0.00 0.00 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 1.71 1.09 0.82 0.00 0.00 106 A 8.01 3.49 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.00 4.12 0.00 2.85 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 0.00 108 A 8.06 3.99 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 0.00 109 T 7.80 3.91 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 1.23 0.00 0.00 110 A 8.01 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.91 3.48 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 1.04 0.00 0.00 0.95 0.00 0.00 112 Q 7.88 4.08 0.00 2.34 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.61 2.64 0.00 113 I 7.85 3.50 1.77 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.47 0.70 0.00 0.00 114 K 8.28 4.00 0.00 1.76 1.84 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.60 7.81 115 Q 8.16 4.09 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.09 0.00 0.00 0.00 0.00 0.00 2.41 2.64 0.00 116 Q 7.57 4.57 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 117 G 7.99 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 0.00 0.00 0.00 118 I 7.57 4.59 1.93 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.89 0.88 0.00 0.00 119 D 9.39 4.91 0.00 2.62 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.08 4.87 0.00 1.78 1.64 0.00 1.64 0.00 0.00 1.89 0.00 0.00 2.80 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.38 1.39 7.81 121 I 9.11 4.92 1.74 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 0.99 0.96 0.85 0.00 0.00 122 G 9.19 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 8.45 5.13 0.00 1.65 1.51 0.84 0.98 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 0.00 124 L 9.17 4.72 0.00 1.74 1.36 0.87 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 125 G 7.90 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 T 8.27 4.31 4.74 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 1.16 0.00 0.00 127 R 9.35 4.06 0.00 1.76 1.99 0.00 3.33 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.64 0.00 128 Y 8.44 4.46 0.00 3.24 3.33 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 0.00 129 T 7.97 3.65 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 0.73 0.00 0.00 *131 E 8.11 4.29 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.40 0.00 132 Q 7.73 4.52 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.19 6.82 0.00 0.00 0.00 0.00 0.00 2.54 2.80 0.00 133 G 8.51 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 0.00 134 F 8.33 4.35 0.00 3.23 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 0.00 135 Y 6.65 4.13 0.00 2.46 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 R 7.56 3.98 0.00 2.27 2.06 0.00 3.13 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 137 G 7.75 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.73 3.84 0.00 1.84 1.91 0.00 2.93 0.00 0.00 2.81 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 139 L 7.66 3.90 0.00 1.84 1.62 0.96 0.50 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 0.00 140 T 7.45 4.57 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 0.00 141 E 8.12 3.87 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 2.31 2.43 0.00 142 K 7.81 4.01 0.00 1.61 1.77 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.12 1.26 7.81 143 H 7.97 4.66 0.00 3.30 3.21 0.00 5.86 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 0.00 144 G 8.08 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 I 7.50 4.26 1.91 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.75 0.83 0.00 0.00 146 E 9.14 4.38 0.00 2.01 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 0.00 2.28 2.24 0.00 147 V 8.38 4.80 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 0.88 0.00 0.00 0.94 0.00 0.00 148 I 8.97 4.59 1.87 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 1.27 1.16 0.95 0.00 0.00 149 T 8.27 4.91 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 1.19 0.00 0.00 150 P 0.00 4.40 0.00 2.08 1.97 0.00 3.63 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.00 0.00 151 D 8.26 4.63 0.00 2.93 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 0.00 152 D 8.64 4.38 0.00 2.69 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 0.00 153 T 7.87 3.83 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 1.20 0.00 0.00 154 D 8.69 4.37 0.00 2.68 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 R 8.37 3.87 0.00 1.95 1.96 0.00 3.11 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.96 0.00 156 E 8.22 3.90 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 157 A 7.92 3.97 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 0.00 158 V 7.98 3.41 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 0.85 0.00 0.00 0.49 0.00 0.00 159 N 8.40 4.37 0.00 3.00 3.04 0.00 0.00 6.90 7.85 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 0.00 160 R 8.36 4.01 0.00 2.13 2.11 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.89 0.00 161 I 8.19 3.80 2.33 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.57 0.77 0.00 0.00 162 I 7.76 3.60 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.03 0.50 0.00 0.00 163 Y 7.73 4.20 0.00 3.04 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 0.00 164 E 8.77 4.38 0.00 2.07 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 0.00 2.38 2.54 0.00 165 E 7.90 4.54 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 166 L 8.31 3.95 0.00 1.60 1.61 0.67 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 167 C 8.09 4.17 0.00 3.00 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 L 7.82 4.37 0.00 1.72 1.70 0.98 0.96 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 0.00 169 G 8.11 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 I 7.68 3.87 1.97 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 1.29 0.58 0.90 0.00 0.00 171 I 8.20 4.15 1.84 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 1.43 0.80 0.85 0.00 0.00 172 S 8.08 4.70 0.00 3.85 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 0.00 173 E 8.70 4.02 0.00 2.01 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 2.39 2.30 0.00 174 T 7.85 3.90 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 175 S 7.77 4.16 0.00 4.05 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 0.00 176 R 8.25 3.79 0.00 1.90 2.05 0.00 3.09 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 177 D 8.52 4.34 0.00 2.91 2.86 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 0.00 178 A 8.11 4.02 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 179 Y 8.38 3.86 0.00 3.11 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 0.00 180 R 8.21 4.00 0.00 2.08 2.02 0.00 3.15 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 181 R 8.11 3.93 0.00 2.03 1.98 0.00 3.15 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 182 V 7.96 3.55 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.84 0.00 0.00 183 I 8.00 3.77 2.10 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.63 0.99 0.00 0.00 184 K 8.04 4.07 0.00 2.00 1.87 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.69 7.81 185 K 8.10 4.00 0.00 1.86 1.86 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.62 7.81 186 L 8.03 4.14 0.00 1.90 1.73 0.93 0.72 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 0.00 187 E 8.30 3.99 0.00 2.20 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 2.36 2.55 0.00 188 A 8.00 4.03 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 0.00 0.00 0.00 0.00 0.00 189 Q 7.76 4.16 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.57 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 190 G 7.90 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 0.00 191 V 7.44 3.82 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.02 0.00 0.00 192 Q 9.14 4.37 0.00 1.96 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 193 G 7.38 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 0.00 0.00 0.00 194 I 8.54 5.28 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.02 1.18 0.00 0.00 195 I 9.15 4.74 1.96 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.76 1.11 0.00 0.00 196 F 9.36 5.13 0.00 2.97 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 0.00 197 G 9.22 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 0.00 198 C 7.82 5.00 0.00 3.18 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 0.00 199 T 8.42 4.03 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 1.21 0.00 0.00 200 E 8.21 3.92 0.00 1.98 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 0.00 2.31 2.40 0.00 201 I 7.43 3.54 1.59 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 1.60 0.63 -0.02 0.00 0.00 202 T 7.58 4.78 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 1.42 0.00 0.00 203 L 7.50 4.04 0.00 1.73 1.70 0.86 0.84 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 0.00 204 L 7.40 4.28 0.00 1.25 1.37 0.80 -0.01 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 0.00 205 V 7.45 4.82 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.99 0.00 0.00 206 N 9.19 5.17 0.00 2.94 2.99 0.00 0.00 7.25 7.93 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 0.00 207 A 8.82 3.99 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 0.00 208 Q 10.18 4.03 0.00 2.19 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.89 0.00 0.00 0.00 0.00 0.00 2.77 2.37 0.00 209 D 7.98 4.53 0.00 2.96 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 0.00 210 A 7.58 4.94 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 0.00 211 S 9.63 4.58 0.00 3.84 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 0.00 212 V 7.31 4.73 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.98 0.00 0.00 213 P 0.00 4.23 0.00 1.78 2.04 0.00 3.85 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 2.25 2.02 0.00 214 V 8.00 4.37 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 -0.43 0.00 0.00 0.62 0.00 0.00 215 F 9.40 4.42 0.00 2.89 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 0.00 216 D 8.48 4.86 0.00 2.65 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 T 8.62 4.09 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 1.34 0.00 0.00 218 T 8.04 3.83 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 0.89 0.00 0.00 219 A 8.13 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 0.00 220 I 8.02 3.71 2.09 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.89 0.99 0.00 0.00 221 H 8.26 4.29 0.00 3.54 3.54 0.00 5.61 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 A 7.92 4.06 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 S 8.20 3.72 0.00 3.84 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 0.00 224 A 8.42 4.01 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 0.00 0.00 225 A 8.28 3.98 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 0.00 0.00 226 A 8.08 3.98 1.39 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 0.00 227 D 8.07 4.29 0.00 2.75 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 0.00 228 Y 8.44 4.18 0.00 3.20 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 0.00 229 A 8.05 3.99 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 230 L 7.43 4.22 0.00 1.75 1.70 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 231 Q 7.46 4.19 0.00 2.12 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 * Residues marked with a * may have inaccurate shift predictions.