NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3854 0.0000 0.0000 61.7021 32.7229 176.0209 3 K 3.9797 8.6267 123.1575 55.5645 32.6882 175.2537 4 K 4.1719 9.1919 126.4839 56.5725 33.9190 175.2828 5 V 4.9167 8.3048 125.5794 61.1744 34.2374 174.2127 6 L 4.9101 9.2055 126.2939 53.2174 46.3621 175.2300 7 T 4.9562 8.0346 115.5585 62.3331 72.1698 173.9724 8 G 4.5915 8.2029 110.2793 47.0840 0.0000 171.7477 9 V 4.9170 7.9923 118.3911 60.8046 35.2097 175.6699 10 V 4.1050 9.0274 127.2110 62.7910 31.6479 176.1851 11 V 4.1428 8.0979 120.9580 61.2136 32.3005 176.1211 12 S 4.7006 7.5210 114.8963 57.3970 65.3033 173.9733 13 D 4.7474 8.7066 120.7809 53.6422 43.4284 176.7595 14 K 3.9582 7.5742 117.8187 59.7447 32.2303 176.8920 15 M 4.4869 7.2566 117.1293 53.7811 33.4223 175.5747 16 Q 4.1992 8.4543 119.6416 56.9661 29.6868 176.1456 17 K 4.6160 8.8886 119.7888 56.2306 30.1092 174.0648 18 T 5.1915 7.6008 111.6681 62.3592 73.0019 174.1133 19 V 4.5406 8.4812 116.8988 60.2412 36.4166 174.5727 20 T 4.4703 8.3626 122.3915 63.3354 69.1659 173.8361 21 V 4.5722 8.9459 127.8768 61.2472 33.9856 174.1650 22 L 4.8787 8.9557 129.5466 53.4380 44.1550 174.9965 23 V 4.6974 9.1221 127.2605 61.2490 33.4636 173.9938 24 E 4.9077 8.7750 129.1240 55.4615 31.1669 175.0253 25 R 4.8605 9.6464 125.2395 55.0237 34.1477 173.5830 26 Q 5.3970 8.7064 121.6348 53.9919 32.9718 174.7550 27 F 4.9577 8.9931 116.5980 55.6205 41.3844 171.4303 28 P 4.5402 0.0000 0.0000 63.4733 31.9020 175.0571 29 H 4.0311 9.4856 124.4591 56.8717 29.8833 175.1137 30 P 4.0570 0.0000 0.0000 64.6770 32.6161 176.3077 31 L 4.3695 7.8460 118.5307 56.0156 43.7937 176.0715 32 Y 4.6851 7.8271 113.4138 57.4066 37.6859 175.5811 33 G 4.1670 7.7853 112.5610 46.2556 0.0000 174.5018 34 K 3.8588 7.7214 117.6361 55.9869 33.4685 175.2843 35 V 4.0350 8.5287 124.1665 63.2051 32.0596 174.9912 36 I 4.5133 8.5464 121.4870 58.9537 40.7657 174.2130 37 K 4.9892 8.4179 123.7527 54.8087 34.5424 174.9234 38 R 5.0156 9.6328 127.1056 54.7685 34.3472 173.3458 39 S 5.1966 8.4128 115.2322 57.2813 66.6800 172.7714 40 K 4.4699 9.1504 119.6506 55.2091 35.7079 174.4153 41 K 4.7781 8.3182 125.6245 55.7463 33.6447 175.6510 42 Y 4.6196 9.0262 121.7054 56.1994 41.4743 174.9085 43 L 4.9667 8.8050 124.2406 53.4777 41.9328 176.1568 44 A 4.6804 8.9377 126.8612 51.9408 20.1996 175.4989 45 H 4.7777 9.2575 121.4106 55.2247 31.6236 173.6133 46 D 4.6886 8.7526 125.9701 52.0638 43.0323 174.1508 47 P 4.3472 0.0000 0.0000 65.1260 32.0007 178.1753 48 E 4.0430 8.1202 117.5514 57.0659 29.5794 176.8313 49 E 3.9768 7.9907 117.2623 57.1987 27.9547 176.4672 50 K 3.9560 8.4535 120.0337 59.3036 32.7108 176.8253 51 Y 4.0944 7.6594 115.0817 57.5873 38.4442 174.9120 52 K 4.7171 9.5205 122.4561 53.6900 35.9977 175.4807 53 L 4.1268 8.3127 121.7020 57.0440 42.3921 177.3279 54 G 3.9404 8.8306 111.9686 45.6670 0.0000 172.2060 55 D 5.1373 7.7325 119.7060 52.6033 43.1486 175.6226 56 V 4.5150 8.3066 122.8445 61.9219 33.3245 175.2076 57 V 5.3514 9.0191 120.6465 59.6654 36.5183 174.0389 58 E 4.8232 9.1538 120.9399 55.0506 31.4780 175.6465 59 I 4.6154 8.3708 126.7040 59.8928 39.1452 174.8574 60 I 4.9990 8.7571 127.5324 58.6109 40.9712 174.1965 61 E 3.5838 9.2167 130.6842 57.0153 29.8647 176.0214 62 S 4.5987 8.4560 121.8661 56.5289 67.9055 173.6137 63 R 3.7727 8.5799 120.3037 56.3016 29.9827 174.2882 64 P 4.3876 0.0000 0.0000 63.2843 32.0361 175.1034 65 I 4.4064 8.4677 119.5345 62.3021 39.3247 176.1639 66 S 4.6604 7.6337 112.3079 55.4799 65.7660 173.3120 67 K 3.5484 8.6402 122.8946 58.5490 32.3034 175.2598 68 R 3.7278 8.4046 126.1417 54.2876 27.1943 175.9940 69 K 5.6684 6.5927 135.0000 56.8716 33.4053 174.1386 70 R 4.8150 7.4780 124.3182 54.9638 32.1977 174.9397 71 F 5.2756 8.1041 116.9070 56.2113 43.3674 174.0839 72 R 4.8834 8.8833 122.7431 54.4845 32.7482 176.1806 73 V 3.8750 7.8410 122.9446 62.6531 30.9111 175.6852 74 L 4.2721 9.3032 132.7910 57.7770 42.6285 176.6916 75 R 4.6461 7.4616 112.4125 55.4620 32.4824 172.9551 76 L 4.7327 8.6646 121.9049 54.7404 42.7341 176.0524 77 V 4.1484 9.6082 127.9389 64.6409 32.5385 176.1287 78 E 4.6542 7.6801 117.6951 55.3068 32.2946 174.6523 79 S 4.3895 9.2034 119.4900 58.3333 63.2976 174.7266 80 G 3.6515 8.7978 107.6074 47.3332 0.0000 174.8019 81 R 4.5876 7.9899 120.0173 55.5455 31.2731 175.0387 82 M 4.1234 8.2568 127.3980 59.1490 32.6073 178.9844 83 D 4.3282 7.7956 117.3643 55.9751 39.7784 178.1382 84 L 4.2514 7.5016 119.9324 56.1028 41.6411 179.2924 85 V 3.5414 7.3785 117.3177 66.9676 31.8733 177.4458 86 E 3.7650 8.6810 115.1545 60.3059 29.5913 179.8094 87 K 3.4260 9.2079 113.0560 60.1251 32.3504 179.8379 88 Y 3.8792 7.3790 119.6148 60.0085 40.8786 177.7066 89 L 3.7133 8.4642 120.0204 57.9360 41.8144 179.4277 90 I 3.5881 7.7357 119.3458 65.2128 37.2530 177.6372 91 R 3.7628 8.1713 117.7616 59.7961 29.3817 177.9209 92 R 2.6876 7.6679 119.6880 59.2235 30.3392 178.2075 93 Q 4.0132 8.3306 119.3892 59.3586 28.9429 177.7484 94 N 4.0026 8.2585 116.5239 56.9158 38.6706 176.3604 95 Y 4.1914 8.1043 116.7041 60.7114 38.8893 177.4778 96 Q 4.4884 9.0420 123.1593 54.5521 29.1704 174.9464 97 S 4.5354 7.7665 123.2356 58.9193 66.6411 179.5848 98 L 3.9374 8.1919 113.7868 57.0978 38.4625 174.8522 99 S 4.5653 7.4258 114.7204 60.0084 65.4222 174.5413 100 K 4.6255 7.7763 118.8338 54.5061 35.2199 176.5556 101 R 4.2253 9.3886 115.4622 54.0133 32.0964 175.5052 102 G 4.1586 8.5505 114.4281 44.9767 0.0000 172.5870 103 G 3.9734 8.3358 115.1909 45.0572 0.0000 173.0619 104 K 4.3553 8.1930 122.7985 55.5766 31.4246 176.6757 105 A 4.0961 8.5407 127.1086 54.2534 19.0182 176.2026 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 P 0.00 4.39 0.00 2.05 2.06 0.00 3.65 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.10 0.00 3 K 8.63 3.98 0.00 1.70 1.87 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.47 7.81 4 K 9.19 4.17 0.00 1.97 1.81 0.00 1.45 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.46 1.42 7.81 5 V 8.30 4.92 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 0.84 0.00 0.00 0.93 0.00 0.00 6 L 9.21 4.91 0.00 1.13 1.28 -0.01 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.03 4.96 4.21 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 1.20 0.00 0.00 8 G 8.20 4.59 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 0.00 0.00 0.00 9 V 7.99 4.92 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 1.02 0.00 0.00 0.92 0.00 0.00 10 V 9.03 4.10 2.23 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 0.91 0.00 0.00 0.96 0.00 0.00 11 V 8.10 4.14 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.28 0.00 0.00 12 S 7.52 4.70 0.00 3.83 3.59 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 13 D 8.71 4.75 0.00 2.69 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 14 K 7.57 3.96 0.00 1.79 1.89 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.44 7.81 15 M 7.26 4.49 0.00 2.04 2.00 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 2.59 2.51 0.00 16 Q 8.45 4.20 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 17 K 8.89 4.62 0.00 1.89 1.79 0.00 1.94 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.40 7.81 18 T 7.60 5.19 4.26 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 1.30 0.00 0.00 19 V 8.48 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 0.76 0.00 0.00 0.95 0.00 0.00 20 T 8.36 4.47 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 21 V 8.95 4.57 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 0.75 0.00 0.00 0.90 0.00 0.00 22 L 8.96 4.88 0.00 1.51 1.38 0.93 0.88 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 23 V 9.12 4.70 2.47 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 0.98 0.00 0.00 1.04 0.00 0.00 24 E 8.77 4.91 0.00 2.04 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 0.00 2.29 2.34 0.00 25 R 9.65 4.86 0.00 1.83 1.86 0.00 2.68 0.00 0.00 3.05 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 26 Q 8.71 5.40 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 27 F 8.99 4.96 0.00 3.16 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 28 P 0.00 4.54 0.00 2.13 2.15 0.00 4.00 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 2.10 2.05 0.00 29 H 9.49 4.03 0.00 3.18 3.31 0.00 5.61 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.06 0.00 2.16 2.10 0.00 3.52 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 1.61 1.96 0.00 31 L 7.85 4.37 0.00 1.35 1.30 0.77 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 32 Y 7.83 4.69 0.00 2.67 2.79 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 33 G 7.79 4.17 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 0.00 34 K 7.72 3.86 0.00 1.87 2.01 0.00 1.38 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.49 1.54 7.81 35 V 8.53 4.03 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 0.80 0.00 0.00 0.94 0.00 0.00 36 I 8.55 4.51 1.69 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 0.62 -0.21 0.89 0.00 0.00 37 K 8.42 4.99 0.00 1.75 1.70 0.00 1.75 0.00 0.00 1.96 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.44 7.81 38 R 9.63 5.02 0.00 2.14 1.92 0.00 3.27 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 39 S 8.41 5.20 0.00 3.96 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 40 K 9.15 4.47 0.00 1.63 1.46 0.00 1.44 0.00 0.00 1.37 0.00 0.00 2.14 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 1.02 7.81 41 K 8.32 4.78 0.00 1.57 1.62 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 1.41 7.81 42 Y 9.03 4.62 0.00 2.70 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 43 L 8.80 4.97 0.00 1.59 1.69 0.94 0.84 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 44 A 8.94 4.68 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 45 H 9.26 4.78 0.00 3.26 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.75 4.69 0.00 2.80 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 47 P 0.00 4.35 0.00 2.25 2.01 0.00 3.72 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.16 0.00 48 E 8.12 4.04 0.00 1.94 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 2.32 2.36 0.00 49 E 7.99 3.98 0.00 2.07 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 2.41 2.37 0.00 50 K 8.45 3.96 0.00 1.57 1.56 0.00 1.58 0.00 0.00 1.19 0.00 0.00 2.62 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.74 1.18 7.81 51 Y 7.66 4.09 0.00 3.06 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 52 K 9.52 4.72 0.00 1.81 1.67 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.42 7.81 53 L 8.31 4.13 0.00 1.59 1.59 0.95 1.06 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 54 G 8.83 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 55 D 7.73 5.14 0.00 2.72 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 56 V 8.31 4.51 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 0.98 0.00 0.00 0.93 0.00 0.00 57 V 9.02 5.35 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 0.79 0.00 0.00 0.76 0.00 0.00 58 E 9.15 4.82 0.00 1.80 1.81 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 2.19 2.24 0.00 59 I 8.37 4.62 1.52 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 0.94 0.96 0.48 0.00 0.00 60 I 8.76 5.00 1.88 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 1.29 1.77 0.96 0.00 0.00 61 E 9.22 3.58 0.00 1.94 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 0.00 2.05 1.74 0.00 62 S 8.46 4.60 0.00 3.60 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 63 R 8.58 3.77 0.00 1.71 1.81 0.00 3.21 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 64 P 0.00 4.39 0.00 2.04 1.95 0.00 3.62 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 65 I 8.47 4.41 1.98 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.79 0.82 0.00 0.00 66 S 7.63 4.66 0.00 3.93 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 67 K 8.64 3.55 0.00 1.74 1.83 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.48 7.81 68 R 8.40 3.73 0.00 2.03 2.05 0.00 3.46 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 69 K 6.59 5.67 0.00 1.98 1.97 0.00 1.78 0.00 0.00 1.88 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.53 7.81 70 R 7.48 4.81 0.00 1.59 1.63 0.00 3.16 0.00 0.00 3.35 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 71 F 8.10 5.28 0.00 2.94 2.75 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 72 R 8.88 4.88 0.00 1.79 1.85 0.00 3.14 0.00 0.00 3.08 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.55 0.00 73 V 7.84 3.87 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 0.80 0.00 0.00 74 L 9.30 4.27 0.00 1.63 1.75 0.92 0.15 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 75 R 7.46 4.65 0.00 1.92 2.00 0.00 3.02 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 76 L 8.66 4.73 0.00 1.89 1.68 0.96 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 77 V 9.61 4.15 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 0.83 0.00 0.00 0.96 0.00 0.00 78 E 7.68 4.65 0.00 2.05 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 2.28 2.31 0.00 79 S 9.20 4.39 0.00 3.86 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 80 G 8.80 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 0.00 0.00 0.00 81 R 7.99 4.59 0.00 2.18 2.02 0.00 3.09 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.49 0.00 82 M 8.26 4.12 0.00 2.08 2.17 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 2.70 2.49 0.00 83 D 7.80 4.33 0.00 2.80 2.81 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 84 L 7.50 4.25 0.00 1.74 1.67 1.00 0.73 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 85 V 7.38 3.54 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 1.21 0.00 0.00 0.93 0.00 0.00 86 E 8.68 3.76 0.00 2.20 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 87 K 9.21 3.43 0.00 2.02 1.74 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.69 7.81 88 Y 7.38 3.88 0.00 3.07 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 89 L 8.46 3.71 0.00 1.91 1.69 1.02 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.74 3.59 1.84 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 1.39 1.08 0.90 0.00 0.00 91 R 8.17 3.76 0.00 1.79 1.76 0.00 3.08 0.00 0.00 3.42 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.79 0.00 92 R 7.67 2.69 0.00 0.98 1.70 0.00 3.13 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.31 0.00 93 Q 8.33 4.01 0.00 2.13 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.48 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 94 N 8.26 4.00 0.00 2.86 2.96 0.00 0.00 7.15 7.40 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 95 Y 8.10 4.19 0.00 3.14 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 96 Q 9.04 4.49 0.00 1.96 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 97 S 7.77 4.54 0.00 4.09 3.39 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.19 3.94 0.00 1.78 2.13 0.85 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 99 S 7.43 4.57 0.00 3.96 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 0.00 100 K 7.78 4.63 0.00 1.69 1.80 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.42 7.81 101 R 9.39 4.23 0.00 1.75 1.69 0.00 3.47 0.00 0.00 3.23 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.52 0.00 102 G 8.55 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.34 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 0.00 104 K 8.19 4.36 0.00 1.75 1.69 0.00 1.90 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.43 7.81 105 A 8.54 4.10 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