NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2427 7.8827 121.4449 61.2247 38.6541 173.7932 17 V 4.3396 8.6644 126.2860 61.8659 32.6803 174.5473 18 G 3.9735 8.4685 113.9525 46.6572 0.0000 173.5563 19 G 4.2558 7.7391 110.0038 44.4741 0.0000 172.6793 20 Y 4.9699 7.9057 117.5756 55.3986 42.2090 174.9584 21 T 4.1001 8.5543 117.4629 63.9401 68.4650 175.2180 22 C 4.2082 8.5882 125.3767 60.3849 36.5479 175.1202 23 G 4.0651 8.5778 107.0703 44.5198 0.0000 172.8323 24 A 4.2584 8.6080 126.9514 53.9435 18.6433 176.7835 25 N 4.2955 8.9496 118.6192 54.2827 36.1355 175.3912 26 T 4.1305 7.7512 108.4091 62.9976 69.7818 175.1562 27 V 4.0602 7.1039 122.2224 60.4900 31.3067 173.6447 28 P 4.4195 0.0000 0.0000 63.8739 32.2184 178.1231 29 Y 4.9331 6.8604 116.2672 57.0012 38.8892 174.7965 30 Q 4.5591 7.4297 123.4994 56.2500 29.5561 175.5417 31 V 4.8499 9.0205 119.2001 59.6960 35.8217 174.1869 32 S 4.9146 8.7156 117.4791 56.7406 64.5122 172.7407 33 L 4.6491 8.4846 127.7236 53.5052 43.2229 175.0215 34 N 5.7145 9.0319 122.5991 49.9797 41.8198 175.0216 *37 S 4.1843 8.4343 121.7239 58.2744 64.1210 174.5229 38 G 3.9268 9.1710 108.6985 46.2550 0.0000 172.8080 39 Y 4.5499 6.4958 114.6001 55.9877 40.0278 172.9392 40 H 4.4831 8.9141 121.9825 56.6400 30.3260 174.8502 41 F 5.0844 7.9116 118.9824 56.5970 39.5255 173.6281 42 C 4.7673 6.8566 114.9880 56.2376 44.6477 173.4690 43 G 4.3188 8.7942 109.7846 45.5956 0.0000 172.2308 44 G 4.5611 7.7728 102.9308 46.3925 0.0000 172.5792 45 S 5.3925 8.8583 115.4753 56.4101 66.7957 173.7342 46 L 4.7802 9.2837 128.0769 54.9850 42.3966 177.0866 47 I 4.5425 8.7012 119.2512 60.9045 39.4112 174.6856 48 N 4.8843 7.7266 118.2900 52.3951 41.6427 174.8922 49 S 4.2915 8.8019 116.6724 60.6343 63.1890 175.4535 50 Q 4.4843 8.1910 117.8820 55.1340 29.9888 174.4332 51 W 5.6375 8.2962 117.9974 54.8919 33.7314 174.1859 52 V 4.9210 9.1557 123.7834 61.1735 34.1546 174.1497 53 V 4.8395 8.8601 127.5707 61.8550 33.4122 174.7507 54 S 5.0205 8.9712 121.1665 57.3667 66.3529 172.1151 55 A 4.4868 8.5181 120.8862 51.0860 19.7268 178.6460 56 A 3.8242 8.2447 124.3705 55.2036 18.4373 179.3645 57 H 4.5125 8.3488 110.1465 57.7343 28.7306 175.4787 58 C 4.6808 7.7871 116.9336 57.1843 40.4028 173.2114 59 Y 4.2137 7.7102 122.3937 57.9567 38.6769 175.4209 60 K 3.2977 7.1433 123.7829 55.2922 35.0163 175.1957 61 S 4.2061 7.9033 114.6487 59.0935 63.8227 173.4106 62 G 3.6863 8.4451 107.0112 46.7629 0.0000 173.6425 63 I 4.2620 7.5930 120.0450 60.3791 38.9344 174.9346 64 Q 4.7748 8.9535 128.6826 54.3221 31.1858 174.2945 65 V 4.1793 8.7024 127.2355 62.1407 33.4249 174.6868 66 R 5.0754 8.9466 127.1553 54.7234 32.3755 175.0009 67 L 4.7456 9.1135 124.8893 52.7251 44.6768 177.7272 *69 G 4.1852 8.2660 107.9358 45.3514 0.0000 172.6750 70 E 4.3835 8.2442 118.5956 55.4811 29.8154 174.0775 71 D 4.8781 7.9559 118.5768 55.3631 44.6048 174.5887 72 N 4.9228 9.0593 119.9546 53.0734 39.2324 176.2643 73 I 3.7315 8.4386 120.0942 62.4219 37.8451 176.3105 74 N 4.7841 8.5381 117.8594 52.9896 39.1527 174.7615 75 V 4.3197 7.4525 118.1466 60.6528 34.3439 175.0075 76 V 4.0213 8.4907 126.8376 62.9308 31.0914 175.0896 77 E 4.3906 9.6704 127.7399 55.6918 30.5047 176.5880 78 G 3.7947 7.8160 105.5373 45.4949 0.0000 174.2315 79 N 4.8708 8.1192 116.3490 52.8006 39.6157 174.0763 80 E 4.4661 7.7878 117.9820 56.4281 30.6995 176.2255 81 Q 4.4643 9.0795 121.0252 54.2206 32.4586 174.2254 82 F 5.5701 8.8202 122.9394 55.9997 40.9343 175.2857 83 I 4.6700 8.8522 124.7357 59.3917 40.8807 175.4842 84 S 4.6161 8.7258 122.5848 58.1474 64.1906 173.4907 85 A 4.5106 8.5112 125.5265 52.2976 18.2055 177.7587 86 S 4.5137 8.9116 116.3121 59.4226 64.7211 174.4685 87 K 4.6800 7.6499 120.0100 55.1490 35.5165 174.5379 88 S 5.3223 8.8061 121.5618 56.9362 66.1870 173.9665 89 I 4.5909 9.2099 124.3262 59.2853 39.6918 174.7957 90 V 4.0294 8.4106 127.1390 62.4430 32.4796 175.0956 91 H 3.4929 8.6652 127.2518 55.8522 30.0502 174.1929 92 P 4.2290 0.0000 0.0000 65.5528 31.0381 177.1537 93 S 4.6604 7.8713 111.8636 57.8979 63.0863 173.1634 94 Y 4.2996 7.9856 123.4346 57.9945 38.8707 174.6308 95 N 4.6246 8.3774 125.9570 51.3276 39.9979 175.1153 96 S 3.7725 7.5893 120.5153 60.1016 63.6243 175.5472 97 N 4.3181 8.1740 119.0352 55.8638 38.2710 176.0799 98 T 3.8827 7.6638 105.1965 60.7034 69.8905 175.0854 99 L 3.6993 7.8240 120.5291 55.1951 39.9913 173.9369 100 N 4.3624 7.7006 118.3839 54.8820 39.3464 174.6519 101 N 4.8018 8.7248 121.0045 54.2894 35.8158 175.3911 102 D 4.6172 7.9539 117.7107 52.9804 39.6365 174.5997 103 I 4.7776 7.0771 120.9898 59.4679 42.2667 172.6736 104 M 5.4735 9.1113 126.2548 54.3611 36.2962 173.2216 105 L 5.3549 9.3027 124.9024 53.3058 44.7209 175.4308 106 I 5.0447 9.1427 123.5525 59.4762 40.5017 174.3949 107 K 3.7707 8.7260 129.1006 54.8491 33.5399 175.5730 108 L 4.4424 8.0808 127.6511 53.8804 42.0222 177.1623 109 K 4.1482 8.7539 124.8034 59.0688 32.6226 177.0417 110 S 4.6035 7.6936 111.4005 55.8597 66.0675 173.1555 111 A 4.3520 8.4045 123.5656 51.7765 18.6375 177.5024 112 A 4.2260 8.8291 124.8971 52.0858 19.4872 177.0669 113 S 4.4368 9.0072 116.2224 57.3970 63.1149 173.6153 114 L 4.7772 8.4597 127.7226 53.7710 43.3410 175.8568 115 N 4.7713 8.6313 121.2346 52.8722 42.1230 175.2410 116 S 4.2591 8.8303 113.4471 62.3402 63.2921 175.5806 117 R 4.1763 7.8684 117.6260 56.7753 30.6338 176.3159 118 V 4.5429 7.6188 116.6290 60.8866 34.0764 173.7474 119 A 5.1487 8.5646 127.5521 50.5995 22.9021 175.3436 120 S 4.9243 8.7112 114.4398 58.0540 64.6623 173.0871 121 I 4.3530 8.3184 122.1424 59.1656 39.1066 175.6277 122 S 4.3426 8.4408 124.7629 58.5439 63.9262 173.9470 123 L 4.2602 8.3753 123.4515 53.6326 42.3244 175.3144 124 P 4.5407 0.0000 0.0000 63.1184 32.5765 176.0696 125 T 4.1712 8.3161 115.4160 64.9218 69.8392 175.3037 *127 S 4.8157 7.5274 112.5536 57.9827 64.0308 174.1453 128 C 4.4097 8.4114 118.4727 56.7449 40.6586 173.5462 129 A 4.3149 7.9777 124.3307 51.8311 19.2928 177.1862 130 S 4.4076 8.0957 115.1012 56.9879 64.5379 173.7648 *132 A 4.2140 8.3137 125.9935 53.3842 19.2824 177.1507 133 G 3.9837 8.9645 111.5416 45.3785 0.0000 174.1644 134 T 3.9948 7.6051 117.6380 63.6660 69.5720 173.6815 135 Q 4.6502 8.6691 125.5842 55.8566 29.4320 176.0854 136 C 5.1055 9.2924 121.9246 55.0668 45.0449 172.5811 137 L 5.0664 8.9585 123.1101 53.7721 43.4916 175.0260 138 I 5.2575 9.0678 127.8891 58.9227 39.7296 175.0201 139 S 4.8632 8.6949 119.3549 56.3575 66.5447 173.1298 140 G 3.7588 7.4737 108.2540 46.2742 0.0000 172.8884 141 W 4.5665 8.5515 116.9220 56.2812 29.2954 176.9697 142 G 4.0738 8.4987 109.3400 44.3401 0.0000 173.4901 143 N 3.6470 8.3412 118.3245 54.1979 38.9412 174.5440 144 T 5.0523 8.2133 113.2987 60.5494 69.4950 174.3480 145 K 4.5856 7.6871 121.4292 54.7269 34.5915 176.2119 146 S 4.2838 8.7556 117.7937 60.3994 62.6603 174.1633 147 S 4.5241 8.1962 115.9393 58.7883 64.7533 173.4558 148 G 3.8647 9.7978 112.9990 44.2936 0.0000 171.2717 149 T 4.7908 7.9733 114.4752 62.1955 72.4685 173.9821 150 S 4.5598 9.3144 121.0717 57.5155 66.3280 172.1776 151 Y 4.8547 8.7427 125.2798 55.5228 39.6014 174.1773 152 P 4.6812 0.0000 0.0000 62.4554 32.9641 175.6810 153 D 4.6568 8.6959 118.2530 56.1321 41.6541 177.3272 154 V 5.1021 7.4341 110.1129 58.8573 33.9219 175.9444 155 L 3.1376 8.3632 124.4591 54.9561 42.8899 176.1206 156 K 4.8513 8.1356 125.1423 55.0440 35.1258 174.6042 157 C 5.1928 8.4154 118.7807 55.2880 43.2745 172.9984 158 L 5.0322 8.6596 122.3949 53.7769 45.5564 174.6707 159 K 5.1103 9.0677 125.5123 55.4538 33.4755 175.9521 160 A 4.8671 9.0728 126.3929 49.7926 23.1301 173.3176 161 P 5.0332 0.0000 0.0000 61.7461 33.7888 175.4148 162 I 4.3703 8.3754 123.2015 61.7258 37.9562 175.6825 163 L 4.8378 8.7956 127.3947 53.2365 43.2661 177.0521 164 S 4.2848 8.5111 115.3272 58.2645 63.8705 174.8657 165 D 4.3912 8.7963 121.2493 57.6785 40.8757 178.8783 166 S 4.1655 8.0022 114.3730 61.3720 63.1833 176.2770 167 S 4.0533 8.1576 116.8441 61.1617 62.2805 175.2940 168 C 4.3146 8.3748 121.2076 59.8252 42.7777 175.7977 169 K 4.0131 8.3043 120.0507 59.5288 31.3553 179.5674 170 S 4.1769 8.1807 114.7757 61.4936 62.7684 176.2671 171 A 3.9967 7.8207 122.7418 53.8614 19.6882 177.3988 172 Y 4.7931 7.7750 113.4549 55.3810 38.4743 172.8948 173 P 4.6124 0.0000 0.0000 63.4107 32.3096 177.6278 174 G 4.0471 9.1302 110.6006 45.7522 0.0000 173.5352 175 Q 4.5468 8.1318 116.4036 55.4035 30.7704 175.4686 176 I 4.3447 7.8943 119.4997 60.1789 37.9456 175.6437 177 T 4.5025 8.2795 116.2157 59.8761 70.5461 175.5053 178 S 4.3589 8.5269 115.1238 60.3466 63.1452 174.3758 179 N 4.9689 8.2748 118.9395 53.4004 38.4606 173.8962 180 M 5.6247 7.9466 116.9264 53.7251 36.0745 174.6365 181 F 5.1426 8.7940 115.3310 55.7001 42.1628 172.7235 182 C 5.4186 8.9725 116.5860 56.0213 40.8996 172.5658 183 A 5.0793 9.4046 122.4005 50.9657 22.4095 174.4856 184A G 3.9070 7.2710 106.2489 44.4755 0.0000 174.3927 184 Y 4.5677 8.4909 121.5113 56.1080 41.1983 176.0682 185 L 4.1169 8.6921 126.0328 57.4122 41.9876 179.0629 186 E 4.1425 8.1975 115.1706 57.1323 29.9032 177.4295 187 G 3.8600 7.6545 106.4612 45.1983 0.0000 172.7600 188A G 4.0081 9.6184 105.9976 44.7264 0.0000 173.5122 188 K 4.9271 7.3533 117.4137 55.2376 35.4640 175.1528 189 D 4.7135 8.8676 123.4501 53.5136 45.5078 174.8526 190 S 4.8732 8.1868 114.7375 58.2991 64.7820 171.8298 191 C 4.7901 9.4019 119.2689 55.1181 47.1696 172.5253 192 Q 4.3091 8.6525 119.3935 58.0823 28.4811 178.3855 193 G 4.2089 9.2960 110.6792 45.6722 0.0000 173.9800 194 D 4.6663 8.5312 118.8838 55.4631 41.6220 176.6295 195 S 4.4684 8.0925 115.1619 60.3965 63.4904 175.6080 196 G 4.0409 8.9720 112.7554 46.4234 0.0000 173.7156 197 G 4.5391 7.8950 107.6046 44.6705 0.0000 171.1425 198 P 5.0710 0.0000 0.0000 62.3861 33.4123 175.6841 199 V 4.5593 8.7427 121.8704 61.4351 33.9848 174.1165 200 V 4.8639 8.7308 129.0080 61.3047 33.9772 173.6887 201 C 5.1215 8.8303 124.7845 55.6316 43.7517 174.6303 202 S 3.7030 9.7547 120.5626 59.7340 60.1029 173.1451 203 G 3.9246 8.3343 103.4958 45.7961 0.0000 173.6355 204 K 4.6846 7.5948 117.6552 52.9376 35.3657 175.5840 *209 L 4.2474 8.2612 122.5165 55.4765 42.0626 175.7950 210 Q 4.5427 8.8745 125.9225 56.4759 31.0101 175.8769 211 G 5.3097 8.0722 104.4671 45.6075 0.0000 171.3706 212 I 5.2607 8.2034 119.7277 58.8387 41.1117 175.2595 213 V 3.9447 8.9468 127.1961 64.0802 31.8315 174.2866 214 S 4.8528 8.4073 120.4413 58.6431 64.3285 173.7992 215 W 4.7332 7.0666 114.1210 56.3396 31.3395 173.1408 216 G 3.7616 8.1038 107.6051 46.5180 0.0000 174.4190 217 S 4.3865 8.0292 118.0799 56.5229 64.0640 172.9700 *219 G 4.3766 8.0708 117.6579 45.4935 0.0000 170.4135 220 C 4.9338 8.0852 115.7739 56.3303 44.9619 173.9787 221A A 4.3123 9.4657 126.3952 53.1712 16.5151 176.9491 221 Q 4.4950 7.3529 117.2931 56.0512 29.7264 175.8275 222 K 4.0056 8.5014 121.8475 58.3625 32.4932 176.1777 223 N 4.2707 9.2731 121.6359 54.0088 37.0177 175.2875 224 K 4.3202 7.5382 116.6997 53.9290 32.2924 173.7366 225 P 4.6269 0.0000 0.0000 61.8618 33.2716 177.7007 226 G 3.5273 8.4042 107.4194 46.3245 0.0000 172.6556 227 V 4.3272 7.5885 122.6227 60.6364 34.1371 174.0425 228 Y 4.9622 8.0687 124.3254 55.9183 42.0282 175.0601 229 T 4.3250 8.5741 120.5507 63.7955 69.9599 174.1202 230 K 5.1401 9.3721 128.3013 55.3636 31.4104 177.2102 231 V 3.9901 8.9441 126.4936 65.7915 31.4062 174.8635 232 C 4.4306 8.3643 112.8322 58.4182 41.4159 174.8913 233 N 4.2163 8.0462 116.8944 54.4192 38.5303 175.5170 234 Y 4.7827 8.0156 117.7869 57.5706 38.9235 177.4467 235 V 3.6929 7.8094 120.8376 66.0023 31.6116 177.6835 236 S 4.0743 8.0783 112.5101 61.0798 62.3344 175.7508 237 W 4.1688 8.3114 130.6135 60.4576 30.4599 177.7986 238 I 2.9609 8.2906 120.0806 64.1339 36.5825 178.5189 239 K 3.7623 8.0876 119.3793 59.6238 31.6548 179.5027 240 Q 3.9163 7.8758 117.1485 59.0751 28.9063 178.6709 241 T 3.7417 7.5281 117.0872 66.4127 68.1961 176.9111 242 I 3.0234 7.0863 113.4152 63.0684 37.5707 177.3426 243 A 4.2622 7.4095 120.6814 53.2648 18.4251 177.6743 244 S 4.6832 7.6344 110.8599 57.7360 64.9991 173.9832 245 N 4.6787 8.0358 123.4675 53.6667 39.4895 174.1321 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 16 I 7.88 4.24 1.78 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.68 0.86 0.00 0.00 17 V 8.66 4.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.94 0.00 0.00 18 G 8.47 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.74 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 20 Y 7.91 4.97 0.00 2.97 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 21 T 8.55 4.10 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 1.21 0.00 0.00 22 C 8.59 4.21 0.00 2.72 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 23 G 8.58 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.61 4.26 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 25 N 8.95 4.30 0.00 2.90 2.94 0.00 0.00 7.15 7.54 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 26 T 7.75 4.13 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 1.28 0.00 0.00 27 V 7.10 4.06 1.72 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 0.23 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.42 0.00 2.38 2.39 0.00 3.68 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 2.18 2.00 0.00 29 Y 6.86 4.93 0.00 3.28 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.43 4.56 0.00 1.75 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.72 0.00 0.00 0.00 0.00 0.00 1.89 2.49 0.00 31 V 9.02 4.85 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.03 0.00 0.00 32 S 8.72 4.91 0.00 2.99 3.31 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 33 L 8.48 4.65 0.00 0.47 1.06 0.83 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.03 5.71 0.00 2.51 2.46 0.00 0.00 6.78 8.34 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 *37 S 8.43 4.18 0.00 3.65 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 38 G 9.17 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 0.00 0.00 0.00 39 Y 6.50 4.55 0.00 3.14 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 40 H 8.91 4.48 0.00 2.90 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.91 5.08 0.00 3.14 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 42 C 6.86 4.77 0.00 2.12 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 43 G 8.79 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 44 G 7.77 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 0.00 0.00 0.00 0.00 45 S 8.86 5.39 0.00 3.82 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.28 4.78 0.00 1.87 1.68 1.09 0.98 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 47 I 8.70 4.54 1.90 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 1.35 0.94 0.95 0.00 0.00 48 N 7.73 4.88 0.00 2.90 2.91 0.00 0.00 6.94 7.15 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 49 S 8.80 4.29 0.00 4.22 4.16 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 0.00 0.00 0.00 0.00 50 Q 8.19 4.48 0.00 2.01 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.91 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 51 W 8.30 5.64 0.00 3.25 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.16 4.92 2.15 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 1.04 0.00 0.00 0.99 0.00 0.00 53 V 8.86 4.84 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 1.05 0.00 0.00 1.01 0.00 0.00 54 S 8.97 5.02 0.00 3.90 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 55 A 8.52 4.49 1.24 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 56 A 8.24 3.82 0.23 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 57 H 8.35 4.51 0.00 3.40 3.61 0.00 5.56 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.79 4.68 0.00 3.22 3.29 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 59 Y 7.71 4.21 0.00 2.96 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 60 K 7.14 3.30 0.00 1.41 1.25 0.00 0.61 0.00 0.00 1.17 0.00 0.00 2.43 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.71 0.96 7.81 61 S 7.90 4.21 0.00 3.97 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 62 G 8.45 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 0.00 0.00 0.00 63 I 7.59 4.26 1.87 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 1.41 0.82 0.93 0.00 0.00 64 Q 8.95 4.77 0.00 1.98 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 65 V 8.70 4.18 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 0.99 0.00 0.00 0.91 0.00 0.00 66 R 8.95 5.08 0.00 1.66 1.77 0.00 2.66 0.00 0.00 2.54 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.19 0.00 67 L 9.11 4.75 0.00 1.66 1.63 1.05 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.27 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 0.00 0.00 0.00 0.00 70 E 8.24 4.38 0.00 2.17 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 2.38 2.08 0.00 71 D 7.96 4.88 0.00 2.79 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.06 4.92 0.00 2.82 2.82 0.00 0.00 7.18 8.67 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 73 I 8.44 3.73 1.42 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.52 -0.57 0.00 0.00 74 N 8.54 4.78 0.00 2.84 2.88 0.00 0.00 6.63 8.38 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 75 V 7.45 4.32 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 0.78 0.00 0.00 0.99 0.00 0.00 76 V 8.49 4.02 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 0.84 0.00 0.00 0.96 0.00 0.00 77 E 9.67 4.39 0.00 1.96 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 2.28 2.45 0.00 78 G 7.82 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.12 4.87 0.00 2.74 2.80 0.00 0.00 7.15 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 80 E 7.79 4.47 0.00 1.46 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 2.44 2.45 0.00 81 Q 9.08 4.46 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 82 F 8.82 5.57 0.00 2.82 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.85 4.67 1.88 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 1.24 0.88 0.91 0.00 0.00 84 S 8.73 4.62 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.51 4.51 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 86 S 8.91 4.51 0.00 3.77 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 87 K 7.65 4.68 0.00 1.79 1.57 0.00 1.79 0.00 0.00 1.94 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.53 7.81 88 S 8.81 5.32 0.00 3.99 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 89 I 9.21 4.59 2.07 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.01 1.18 0.00 0.00 90 V 8.41 4.03 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 0.71 0.00 0.00 0.87 0.00 0.00 91 H 8.67 3.49 0.00 2.81 3.01 0.00 5.66 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.23 0.00 2.15 2.17 0.00 2.37 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.86 0.00 93 S 7.87 4.66 0.00 3.93 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 94 Y 7.99 4.30 0.00 2.99 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 95 N 8.38 4.62 0.00 2.56 2.44 0.00 0.00 6.56 7.06 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 96 S 7.59 3.77 0.00 3.95 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 97 N 8.17 4.32 0.00 2.75 2.78 0.00 0.00 6.91 7.16 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 98 T 7.66 3.88 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 1.07 0.00 0.00 99 L 7.82 3.70 0.00 1.11 1.79 0.52 1.21 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 0.00 100 N 7.70 4.36 0.00 2.79 2.65 0.00 0.00 7.24 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.72 4.80 0.00 3.04 2.59 0.00 0.00 7.23 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.95 4.62 0.00 3.05 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 0.00 103 I 7.08 4.78 1.43 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 1.38 1.28 0.04 0.00 0.00 104 M 9.11 5.47 0.00 2.14 1.83 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.67 0.00 105 L 9.30 5.35 0.00 1.69 1.79 -0.12 1.07 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 0.00 106 I 9.14 5.04 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.98 0.91 0.00 0.00 107 K 8.73 3.77 0.00 0.79 1.12 0.00 1.15 0.00 0.00 1.34 0.00 0.00 2.58 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.73 0.21 7.81 108 L 8.08 4.44 0.00 1.43 1.57 0.96 0.69 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 0.00 109 K 8.75 4.15 0.00 1.80 1.84 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.36 7.81 110 S 7.69 4.60 0.00 3.92 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 0.00 111 A 8.40 4.35 1.24 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 0.00 112 A 8.83 4.23 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 0.00 113 S 9.01 4.44 0.00 3.88 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 0.00 114 L 8.46 4.78 0.00 1.69 1.61 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.63 4.77 0.00 2.72 2.68 0.00 0.00 6.37 7.16 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 0.00 116 S 8.83 4.26 0.00 3.99 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.87 4.18 0.00 1.83 2.03 0.00 3.21 0.00 0.00 3.16 7.35 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.53 4.82 0.00 3.97 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 0.00 128 C 8.41 4.41 0.00 2.94 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 0.00 129 A 7.98 4.31 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.10 4.41 0.00 3.83 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 *132 A 8.31 4.21 1.24 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 0.00 133 G 8.96 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 0.00 134 T 7.61 3.99 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 1.16 0.00 0.00 135 Q 8.67 4.65 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 136 C 9.29 5.11 0.00 2.76 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.96 5.07 0.00 1.76 1.59 1.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.07 5.26 1.86 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.55 0.99 0.00 0.00 139 S 8.69 4.86 0.00 3.54 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 0.00 140 G 7.47 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.55 4.57 0.00 3.12 2.94 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 0.00 142 G 8.50 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.34 3.65 0.00 2.19 2.56 0.00 0.00 7.13 8.56 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 0.00 144 T 8.21 5.05 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 1.25 0.00 0.00 145 K 7.69 4.59 0.00 1.93 1.86 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.28 1.29 7.81 146 S 8.76 4.28 0.00 3.83 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 0.00 147 S 8.20 4.52 0.00 3.85 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 0.00 148 G 9.80 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 0.00 149 T 7.97 4.79 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 1.50 0.00 0.00 150 S 9.31 4.56 0.00 3.84 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 0.00 151 Y 8.74 4.85 0.00 2.94 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 0.00 152 P 0.00 4.68 0.00 2.42 2.08 0.00 4.10 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 2.15 2.01 0.00 153 D 8.70 4.66 0.00 2.80 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.43 5.10 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 1.05 0.00 0.00 0.95 0.00 0.00 155 L 8.36 3.14 0.00 1.28 1.22 -0.81 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.14 4.85 0.00 1.65 1.49 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.45 7.81 157 C 8.42 5.19 0.00 1.47 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 0.00 0.00 0.00 158 L 8.66 5.03 0.00 1.71 1.46 1.02 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.07 5.11 0.00 1.81 1.82 0.00 1.83 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.63 1.46 7.81 160 A 9.07 4.87 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 0.00 161 P 0.00 5.03 0.00 2.02 2.09 0.00 3.09 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.73 0.00 162 I 8.38 4.37 1.91 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.49 0.87 0.00 0.00 163 L 8.80 4.84 0.00 1.56 1.60 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.51 4.28 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.80 4.39 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.00 4.17 0.00 4.10 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 0.00 167 S 8.16 4.05 0.00 3.94 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 0.00 168 C 8.37 4.31 0.00 3.23 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 0.00 169 K 8.30 4.01 0.00 1.95 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.54 1.64 7.81 170 S 8.18 4.18 0.00 4.00 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 0.00 171 A 7.82 4.00 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.78 4.79 0.00 3.08 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.61 0.00 2.08 2.04 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 174 G 9.13 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 0.00 0.00 0.00 175 Q 8.13 4.55 0.00 2.51 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.61 0.00 176 I 7.89 4.34 1.98 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 1.82 0.91 1.00 0.00 0.00 177 T 8.28 4.50 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 1.25 0.00 0.00 178 S 8.53 4.36 0.00 4.02 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 0.00 179 N 8.27 4.97 0.00 3.09 3.12 0.00 0.00 6.62 7.64 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 0.00 180 M 7.95 5.62 0.00 1.89 2.14 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.65 0.00 181 F 8.79 5.14 0.00 3.13 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 0.00 182 C 8.97 5.42 0.00 2.99 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.40 5.08 1.25 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 0.00 0.00 184A G 7.27 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 0.00 184 Y 8.49 4.57 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 0.00 185 L 8.69 4.12 0.00 1.73 1.73 0.92 0.86 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 0.00 186 E 8.20 4.14 0.00 2.10 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 0.00 2.33 2.27 0.00 187 G 7.65 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 188A G 9.62 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.35 4.93 0.00 1.38 1.66 0.00 0.83 0.00 0.00 0.86 0.00 0.00 2.56 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.18 7.81 189 D 8.87 4.71 0.00 2.83 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 0.00 190 S 8.19 4.87 0.00 4.10 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.40 4.79 0.00 2.92 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.65 4.31 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.17 0.00 0.00 0.00 0.00 0.00 2.57 2.56 0.00 193 G 9.30 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 0.00 0.00 0.00 0.00 194 D 8.53 4.67 0.00 2.94 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 0.00 195 S 8.09 4.47 0.00 4.00 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 0.00 196 G 8.97 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.89 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.07 0.00 2.35 2.40 0.00 3.69 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 2.18 2.19 0.00 199 V 8.74 4.56 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 0.86 0.00 0.00 0.50 0.00 0.00 200 V 8.73 4.86 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.70 0.00 0.00 201 C 8.83 5.12 0.00 2.79 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 0.00 202 S 9.75 3.70 0.00 3.93 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 0.00 203 G 8.33 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 0.00 204 K 7.59 4.68 0.00 1.71 1.64 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.26 4.25 0.00 1.50 1.64 0.97 0.76 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 0.00 210 Q 8.87 4.54 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.42 0.00 0.00 0.00 0.00 0.00 2.42 2.35 0.00 211 G 8.07 5.31 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 0.00 212 I 8.20 5.26 1.94 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 1.31 0.92 0.98 0.00 0.00 213 V 8.95 3.94 2.39 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 1.05 0.00 0.00 1.23 0.00 0.00 214 S 8.41 4.85 0.00 4.03 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 0.00 215 W 7.07 4.73 0.00 3.36 2.98 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 0.00 216 G 8.10 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.03 4.39 0.00 4.09 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 *219 G 8.07 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.09 4.93 0.00 2.94 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 9.47 4.31 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 0.00 221 Q 7.35 4.50 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 222 K 8.50 4.01 0.00 1.71 1.73 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.60 7.81 223 N 9.27 4.27 0.00 2.81 2.81 0.00 0.00 6.79 7.54 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 0.00 224 K 7.54 4.32 0.00 1.63 1.75 0.00 1.42 0.00 0.00 1.21 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.25 1.46 7.81 225 P 0.00 4.63 0.00 2.13 2.10 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 226 G 8.40 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 0.00 0.00 0.00 227 V 7.59 4.33 0.67 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 0.40 0.00 0.00 -0.79 0.00 0.00 228 Y 8.07 4.96 0.00 1.43 2.27 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 0.00 229 T 8.57 4.33 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 1.23 0.00 0.00 230 K 9.37 5.14 0.00 2.14 1.92 0.00 1.80 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.54 1.65 7.81 231 V 8.94 3.99 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 1.14 0.00 0.00 232 C 8.36 4.43 0.00 3.16 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 0.00 233 N 8.05 4.22 0.00 2.29 2.35 0.00 0.00 6.83 7.61 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 0.00 234 Y 8.02 4.78 0.00 3.28 3.31 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 0.00 235 V 7.81 3.69 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 1.13 0.00 0.00 1.03 0.00 0.00 236 S 8.08 4.07 0.00 3.96 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 0.00 237 W 8.31 4.17 0.00 3.54 3.56 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 0.00 238 I 8.29 2.96 1.96 0.00 0.00 1.00 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 0.98 0.69 0.00 0.00 239 K 8.09 3.76 0.00 1.78 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.54 7.81 240 Q 7.88 3.92 0.00 1.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 241 T 7.53 3.74 3.43 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 0.72 0.00 0.00 242 I 7.09 3.02 1.10 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.27 -0.59 0.00 0.00 243 A 7.41 4.26 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 0.00 244 S 7.63 4.68 0.00 3.80 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 0.00 245 N 8.04 4.68 0.00 3.04 2.99 0.00 0.00 6.88 7.56 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 * Residues marked with a * may have inaccurate shift predictions.