NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2358 8.1614 121.7824 55.9253 33.7935 176.1751 4 G 4.1224 9.0129 114.5072 45.7546 0.0000 172.5926 5 E 4.1755 9.0551 121.2279 59.1260 29.6425 177.2411 6 E 4.0550 7.8868 118.2424 58.9666 29.5469 178.4894 7 L 4.0528 7.8913 117.0860 55.7173 40.3328 177.3601 8 F 4.8651 8.0900 117.5632 57.3082 39.6656 177.0129 9 T 3.9827 8.1381 111.7962 63.1082 69.1330 173.6912 10 G 4.3426 7.1411 109.7385 43.4133 0.0000 171.7317 11 V 4.0985 8.3868 119.2426 62.8522 32.2734 176.1746 12 V 4.6579 8.8528 128.1700 60.1717 34.2630 173.0091 13 P 4.7998 0.0000 0.0000 63.0042 32.9410 175.0535 14 I 5.0518 8.6837 122.6244 59.5573 40.7396 174.3902 15 L 5.2040 8.7926 125.6072 52.8799 45.3532 175.6160 16 V 4.9327 8.8649 122.5011 61.2084 34.9361 174.0076 17 E 5.2012 9.3928 126.6193 54.5796 33.2389 174.2758 18 L 5.2220 9.1649 126.7812 53.2325 45.5185 174.5657 19 D 5.1173 8.9679 125.5492 52.4090 43.7320 175.4493 20 G 3.5223 8.5308 109.8332 44.0649 0.0000 171.2950 21 D 5.1401 8.6619 120.7556 52.5426 44.6938 174.2430 22 V 4.7581 8.8986 126.8156 61.3355 34.0381 175.0954 23 N 4.3711 10.3276 126.8524 54.2931 36.6744 175.7744 24 G 3.8724 8.6470 105.4335 45.5659 0.0000 174.0654 25 H 4.5465 8.3506 118.6824 55.0335 28.8257 174.2018 26 K 5.1158 8.4938 124.6538 55.1992 33.6730 176.0028 27 F 5.0378 8.3275 117.6346 56.6094 41.8988 173.0508 28 S 5.1515 8.6876 114.2761 56.8603 67.3221 173.2262 29 V 5.1739 8.9328 122.5898 61.3306 34.9570 174.2424 30 S 5.3108 9.4305 123.2633 56.7601 65.9868 173.3518 31 G 4.3538 9.5808 111.1708 44.4598 0.0000 171.4606 32 E 5.0118 8.7660 120.3326 53.9407 34.0775 175.9180 33 G 4.0906 7.8325 109.4247 46.1511 0.0000 171.4386 34 E 4.9639 8.0401 119.1935 55.0447 33.5543 174.9778 35 G 3.5953 8.6776 107.3880 44.4180 0.0000 171.5197 36 D 5.1638 9.2751 121.9369 51.9103 42.4329 175.6040 37 A 4.4859 9.0858 128.4777 54.9122 19.0218 179.7965 38 T 3.7055 8.1275 111.8916 66.4505 68.4027 174.3480 39 Y 4.6523 7.9605 115.4829 56.7806 38.6347 175.5750 40 G 4.4146 8.2049 108.2266 46.5064 0.0000 172.8506 41 K 4.6538 8.1584 119.6631 54.0141 35.0586 174.4224 42 L 5.1206 8.5656 127.2015 52.9589 45.4845 175.6292 43 T 4.9091 8.5296 112.5895 60.0307 71.5691 172.8341 44 L 4.9813 8.8423 125.5117 52.5212 46.8678 175.2304 45 K 4.7636 8.4811 122.6564 54.6041 35.0450 174.6751 46 F 5.4816 9.1475 126.1294 55.8020 42.0158 174.5989 47 I 5.0867 9.0356 123.2783 59.5686 40.7667 174.2908 48 C 5.0233 9.5820 128.5250 59.6042 31.2837 173.2968 49 T 4.4951 8.8877 117.3206 62.7125 69.2315 175.5551 50 T 4.4529 9.2272 112.0453 61.3758 70.7555 172.4617 51 G 4.0845 7.6288 110.4148 44.5429 0.0000 174.6902 52 K 4.3165 8.3285 125.7529 55.3807 32.8349 176.3072 53 L 3.6969 8.9410 126.2353 54.3048 42.2190 175.0818 54 P 4.3710 0.0000 0.0000 63.1947 31.8683 175.6952 55 V 4.1413 6.4111 111.0141 58.4441 35.5849 173.3189 56 P 4.3994 0.0000 0.0000 62.1103 32.0697 177.5921 57 W 4.3462 9.1669 122.9332 59.9477 28.8980 177.0616 58 P 4.5356 0.0000 0.0000 65.6284 30.5723 178.2453 59 T 4.3893 8.0397 107.2027 63.4814 69.0462 175.4581 60 L 4.6673 8.1116 121.3240 54.8389 42.1326 178.2524 61 V 3.4799 7.6210 119.0957 66.3411 31.5231 177.7370 62 T 4.1396 8.0609 107.4542 64.8943 68.7719 176.3239 63 T 4.1869 7.9258 117.6420 66.1168 69.6923 176.9761 64 L 4.2920 7.8240 120.9160 54.0872 40.4806 178.6484 *68 V 4.0812 7.3464 111.1750 61.8013 33.1184 177.3766 69 Q 4.0130 7.6315 118.1642 57.0393 29.2058 178.5305 70 C 3.9699 7.4652 112.1994 60.4159 29.8430 174.4840 71 F 4.5737 8.1816 118.6825 57.4187 38.8037 175.5846 72 S 4.5972 7.5904 117.8056 58.7643 63.6030 174.2274 73 R 4.3615 9.0957 124.8985 56.0978 30.8150 174.7928 74 Y 4.4801 8.5895 125.2942 55.8526 39.0008 174.1168 75 P 4.2567 0.0000 0.0000 62.7686 32.5315 176.8459 76 D 4.3750 9.1448 122.4512 57.9291 41.0432 178.3259 77 H 4.4999 8.2310 111.3784 57.4148 28.8814 175.3873 78 M 4.7530 8.2709 120.0846 54.8929 32.6006 177.6231 79 K 3.9832 8.0954 120.8307 59.4250 32.7670 178.5454 80 Q 4.1099 7.9565 115.7182 57.6683 28.7154 175.9344 81 H 4.6929 8.0254 115.3727 55.7800 29.1007 174.8826 82 D 3.6942 7.0317 121.4877 52.1025 39.6093 176.1325 83 F 4.2542 8.1380 127.9756 60.1647 39.3831 176.1653 84 F 3.8757 7.6262 116.5888 60.6722 38.7257 177.8006 85 K 4.0448 8.1565 118.0133 59.0455 31.5506 179.5722 86 S 4.0292 7.3425 113.7028 60.7044 63.1559 175.5869 87 A 4.0888 7.2692 121.8288 52.4297 18.5088 176.8908 88 M 4.7162 7.1942 116.9787 53.8832 33.5416 174.6608 89 P 4.8058 0.0000 0.0000 64.0777 32.3885 178.0419 90 E 3.8555 8.1934 118.7297 57.9041 29.7873 176.7871 91 G 3.8294 9.4752 104.8566 44.2652 0.0000 171.1271 92 Y 5.4061 7.9370 114.8128 55.3824 42.1162 174.3341 93 V 4.6933 9.0776 121.4275 61.9707 33.5688 174.3004 94 Q 5.2593 9.3760 129.2664 54.4833 31.5828 173.7038 95 E 5.3176 9.3662 126.3329 54.9217 32.7746 175.1075 96 M 5.3190 8.8278 121.8813 53.9017 37.1045 174.2840 97 T 4.9343 8.8460 118.3865 61.9922 71.5135 173.3261 98 I 4.4193 9.0210 128.4397 59.7207 39.5279 175.2235 99 S 4.6884 8.6110 125.6397 56.7517 64.3366 173.9265 100 F 4.6578 8.7454 125.6435 56.1384 39.7498 175.7991 101 K 4.0322 8.6763 126.1039 58.1101 32.3488 175.9184 102 D 4.5243 9.0996 123.7103 54.9315 38.5887 173.1121 103 D 4.3419 7.8319 118.3118 53.8372 43.8298 173.6208 104 G 2.9792 7.5194 106.8448 44.5113 0.0000 171.6172 105 N 5.6501 7.8839 114.9625 51.4776 41.1693 173.1108 106 Y 5.6906 9.0928 118.5526 56.9126 40.5921 174.6700 107 K 5.3190 9.5229 122.8591 54.8481 35.5112 175.3401 108 T 5.2223 9.0846 114.6999 59.9230 72.5323 172.9350 109 R 5.1305 8.9789 122.6240 54.8479 33.4665 173.6392 110 A 5.3117 9.3871 127.6478 50.1777 23.1761 174.1743 111 E 4.9986 9.1449 119.8605 54.5023 32.6281 175.2345 112 V 4.8067 8.3375 125.3441 61.0466 33.7486 174.4775 113 K 4.7226 8.4961 125.6762 55.9232 36.3384 174.5867 114 F 4.6348 8.6485 119.7422 57.1935 40.1032 175.9292 115 E 4.5220 9.3407 123.1902 55.0572 31.1414 176.8795 116 G 3.8195 8.1746 116.6288 47.3098 0.0000 172.5878 117 D 4.8011 8.9234 124.8176 54.2869 41.0094 175.4123 118 T 4.7964 7.8699 117.3856 61.6839 71.1853 173.3094 119 L 3.9324 8.6115 128.8180 54.1236 43.5755 175.2960 120 V 4.8337 8.5987 126.7429 61.0177 34.4612 173.5885 121 N 5.3141 9.1700 126.7179 52.1623 41.0581 172.9893 122 R 5.1060 8.8076 126.2887 54.5454 32.7449 175.5847 123 I 5.0881 8.9418 124.3897 59.5171 41.6511 174.0571 124 E 5.0442 9.1477 125.5532 54.4418 32.2779 174.6648 125 L 5.1488 8.7542 126.2506 52.9802 45.5091 174.8016 126 K 5.0205 9.3594 127.3096 54.5635 35.2122 174.6867 127 G 5.0793 9.5272 115.1608 44.5928 0.0000 171.9512 128 I 5.1088 8.5929 116.6046 59.3693 41.8222 174.6098 129 D 4.2449 8.7964 119.4518 55.4515 38.0990 174.2561 130 F 4.4587 8.2491 117.1728 56.8952 39.9147 175.8744 131 K 4.2926 9.4515 124.9818 55.8735 32.6381 178.2082 132 E 4.0059 9.0136 123.3677 58.9748 29.5290 177.4278 133 D 4.8449 7.9366 116.0730 53.7407 41.8528 176.1088 134 G 4.0045 7.7910 108.0560 44.0131 0.0000 174.9643 135 N 4.3726 8.0433 112.5881 55.9345 38.4827 177.4487 136 I 3.7252 7.2228 119.4077 63.6590 37.7880 177.9864 137 L 3.8280 7.5749 121.5185 57.2694 41.8183 178.4647 138 G 3.7036 8.0298 105.6566 45.4367 0.0000 173.0492 139 H 3.9178 7.5507 116.2374 57.2695 26.4455 174.8005 140 K 4.5718 8.3182 115.4087 56.1230 34.0916 177.5078 141 L 4.9185 7.7033 120.7191 53.4700 42.7371 176.6380 142 E 4.1317 8.8881 123.2906 56.5476 30.4598 177.3022 143 Y 4.4789 8.5079 124.6864 55.3843 37.3274 173.3639 144 N 5.0362 7.5685 119.3330 52.5118 40.3407 173.9502 145 Y 4.3777 8.0339 117.4029 56.8427 41.5160 173.9128 146 N 4.6560 8.2038 124.7025 52.5925 39.7668 174.3659 147 S 4.7083 8.1903 114.8996 58.6962 63.2808 172.8685 148 H 5.0361 8.9955 122.2227 54.3417 33.6766 171.6844 149 N 5.1148 8.6353 117.5509 51.7394 40.2766 174.7174 150 V 3.7228 8.4484 124.9927 61.6001 32.9958 174.2374 151 Y 4.8789 8.5914 126.9307 57.3589 39.3369 174.7719 152 I 5.1040 8.9439 125.9475 59.9514 40.0146 175.0584 153 T 5.0281 8.8604 121.6787 61.4655 72.9765 173.3099 154 A 4.2627 8.6245 125.4575 52.1336 19.7337 177.2167 155 D 4.6542 8.7672 121.3912 52.0272 41.7376 176.6201 156 K 4.0193 8.5033 124.8774 58.9339 32.5679 179.6903 157 Q 3.9944 8.1062 115.5088 58.3192 28.7738 176.7737 158 K 4.2943 7.8096 115.6995 55.2674 32.3733 175.5309 159 N 4.2922 8.1703 116.6362 53.9404 38.5805 173.8230 160 G 3.6611 7.8633 106.0582 45.0536 0.0000 172.5901 161 I 5.0091 7.8291 115.3998 59.0857 41.6961 174.9170 162 K 5.0741 9.0517 121.4543 54.6424 36.0269 175.2513 163 A 5.4066 8.9841 123.5271 50.5531 23.2597 174.8758 164 N 5.7052 9.2345 117.0942 51.7897 43.1655 173.6736 165 F 5.2381 8.3685 115.9937 56.3863 41.9773 172.7574 166 K 4.9585 8.8891 118.6170 54.7453 34.6223 175.8799 167 I 3.8946 8.5995 126.7985 60.4367 38.8803 175.5108 168 R 4.7081 8.5205 126.1204 55.1816 30.6238 174.8746 169 H 4.6953 8.9593 122.5895 54.4481 30.5759 174.7908 170 N 4.8234 8.7707 121.3531 53.3881 39.7317 174.3925 171 I 4.7789 8.6785 125.0889 59.9205 38.7632 177.0674 172 E 4.2077 9.1536 123.9457 58.6168 29.4593 177.4010 173 D 4.6485 8.1422 117.8273 53.0607 39.7446 177.1967 174 G 3.8958 8.3779 109.1907 45.3086 0.0000 173.7451 175 S 4.6135 8.2317 114.9399 57.3253 64.9325 172.2867 176 V 4.7658 8.1380 119.4931 61.0910 34.1881 174.7162 177 Q 4.5234 9.2078 129.7288 54.5548 30.2311 174.4597 178 L 4.6451 8.5161 127.2210 54.5869 43.4754 176.2552 179 A 4.6166 9.1163 124.8748 49.8554 21.2141 174.6317 180 D 4.5910 8.7395 122.1411 55.3081 42.4945 175.4666 181 H 5.0122 9.0851 120.6975 53.9043 31.6291 172.3907 182 Y 5.2371 8.7067 124.3671 55.8527 41.2674 173.9391 183 Q 4.9841 8.8866 127.7820 54.3427 32.7729 173.9696 184 Q 4.8689 9.0366 123.8346 54.1675 33.1335 173.8487 185 N 6.1730 8.8871 120.2877 50.9049 42.3917 173.6772 186 T 5.1761 8.4242 118.1370 61.0035 73.1756 171.6395 187 P 4.9601 0.0000 0.0000 63.3096 31.8057 176.3860 188 I 4.0260 8.8194 123.5628 64.0031 37.8612 177.0237 189 G 3.9181 8.0841 109.7249 45.0824 0.0000 172.6146 190 D 4.7447 8.4397 116.3445 52.7814 39.7880 176.8907 191 G 3.8877 7.7037 109.0936 44.2041 0.0000 171.9195 192 P 4.4176 0.0000 0.0000 62.6022 31.8967 175.9207 193 V 4.4163 7.9401 112.2363 59.3646 35.1606 174.9442 194 L 4.3132 8.5546 121.6320 53.8029 42.0883 176.2618 195 L 4.6290 8.3939 124.5105 52.4041 42.4421 174.6117 196 P 4.7493 0.0000 0.0000 61.6255 32.6098 175.8552 197 D 4.5760 8.5105 119.3544 54.1374 41.4075 176.1257 198 N 4.8106 8.5648 118.8999 54.7997 39.2713 173.9561 199 H 4.9629 8.6546 117.0394 55.4703 32.5660 171.5516 200 Y 5.2167 8.4782 115.4387 55.5761 42.0960 173.9672 201 L 4.7939 8.5334 120.0978 53.0729 44.0775 175.6803 202 S 4.9865 9.0192 120.4297 57.7663 63.8499 172.8292 203 T 5.1592 9.0133 124.0276 61.8630 71.8380 173.0481 204 Q 5.0376 9.3594 124.6775 54.2711 32.6024 174.6859 205 S 5.1443 8.8632 117.8896 56.7245 67.1387 173.1270 206 A 4.7608 9.2557 125.6033 50.1199 21.6917 174.7426 207 L 5.1523 8.4915 122.5466 53.2878 44.0029 175.8943 208 S 4.8829 9.1034 116.7302 57.5389 67.0867 172.4461 209 K 4.8767 8.5131 117.9776 54.5349 35.4078 176.0168 210 D 4.5773 8.9170 123.1417 52.5918 41.2444 175.3936 211 P 4.3819 0.0000 0.0000 64.8844 31.4615 176.5911 212 N 4.7025 8.4389 115.5831 52.7774 38.7726 173.7606 213 E 4.4893 8.0068 120.4176 54.4285 30.6898 175.8133 214 K 4.2831 8.4965 125.2847 57.6086 33.0501 177.5111 215 R 4.2102 8.0769 117.6039 55.4733 30.7553 175.5802 216 D 4.8180 8.6444 120.4003 54.9021 42.2034 174.7418 217 H 5.1009 8.5776 119.8834 55.1835 31.9275 172.4246 218 M 4.6060 8.2141 117.9733 53.3004 35.6114 173.4035 219 V 4.6577 8.6683 126.3925 61.3369 33.8164 174.0980 220 L 5.1458 8.9938 129.7674 53.0847 45.3691 174.4834 221 L 5.0402 8.7128 127.8989 53.2068 44.7421 174.6024 222 E 5.1048 8.7827 126.2260 54.4606 33.6662 173.7843 223 F 5.4016 9.2276 124.2798 55.7071 42.7597 174.3342 224 V 4.9036 9.0512 122.6258 61.5708 34.9247 174.1404 225 T 5.0201 8.8458 123.7008 61.5363 72.1300 173.3672 226 A 4.2961 8.5361 128.8345 52.0204 19.3353 176.1533 227 A 4.1056 8.5288 121.9158 50.9516 23.2706 177.1119 228 G 4.1944 9.2042 105.6911 45.4680 0.0000 174.0206 229 I 4.1635 7.2495 125.0209 61.3510 37.9387 175.1865 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 K 8.16 4.24 0.00 1.75 1.86 0.00 1.70 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.36 7.81 4 G 9.01 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 0.00 0.00 0.00 5 E 9.06 4.18 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 6 E 7.89 4.06 0.00 2.03 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 2.34 2.40 0.00 7 L 7.89 4.05 0.00 1.37 0.92 0.50 0.13 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 8 F 8.09 4.87 0.00 3.26 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 T 8.14 3.98 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 10 G 7.14 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.39 4.10 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 0.83 0.00 0.00 1.03 0.00 0.00 12 V 8.85 4.66 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 1.35 0.00 0.00 1.10 0.00 0.00 13 P 0.00 4.80 0.00 2.23 2.14 0.00 3.67 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 2.10 2.13 0.00 14 I 8.68 5.05 1.72 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.00 0.93 0.00 0.00 15 L 8.79 5.20 0.00 1.55 1.51 0.91 0.49 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 16 V 8.86 4.93 2.38 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 1.07 0.00 0.00 1.09 0.00 0.00 17 E 9.39 5.20 0.00 1.89 1.81 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 2.24 2.38 0.00 18 L 9.16 5.22 0.00 1.67 1.51 0.81 1.16 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 19 D 8.97 5.12 0.00 2.50 2.38 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 20 G 8.53 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.66 5.14 0.00 2.61 2.42 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 22 V 8.90 4.76 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 0.88 0.00 0.00 0.91 0.00 0.00 23 N 10.33 4.37 0.00 2.97 2.94 0.00 0.00 7.53 8.61 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 24 G 8.65 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 25 H 8.35 4.55 0.00 3.43 3.29 0.00 5.80 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.49 5.12 0.00 1.65 1.70 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.42 7.81 27 F 8.33 5.04 0.00 2.98 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 28 S 8.69 5.15 0.00 3.77 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 29 V 8.93 5.17 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 1.53 0.00 0.00 1.08 0.00 0.00 30 S 9.43 5.31 0.00 3.85 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 31 G 9.58 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 E 8.77 5.01 0.00 1.77 1.68 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 2.16 2.18 0.00 33 G 7.83 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 0.00 0.00 0.00 0.00 34 E 8.04 4.96 0.00 1.99 1.92 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 2.09 2.17 0.00 35 G 8.68 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 9.28 5.16 0.00 2.80 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 9.09 4.49 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.13 3.71 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 0.48 0.00 0.00 39 Y 7.96 4.65 0.00 3.14 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 40 G 8.20 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.16 4.65 0.00 2.15 1.73 0.00 1.85 0.00 0.00 1.84 0.00 0.00 2.83 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.17 0.76 7.81 42 L 8.57 5.12 0.00 1.40 1.33 0.94 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 43 T 8.53 4.91 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 1.07 0.00 0.00 44 L 8.84 4.98 0.00 1.31 0.67 0.92 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.48 4.76 0.00 1.64 1.44 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.76 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.21 1.29 7.81 46 F 9.15 5.48 0.00 2.74 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 47 I 9.04 5.09 1.97 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.75 1.01 0.00 0.00 48 C 9.58 5.02 0.00 3.09 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 49 T 8.89 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 1.34 0.00 0.00 50 T 9.23 4.45 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 51 G 7.63 4.08 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 0.00 0.00 0.00 52 K 8.33 4.32 0.00 1.71 1.67 0.00 1.76 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.33 7.81 53 L 8.94 3.70 0.00 1.03 1.00 0.14 -0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.37 0.00 1.91 1.93 0.00 2.61 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.80 0.00 55 V 6.41 4.14 1.80 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 0.47 0.00 0.00 0.45 0.00 0.00 56 P 0.00 4.40 0.00 2.15 2.00 0.00 3.39 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 57 W 9.17 4.35 0.00 3.68 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 P 0.00 4.54 0.00 2.30 2.42 0.00 3.72 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.25 0.00 59 T 8.04 4.39 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 60 L 8.11 4.67 0.00 1.90 1.76 0.71 0.65 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 61 V 7.62 3.48 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.00 0.00 0.72 0.00 0.00 62 T 8.06 4.14 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 1.46 0.00 0.00 63 T 7.93 4.19 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 64 L 7.82 4.29 0.00 1.32 1.33 0.29 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 *68 V 7.35 4.08 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 0.95 0.00 0.00 1.09 0.00 0.00 69 Q 7.63 4.01 0.00 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.72 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 70 C 7.47 3.97 0.00 2.31 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 71 F 8.18 4.57 0.00 3.24 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 72 S 7.59 4.60 0.00 3.97 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 73 R 9.10 4.36 0.00 2.08 1.82 0.00 3.08 0.00 0.00 3.27 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 74 Y 8.59 4.48 0.00 2.83 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 75 P 0.00 4.26 0.00 1.87 1.99 0.00 3.44 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 2.00 2.03 0.00 76 D 9.14 4.38 0.00 2.76 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.23 4.50 0.00 3.32 3.42 0.00 5.53 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 8.27 4.75 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.37 0.00 79 K 8.10 3.98 0.00 1.94 2.08 0.00 1.30 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.35 7.81 80 Q 7.96 4.11 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.11 0.00 0.00 0.00 0.00 0.00 1.78 2.14 0.00 81 H 8.03 4.69 0.00 3.33 3.31 0.00 5.64 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 82 D 7.03 3.69 0.00 1.58 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 0.00 0.00 0.00 0.00 83 F 8.14 4.25 0.00 2.96 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 0.00 0.00 0.00 0.00 84 F 7.63 3.88 0.00 3.09 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 85 K 8.16 4.04 0.00 1.62 1.76 0.00 1.57 0.00 0.00 1.49 0.00 0.00 2.90 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 1.05 7.81 86 S 7.34 4.03 0.00 3.84 3.96 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 87 A 7.27 4.09 1.15 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 88 M 7.19 4.72 0.00 2.40 2.43 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.14 2.86 0.00 89 P 0.00 4.81 0.00 2.23 2.09 0.00 3.68 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.89 0.00 90 E 8.19 3.86 0.00 1.98 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 2.33 2.39 0.00 91 G 9.48 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 7.94 5.41 0.00 3.36 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 93 V 9.08 4.69 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.00 0.00 0.00 94 Q 9.38 5.26 0.00 2.50 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 95 E 9.37 5.32 0.00 1.89 1.81 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 2.24 2.29 0.00 96 M 8.83 5.32 0.00 1.98 1.97 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 2.60 2.56 0.00 97 T 8.85 4.93 4.33 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 1.23 0.00 0.00 98 I 9.02 4.42 1.80 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.74 0.13 0.00 0.00 99 S 8.61 4.69 0.00 3.62 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.75 4.66 0.00 3.14 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 0.00 101 K 8.68 4.03 0.00 1.70 1.75 0.00 1.92 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.42 7.81 102 D 9.10 4.52 0.00 2.88 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 0.00 103 D 7.83 4.34 0.00 2.62 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 G 7.52 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 0.00 0.00 0.00 105 N 7.88 5.65 0.00 2.94 2.82 0.00 0.00 7.33 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 0.00 106 Y 9.09 5.69 0.00 3.04 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 0.00 107 K 9.52 5.32 0.00 1.69 1.74 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.42 7.81 108 T 9.08 5.22 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 1.31 0.00 0.00 109 R 8.98 5.13 0.00 1.89 1.78 0.00 3.05 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 110 A 9.39 5.31 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 0.00 111 E 9.14 5.00 0.00 1.88 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 2.24 2.23 0.00 112 V 8.34 4.81 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 0.00 0.00 0.74 0.00 0.00 0.93 0.00 0.00 113 K 8.50 4.72 0.00 2.09 1.79 0.00 1.52 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.28 1.39 7.81 114 F 8.65 4.63 0.00 2.95 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 9.34 4.52 0.00 1.93 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 2.21 2.35 0.00 116 G 8.17 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 0.00 117 D 8.92 4.80 0.00 2.71 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 0.00 118 T 7.87 4.80 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 119 L 8.61 3.93 0.00 1.25 1.57 1.01 0.14 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 0.00 120 V 8.60 4.83 2.13 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 0.87 0.00 0.00 0.96 0.00 0.00 121 N 9.17 5.31 0.00 2.89 2.72 0.00 0.00 7.00 8.35 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 0.00 122 R 8.81 5.11 0.00 1.79 1.81 0.00 3.12 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 123 I 8.94 5.09 1.88 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 1.28 0.86 0.93 0.00 0.00 124 E 9.15 5.04 0.00 1.87 1.79 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 2.18 2.20 0.00 125 L 8.75 5.15 0.00 1.57 1.26 0.59 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.36 5.02 0.00 1.85 1.64 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.47 7.81 127 G 9.53 5.08 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 0.00 0.00 0.00 128 I 8.59 5.11 1.92 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 1.30 0.78 0.99 0.00 0.00 129 D 8.80 4.24 0.00 2.74 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.25 4.46 0.00 3.22 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 0.00 131 K 9.45 4.29 0.00 1.80 1.74 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.40 7.81 132 E 9.01 4.01 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 133 D 7.94 4.84 0.00 2.59 2.61 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 0.00 134 G 7.79 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 0.00 135 N 8.04 4.37 0.00 2.96 2.87 0.00 0.00 7.50 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 0.00 136 I 7.22 3.73 1.65 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.35 0.22 0.00 0.00 137 L 7.57 3.83 0.00 1.78 1.66 1.04 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.03 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 0.00 139 H 7.55 3.92 0.00 3.25 3.30 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.32 4.57 0.00 1.81 1.80 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.38 7.81 141 L 7.70 4.92 0.00 1.55 1.63 0.83 0.97 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 0.00 142 E 8.89 4.13 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 2.40 2.31 0.00 143 Y 8.51 4.48 0.00 3.08 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 0.00 144 N 7.57 5.04 0.00 2.84 2.81 0.00 0.00 6.45 7.60 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 0.00 145 Y 8.03 4.38 0.00 2.89 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 N 8.20 4.66 0.00 2.58 2.58 0.00 0.00 7.33 7.77 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 0.00 147 S 8.19 4.71 0.00 3.89 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 0.00 148 H 9.00 5.04 0.00 3.15 3.13 0.00 5.84 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.64 5.11 0.00 2.06 1.81 0.00 0.00 6.85 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 8.45 3.72 1.81 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 0.83 0.00 0.00 0.06 0.00 0.00 151 Y 8.59 4.88 0.00 3.26 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 I 8.94 5.10 1.66 0.00 0.00 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 1.34 1.23 0.89 0.00 0.00 153 T 8.86 5.03 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 1.37 0.00 0.00 154 A 8.62 4.26 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 0.00 155 D 8.77 4.65 0.00 2.60 2.42 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 0.00 156 K 8.50 4.02 0.00 1.85 1.84 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.43 7.81 157 Q 8.11 3.99 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 7.13 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 158 K 7.81 4.29 0.00 1.73 1.86 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.65 7.81 159 N 8.17 4.29 0.00 2.83 2.90 0.00 0.00 6.87 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 G 7.86 3.66 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 0.00 0.00 0.00 161 I 7.83 5.01 1.63 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.13 0.29 0.33 0.00 0.00 162 K 9.05 5.07 0.00 1.69 1.74 0.00 1.68 0.00 0.00 1.87 0.00 0.00 3.16 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.27 1.31 7.81 163 A 8.98 5.41 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 0.00 164 N 9.23 5.71 0.00 2.79 2.78 0.00 0.00 6.92 7.80 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 0.00 165 F 8.37 5.24 0.00 3.18 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 K 8.89 4.96 0.00 1.66 1.74 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.61 1.44 7.81 167 I 8.60 3.89 1.75 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 1.19 0.92 0.48 0.00 0.00 168 R 8.52 4.71 0.00 1.70 1.89 0.00 3.21 0.00 0.00 3.23 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 169 H 8.96 4.70 0.00 3.23 3.22 0.00 5.61 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.77 4.82 0.00 2.80 2.84 0.00 0.00 7.24 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 8.68 4.78 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 1.32 0.85 0.99 0.00 0.00 172 E 9.15 4.21 0.00 2.08 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 0.00 173 D 8.14 4.65 0.00 2.81 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 0.00 174 G 8.38 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 0.00 175 S 8.23 4.61 0.00 3.94 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 0.00 176 V 8.14 4.77 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 0.00 177 Q 9.21 4.52 0.00 2.24 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.97 0.00 0.00 0.00 0.00 0.00 2.45 2.63 0.00 178 L 8.52 4.65 0.00 1.64 1.53 0.91 0.67 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 0.00 179 A 9.12 4.62 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 8.74 4.59 0.00 2.48 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 0.00 181 H 9.09 5.01 0.00 1.47 2.38 0.00 5.75 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.71 5.24 0.00 2.93 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 0.00 183 Q 8.89 4.98 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 7.05 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 184 Q 9.04 4.87 0.00 1.83 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.50 0.00 0.00 0.00 0.00 0.00 1.91 1.69 0.00 185 N 8.89 6.17 0.00 2.24 2.58 0.00 0.00 7.08 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 T 8.42 5.18 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 1.33 0.00 0.00 187 P 0.00 4.96 0.00 2.15 2.13 0.00 3.88 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.24 0.00 188 I 8.82 4.03 2.14 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.63 0.94 0.00 0.00 189 G 8.08 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 0.00 190 D 8.44 4.74 0.00 2.77 2.78 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 0.00 191 G 7.70 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 0.00 192 P 0.00 4.42 0.00 2.18 2.06 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 193 V 7.94 4.42 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 0.78 0.00 0.00 1.16 0.00 0.00 194 L 8.55 4.31 0.00 1.61 1.68 0.89 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 0.00 195 L 8.39 4.63 0.00 1.63 1.61 0.93 1.13 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 0.00 196 P 0.00 4.75 0.00 2.34 2.39 0.00 3.71 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 1.98 1.98 0.00 197 D 8.51 4.58 0.00 2.59 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 0.00 198 N 8.56 4.81 0.00 2.67 2.87 0.00 0.00 6.81 8.20 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 0.00 199 H 8.65 4.96 0.00 3.35 3.36 0.00 5.21 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.48 5.22 0.00 2.67 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.53 4.79 0.00 1.46 1.49 0.82 0.63 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 0.00 202 S 9.02 4.99 0.00 4.03 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 0.00 203 T 9.01 5.16 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 204 Q 9.36 5.04 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 205 S 8.86 5.14 0.00 3.68 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 A 9.26 4.76 1.22 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 0.00 0.00 0.00 207 L 8.49 5.15 0.00 0.91 0.82 0.59 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 208 S 9.10 4.88 0.00 3.88 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 0.00 209 K 8.51 4.88 0.00 1.60 1.70 0.00 1.36 0.00 0.00 1.24 0.00 0.00 2.13 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.18 1.13 7.81 210 D 8.92 4.58 0.00 2.63 2.42 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 0.00 211 P 0.00 4.38 0.00 2.21 2.16 0.00 3.78 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 212 N 8.44 4.70 0.00 2.81 2.84 0.00 0.00 6.74 7.18 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 0.00 213 E 8.01 4.49 0.00 1.87 1.65 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 1.80 2.24 0.00 214 K 8.50 4.28 0.00 1.78 1.85 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.44 7.81 215 R 8.08 4.21 0.00 1.96 1.94 0.00 3.21 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 216 D 8.64 4.82 0.00 2.85 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 0.00 217 H 8.58 5.10 0.00 3.25 3.22 0.00 5.55 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 8.21 4.61 0.00 1.29 0.73 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.28 0.00 219 V 8.67 4.66 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 1.00 0.00 0.00 0.93 0.00 0.00 220 L 8.99 5.15 0.00 1.83 1.56 0.89 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.71 5.04 0.00 1.71 1.43 0.69 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 222 E 8.78 5.10 0.00 1.91 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 2.13 2.40 0.00 223 F 9.23 5.40 0.00 3.06 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 0.00 224 V 9.05 4.90 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 1.04 0.00 0.00 0.91 0.00 0.00 225 T 8.85 5.02 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 1.13 0.00 0.00 226 A 8.54 4.30 0.16 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 0.00 0.00 227 A 8.53 4.11 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 9.20 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 0.00 229 I 7.25 4.16 1.85 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.70 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.