NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4756 8.1476 120.3556 55.1623 33.6524 175.6712 2 D 4.3778 8.4705 118.7316 55.9843 39.0424 177.0356 3 K 3.9871 8.8147 120.9617 59.3456 32.5234 180.4085 4 I 3.8064 7.6010 119.6939 64.0710 37.1407 178.3502 5 K 4.1121 8.4859 119.8867 59.6370 31.9395 179.0592 6 Q 3.9883 8.3231 119.8577 59.0957 28.8507 178.1822 7 L 3.9052 7.7723 121.0442 58.2285 42.1416 179.0051 8 F 4.1865 8.2686 117.5527 60.3197 38.7835 177.5624 9 A 4.1151 8.4285 120.5813 55.3920 18.2252 179.3358 10 N 4.3528 8.6914 115.4317 56.5683 38.5317 177.1817 11 N 4.4409 8.5206 118.5263 56.7823 38.9968 176.3634 12 Y 4.1508 8.2955 120.9392 60.8380 38.9469 177.6890 13 S 4.0190 8.4127 114.1102 61.1069 62.4830 175.7709 14 W 4.1290 8.5001 130.7411 60.6813 30.2734 177.8034 15 A 3.0017 8.1789 119.3439 54.6477 17.8099 179.2266 16 Q 3.7084 7.6761 117.4504 59.3116 29.2670 177.7142 17 R 3.8951 7.6007 118.3844 61.6728 30.4986 177.9193 18 M 4.1039 7.5573 120.4647 53.9126 34.2741 175.4674 *33 Q 4.1231 7.8667 120.1403 57.2368 30.0021 174.6994 34 T 4.2495 8.1256 115.9423 61.9517 69.5880 173.1183 35 P 5.0302 0.0000 0.0000 62.4024 32.2422 175.5740 36 H 4.7812 9.2092 116.7446 55.7236 31.1829 173.1705 37 Y 5.2977 7.7755 115.8123 56.1555 42.6163 173.6305 38 L 5.2047 9.0567 125.8845 53.5427 44.1343 174.6917 39 W 5.0635 9.7488 135.0000 55.8537 33.0820 174.3403 40 I 4.9038 8.8070 129.4601 60.0141 38.4390 174.8055 41 A 5.3261 9.0445 128.6892 49.1645 23.3398 173.5493 42 C 5.1561 8.5196 117.9495 58.1812 33.0022 175.0795 43 S 4.1628 8.7633 121.7564 61.1613 62.5745 175.0623 44 D 4.8036 7.9892 117.3906 52.7282 39.5377 176.2827 45 S 4.1294 7.7391 115.2143 58.4136 63.7287 174.7017 46 R 4.0505 8.6493 122.8104 58.1530 30.3842 176.9250 47 V 4.1106 7.4061 118.0409 60.5206 32.5090 174.4566 48 P 4.2873 0.0000 0.0000 62.1058 33.1222 176.8590 49 A 3.0615 8.2454 122.9216 55.3206 18.1117 179.8084 50 E 3.6370 7.7738 116.8648 59.2776 29.4019 178.8922 51 K 3.8803 7.6419 118.1117 59.3310 32.4756 178.3357 52 L 3.9821 7.6214 118.5291 57.4581 41.6508 178.8053 53 T 4.1943 7.7946 107.0131 60.5415 69.8380 173.8372 54 N 4.1255 7.6408 119.0877 54.4512 38.0344 173.6960 55 L 4.5108 7.5194 114.4822 53.2099 43.5523 176.9381 56 E 4.1522 8.5322 121.2010 55.3010 30.1004 175.0033 57 P 4.4648 0.0000 0.0000 64.2165 31.8737 176.1341 58 G 4.1687 9.0957 110.1264 45.8468 0.0000 175.5569 59 E 4.0564 8.6843 119.6978 58.8288 29.7113 176.6570 60 L 5.2230 7.8279 117.7825 53.3380 43.4409 175.9841 61 F 5.1140 9.4325 126.2864 56.4457 41.8460 174.1253 62 V 4.9755 8.0027 125.1969 61.3594 34.2281 173.6732 63 H 4.9627 9.3480 127.7555 54.3710 32.5197 172.7303 64 R 5.7535 8.5903 123.5251 53.4534 33.1321 174.2384 65 N 5.0292 8.5151 119.7897 50.6133 41.9126 173.3446 66 V 3.9613 8.2445 119.1005 63.3470 31.9634 175.3624 67 A 3.6721 8.9663 129.6478 52.5190 16.4586 177.1921 68 N 4.2427 8.1936 112.4814 55.3333 35.9676 173.7259 69 Q 4.4988 8.9861 116.8637 55.2763 30.7805 176.9108 70 V 4.1279 8.7689 121.8469 61.1376 31.6350 174.5161 71 I 3.8868 7.6960 127.6798 59.9698 38.2023 176.7277 72 H 4.0550 8.5871 123.0085 58.8724 28.5766 176.2894 73 T 4.4245 7.6086 106.0810 61.0982 69.0228 174.0099 74 D 4.6500 8.1871 123.0421 54.0960 41.3230 175.9214 75 F 3.7709 8.9089 130.3226 61.5486 39.4512 175.6427 76 N 4.3670 8.6572 116.1219 57.1777 38.6824 176.0788 77 C 3.8850 8.4301 119.4286 62.4911 31.7771 175.8467 78 L 3.9128 8.1208 120.7117 57.7528 41.0300 179.6594 79 S 4.0823 8.2069 115.1923 61.6504 62.7675 176.7222 80 V 3.8356 7.7258 120.7582 66.3205 31.2290 178.2629 81 V 3.6148 7.9900 117.8120 65.9966 31.3898 177.8255 82 Q 3.9172 8.4403 119.7497 59.1388 28.8178 177.4299 83 Y 4.1399 8.4218 120.5934 60.6868 38.8560 177.7182 84 A 3.6134 8.3137 121.9223 55.1543 18.1912 179.8207 85 V 3.4383 7.7524 116.3065 66.3100 31.5449 178.0830 86 D 4.3788 8.4194 117.3806 56.4254 41.1578 177.4395 87 V 4.0377 7.5210 116.2568 64.5684 32.5483 176.8698 88 L 3.8115 7.5056 117.6627 55.1856 41.5712 177.4041 89 K 4.0307 7.7546 115.5693 56.5975 29.3092 175.7200 90 I 3.8094 7.6642 119.3910 61.7551 37.5847 176.0678 91 E 4.7573 8.6672 121.9703 56.4584 31.4483 174.9218 92 H 5.4422 7.8935 119.5152 54.3539 33.2264 172.2224 93 I 5.0161 8.8203 124.4335 59.4825 40.0961 174.6656 94 I 4.4279 8.7561 127.7260 59.3146 40.1428 174.4823 95 I 4.4078 8.1657 128.5931 60.0122 38.6345 174.2462 96 C 5.0491 8.7838 128.6626 57.6721 33.9326 173.8675 97 G 4.2860 9.0518 115.3616 46.0104 0.0000 171.2742 98 H 5.1425 8.0576 113.1193 54.3309 30.7876 173.8918 99 T 3.9469 8.0549 110.9149 61.5067 69.8603 173.0973 100 N 4.0489 8.4166 117.5078 54.9119 37.4010 174.7901 101 C 4.3534 7.8531 117.5545 58.3788 32.5909 172.5529 102 G 3.7825 9.0193 116.2283 47.7443 0.0000 174.9112 103 G 3.7364 8.4256 108.0105 47.8156 0.0000 175.9081 104 I 3.6726 7.6353 121.7829 64.4340 37.3151 178.1440 105 H 4.0967 8.3087 116.8618 58.6345 28.2488 177.7611 106 A 4.0305 8.3033 122.1193 55.1032 18.3041 179.1554 107 A 4.1376 8.0771 118.5038 55.6123 18.5422 179.3822 108 M 4.3915 7.8042 115.4636 56.5819 32.4246 177.1080 109 A 4.3193 7.1717 121.0619 52.1807 19.1630 176.1593 110 D 4.8749 8.5819 118.3192 54.1432 41.4214 176.3302 111 K 4.4323 7.7551 115.9221 54.2473 33.6665 176.1638 112 D 4.7017 8.5341 121.8729 54.1612 40.4310 175.8999 113 L 4.4776 8.6640 126.4328 54.3768 43.4445 177.7939 114 G 3.9881 8.0374 105.2397 43.7933 0.0000 175.1352 115 L 3.9311 8.8865 119.7080 58.6196 41.9141 179.2121 116 I 3.7712 7.9644 117.7047 64.4574 37.8181 177.2318 117 N 4.4033 8.3297 117.2682 56.2646 38.0859 176.9974 118 N 4.3703 7.9456 116.7458 56.0690 39.1188 176.7257 119 W 4.4029 8.3681 129.1749 60.6501 31.0110 177.3872 120 L 4.3657 8.4286 117.2401 56.2550 41.0918 179.0059 121 L 4.0657 7.7726 119.4763 57.7891 41.5232 178.9588 122 H 4.1081 7.6700 115.2873 58.8067 28.5102 177.7858 123 I 3.7178 7.5497 121.1721 64.4659 36.9055 178.5785 124 R 3.9121 7.8645 118.6437 59.0372 29.7235 178.7115 125 D 4.4059 8.3766 119.2999 57.4136 40.8187 178.9539 126 I 3.7745 7.6526 120.0997 63.9674 36.8999 177.9197 127 W 4.4194 8.1888 128.4987 60.9992 30.7206 177.7574 128 F 4.6189 8.0457 117.5589 60.3709 38.0714 177.4467 129 K 3.9766 8.3561 118.8734 59.1375 32.1709 177.7336 130 H 5.1245 8.2572 115.7191 55.6434 30.2175 177.2096 131 G 3.7788 8.1661 110.8152 47.8332 0.0000 175.7102 132 H 4.2916 8.1738 119.5048 59.2232 30.4026 176.3605 133 L 4.0797 8.0648 121.5956 58.6029 41.4578 178.9651 134 L 4.2433 8.4895 118.7106 57.3991 41.3382 179.4883 135 G 3.8981 8.2064 104.6644 46.5523 0.0000 174.5513 136 K 4.3164 8.0289 119.2548 56.6667 32.5986 175.9054 137 L 5.1149 7.1523 120.1260 52.5006 44.2387 175.9029 138 S 4.1895 8.7764 120.1123 57.9829 63.2066 172.9455 139 P 4.2832 0.0000 0.0000 65.8914 31.0798 178.0197 140 E 4.1775 8.1905 112.3212 57.7420 29.6076 177.6538 141 K 4.4142 8.0795 118.8773 56.6700 32.8738 178.2546 142 R 3.8249 7.9443 119.6377 59.0089 30.0294 178.3871 143 A 3.6834 7.8054 120.0916 55.3450 18.1827 179.3206 144 D 4.2302 7.8686 116.7732 57.3854 40.9523 178.4867 145 M 3.9107 7.6952 118.8160 58.5155 32.2825 177.8619 146 L 3.8017 8.2941 120.7891 58.5079 42.0308 178.8389 147 T 3.7666 7.7284 115.4531 66.7842 68.2608 176.6718 148 K 3.9961 7.6890 119.7429 59.5324 32.0790 179.5961 149 I 3.6550 8.0985 120.5632 64.1261 36.8637 177.7394 150 N 4.2264 8.7186 118.3569 56.9459 38.7065 176.9812 151 V 3.5513 7.5845 119.2302 65.8583 31.6006 177.7979 152 A 4.0733 7.8352 120.5249 55.4158 18.2263 179.5407 153 E 4.1405 8.5380 117.2148 59.7084 29.4228 179.6760 154 Q 4.0116 8.4941 118.5022 58.7421 28.7091 178.7879 155 V 3.5736 7.8877 119.5313 65.9729 31.4660 177.5052 156 Y 4.1490 7.9664 119.2611 60.7884 38.4108 177.5087 157 N 4.1430 8.2196 116.4657 56.3238 39.0968 176.6773 158 L 4.0946 8.1880 121.8436 58.2225 41.9946 179.3286 159 G 3.6422 8.0680 103.8566 46.9493 0.0000 174.9351 160 R 4.1945 7.1920 118.0712 55.7543 31.0641 176.9593 161 T 3.9379 6.9093 110.3296 61.1217 69.6437 175.3863 162 S 4.0390 8.6496 118.7976 61.8760 62.7111 176.9438 163 I 3.5617 7.4705 122.6305 64.1911 36.9554 178.4074 164 V 3.1704 7.2906 118.5879 65.2843 31.2060 178.1359 165 K 3.9306 7.7610 118.2647 59.7436 31.9476 179.4493 166 S 4.0916 8.0699 114.9936 61.3234 62.6321 176.6933 167 A 3.8992 7.6429 122.9804 55.0105 18.1919 179.6107 168 W 4.4900 7.9260 117.6999 60.0899 28.9315 178.6450 169 E 4.1484 8.4093 116.7744 58.9632 29.0852 178.3224 170 R 4.4383 7.8468 114.7346 55.6293 29.7439 176.7728 171 G 3.8875 7.9612 106.4789 46.5472 0.0000 173.8859 172 Q 4.0822 8.0331 120.3705 54.9764 29.5818 175.6499 173 K 4.1990 8.5136 126.0610 56.1538 32.5505 175.9878 174 L 4.8957 8.5825 128.6388 53.9270 45.7173 174.0760 175 S 5.3701 9.2537 121.2148 56.6248 66.0263 172.9373 176 L 5.2637 9.0867 123.8523 53.5773 44.1872 175.2289 177 H 5.0660 8.9453 118.2884 54.1617 33.8900 173.1634 178 G 4.1343 8.4850 107.2694 44.8124 0.0000 171.3678 179 W 5.7847 9.1288 126.3187 54.4887 33.5163 175.0048 180 V 5.0768 9.0671 120.8207 61.4045 34.7143 173.6016 181 Y 5.6656 8.7480 125.0454 54.5803 40.8926 173.8554 182 D 4.9150 8.6448 121.7500 53.0323 42.3689 177.7079 183 V 3.7605 8.1940 119.2780 64.3867 31.8197 177.5454 184 N 4.5186 9.3287 117.9251 55.4552 38.4080 175.3796 185 D 4.3357 7.4739 113.0768 51.3935 40.8957 176.4550 186 G 3.9134 8.4699 107.9670 45.6515 0.0000 173.6935 187 F 4.8203 8.0523 119.8769 57.0793 40.3233 174.8779 188 L 4.6631 8.6855 123.7505 54.6941 42.2150 176.3470 189 V 4.2195 9.2393 125.7979 60.8895 33.3719 174.3703 190 D 4.9564 8.5941 128.5074 54.7416 41.3577 175.7748 191 Q 4.2584 9.0738 124.4344 55.8756 28.8866 175.9991 192 G 4.0308 8.4303 107.5213 45.5845 0.0000 174.2387 193 V 3.9641 7.6491 119.2919 62.6251 31.8162 175.3812 194 M 5.0369 8.6064 127.8281 53.8102 34.9042 174.1522 195 A 4.8777 8.9237 127.7385 50.2797 22.2214 176.1637 196 T 4.8139 8.4970 109.9456 59.4896 69.9319 173.9128 197 S 2.7900 5.8684 115.8622 56.1813 66.3442 176.3465 198 R 3.9071 7.6351 121.5121 59.3588 29.8377 177.9112 199 E 3.9314 7.9238 119.0073 59.4944 29.7741 178.7888 200 T 3.9160 7.7706 109.7155 64.2609 68.7476 176.5058 201 L 4.0206 7.6845 123.5416 58.1270 42.1956 178.7352 202 E 4.1516 8.3245 118.4733 59.5212 29.3663 179.4171 203 I 3.7036 7.7957 119.9545 64.5547 37.2313 178.7940 204 S 4.1223 8.1810 115.0733 61.3392 62.8215 175.7035 205 Y 4.0454 8.1018 123.1624 60.6408 38.5292 178.2861 206 R 3.5904 7.9201 118.7566 59.3009 30.1789 178.6064 207 N 4.2125 8.3243 116.1461 56.4394 38.4719 177.3610 208 A 3.9242 8.0086 121.8610 55.1325 18.5263 179.6942 209 I 3.4364 7.4509 118.1013 64.3633 36.8913 178.4804 210 A 3.9272 7.7100 120.4132 55.1926 18.3689 179.3684 211 R 3.9470 8.0918 117.2305 59.5678 29.9406 178.7724 212 L 3.9871 7.9822 118.1392 57.6038 41.6821 178.8945 213 S 4.6132 7.8928 112.6181 58.6000 63.2056 174.6416 214 I 4.0357 7.1439 123.6469 60.2540 35.8609 175.5342 215 L 4.3404 8.0240 125.2014 53.6030 42.8122 177.1306 216 D 4.4906 8.4360 121.6523 54.2516 41.3333 177.5931 217 E 4.0092 8.9073 123.6699 59.3386 29.5823 177.9771 218 E 4.1985 8.1155 114.2098 57.5163 30.2896 176.6796 219 N 4.8541 8.2832 116.7453 53.0190 39.3084 173.7545 220 I 4.6859 7.4829 119.8860 60.1670 38.4427 175.7514 221 L 4.2518 8.4620 124.2215 55.0051 41.5231 176.5502 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 1 M 8.15 4.48 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 2 D 8.47 4.38 0.00 3.00 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 3 K 8.81 3.99 0.00 1.82 1.89 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.53 7.81 4 I 7.60 3.81 2.15 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.92 1.10 0.00 0.00 5 K 8.49 4.11 0.00 1.93 1.91 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.50 7.81 6 Q 8.32 3.99 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 7 L 7.77 3.91 0.00 1.81 1.72 0.77 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 8 F 8.27 4.19 0.00 3.30 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 9 A 8.43 4.12 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 10 N 8.69 4.35 0.00 2.87 2.91 0.00 0.00 6.73 6.93 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 11 N 8.52 4.44 0.00 2.78 3.14 0.00 0.00 6.87 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 12 Y 8.30 4.15 0.00 3.29 3.19 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 13 S 8.41 4.02 0.00 4.04 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 14 W 8.50 4.13 0.00 3.44 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 15 A 8.18 3.00 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 16 Q 7.68 3.71 0.00 1.72 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.82 0.00 0.00 0.00 0.00 0.00 2.01 2.20 0.00 17 R 7.60 3.90 0.00 1.88 1.97 0.00 3.30 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 1.57 1.65 0.00 18 M 7.56 4.10 0.00 1.64 1.37 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 *33 Q 7.87 4.12 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 34 T 8.13 4.25 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 1.07 0.00 0.00 35 P 0.00 5.03 0.00 2.15 2.13 0.00 3.16 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 1.75 1.75 0.00 36 H 9.21 4.78 0.00 2.63 2.66 0.00 5.56 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 37 Y 7.78 5.30 0.00 3.03 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 38 L 9.06 5.20 0.00 2.00 1.67 1.18 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 39 W 9.75 5.06 0.00 3.52 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 40 I 8.81 4.90 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.60 0.98 0.00 0.00 41 A 9.04 5.33 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 42 C 8.52 5.16 0.00 3.37 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 43 S 8.76 4.16 0.00 3.90 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 44 D 7.99 4.80 0.00 2.80 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 45 S 7.74 4.13 0.00 4.15 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.65 4.05 0.00 1.88 2.04 0.00 3.21 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 47 V 7.41 4.11 1.84 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 0.62 0.00 0.00 0.98 0.00 0.00 48 P 0.00 4.29 0.00 2.05 1.83 0.00 3.58 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 2.01 2.06 0.00 49 A 8.25 3.06 -0.03 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 0.00 0.00 50 E 7.77 3.64 0.00 1.92 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 0.00 2.30 2.31 0.00 51 K 7.64 3.88 0.00 1.69 1.81 0.00 1.78 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.46 7.81 52 L 7.62 3.98 0.00 1.53 1.59 0.41 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 53 T 7.79 4.19 4.09 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 0.89 0.00 0.00 54 N 7.64 4.13 0.00 2.82 2.84 0.00 0.00 7.14 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 55 L 7.52 4.51 0.00 1.58 1.59 0.62 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.53 4.15 0.00 2.13 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 0.00 2.44 2.39 0.00 57 P 0.00 4.46 0.00 2.21 2.10 0.00 3.76 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 2.02 2.01 0.00 58 G 9.10 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.68 4.06 0.00 2.24 2.36 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 2.71 2.77 0.00 60 L 7.83 5.22 0.00 1.55 1.64 0.61 0.70 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 61 F 9.43 5.11 0.00 3.07 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 8.00 4.98 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 0.95 0.00 0.00 0.93 0.00 0.00 63 H 9.35 4.96 0.00 3.20 3.13 0.00 5.77 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 8.59 5.75 0.00 1.63 1.77 0.00 3.28 0.00 0.00 3.92 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 65 N 8.52 5.03 0.00 2.79 2.91 0.00 0.00 5.90 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 66 V 8.24 3.96 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 0.87 0.00 0.00 0.80 0.00 0.00 67 A 8.97 3.67 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 68 N 8.19 4.24 0.00 2.95 3.04 0.00 0.00 6.18 7.39 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 69 Q 8.99 4.50 0.00 1.92 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.93 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 70 V 8.77 4.13 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 0.73 0.00 0.00 0.90 0.00 0.00 71 I 7.70 3.89 1.52 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 -0.10 0.58 0.00 0.00 72 H 8.59 4.06 0.00 3.09 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.61 4.42 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 1.22 0.00 0.00 74 D 8.19 4.65 0.00 2.86 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 75 F 8.91 3.77 0.00 3.28 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 76 N 8.66 4.37 0.00 2.90 3.19 0.00 0.00 6.84 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 77 C 8.43 3.89 0.00 3.16 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 78 L 8.12 3.91 0.00 1.71 1.47 0.82 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.21 4.08 0.00 4.27 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 80 V 7.73 3.84 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.96 0.00 0.00 81 V 7.99 3.61 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 0.86 0.00 0.00 0.98 0.00 0.00 82 Q 8.44 3.92 0.00 2.12 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 83 Y 8.42 4.14 0.00 3.15 3.26 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 84 A 8.31 3.61 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 85 V 7.75 3.44 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 0.91 0.00 0.00 0.91 0.00 0.00 86 D 8.42 4.38 0.00 2.81 2.68 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 87 V 7.52 4.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.03 0.00 0.00 88 L 7.51 3.81 0.00 1.44 1.35 -0.10 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 89 K 7.75 4.03 0.00 1.82 1.85 0.00 1.76 0.00 0.00 2.43 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.29 7.81 90 I 7.66 3.81 1.93 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.30 1.04 0.00 0.00 91 E 8.67 4.76 0.00 1.77 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 0.00 2.39 2.39 0.00 92 H 7.89 5.44 0.00 3.27 3.37 0.00 5.57 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 I 8.82 5.02 1.85 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.85 0.89 0.00 0.00 94 I 8.76 4.43 1.06 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.51 -0.78 0.00 0.00 95 I 8.17 4.41 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.59 0.85 0.00 0.00 96 C 8.78 5.05 0.00 2.24 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 97 G 9.05 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 0.00 0.00 0.00 0.00 98 H 8.06 5.14 0.00 2.16 2.62 0.00 5.73 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.05 3.95 4.18 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 1.15 0.00 0.00 100 N 8.42 4.05 0.00 2.82 2.90 0.00 0.00 6.97 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 0.00 101 C 7.85 4.35 0.00 2.90 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 0.00 102 G 9.02 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.43 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 0.00 0.00 0.00 104 I 7.64 3.67 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.70 0.74 0.00 0.00 105 H 8.31 4.10 0.00 3.29 3.32 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.30 4.03 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 0.00 107 A 8.08 4.14 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 0.00 108 M 7.80 4.39 0.00 1.70 1.98 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 1.64 0.00 109 A 7.17 4.32 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 0.00 110 D 8.58 4.87 0.00 2.72 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 0.00 111 K 7.76 4.43 0.00 1.82 1.74 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 112 D 8.53 4.70 0.00 2.64 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 0.00 113 L 8.66 4.48 0.00 1.75 1.71 0.96 0.89 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 0.00 114 G 8.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.89 3.93 0.00 1.78 1.71 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 116 I 7.96 3.77 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.38 0.99 0.00 0.00 117 N 8.33 4.40 0.00 3.10 2.91 0.00 0.00 6.93 7.05 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 0.00 118 N 7.95 4.37 0.00 2.97 2.96 0.00 0.00 6.98 6.96 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 0.00 119 W 8.37 4.40 0.00 3.47 3.32 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 0.00 120 L 8.43 4.37 0.00 1.93 1.76 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 121 L 7.77 4.07 0.00 1.78 1.66 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 122 H 7.67 4.11 0.00 3.12 3.17 0.00 5.62 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 0.00 123 I 7.55 3.72 2.01 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 1.60 0.93 0.87 0.00 0.00 124 R 7.86 3.91 0.00 1.91 1.55 0.00 3.34 0.00 0.00 3.20 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.89 0.00 125 D 8.38 4.41 0.00 2.84 2.76 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 0.00 126 I 7.65 3.77 2.06 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 1.48 1.00 1.01 0.00 0.00 127 W 8.19 4.42 0.00 3.18 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 0.00 128 F 8.05 4.62 0.00 3.07 2.89 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 0.00 129 K 8.36 3.98 0.00 1.89 2.08 0.00 1.84 0.00 0.00 1.90 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.24 1.49 7.81 130 H 8.26 5.12 0.00 3.32 3.32 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.17 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 H 8.17 4.29 0.00 3.18 3.35 0.00 5.75 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 L 8.06 4.08 0.00 1.76 1.89 0.92 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 0.00 134 L 8.49 4.24 0.00 2.09 1.91 0.97 0.96 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 0.00 135 G 8.21 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 0.00 136 K 8.03 4.32 0.00 2.04 1.85 0.00 1.55 0.00 0.00 1.54 0.00 0.00 2.78 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.46 1.56 7.81 137 L 7.15 5.11 0.00 1.61 1.72 0.95 0.87 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 S 8.78 4.19 0.00 4.03 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 0.00 139 P 0.00 4.28 0.00 2.24 2.16 0.00 3.67 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 2.15 2.16 0.00 140 E 8.19 4.18 0.00 2.07 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 0.00 2.27 2.27 0.00 141 K 8.08 4.41 0.00 1.90 1.83 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.58 7.81 142 R 7.94 3.82 0.00 1.81 1.72 0.00 3.28 0.00 0.00 3.27 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 143 A 7.81 3.68 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 D 7.87 4.23 0.00 2.68 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 0.00 145 M 7.70 3.91 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 146 L 8.29 3.80 0.00 1.53 1.55 0.81 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 147 T 7.73 3.77 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 1.18 0.00 0.00 148 K 7.69 4.00 0.00 1.89 1.96 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.55 7.81 149 I 8.10 3.65 1.79 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.62 0.73 0.00 0.00 150 N 8.72 4.23 0.00 2.85 3.01 0.00 0.00 6.84 7.94 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 0.00 151 V 7.58 3.55 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.07 0.00 0.00 152 A 7.84 4.07 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 0.00 153 E 8.54 4.14 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.63 0.00 154 Q 8.49 4.01 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.63 2.72 0.00 155 V 7.89 3.57 2.32 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 1.06 0.00 0.00 1.04 0.00 0.00 156 Y 7.97 4.15 0.00 2.89 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 0.00 157 N 8.22 4.14 0.00 2.84 2.87 0.00 0.00 7.05 7.41 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 0.00 158 L 8.19 4.09 0.00 1.82 1.83 0.84 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 159 G 8.07 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 R 7.19 4.19 0.00 1.64 1.76 0.00 2.21 0.00 0.00 2.68 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.23 0.00 161 T 6.91 3.94 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 1.20 0.00 0.00 162 S 8.65 4.04 0.00 3.99 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 I 7.47 3.56 1.73 0.00 0.00 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 1.44 0.87 0.80 0.00 0.00 164 V 7.29 3.17 1.73 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 -0.51 0.00 0.00 0.65 0.00 0.00 165 K 7.76 3.93 0.00 1.78 1.86 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.58 7.81 166 S 8.07 4.09 0.00 3.80 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 0.00 167 A 7.64 3.90 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 0.00 168 W 7.93 4.49 0.00 3.62 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 E 8.41 4.15 0.00 2.15 2.33 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 2.32 2.55 0.00 170 R 7.85 4.44 0.00 2.01 2.07 0.00 3.13 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.64 0.00 171 G 7.96 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 0.00 0.00 0.00 172 Q 8.03 4.08 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.85 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 173 K 8.51 4.20 0.00 1.78 1.73 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.45 7.81 174 L 8.58 4.90 0.00 1.79 1.65 0.88 0.33 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 0.00 175 S 9.25 5.37 0.00 3.96 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 0.00 176 L 9.09 5.26 0.00 1.66 1.61 1.02 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 177 H 8.95 5.07 0.00 2.24 2.62 0.00 5.56 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 8.49 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 W 9.13 5.78 0.00 3.22 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 0.00 180 V 9.07 5.08 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 0.99 0.00 0.00 0.96 0.00 0.00 181 Y 8.75 5.67 0.00 3.33 3.15 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 0.00 182 D 8.64 4.91 0.00 2.77 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 0.00 183 V 8.19 3.76 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 0.69 0.00 0.00 0.92 0.00 0.00 184 N 9.33 4.52 0.00 2.73 2.84 0.00 0.00 6.75 5.33 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 0.00 185 D 7.47 4.34 0.00 1.87 2.44 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 0.00 186 G 8.47 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 0.00 187 F 8.05 4.82 0.00 3.12 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 0.00 188 L 8.69 4.66 0.00 1.29 1.35 1.01 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 189 V 9.24 4.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.01 0.00 0.00 190 D 8.59 4.96 0.00 2.61 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 Q 9.07 4.26 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.69 0.00 0.00 0.00 0.00 0.00 2.56 2.52 0.00 192 G 8.43 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 0.00 0.00 0.00 193 V 7.65 3.96 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 0.94 0.00 0.00 1.05 0.00 0.00 194 M 8.61 5.04 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.77 0.00 195 A 8.92 4.88 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 0.00 196 T 8.50 4.81 4.14 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 1.21 0.00 0.00 197 S 5.87 2.79 0.00 3.59 3.49 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 0.00 198 R 7.64 3.91 0.00 2.09 1.97 0.00 3.47 0.00 0.00 3.54 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.81 0.00 199 E 7.92 3.93 0.00 2.03 1.84 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 2.33 2.34 0.00 200 T 7.77 3.92 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 1.10 0.00 0.00 201 L 7.68 4.02 0.00 2.01 2.02 1.16 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 202 E 8.32 4.15 0.00 2.24 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 2.46 2.59 0.00 203 I 7.80 3.70 1.88 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 1.79 0.96 0.91 0.00 0.00 204 S 8.18 4.12 0.00 4.32 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 0.00 205 Y 8.10 4.05 0.00 3.08 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 R 7.92 3.59 0.00 2.03 1.90 0.00 3.32 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 207 N 8.32 4.21 0.00 2.99 2.85 0.00 0.00 6.98 7.88 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 0.00 208 A 8.01 3.92 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 0.00 209 I 7.45 3.44 1.51 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.45 0.82 0.00 0.00 210 A 7.71 3.93 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 0.00 211 R 8.09 3.95 0.00 1.97 2.04 0.00 3.13 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 212 L 7.98 3.99 0.00 1.83 1.66 0.89 1.02 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 0.00 213 S 7.89 4.61 0.00 3.95 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 0.00 214 I 7.14 4.04 1.95 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 1.28 0.63 0.90 0.00 0.00 215 L 8.02 4.34 0.00 1.63 1.58 0.92 1.11 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 0.00 216 D 8.44 4.49 0.00 2.87 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 0.00 217 E 8.91 4.01 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 218 E 8.12 4.20 0.00 2.07 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 2.27 2.27 0.00 219 N 8.28 4.85 0.00 2.79 2.83 0.00 0.00 6.84 6.55 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 0.00 220 I 7.48 4.69 1.87 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 1.41 0.64 0.92 0.00 0.00 221 L 8.46 4.25 0.00 1.67 1.59 1.07 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.