NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.4461 8.1927 117.0853 58.2624 65.3716 175.5334 5 I 3.7216 7.3258 120.6706 63.0560 38.3480 174.7471 6 E 2.7073 8.5145 120.1783 57.9979 30.2650 177.1623 7 D 4.5674 7.6983 117.4226 55.0733 39.8917 176.4375 8 T 4.1935 7.8363 118.2258 63.0511 69.5641 171.8016 9 P 4.8815 0.0000 0.0000 62.5926 32.9878 175.1386 10 I 4.8293 8.8525 124.9081 59.3093 40.4743 174.5192 11 V 4.7054 8.4466 126.3481 61.0635 34.3589 174.0280 12 L 5.0936 8.4936 127.0199 53.3691 44.0469 175.5825 13 I 4.7368 9.0043 126.1821 63.1074 38.1296 174.9417 14 G 4.4348 9.7051 115.3213 45.7592 0.0000 171.9940 15 A 4.7452 8.3212 125.2812 51.0352 20.4566 178.0445 16 G 3.9766 7.9221 109.0877 46.0065 0.0000 173.7363 17 N 4.3486 8.7428 116.8963 56.4383 38.7356 176.8335 18 L 3.0488 7.8835 120.7646 57.9240 42.2827 178.6684 19 A 3.9888 7.8804 120.1648 55.3126 18.3784 179.4290 20 T 3.7503 8.0812 114.4257 66.9895 68.5805 176.5877 21 N 4.4191 7.9188 117.9666 56.2838 38.6212 177.3427 22 L 3.5952 8.1955 121.9676 57.8679 42.0984 178.8679 23 A 3.9571 8.4606 121.1021 55.0876 18.2434 179.7647 24 K 3.9759 8.1610 116.7913 59.5385 32.2199 179.4736 25 A 3.8898 7.7996 121.0434 54.9251 18.1445 179.6622 26 L 3.8794 7.6557 117.4054 58.1458 41.8708 178.9098 27 Y 4.3743 8.2202 119.4743 61.1930 38.4705 178.6765 28 R 3.8090 8.2492 117.7681 58.6748 30.2437 178.3089 29 K 4.3135 7.7636 115.4666 56.6270 32.3805 177.6440 30 G 3.8612 7.5926 107.6341 44.8272 0.0000 173.9276 31 F 4.5153 8.0412 117.6634 56.6987 40.1224 175.3494 32 R 4.4518 8.2643 120.0490 55.1866 31.1231 175.3812 33 I 4.5890 8.3433 128.6468 60.3931 37.4091 176.3668 34 V 4.0367 8.9330 122.9953 64.1410 32.9461 176.3780 35 Q 5.0751 7.6396 115.5287 55.6038 31.8067 173.1955 36 V 4.8963 8.7318 119.7270 61.3139 34.7181 173.4012 37 Y 5.6324 9.2074 128.7098 55.5037 41.2648 174.2062 38 S 4.3169 7.2935 118.5266 56.5847 65.8468 174.9400 39 R 3.8715 8.4980 123.2080 58.2239 30.3954 177.8238 40 T 4.5596 7.3592 108.2459 59.4240 71.8082 174.5148 41 E 3.8493 8.7346 124.8047 59.4977 29.6434 178.6352 42 E 3.7933 8.0607 118.5849 59.5238 29.8198 178.9630 43 S 4.0221 7.4558 113.7314 61.2537 62.9204 176.4360 44 A 3.8076 7.6679 123.4875 55.0400 18.1214 179.7329 45 R 2.9959 7.3700 117.1944 59.2199 29.9021 178.1865 46 E 3.8519 7.6614 117.0090 59.6102 29.8056 179.0760 47 L 4.0023 7.6570 119.2304 58.0503 42.1795 178.7494 48 A 4.0062 8.0016 120.7519 55.3208 18.0662 179.6686 49 Q 4.1183 7.9695 115.7509 58.9132 28.7978 178.7734 50 K 4.1279 7.5871 118.4181 58.2317 32.0182 178.1806 51 V 2.6974 6.8494 109.7336 59.5847 33.0075 175.3348 52 E 3.6881 7.8486 116.4992 57.9305 26.7746 173.6646 53 A 4.9336 8.0184 118.1926 49.8438 22.7150 177.5538 54 E 4.4659 8.7645 119.1171 56.5823 30.9915 175.6296 55 Y 5.4991 7.9539 117.9260 56.1554 41.6016 173.9345 56 T 4.7801 9.2273 114.1130 60.8131 71.5345 173.9795 57 T 4.9620 8.6004 113.1365 60.3241 69.4236 173.1271 58 D 4.9649 8.3207 122.2667 52.5211 43.3184 176.4919 59 L 3.7568 8.7134 126.8912 57.5765 41.8417 179.3049 60 A 4.0469 8.4292 120.9180 54.4453 18.3306 177.8504 61 E 4.3586 7.9872 113.7002 56.2816 29.9648 176.7978 62 V 3.9331 7.3655 120.5674 62.2878 31.9514 174.9583 63 N 4.2505 9.2386 126.8523 53.7294 38.9254 172.3360 64 P 4.5843 0.0000 0.0000 63.0821 31.6378 176.3022 65 Y 4.7329 8.5621 115.1097 58.0086 38.5788 175.7817 66 A 4.3125 7.6396 123.5121 51.6276 19.5059 177.3920 67 K 4.2977 8.4441 120.5741 57.6476 34.0377 176.3547 68 L 5.1084 7.5189 121.4088 53.2745 45.4558 174.6247 69 Y 4.9614 8.9397 124.2516 56.4353 40.1154 175.4042 70 I 4.3503 9.0172 127.1582 59.9342 39.1148 175.1536 71 V 4.7367 9.1003 129.0163 61.5691 32.7900 174.8678 72 S 5.3401 9.4527 125.3757 56.3774 63.0728 173.0806 73 L 4.7811 8.1730 123.4082 52.0925 45.6074 177.7403 74 K 4.3362 8.4336 125.6060 56.5323 33.6421 178.9675 75 D 4.5685 8.6716 118.9078 59.8081 40.6048 179.9608 76 S 4.1528 8.2302 116.6946 62.9515 62.1608 177.3251 77 A 4.6045 7.3967 119.9711 54.6086 19.2973 178.0256 78 F 3.5333 8.4370 119.4014 61.2395 39.2541 176.7061 79 A 3.9520 8.1125 118.9937 55.6265 18.2531 178.9414 80 E 3.8448 7.9373 115.5688 58.9524 30.0146 178.2282 81 L 4.5741 7.8009 115.6224 53.8490 42.9571 178.0224 82 L 3.8293 7.5159 121.4454 58.5248 42.0898 178.9400 83 Q 4.1720 8.0311 117.2510 58.5064 28.5506 178.5647 84 G 3.5765 7.9275 105.7499 47.4661 0.0000 175.4478 85 I 3.7606 7.5217 121.5445 63.9580 37.2619 178.1239 86 V 3.8502 7.3343 111.2219 61.8302 32.2806 176.8190 87 E 3.9778 7.5444 118.2548 57.2472 29.7932 176.8823 88 G 3.8197 8.6349 109.5361 46.2779 0.0000 173.7268 89 K 4.5084 7.5737 118.2241 54.4419 33.7814 176.7689 90 R 4.1157 7.7236 116.9128 56.0631 30.6110 177.7616 91 E 3.9137 9.0132 122.9685 59.4608 29.5028 177.8350 92 E 3.9857 8.0383 112.5726 56.4756 30.2994 176.5274 93 A 4.1988 7.5565 123.5588 52.8485 19.2164 176.9411 94 L 4.8268 8.8242 124.6753 53.5764 45.4643 175.3874 *96 V 5.0937 8.3807 109.4837 61.9989 33.4393 174.4489 97 H 6.3000 9.3863 117.6928 53.4005 32.1673 173.9314 98 T 5.3934 9.0643 105.4030 60.6727 69.5735 173.6073 99 A 4.5173 8.4752 124.7778 51.3673 19.9060 178.6892 100 G 2.7028 8.3417 111.3613 47.5607 0.0000 174.6372 101 S 4.6467 7.7759 113.3966 57.8528 63.7274 173.1550 102 I 4.4165 7.3979 121.3753 58.5902 39.2828 174.8409 103 P 5.0223 0.0000 0.0000 61.6482 30.6240 178.8496 *105 N 4.7346 8.7413 113.1796 51.9635 39.0422 176.4772 106 V 3.3711 7.2536 111.7835 64.5235 31.7952 177.7944 107 W 4.4298 7.7069 118.4372 58.6090 29.2697 176.1389 108 E 3.9248 7.3866 117.5386 57.1877 29.4131 177.0347 109 G 4.0048 9.0334 111.2461 45.7221 0.0000 173.9680 110 H 4.6729 7.9534 115.6460 57.4509 29.4718 176.0790 111 V 4.6638 7.4041 109.7177 58.7489 35.4474 173.6586 112 P 4.4361 0.0000 0.0000 65.1252 31.5639 176.4198 113 H 4.7278 7.8764 115.3605 53.8696 31.7754 171.7970 114 Y 4.4642 7.2602 120.5999 56.2007 41.9966 173.4788 115 G 4.1210 7.5437 105.0311 46.5504 0.0000 171.4773 116 V 5.0649 8.5621 119.3058 61.1935 34.7580 174.8837 117 F 5.5182 9.6573 129.7221 56.3272 40.2656 170.8761 118 Y 5.0808 9.6384 124.0739 55.0804 39.8113 172.9057 119 P 3.9062 0.0000 0.0000 60.2850 33.8961 175.3227 *121 Q 3.6716 8.2062 117.5467 56.1580 29.5949 174.9912 122 T 4.0038 8.0246 117.5353 61.3761 67.8982 174.0854 123 F 5.0920 8.4741 126.6534 55.9015 42.1097 174.6801 124 S 4.8293 8.3454 118.2247 56.7008 66.9709 175.4504 125 K 4.0066 8.8320 123.0758 59.9216 31.9155 178.2374 126 Q 4.3502 8.0087 114.1177 55.9285 28.7039 175.3988 127 R 4.5609 7.6308 118.4301 54.4325 32.5317 174.4392 128 E 4.4844 8.8119 125.0555 55.8957 30.5539 176.4018 129 V 4.4218 8.1118 114.9870 59.2698 35.5523 175.2175 130 D 4.5953 8.5547 122.7150 53.8594 40.7693 176.8439 131 F 3.9527 9.1342 127.0212 60.1235 39.5173 177.9070 132 K 4.0812 8.5309 119.4591 58.3754 31.8867 177.8002 133 E 4.4946 7.5766 114.3980 55.9185 29.5900 175.6160 134 I 3.8173 7.4377 121.4221 59.7825 37.0583 174.0795 135 P 4.2791 0.0000 0.0000 62.9447 32.5091 174.9908 136 F 4.5758 8.8619 127.9832 56.4109 41.6281 173.7595 137 F 5.5649 9.3512 126.1777 56.1707 41.2496 175.1535 138 I 5.3477 9.0762 123.7608 59.6373 40.6921 174.2132 139 E 5.2081 9.3081 126.2027 54.7951 32.8491 173.8402 140 A 5.1847 8.3722 125.2781 50.5497 22.6409 177.3357 141 S 3.8288 8.6363 114.6164 60.3947 63.1858 174.9758 142 S 4.6167 7.3360 115.9151 56.2367 67.0863 175.0032 143 T 3.8779 8.4639 119.0406 66.9446 68.1428 176.7665 144 E 4.0379 8.0849 120.0511 59.3903 29.5414 178.9144 145 D 4.3804 8.0967 118.4531 57.2152 40.7860 178.6281 146 A 4.0398 8.4585 121.5114 55.0990 18.4053 179.5030 147 A 3.9544 8.4641 119.7340 55.1444 18.4481 179.5182 148 F 4.1106 8.2758 119.1079 61.5521 39.5356 177.2790 149 L 3.7829 8.2153 118.5251 57.8737 41.4684 179.7610 150 K 4.0034 8.4345 118.3545 59.3090 31.6900 179.3166 151 A 3.9595 7.7616 120.3413 55.0058 18.5483 179.4883 152 I 3.7398 7.4370 118.0182 64.5891 37.1695 178.5605 153 A 3.2629 8.2946 121.8017 55.0211 16.5320 179.8204 154 S 4.2793 8.6526 115.3566 60.8837 62.6023 176.6348 155 T 4.0249 7.6122 111.2305 63.5387 68.7991 175.6823 156 L 4.4809 7.1898 121.2616 54.7985 42.8034 176.1485 157 S 5.1440 7.7011 112.4075 56.5863 64.9305 173.7675 158 N 4.7109 8.9063 123.2898 53.9801 39.1075 175.8697 159 R 4.2452 8.0853 118.0873 54.0492 29.9239 173.9149 160 V 4.3719 6.9818 118.4078 61.1842 33.5313 174.8462 161 Y 5.0435 8.7155 125.2767 56.1894 42.0806 174.3990 162 D 5.2539 9.0161 122.7324 54.1604 41.7285 175.7200 163 A 5.0523 8.8596 124.4458 50.5036 22.8150 175.7170 164 D 4.8509 9.4288 121.3599 53.6656 41.8723 178.0987 165 S 4.1824 8.6794 116.0119 61.5459 62.6334 176.7838 166 E 3.9245 8.0483 121.7039 59.4970 29.6437 178.4914 167 Q 3.9713 8.0903 117.5961 59.1507 28.6659 179.0347 168 R 3.7234 7.9978 119.5383 58.9983 30.0104 178.5468 169 K 3.8492 8.1467 118.5219 59.6021 32.1658 179.2042 170 S 4.0947 7.7795 114.7199 61.7486 62.7081 176.9501 171 L 3.9332 7.8410 121.3758 58.0437 41.3638 179.0578 172 H 4.2743 8.4564 118.4389 59.0605 29.2384 177.0106 173 L 3.8429 8.2199 122.1881 58.2174 41.8951 178.8463 174 A 4.1263 7.9931 120.2287 55.2043 18.1819 179.4788 175 A 3.9285 8.2842 119.4449 54.9168 18.3066 180.1161 176 V 3.3316 7.6222 117.1590 65.9200 31.6668 178.1500 177 F 3.7120 7.4450 116.3290 60.9340 38.6107 177.8021 178 T 4.0163 8.0627 113.9253 66.0797 68.5186 175.2229 179 C 4.5213 8.1067 116.9019 61.5041 29.6689 176.1294 180 N 4.2660 7.6302 117.1597 56.5547 38.1149 177.5919 181 F 4.5485 7.7998 117.8308 60.6378 38.9935 177.7889 182 T 3.8653 7.3086 113.5894 66.6713 68.5810 175.8358 183 N 3.9272 7.9190 118.8162 56.4130 38.9232 177.1035 184 H 4.4689 8.0679 120.4038 56.1885 29.9674 176.6601 *186 Y 4.9562 7.9721 118.0351 57.7937 40.1036 177.6354 187 A 3.8941 8.1309 121.4215 54.9761 18.3102 179.7458 188 L 3.8673 8.0723 117.3495 57.8314 41.6738 179.2764 189 A 4.0546 8.2280 120.0240 55.4193 18.2689 179.2548 190 A 4.1608 8.3103 119.0098 55.5168 18.5050 179.6137 191 E 3.9348 8.3723 117.0395 59.4531 29.1051 179.4702 192 L 4.0396 8.2376 120.3476 58.3137 42.1976 178.9629 193 L 4.1264 8.3914 119.3668 57.7299 41.5502 179.4790 194 K 3.9836 8.3598 119.6555 59.3955 31.9485 178.7765 195 K 3.9569 7.9805 118.6040 58.5658 31.9882 176.6850 196 Y 4.5167 7.3639 115.1268 57.4093 38.5640 175.2115 197 N 4.2501 7.9645 114.3056 54.6087 36.8228 174.5530 198 L 4.8853 8.2163 115.8053 52.1010 45.5192 175.5803 199 P 4.5914 0.0000 0.0000 62.0919 32.3379 177.1290 200 F 4.2996 8.8836 122.3839 61.4329 39.5084 176.0885 201 D 4.2209 8.1781 119.2834 57.2247 40.7694 178.9213 202 V 3.7520 6.7710 113.0165 60.8297 30.6517 177.4809 *204 L 4.1677 8.0882 120.5847 54.4265 43.8732 177.6717 205 P 4.1796 0.0000 0.0000 65.9425 31.1126 178.6056 206 L 4.0285 7.7123 116.9097 57.5802 41.7116 179.3231 207 I 3.6851 7.5525 119.3455 64.4220 36.9900 177.9902 208 D 4.3099 8.3185 119.9572 57.3256 40.7103 178.3551 209 E 3.9064 8.1567 119.6768 59.7552 29.4028 179.0239 210 T 3.9010 7.8861 114.1478 66.4807 68.6519 176.3288 211 A 4.2049 8.0324 122.7337 55.2473 18.4650 179.9625 212 R 3.8954 8.2598 114.8109 59.1942 29.3015 178.7781 213 K 3.9369 8.1873 120.4794 59.3250 31.9490 178.2367 214 V 4.7017 7.2876 110.9850 61.8235 31.7899 177.5096 215 H 4.3040 8.0153 116.6845 58.3992 28.6016 176.9511 216 E 4.2259 8.0862 118.7905 57.4423 30.6767 176.5019 217 L 4.7619 7.4178 118.5114 52.3281 44.1872 176.0309 218 E 4.2596 8.5277 121.0851 56.0755 30.4262 176.2715 219 P 4.2479 0.0000 0.0000 66.0544 31.1261 179.0047 220 K 3.9581 8.0022 115.4486 59.9018 32.0373 178.9641 221 T 4.0925 7.7249 114.8073 66.0896 68.5077 176.5258 222 A 4.2262 7.7882 121.4297 53.0747 18.8201 177.5059 223 Q 3.8489 7.3730 118.5932 57.0806 29.2852 175.8970 224 T 4.5638 8.4795 114.1709 59.3393 72.2573 172.4192 225 G 3.8739 8.5849 106.8362 44.0932 0.0000 172.3409 226 P 4.4861 0.0000 0.0000 63.5975 31.9512 177.9878 227 A 4.0183 7.6253 121.9317 54.6929 19.0611 179.7892 228 I 3.7552 8.0489 116.1111 64.7732 37.1073 177.5180 229 R 4.1489 7.9992 115.7543 56.3199 30.9311 175.4415 230 Y 3.1162 7.5722 117.9788 57.9588 37.2523 170.8533 231 D 4.4784 8.0290 120.7634 54.8145 40.6032 176.2011 232 E 3.8747 8.4483 125.6288 58.4011 30.0199 178.5796 233 N 4.2798 7.8577 117.4200 56.7464 38.9694 176.9369 234 V 3.5700 7.6776 112.9486 64.4230 31.7426 178.7111 235 I 3.8983 7.9420 119.8623 64.0822 36.8011 178.6087 236 G 3.5786 8.0444 106.6222 47.9706 0.0000 175.1338 237 N 4.2486 8.2673 118.6604 56.4395 38.6860 176.9147 238 H 4.2362 8.2078 116.2981 58.7529 28.7677 177.6048 239 L 3.9883 7.7092 120.1066 57.3601 41.6407 180.1480 240 R 3.9333 8.0663 117.7196 56.6326 30.2482 177.4088 *242 L 4.3119 7.8095 114.2410 53.5070 43.4008 178.3514 243 A 4.5315 7.7238 123.0203 54.7930 18.2616 179.5723 244 D 4.5089 8.1103 113.9363 56.7488 41.1002 176.3651 245 D 4.7404 8.0288 118.1222 50.6681 41.3516 172.4308 246 P 4.3241 0.0000 0.0000 65.3938 32.0763 179.0045 247 A 4.1926 7.8793 117.1650 52.9407 17.9916 178.6447 *249 Q 4.2355 8.2000 121.8588 57.6091 30.9534 177.4367 250 R 3.9894 8.3922 117.8671 59.2293 29.9487 178.4083 251 L 3.9744 7.9108 118.7103 57.9831 41.6496 178.6433 252 Y 3.9791 8.1419 118.8752 60.7888 38.6375 177.8311 253 E 4.1327 8.2696 119.4907 59.5030 29.7638 178.8374 254 L 4.1199 8.1562 119.0701 57.6313 41.5818 179.4335 255 L 3.9732 8.3504 119.4899 57.7943 41.4601 179.7864 256 S 4.0187 8.1093 115.0728 61.6406 62.8207 176.4206 257 R 3.8741 8.5130 121.8442 59.7592 29.4574 178.4473 258 S 4.0812 8.0451 111.7854 61.2993 62.7496 175.7464 259 I 3.8423 8.0212 122.8373 64.7727 36.6836 177.6215 260 H 4.1893 8.2519 117.6107 59.7009 29.7086 176.8031 261 E 4.0245 8.1456 118.8060 58.4027 29.2829 177.7880 262 R 4.3294 7.7280 122.0718 56.1578 30.6170 175.7229 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 4 S 8.19 4.45 0.00 3.67 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 5 I 7.33 3.72 1.88 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 1.47 1.39 0.88 0.00 0.00 6 E 8.51 2.71 0.00 1.76 1.69 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 2.08 1.47 0.00 7 D 7.70 4.57 0.00 2.79 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 8 T 7.84 4.19 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 1.45 0.00 0.00 9 P 0.00 4.88 0.00 2.10 2.20 0.00 3.67 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.02 0.00 10 I 8.85 4.83 1.85 0.00 0.00 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 1.04 1.03 0.85 0.00 0.00 11 V 8.45 4.71 1.60 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 1.02 0.00 0.00 0.77 0.00 0.00 12 L 8.49 5.09 0.00 1.73 1.61 0.93 0.64 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 13 I 9.00 4.74 1.95 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 1.32 0.92 0.84 0.00 0.00 14 G 9.71 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.32 4.75 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.92 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 17 N 8.74 4.35 0.00 2.84 3.02 0.00 0.00 6.50 6.74 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 18 L 7.88 3.05 0.00 1.75 1.64 1.09 1.18 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 19 A 7.88 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 20 T 8.08 3.75 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 1.21 0.00 0.00 21 N 7.92 4.42 0.00 2.46 3.17 0.00 0.00 6.74 6.56 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 22 L 8.20 3.60 0.00 1.74 1.69 1.08 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.46 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.16 3.98 0.00 1.99 1.94 0.00 1.68 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.50 7.81 25 A 7.80 3.89 0.60 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 26 L 7.66 3.88 0.00 1.86 1.65 0.87 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 8.22 4.37 0.00 3.08 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 28 R 8.25 3.81 0.00 1.87 1.97 0.00 3.37 0.00 0.00 3.28 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.87 0.00 29 K 7.76 4.31 0.00 2.15 1.97 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.61 1.76 7.81 30 G 7.59 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 0.00 0.00 0.00 31 F 8.04 4.52 0.00 2.98 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 32 R 8.26 4.45 0.00 1.89 1.87 0.00 3.10 0.00 0.00 3.18 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 33 I 8.34 4.59 1.92 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 1.36 0.76 0.92 0.00 0.00 34 V 8.93 4.04 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 0.73 0.00 0.00 0.93 0.00 0.00 35 Q 7.64 5.08 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 36 V 8.73 4.90 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 1.00 0.00 0.00 0.94 0.00 0.00 37 Y 9.21 5.63 0.00 3.18 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.29 4.32 0.00 3.70 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.50 3.87 0.00 1.81 1.97 0.00 3.27 0.00 0.00 3.38 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 40 T 7.36 4.56 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 41 E 8.73 3.85 0.00 2.10 2.00 0.00 0.00 0.00 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 2.44 0.00 42 E 8.06 3.79 0.00 2.02 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 2.32 2.36 0.00 43 S 7.46 4.02 0.00 3.82 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.67 3.81 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.37 3.00 0.00 1.06 1.62 0.00 3.20 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 46 E 7.66 3.85 0.00 1.95 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 2.29 2.36 0.00 47 L 7.66 4.00 0.00 1.72 1.58 0.86 1.01 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 48 A 8.00 4.01 1.48 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 0.00 0.00 49 Q 7.97 4.12 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 50 K 7.59 4.13 0.00 1.76 1.75 0.00 1.58 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.52 7.81 51 V 6.85 2.70 1.83 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 0.53 0.00 0.00 0.90 0.00 0.00 52 E 7.85 3.69 0.00 2.16 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 2.26 2.27 0.00 53 A 8.02 4.93 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 54 E 8.76 4.47 0.00 2.07 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 2.33 2.28 0.00 55 Y 7.95 5.50 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 56 T 9.23 4.78 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 1.49 0.00 0.00 57 T 8.60 4.96 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 1.24 0.00 0.00 58 D 8.32 4.96 0.00 2.73 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 59 L 8.71 3.76 0.00 1.62 1.50 0.70 -0.12 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 60 A 8.43 4.05 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 61 E 7.99 4.36 0.00 2.21 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 2.30 2.24 0.00 62 V 7.37 3.93 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 0.79 0.00 0.00 0.91 0.00 0.00 63 N 9.24 4.25 0.00 2.77 2.80 0.00 0.00 7.23 8.43 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 64 P 0.00 4.58 0.00 1.95 1.96 0.00 3.11 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.43 0.00 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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 74 K 8.43 4.34 0.00 1.76 1.72 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.44 1.10 7.81 75 D 8.67 4.57 0.00 2.71 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 76 S 8.23 4.15 0.00 3.70 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.40 4.60 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 F 8.44 3.53 0.00 3.30 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 79 A 8.11 3.95 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 80 E 7.94 3.84 0.00 1.97 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 2.30 2.45 0.00 81 L 7.80 4.57 0.00 1.59 1.46 0.94 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.34 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 0.00 0.00 0.00 101 S 7.78 4.65 0.00 3.85 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 0.00 102 I 7.40 4.42 1.55 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.43 0.36 0.00 0.00 103 P 0.00 5.02 0.00 2.34 1.74 0.00 3.71 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 2.06 1.84 0.00 *105 N 8.74 4.73 0.00 3.14 3.20 0.00 0.00 5.94 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.25 3.37 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 0.27 0.00 0.00 0.11 0.00 0.00 107 W 7.71 4.43 0.00 2.55 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 0.00 108 E 7.39 3.92 0.00 2.15 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 1.01 0.00 0.00 117 F 9.66 5.52 0.00 3.15 3.10 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 0.00 118 Y 9.64 5.08 0.00 3.11 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 0.00 119 P 0.00 3.91 0.00 1.87 0.49 0.00 3.42 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.58 0.00 *121 Q 8.21 3.67 0.00 1.48 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.97 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 122 T 8.02 4.00 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 1.09 0.00 0.00 123 F 8.47 5.09 0.00 3.07 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 0.00 124 S 8.35 4.83 0.00 3.87 3.73 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 0.00 125 K 8.83 4.01 0.00 1.76 1.88 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.45 1.72 7.81 126 Q 8.01 4.35 0.00 2.07 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.72 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 127 R 7.63 4.56 0.00 1.72 1.81 0.00 3.34 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 128 E 8.81 4.48 0.00 2.05 1.93 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 2.35 2.32 0.00 129 V 8.11 4.42 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 0.69 0.00 0.00 1.06 0.00 0.00 130 D 8.55 4.60 0.00 2.79 2.60 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 0.00 131 F 9.13 3.95 0.00 3.28 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 K 8.53 4.08 0.00 1.82 1.91 0.00 1.95 0.00 0.00 1.92 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.61 1.43 7.81 133 E 7.58 4.49 0.00 2.06 1.93 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 2.26 2.40 0.00 134 I 7.44 3.82 1.66 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.32 0.50 0.00 0.00 135 P 0.00 4.28 0.00 2.09 2.07 0.00 3.41 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.15 0.00 136 F 8.86 4.58 0.00 2.81 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 F 9.35 5.56 0.00 3.34 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.08 5.35 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 1.19 1.12 1.07 0.00 0.00 139 E 9.31 5.21 0.00 2.16 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 2.29 2.47 0.00 140 A 8.37 5.18 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 0.00 141 S 8.64 3.83 0.00 3.33 2.63 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 0.00 142 S 7.34 4.62 0.00 4.33 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 T 8.46 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 1.23 0.00 0.00 144 E 8.08 4.04 0.00 2.04 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 2.46 0.00 145 D 8.10 4.38 0.00 2.84 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 0.00 146 A 8.46 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 A 8.46 3.95 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 F 8.28 4.11 0.00 3.21 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 L 8.22 3.78 0.00 1.98 1.95 1.04 0.55 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 0.00 150 K 8.43 4.00 0.00 1.84 1.83 0.00 1.94 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.59 7.81 151 A 7.76 3.96 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 0.00 152 I 7.44 3.74 1.76 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.68 0.43 0.00 0.00 153 A 8.29 3.26 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 8.65 4.28 0.00 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 0.00 155 T 7.61 4.02 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 156 L 7.19 4.48 0.00 1.97 1.83 0.73 0.54 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 0.00 157 S 7.70 5.14 0.00 4.16 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.91 4.71 0.00 2.93 2.80 0.00 0.00 6.76 7.21 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 0.00 159 R 8.09 4.25 0.00 1.57 1.62 0.00 3.13 0.00 0.00 3.24 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 160 V 6.98 4.37 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 0.64 0.00 0.00 0.73 0.00 0.00 161 Y 8.72 5.04 0.00 2.89 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 0.00 162 D 9.02 5.25 0.00 2.68 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 0.00 163 A 8.86 5.05 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 D 9.43 4.85 0.00 2.74 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 0.00 165 S 8.68 4.18 0.00 3.89 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 0.00 166 E 8.05 3.92 0.00 2.03 1.93 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 2.36 2.38 0.00 167 Q 8.09 3.97 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.70 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 168 R 8.00 3.72 0.00 1.92 1.97 0.00 2.57 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.50 0.00 169 K 8.15 3.85 0.00 1.93 1.81 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.44 7.81 170 S 7.78 4.09 0.00 4.04 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 0.00 171 L 7.84 3.93 0.00 1.67 1.58 0.12 0.70 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 0.00 172 H 8.46 4.27 0.00 3.20 3.37 0.00 5.61 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 L 8.22 3.84 0.00 1.77 1.81 1.04 1.45 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 0.00 174 A 7.99 4.13 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 0.00 175 A 8.28 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 7.62 3.33 1.75 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 0.10 0.00 0.00 0.73 0.00 0.00 177 F 7.45 3.71 0.00 3.28 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 0.00 178 T 8.06 4.02 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 0.00 179 C 8.11 4.52 0.00 2.94 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 0.00 180 N 7.63 4.27 0.00 2.57 2.78 0.00 0.00 7.05 8.13 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 0.00 181 F 7.80 4.55 0.00 3.06 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 T 7.31 3.87 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 0.84 0.00 0.00 183 N 7.92 3.93 0.00 2.85 2.76 0.00 0.00 6.93 7.32 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 0.00 184 H 8.07 4.47 0.00 3.42 3.43 0.00 5.86 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *186 Y 7.97 4.96 0.00 3.18 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 0.00 187 A 8.13 3.89 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 0.00 188 L 8.07 3.87 0.00 1.69 1.73 0.88 0.56 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 0.00 189 A 8.23 4.05 1.55 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 0.00 0.00 190 A 8.31 4.16 1.27 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 0.00 0.00 0.00 191 E 8.37 3.93 0.00 2.24 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 2.34 2.51 0.00 192 L 8.24 4.04 0.00 1.82 2.03 1.05 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 193 L 8.39 4.13 0.00 1.82 1.99 0.99 0.73 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 0.00 194 K 8.36 3.98 0.00 1.99 2.01 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 195 K 7.98 3.96 0.00 1.78 2.03 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.84 1.25 7.81 196 Y 7.36 4.52 0.00 3.03 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 N 7.96 4.25 0.00 2.87 2.87 0.00 0.00 6.62 7.13 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 0.00 198 L 8.22 4.89 0.00 1.75 1.54 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 199 P 0.00 4.59 0.00 2.38 2.20 0.00 3.71 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 1.96 0.00 200 F 8.88 4.30 0.00 3.02 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 D 8.18 4.22 0.00 2.65 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 V 6.77 3.75 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.92 0.00 0.00 *204 L 8.09 4.17 0.00 1.57 1.62 0.86 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 205 P 0.00 4.18 0.00 2.08 2.07 0.00 3.45 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 206 L 7.71 4.03 0.00 1.63 1.69 0.89 0.85 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 0.00 207 I 7.55 3.69 1.81 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.84 0.65 0.00 0.00 208 D 8.32 4.31 0.00 2.80 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 0.00 209 E 8.16 3.91 0.00 2.15 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 2.36 0.00 210 T 7.89 3.90 4.45 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 1.28 0.00 0.00 211 A 8.03 4.20 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 0.00 212 R 8.26 3.90 0.00 2.04 2.18 0.00 2.83 0.00 0.00 3.08 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.91 0.00 213 K 8.19 3.94 0.00 2.19 1.88 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.50 7.81 214 V 7.29 4.70 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 1.13 0.00 0.00 1.00 0.00 0.00 215 H 8.02 4.30 0.00 3.26 3.38 0.00 5.64 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 E 8.09 4.23 0.00 2.07 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 2.29 2.46 0.00 217 L 7.42 4.76 0.00 1.69 1.55 0.93 1.14 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 0.00 218 E 8.53 4.26 0.00 2.02 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 2.39 2.34 0.00 219 P 0.00 4.25 0.00 2.14 2.12 0.00 3.59 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 220 K 8.00 3.96 0.00 1.71 1.87 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.52 7.81 221 T 7.72 4.09 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 1.21 0.00 0.00 222 A 7.79 4.23 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 0.00 223 Q 7.37 3.85 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 224 T 8.48 4.56 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 1.25 0.00 0.00 225 G 8.58 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 0.00 226 P 0.00 4.49 0.00 2.17 2.27 0.00 3.70 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 2.08 2.00 0.00 227 A 7.63 4.02 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 0.00 228 I 8.05 3.76 1.90 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 1.44 0.60 0.94 0.00 0.00 229 R 8.00 4.15 0.00 1.82 2.02 0.00 3.56 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 230 Y 7.57 3.12 0.00 2.69 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 D 8.03 4.48 0.00 2.72 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 E 8.45 3.87 0.00 2.10 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 2.57 2.59 0.00 233 N 7.86 4.28 0.00 2.80 2.86 0.00 0.00 7.24 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 0.00 234 V 7.68 3.57 1.91 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 0.68 0.00 0.00 0.97 0.00 0.00 235 I 7.94 3.90 1.64 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.84 0.00 0.00 236 G 8.04 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 0.00 237 N 8.27 4.25 0.00 2.70 2.86 0.00 0.00 7.18 8.10 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 0.00 238 H 8.21 4.24 0.00 2.82 2.42 0.00 5.68 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 L 7.71 3.99 0.00 1.70 1.70 1.01 1.25 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 0.00 240 R 8.07 3.93 0.00 2.01 2.03 0.00 3.10 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 *242 L 7.81 4.31 0.00 1.71 1.69 0.75 0.86 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 0.00 243 A 7.72 4.53 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 0.00 244 D 8.11 4.51 0.00 2.66 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 0.00 245 D 8.03 4.74 0.00 2.53 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 P 0.00 4.32 0.00 2.21 2.13 0.00 3.65 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 2.13 0.00 247 A 7.88 4.19 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 *249 Q 8.20 4.24 0.00 2.45 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 250 R 8.39 3.99 0.00 2.01 1.93 0.00 3.16 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 251 L 7.91 3.97 0.00 1.81 1.72 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 252 Y 8.14 3.98 0.00 3.13 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 E 8.27 4.13 0.00 2.26 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 0.00 2.39 2.50 0.00 254 L 8.16 4.12 0.00 1.75 1.71 0.93 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 255 L 8.35 3.97 0.00 1.60 1.64 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 256 S 8.11 4.02 0.00 4.13 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 0.00 257 R 8.51 3.87 0.00 2.06 2.16 0.00 3.08 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 258 S 8.05 4.08 0.00 4.05 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 0.00 259 I 8.02 3.84 2.02 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 1.41 0.75 0.94 0.00 0.00 260 H 8.25 4.19 0.00 3.48 3.56 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 0.00 261 E 8.15 4.02 0.00 1.97 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 2.49 2.47 0.00 262 R 7.73 4.33 0.00 1.76 1.79 0.00 3.36 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.