NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.3384 8.0976 120.8685 56.8530 31.4094 174.4305 2 N 4.5164 7.9077 114.6171 51.9409 40.6552 172.3442 3 I 5.1947 8.7635 120.3770 59.3178 42.2384 175.4230 4 L 4.7803 8.7069 126.8644 53.2914 45.3365 176.8722 5 R 4.9288 9.2565 124.2272 54.4809 33.1105 174.9095 6 N 4.3340 8.7394 116.4543 54.7714 39.4613 175.4312 7 D 4.6156 9.1129 125.1340 55.7721 38.8505 173.7684 8 E 4.9033 7.8833 116.6622 55.2088 33.2612 175.6542 9 G 4.5449 8.4327 107.1077 46.3252 0.0000 171.8383 10 L 5.1152 8.9311 119.5142 53.3436 44.2856 176.6044 11 Y 4.8098 8.7944 120.6207 56.0364 41.1205 174.0534 12 G 4.1861 8.1601 108.1379 48.0920 0.0000 172.3914 13 G 3.7977 9.3861 115.9775 45.2791 0.0000 172.2093 14 Q 4.4932 8.8004 123.1014 56.4462 30.4586 174.6018 15 S 5.1365 8.3667 115.7831 57.8086 66.0935 173.4805 16 L 5.0088 8.8849 120.3331 53.3902 44.1390 175.6094 17 D 5.3806 8.7297 121.2643 53.1534 45.3722 176.2751 18 V 4.0662 8.4326 115.8667 62.0530 32.6843 173.2990 19 N 4.2713 8.7535 125.9729 52.2776 37.4597 173.6262 20 P 4.5822 0.0000 0.0000 63.0348 28.2330 174.9006 21 Y 5.3333 7.5842 118.6009 56.9105 43.5100 174.2320 22 H 5.2118 9.2290 122.8267 55.6691 33.8144 171.8670 23 F 5.5798 9.1966 129.5880 56.8385 40.9707 174.2137 24 I 4.9920 8.5564 126.1867 59.4723 41.9905 173.9509 25 M 4.3080 8.5604 128.2066 54.0633 32.8375 175.6818 26 Q 4.5023 8.1889 124.9606 54.9496 29.8920 177.1100 27 E 4.2531 8.5358 116.9699 57.9630 29.7857 177.6480 28 D 4.5602 7.9168 118.5383 54.2939 41.4982 178.0051 29 C 3.8439 8.0198 118.0815 56.6928 41.0595 171.3304 30 N 4.7221 7.6556 117.1546 51.3277 40.5607 173.3229 31 L 4.2222 8.3275 129.7922 54.7724 43.2254 175.7454 32 V 4.7749 8.3768 125.5394 60.8522 35.7012 173.7705 33 L 5.3953 8.9506 127.7048 53.7796 44.4268 174.4443 34 Y 5.2897 9.3630 125.0544 56.3761 40.7171 174.4571 35 D 4.9994 9.3475 124.8010 52.6489 42.5405 176.3804 36 H 4.0006 8.1626 126.6776 57.3847 27.9204 178.3691 37 S 4.4019 8.8700 123.1152 60.4089 63.7926 174.6200 38 T 4.0965 7.7437 119.7528 63.3936 68.5857 174.2786 39 S 4.5949 8.6427 120.8215 58.3029 64.2271 173.6428 40 V 4.3724 8.5874 118.9534 63.7654 34.1528 175.1834 41 W 5.2059 7.8329 127.6379 55.9221 34.5937 173.4211 42 A 4.6722 6.4559 122.4704 51.7142 20.7015 176.6438 43 S 3.0113 7.6687 113.7243 57.7041 64.0576 173.9566 44 N 3.9892 7.5909 116.3262 55.1340 35.4753 173.9921 45 T 4.4830 8.0580 109.0904 61.6973 68.4886 173.8464 46 G 3.8707 8.0313 106.6667 45.6438 0.0000 174.0306 47 I 4.7061 8.9762 124.3754 59.1228 41.5425 174.9431 48 L 4.0599 8.6384 127.6427 56.4284 41.8808 177.7677 49 G 3.9553 8.9688 111.6636 45.3115 0.0000 174.1395 50 K 4.1421 7.7429 122.0942 54.8008 30.3889 175.2095 51 K 4.4296 7.8458 124.2778 55.0539 34.9747 175.8473 52 G 3.8881 8.6767 105.5263 46.0601 0.0000 173.6640 53 C 5.1224 7.8683 116.2068 56.0195 40.0517 172.8735 54 R 4.9012 8.5079 119.1528 54.5422 34.1164 173.9017 55 A 5.1435 9.0110 126.0514 50.3210 21.4670 176.1350 56 V 5.0521 8.9967 122.2097 59.8456 34.9958 174.4736 57 L 4.8581 8.9982 127.7996 54.8947 43.2130 175.7242 58 Q 5.0338 8.7842 124.4929 53.8915 32.2850 176.6705 59 S 4.5965 8.3050 117.1300 62.0815 63.7592 176.1521 60 D 4.7360 7.7886 116.8184 52.3457 40.4380 177.0417 61 G 2.7368 7.8681 107.3937 46.5735 0.0000 172.9575 62 N 4.7820 7.7111 116.8898 51.3204 42.3093 173.1307 63 F 5.4784 9.0799 129.3575 57.1780 39.9302 173.6222 64 V 4.3223 8.3967 125.7874 60.7933 33.8682 174.2445 65 V 4.5107 8.2839 127.8568 61.6569 33.1029 174.0794 66 Y 5.2850 8.8107 125.7809 55.9724 40.8199 175.3223 67 D 4.7209 9.2925 122.0252 53.6479 42.1182 177.0530 68 A 4.4704 8.0680 124.5998 54.4767 17.7649 178.2959 69 E 4.1783 7.2306 115.4566 55.7905 30.0137 176.6216 70 G 4.6387 6.8490 114.3087 46.5993 0.0000 172.5761 71 R 4.8527 7.3139 117.3749 53.5425 33.4698 175.7560 72 S 4.5310 8.7124 116.7647 58.9531 63.4878 173.6490 73 L 4.6546 8.3524 124.3284 55.6973 43.6398 176.6317 74 W 5.2489 7.7273 125.9584 56.2000 34.5508 173.2701 75 A 4.3171 6.5693 124.3691 50.3326 20.8463 176.8766 76 S 3.5354 7.7226 117.2507 58.7448 63.8518 174.1498 77 H 4.1089 7.8863 116.5501 57.0457 26.0948 174.7396 78 S 4.5808 7.9822 109.0202 58.1200 63.5783 174.3163 79 V 3.9252 7.7160 114.9456 63.1446 31.0199 176.5013 80 R 4.6069 8.7042 128.1510 55.5922 30.8750 177.1875 81 G 4.1296 8.3025 100.9837 45.3473 0.0000 172.9474 82 N 4.8769 8.5760 118.4139 53.5728 39.9882 175.1252 83 G 3.9163 7.9601 112.7125 45.7253 0.0000 171.6770 84 N 5.3542 7.2414 117.3394 50.9881 42.0399 173.6998 85 Y 5.3013 8.2175 118.2189 56.6860 42.9526 174.1449 86 V 4.8110 8.3044 110.8698 60.5002 36.6512 173.2117 87 L 5.0931 8.9060 125.3964 53.2472 44.6135 175.5258 88 V 4.8566 8.4302 125.7064 59.9130 34.7307 174.7689 89 L 4.5794 8.2564 125.8585 53.4200 41.6690 176.0189 90 Q 4.1694 8.4726 124.7871 55.1902 29.3396 177.6500 91 E 4.1185 8.6844 119.6436 58.2514 29.4910 177.3393 92 D 4.5801 7.7918 117.5096 52.3893 40.0750 176.0625 93 G 3.0612 7.4731 106.9421 46.7001 0.0000 173.2582 94 N 4.8508 7.4312 115.4466 51.3111 43.4229 173.1556 95 V 4.5616 7.9201 123.2782 60.2392 33.3751 174.7113 96 V 4.2887 7.9864 126.7325 60.9385 35.3427 173.7561 97 I 4.8171 7.7985 124.7592 59.5873 39.4480 174.4464 98 Y 4.8087 8.3764 123.6857 55.7924 40.5317 175.1794 99 R 4.1757 9.1051 124.9350 57.3662 30.2272 176.5301 100 S 3.5739 7.7774 118.7039 58.5799 62.3371 170.7831 101 D 4.9126 8.0203 119.6580 52.1311 40.7503 176.3083 102 I 4.5440 7.8826 111.6062 60.1934 39.2578 175.2699 103 W 4.6897 7.8043 128.1553 56.5709 33.3580 173.2129 104 S 4.1269 7.3460 119.0028 56.8585 65.5001 173.6743 105 T 3.7047 7.8963 112.1103 62.0821 69.7794 174.4721 106 N 4.5777 7.8853 122.6190 53.0742 37.9490 173.9440 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 R 8.10 4.34 0.00 1.91 1.96 0.00 3.25 0.00 0.00 3.48 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 2 N 7.91 4.52 0.00 2.85 3.07 0.00 0.00 5.32 6.96 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 3 I 8.76 5.19 1.89 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 1.37 0.85 0.93 0.00 0.00 4 L 8.71 4.78 0.00 1.58 1.55 1.09 0.82 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 5 R 9.26 4.93 0.00 1.91 1.91 0.00 3.17 0.00 0.00 3.45 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 6 N 8.74 4.33 0.00 2.74 2.87 0.00 0.00 6.89 8.08 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 7 D 9.11 4.62 0.00 2.87 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.88 4.90 0.00 2.12 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 2.28 2.39 0.00 9 G 8.43 4.54 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 0.00 0.00 0.00 10 L 8.93 5.12 0.00 1.69 1.70 1.09 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.79 4.81 0.00 2.89 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 12 G 8.16 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 0.00 0.00 0.00 13 G 9.39 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 14 Q 8.80 4.49 0.00 2.53 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.52 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 15 S 8.37 5.14 0.00 4.10 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 16 L 8.88 5.01 0.00 1.80 1.69 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.73 5.38 0.00 2.55 2.57 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 18 V 8.43 4.07 2.14 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 0.73 0.00 0.00 1.02 0.00 0.00 19 N 8.75 4.27 0.00 3.05 2.84 0.00 0.00 7.20 8.02 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 20 P 0.00 4.58 0.00 1.53 1.48 0.00 3.27 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 1.90 1.95 0.00 21 Y 7.58 5.33 0.00 3.08 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 22 H 9.23 5.21 0.00 3.25 3.40 0.00 5.58 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 F 9.20 5.58 0.00 3.14 3.03 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 24 I 8.56 4.99 1.65 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.56 1.09 0.00 0.00 25 M 8.56 4.31 0.00 2.40 1.94 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 26 Q 8.19 4.50 0.00 2.28 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.48 6.67 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 27 E 8.54 4.25 0.00 1.94 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 2.32 2.41 0.00 28 D 7.92 4.56 0.00 2.74 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 29 C 8.02 3.84 0.00 3.37 3.16 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 30 N 7.66 4.72 0.00 2.76 2.71 0.00 0.00 6.76 6.66 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 31 L 8.33 4.22 0.00 1.41 1.29 0.81 -0.12 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 32 V 8.38 4.77 1.72 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 0.22 0.00 0.00 0.84 0.00 0.00 33 L 8.95 5.40 0.00 2.23 1.80 1.13 0.87 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 34 Y 9.36 5.29 0.00 3.01 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 35 D 9.35 5.00 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 36 H 8.16 4.00 0.00 3.39 2.47 0.00 5.69 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.87 4.40 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 38 T 7.74 4.10 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 1.29 0.00 0.00 39 S 8.64 4.59 0.00 3.86 3.60 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 0.00 0.00 0.00 40 V 8.59 4.37 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 0.85 0.00 0.00 1.07 0.00 0.00 41 W 7.83 5.21 0.00 3.39 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 42 A 6.46 4.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 7.67 3.01 0.00 3.06 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.59 3.99 0.00 2.66 2.79 0.00 0.00 6.64 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 45 T 8.06 4.48 4.13 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 0.00 0.00 0.00 1.08 0.00 0.00 46 G 8.03 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.98 4.71 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.67 0.89 0.00 0.00 48 L 8.64 4.06 0.00 1.60 1.61 0.90 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.97 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.74 4.14 0.00 1.70 1.87 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.40 7.81 51 K 7.85 4.43 0.00 1.74 1.70 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.42 7.81 52 G 8.68 3.89 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 0.00 0.00 0.00 53 C 7.87 5.12 0.00 2.87 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 54 R 8.51 4.90 0.00 1.63 1.65 0.00 2.80 0.00 0.00 2.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.80 0.00 55 A 9.01 5.14 1.12 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 0.00 0.00 56 V 9.00 5.05 2.24 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 0.97 0.00 0.00 1.08 0.00 0.00 57 L 9.00 4.86 0.00 1.85 1.65 0.86 0.78 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 58 Q 8.78 5.03 0.00 2.25 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.73 0.00 59 S 8.30 4.60 0.00 4.06 4.02 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 60 D 7.79 4.74 0.00 2.79 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 61 G 7.87 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 0.00 0.00 0.00 62 N 7.71 4.78 0.00 2.86 2.59 0.00 0.00 6.82 7.59 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 63 F 9.08 5.48 0.00 3.01 2.91 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 64 V 8.40 4.32 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 -0.16 0.00 0.00 0.84 0.00 0.00 65 V 8.28 4.51 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 0.84 0.00 0.00 1.00 0.00 0.00 66 Y 8.81 5.29 0.00 2.85 2.71 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 0.00 0.00 0.00 0.00 67 D 9.29 4.72 0.00 2.83 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 68 A 8.07 4.47 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 69 E 7.23 4.18 0.00 1.83 1.85 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 2.48 2.39 0.00 70 G 6.85 4.64 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 0.00 0.00 0.00 71 R 7.31 4.85 0.00 1.85 1.85 0.00 3.33 0.00 0.00 3.41 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 72 S 8.71 4.53 0.00 3.83 3.66 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 73 L 8.35 4.65 0.00 1.52 1.68 0.91 0.87 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 74 W 7.73 5.25 0.00 3.24 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 75 A 6.57 4.32 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 S 7.72 3.54 0.00 3.86 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 77 H 7.89 4.11 0.00 3.16 3.32 0.00 5.66 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 7.98 4.58 0.00 3.86 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.72 3.93 2.05 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 0.73 0.00 0.00 0.86 0.00 0.00 80 R 8.70 4.61 0.00 1.81 1.93 0.00 3.22 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 81 G 8.30 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.58 4.88 0.00 2.74 2.78 0.00 0.00 6.82 7.98 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 83 G 7.96 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 84 N 7.24 5.35 0.00 2.62 2.59 0.00 0.00 6.72 7.37 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 85 Y 8.22 5.30 0.00 2.78 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 86 V 8.30 4.81 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 0.71 0.00 0.00 1.12 0.00 0.00 87 L 8.91 5.09 0.00 1.45 1.29 0.29 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.43 4.86 2.14 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 0.86 0.00 0.00 0.93 0.00 0.00 89 L 8.26 4.58 0.00 1.56 1.60 0.72 0.82 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 90 Q 8.47 4.17 0.00 2.31 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.51 6.64 0.00 0.00 0.00 0.00 0.00 2.37 2.25 0.00 91 E 8.68 4.12 0.00 1.94 2.05 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 2.35 2.41 0.00 92 D 7.79 4.58 0.00 2.71 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 93 G 7.47 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 0.00 0.00 0.00 94 N 7.43 4.85 0.00 2.65 2.53 0.00 0.00 6.48 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 95 V 7.92 4.56 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 0.43 0.00 0.00 0.08 0.00 0.00 96 V 7.99 4.29 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 0.34 0.00 0.00 0.80 0.00 0.00 97 I 7.80 4.82 1.70 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 1.11 0.56 0.83 0.00 0.00 98 Y 8.38 4.81 0.00 2.96 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 99 R 9.11 4.18 0.00 1.89 1.96 0.00 3.45 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 100 S 7.78 3.57 0.00 3.81 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 0.00 101 D 8.02 4.91 0.00 2.73 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 7.88 4.54 1.92 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 1.33 0.82 0.92 0.00 0.00 103 W 7.80 4.69 0.00 3.19 3.12 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 0.00 104 S 7.35 4.13 0.00 3.69 3.54 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 0.00 105 T 7.90 3.70 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 0.79 0.00 0.00 106 N 7.89 4.58 0.00 2.78 2.99 0.00 0.00 6.73 7.56 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