NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4684 8.2893 118.1903 54.7738 33.2396 174.5272 2 I 5.0837 7.7009 109.1366 57.6807 40.6565 172.0424 3 Q 4.6466 7.6897 119.1887 56.1888 30.4218 171.7519 4 P 4.5032 0.0000 0.0000 63.5112 32.4705 175.3521 5 Q 4.2755 8.3359 118.2344 56.0591 30.1375 175.7655 6 T 5.2579 8.9262 120.2723 61.5255 71.5052 172.3634 7 Y 4.7422 10.3213 126.8306 56.7120 37.1229 174.1984 8 L 4.7957 9.2869 126.6992 53.1831 46.0015 174.1761 9 E 5.6810 9.0415 120.3951 55.6753 32.4237 177.8153 10 V 5.2057 8.9212 118.0206 60.4684 31.5207 176.0829 11 A 4.3644 9.4460 120.3062 52.5196 18.9514 179.8224 12 D 4.9497 7.9321 123.6417 56.2060 39.5009 177.5524 13 N 4.8342 9.2242 126.0343 55.0744 38.5714 173.3873 14 T 3.8099 7.0676 107.2082 58.7104 71.5311 174.4502 15 G 3.5871 8.8232 111.9678 47.9981 0.0000 173.8833 16 A 4.8090 7.4937 120.5600 50.6923 22.1089 176.5617 17 R 4.0636 8.8263 120.3143 57.3342 31.5412 175.1106 18 K 5.8986 10.2138 118.7472 53.5779 35.6352 175.1252 19 I 5.1434 8.3143 118.9729 59.6061 41.9884 173.0427 20 M 6.0402 8.7831 122.5245 53.5209 34.3955 174.5453 21 C 4.4703 8.5915 125.8630 59.3425 33.7594 172.2828 22 I 4.1858 8.7471 124.1508 62.4968 36.2070 179.1716 23 R 4.5416 7.5348 122.4542 55.6583 33.4831 174.6073 24 V 4.2349 8.3508 111.7546 61.7336 31.9815 176.5744 25 L 4.2777 8.6720 126.4422 55.8098 42.2038 179.9724 26 K 4.4490 8.0689 119.0724 56.6465 31.7607 180.1478 27 G 3.6621 9.1387 105.4361 45.7222 0.0000 174.2814 28 S 3.6946 6.7347 121.5050 57.2865 58.9581 173.3264 29 N 5.4191 8.2289 135.0000 56.3326 42.9484 174.9391 30 A 3.6565 7.0966 118.2305 52.4105 19.2130 180.1914 31 K 3.5051 9.9811 120.0415 57.9141 29.8523 176.5646 32 Y 4.6811 6.8773 115.4281 56.6460 40.0963 173.5122 33 A 4.2219 8.8338 125.5503 52.5837 17.1253 177.3586 34 T 4.7366 7.9490 117.7956 61.8590 70.6752 175.1076 35 V 3.6939 8.3542 116.0637 63.4554 31.7972 176.5339 36 G 3.9135 8.6378 112.2945 46.7184 0.0000 172.9872 37 D 5.0382 7.8139 120.9438 52.2776 43.6956 175.1763 38 V 5.5939 8.2460 111.3259 59.5783 35.7424 175.3923 39 I 4.8644 8.0538 117.3575 60.1041 40.8834 173.1933 40 V 4.9673 8.0095 120.4227 60.7311 34.1020 174.7662 41 A 4.8328 8.5665 123.6524 51.8447 23.5232 174.3266 42 S 5.6551 8.8891 113.5956 55.2954 66.4421 173.3626 43 V 4.1152 8.2657 121.2985 61.7279 31.8752 174.9822 44 K 4.3862 8.6239 120.5669 58.2072 33.8896 176.1591 45 E 4.4072 8.3365 117.9926 55.2035 30.6197 176.5778 46 A 4.0169 8.1590 124.2747 53.3498 18.4730 177.3927 47 I 4.8512 7.9941 110.6045 60.4258 38.8335 171.9356 48 P 4.2515 0.0000 0.0000 64.4581 32.7796 178.5495 49 R 3.3050 8.8991 116.2776 54.6791 31.5486 176.2342 50 G 3.7770 8.9093 126.9484 45.8451 0.0000 173.5588 51 A 4.2500 8.5762 124.5508 52.9574 18.0906 178.6741 52 V 3.3764 6.6188 109.7918 59.8317 31.8986 179.1399 53 K 3.9809 8.2229 121.9158 56.2543 32.3290 176.0044 54 E 4.7802 8.3680 114.8411 56.3922 30.9028 176.6979 55 G 4.3975 7.1651 113.4412 45.3344 0.0000 176.2923 56 D 5.3394 8.1556 120.9795 53.6728 41.3303 174.5807 57 V 4.6127 7.9382 117.2948 60.4902 36.1243 174.0308 58 V 4.8760 7.9907 114.6260 61.1275 36.8534 174.3927 59 K 4.4605 7.7906 116.7543 57.2418 37.3460 172.6982 60 A 5.1665 7.8407 119.4122 50.1041 22.4671 175.8610 61 V 3.7707 8.8154 122.4676 63.7425 32.7751 174.9193 62 V 4.3065 8.1575 128.1167 62.0777 34.3097 177.0085 63 V 3.5689 8.2710 119.5495 63.1181 29.5780 172.1299 64 R 5.2804 8.4683 124.7101 58.3387 28.2232 173.2618 65 T 2.9629 7.0357 119.6005 60.3075 64.7406 171.1135 66 K 4.4675 8.6640 135.0000 56.3567 34.0163 173.7553 67 K 3.7102 7.6997 122.8145 56.3963 28.8056 176.1816 68 E 4.3427 8.7445 122.9275 54.9508 30.2743 175.0445 69 V 4.4450 8.1578 126.2343 61.7123 32.4210 175.1645 70 K 4.4658 8.7342 128.1409 54.8749 34.1456 178.2661 71 R 3.8743 8.8734 120.8748 59.3232 29.8784 176.3774 72 P 4.5356 0.0000 0.0000 62.4507 31.3661 175.4363 73 D 4.4358 8.0168 117.0267 55.7949 38.7056 173.8979 74 G 4.2808 7.7600 105.1208 45.2882 0.0000 173.8125 75 S 5.2782 8.3115 115.6986 56.6625 66.2912 172.7127 76 A 4.5621 8.8551 123.0411 51.8378 23.3537 174.7687 77 I 4.6389 8.0584 117.6615 60.2299 40.8561 173.7402 78 R 4.7559 8.5916 125.6681 54.4971 32.0308 176.7938 79 F 4.4749 8.8132 121.2540 55.4577 37.7868 174.2565 80 D 4.7299 7.8507 119.6899 53.4319 46.0963 174.7696 81 D 5.1649 8.3274 123.5048 53.1962 44.5118 174.0480 82 N 5.3681 8.9860 118.6320 53.3767 41.2689 173.4699 83 A 4.7768 7.9755 120.3885 50.8733 23.6221 173.9125 84 A 5.3625 8.5438 119.3211 49.5758 21.3707 177.0983 85 V 3.9612 12.0000 122.1790 63.0278 32.2698 175.4086 86 I 4.7579 8.4048 127.0489 59.6177 40.1800 174.8582 87 I 4.2964 8.0962 125.0762 60.8213 39.3574 176.1572 88 N 3.9090 9.7698 120.5211 53.2725 40.2419 177.9127 89 N 3.8078 7.8426 127.7463 56.3664 39.3032 173.0773 90 Q 4.2829 8.8555 122.6709 57.0981 27.8961 173.6071 91 L 3.6404 7.2072 120.7034 53.5250 39.4369 175.9650 92 E 4.2981 8.5487 122.5027 54.8646 29.7487 174.2997 93 P 4.3172 0.0000 0.0000 64.5225 32.0250 178.2180 94 R 4.1918 7.6499 121.3744 54.7588 31.5856 177.0780 95 G 3.8903 8.5597 108.0706 48.1901 0.0000 173.6529 96 T 4.5430 8.2105 119.2516 62.0203 69.3641 173.6078 97 R 5.4467 8.1635 127.3528 56.5957 29.6060 175.5451 98 V 3.9522 7.6545 115.4417 59.2260 30.0908 174.9040 99 F 4.8377 7.0416 124.4494 58.2704 42.3651 171.4164 100 G 4.4415 7.2340 108.2976 42.8599 0.0000 168.5370 101 P 4.1413 0.0000 0.0000 61.2250 32.3796 174.9097 102 V 3.2753 8.8445 118.5352 65.2812 30.2403 174.6540 103 A 3.1502 8.4757 126.1786 50.9693 21.2044 180.2101 104 R 3.7374 7.7134 116.1959 57.0222 31.7411 177.5168 105 E 3.9526 9.0583 118.5519 57.6414 29.0000 179.5646 106 L 4.1919 8.7205 124.0437 59.5485 41.3970 179.5027 107 R 3.8984 8.2924 118.5611 59.2226 30.1952 178.0899 108 E 4.0136 8.5699 117.6999 56.8730 29.9110 178.3231 109 K 3.7673 7.4910 119.0709 57.0351 29.4427 176.0620 110 G 4.2606 7.1229 114.1482 43.9784 0.0000 173.1407 111 F 5.3629 8.2891 134.1282 57.5798 41.0409 176.7429 112 M 3.8896 7.9070 124.0234 59.7042 31.6638 177.2378 113 K 3.8387 8.2770 118.9852 59.9430 32.1366 178.0914 114 I 3.6989 8.5295 119.9575 65.2202 36.8316 177.6830 115 V 3.5530 8.1500 116.3095 67.4377 31.2690 177.7600 116 S 4.2873 7.9114 115.4253 61.1232 63.2911 175.8096 117 L 4.2716 8.0399 123.3422 57.0774 42.7022 177.9178 118 A 4.4223 8.2198 128.4224 50.2713 17.5554 174.9972 119 P 4.5901 0.0000 0.0000 63.2899 32.5260 176.5883 120 E 3.8728 8.7983 117.6452 56.0365 30.7625 177.3837 121 V 3.1452 7.4529 119.3440 65.3636 31.1133 175.6487 122 L 4.0659 8.7330 128.9441 55.3237 42.4785 173.3145 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 4.47 0.00 2.11 2.27 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 2.49 2.61 0.00 2 I 7.70 5.08 1.96 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 1.45 1.25 1.11 0.00 0.00 3 Q 7.69 4.65 0.00 2.53 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.70 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 4 P 0.00 4.50 0.00 2.15 1.89 0.00 3.79 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.89 0.00 5 Q 8.34 4.28 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 6 T 8.93 5.26 4.39 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 1.42 0.00 0.00 7 Y 10.32 4.74 0.00 2.78 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 8 L 9.29 4.80 0.00 1.66 1.52 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 9 E 9.04 5.68 0.00 1.96 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 2.33 2.18 0.00 10 V 8.92 5.21 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 0.64 0.00 0.00 0.96 0.00 0.00 11 A 9.45 4.36 1.46 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 12 D 7.93 4.95 0.00 2.70 1.65 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 13 N 9.22 4.83 0.00 2.67 2.78 0.00 0.00 6.86 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 14 T 7.07 3.81 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 1.27 0.00 0.00 15 G 8.82 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 0.00 0.00 0.00 16 A 7.49 4.81 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 17 R 8.83 4.06 0.00 1.92 1.93 0.00 3.15 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 18 K 10.21 5.90 0.00 2.07 1.66 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.52 7.81 19 I 8.31 5.14 2.03 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 1.22 0.84 0.93 0.00 0.00 20 M 8.78 6.04 0.00 2.04 1.81 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.14 0.00 21 C 8.59 4.47 0.00 3.02 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 I 8.75 4.19 1.86 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 0.83 0.89 0.00 0.00 23 R 7.53 4.54 0.00 1.83 1.97 0.00 2.99 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 24 V 8.35 4.23 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 0.76 0.00 0.00 1.00 0.00 0.00 25 L 8.67 4.28 0.00 1.61 2.21 0.93 0.51 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 26 K 8.07 4.45 0.00 1.93 1.65 0.00 1.69 0.00 0.00 1.79 0.00 0.00 3.22 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.45 1.48 7.81 27 G 9.14 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 0.00 0.00 0.00 28 S 6.73 3.69 0.00 3.93 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 29 N 8.23 5.42 0.00 2.89 2.88 0.00 0.00 7.25 7.96 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 30 A 7.10 3.66 1.09 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 31 K 9.98 3.51 0.00 1.57 0.74 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.05 1.27 7.81 32 Y 6.88 4.68 0.00 3.15 2.94 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 33 A 8.83 4.22 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 34 T 7.95 4.74 4.53 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 1.22 0.00 0.00 35 V 8.35 3.69 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 0.73 0.00 0.00 0.93 0.00 0.00 36 G 8.64 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 0.00 0.00 0.00 37 D 7.81 5.04 0.00 3.00 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 38 V 8.25 5.59 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 0.93 0.00 0.00 0.96 0.00 0.00 39 I 8.05 4.86 2.13 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 1.40 1.02 0.95 0.00 0.00 40 V 8.01 4.97 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 0.78 0.00 0.00 0.92 0.00 0.00 41 A 8.57 4.83 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 42 S 8.89 5.66 0.00 3.84 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 43 V 8.27 4.12 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 0.78 0.00 0.00 1.08 0.00 0.00 44 K 8.62 4.39 0.00 1.70 1.79 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.25 1.33 7.81 45 E 8.34 4.41 0.00 1.89 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 2.33 2.28 0.00 46 A 8.16 4.02 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 47 I 7.99 4.85 1.83 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 1.16 1.12 0.91 0.00 0.00 48 P 0.00 4.25 0.00 2.21 2.06 0.00 3.84 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 1.99 2.01 0.00 49 R 8.90 3.30 0.00 1.90 1.31 0.00 3.52 0.00 0.00 3.23 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 50 G 8.91 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 51 A 8.58 4.25 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 52 V 6.62 3.38 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 0.88 0.00 0.00 0.94 0.00 0.00 53 K 8.22 3.98 0.00 1.90 2.30 0.00 1.53 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 1.49 7.81 54 E 8.37 4.78 0.00 1.94 1.95 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 2.21 2.20 0.00 55 G 7.17 4.40 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 0.00 56 D 8.16 5.34 0.00 2.61 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 57 V 7.94 4.61 2.21 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 0.83 0.00 0.00 0.92 0.00 0.00 58 V 7.99 4.88 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 0.77 0.00 0.00 0.93 0.00 0.00 59 K 7.79 4.46 0.00 2.03 1.92 0.00 1.25 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.12 1.25 7.81 60 A 7.84 5.17 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 61 V 8.82 3.77 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 0.96 0.00 0.00 0.94 0.00 0.00 62 V 8.16 4.31 1.80 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 0.43 0.00 0.00 0.69 0.00 0.00 63 V 8.27 3.57 2.27 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 0.82 0.00 0.00 1.00 0.00 0.00 64 R 8.47 5.28 0.00 2.03 2.09 0.00 3.12 0.00 0.00 3.07 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.26 0.00 65 T 7.04 2.96 4.14 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 0.88 0.00 0.00 66 K 8.66 4.47 0.00 1.74 1.85 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.17 1.21 7.81 67 K 7.70 3.71 0.00 1.92 1.99 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 1.32 7.81 68 E 8.74 4.34 0.00 2.05 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 0.00 2.43 2.27 0.00 69 V 8.16 4.45 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 0.81 0.00 0.00 0.92 0.00 0.00 70 K 8.73 4.47 0.00 1.87 1.71 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.41 1.42 7.81 71 R 8.87 3.87 0.00 1.80 2.03 0.00 3.21 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 72 P 0.00 4.54 0.00 2.18 2.14 0.00 3.89 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 2.08 1.99 0.00 73 D 8.02 4.44 0.00 2.84 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 74 G 7.76 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 75 S 8.31 5.28 0.00 3.81 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 76 A 8.86 4.56 1.29 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 0.00 0.00 0.00 77 I 8.06 4.64 1.79 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.42 0.86 0.00 0.00 78 R 8.59 4.76 0.00 2.04 1.96 0.00 3.30 0.00 0.00 3.35 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.82 0.00 79 F 8.81 4.47 0.00 2.91 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 80 D 7.85 4.73 0.00 3.02 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 81 D 8.33 5.16 0.00 2.61 2.51 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 82 N 8.99 5.37 0.00 2.57 2.73 0.00 0.00 6.45 6.94 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 83 A 7.98 4.78 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 84 A 8.54 5.36 1.15 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 85 V 12.00 3.96 2.19 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 0.76 0.00 0.00 0.92 0.00 0.00 86 I 8.40 4.76 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 1.45 0.78 0.98 0.00 0.00 87 I 8.10 4.30 2.23 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 0.60 0.92 0.00 0.00 88 N 9.77 3.91 0.00 2.84 2.21 0.00 0.00 6.95 6.92 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 89 N 7.84 3.81 0.00 2.87 3.00 0.00 0.00 5.92 7.39 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 90 Q 8.86 4.28 0.00 2.13 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.56 0.00 0.00 0.00 0.00 0.00 2.24 2.15 0.00 91 L 7.21 3.64 0.00 1.79 1.61 0.93 0.87 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 92 E 8.55 4.30 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 2.32 2.33 0.00 93 P 0.00 4.32 0.00 2.19 2.09 0.00 3.77 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.12 0.00 94 R 7.65 4.19 0.00 1.82 1.90 0.00 3.32 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.67 0.00 95 G 8.56 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 96 T 8.21 4.54 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 1.23 0.00 0.00 97 R 8.16 5.45 0.00 2.13 2.02 0.00 2.72 0.00 0.00 3.95 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.42 0.00 98 V 7.65 3.95 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 0.72 0.00 0.00 0.99 0.00 0.00 99 F 7.04 4.84 0.00 2.93 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 0.00 100 G 7.23 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.14 0.00 2.06 2.09 0.00 3.58 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 102 V 8.84 3.28 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 0.98 0.00 0.00 0.95 0.00 0.00 103 A 8.48 3.15 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 0.00 104 R 7.71 3.74 0.00 1.85 1.97 0.00 3.51 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 105 E 9.06 3.95 0.00 2.07 1.54 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 2.28 2.58 0.00 106 L 8.72 4.19 0.00 2.01 2.09 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.29 3.90 0.00 2.04 2.09 0.00 3.24 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 108 E 8.57 4.01 0.00 2.10 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 2.60 2.67 0.00 109 K 7.49 3.77 0.00 1.83 1.52 0.00 1.95 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.23 1.53 7.81 110 G 7.12 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 0.00 0.00 0.00 0.00 111 F 8.29 5.36 0.00 3.37 3.43 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 0.00 112 M 7.91 3.89 0.00 2.10 2.09 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 2.67 2.66 0.00 113 K 8.28 3.84 0.00 1.91 2.38 0.00 1.71 0.00 0.00 1.84 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.66 7.81 114 I 8.53 3.70 2.11 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.69 0.79 0.00 0.00 115 V 8.15 3.55 2.37 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 0.93 0.00 0.00 1.34 0.00 0.00 116 S 7.91 4.29 0.00 4.09 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 0.00 117 L 8.04 4.27 0.00 1.71 1.97 0.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.22 4.42 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.59 0.00 2.31 2.11 0.00 3.49 0.00 0.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.45 0.00 120 E 8.80 3.87 0.00 1.97 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 2.32 2.34 0.00 121 V 7.45 3.15 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 0.71 0.00 0.00 0.91 0.00 0.00 122 L 8.73 4.07 0.00 1.74 1.85 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00