NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.6924 8.4444 117.8345 55.3323 30.5045 172.5596 3 Y 4.1162 8.2095 121.2732 58.2235 38.7834 175.3062 4 Q 4.3420 7.7783 126.2351 53.3288 30.4331 172.3114 5 P 4.3153 0.0000 0.0000 61.3684 33.0336 177.3703 6 K 4.1837 8.2557 117.9166 56.3355 32.7193 178.2491 7 Q 3.7354 8.6710 122.0365 57.9664 29.4506 176.9285 8 D 4.7679 7.9101 116.2582 53.3469 39.8900 177.4645 9 L 3.9692 7.9232 123.8150 58.4520 42.0445 178.1685 10 L 4.6699 8.3787 116.9820 54.2225 41.9692 175.8119 11 Q 4.3653 7.7155 119.8232 56.9798 29.2577 175.6943 12 N 4.3091 8.8837 121.0628 54.6403 36.1413 173.8685 13 R 4.8294 7.7649 116.1709 54.4772 33.6271 174.9724 14 I 4.7610 9.1179 125.3372 59.9182 39.0915 174.7824 15 I 4.8599 8.5827 128.0381 59.2999 40.7236 174.1976 16 L 4.9786 8.7676 129.5832 53.5494 44.1502 175.1448 17 V 4.9661 8.8059 125.9829 61.3802 34.1822 174.7598 18 T 4.6653 8.8188 118.5952 60.6351 70.9098 174.2615 19 G 3.9238 8.5680 107.7727 46.8637 0.0000 174.7733 20 A 4.3449 8.0917 121.1403 52.5487 18.9239 179.8508 21 S 4.3784 7.8071 109.7040 59.0764 64.0798 172.9290 22 D 4.4205 8.0251 119.5212 53.7164 44.9920 176.0464 23 G 3.8049 8.3434 110.7860 46.1933 0.0000 175.9391 24 I 3.6240 8.5107 120.8796 64.2218 36.8761 177.9506 25 G 4.1535 7.9480 107.3060 47.2269 0.0000 175.4152 26 R 4.2611 7.7812 122.4023 58.6387 30.0446 178.2457 27 E 3.8078 7.9624 118.4638 59.0649 29.6140 178.5014 28 A 3.3644 8.0978 121.0020 54.8124 18.3580 179.4020 29 A 3.9666 8.0836 119.3866 55.3908 18.5100 179.7975 30 L 3.9588 7.8959 117.3673 58.2947 41.8064 180.0620 31 T 3.9694 8.1595 115.8981 66.9534 68.4416 176.3736 32 Y 4.5429 8.2889 118.8302 61.2498 37.8697 178.7104 33 A 4.2984 8.2556 121.6680 55.3790 18.2904 179.9487 34 R 3.9827 8.0786 115.5530 58.8933 30.2487 177.2429 35 Y 4.9541 7.4067 114.6091 57.1779 37.5842 177.1583 36 G 3.9971 8.2304 110.2792 44.8631 0.0000 174.1309 37 A 4.3769 7.7555 121.0419 52.3940 19.5432 177.9372 38 T 4.3540 8.9302 117.7778 62.4854 69.2140 174.1488 39 V 4.5911 8.2990 126.6404 61.7820 33.2459 175.0223 40 I 4.7223 8.7168 128.0964 59.6419 39.9334 174.3060 41 L 4.9470 9.0320 127.9356 53.2593 43.6712 175.6409 42 L 5.5505 8.0836 123.8773 52.4585 45.1517 176.0839 43 G 4.2587 8.3091 108.1195 46.5930 0.0000 173.3626 44 R 4.3363 8.8746 114.5242 56.2566 31.0684 176.0421 45 N 4.6289 7.7733 117.0986 51.6847 39.6409 174.2778 46 E 3.2983 8.5463 129.4227 59.3340 29.7316 178.4359 47 E 3.7609 7.9813 117.8120 59.2152 29.6430 179.2872 48 K 3.8372 7.9990 118.2738 59.4085 32.1037 179.3087 49 L 3.7647 7.6689 119.2309 57.6875 41.3625 179.5713 50 R 3.5516 7.3379 118.5707 59.3068 29.9792 178.7645 51 R 3.8531 7.7568 117.8254 59.2709 30.0630 179.2222 52 V 3.5628 7.6655 117.6837 65.7897 31.4227 177.8815 53 A 4.0386 8.1280 120.5427 55.4236 18.2166 179.5761 54 Q 3.9732 8.3794 116.8330 59.4435 28.8193 178.6600 55 H 4.0637 8.3817 119.1998 59.2692 29.8830 177.4903 56 I 3.8064 7.9388 121.5340 64.2264 36.9266 178.1521 57 A 4.0924 8.4134 122.0789 55.3537 17.9445 179.4188 58 D 4.1995 8.1681 116.7357 57.0869 40.8792 178.2291 59 E 4.2013 7.4626 117.0992 58.4357 30.4891 178.0050 60 Q 4.2936 8.6013 116.6365 55.6013 28.9391 176.6442 61 H 3.9892 7.9586 115.4509 56.1403 26.9608 174.7689 62 V 4.2015 7.3035 117.7890 60.8581 32.8262 174.7386 63 Q 4.1994 8.6407 129.5887 54.9977 29.4219 173.7569 64 P 4.7168 0.0000 0.0000 62.6737 32.7399 175.9537 65 Q 4.3840 8.7010 120.0810 55.2628 30.3892 174.7798 66 W 5.5789 7.4989 117.5346 54.8525 31.6657 174.4406 67 F 5.0333 9.7087 119.8859 56.0378 42.6615 173.8565 68 T 5.0368 8.9199 113.2907 60.8236 70.4050 174.3281 69 L 4.3131 8.9194 127.6026 54.5072 45.1934 174.1273 70 D 4.7010 8.7803 127.5538 52.9112 41.3174 176.9413 71 L 4.1653 8.5026 127.4537 57.1319 41.9744 178.2959 72 L 4.2179 8.3910 120.4575 56.7429 42.1524 177.1558 73 T 4.5543 7.8458 105.5958 61.0683 70.0709 174.0452 74 C 5.1240 8.2138 117.3912 57.9007 30.6597 173.6704 75 T 4.5202 8.1953 111.7855 60.0492 72.0436 175.4574 76 A 3.9779 8.3698 122.3435 55.2050 18.1953 179.3844 77 E 3.8595 8.1256 117.2984 59.6388 29.8996 178.8353 78 E 4.1242 8.1581 118.3018 59.4482 29.3605 179.2913 79 C 4.1249 7.9570 116.5699 62.7835 28.2255 175.9902 80 R 3.8378 7.9753 120.3149 59.4728 29.5297 178.5654 81 Q 4.0168 8.3287 118.1788 58.8430 28.5880 178.9698 82 V 3.4347 7.6954 118.6088 65.8685 31.5237 177.9849 83 A 3.8561 8.0982 120.6658 55.1679 18.2492 179.3757 84 D 4.2631 8.4936 117.8922 57.4995 40.8503 179.2074 85 R 3.9081 8.0332 118.7169 59.2150 30.0411 179.1966 86 I 3.8362 7.7862 119.6442 64.4401 36.9088 178.4138 87 A 4.3698 8.3754 121.5812 54.4430 18.1604 179.2134 88 A 3.9934 7.7451 118.6786 55.1204 18.4807 178.7143 89 H 4.4760 7.5360 111.4059 55.6332 30.2234 175.1370 90 Y 4.8244 7.9829 118.3577 55.3281 40.9711 174.6740 91 P 4.4977 0.0000 0.0000 64.4713 32.0135 175.5520 92 R 4.4611 7.1666 113.4497 55.8995 31.5740 173.3054 93 L 4.6447 8.1273 117.2876 53.2075 44.4411 177.3783 94 D 4.5527 9.1178 123.9732 55.8395 42.2791 176.5630 95 G 4.3573 7.5162 104.1701 44.8383 0.0000 172.3607 96 V 4.6456 8.5983 122.0191 60.8301 35.0690 173.8581 97 L 4.7987 8.9753 131.4389 53.8964 43.3398 175.0823 98 H 5.0112 9.2881 126.1766 55.2224 27.7228 175.0499 99 N 4.6620 9.2926 121.6936 53.5638 40.4058 175.3108 100 A 4.1481 8.1906 120.7320 52.7438 18.9587 176.5094 101 G 4.1984 8.0203 107.3648 44.8260 0.0000 172.4551 102 L 4.7831 9.0673 123.0001 52.8525 44.4780 176.4892 103 L 3.9837 8.7259 127.7202 56.2499 43.1040 177.6705 104 G 3.9455 8.1351 105.1852 45.2191 0.0000 171.7556 105 E 4.5987 8.3785 120.5971 54.2176 32.4166 175.6253 106 I 3.7651 8.2442 124.4197 60.4215 37.9331 175.8630 107 G 4.1196 7.8702 115.2660 44.8268 0.0000 172.7205 108 P 4.9193 0.0000 0.0000 61.8318 30.4565 180.4062 *110 S 4.3560 8.6273 119.9498 58.7113 64.4290 174.2542 111 E 4.4834 7.9866 118.0692 55.9061 30.5451 176.2975 112 Q 3.9832 8.1240 118.0795 56.3804 29.2720 176.4176 113 D 4.5037 8.7488 122.0107 53.4736 42.3269 175.2584 114 P 4.2644 0.0000 0.0000 65.5219 31.3052 178.4700 115 Q 4.0527 8.7878 119.1643 59.1621 28.9256 178.1320 116 I 3.7679 7.9713 120.4947 63.8680 36.9827 177.8459 117 W 4.1627 8.3547 128.6592 60.8651 30.6353 177.6938 118 Q 4.3419 8.2411 116.3523 59.1155 28.4466 178.3140 119 D 4.6031 8.3699 120.0651 57.2604 40.7992 179.6261 120 V 3.6030 7.7823 115.4018 63.6432 31.2211 177.2600 *122 Q 4.2166 7.9858 119.3610 55.7691 30.6125 177.4283 123 V 3.5899 7.9329 116.7945 66.3281 31.3989 177.8723 124 N 4.4781 8.2462 114.7862 55.4333 38.5390 175.6928 125 V 4.2237 7.5530 116.2958 64.4501 33.2943 177.1177 126 N 4.4538 8.0352 115.2358 56.5569 38.7983 177.0596 127 A 4.1936 8.4571 120.9162 55.3959 18.7484 179.4556 128 T 4.0228 7.5779 114.3851 66.5691 68.3617 176.8737 129 F 4.2619 8.4196 119.3522 58.9902 39.0994 176.2937 *131 L 4.1357 7.8368 120.4732 54.9909 43.9991 178.6416 132 T 3.8938 7.9231 115.1162 66.8821 68.6728 175.9702 133 Q 3.8820 8.0379 120.7031 59.1056 29.0701 177.7061 134 A 4.0598 7.8316 118.8811 54.8372 18.7212 178.0555 135 L 4.2903 7.8601 114.2446 55.6611 42.5923 178.8248 136 L 3.8626 7.8645 119.5265 57.3604 41.0817 177.3795 137 P 4.2262 0.0000 0.0000 65.7130 31.3142 178.5895 138 L 3.8835 7.8071 117.0826 57.8155 41.6056 179.4285 139 L 4.4383 7.8520 120.2116 57.1451 41.3506 178.9433 140 L 4.2467 7.8589 116.4395 55.9208 41.7596 178.3786 141 K 4.2304 7.1767 117.6430 56.4441 32.7287 177.0200 142 S 4.3514 7.0334 113.5437 57.7358 62.9637 173.8698 143 D 4.4561 8.5714 124.8922 57.4401 40.9369 177.1320 144 A 5.1509 6.8369 117.9255 51.8136 20.5542 176.3436 145 G 3.6781 8.1288 108.9454 45.6955 0.0000 169.9221 146 S 4.9543 8.7675 116.4436 56.1236 65.5571 172.2483 147 L 4.9216 8.8614 130.2460 53.2607 44.2100 175.0659 148 V 4.9607 8.6105 126.1970 61.2570 34.5238 174.5732 149 F 5.0663 9.2214 126.3048 56.4363 42.0301 174.6925 150 T 4.9291 8.2475 116.8724 62.3230 70.5416 173.1170 151 S 4.9588 8.4847 125.0946 58.2810 65.0541 172.4655 152 S 4.7307 8.1031 110.3954 57.4269 65.2300 176.9173 153 S 4.0001 8.4178 118.0405 61.4723 62.6321 176.3219 154 V 4.4104 6.8587 110.3729 61.3984 31.2138 176.6139 155 G 3.6516 7.7729 108.8568 45.7965 0.0000 174.9010 156 R 3.8473 7.4406 117.9256 56.5969 32.0990 176.4357 157 Q 4.5730 7.6420 118.7585 54.1336 31.4390 173.9068 158 G 4.0630 8.9765 115.0628 45.6016 0.0000 172.4571 159 R 4.7720 8.3180 120.3858 53.4066 34.0379 174.8024 160 A 4.0368 8.6222 122.6503 54.3121 18.8660 178.1774 161 N 4.9782 8.8960 116.2710 54.0113 36.6518 175.6661 162 W 4.4942 8.2146 118.0456 58.1107 31.4255 179.6859 163 G 3.8058 7.8999 104.1021 44.8270 0.0000 176.7069 164 A 2.5800 7.2638 131.6907 54.5523 18.1723 179.3469 165 Y 3.9623 7.9963 117.1383 60.8584 39.0286 177.9608 166 A 4.0054 8.5224 121.7960 55.5788 18.5323 179.6239 167 T 3.7969 7.8455 114.4604 66.8755 68.4978 177.0140 168 S 4.0881 8.3147 116.4498 61.1778 63.0028 176.6610 169 K 3.8588 7.8709 122.1437 58.8327 31.7737 179.3064 170 F 3.8928 8.4458 118.0580 60.4310 38.6357 177.3105 171 A 3.9879 7.8108 118.9812 55.5223 18.1966 179.3710 172 T 3.7484 7.5610 112.8454 66.8811 68.6397 176.1534 173 E 4.1185 7.7643 118.8890 58.7420 31.0801 179.2823 174 G 3.8200 7.7634 106.6958 45.2129 0.0000 173.4287 *177 Q 4.2269 7.7996 122.5033 56.3216 31.6857 178.2445 178 V 3.5413 7.9654 116.9781 66.0902 31.5293 177.9775 179 L 4.1635 8.0027 117.8736 57.8980 41.0079 179.2257 180 A 4.0910 8.0724 120.1023 55.2888 18.1490 179.0365 181 D 4.2921 7.9550 115.3761 57.6171 41.4100 178.0635 182 E 3.9836 8.2549 118.0064 58.5776 29.6136 177.9323 183 Y 4.6219 7.6916 114.8268 57.5890 38.1641 177.5401 184 Q 4.0309 7.7438 119.6038 58.8998 28.7483 177.0002 185 N 4.7547 8.0901 113.4518 52.8458 38.7618 173.9718 186 R 4.8307 7.6622 118.3116 54.0767 33.5030 175.4814 187 S 4.3680 8.5350 111.4075 60.1087 64.1064 173.3209 188 L 5.0299 7.8623 123.6715 53.6871 43.1491 175.4531 189 R 4.7813 8.7444 122.8059 54.5582 32.5424 175.2325 190 V 4.9733 8.7188 120.4718 61.6182 34.5764 174.0179 191 N 5.3700 9.3039 123.7159 52.4856 44.0586 172.7645 192 C 5.3422 8.7222 116.1860 58.2344 32.1991 173.3167 193 I 4.9571 8.6757 121.9936 59.5763 40.3585 174.1534 194 N 5.1022 9.3853 126.4029 51.2044 39.5032 173.6267 195 P 4.2165 0.0000 0.0000 63.8046 31.7621 177.6317 196 G 3.8739 8.1055 104.9601 44.2081 0.0000 172.8817 197 G 3.7006 8.4778 107.3022 46.3433 0.0000 173.0972 198 T 4.7845 8.1569 121.3201 61.2799 72.4384 174.9131 199 R 4.2956 8.7843 126.2149 56.9695 29.1717 175.2202 200 T 4.8499 8.0032 115.1321 58.8442 73.5951 174.9897 201 S 4.4947 8.3642 114.1946 58.4844 62.8200 176.3938 *203 R 4.3171 8.2170 122.4793 57.4993 31.9442 177.0189 204 A 4.0889 7.9269 120.2925 55.1425 18.6316 179.5485 205 S 4.1292 8.1496 109.8403 61.1780 62.6465 175.3296 206 A 3.7480 7.8245 122.1448 54.1876 18.6727 177.3006 207 F 4.7924 8.2075 114.7153 54.4907 39.3055 173.6254 208 P 4.4822 0.0000 0.0000 64.4084 31.5107 178.1978 209 T 4.3668 7.7605 106.8800 61.2616 69.5081 174.3795 210 E 3.9907 7.9990 124.1612 56.0482 30.4156 175.6843 211 D 4.6059 8.4867 125.1242 52.6841 41.1893 175.1704 212 P 4.3666 0.0000 0.0000 65.3464 31.5739 178.7329 213 Q 4.1382 8.2600 116.2513 57.8863 28.6019 177.0360 214 K 4.2708 7.9492 116.0905 56.7264 32.4789 176.4035 215 L 4.7707 7.3654 119.0790 52.7567 43.9748 176.6730 216 K 4.4374 8.4346 120.3113 56.7000 33.4928 176.8471 217 T 4.5959 8.7166 113.8891 60.0135 70.1300 173.1330 218 P 4.2348 0.0000 0.0000 65.6123 31.6298 178.8947 219 A 3.9755 8.0538 119.8743 55.3164 18.3788 178.4224 220 D 4.4765 7.8145 114.6554 56.7277 40.8321 177.2323 221 I 4.1604 7.2655 114.4945 58.7274 36.6363 173.9180 *223 P 4.6406 0.0000 0.0000 63.2312 33.7823 178.9258 224 L 3.9382 7.5513 119.7752 58.2040 41.6434 178.5721 225 Y 3.9966 8.1602 115.5235 60.9940 37.9393 178.2007 226 L 4.3965 8.0539 118.2965 57.5671 41.9777 178.5627 227 W 4.0140 8.0931 127.0100 60.3773 30.5150 179.2270 228 L 4.0373 7.1272 116.9496 53.4456 41.2250 177.0083 *230 G 3.7217 7.6575 107.4653 45.1245 0.0000 174.2595 231 D 4.3169 8.2994 117.8496 56.6931 40.8389 178.5974 232 D 4.4447 7.9314 117.9506 55.9974 40.8691 176.8793 233 S 3.9662 6.9204 113.4375 57.2978 62.8939 176.1585 234 R 3.8764 7.3906 119.1863 58.9467 29.0621 177.5615 235 R 4.4883 7.8269 115.7419 55.5381 30.3643 175.3090 236 K 4.6885 7.7172 118.3693 54.8562 33.9010 175.6614 237 T 4.6717 7.7987 116.1155 62.1691 70.7296 172.3549 238 G 3.4196 8.9856 112.9194 46.2621 0.0000 174.3513 *240 T 4.0759 7.4541 110.3839 61.9308 68.7975 173.6158 241 F 4.9760 9.1833 127.9180 55.9291 41.9242 174.3436 242 D 5.2600 8.6172 121.8498 52.8660 41.5531 176.7063 243 A 4.0671 8.9899 126.1290 53.7476 19.1699 177.8096 244 Q 4.5865 7.6479 114.0084 53.3440 28.9317 174.2062 245 P 4.2498 0.0000 0.0000 65.2560 31.9646 178.2715 246 G 3.9805 7.9706 106.2937 45.0416 0.0000 172.6152 247 R 4.4942 7.4136 119.6437 53.4721 31.9846 175.4197 248 K 4.0916 8.5716 126.7276 55.3502 32.6675 174.6865 249 P 4.2103 0.0000 0.0000 63.4296 31.8442 175.1539 250 G 3.8990 8.7371 106.9013 43.4771 0.0000 173.0871 251 I 3.0709 7.9567 119.2563 60.3598 38.4110 175.7969 252 A 4.0530 8.8635 130.4135 52.2915 18.8336 177.8363 253 Q 4.2323 8.5177 120.3015 55.9956 29.0993 175.6690 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 H 8.44 4.69 0.00 3.18 3.40 0.00 5.69 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 3 Y 8.21 4.12 0.00 2.81 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 Q 7.78 4.34 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.57 0.00 5 P 0.00 4.32 0.00 2.12 1.54 0.00 3.48 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 6 K 8.26 4.18 0.00 1.97 1.84 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.44 7.81 7 Q 8.67 3.74 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 8 D 7.91 4.77 0.00 3.01 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 9 L 7.92 3.97 0.00 1.96 1.97 1.03 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.38 4.67 0.00 1.91 1.62 0.91 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 7.72 4.37 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.07 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 12 N 8.88 4.31 0.00 2.92 2.92 0.00 0.00 6.83 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 13 R 7.76 4.83 0.00 1.74 1.71 0.00 3.20 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 14 I 9.12 4.76 1.80 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.76 0.67 0.00 0.00 15 I 8.58 4.86 1.75 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.69 0.66 0.00 0.00 16 L 8.77 4.98 0.00 1.59 1.41 0.82 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.81 4.97 2.16 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 1.15 0.00 0.00 1.15 0.00 0.00 18 T 8.82 4.67 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 19 G 8.57 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 0.00 0.00 0.00 20 A 8.09 4.34 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 21 S 7.81 4.38 0.00 3.93 3.93 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 22 D 8.03 4.42 0.00 2.62 2.49 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 23 G 8.34 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 24 I 8.51 3.62 1.96 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 1.48 0.56 0.64 0.00 0.00 25 G 7.95 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 0.00 0.00 0.00 26 R 7.78 4.26 0.00 2.04 2.06 0.00 3.07 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.44 0.00 27 E 7.96 3.81 0.00 2.04 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 2.29 2.23 0.00 28 A 8.10 3.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.08 3.97 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 30 L 7.90 3.96 0.00 1.83 1.75 0.83 0.65 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 31 T 8.16 3.97 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 32 Y 8.29 4.54 0.00 2.99 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 33 A 8.26 4.30 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 34 R 8.08 3.98 0.00 2.11 1.93 0.00 3.22 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.89 0.00 35 Y 7.41 4.95 0.00 3.16 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 36 G 8.23 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 37 A 7.76 4.38 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 38 T 8.93 4.35 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 1.40 0.00 0.00 39 V 8.30 4.59 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.12 0.00 0.00 40 I 8.72 4.72 1.80 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 1.00 0.35 1.11 0.00 0.00 41 L 9.03 4.95 0.00 1.81 1.69 1.01 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.08 5.55 0.00 1.81 1.61 1.07 1.06 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 43 G 8.31 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 44 R 8.87 4.34 0.00 1.94 2.08 0.00 3.04 0.00 0.00 3.18 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 45 N 7.77 4.63 0.00 2.73 2.69 0.00 0.00 6.85 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.55 3.30 0.00 2.04 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 2.19 1.90 0.00 47 E 7.98 3.76 0.00 2.03 1.89 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 2.33 2.29 0.00 48 K 8.00 3.84 0.00 1.87 1.76 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.42 7.81 49 L 7.67 3.76 0.00 0.99 1.14 0.99 0.69 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 50 R 7.34 3.55 0.00 1.56 1.85 0.00 3.08 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 51 R 7.76 3.85 0.00 1.98 1.92 0.00 3.15 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 52 V 7.67 3.56 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 1.00 0.00 0.00 0.87 0.00 0.00 53 A 8.13 4.04 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 8.38 3.97 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.53 2.53 0.00 55 H 8.38 4.06 0.00 3.32 3.44 0.00 5.58 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 56 I 7.94 3.81 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.60 0.96 0.00 0.00 57 A 8.41 4.09 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 58 D 8.17 4.20 0.00 2.70 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 7.46 4.20 0.00 2.03 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 2.23 2.39 0.00 60 Q 8.60 4.29 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.15 0.00 0.00 0.00 0.00 0.00 2.52 2.56 0.00 61 H 7.96 3.99 0.00 3.31 3.40 0.00 5.60 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.30 4.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.01 0.00 0.00 63 Q 8.64 4.20 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 64 P 0.00 4.72 0.00 2.30 2.11 0.00 4.00 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 65 Q 8.70 4.38 0.00 2.15 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 66 W 7.50 5.58 0.00 3.41 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 67 F 9.71 5.03 0.00 2.97 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 68 T 8.92 5.04 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 69 L 8.92 4.31 0.00 1.68 1.64 0.96 1.18 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 70 D 8.78 4.70 0.00 2.79 2.58 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 71 L 8.50 4.17 0.00 1.72 1.76 0.98 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.39 4.22 0.00 1.62 1.90 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.85 4.55 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 1.24 0.00 0.00 74 C 8.21 5.12 0.00 3.15 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 75 T 8.20 4.52 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 76 A 8.37 3.98 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 77 E 8.13 3.86 0.00 2.09 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 2.38 2.47 0.00 78 E 8.16 4.12 0.00 2.23 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 2.35 2.37 0.00 79 C 7.96 4.12 0.00 3.09 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 7.98 3.84 0.00 1.90 2.05 0.00 3.17 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 81 Q 8.33 4.02 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 82 V 7.70 3.43 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.04 0.00 0.00 83 A 8.10 3.86 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 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0.00 0.00 0.00 2.26 2.06 0.00 *110 S 8.63 4.36 0.00 3.98 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 7.99 4.48 0.00 2.05 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 2.24 2.24 0.00 112 Q 8.12 3.98 0.00 2.09 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.97 0.00 0.00 0.00 0.00 0.00 2.71 2.53 0.00 113 D 8.75 4.50 0.00 2.77 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 0.00 114 P 0.00 4.26 0.00 2.20 2.03 0.00 3.66 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 115 Q 8.79 4.05 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 116 I 7.97 3.77 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 1.56 0.48 0.96 0.00 0.00 117 W 8.35 4.16 0.00 3.47 3.28 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 0.00 118 Q 8.24 4.34 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.64 2.81 0.00 119 D 8.37 4.60 0.00 2.90 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 0.00 120 V 7.78 3.60 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 1.03 0.00 0.00 1.07 0.00 0.00 *122 Q 7.99 4.22 0.00 2.38 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 123 V 7.93 3.59 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 1.03 0.00 0.00 0.97 0.00 0.00 124 N 8.25 4.48 0.00 2.78 2.83 0.00 0.00 6.89 7.19 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 0.00 125 V 7.55 4.22 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 1.18 0.00 0.00 0.88 0.00 0.00 126 N 8.04 4.45 0.00 3.01 2.98 0.00 0.00 6.85 7.35 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 0.00 127 A 8.46 4.19 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 0.00 128 T 7.58 4.02 4.56 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 1.31 0.00 0.00 129 F 8.42 4.26 0.00 3.10 3.34 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 *131 L 7.84 4.14 0.00 1.88 1.71 0.89 0.86 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 0.00 132 T 7.92 3.89 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 133 Q 8.04 3.88 0.00 1.64 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 134 A 7.83 4.06 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 0.00 135 L 7.86 4.29 0.00 1.65 1.61 0.82 0.30 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 0.00 136 L 7.86 3.86 0.00 1.71 1.69 1.06 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 137 P 0.00 4.23 0.00 2.13 2.10 0.00 3.68 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.19 0.00 138 L 7.81 3.88 0.00 1.77 1.66 0.86 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 139 L 7.85 4.44 0.00 1.71 1.56 0.77 0.21 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 0.00 140 L 7.86 4.25 0.00 1.72 1.72 1.00 0.90 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 0.00 141 K 7.18 4.23 0.00 1.67 1.84 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.66 7.81 142 S 7.03 4.35 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 0.00 143 D 8.57 4.46 0.00 2.68 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 0.00 144 A 6.84 5.15 1.14 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 0.00 0.00 145 G 8.13 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 0.00 0.00 0.00 146 S 8.77 4.95 0.00 3.72 3.53 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 0.00 147 L 8.86 4.92 0.00 1.63 1.56 0.56 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.61 4.96 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 0.91 0.00 0.00 0.88 0.00 0.00 149 F 9.22 5.07 0.00 3.03 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 0.00 150 T 8.25 4.93 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 151 S 8.48 4.96 0.00 3.80 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.10 4.73 0.00 3.85 3.46 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.42 4.00 0.00 3.96 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 0.00 154 V 6.86 4.41 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 -0.04 0.00 0.00 0.55 0.00 0.00 155 G 7.77 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.44 3.85 0.00 1.77 1.81 0.00 2.95 0.00 0.00 3.07 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.35 0.00 157 Q 7.64 4.57 0.00 2.09 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.10 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 158 G 8.98 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 0.00 0.00 0.00 159 R 8.32 4.77 0.00 2.06 2.00 0.00 3.26 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 160 A 8.62 4.04 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 0.00 161 N 8.90 4.98 0.00 2.77 2.79 0.00 0.00 7.59 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 0.00 162 W 8.21 4.49 0.00 3.57 3.34 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 0.00 163 G 7.90 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 0.00 0.00 0.00 164 A 7.26 2.58 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 Y 8.00 3.96 0.00 3.30 3.34 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 0.00 166 A 8.52 4.01 1.52 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 0.00 0.00 167 T 7.85 3.80 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 1.25 0.00 0.00 168 S 8.31 4.09 0.00 3.89 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 7.87 3.86 0.00 1.68 1.65 0.00 1.56 0.00 0.00 1.39 0.00 0.00 2.50 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.83 0.88 7.81 170 F 8.45 3.89 0.00 3.19 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.81 3.99 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 0.00 172 T 7.56 3.75 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 1.16 0.00 0.00 173 E 7.76 4.12 0.00 1.93 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 2.31 2.33 0.00 174 G 7.76 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 0.00 0.00 0.00 *177 Q 7.80 4.23 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 178 V 7.97 3.54 2.06 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 1.03 0.00 0.00 0.92 0.00 0.00 179 L 8.00 4.16 0.00 1.88 1.94 1.18 1.25 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 0.00 180 A 8.07 4.09 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 0.00 181 D 7.96 4.29 0.00 2.81 2.83 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 0.00 182 E 8.25 3.98 0.00 1.94 1.52 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 2.24 2.52 0.00 183 Y 7.69 4.62 0.00 3.17 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 0.00 184 Q 7.74 4.03 0.00 2.21 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 7.10 0.00 0.00 0.00 0.00 0.00 2.56 2.34 0.00 185 N 8.09 4.75 0.00 2.72 2.87 0.00 0.00 6.70 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 0.00 186 R 7.66 4.83 0.00 2.09 1.98 0.00 3.16 0.00 0.00 3.40 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00 187 S 8.54 4.37 0.00 4.03 4.11 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 0.00 188 L 7.86 5.03 0.00 1.49 1.47 0.81 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 189 R 8.74 4.78 0.00 2.05 1.98 0.00 2.91 0.00 0.00 2.99 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.46 0.00 190 V 8.72 4.97 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 1.24 0.00 0.00 1.01 0.00 0.00 191 N 9.30 5.37 0.00 2.81 2.93 0.00 0.00 6.36 7.02 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 0.00 192 C 8.72 5.34 0.00 2.83 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 0.00 193 I 8.68 4.96 1.73 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.76 0.73 0.00 0.00 194 N 9.39 5.10 0.00 2.75 2.86 0.00 0.00 6.66 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 0.00 195 P 0.00 4.22 0.00 2.33 2.40 0.00 4.06 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 2.10 2.12 0.00 196 G 8.11 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 0.00 197 G 8.48 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 0.00 198 T 8.16 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 1.26 0.00 0.00 199 R 8.78 4.30 0.00 1.83 1.88 0.00 3.21 0.00 0.00 3.27 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 200 T 8.00 4.85 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 1.26 0.00 0.00 201 S 8.36 4.49 0.00 4.02 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *203 R 8.22 4.32 0.00 2.07 2.25 0.00 3.63 0.00 0.00 3.53 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.91 0.00 204 A 7.93 4.09 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 0.00 205 S 8.15 4.13 0.00 3.82 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 0.00 206 A 7.82 3.75 1.13 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 0.00 207 F 8.21 4.79 0.00 3.04 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 0.00 208 P 0.00 4.48 0.00 2.16 2.16 0.00 3.27 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.85 0.00 209 T 7.76 4.37 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 1.23 0.00 0.00 210 E 8.00 3.99 0.00 2.02 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 2.28 2.15 0.00 211 D 8.49 4.61 0.00 2.71 2.54 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 0.00 212 P 0.00 4.37 0.00 2.22 2.09 0.00 3.65 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 213 Q 8.26 4.14 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.91 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 214 K 7.95 4.27 0.00 1.87 1.82 0.00 1.66 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.54 7.81 215 L 7.37 4.77 0.00 1.65 1.57 0.98 0.69 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 0.00 216 K 8.43 4.44 0.00 1.68 1.72 0.00 1.67 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.45 7.81 217 T 8.72 4.60 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 218 P 0.00 4.23 0.00 2.11 2.03 0.00 3.57 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 2.06 2.05 0.00 219 A 8.05 3.98 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 0.00 220 D 7.81 4.48 0.00 2.78 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 0.00 221 I 7.27 4.16 2.00 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 1.38 0.87 0.95 0.00 0.00 *223 P 0.00 4.64 0.00 2.28 2.30 0.00 3.57 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 224 L 7.55 3.94 0.00 1.82 1.65 0.60 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 225 Y 8.16 4.00 0.00 2.97 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 0.00 226 L 8.05 4.40 0.00 1.96 1.84 0.30 0.71 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 0.00 227 W 8.09 4.01 0.00 2.56 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 0.00 228 L 7.13 4.04 0.00 1.60 1.55 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 *230 G 7.66 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 0.00 0.00 0.00 231 D 8.30 4.32 0.00 2.70 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 0.00 232 D 7.93 4.44 0.00 2.54 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 0.00 233 S 6.92 3.97 0.00 2.72 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 0.00 234 R 7.39 3.88 0.00 1.81 2.00 0.00 3.10 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.56 0.00 235 R 7.83 4.49 0.00 1.82 1.98 0.00 3.17 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 236 K 7.72 4.69 0.00 1.89 2.04 0.00 2.04 0.00 0.00 1.79 0.00 0.00 3.16 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.46 1.88 7.81 237 T 7.80 4.67 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 1.24 0.00 0.00 238 G 8.99 3.42 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 0.00 *240 T 7.45 4.08 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 1.05 0.00 0.00 241 F 9.18 4.98 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 0.00 242 D 8.62 5.26 0.00 2.55 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 0.00 243 A 8.99 4.07 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 0.00 244 Q 7.65 4.59 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 245 P 0.00 4.25 0.00 2.15 2.17 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 246 G 7.97 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 0.00 247 R 7.41 4.49 0.00 1.70 1.88 0.00 3.38 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 248 K 8.57 4.09 0.00 1.75 1.70 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.46 7.81 249 P 0.00 4.21 0.00 2.09 1.96 0.00 3.71 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 0.00 250 G 8.74 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 0.00 251 I 7.96 3.07 1.83 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 1.24 0.60 0.91 0.00 0.00 252 A 8.86 4.05 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 Q 8.52 4.23 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.60 0.00 0.00 0.00 0.00 0.00 2.26 2.44 0.00 * Residues marked with a * may have inaccurate shift predictions.