NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 K 4.2359 8.3149 121.7870 56.1939 33.3087 175.0567 9 R 4.2325 8.3119 125.3939 52.5072 31.2202 174.0009 10 P 4.4037 0.0000 0.0000 62.9058 32.9859 176.2257 11 E 4.3962 8.5854 119.1924 56.4488 29.4786 176.2289 12 I 4.1302 6.8631 115.7522 60.1858 41.1908 173.6055 13 V 4.3917 7.6113 119.4348 60.2511 35.5843 175.2715 14 G 4.2683 8.7219 108.5623 44.5100 0.0000 171.7396 15 P 4.6427 0.0000 0.0000 61.9859 32.2657 176.4239 16 E 4.2512 8.9987 118.6801 58.8782 29.5327 177.9049 17 K 4.6093 7.7571 115.9365 53.8358 34.3835 176.1513 18 V 3.2452 8.0436 122.8015 63.4353 31.8762 175.1924 19 Q 4.7450 8.5217 127.4255 53.5514 31.7118 174.7185 20 S 4.6338 8.7830 117.3201 57.3778 63.2301 172.5883 21 P 4.3094 0.0000 0.0000 63.6950 30.6978 175.6451 22 Y 4.7792 7.1053 117.6942 56.4923 39.8241 173.1155 23 P 4.6109 0.0000 0.0000 62.9690 32.6666 176.0656 24 I 4.2880 8.7453 124.2704 59.9526 38.3243 174.6471 25 R 4.8595 8.1618 126.2913 55.2764 31.2794 175.9581 26 F 5.0263 8.8025 116.3923 56.3141 41.5065 172.4666 27 E 5.2011 9.1469 117.1438 55.1236 32.7880 174.5253 28 G 4.3412 9.0408 107.1147 45.6659 0.0000 171.7317 29 K 5.0696 8.4366 119.6554 54.8325 34.3041 176.6268 30 V 4.3916 8.9823 125.4705 63.0104 32.3149 175.3716 31 V 5.0220 8.8008 120.9893 59.4050 35.3651 175.3391 32 H 4.5057 8.8839 119.4001 55.8983 29.8717 176.5910 33 G 4.5101 8.3009 117.4060 45.5231 0.0000 174.4375 34 F 4.6989 8.8676 120.6427 57.2113 39.8104 175.6389 35 G 4.0404 8.3418 105.6292 46.5191 0.0000 175.8351 36 R 4.0357 8.1893 116.3719 57.3279 30.0658 177.4764 37 G 4.0723 8.6221 105.5988 46.4271 0.0000 175.3469 38 S 4.0929 8.5336 116.1113 61.0487 63.1875 176.5185 39 K 3.9924 8.0881 121.5485 58.9464 32.4055 178.3078 40 E 4.0164 8.4451 118.8567 59.4056 29.4253 178.3185 41 L 4.3292 7.9287 115.3680 54.5964 41.7206 177.6700 42 G 3.9910 8.6675 107.1917 45.8601 0.0000 174.7778 43 I 4.4016 7.4099 120.3195 57.6939 37.3321 172.6644 44 P 4.8673 0.0000 0.0000 62.3131 31.9942 176.6602 45 T 4.8240 8.3073 110.7729 59.8634 71.3266 172.8492 46 A 4.3915 9.2679 128.6163 50.8199 20.6761 175.7395 47 N 5.1166 8.7030 120.8922 52.8838 39.9596 174.8158 48 I 4.7695 8.4965 125.6884 60.4154 38.7148 176.2160 49 S 4.2874 8.8492 121.4220 58.4473 63.4695 174.7742 50 E 3.9598 9.3286 122.7780 59.6250 29.0810 178.6698 51 D 4.4138 8.2252 114.7394 54.2429 39.1005 176.1508 52 A 4.7334 7.9140 120.8773 51.9589 20.3952 176.6418 53 I 4.3383 8.0529 107.8994 59.6868 39.1080 177.3371 54 Q 3.8863 8.2632 120.0692 58.8502 28.9274 177.2951 55 E 4.2240 8.0280 117.1331 57.9838 30.5878 177.1902 56 L 3.7832 7.8492 118.7425 57.6628 42.1019 177.4852 57 L 4.4201 7.5173 115.1123 54.0314 42.4726 177.8995 58 R 3.7469 7.8297 120.5476 59.2004 29.8168 177.0783 59 Y 4.8998 7.6486 112.6744 57.8102 38.5222 175.3262 60 R 4.7167 7.4621 118.1891 54.1075 32.3468 176.3181 61 D 4.6352 8.5126 120.4356 54.6893 41.4900 176.4089 62 S 4.5887 9.0802 117.0919 57.7452 64.2159 175.2764 63 G 3.9804 7.6422 109.6780 44.3322 0.0000 171.3157 64 V 4.4621 7.7184 120.7967 62.2294 32.9942 175.7126 65 Y 5.1387 9.4440 126.0691 56.4191 41.7876 174.0458 66 F 5.3032 8.3372 113.5804 55.4647 41.4902 175.0344 67 G 4.1062 7.6838 106.2128 46.7467 0.0000 170.8695 68 Y 5.3623 8.0153 119.0911 56.4352 41.9090 175.0179 69 A 5.3581 8.8866 122.5533 50.8467 23.3870 174.6869 70 M 5.3321 9.2881 121.3395 53.0217 34.8812 174.9681 71 V 4.3355 7.9357 124.2257 61.9845 35.2780 174.2321 72 Q 3.8422 9.1466 126.7655 57.4068 26.2557 173.3013 73 K 3.8054 8.0527 109.6781 56.8929 30.0055 176.2767 74 R 4.4005 7.3667 115.3752 54.8320 35.2965 175.3341 75 V 4.2986 7.6460 123.0407 61.1040 33.2319 174.8149 76 F 5.0846 8.8214 126.0162 54.6691 42.8684 172.9810 77 P 4.6389 0.0000 0.0000 63.5264 32.6903 174.6700 78 M 5.2544 9.4055 118.5103 54.6013 35.5128 173.5285 79 V 4.9735 8.3592 111.3330 59.7612 35.6038 174.7268 80 M 5.2700 8.9996 123.9080 53.8739 35.6293 173.7242 81 S 5.1939 8.9358 121.0662 56.9682 64.5575 172.5902 82 V 4.7584 8.9280 127.6067 61.4677 34.0333 174.8532 83 G 4.2190 8.4066 113.4121 45.3615 0.0000 170.5681 84 W 5.2706 8.5460 119.0742 54.3173 31.9111 175.1408 85 N 4.2913 9.7834 124.2375 53.7514 38.7429 173.9435 86 P 4.1311 0.0000 0.0000 65.5445 31.6084 177.0811 87 Y 4.3589 6.9935 113.1393 58.3517 37.8746 174.9559 88 Y 4.6780 7.7758 119.3062 56.8532 41.3267 175.3931 89 K 4.4621 8.8345 123.7409 56.6536 32.2186 177.2166 90 N 4.3957 8.1129 117.8879 53.8214 39.2710 172.8138 91 K 3.7268 7.6697 118.4116 56.3556 30.3784 172.8472 92 L 4.9000 8.0936 124.2038 52.5231 44.5145 175.0890 93 R 4.1899 8.7756 126.9767 56.2653 31.0820 175.4510 94 S 4.8890 8.7151 118.0681 56.6720 67.1171 172.6279 95 A 5.1708 8.4159 121.9241 50.5377 22.8248 174.6596 96 E 5.1818 9.1437 121.0391 54.5094 33.4777 174.9914 97 V 4.9393 9.1616 124.4630 61.2651 34.5131 173.5891 98 H 5.0990 8.7764 127.1004 54.1818 32.0991 172.7326 99 L 4.3185 8.3827 126.5144 54.6583 42.2057 176.7946 100 I 3.9779 8.5697 125.3845 60.9839 38.2662 175.7770 101 E 3.7375 8.6891 124.5376 57.7054 26.9964 174.5316 102 R 4.2469 7.8505 117.2349 54.2958 32.0022 174.3594 103 Q 4.5351 9.1653 123.9788 52.9503 31.1873 175.4061 104 G 3.9476 7.9830 111.1224 45.3522 0.0000 171.0976 105 E 4.2414 8.2061 119.6113 55.3990 30.2113 176.3081 106 D 4.2872 8.2176 120.3353 54.8135 41.3301 176.6717 107 F 4.9478 6.8128 113.6450 55.8094 38.0512 174.3856 108 Y 4.1682 7.9352 118.1821 60.3264 38.2455 177.5107 109 E 3.9490 9.0487 118.9757 57.1320 28.6496 174.7633 110 E 4.6157 7.8427 118.4772 55.3609 31.6429 175.4231 111 I 4.6257 8.2064 123.0083 60.9367 38.5822 174.8429 112 M 4.8237 9.6127 127.0032 53.8088 35.0770 174.2737 113 R 4.8666 8.5089 124.9181 54.6293 32.6274 175.4801 114 V 4.9449 9.0885 123.3091 61.1254 35.5273 174.4362 115 I 4.9472 9.0019 127.1126 59.4727 40.4030 174.6182 116 V 4.1023 8.8810 129.0601 62.5728 31.9410 176.3106 117 L 4.1674 8.1707 127.6485 54.5401 43.2034 176.4399 118 G 2.9004 5.9158 104.8346 45.5264 0.0000 171.6297 119 Y 4.6860 7.8631 121.1150 56.7110 40.4626 175.1900 120 I 3.9707 7.0030 124.3643 61.2897 39.1503 176.1641 121 R 4.1898 5.8400 113.5864 54.7203 31.0629 171.9319 122 P 5.4409 0.0000 0.0000 61.1837 32.3310 175.6805 123 E 3.8530 8.6102 120.0100 56.5976 29.7282 176.9101 124 L 4.4983 8.1162 126.1489 53.5834 44.1003 177.8805 125 N 4.9864 8.1738 124.9015 52.8435 37.5931 174.8542 126 Y 4.7571 8.2527 112.2028 57.1407 41.6083 173.7771 127 A 4.5035 9.2053 130.7889 51.2262 19.6263 176.8454 128 G 3.9412 8.4184 108.2484 46.1423 0.0000 174.8231 129 L 4.3125 8.6519 123.2814 57.2752 41.6269 179.7758 130 D 4.3827 8.1860 118.1907 57.4775 40.7865 178.6694 131 K 3.9995 8.1976 119.9380 59.1802 32.1871 178.5712 132 L 3.7432 7.9906 120.1867 58.3035 42.0275 178.7067 133 I 3.7783 8.0611 120.0377 64.4260 37.0158 178.0495 134 E 3.8931 8.0262 119.6154 59.3191 29.5035 178.5335 135 D 4.3156 8.2317 119.1701 57.5612 40.9444 178.9740 136 I 3.9162 8.0691 121.8385 64.2578 37.2259 178.2561 137 H 4.0802 8.5725 117.3203 59.1077 28.3589 178.0747 138 T 3.9065 7.9425 117.6857 66.5252 68.0303 176.4200 139 D 4.2712 8.0931 120.9081 57.5383 40.8580 179.0689 140 I 3.7427 7.7797 120.0946 64.2824 37.0286 178.5258 141 R 3.8204 7.7241 119.1475 59.3766 29.8563 178.6922 142 V 3.5389 7.9650 118.1253 65.7076 31.4548 177.6786 143 A 3.5368 7.8983 120.5447 55.1691 18.0344 179.5087 144 L 3.8882 7.5698 115.7646 58.1669 41.9559 179.3414 145 N 4.3435 8.2035 116.3992 56.4144 38.3386 177.5310 146 S 4.0047 8.2946 117.1276 61.1398 62.8780 175.8867 147 M 4.4633 7.6397 119.3045 55.2533 32.0475 176.8802 148 D 4.4254 8.2074 118.9366 54.9568 41.8794 176.0182 149 R 4.3236 7.5741 119.6569 55.1970 30.7565 175.2876 150 P 4.3788 0.0000 0.0000 65.8086 30.5901 178.4343 151 S 4.1684 8.2318 111.4008 61.0874 62.6359 175.1865 152 Y 4.5501 8.8537 119.9430 60.8824 38.2687 177.9811 153 S 5.2527 7.9122 116.3530 61.0253 62.3895 176.3490 154 S 4.1721 8.0047 116.3150 61.4027 61.8261 174.9643 155 Y 4.1980 8.3376 117.3396 58.8935 37.8145 177.0967 156 K 3.3250 7.5120 121.0979 57.7954 32.2472 176.9880 157 K 4.5761 7.1897 117.5645 55.7875 32.8153 175.8996 158 D 4.4297 8.0962 118.4772 53.4197 42.4609 174.9067 159 P 4.2282 0.0000 0.0000 65.7029 31.5709 178.2012 160 F 4.0546 8.1679 119.3040 61.1896 38.7183 175.7121 161 F 4.5615 7.4506 119.4372 59.5881 39.4307 175.6442 162 K 4.1465 7.8863 124.1627 56.9326 31.7202 177.1542 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 8 K 8.31 4.24 0.00 1.72 1.78 0.00 1.74 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.40 7.81 9 R 8.31 4.23 0.00 1.88 1.78 0.00 3.22 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 10 P 0.00 4.40 0.00 2.36 2.15 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 2.02 1.96 0.00 11 E 8.59 4.40 0.00 1.93 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 0.00 2.26 2.20 0.00 12 I 6.86 4.13 1.76 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.28 0.85 0.00 0.00 13 V 7.61 4.39 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 0.67 0.00 0.00 0.90 0.00 0.00 14 G 8.72 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 0.00 0.00 0.00 0.00 15 P 0.00 4.64 0.00 2.31 2.18 0.00 4.05 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.13 0.00 16 E 9.00 4.25 0.00 2.07 2.17 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 2.38 2.35 0.00 17 K 7.76 4.61 0.00 1.77 1.73 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.45 7.81 18 V 8.04 3.25 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 0.48 0.00 0.00 0.37 0.00 0.00 19 Q 8.52 4.75 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.76 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 20 S 8.78 4.63 0.00 3.92 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.31 0.00 1.90 1.96 0.00 3.13 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.61 0.00 22 Y 7.11 4.78 0.00 3.09 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 0.00 23 P 0.00 4.61 0.00 1.87 1.31 0.00 3.71 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 1.96 2.10 0.00 24 I 8.75 4.29 1.97 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.87 0.93 0.00 0.00 25 R 8.16 4.86 0.00 1.06 0.66 0.00 2.76 0.00 0.00 2.59 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.38 0.00 26 F 8.80 5.03 0.00 3.07 3.07 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 27 E 9.15 5.20 0.00 2.04 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 28 G 9.04 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 29 K 8.44 5.07 0.00 1.73 1.79 0.00 1.71 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.42 7.81 30 V 8.98 4.39 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 0.85 0.00 0.00 1.22 0.00 0.00 31 V 8.80 5.02 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 0.84 0.00 0.00 1.02 0.00 0.00 32 H 8.88 4.51 0.00 2.98 3.13 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.30 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 F 8.87 4.70 0.00 3.17 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 35 G 8.34 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 36 R 8.19 4.04 0.00 2.02 2.21 0.00 3.16 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 37 G 8.62 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 38 S 8.53 4.09 0.00 4.26 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.09 3.99 0.00 1.81 1.85 0.00 1.72 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.44 7.81 40 E 8.45 4.02 0.00 2.23 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 2.35 2.41 0.00 41 L 7.93 4.33 0.00 1.80 1.71 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.67 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 43 I 7.41 4.40 1.79 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.89 0.59 0.00 0.00 44 P 0.00 4.87 0.00 2.10 2.02 0.00 3.32 0.00 0.00 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.90 0.00 45 T 8.31 4.82 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 1.24 0.00 0.00 46 A 9.27 4.39 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 47 N 8.70 5.12 0.00 3.01 2.80 0.00 0.00 7.13 7.49 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 48 I 8.50 4.77 1.98 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.60 1.11 0.00 0.00 49 S 8.85 4.29 0.00 4.10 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 50 E 9.33 3.96 0.00 2.36 2.30 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 2.39 2.33 0.00 51 D 8.23 4.41 0.00 2.81 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 52 A 7.91 4.73 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 53 I 8.05 4.34 1.56 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.58 0.59 0.00 0.00 54 Q 8.26 3.89 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.93 0.00 0.00 0.00 0.00 0.00 2.53 2.30 0.00 55 E 8.03 4.22 0.00 2.01 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 2.32 2.37 0.00 56 L 7.85 3.78 0.00 1.49 1.46 0.86 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.52 4.42 0.00 1.59 1.36 0.56 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 58 R 7.83 3.75 0.00 1.85 1.65 0.00 2.99 0.00 0.00 2.95 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.45 0.00 59 Y 7.65 4.90 0.00 3.01 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 60 R 7.46 4.72 0.00 1.85 1.88 0.00 3.30 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 61 D 8.51 4.64 0.00 2.41 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 62 S 9.08 4.59 0.00 4.00 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 63 G 7.64 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 0.00 0.00 0.00 64 V 7.72 4.46 1.84 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 0.98 0.00 0.00 0.90 0.00 0.00 65 Y 9.44 5.14 0.00 3.05 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 66 F 8.34 5.30 0.00 3.12 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 67 G 7.68 4.11 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 0.00 0.00 0.00 68 Y 8.02 5.36 0.00 3.50 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.89 5.36 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 70 M 9.29 5.33 0.00 2.00 1.30 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.15 0.00 71 V 7.94 4.34 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.44 0.00 0.00 72 Q 9.15 3.84 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.67 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 73 K 8.05 3.81 0.00 1.84 1.81 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.39 7.81 74 R 7.37 4.40 0.00 1.71 1.16 0.00 3.14 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.70 0.00 75 V 7.65 4.30 1.62 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 0.22 0.00 0.00 0.15 0.00 0.00 76 F 8.82 5.08 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 77 P 0.00 4.64 0.00 2.01 2.07 0.00 3.90 0.00 0.00 4.01 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 78 M 9.41 5.25 0.00 2.07 2.33 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.62 0.00 79 V 8.36 4.97 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 0.77 0.00 0.00 0.98 0.00 0.00 80 M 9.00 5.27 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 81 S 8.94 5.19 0.00 3.98 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.93 4.76 2.26 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 0.68 0.00 0.00 0.88 0.00 0.00 83 G 8.41 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 84 W 8.55 5.27 0.00 3.15 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 N 9.78 4.29 0.00 3.02 3.03 0.00 0.00 6.91 5.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 P 0.00 4.13 0.00 1.25 1.84 0.00 3.07 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.08 0.00 87 Y 6.99 4.36 0.00 2.73 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 Y 7.78 4.68 0.00 3.08 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 89 K 8.83 4.46 0.00 1.76 1.83 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.73 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.41 7.81 90 N 8.11 4.40 0.00 2.73 2.88 0.00 0.00 7.21 6.68 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 91 K 7.67 3.73 0.00 1.76 1.78 0.00 1.33 0.00 0.00 0.95 0.00 0.00 2.37 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.62 7.81 92 L 8.09 4.90 0.00 1.82 1.64 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.78 4.19 0.00 1.55 1.57 0.00 2.21 0.00 0.00 2.75 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.11 0.00 94 S 8.72 4.89 0.00 3.93 3.94 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 95 A 8.42 5.17 1.20 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 0.00 0.00 0.00 96 E 9.14 5.18 0.00 1.96 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 2.27 2.28 0.00 97 V 9.16 4.94 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 0.99 0.00 0.00 1.04 0.00 0.00 98 H 8.78 5.10 0.00 3.29 3.15 0.00 5.83 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.38 4.32 0.00 1.29 1.25 0.59 0.92 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 0.00 100 I 8.57 3.98 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.75 0.92 0.00 0.00 101 E 8.69 3.74 0.00 2.19 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 0.00 2.24 2.30 0.00 102 R 7.85 4.25 0.00 0.89 1.37 0.00 3.13 0.00 0.00 3.00 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 103 Q 9.17 4.54 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 104 G 7.98 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 0.00 105 E 8.21 4.24 0.00 2.01 1.94 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 2.33 2.29 0.00 106 D 8.22 4.29 0.00 2.70 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 0.00 107 F 6.81 4.95 0.00 2.98 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 Y 7.94 4.17 0.00 3.13 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 0.00 109 E 9.05 3.95 0.00 2.19 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 0.00 2.30 2.36 0.00 110 E 7.84 4.62 0.00 2.28 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 2.53 2.59 0.00 111 I 8.21 4.63 1.86 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 1.26 0.51 0.89 0.00 0.00 112 M 9.61 4.82 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.41 0.00 113 R 8.51 4.87 0.00 1.82 1.44 0.00 2.68 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.34 0.00 114 V 9.09 4.94 0.69 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 1.08 0.00 0.00 0.69 0.00 0.00 115 I 9.00 4.95 2.06 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 1.01 0.59 0.84 0.00 0.00 116 V 8.88 4.10 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 1.03 0.00 0.00 1.06 0.00 0.00 117 L 8.17 4.17 0.00 1.34 1.66 1.33 0.54 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 0.00 118 G 5.92 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Y 7.86 4.69 0.00 3.00 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 0.00 120 I 7.00 3.97 1.73 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.93 0.74 0.00 0.00 121 R 5.84 4.19 0.00 1.83 1.82 0.00 2.88 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.29 0.00 122 P 0.00 5.44 0.00 2.28 2.25 0.00 3.41 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 123 E 8.61 3.85 0.00 1.97 1.94 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 2.31 2.38 0.00 124 L 8.12 4.50 0.00 1.61 1.58 0.98 1.04 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 0.00 125 N 8.17 4.99 0.00 2.72 2.42 0.00 0.00 6.70 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 0.00 126 Y 8.25 4.76 0.00 2.97 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 0.00 127 A 9.21 4.50 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 0.00 128 G 8.42 3.94 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 0.00 0.00 0.00 129 L 8.65 4.31 0.00 1.76 1.87 0.95 1.42 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 0.00 130 D 8.19 4.38 0.00 2.75 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 0.00 131 K 8.20 4.00 0.00 1.91 1.92 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 132 L 7.99 3.74 0.00 1.51 1.80 0.18 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 133 I 8.06 3.78 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.81 0.94 0.00 0.00 134 E 8.03 3.89 0.00 2.06 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 0.00 2.29 2.33 0.00 135 D 8.23 4.32 0.00 2.85 2.62 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 0.00 136 I 8.07 3.92 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.37 0.81 0.00 0.00 137 H 8.57 4.08 0.00 3.42 3.35 0.00 5.81 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 0.00 138 T 7.94 3.91 4.37 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 1.16 0.00 0.00 139 D 8.09 4.27 0.00 2.87 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 0.00 140 I 7.78 3.74 2.02 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.92 0.89 0.00 0.00 141 R 7.72 3.82 0.00 2.00 1.99 0.00 3.07 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 1.67 1.59 0.00 142 V 7.97 3.54 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 0.67 0.00 0.00 0.90 0.00 0.00 143 A 7.90 3.54 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 0.00 144 L 7.57 3.89 0.00 1.72 1.71 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 145 N 8.20 4.34 0.00 2.81 2.71 0.00 0.00 7.01 7.31 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 0.00 146 S 8.29 4.00 0.00 2.75 3.10 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 0.00 147 M 7.64 4.46 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.78 0.00 148 D 8.21 4.43 0.00 2.87 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 0.00 149 R 7.57 4.32 0.00 2.11 2.01 0.00 3.48 0.00 0.00 3.37 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.60 0.00 150 P 0.00 4.38 0.00 2.31 2.41 0.00 3.96 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.98 0.00 151 S 8.23 4.17 0.00 3.97 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 0.00 152 Y 8.85 4.55 0.00 3.37 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 0.00 153 S 7.91 5.25 0.00 4.14 4.55 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 0.00 154 S 8.00 4.17 0.00 3.94 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 Y 8.34 4.20 0.00 3.29 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 0.00 156 K 7.51 3.33 0.00 0.79 1.57 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.17 1.02 7.81 157 K 7.19 4.58 0.00 1.68 1.73 0.00 1.52 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.32 1.31 7.81 158 D 8.10 4.43 0.00 2.97 2.26 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 0.00 159 P 0.00 4.23 0.00 2.23 2.10 0.00 3.64 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 2.09 2.06 0.00 160 F 8.17 4.05 0.00 2.78 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 F 7.45 4.56 0.00 3.28 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 0.00 162 K 7.89 4.15 0.00 1.81 1.72 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.50 1.52 7.81