NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3883 8.3044 120.3494 54.8449 33.4115 174.9516 2 I 3.6459 8.3673 126.1587 61.1512 38.7608 173.2372 3 Q 4.8752 8.3343 124.5959 54.1958 33.7100 173.7964 4 S 5.1868 8.6024 115.6219 56.9274 66.5776 172.8412 5 Q 4.9133 8.8893 119.8172 54.3217 30.6696 175.9074 6 I 4.3506 8.4805 112.6150 60.1886 39.1676 174.7605 7 N 4.8442 7.8296 119.9842 51.0114 40.5033 174.5524 8 R 3.9446 8.6360 124.1161 59.4002 29.2639 178.2744 9 N 4.3340 8.5818 117.2134 55.8542 38.5083 177.1873 10 I 3.6844 7.4380 121.5644 64.7191 37.2902 178.6863 11 R 4.0039 7.8930 118.1089 59.0347 29.9952 179.0558 12 L 4.0124 8.2061 119.2664 57.7087 41.5854 179.0529 13 D 4.3509 8.2406 118.9528 57.3723 40.7273 178.5785 14 L 3.9327 7.8428 120.0226 58.1456 41.9532 178.8560 15 A 4.1300 8.0777 120.6460 55.3636 18.3238 179.3727 16 D 4.2843 8.1587 117.0716 57.2544 40.8415 178.8391 17 A 3.9791 8.0031 121.2916 55.2325 18.4454 179.4334 18 I 3.6502 8.0448 118.7158 64.8970 37.2661 178.6752 19 L 4.0874 8.2249 119.6695 57.4438 41.2884 179.4099 20 L 3.8908 8.0549 120.3727 58.1493 42.1382 178.6919 21 S 4.0399 8.0831 113.1054 61.4300 62.2972 175.8577 22 K 3.7241 8.5637 122.1186 59.6255 31.8451 178.5060 23 A 3.9260 7.9904 120.6816 55.1439 18.1241 179.4990 24 K 3.8418 8.0216 116.0676 59.4964 32.2487 178.6868 25 K 4.2412 7.8298 115.2359 55.2899 32.5154 175.9781 26 D 4.3273 7.7888 117.7902 54.9382 40.2694 173.5226 27 L 4.3001 7.6972 115.8192 53.9496 42.9010 177.4845 28 S 4.6173 8.0128 115.8906 56.8978 66.4070 175.3869 29 F 4.1348 8.3136 121.7344 60.5896 38.5964 177.5617 30 A 4.0421 8.2138 120.0323 55.4763 17.9122 179.2178 31 E 3.9298 8.0157 116.2655 59.3283 29.7899 178.5383 32 I 3.8257 7.7584 118.9304 64.3665 37.4983 177.8278 33 A 4.2879 8.1651 120.7358 52.8191 18.3806 176.9369 34 D 4.4508 7.1641 117.9255 55.7830 41.5150 176.6113 35 G 4.0132 9.0661 114.9390 45.5878 0.0000 173.8545 36 T 4.0472 7.7597 109.3888 62.0777 69.3467 176.2871 37 G 3.9485 8.4095 108.9869 45.2647 0.0000 172.7956 38 L 4.7461 7.4843 118.1800 51.9315 44.8918 176.9445 39 A 4.1739 8.3626 123.0739 51.6547 20.2288 178.1779 40 E 3.8667 8.9576 124.1202 59.7868 29.6897 179.7121 41 A 3.9166 7.9931 119.8846 54.9018 18.4778 179.1983 42 F 3.8515 8.1417 118.6750 61.4733 39.6859 177.3537 43 V 3.6117 8.1574 117.9646 66.2733 31.3505 178.0417 44 T 3.7709 8.1751 115.4358 66.5645 68.2041 176.3037 45 A 3.8238 7.8763 122.3239 54.9890 18.3144 179.3987 46 A 4.1626 7.4542 120.3891 54.8536 18.2500 179.7599 47 L 3.9884 7.6486 115.8379 57.8131 41.7927 178.9641 48 L 4.4073 7.6804 115.8241 54.7199 41.7475 177.5599 49 G 3.9507 7.9969 107.6395 45.4585 0.0000 174.2525 50 Q 4.5026 8.1071 116.4249 55.4857 29.8486 175.0580 51 Q 4.4098 7.3844 115.9842 54.2937 32.9895 172.7133 52 A 4.9409 8.2956 120.9114 50.6557 20.7280 176.7377 53 L 4.6534 8.7455 122.4932 53.1614 43.5920 175.1018 54 P 4.6226 0.0000 0.0000 62.3549 32.4516 177.1516 55 A 3.9809 8.9350 123.7115 55.8462 18.1793 180.0531 56 D 4.2682 8.0614 116.3174 57.5200 40.9443 178.7649 57 A 4.0355 8.0116 120.6116 54.8503 18.4444 179.2256 58 A 3.9526 8.3224 119.6630 55.5463 18.5058 180.0735 59 R 3.8748 8.1840 116.5765 59.2179 30.2117 179.1573 60 L 3.9451 7.9848 119.9940 58.4051 42.1991 179.4766 61 V 3.7872 8.1226 112.6823 64.3454 31.3891 178.8786 62 G 3.6226 8.2679 105.4193 47.4331 0.0000 175.6642 63 A 4.0031 8.1057 123.0446 55.2035 18.2474 180.0021 64 K 3.9661 7.8699 115.3126 58.7326 32.1993 178.6306 65 L 4.3898 7.7687 116.6009 53.2967 42.4304 175.6258 66 D 4.3801 7.5899 117.5694 55.0303 40.1318 173.5919 67 L 4.2547 8.1147 117.1487 53.9094 42.7035 177.7044 68 D 4.6973 8.3103 122.1017 52.8050 41.7909 177.3902 69 E 3.9772 8.5354 118.3222 59.7041 29.3404 179.2379 70 D 4.3576 8.0867 118.4307 57.4780 40.9329 178.9727 71 S 4.1338 8.6387 115.9270 61.6039 62.6129 176.7722 72 I 3.7369 7.6675 121.5828 64.0677 37.1124 177.8438 73 L 4.0997 8.1994 121.4976 58.2956 41.9485 178.9360 74 L 4.0056 8.2086 119.1085 57.9823 41.5033 179.5412 75 L 4.1264 7.9970 118.0988 57.0395 41.3015 178.6207 76 Q 4.7199 7.6361 117.6621 55.4447 29.4655 175.8350 77 M 4.5179 7.2276 120.1486 54.8622 33.1628 176.3272 78 I 4.0676 8.7054 124.4311 60.7063 38.1910 174.3204 79 P 4.7358 0.0000 0.0000 62.1767 32.9639 176.1735 80 L 4.3456 8.2806 123.0174 53.9499 41.4334 176.4458 81 R 4.1290 8.2214 124.8398 55.9657 30.8335 175.2807 82 G 3.1397 8.1727 107.3079 44.9267 0.0000 173.4032 83 C 4.3118 8.2161 122.5387 58.7291 30.7230 174.4574 84 I 3.9855 7.4926 121.8578 60.5308 37.4874 174.8007 85 D 4.4822 8.8913 125.6976 57.1263 41.4866 176.7547 86 D 4.6375 7.3997 114.9886 53.3449 41.6346 173.7536 87 R 4.2109 8.1446 127.2042 56.6705 29.1691 176.9464 88 I 4.0262 7.1723 116.1196 58.2592 38.9629 173.9811 89 P 4.3935 0.0000 0.0000 63.0034 31.7591 176.5753 90 T 4.1412 8.3868 112.0846 63.6009 69.8639 175.4249 91 D 4.5138 7.9767 122.1506 53.1254 42.6826 174.5354 92 P 4.3667 0.0000 0.0000 66.2825 31.1666 178.8260 93 T 3.9246 7.9719 112.6919 67.1012 68.6821 176.2360 94 M 4.4731 8.1563 120.6596 58.4618 31.9558 177.9990 95 Y 3.9802 8.7698 120.1143 60.9780 38.9454 178.4184 96 R 3.9241 8.1251 118.7207 59.5335 29.5594 179.0347 97 F 4.1848 7.9162 117.3645 60.4085 38.8264 177.1727 98 Y 3.9606 7.7606 118.9337 60.5755 38.5978 177.3298 99 E 3.7025 8.0612 120.6594 59.4257 29.6366 178.4392 100 M 4.0826 8.0162 118.7162 58.6389 31.9297 178.8326 101 L 3.9822 7.4051 117.9305 57.8181 41.5936 179.4657 102 Q 3.7662 7.4939 117.0575 58.6294 28.6138 178.6830 103 V 3.6452 7.7485 118.5573 64.9712 32.0774 176.7747 104 Y 4.8156 8.1276 114.0190 57.3825 38.6986 177.6891 105 G 3.7158 8.3257 109.1077 48.2530 0.0000 176.0452 106 T 4.0535 7.8465 111.6922 64.4332 68.9042 176.9313 107 T 3.9099 7.8839 118.3788 66.3897 68.5170 176.3110 108 L 3.9768 8.4315 121.3725 57.7107 41.6368 179.3391 109 K 3.7571 8.0860 119.0509 59.5989 32.1001 178.2894 110 A 4.0193 8.2141 121.0526 55.4888 18.2104 179.4682 111 L 4.0724 8.3043 117.0776 57.0947 41.7628 179.7464 112 V 3.7873 8.0999 118.8775 66.4035 31.3819 177.7847 113 H 5.0052 8.2145 117.3567 58.4432 28.3270 177.3996 114 E 3.9368 8.2121 120.0721 59.2980 29.5830 178.6289 115 K 3.9603 8.1328 117.0680 57.6855 32.2741 177.4311 116 F 4.1040 8.7370 115.5426 59.7701 41.3131 174.6983 117 G 3.9152 7.8740 105.1226 43.4846 0.0000 171.3774 118 D 4.7061 8.7349 120.1988 53.6502 42.4171 175.3301 119 G 4.0975 7.9379 114.3930 45.4588 0.0000 172.1046 120 I 4.7976 8.3403 116.2137 59.2944 41.8054 174.9320 121 I 4.4449 8.2848 124.3017 59.8607 37.7186 176.1978 122 G 3.8035 8.7535 115.1271 46.4799 0.0000 172.9640 123 A 4.0769 8.4922 123.4956 51.5323 19.8586 177.0864 124 I 4.2577 7.7554 116.5972 63.0511 39.1727 176.1539 125 N 4.7832 7.7822 121.7882 51.9071 37.9349 172.3016 126 F 5.4391 8.0044 122.5914 56.5404 42.7952 172.5505 127 K 4.5396 8.4154 124.2615 54.8922 36.4275 174.6600 128 L 5.1686 8.1787 122.3426 53.3516 44.9109 175.0683 129 D 4.9162 8.8772 124.2453 51.6509 43.5414 174.1741 130 V 4.7264 8.3798 119.2861 61.0410 33.9388 174.3752 131 K 4.5992 9.0147 129.5330 54.3741 34.7493 174.7118 132 K 4.8934 8.7537 129.2541 56.0238 33.2628 176.1441 133 V 4.6532 8.6349 125.3577 59.6559 35.1170 174.4317 134 A 4.3621 8.6751 125.1793 52.1746 19.4167 176.2218 135 D 4.6239 8.9285 122.4482 52.4230 41.8750 175.6629 136 P 4.5017 0.0000 0.0000 65.5757 31.4972 177.2011 137 E 4.1108 8.7746 116.2440 56.4076 29.7461 177.2098 138 G 3.9667 8.5995 108.3558 46.3478 0.0000 175.2045 139 G 3.8399 9.2619 109.1413 44.0413 0.0000 171.6189 140 E 5.2169 8.3278 116.9719 54.7315 33.8570 175.4270 141 R 4.8110 9.0600 119.7436 54.4212 34.3910 174.3110 142 A 5.0989 8.5804 123.2941 50.5367 20.8684 176.5181 143 V 4.1545 9.0848 123.9565 61.5567 33.1484 174.6094 144 I 4.8082 8.3802 129.5926 60.1260 38.8231 175.3812 145 T 4.4229 8.8593 125.2301 61.9854 70.3192 173.9790 146 L 4.2558 8.5911 127.4561 53.4453 42.8590 175.9558 147 D 4.7045 8.6296 126.4586 52.1921 42.2647 174.6242 148 G 4.6138 8.3514 111.5268 43.7755 0.0000 170.1592 149 K 4.3616 8.7171 125.3187 55.8386 33.5177 175.4811 150 Y 4.6641 8.6402 128.9998 57.7173 39.7569 174.7816 151 L 4.4299 8.6653 126.9234 51.9276 44.3568 174.1520 152 P 4.5014 0.0000 0.0000 62.7714 32.3560 175.9540 153 T 4.4925 8.8795 119.5877 62.2664 69.9109 174.0393 154 K 4.6836 8.5231 125.8917 53.4962 34.6678 174.5725 155 P 4.4480 0.0000 0.0000 63.0325 31.9733 176.4253 156 F 4.5583 7.9445 113.6352 57.2541 37.9632 174.5519 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.39 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.37 3.65 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.05 0.91 0.00 0.00 3 Q 8.33 4.88 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.55 0.00 0.00 0.00 0.00 0.00 2.51 2.27 0.00 4 S 8.60 5.19 0.00 3.80 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.89 4.91 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 6 I 8.48 4.35 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 0.67 0.91 0.00 0.00 7 N 7.83 4.84 0.00 2.76 2.68 0.00 0.00 6.93 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 8 R 8.64 3.94 0.00 2.06 2.30 0.00 3.13 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.58 4.33 0.00 2.87 2.91 0.00 0.00 6.84 6.76 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 10 I 7.44 3.68 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 1.52 1.27 0.91 0.00 0.00 11 R 7.89 4.00 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.45 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.21 4.01 0.00 1.67 1.71 0.91 1.09 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 13 D 8.24 4.35 0.00 2.95 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 14 L 7.84 3.93 0.00 1.79 1.83 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.08 4.13 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 16 D 8.16 4.28 0.00 2.89 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 17 A 8.00 3.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.04 3.65 2.04 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 1.54 0.76 0.96 0.00 0.00 19 L 8.22 4.09 0.00 1.85 1.75 0.99 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.05 3.89 0.00 1.77 1.81 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.08 4.04 0.00 3.92 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 22 K 8.56 3.72 0.00 1.79 1.91 0.00 1.15 0.00 0.00 1.21 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.24 7.81 23 A 7.99 3.93 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 24 K 8.02 3.84 0.00 1.88 1.89 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.62 7.81 25 K 7.83 4.24 0.00 1.71 1.81 0.00 1.93 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.52 7.81 26 D 7.79 4.33 0.00 2.75 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 27 L 7.70 4.30 0.00 1.70 1.43 0.95 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.01 4.62 0.00 4.03 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.31 4.13 0.00 3.20 3.14 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 30 A 8.21 4.04 1.41 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 31 E 8.02 3.93 0.00 1.98 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 0.00 2.31 2.34 0.00 32 I 7.76 3.83 2.06 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.75 0.96 0.00 0.00 33 A 8.17 4.29 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 34 D 7.16 4.45 0.00 2.72 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 35 G 9.07 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.76 4.05 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 37 G 8.41 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 38 L 7.48 4.75 0.00 1.72 1.62 1.01 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 39 A 8.36 4.17 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 40 E 8.96 3.87 0.00 2.08 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 2.41 2.48 0.00 41 A 7.99 3.92 1.34 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 42 F 8.14 3.85 0.00 3.18 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 43 V 8.16 3.61 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.08 0.00 0.00 44 T 8.18 3.77 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 0.32 0.00 0.00 45 A 7.88 3.82 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 7.45 4.16 1.19 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 47 L 7.65 3.99 0.00 1.85 1.84 1.15 0.84 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 48 L 7.68 4.41 0.00 1.66 1.63 0.72 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.11 4.50 0.00 1.97 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.64 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 51 Q 7.38 4.41 0.00 1.39 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.90 0.00 0.00 0.00 0.00 0.00 2.00 1.40 0.00 52 A 8.30 4.94 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.75 4.65 0.00 1.65 1.65 0.96 1.34 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 54 P 0.00 4.62 0.00 2.10 1.98 0.00 3.71 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.12 0.00 55 A 8.94 3.98 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 D 8.06 4.27 0.00 2.71 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 57 A 8.01 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 A 8.32 3.95 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 59 R 8.18 3.87 0.00 2.10 2.00 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 60 L 7.98 3.95 0.00 1.87 1.83 0.93 0.96 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 61 V 8.12 3.79 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 0.77 0.00 0.00 1.02 0.00 0.00 62 G 8.27 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 0.00 0.00 0.00 63 A 8.11 4.00 1.41 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 64 K 7.87 3.97 0.00 1.92 1.88 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.66 7.81 65 L 7.77 4.39 0.00 1.73 1.69 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.59 4.38 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.11 4.25 0.00 1.65 1.58 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.31 4.70 0.00 2.95 2.82 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 69 E 8.54 3.98 0.00 2.00 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 2.40 2.34 0.00 70 D 8.09 4.36 0.00 2.72 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 71 S 8.64 4.13 0.00 4.10 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.67 3.74 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.47 0.99 0.00 0.00 73 L 8.20 4.10 0.00 1.87 1.86 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.21 4.01 0.00 1.88 1.71 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.00 4.13 0.00 1.89 1.73 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.64 4.72 0.00 2.20 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.89 0.00 0.00 0.00 0.00 0.00 2.56 2.38 0.00 77 M 7.23 4.52 0.00 1.92 2.13 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 2.83 2.52 0.00 78 I 8.71 4.07 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.72 0.92 0.00 0.00 79 P 0.00 4.74 0.00 2.13 2.02 0.00 3.75 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 80 L 8.28 4.35 0.00 1.80 1.64 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.22 4.13 0.00 1.81 1.87 0.00 3.23 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 82 G 8.17 3.14 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 83 C 8.22 4.31 0.00 3.05 3.02 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 0.00 0.00 0.00 84 I 7.49 3.99 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 1.30 0.52 0.95 0.00 0.00 85 D 8.89 4.48 0.00 2.62 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 D 7.40 4.64 0.00 2.60 2.48 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 0.00 0.00 0.00 0.00 87 R 8.14 4.21 0.00 1.98 2.05 0.00 3.21 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.17 4.03 1.74 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.70 0.57 0.00 0.00 89 P 0.00 4.39 0.00 2.19 2.05 0.00 3.31 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 90 T 8.39 4.14 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 1.19 0.00 0.00 91 D 7.98 4.51 0.00 2.85 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.37 0.00 2.23 2.14 0.00 3.69 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 93 T 7.97 3.92 4.49 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 1.35 0.00 0.00 94 M 8.16 4.47 0.00 2.12 2.32 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.60 0.00 95 Y 8.77 3.98 0.00 3.21 3.22 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 96 R 8.13 3.92 0.00 1.54 1.72 0.00 3.35 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.77 0.00 97 F 7.92 4.18 0.00 3.28 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 98 Y 7.76 3.96 0.00 2.90 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.06 3.70 0.00 1.98 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 2.30 2.39 0.00 100 M 8.02 4.08 0.00 2.18 2.34 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.60 0.00 101 L 7.41 3.98 0.00 1.55 1.56 0.91 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.49 3.77 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.94 0.00 0.00 0.00 0.00 0.00 1.65 2.36 0.00 103 V 7.75 3.65 1.82 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 0.06 0.00 0.00 0.84 0.00 0.00 104 Y 8.13 4.82 0.00 3.24 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.33 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 0.00 0.00 0.00 106 T 7.85 4.05 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 1.21 0.00 0.00 107 T 7.88 3.91 4.61 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 1.32 0.00 0.00 108 L 8.43 3.98 0.00 1.84 1.73 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.09 3.76 0.00 1.83 1.99 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.45 7.81 110 A 8.21 4.02 1.41 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 0.00 111 L 8.30 4.07 0.00 1.77 1.74 0.93 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.10 3.79 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 1.08 0.00 0.00 0.99 0.00 0.00 113 H 8.21 5.01 0.00 3.37 3.36 0.00 5.69 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 0.00 114 E 8.21 3.94 0.00 2.04 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 2.29 2.34 0.00 115 K 8.13 3.96 0.00 1.61 1.14 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.49 7.81 116 F 8.74 4.10 0.00 2.48 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 0.00 117 G 7.87 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 0.00 118 D 8.73 4.71 0.00 2.76 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 0.00 119 G 7.94 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.34 4.80 1.86 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 1.19 1.22 0.93 0.00 0.00 121 I 8.28 4.44 1.82 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 1.10 0.63 0.94 0.00 0.00 122 G 8.75 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 0.00 0.00 0.00 123 A 8.49 4.08 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.76 4.26 1.87 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 1.26 0.94 0.93 0.00 0.00 125 N 7.78 4.78 0.00 2.79 2.74 0.00 0.00 6.58 7.71 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 0.00 126 F 8.00 5.44 0.00 2.94 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 0.00 127 K 8.42 4.54 0.00 1.65 1.71 0.00 1.22 0.00 0.00 1.49 0.00 0.00 2.74 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.12 1.19 7.81 128 L 8.18 5.17 0.00 1.60 1.52 1.02 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.88 4.92 0.00 2.69 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.38 4.73 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 0.84 0.00 0.00 0.91 0.00 0.00 131 K 9.01 4.60 0.00 1.82 1.72 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.32 1.34 7.81 132 K 8.75 4.89 0.00 1.83 1.70 0.00 1.80 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.45 7.81 133 V 8.63 4.65 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 0.83 0.00 0.00 0.94 0.00 0.00 134 A 8.68 4.36 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 D 8.93 4.62 0.00 2.77 2.65 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 0.00 136 P 0.00 4.50 0.00 2.08 2.12 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 137 E 8.77 4.11 0.00 2.12 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 2.34 2.40 0.00 138 G 8.60 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 9.26 3.84 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 0.00 0.00 0.00 140 E 8.33 5.22 0.00 1.82 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 141 R 9.06 4.81 0.00 1.71 1.78 0.00 3.24 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 142 A 8.58 5.10 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 0.00 143 V 9.08 4.15 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 1.05 0.00 0.00 0.94 0.00 0.00 144 I 8.38 4.81 2.00 0.00 0.00 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 1.43 0.70 0.97 0.00 0.00 145 T 8.86 4.42 4.46 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 1.16 0.00 0.00 146 L 8.59 4.26 0.00 1.62 1.94 1.03 1.22 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 0.00 147 D 8.63 4.70 0.00 2.55 2.43 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 0.00 148 G 8.35 4.61 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 0.00 149 K 8.72 4.36 0.00 1.95 1.70 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.44 7.81 150 Y 8.64 4.66 0.00 2.44 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 0.00 151 L 8.67 4.43 0.00 1.38 1.36 0.86 0.67 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 0.00 152 P 0.00 4.50 0.00 2.02 1.96 0.00 3.46 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 153 T 8.88 4.49 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 1.27 0.00 0.00 154 K 8.52 4.68 0.00 1.76 1.75 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.45 7.81 155 P 0.00 4.45 0.00 2.03 1.96 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 156 F 7.94 4.56 0.00 3.03 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00