NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4541 8.2893 120.3264 55.1590 32.4298 174.4138 2 R 4.0705 8.3044 121.0421 54.4701 31.0063 174.8230 3 L 4.3186 9.1008 123.0090 53.9895 42.6318 178.4767 4 N 4.4845 8.6869 119.5604 54.3077 37.8300 175.4762 5 T 4.1889 7.8168 111.5527 62.0261 67.6104 173.9009 6 L 3.5230 7.7526 117.4315 53.2552 37.2530 173.5151 7 S 4.9746 6.6590 117.0282 58.0545 66.6418 175.8707 8 P 5.1286 0.0000 0.0000 63.8976 32.8565 174.9149 9 A 5.0883 7.6836 114.7229 52.9094 20.8175 176.8733 10 E 4.6820 7.5081 124.5698 54.9981 29.5850 179.2119 11 G 4.2176 8.4915 113.3540 46.0249 0.0000 169.1276 12 S 4.5268 8.8494 123.1411 58.2177 69.2884 175.5735 13 K 4.5133 9.1456 118.3148 55.8235 33.4389 177.8375 14 K 3.8358 8.2391 120.8083 57.8657 32.1839 176.0800 15 A 4.5847 6.8525 123.2608 52.7941 22.1121 176.3953 16 G 3.8068 8.4510 107.8710 45.1125 0.0000 175.0145 17 K 4.3662 8.4497 122.9127 56.3116 30.2931 176.0918 18 R 4.5459 7.2534 115.5012 54.1343 32.9353 174.6445 19 L 4.5007 8.5330 121.1739 55.7830 43.5311 171.4045 20 G 4.0312 8.9125 118.2156 45.4317 0.0000 172.2868 21 R 4.2640 8.3328 119.8858 56.0894 31.6984 176.1131 22 G 4.6582 8.5664 103.9921 46.9763 0.0000 174.0203 23 I 4.1341 7.1585 117.0001 58.5598 36.2326 176.9025 24 G 4.4476 6.8985 113.6039 46.0115 0.0000 172.5055 25 S 4.4648 7.6805 115.9867 58.3823 62.5303 173.4070 26 G 4.2838 8.1642 105.2486 45.8325 0.0000 171.2983 27 L 4.2729 7.7750 120.8814 55.0946 42.0845 177.5552 28 G 4.1472 8.5643 105.8482 44.6731 0.0000 175.1325 29 K 4.5073 6.3821 119.2474 56.5877 35.4702 175.3733 30 T 5.0981 8.2305 120.8286 61.8164 68.8217 172.6444 31 G 3.7859 7.9401 111.6352 46.8025 0.0000 173.4172 32 G 3.7853 7.7815 123.0360 44.6184 0.0000 174.0503 33 R 3.9903 8.9830 124.1941 56.8475 30.1481 176.7345 34 G 3.8241 7.7207 105.9832 46.3071 0.0000 173.3177 35 H 4.5765 7.9892 115.6365 55.3457 29.0285 174.5708 36 K 3.8157 8.2868 121.3933 57.5724 31.7343 177.0607 37 G 3.5663 8.6134 113.1448 48.3107 0.0000 172.6733 38 Q 3.7108 7.8196 119.8246 55.8201 28.3677 172.9607 39 K 3.7243 9.2388 116.7448 57.0640 32.2016 174.9387 40 S 3.5975 8.9264 110.2923 59.7676 61.2736 173.1431 41 R 4.1970 8.1327 117.0927 56.0835 29.3333 177.3082 42 S 4.2423 8.7552 112.7542 59.0988 61.4488 174.3860 43 G 4.3220 8.5257 114.5756 45.1381 0.0000 173.9848 44 G 4.0045 8.4122 106.9646 44.8808 0.0000 173.6834 45 G 3.9260 7.8500 109.0571 43.5329 0.0000 172.8399 46 V 3.7102 7.3719 125.4494 63.7512 32.0373 176.8846 47 R 4.0087 8.3182 125.2855 55.6012 28.4591 180.5737 48 R 2.5483 8.1175 121.4140 53.5778 33.7242 175.6568 49 G 4.3390 8.0940 104.0482 45.8711 0.0000 172.3491 50 F 5.2795 8.3828 121.9870 56.2970 42.1234 175.4839 51 E 4.6060 8.3309 124.5338 55.1610 30.0864 173.8667 52 G 3.8059 7.6002 116.3672 44.9879 0.0000 169.8179 53 G 3.8505 8.4892 104.3118 46.0431 0.0000 172.2100 54 Q 3.8813 7.7204 118.0386 55.4156 29.9840 176.2995 55 M 4.2369 8.2228 114.9947 55.2327 31.6893 175.2146 56 P 4.1024 0.0000 0.0000 64.1917 30.8258 179.0249 57 L 4.1040 8.0418 122.7692 56.3105 42.5664 175.6288 58 Y 4.0135 8.6384 112.8212 58.8425 37.8821 172.5514 59 R 4.4608 9.2483 115.6692 56.7371 31.7637 176.0263 60 R 4.2320 8.0150 120.3214 54.2375 28.3799 174.1602 61 L 4.4577 7.3648 121.5880 53.6487 44.8162 173.6330 62 P 3.4442 0.0000 0.0000 62.1134 32.5107 173.8170 63 K 4.5371 7.8293 122.5686 54.6926 34.9031 175.5705 64 F 4.9300 8.6262 122.4920 55.4885 40.4039 175.2038 65 G 2.4598 8.3012 115.3941 44.6395 0.0000 171.1663 66 F 4.6428 7.0135 110.0330 56.3780 39.8951 174.2052 67 T 3.9966 8.8763 119.5046 62.5227 67.8540 173.3481 68 S 3.7093 7.5703 115.7637 59.1276 59.7515 170.1318 69 R 3.7994 7.3393 118.0759 53.7058 31.2968 177.1562 70 K 3.9921 8.4758 119.7854 59.0657 33.3637 175.8891 71 A 4.0166 8.5692 132.3707 51.5886 18.9283 178.7328 72 A 3.9241 6.9317 120.4428 51.7806 21.8610 177.7911 73 I 4.1157 8.7373 117.2980 65.0924 38.6659 176.1838 74 T 3.3583 7.9413 106.9001 61.6305 67.2960 171.9231 75 A 4.0726 7.8390 121.5244 53.1927 19.3338 177.8173 76 E 4.2968 8.9252 120.0937 56.9191 30.3101 178.2409 77 I 3.5961 7.4730 124.3328 62.9991 38.6214 175.4371 78 R 5.0077 7.4716 114.0872 54.5510 30.0318 174.7585 79 L 4.0771 8.0456 118.8375 58.5733 39.8996 178.6337 80 S 3.7519 6.9398 115.0668 60.0176 61.0389 171.7262 81 D 4.9571 7.4191 120.5856 53.7619 41.5351 176.5539 82 L 4.4524 7.9429 118.0971 53.2501 43.7884 175.5483 83 A 3.5414 8.6665 124.9697 52.5174 17.6622 176.7094 84 K 4.0080 8.4883 114.2763 56.9022 29.9083 175.5108 85 V 4.4323 6.9032 122.9131 63.3212 35.0053 171.8503 86 E 4.8747 7.6909 119.2283 56.7471 29.9876 176.5598 87 G 4.0688 8.0826 110.3039 45.3937 0.0000 174.7028 88 G 4.0884 8.0445 105.9960 45.5127 0.0000 174.7754 89 V 3.9381 7.3325 119.1406 60.9095 29.0199 175.7759 90 V 3.5189 7.3402 121.4114 64.5721 31.8118 172.2688 91 D 4.6129 9.5385 126.1270 53.0929 38.3347 175.7918 92 L 4.3909 8.4590 123.5370 55.4104 42.1511 173.7309 93 N 4.7383 8.2677 124.6342 53.0428 40.9929 175.1837 94 T 3.2156 8.9238 123.7739 62.1648 65.8444 172.1923 95 L 4.1851 8.9016 117.0138 54.4864 41.9152 175.9133 96 K 4.6416 7.8801 118.3537 54.4271 35.3391 176.4238 97 A 4.7133 7.5165 124.7413 51.7120 19.4171 176.9335 98 A 4.3891 7.2888 118.4834 53.3133 21.2615 177.3280 99 N 4.5899 7.4749 115.5324 54.1513 39.9689 173.3131 100 I 4.4505 7.9239 122.9906 58.7723 40.6240 174.7572 101 I 4.1429 8.0699 121.1447 59.3677 39.9134 171.4162 102 G 3.6934 8.1656 116.3857 45.1356 0.0000 173.2021 103 I 4.1231 8.2094 127.4057 61.2392 35.8592 175.1579 104 Q 4.6597 7.8293 125.0549 55.8457 31.5846 176.3634 105 I 4.0774 7.2768 116.4330 61.3442 37.7079 173.9412 106 E 4.4618 8.0841 118.1357 56.8023 35.5386 176.5906 107 F 4.9435 7.0670 117.5957 55.3044 41.4052 174.6217 108 A 4.4356 7.9827 121.0655 53.6203 20.9917 178.0781 109 K 4.2475 8.3860 113.7607 56.4729 30.7484 174.0721 110 V 4.3981 8.3480 115.4125 64.8764 37.4022 176.0190 111 I 3.3811 7.1533 110.8917 60.2790 38.2332 173.5595 112 L 4.5712 8.1008 122.5501 53.4531 41.8428 176.3253 113 A 4.6628 7.5778 131.6342 51.2786 17.7306 180.7638 114 G 3.7756 8.6556 114.6125 46.6935 0.0000 173.6937 115 E 3.9123 8.9054 128.3450 55.6920 31.2869 173.0084 116 V 4.3953 7.9490 117.6350 61.3218 37.8083 173.5055 117 T 3.9618 7.7819 127.6244 61.1585 72.9634 173.1123 118 T 5.6597 7.4992 129.6868 64.5228 68.7193 171.6414 119 P 4.3262 0.0000 0.0000 62.6738 31.3724 176.3809 120 V 4.4049 7.6570 120.8378 61.5124 33.6840 171.1255 121 T 5.1486 8.7083 117.5648 59.5359 70.1438 174.4606 122 V 4.2645 8.2722 128.7392 61.2834 32.2072 175.1602 123 R 4.3761 8.1607 124.3545 54.3281 31.6147 176.0851 124 G 4.1767 9.1683 106.4769 45.8962 0.0000 170.0380 125 L 3.4975 8.2275 126.5282 55.4867 42.3287 171.7161 126 R 4.2127 8.9334 125.7177 56.4123 30.9213 175.5115 127 V 4.5414 7.9641 116.7091 59.5974 35.6066 175.2753 128 T 4.2919 8.4958 113.2008 61.0145 69.7500 176.0907 129 K 4.2358 8.4951 125.8557 59.5557 33.0709 178.4706 130 G 3.4758 8.2987 105.0417 47.9138 0.0000 175.2770 131 A 3.6742 8.0999 123.6189 54.5202 17.9347 179.3072 132 R 3.7770 7.9292 116.5000 59.8841 30.3402 178.1974 133 A 4.1709 7.4097 116.6359 54.6839 18.4006 179.1390 134 A 3.9049 8.7951 119.6195 54.8456 18.5732 178.5276 135 I 4.3583 7.8223 116.7759 61.5059 37.7747 176.9510 136 E 4.0459 8.7059 124.1783 58.5568 30.4414 177.1037 137 A 4.3564 7.9158 123.0466 50.1798 17.6068 175.3294 138 A 4.3819 6.5013 123.2949 52.7178 24.2360 177.2376 139 G 3.9915 7.4326 104.1417 43.7833 0.0000 173.8929 140 G 3.6060 8.8793 116.2398 46.6997 0.0000 174.9532 141 K 3.4833 8.7494 116.6528 55.2009 33.5635 176.0387 142 I 3.2723 7.5354 117.1749 61.1097 36.1498 171.9601 143 E 4.6919 8.5333 123.4661 54.1553 31.5204 176.0520 144 E 4.2578 8.5936 119.5047 56.4503 29.8286 175.4044 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 8.29 4.45 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 2 R 8.30 4.07 0.00 1.99 1.92 0.00 3.02 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 3 L 9.10 4.32 0.00 1.73 1.65 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 4 N 8.69 4.48 0.00 2.69 2.83 0.00 0.00 7.10 7.54 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 5 T 7.82 4.19 4.24 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 1.21 0.00 0.00 6 L 7.75 3.52 0.00 1.87 1.80 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 7 S 6.66 4.97 0.00 3.90 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 8 P 0.00 5.13 0.00 2.11 1.99 0.00 3.59 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.03 0.00 9 A 7.68 5.09 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 7.51 4.68 0.00 1.95 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 2.22 2.27 0.00 11 G 8.49 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 0.00 0.00 0.00 0.00 12 S 8.85 4.53 0.00 3.94 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 13 K 9.15 4.51 0.00 1.91 2.01 0.00 1.53 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.36 1.37 7.81 14 K 8.24 3.84 0.00 1.71 1.90 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.52 7.81 15 A 6.85 4.58 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 16 G 8.45 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 0.00 0.00 0.00 17 K 8.45 4.37 0.00 1.94 2.03 0.00 1.69 0.00 0.00 1.63 0.00 0.00 3.13 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.41 7.81 18 R 7.25 4.55 0.00 1.71 1.75 0.00 3.31 0.00 0.00 3.15 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 19 L 8.53 4.50 0.00 1.61 1.55 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.91 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.33 4.26 0.00 2.00 2.11 0.00 3.11 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 22 G 8.57 4.66 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 23 I 7.16 4.13 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 1.23 0.70 0.91 0.00 0.00 24 G 6.90 4.45 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 0.00 25 S 7.68 4.46 0.00 3.80 3.69 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 0.00 26 G 8.16 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 0.00 0.00 0.00 0.00 27 L 7.78 4.27 0.00 1.88 1.85 0.93 0.66 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 28 G 8.56 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 6.38 4.51 0.00 1.84 1.18 0.00 2.08 0.00 0.00 1.75 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.11 7.81 30 T 8.23 5.10 4.24 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 1.29 0.00 0.00 31 G 7.94 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 32 G 7.78 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 33 R 8.98 3.99 0.00 1.78 1.97 0.00 3.24 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 34 G 7.72 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 35 H 7.99 4.58 0.00 3.25 3.43 0.00 5.76 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.29 3.82 0.00 1.81 1.89 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.56 1.68 7.81 37 G 8.61 3.57 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 0.00 0.00 0.00 38 Q 7.82 3.71 0.00 2.20 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.04 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 39 K 9.24 3.72 0.00 2.34 2.01 0.00 1.51 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.45 7.81 40 S 8.93 3.60 0.00 4.04 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 41 R 8.13 4.20 0.00 1.97 2.18 0.00 3.24 0.00 0.00 3.37 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.71 0.00 42 S 8.76 4.24 0.00 3.99 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 43 G 8.53 4.32 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 0.00 44 G 8.41 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 45 G 7.85 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 0.00 0.00 0.00 46 V 7.37 3.71 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 0.83 0.00 0.00 0.88 0.00 0.00 47 R 8.32 4.01 0.00 1.92 1.93 0.00 3.14 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 48 R 8.12 2.55 0.00 1.94 2.02 0.00 3.30 0.00 0.00 3.36 7.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.69 0.00 49 G 8.09 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 50 F 8.38 5.28 0.00 3.03 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 51 E 8.33 4.61 0.00 1.99 1.87 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 2.18 2.36 0.00 52 G 7.60 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 0.00 0.00 0.00 53 G 8.49 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 54 Q 7.72 3.88 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.07 0.00 0.00 0.00 0.00 0.00 2.27 2.67 0.00 55 M 8.22 4.24 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.44 0.00 56 P 0.00 4.10 0.00 2.11 1.86 0.00 3.40 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 2.13 2.04 0.00 57 L 8.04 4.10 0.00 1.33 1.79 0.74 1.07 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 58 Y 8.64 4.01 0.00 3.12 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 59 R 9.25 4.46 0.00 1.85 1.99 0.00 3.13 0.00 0.00 2.87 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 60 R 8.02 4.23 0.00 1.74 1.98 0.00 3.21 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 61 L 7.36 4.46 0.00 1.59 1.48 1.00 1.16 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 62 P 0.00 3.44 0.00 1.98 2.24 0.00 3.65 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 1.91 2.01 0.00 63 K 7.83 4.54 0.00 1.62 1.54 0.00 1.68 0.00 0.00 1.52 0.00 0.00 3.12 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.28 1.57 7.81 64 F 8.63 4.93 0.00 3.10 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 65 G 8.30 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 0.00 0.00 0.00 66 F 7.01 4.64 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 67 T 8.88 4.00 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 1.25 0.00 0.00 68 S 7.57 3.71 0.00 4.10 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 69 R 7.34 3.80 0.00 2.00 1.92 0.00 3.10 0.00 0.00 3.46 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 70 K 8.48 3.99 0.00 1.90 1.97 0.00 1.61 0.00 0.00 1.77 0.00 0.00 3.22 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.54 7.81 71 A 8.57 4.02 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 72 A 6.93 3.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.74 4.12 1.85 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 1.46 0.65 0.91 0.00 0.00 74 T 7.94 3.36 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 75 A 7.84 4.07 1.27 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 0.00 0.00 76 E 8.93 4.30 0.00 1.96 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 2.33 2.37 0.00 77 I 7.47 3.60 2.19 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 1.36 0.73 0.94 0.00 0.00 78 R 7.47 5.01 0.00 2.26 2.05 0.00 3.17 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 79 L 8.05 4.08 0.00 1.78 1.68 0.92 0.84 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 80 S 6.94 3.75 0.00 3.97 4.24 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 81 D 7.42 4.96 0.00 2.65 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 82 L 7.94 4.45 0.00 1.64 1.63 0.92 0.92 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 83 A 8.67 3.54 1.35 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 84 K 8.49 4.01 0.00 1.84 1.85 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.37 1.35 7.81 85 V 6.90 4.43 2.20 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 0.91 0.00 0.00 0.93 0.00 0.00 86 E 7.69 4.87 0.00 2.03 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 2.42 2.24 0.00 87 G 8.08 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.04 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 89 V 7.33 3.94 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 0.72 0.00 0.00 0.93 0.00 0.00 90 V 7.34 3.52 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 0.82 0.00 0.00 0.98 0.00 0.00 91 D 9.54 4.61 0.00 2.80 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 8.46 4.39 0.00 1.71 1.98 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.27 4.74 0.00 2.65 2.66 0.00 0.00 7.27 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 94 T 8.92 3.22 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 1.20 0.00 0.00 95 L 8.90 4.19 0.00 1.65 1.66 0.91 0.78 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 96 K 7.88 4.64 0.00 1.73 1.67 0.00 1.59 0.00 0.00 1.79 0.00 0.00 3.15 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.45 7.81 97 A 7.52 4.71 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 98 A 7.29 4.39 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 99 N 7.47 4.59 0.00 2.67 2.72 0.00 0.00 6.91 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 7.92 4.45 2.05 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 1.38 1.22 0.91 0.00 0.00 101 I 8.07 4.14 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 1.34 0.93 0.90 0.00 0.00 102 G 8.17 3.69 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 0.00 0.00 0.00 0.00 103 I 8.21 4.12 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.83 0.89 0.00 0.00 104 Q 7.83 4.66 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.95 0.00 0.00 0.00 0.00 0.00 2.17 2.11 0.00 105 I 7.28 4.08 1.78 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 1.27 0.82 0.96 0.00 0.00 106 E 8.08 4.46 0.00 1.37 1.60 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 1.47 1.47 0.00 107 F 7.07 4.94 0.00 3.09 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 0.00 108 A 7.98 4.44 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 0.00 109 K 8.39 4.25 0.00 1.96 1.93 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.44 7.81 110 V 8.35 4.40 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 0.79 0.00 0.00 1.03 0.00 0.00 111 I 7.15 3.38 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 0.86 0.92 0.00 0.00 112 L 8.10 4.57 0.00 1.60 1.61 0.92 0.99 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 0.00 113 A 7.58 4.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.66 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.91 3.91 0.00 2.08 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 0.00 2.18 2.37 0.00 116 V 7.95 4.40 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 0.65 0.00 0.00 0.93 0.00 0.00 117 T 7.78 3.96 4.24 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 1.25 0.00 0.00 118 T 7.50 5.66 4.24 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 1.21 0.00 0.00 119 P 0.00 4.33 0.00 2.04 2.02 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 120 V 7.66 4.40 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 0.76 0.00 0.00 0.93 0.00 0.00 121 T 8.71 5.15 4.24 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 1.21 0.00 0.00 122 V 8.27 4.26 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 1.06 0.00 0.00 0.93 0.00 0.00 123 R 8.16 4.38 0.00 2.16 2.00 0.00 3.06 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 124 G 9.17 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 0.00 0.00 0.00 125 L 8.23 3.50 0.00 1.94 1.79 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.93 4.21 0.00 2.00 2.07 0.00 3.34 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.59 0.00 127 V 7.96 4.54 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 0.83 0.00 0.00 0.93 0.00 0.00 128 T 8.50 4.29 4.24 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 1.24 0.00 0.00 129 K 8.50 4.24 0.00 1.82 1.82 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.51 1.50 7.81 130 G 8.30 3.48 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 0.00 0.00 0.00 131 A 8.10 3.67 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 0.00 132 R 7.93 3.78 0.00 1.79 2.15 0.00 3.31 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 133 A 7.41 4.17 1.36 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 0.00 134 A 8.80 3.90 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 0.00 135 I 7.82 4.36 1.92 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 1.18 0.86 0.91 0.00 0.00 136 E 8.71 4.05 0.00 1.89 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 0.00 2.31 2.29 0.00 137 A 7.92 4.36 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 0.00 138 A 6.50 4.38 1.35 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 0.00 139 G 7.43 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 0.00 140 G 8.88 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 0.00 0.00 0.00 141 K 8.75 3.48 0.00 1.80 1.16 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.36 7.81 142 I 7.54 3.27 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 1.35 0.56 0.98 0.00 0.00 143 E 8.53 4.69 0.00 2.11 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 2.27 2.21 0.00 144 E 8.59 4.26 0.00 2.03 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 2.15 2.24 0.00