NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2526 8.1985 119.6852 55.9714 31.4091 177.0858 2 A 3.7789 8.0860 119.8244 54.9489 18.1856 177.8454 3 N 4.2991 8.2851 114.7607 56.3980 38.9998 175.7016 4 L 3.7216 7.7665 121.2841 58.1355 42.2480 178.6286 5 M 3.9366 8.2715 119.0972 58.2908 31.7732 178.9186 6 R 3.8506 8.0636 118.1370 59.1120 30.2678 178.5368 7 L 3.0225 7.8574 120.1404 58.0312 41.8702 179.1497 8 K 3.3355 7.5233 118.1140 59.2271 31.8615 179.2783 9 S 4.0689 7.8657 113.2508 61.5913 62.1290 175.9899 10 D 4.3183 7.9959 120.5285 57.3347 40.5917 178.5285 11 L 3.9248 7.7269 119.0039 56.8776 41.6398 178.5084 12 F 5.1331 7.9277 115.1056 57.6111 40.5998 176.1466 13 N 4.8344 8.3944 114.1005 53.3358 39.2391 175.8277 14 R 4.3054 8.0420 116.8721 57.1830 31.2251 176.1160 15 S 4.8229 7.5999 109.0674 55.1088 65.4832 171.2021 16 P 4.4863 0.0000 0.0000 62.4522 31.6356 176.2070 17 M 4.3848 8.3086 119.2945 55.0163 32.8685 175.2978 18 Y 4.1665 8.8030 124.1520 57.9658 39.0013 174.2305 19 P 4.4200 0.0000 0.0000 62.5333 31.5944 177.1099 20 G 3.1461 5.8131 102.9049 44.6041 0.0000 171.7837 21 P 4.3861 0.0000 0.0000 62.3699 32.0368 175.1411 22 T 4.7747 7.5351 107.8456 59.1880 71.8466 173.8774 23 K 4.6456 8.6333 121.3139 59.1335 32.0827 177.4104 24 D 4.5292 7.9493 116.6406 56.1538 41.1744 176.1769 25 D 4.7919 7.6572 118.6684 51.7974 41.1302 172.6809 26 P 4.7483 0.0000 0.0000 62.2529 33.5340 176.4738 27 L 4.8444 8.9533 121.4674 53.5970 45.7078 174.8808 28 T 5.1185 8.6332 121.4866 61.9495 70.5941 173.6999 29 V 4.7664 8.9199 127.1601 61.6586 34.0365 174.3224 30 T 5.0737 9.1829 125.1197 62.1673 69.9828 173.6316 31 L 5.2721 9.0107 126.6284 53.0822 45.1071 175.8136 32 G 4.1440 8.4806 108.1693 44.9875 0.0000 171.5553 33 F 5.0752 9.3832 120.8746 55.5236 42.5029 174.9017 34 T 4.7617 8.3948 119.0950 61.5958 70.8280 172.9048 35 L 4.6429 8.4534 130.0867 54.7990 42.3292 176.2402 36 Q 4.5585 9.2324 125.8896 57.8148 30.8903 175.4862 37 D 4.3513 7.7113 114.7338 53.2940 44.8031 174.8089 38 I 4.5203 8.6663 127.2382 60.6073 36.9361 175.7453 39 V 4.0345 8.6525 128.7408 65.1296 32.3975 176.4462 40 K 4.8286 7.8478 119.8869 55.1069 35.6693 175.0615 41 V 4.8208 8.5692 119.1874 59.5476 35.3655 174.7567 42 D 4.8809 8.9040 123.9745 52.5296 42.8258 176.3922 43 S 4.3738 8.8352 121.0325 60.1658 63.7804 175.8803 44 S 4.2856 8.2030 117.6731 60.7330 62.6315 174.8747 45 T 4.3542 7.8174 106.7335 60.2430 70.5003 173.1110 46 N 4.3123 7.9558 118.9304 53.7189 36.4623 173.5073 47 E 4.9711 7.5258 116.3544 54.4827 33.8732 176.8713 48 V 4.7310 8.3070 124.1385 61.0665 35.1128 173.6636 49 D 5.6591 9.1831 126.2459 52.6327 43.4135 175.2706 50 L 5.3816 9.1616 122.8358 52.8987 45.7306 175.4976 51 V 4.7722 8.8263 122.7164 61.2966 33.9743 174.0502 52 Y 5.3197 8.0528 124.9360 56.1225 42.2242 172.8397 53 Y 5.2212 8.4201 117.6406 55.1741 41.4779 174.2961 54 E 4.4847 8.8871 123.6472 54.3126 31.5898 174.5282 55 Q 4.5412 8.8638 130.6011 56.0495 30.3378 174.5914 56 Q 5.3860 9.4041 125.7823 54.2880 32.3811 174.8498 57 R 5.4691 9.3467 121.7212 53.4269 34.8723 174.3553 58 W 5.3528 7.8158 118.2171 55.9757 31.8166 172.6241 59 K 4.8978 8.6773 120.1305 54.9297 34.8915 175.0623 60 L 4.6319 8.6595 126.8593 52.7751 44.5698 177.5294 61 N 4.3154 8.9520 121.1321 56.3768 38.7437 177.2501 62 S 4.3131 8.0266 110.9962 60.3588 63.2424 174.4259 63 L 4.7777 7.6238 119.8198 54.9057 42.0331 176.5466 64 M 4.6181 8.0469 119.5477 55.0493 32.7280 175.6196 65 W 5.2543 7.9457 117.9428 55.3216 32.2073 173.8643 66 D 4.6331 9.0168 120.5943 52.7430 40.8643 175.1077 67 P 4.7715 0.0000 0.0000 65.9077 31.0070 177.8002 68 N 4.2671 8.3538 115.2050 56.6012 38.8627 175.8589 69 E 4.2124 8.1710 117.1725 56.7176 30.8867 175.7191 70 Y 4.6606 7.3064 117.0050 57.6494 38.9683 175.2573 71 G 4.0586 8.5600 100.4398 46.4631 0.0000 173.3319 72 N 4.3214 8.6273 111.8932 53.5214 37.1275 174.9103 73 I 3.9134 7.7755 119.1420 62.3182 37.5485 175.9425 74 T 4.7822 8.5953 114.5997 62.1427 71.0020 173.3435 75 D 5.5472 8.3166 119.5903 53.2071 42.0865 174.2753 76 F 5.0380 8.8424 113.2412 56.1812 41.5851 173.0055 77 R 5.1021 8.6309 118.4700 55.2830 32.1449 175.6794 78 T 4.7520 8.7675 115.7899 60.4296 71.6084 172.6516 79 S 4.4894 8.9382 121.0501 58.8938 62.9120 175.1366 80 A 3.6787 9.2110 129.7991 55.0562 18.2907 179.4911 81 A 4.0141 7.4177 117.8852 55.1080 18.4477 178.4001 82 D 4.2848 7.9144 114.9607 55.5136 41.1466 176.2724 83 I 4.7875 7.1271 111.2751 57.8955 40.5705 175.0603 84 W 4.2840 8.9924 131.4709 57.8109 31.1854 175.3856 85 T 3.8299 6.7997 113.7931 58.4486 71.2664 171.9035 86 P 3.4055 0.0000 0.0000 62.4610 32.6904 175.9081 87 D 4.7564 8.2467 119.8633 53.1775 38.5991 176.4561 88 I 4.5992 7.5432 118.9735 62.5252 38.3899 177.4530 89 T 4.9246 9.4140 123.2497 61.4452 72.8089 173.2573 90 A 3.8143 8.6569 127.0521 52.1575 18.4620 177.2149 91 Y 4.9828 9.2080 119.7920 58.6723 39.5846 176.7331 92 S 4.5463 7.6439 115.0675 57.5077 63.6545 174.2041 93 S 4.7930 8.3024 114.8271 59.8434 63.3867 173.6896 94 T 4.5816 8.4598 110.1268 61.4963 69.7712 174.0140 95 R 4.6998 7.5556 119.4620 53.7208 34.2967 172.8593 96 P 4.2430 0.0000 0.0000 62.8060 31.8157 176.7251 97 V 3.8870 8.3212 122.5153 63.5284 32.4012 174.8531 98 Q 4.5729 8.8498 126.4040 54.3746 30.6264 174.8309 99 V 4.3656 8.3816 124.5068 62.4746 32.1359 175.4547 100 L 4.7788 8.9728 127.0459 54.5060 42.8837 176.2806 101 S 4.8212 7.7501 112.4680 55.2835 66.2243 172.3439 102 P 4.3684 0.0000 0.0000 63.4960 31.9784 177.2800 103 Q 4.8177 8.4099 121.5416 54.7349 27.4738 173.8235 104 I 5.1206 8.0115 120.4218 59.2239 41.5494 174.3810 105 A 5.0489 9.2095 126.9701 50.1562 23.0202 174.9308 106 V 4.5135 8.4648 119.3582 61.2220 33.7055 174.6220 107 V 4.6073 8.2309 128.4464 61.4359 33.6812 174.6224 108 T 5.2038 8.5610 124.3188 61.7062 71.4505 175.3288 109 H 2.0000 8.2655 119.1348 57.0840 28.5119 176.5271 110 D 4.1513 7.2040 118.4607 53.1678 39.3435 177.2717 111 G 3.8801 8.0437 109.0462 45.5042 0.0000 173.8622 112 S 4.4917 8.1307 117.0806 58.3475 64.2869 173.4165 113 V 4.4955 8.4805 123.6828 60.9815 34.4912 173.7734 114 M 5.0324 8.7989 126.9740 53.6454 35.3267 173.7535 115 F 5.1995 9.3985 128.0664 56.4434 42.8141 173.9767 116 I 5.1855 8.0475 125.9301 57.4330 36.9200 172.3816 117 P 4.0740 0.0000 0.0000 62.5053 32.7844 176.7472 118 A 4.8373 9.0372 127.6059 51.7698 19.9132 176.1538 119 Q 4.8234 8.8153 119.8389 54.1208 33.9733 173.8310 120 R 4.9088 8.8764 122.8971 54.4589 32.5958 174.2671 121 L 5.0590 8.9272 128.3693 53.4333 45.2632 174.9245 122 S 5.5099 8.7881 122.4288 57.3914 64.8488 173.1938 123 F 5.4004 9.1892 118.9512 55.2112 42.1615 173.5045 124 M 4.5411 8.5877 119.4979 55.4794 32.1881 175.9592 125 C 4.4737 8.6245 124.1355 55.6255 47.6387 172.5060 126 D 4.8755 8.7416 127.3135 52.9713 40.5526 173.4568 127 P 4.5226 0.0000 0.0000 62.8470 31.7195 175.9273 128 T 3.9351 7.7634 116.8757 65.6922 68.7717 174.4417 129 G 4.0049 9.0244 114.9436 45.1689 0.0000 175.6076 130 V 3.6152 8.0005 120.0448 64.4199 31.2916 177.2621 131 D 4.6389 8.0327 117.3325 53.2382 40.0942 176.1125 132 S 4.6395 8.1558 116.1159 56.8611 64.6805 174.8824 133 E 3.9954 8.5665 121.5754 58.9873 29.4978 177.6956 134 E 4.0646 7.8610 117.2519 56.4164 30.1985 178.0862 135 G 3.8507 7.7331 107.1754 44.8764 0.0000 172.8374 136 V 4.4401 7.7933 117.0626 60.4002 35.2008 174.1946 137 T 5.1760 8.3686 118.2676 62.2050 70.8241 174.1933 138 C 5.3941 9.4424 121.9454 55.3610 44.9791 172.7840 139 A 5.4620 8.6521 120.9855 50.6282 22.1195 176.0800 140 V 4.3765 8.6685 120.4791 59.9188 34.9624 174.6404 141 K 4.7751 8.4961 123.5900 55.5036 34.0492 175.4955 142 F 4.8248 8.5715 122.4642 55.7845 42.7236 174.7924 143 G 4.2521 8.1323 108.1683 46.2102 0.0000 172.1846 144 S 4.9507 9.0396 115.0220 58.3327 62.4604 174.3607 145 W 4.4960 9.2673 135.0000 60.0502 30.6097 177.2610 146 V 4.2408 8.3484 107.6125 60.8085 32.8400 174.9038 147 Y 4.7532 8.2813 118.8221 55.9643 39.5900 176.0995 148 S 4.4327 8.7706 119.6071 57.0695 64.4319 175.2567 149 G 3.9460 8.1037 109.2311 49.3268 0.0000 175.3036 150 F 4.6956 7.7486 118.0920 59.9082 39.3873 176.5340 151 E 4.4588 8.3514 118.9973 57.0910 32.3132 175.9653 152 I 4.9968 8.3138 121.1289 59.4994 40.5325 174.5284 153 D 4.9793 9.0132 127.6915 53.4127 42.7455 175.0298 154 L 5.4127 8.4638 123.8983 53.2942 44.3503 175.7770 155 K 4.8843 8.8935 120.3403 55.2458 37.0287 175.2240 156 T 5.1744 8.3212 111.2817 59.3722 71.2940 173.7956 157 D 4.5813 8.6949 120.9162 56.0255 41.5885 176.6480 158 T 4.4016 6.9894 110.2676 61.2103 70.5673 172.3434 159 D 5.4568 8.4270 124.9504 53.1114 40.9991 175.1166 160 Q 4.8608 7.8586 119.7195 54.4042 29.7160 175.9354 161 V 3.7048 8.1925 125.2413 63.0182 32.6658 175.0939 162 D 4.4710 8.9987 127.5656 54.0731 42.0582 176.2208 163 L 4.6302 8.4812 124.9943 54.5661 42.2908 178.3201 164 S 4.3485 8.8052 115.0482 60.2764 63.1512 175.1028 165 S 4.7536 7.8663 115.8521 58.2380 63.1965 173.0940 166 Y 4.2714 7.9095 122.7962 57.1841 39.1802 174.9026 167 Y 4.1858 8.1798 128.7757 57.6366 38.9669 176.7276 168 A 4.0398 8.7261 130.9053 54.5911 18.6589 177.8128 169 S 4.3766 5.8382 110.1048 57.8540 63.5226 174.2820 170 S 4.3470 6.8042 114.5433 58.4918 62.6164 174.6539 171 K 4.0371 8.6164 123.4223 58.3374 32.7346 176.0477 172 Y 5.2635 7.9055 117.6921 56.0184 41.2327 174.7607 173 E 4.5008 9.4185 125.4497 55.4163 31.5467 174.9020 174 I 4.3301 8.0108 127.4501 60.8108 37.4971 175.4327 175 L 4.5178 9.1688 128.2238 56.7088 42.7120 177.2240 176 S 4.7487 7.8089 110.6145 57.2690 66.8581 173.6946 177 A 5.0588 8.3883 122.9593 51.3840 21.8457 175.2570 178 T 5.1508 9.0065 112.7622 60.1609 73.0933 173.5627 179 Q 4.7971 9.1168 120.2851 55.1004 31.6062 173.8636 180 T 4.8652 8.6325 121.3148 61.1189 71.8747 173.8386 181 R 4.5272 8.8368 127.4274 56.7190 30.9132 175.5267 182 Q 4.7757 9.6861 125.2461 54.0174 32.8327 174.4862 183 V 4.8156 8.6121 124.5628 62.0206 33.6522 175.1997 184 Q 4.8308 9.3009 128.8900 54.3768 30.6948 170.9193 185 H 5.0681 8.5653 117.7711 53.7424 32.1296 173.3459 *191 E 2.6923 8.4886 121.3518 54.9215 30.4925 174.1141 192 P 4.3213 0.0000 0.0000 62.7824 33.3696 174.3568 193 Y 4.7778 8.9164 119.0066 56.3071 40.7385 174.6666 194 I 5.1748 8.5572 124.6765 59.7492 39.6271 174.4680 195 D 4.9977 9.1275 124.5234 52.0955 43.8180 173.9367 196 V 4.6555 8.8267 119.4664 61.1902 33.9472 173.8697 197 N 4.8427 9.2477 128.2866 52.5173 40.0934 173.5594 198 L 4.6366 8.8637 130.5787 54.2236 43.4930 175.4194 199 V 4.7619 8.7029 127.0483 61.0799 34.3661 174.2680 200 V 4.8268 9.0184 128.0576 61.0060 34.7141 173.7439 201 K 5.1727 9.1962 130.1523 54.8967 33.9997 174.9958 202 F 5.6179 9.1605 121.9444 55.8448 42.0327 173.1360 203 R 5.1342 8.9106 114.7464 54.6192 33.2695 174.0710 204 E 4.4996 9.2601 120.6257 56.3146 30.1204 177.6162 205 R 4.1693 8.5069 122.3260 56.5660 29.7114 176.6082 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 Q 8.20 4.25 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 2 A 8.09 3.78 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 3 N 8.29 4.30 0.00 2.79 3.07 0.00 0.00 6.70 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 7.77 3.72 0.00 1.65 1.71 0.38 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 5 M 8.27 3.94 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.54 0.00 6 R 8.06 3.85 0.00 2.14 2.12 0.00 3.13 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 7 L 7.86 3.02 0.00 1.08 1.16 -0.88 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.52 3.34 0.00 1.64 1.87 0.00 1.48 0.00 0.00 1.46 0.00 0.00 3.19 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.68 0.94 7.81 9 S 7.87 4.07 0.00 3.97 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 10 D 8.00 4.32 0.00 2.65 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 11 L 7.73 3.92 0.00 0.49 0.66 0.56 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 12 F 7.93 5.13 0.00 3.13 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 13 N 8.39 4.83 0.00 2.86 2.88 0.00 0.00 6.93 7.81 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 14 R 8.04 4.31 0.00 1.81 1.99 0.00 3.16 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 15 S 7.60 4.82 0.00 3.83 3.77 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 16 P 0.00 4.49 0.00 2.13 2.02 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.11 0.00 17 M 8.31 4.38 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.77 0.00 18 Y 8.80 4.17 0.00 2.95 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 19 P 0.00 4.42 0.00 2.08 2.03 0.00 3.25 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.81 0.00 20 G 5.81 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 0.00 0.00 0.00 21 P 0.00 4.39 0.00 2.16 1.86 0.00 2.96 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.41 0.00 22 T 7.54 4.77 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 23 K 8.63 4.65 0.00 1.77 1.85 0.00 1.20 0.00 0.00 2.18 0.00 0.00 2.13 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.20 1.14 7.81 24 D 7.95 4.53 0.00 2.69 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 25 D 7.66 4.79 0.00 2.60 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 26 P 0.00 4.75 0.00 2.09 2.33 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 27 L 8.95 4.84 0.00 1.61 1.39 0.89 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.63 5.12 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 1.32 0.00 0.00 29 V 8.92 4.77 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.02 0.00 0.00 30 T 9.18 5.07 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 1.33 0.00 0.00 31 L 9.01 5.27 0.00 1.51 1.31 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.48 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 0.00 0.00 0.00 0.00 33 F 9.38 5.08 0.00 2.90 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 34 T 8.39 4.76 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 0.81 0.00 0.00 35 L 8.45 4.64 0.00 1.69 1.66 1.05 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 9.23 4.56 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 37 D 7.71 4.35 0.00 2.63 2.41 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 38 I 8.67 4.52 1.96 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.77 0.37 0.00 0.00 39 V 8.65 4.03 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 0.74 0.00 0.00 0.98 0.00 0.00 40 K 7.85 4.83 0.00 1.88 1.72 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 41 V 8.57 4.82 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 0.56 0.00 0.00 1.02 0.00 0.00 42 D 8.90 4.88 0.00 2.68 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 43 S 8.84 4.37 0.00 4.02 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 44 S 8.20 4.29 0.00 4.09 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 45 T 7.82 4.35 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 46 N 7.96 4.31 0.00 2.91 2.87 0.00 0.00 6.99 7.42 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 47 E 7.53 4.97 0.00 1.82 1.74 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 2.23 2.38 0.00 48 V 8.31 4.73 1.51 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 0.94 0.00 0.00 0.84 0.00 0.00 49 D 9.18 5.66 0.00 2.67 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 9.16 5.38 0.00 1.87 1.77 0.66 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 51 V 8.83 4.77 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.90 0.00 0.00 52 Y 8.05 5.32 0.00 3.26 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 53 Y 8.42 5.22 0.00 2.97 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 E 8.89 4.48 0.00 2.01 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 1.83 1.47 0.00 55 Q 8.86 4.54 0.00 2.13 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 56 Q 9.40 5.39 0.00 2.43 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.54 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 57 R 9.35 5.47 0.00 1.75 1.74 0.00 3.13 0.00 0.00 3.30 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.36 0.00 58 W 7.82 5.35 0.00 3.42 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 59 K 8.68 4.90 0.00 1.67 1.65 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.68 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.25 1.46 7.81 60 L 8.66 4.63 0.00 1.52 1.31 0.56 -0.04 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 61 N 8.95 4.32 0.00 2.82 2.87 0.00 0.00 6.90 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 62 S 8.03 4.31 0.00 4.07 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 63 L 7.62 4.78 0.00 1.63 1.87 1.07 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 64 M 8.05 4.62 0.00 1.87 2.11 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.40 0.00 65 W 7.95 5.25 0.00 3.23 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 66 D 9.02 4.63 0.00 2.78 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 67 P 0.00 4.77 0.00 2.19 2.32 0.00 3.57 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 1.73 1.96 0.00 68 N 8.35 4.27 0.00 2.75 2.95 0.00 0.00 7.21 6.95 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 69 E 8.17 4.21 0.00 1.91 1.58 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 2.27 2.50 0.00 70 Y 7.31 4.66 0.00 3.04 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 71 G 8.56 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.63 4.32 0.00 2.89 2.92 0.00 0.00 6.85 7.10 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 73 I 7.78 3.91 2.10 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 1.42 0.62 1.13 0.00 0.00 74 T 8.60 4.78 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 1.25 0.00 0.00 75 D 8.32 5.55 0.00 2.76 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 76 F 8.84 5.04 0.00 3.11 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 77 R 8.63 5.10 0.00 1.75 1.92 0.00 3.30 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 78 T 8.77 4.75 4.74 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 1.31 0.00 0.00 79 S 8.94 4.49 0.00 3.92 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 80 A 9.21 3.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.42 4.01 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 82 D 7.91 4.28 0.00 2.32 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 0.00 0.00 0.00 83 I 7.13 4.79 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.79 1.04 0.00 0.00 84 W 8.99 4.28 0.00 3.53 3.45 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 85 T 6.80 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 0.94 0.00 0.00 86 P 0.00 3.41 0.00 2.03 1.79 0.00 2.89 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.41 0.00 87 D 8.25 4.76 0.00 2.86 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 88 I 7.54 4.60 1.97 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.86 1.13 0.00 0.00 89 T 9.41 4.92 4.69 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 1.11 0.00 0.00 90 A 8.66 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 9.21 4.98 0.00 2.84 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 92 S 7.64 4.55 0.00 4.01 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 93 S 8.30 4.79 0.00 4.16 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 94 T 8.46 4.58 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 95 R 7.56 4.70 0.00 1.78 1.81 0.00 3.39 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 96 P 0.00 4.24 0.00 2.02 1.98 0.00 3.68 0.00 0.00 3.57 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 97 V 8.32 3.89 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 0.91 0.00 0.00 1.03 0.00 0.00 98 Q 8.85 4.57 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.28 0.00 99 V 8.38 4.37 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 0.84 0.00 0.00 0.94 0.00 0.00 100 L 8.97 4.78 0.00 1.44 1.61 0.84 0.75 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 0.00 101 S 7.75 4.82 0.00 3.74 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 0.00 102 P 0.00 4.37 0.00 2.08 2.04 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 103 Q 8.41 4.82 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 104 I 8.01 5.12 1.92 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 1.31 0.65 0.95 0.00 0.00 105 A 9.21 5.05 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 8.46 4.51 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 0.92 0.00 0.00 0.90 0.00 0.00 107 V 8.23 4.61 0.98 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 0.99 0.00 0.00 0.69 0.00 0.00 108 T 8.56 5.20 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 1.08 0.00 0.00 109 H 8.27 2.00 0.00 1.96 2.55 0.00 5.45 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.20 4.15 0.00 2.60 2.46 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 0.00 111 G 8.04 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 S 8.13 4.49 0.00 3.66 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 0.00 113 V 8.48 4.50 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 0.38 0.00 0.00 0.66 0.00 0.00 114 M 8.80 5.03 0.00 1.96 1.73 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.40 0.00 115 F 9.40 5.20 0.00 3.03 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.05 5.19 1.67 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 0.97 1.85 0.85 0.00 0.00 117 P 0.00 4.07 0.00 1.93 1.71 0.00 3.46 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.55 0.00 118 A 9.04 4.84 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 0.00 119 Q 8.82 4.82 0.00 1.17 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.71 0.00 0.00 0.00 0.00 0.00 2.20 2.20 0.00 120 R 8.88 4.91 0.00 1.77 1.72 0.00 3.01 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 121 L 8.93 5.06 0.00 2.04 1.81 1.02 0.97 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 0.00 122 S 8.79 5.51 0.00 3.86 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 0.00 123 F 9.19 5.40 0.00 3.21 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 0.00 124 M 8.59 4.54 0.00 1.94 2.10 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.48 0.00 125 C 8.62 4.47 0.00 2.13 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 0.00 0.00 0.00 0.00 126 D 8.74 4.88 0.00 2.64 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 0.00 127 P 0.00 4.52 0.00 2.26 2.26 0.00 3.82 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.97 0.00 128 T 7.76 3.94 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 129 G 9.02 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 0.00 130 V 8.00 3.62 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.01 0.00 0.00 131 D 8.03 4.64 0.00 2.82 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 0.00 132 S 8.16 4.64 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 0.00 133 E 8.57 4.00 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 134 E 7.86 4.06 0.00 1.92 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 2.31 2.28 0.00 135 G 7.73 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 0.00 0.00 0.00 136 V 7.79 4.44 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 -0.07 0.00 0.00 0.84 0.00 0.00 137 T 8.37 5.18 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 138 C 9.44 5.39 0.00 3.22 3.27 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 0.00 139 A 8.65 5.46 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 0.00 140 V 8.67 4.38 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 0.18 0.00 0.00 0.35 0.00 0.00 141 K 8.50 4.78 0.00 1.74 1.63 0.00 1.74 0.00 0.00 2.08 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.53 7.81 142 F 8.57 4.82 0.00 2.88 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 0.00 143 G 8.13 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 S 9.04 4.95 0.00 4.15 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 0.00 145 W 9.27 4.50 0.00 3.46 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 0.00 146 V 8.35 4.24 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 0.94 0.00 0.00 0.64 0.00 0.00 147 Y 8.28 4.75 0.00 3.05 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 0.00 148 S 8.77 4.43 0.00 3.36 3.77 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 0.00 149 G 8.10 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 0.00 0.00 0.00 150 F 7.75 4.70 0.00 3.05 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 0.00 151 E 8.35 4.46 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.48 0.00 152 I 8.31 5.00 1.97 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 1.03 0.97 1.00 0.00 0.00 153 D 9.01 4.98 0.00 2.86 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 0.00 154 L 8.46 5.41 0.00 1.61 1.60 1.01 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 155 K 8.89 4.88 0.00 1.71 1.66 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.42 7.81 156 T 8.32 5.17 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 157 D 8.69 4.58 0.00 2.68 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 0.00 158 T 6.99 4.40 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 159 D 8.43 5.46 0.00 2.84 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 Q 7.86 4.86 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 161 V 8.19 3.70 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 0.72 0.00 0.00 0.93 0.00 0.00 162 D 9.00 4.47 0.00 2.76 2.57 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 0.00 0.00 0.00 0.00 163 L 8.48 4.63 0.00 1.73 1.64 0.84 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.81 4.35 0.00 3.99 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 0.00 165 S 7.87 4.75 0.00 3.88 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 0.00 166 Y 7.91 4.27 0.00 3.01 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 0.00 167 Y 8.18 4.19 0.00 2.74 2.50 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 0.00 168 A 8.73 4.04 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 0.00 169 S 5.84 4.38 0.00 3.13 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 0.00 170 S 6.80 4.35 0.00 3.95 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 0.00 171 K 8.62 4.04 0.00 1.19 1.17 0.00 1.53 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.48 1.34 7.81 172 Y 7.91 5.26 0.00 3.05 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 0.00 173 E 9.42 4.50 0.00 2.08 1.88 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 2.28 2.30 0.00 174 I 8.01 4.33 1.51 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 -0.10 0.04 0.80 0.00 0.00 175 L 9.17 4.52 0.00 1.61 1.71 0.92 0.87 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 0.00 176 S 7.81 4.75 0.00 3.84 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 0.00 177 A 8.39 5.06 1.16 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 0.00 178 T 9.01 5.15 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 1.20 0.00 0.00 179 Q 9.12 4.80 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 180 T 8.63 4.87 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 181 R 8.84 4.53 0.00 1.86 1.87 0.00 3.30 0.00 0.00 3.26 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 182 Q 9.69 4.78 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.52 0.00 0.00 0.00 0.00 0.00 2.28 2.50 0.00 183 V 8.61 4.82 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 0.70 0.00 0.00 0.95 0.00 0.00 184 Q 9.30 4.83 0.00 1.72 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.51 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 185 H 8.57 5.07 0.00 3.08 3.21 0.00 5.89 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 *191 E 8.49 2.69 0.00 1.16 1.12 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 1.99 2.15 0.00 192 P 0.00 4.32 0.00 1.89 1.93 0.00 2.20 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.88 0.00 193 Y 8.92 4.78 0.00 2.83 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 I 8.56 5.17 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 1.40 0.87 0.99 0.00 0.00 195 D 9.13 5.00 0.00 2.82 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 V 8.83 4.66 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 1.14 0.00 0.00 1.00 0.00 0.00 197 N 9.25 4.84 0.00 3.04 2.69 0.00 0.00 6.37 6.66 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 0.00 198 L 8.86 4.64 0.00 1.23 1.47 0.57 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 199 V 8.70 4.76 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 0.90 0.00 0.00 0.92 0.00 0.00 200 V 9.02 4.83 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 0.95 0.00 0.00 0.83 0.00 0.00 201 K 9.20 5.17 0.00 1.87 1.75 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.33 7.81 202 F 9.16 5.62 0.00 3.31 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 0.00 203 R 8.91 5.13 0.00 2.05 2.01 0.00 2.79 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 204 E 9.26 4.50 0.00 1.86 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 2.54 2.55 0.00 205 R 8.51 4.17 0.00 1.62 1.82 0.00 3.14 0.00 0.00 3.24 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.59 0.00 * Residues marked with a * may have inaccurate shift predictions.