NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 I 4.2829 8.0244 121.4514 61.3824 38.3199 174.9245 3 V 3.7118 8.7423 126.6959 64.7090 32.2065 174.4377 4 G 4.6498 7.6704 104.1876 46.1659 0.0000 171.8106 5 L 5.2615 8.1220 122.4834 53.1793 45.8240 175.2691 6 G 4.3629 9.1051 111.7741 45.1801 0.0000 171.1844 7 T 5.2658 8.2324 115.0525 60.8485 70.9097 172.1582 8 D 4.7696 8.7715 123.8090 53.1799 45.2324 173.7071 9 I 5.0882 8.4391 123.4794 59.1662 41.1418 174.1522 10 A 4.9199 9.3859 130.1300 50.0445 22.4882 174.8452 11 E 4.4038 8.8828 123.0313 55.3291 30.1964 177.1736 12 I 3.6986 8.5343 129.0823 64.5066 37.0486 178.0020 13 E 4.0402 8.0539 119.6002 59.4063 29.4295 179.0113 14 R 3.8300 7.7493 118.2184 59.0060 30.0929 179.1965 15 V 3.5247 7.6124 117.6640 65.9361 31.6678 177.7428 16 E 4.0065 8.3179 118.4050 59.4286 29.3222 179.5285 17 K 3.9183 8.2860 118.4648 59.3601 32.0481 179.2230 18 A 3.7037 7.7920 120.9995 55.0429 18.1137 179.7410 19 L 4.0911 8.0155 117.2710 57.8767 41.4982 179.5798 20 A 4.0409 7.9448 119.8234 54.6184 18.2777 179.5782 21 R 4.1436 7.4604 115.5041 58.6292 30.8421 178.3162 22 S 4.7149 8.4324 112.2778 55.9564 64.8111 176.2423 23 G 3.9887 8.7906 111.4782 45.9174 0.0000 175.6647 24 E 4.0123 9.0839 124.3775 59.1079 28.9776 177.5177 25 N 4.3819 7.8520 115.6621 56.1819 38.9211 176.9081 26 F 4.4066 8.2248 121.2779 61.3136 39.6078 176.9230 27 A 3.4607 8.1607 120.5227 55.1085 17.9092 179.7446 28 R 3.8397 8.0980 115.3437 58.6300 30.1569 178.8252 29 R 3.9931 7.5365 117.8922 58.6706 30.0585 177.6205 30 I 3.5576 7.0688 117.7943 61.2768 38.4163 175.7966 31 L 4.7963 7.1838 118.5866 53.1374 43.4210 177.1496 32 T 4.0087 8.7956 113.5290 61.1794 70.7865 175.5723 33 D 4.3429 8.4427 121.3744 57.7107 41.1894 178.8338 34 S 4.2496 7.9648 113.0866 61.4273 62.4975 175.9126 35 E 4.2433 8.1915 120.7696 59.1345 29.1912 179.2089 36 L 4.0352 7.8651 119.2325 57.2501 41.4049 179.1000 37 E 3.9138 7.7882 118.3607 59.4755 29.4144 178.9212 38 Q 3.9988 8.0000 116.1976 58.6899 29.1783 177.9406 39 F 2.8319 7.9016 121.6305 61.4021 39.1885 176.9147 40 H 3.9439 8.2914 114.2492 58.6546 28.5402 177.1221 41 A 4.0856 7.2861 120.9597 52.8565 18.7951 177.8077 42 S 4.1621 6.9400 112.0479 58.2305 62.9232 173.9429 43 K 4.3962 8.4287 123.7409 56.4886 33.0496 176.8654 44 Q 4.6236 7.9460 117.6350 53.8391 29.2873 176.0167 45 Q 4.0226 7.9451 120.0939 58.7050 29.1476 178.8547 46 G 3.7558 8.1558 106.3560 48.0331 0.0000 175.7934 47 R 3.9735 8.0315 120.5640 58.6577 30.0778 178.5219 48 F 4.0375 8.5974 120.7709 61.5983 39.3619 177.0883 49 L 4.2099 8.8800 119.8883 57.8968 41.8479 178.5810 50 A 4.0950 8.4577 121.2298 55.1848 18.2472 179.7939 51 K 3.9692 8.0575 116.7431 59.6516 32.0195 179.9001 52 R 3.8520 7.7932 118.1368 59.0047 29.9256 178.7806 53 F 3.9881 8.7092 120.6973 61.3232 39.3550 177.0066 54 A 4.4773 8.6677 121.4815 54.6151 18.1020 179.4749 55 A 3.8502 8.2281 119.4309 55.3126 18.3975 180.1108 56 K 3.4616 8.2223 117.3109 59.2390 32.0629 179.5360 57 E 3.5940 8.0342 118.7512 59.1934 29.3905 179.0988 58 A 3.8656 7.9686 120.6198 55.1969 18.3966 179.5620 59 A 3.8541 7.8758 119.5295 55.2252 18.3981 180.0643 60 S 4.1739 7.6568 112.9210 61.3892 63.0388 176.8867 61 K 3.9916 7.9938 122.0163 58.9900 31.8044 179.1547 62 A 4.2444 7.9138 122.6146 54.4686 18.0442 179.3941 63 L 4.0462 7.8048 118.2075 56.5110 42.2254 177.9609 64 G 4.0352 7.9328 105.7720 45.2244 0.0000 173.6699 65 T 4.2372 7.6519 108.7682 60.1795 70.7809 175.7726 66 G 4.0491 7.8318 110.9367 45.5688 0.0000 173.8931 67 I 3.9887 8.0124 117.1432 58.4077 35.5281 174.6054 68 A 4.2212 7.9800 126.5760 52.0186 21.7454 176.0538 69 Q 3.5285 9.8087 114.8281 57.1702 26.1636 175.6669 70 G 3.7899 8.4373 104.4051 45.3564 0.0000 174.4904 71 V 3.9174 7.7757 121.2007 62.1838 31.2810 175.2557 72 T 4.4563 8.2594 117.8365 59.4254 71.1804 175.7246 73 F 4.3813 8.5172 120.2194 61.1704 38.9665 177.1799 74 H 4.6713 7.7323 115.1657 57.4064 28.6850 175.7225 75 D 4.4889 8.0138 118.8366 54.1931 40.9708 175.4417 76 F 5.3139 7.8659 118.0489 55.8064 41.8968 174.7847 77 T 4.8432 9.0166 119.5809 61.8533 71.8035 172.8206 78 I 4.8622 8.8980 127.7173 60.0481 38.9129 175.1832 79 S 4.9433 8.8725 121.7642 57.2180 66.6187 172.2264 80 H 5.4354 8.6100 114.6092 54.6497 33.0319 173.4840 81 D 4.7678 8.8797 121.2420 51.9500 41.0779 177.4774 82 K 4.0423 8.4999 117.5513 59.0441 31.9685 178.1605 83 L 4.2653 8.0607 116.9853 54.8094 41.9297 177.4760 84 G 4.0018 8.1967 107.3648 44.3956 0.0000 173.7784 85 K 4.2502 8.0853 122.4879 55.6472 33.2257 174.2416 86 P 4.7527 0.0000 0.0000 62.7334 32.4189 175.4785 87 L 4.8699 9.0210 121.6225 52.8261 45.6636 175.0201 88 L 5.1354 8.5390 123.7659 53.3639 44.3990 175.3307 89 I 4.6113 8.8119 126.9449 59.5422 40.1505 174.7421 90 L 5.0510 8.5266 126.2761 53.6752 43.4744 175.5376 91 S 4.3688 8.5711 115.7693 56.9997 67.1301 174.5476 92 G 3.8577 8.7688 108.0223 46.5922 0.0000 175.9479 93 Q 3.9098 8.6050 119.2224 58.8726 28.9131 178.1628 94 A 3.8217 7.8478 121.3840 54.9981 18.3856 179.2926 95 A 3.8490 7.7960 119.3085 55.0427 18.4010 179.5595 96 E 3.8199 8.0500 117.7832 59.3811 29.7705 179.0190 97 L 3.9443 8.0407 118.8633 57.8385 41.6333 179.3443 98 A 3.9961 8.2022 120.8511 55.1526 18.2661 179.6327 99 S 3.9929 8.2544 111.6986 61.6164 62.2609 176.2281 100 Q 4.0220 7.8288 119.5277 59.0612 28.6396 178.4909 101 L 4.2193 7.7992 116.3955 54.4034 41.9971 176.8113 102 Q 3.5321 7.9798 116.9547 56.5166 26.7132 174.0905 103 V 3.8228 7.9395 117.7907 63.3270 31.9418 174.8721 104 E 4.6811 9.1697 127.1730 56.1639 32.1478 175.5710 105 N 5.0938 8.0403 115.8230 51.3784 43.0096 173.3931 106 I 4.9485 8.2915 122.8743 59.7869 40.5739 174.4825 107 H 4.9980 9.1717 123.3110 53.8572 32.2416 172.4258 108 L 5.2179 8.5494 123.7460 53.4126 45.2082 175.2383 109 S 4.8291 9.1457 119.5974 56.6080 66.0983 172.5284 110 I 4.9784 8.3165 125.1123 59.7798 40.3855 174.7443 111 S 4.6995 8.4444 118.2298 56.9875 65.5274 172.4146 112 D 4.9762 8.3406 123.5509 51.8579 42.2796 174.2780 113 E 4.8323 8.6705 118.1772 54.6815 32.5639 174.9299 114 R 3.9910 8.8375 116.5969 59.8596 30.0748 177.2214 115 H 4.6500 8.5712 111.9076 55.5569 30.9354 173.3151 116 Y 5.2952 7.8572 115.9993 56.0697 42.2243 174.4721 117 A 5.4409 9.2044 123.7964 49.2054 23.0191 174.8915 *119 A 4.5347 8.2157 118.9315 52.4716 20.4573 176.0119 120 T 5.1197 8.6868 115.4748 61.7447 73.0115 173.3461 121 V 4.9150 8.9250 124.7056 61.1659 35.1784 174.1495 122 I 5.0237 8.8961 127.7407 59.4997 40.7521 174.2115 123 L 5.2874 8.9149 126.8117 52.9268 44.2344 175.3987 124 E 5.0759 9.3462 121.1184 54.3601 33.5461 176.1640 125 R 4.3124 8.4934 116.2184 56.4191 29.7228 175.7104 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 I 8.02 4.28 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 1.30 1.07 0.99 0.00 0.00 3 V 8.74 3.71 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 0.69 0.00 0.00 1.00 0.00 0.00 4 G 7.67 4.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.12 5.26 0.00 1.71 1.44 0.91 0.99 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 6 G 9.11 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.23 5.27 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 8 D 8.77 4.77 0.00 2.77 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 9 I 8.44 5.09 1.87 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.34 0.92 0.00 0.00 10 A 9.39 4.92 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 11 E 8.88 4.40 0.00 2.15 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.01 0.00 12 I 8.53 3.70 1.86 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 1.42 0.48 0.90 0.00 0.00 13 E 8.05 4.04 0.00 1.97 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 2.33 2.37 0.00 14 R 7.75 3.83 0.00 1.87 1.87 0.00 3.34 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 15 V 7.61 3.52 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 1.30 0.00 0.00 0.89 0.00 0.00 16 E 8.32 4.01 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 17 K 8.29 3.92 0.00 1.82 1.78 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.57 7.81 18 A 7.79 3.70 0.46 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 0.00 0.00 19 L 8.02 4.09 0.00 1.95 1.85 1.18 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.94 4.04 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 21 R 7.46 4.14 0.00 1.83 1.94 0.00 3.05 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.83 0.00 22 S 8.43 4.71 0.00 3.89 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 23 G 8.79 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 24 E 9.08 4.01 0.00 2.18 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 2.44 2.52 0.00 25 N 7.85 4.38 0.00 2.92 2.93 0.00 0.00 6.99 8.72 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 26 F 8.22 4.41 0.00 3.03 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.16 3.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.10 3.84 0.00 1.81 2.01 0.00 3.19 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 29 R 7.54 3.99 0.00 1.81 1.77 0.00 3.33 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 30 I 7.07 3.56 1.44 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.34 0.58 0.00 0.00 31 L 7.18 4.80 0.00 1.43 1.50 0.43 1.15 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 32 T 8.80 4.01 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 1.25 0.00 0.00 33 D 8.44 4.34 0.00 2.65 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 34 S 7.96 4.25 0.00 3.89 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 35 E 8.19 4.24 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 36 L 7.87 4.04 0.00 1.88 1.60 0.93 0.70 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 37 E 7.79 3.91 0.00 2.16 1.97 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 2.32 2.41 0.00 38 Q 8.00 4.00 0.00 2.34 2.37 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 2.47 2.52 0.00 39 F 7.90 2.83 0.00 2.70 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 40 H 8.29 3.94 0.00 3.19 3.26 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.29 4.09 1.30 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 0.00 0.00 42 S 6.94 4.16 0.00 3.61 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 43 K 8.43 4.40 0.00 1.74 1.77 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.39 7.81 44 Q 7.95 4.62 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 45 Q 7.95 4.02 0.00 1.92 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 1.65 2.16 0.00 46 G 8.16 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.03 3.97 0.00 2.05 2.04 0.00 3.16 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 48 F 8.60 4.04 0.00 3.31 3.38 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 49 L 8.88 4.21 0.00 2.11 1.92 0.67 1.00 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 50 A 8.46 4.09 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 51 K 8.06 3.97 0.00 1.91 1.81 0.00 1.64 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.49 7.81 52 R 7.79 3.85 0.00 1.93 1.97 0.00 3.24 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 53 F 8.71 3.99 0.00 3.10 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.67 4.48 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 55 A 8.23 3.85 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 56 K 8.22 3.46 0.00 1.82 1.73 0.00 1.88 0.00 0.00 2.12 0.00 0.00 3.13 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.74 7.81 57 E 8.03 3.59 0.00 1.88 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 0.00 1.88 1.53 0.00 58 A 7.97 3.87 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 59 A 7.88 3.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 7.66 4.17 0.00 4.09 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.99 3.99 0.00 1.92 1.85 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.51 7.81 62 A 7.91 4.24 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 63 L 7.80 4.05 0.00 1.93 1.93 0.95 1.33 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 64 G 7.93 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.65 4.24 4.36 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 0.00 0.00 1.21 0.00 0.00 66 G 7.83 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 I 8.01 3.99 1.59 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.71 0.45 0.00 0.00 68 A 7.98 4.22 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 9.81 3.53 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.67 0.00 0.00 0.00 0.00 0.00 2.25 2.27 0.00 70 G 8.44 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 7.78 3.92 2.34 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 1.06 0.00 0.00 0.90 0.00 0.00 72 T 8.26 4.46 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 1.21 0.00 0.00 73 F 8.52 4.38 0.00 3.27 3.36 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 0.00 0.00 0.00 74 H 7.73 4.67 0.00 2.97 3.35 0.00 5.67 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 75 D 8.01 4.49 0.00 2.16 2.29 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 76 F 7.87 5.31 0.00 2.91 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 77 T 9.02 4.84 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 78 I 8.90 4.86 1.85 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 1.43 0.78 0.80 0.00 0.00 79 S 8.87 4.94 0.00 3.85 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 80 H 8.61 5.44 0.00 2.98 3.21 0.00 5.89 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 81 D 8.88 4.77 0.00 2.90 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.50 4.04 0.00 1.78 1.93 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.48 7.81 83 L 8.06 4.27 0.00 1.77 1.71 0.93 0.78 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 84 G 8.20 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 85 K 8.09 4.25 0.00 1.87 1.98 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.46 7.81 86 P 0.00 4.75 0.00 2.05 1.98 0.00 3.77 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 2.16 1.99 0.00 87 L 9.02 4.87 0.00 1.49 1.53 0.92 0.37 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 88 L 8.54 5.14 0.00 1.60 1.53 1.05 1.02 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 89 I 8.81 4.61 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.84 0.90 0.00 0.00 90 L 8.53 5.05 0.00 1.46 1.43 0.93 0.93 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 91 S 8.57 4.37 0.00 3.75 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 92 G 8.77 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 8.60 3.91 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 94 A 7.85 3.82 0.77 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 0.00 0.00 95 A 7.80 3.85 1.30 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 0.00 0.00 96 E 8.05 3.82 0.00 2.08 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 0.00 2.28 2.37 0.00 97 L 8.04 3.94 0.00 1.84 1.69 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.20 4.00 1.37 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 0.00 0.00 99 S 8.25 3.99 0.00 3.96 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 0.00 100 Q 7.83 4.02 0.00 2.22 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 101 L 7.80 4.22 0.00 1.75 1.71 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.98 3.53 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 103 V 7.94 3.82 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 0.72 0.00 0.00 0.93 0.00 0.00 104 E 9.17 4.68 0.00 1.92 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 0.00 2.19 2.28 0.00 105 N 8.04 5.09 0.00 2.71 2.65 0.00 0.00 6.93 7.21 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 0.00 106 I 8.29 4.95 1.84 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 1.34 0.58 0.92 0.00 0.00 107 H 9.17 5.00 0.00 3.04 3.14 0.00 5.56 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.55 5.22 0.00 1.56 1.46 0.89 0.82 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 0.00 109 S 9.15 4.83 0.00 3.89 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 I 8.32 4.98 1.87 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 1.21 0.77 0.90 0.00 0.00 111 S 8.44 4.70 0.00 3.80 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 8.34 4.98 0.00 2.94 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 E 8.67 4.83 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.57 0.00 114 R 8.84 3.99 0.00 1.69 1.76 0.00 3.12 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 115 H 8.57 4.65 0.00 3.06 2.65 0.00 5.75 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 7.86 5.30 0.00 2.94 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 0.00 117 A 9.20 5.44 1.29 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 *119 A 8.22 4.53 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 T 8.69 5.12 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 1.26 0.00 0.00 121 V 8.92 4.91 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.91 0.00 0.00 122 I 8.90 5.02 1.91 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 0.58 0.93 0.00 0.00 123 L 8.91 5.29 0.00 1.58 1.56 0.98 0.94 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 0.00 124 E 9.35 5.08 0.00 1.98 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 2.37 2.25 0.00 125 R 8.49 4.31 0.00 2.04 1.91 0.00 3.06 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.