NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5583 8.1476 120.6165 55.5773 34.0523 174.5491 2 E 4.6928 8.5857 122.8494 54.9233 32.4544 173.9885 3 A 4.2338 9.2417 122.8836 50.9668 22.2854 177.7989 4 K 4.4798 8.5478 121.6114 56.4273 34.3464 176.4394 5 A 4.5331 7.2222 118.9566 52.0085 23.1230 175.8648 6 I 5.0320 8.4805 122.7261 59.5529 41.3720 174.7259 7 A 4.5796 8.6750 129.2053 50.4439 20.1798 176.5901 8 R 4.4605 8.5641 120.4142 56.4470 31.7814 175.8464 9 Y 3.5469 9.1377 114.5419 59.0032 35.7791 170.8031 10 V 3.5179 8.0435 120.9426 62.7644 32.3211 175.7500 11 R 4.7421 8.4872 129.8949 55.4748 27.8734 174.7153 12 I 4.1085 7.5573 117.8473 59.5563 42.5362 172.9959 13 S 4.3156 8.2864 122.1465 57.5480 62.9834 172.7985 14 P 4.2490 0.0000 0.0000 65.6762 30.9211 178.9126 15 R 3.9108 7.9862 116.1137 59.6134 30.4913 178.7913 16 K 4.1311 7.9570 117.2882 59.8044 32.1930 179.7033 17 V 3.8682 7.6317 112.5145 64.0043 31.5613 178.4450 18 R 3.9527 8.3919 119.0683 59.4656 29.4763 178.5011 19 L 4.0079 7.3297 117.0369 57.7729 41.9342 179.3179 20 V 3.7658 8.1348 118.5990 65.7206 31.5080 178.0803 21 V 3.6099 7.8079 117.5514 66.2346 31.2458 177.2796 22 D 4.5294 7.8749 114.5820 55.7683 40.6065 177.3094 23 L 4.3884 7.7578 121.3436 55.6102 42.6168 176.5984 24 I 4.3285 7.9276 110.1141 60.2488 38.9738 175.9707 25 R 3.7794 8.1173 121.8241 57.9461 30.5943 176.0524 26 G 4.4621 8.8000 112.5585 46.8744 0.0000 172.6083 27 K 4.6917 7.4326 117.6354 53.1944 36.3121 174.8388 28 S 4.5184 8.5434 116.9386 58.4323 64.0417 174.9460 29 L 3.9436 8.0520 129.7795 58.4883 41.9662 179.2377 30 E 3.9254 8.1586 118.6850 59.0572 29.5815 178.1926 31 E 3.8591 8.0228 119.4247 59.2001 29.7239 178.3326 32 A 3.9529 8.1581 120.7103 55.3738 18.4651 179.5411 33 R 3.8425 8.1561 115.9156 59.6870 29.9934 178.9490 34 N 4.2116 7.8046 114.6779 57.1373 38.8656 176.8176 35 I 3.6244 8.4555 121.1383 63.8308 37.1219 178.1431 36 L 3.9532 8.4129 119.3957 58.4468 41.7118 179.7238 37 R 4.0172 7.7184 116.7637 59.0515 30.0125 176.3947 38 Y 4.4633 8.5033 112.9485 57.6525 39.0901 175.4769 39 T 4.2273 7.6635 115.5436 61.5125 68.1027 174.6682 40 N 4.6955 8.3988 127.8481 51.5609 37.7808 173.0897 41 K 4.5365 7.7934 119.3603 53.3869 36.3166 176.6412 42 R 3.9774 9.0087 123.2669 59.8913 29.8306 179.0021 43 G 3.8875 8.2732 104.3824 47.2317 0.0000 175.0767 44 A 4.0217 8.0669 123.4341 55.6124 18.3703 178.6196 45 Y 3.8239 7.4839 116.7621 61.1348 38.7120 178.8220 46 F 4.2872 7.6703 117.5067 60.7190 39.2612 177.6532 47 V 3.6331 8.1046 117.6510 65.9778 31.1205 177.9411 48 A 3.8910 8.5887 120.6524 55.0215 18.3091 179.3141 49 K 3.6738 7.8123 118.4189 59.5709 32.1040 179.3283 50 V 3.5441 7.9297 119.1588 64.9489 31.2499 177.8108 51 L 3.8125 8.2215 122.2986 58.1980 41.6721 178.2632 52 E 3.9800 8.5892 119.4861 58.8015 29.7828 178.3864 53 S 4.0481 8.4330 113.4136 61.0534 62.3774 176.7130 54 A 3.8995 8.1930 123.3355 55.3079 18.3037 179.1327 55 A 3.8785 7.6496 118.6755 55.6804 18.2920 179.0182 56 A 3.8877 8.1832 118.7050 55.9781 18.1450 179.3455 57 N 4.2030 8.3527 112.6983 56.3953 38.7662 177.4146 58 A 4.0302 8.6290 122.3455 55.0747 17.8647 179.7993 59 V 3.8204 7.8317 116.2452 65.7935 31.6721 177.2021 60 N 4.8862 8.0234 112.8998 53.4808 38.5802 175.4118 61 N 4.9700 7.8746 115.0751 53.6637 42.8080 175.3567 62 H 4.6347 8.2616 112.6960 56.6094 31.4957 174.3393 63 D 4.4104 7.5620 116.9513 54.7463 37.8143 173.7370 64 M 4.7553 7.7921 121.6740 54.2700 33.9459 176.6487 65 L 4.3475 8.0185 120.6480 53.7015 42.2446 177.8083 66 E 3.8568 9.0079 125.4263 59.4556 29.4796 177.2626 67 D 4.7487 8.0225 115.6134 54.9765 39.8017 176.4909 68 R 4.7546 8.5049 114.7747 56.4950 32.7143 175.6558 69 L 5.3047 8.3759 119.3076 56.1656 41.6953 175.7300 70 Y 5.0151 8.1075 116.8462 55.7152 42.4635 174.4713 71 V 4.0450 8.6986 120.1120 62.2093 30.0433 176.0434 72 K 3.8544 7.9621 128.0508 58.4060 33.0401 175.8640 73 A 4.4445 7.3481 119.5756 51.5584 23.4711 175.3737 74 A 4.6731 8.2166 116.1824 51.6736 21.9195 175.3644 75 Y 5.0659 7.3910 120.7410 55.5285 42.6487 174.8737 76 V 4.8427 8.3859 118.2031 60.6985 33.7204 174.3521 77 D 4.9790 9.0244 125.7571 52.5445 43.5638 175.3415 78 E 4.5084 8.6437 122.4333 55.7573 30.3766 176.6345 79 G 3.8937 8.0809 114.9196 43.8843 0.0000 171.3204 80 P 4.2669 0.0000 0.0000 62.8662 31.3837 176.0043 81 A 4.1988 8.1722 121.8635 51.9086 19.9432 177.1632 82 L 4.5302 8.4332 120.3925 53.1658 43.7917 174.6516 83 K 4.7673 8.4274 124.3359 55.6690 33.1775 176.4802 84 R 4.7726 9.2025 123.0275 54.3176 34.5298 175.5134 85 V 4.2447 8.3086 114.5929 61.5438 33.0795 176.7894 86 L 4.5506 8.6184 124.0576 52.8343 42.9740 172.4074 87 P 4.3415 0.0000 0.0000 62.9433 32.0205 175.0771 88 R 4.7603 8.4488 121.8581 54.0266 33.7779 174.4741 89 A 4.0112 8.8110 125.8058 53.1279 18.8026 177.4952 90 R 3.5362 9.8702 115.0399 57.0092 28.0045 177.7918 91 G 3.9670 8.0304 106.0910 44.9216 0.0000 174.4227 92 R 4.2505 7.7180 118.2369 56.4968 31.8551 175.9776 93 A 4.3903 8.1094 122.1735 51.1981 20.8942 176.0037 94 D 4.6746 8.8022 121.8635 54.8859 42.8461 175.9463 95 I 4.7039 8.0873 114.4921 59.1986 39.2063 174.8977 96 I 3.9717 9.0372 129.6220 60.3398 39.0200 174.7997 97 K 4.4745 8.6392 129.7829 55.6412 33.0083 177.0617 98 K 4.3015 9.1391 127.1487 55.2439 32.0569 177.2984 99 R 4.6648 8.2960 125.0036 56.1521 32.4543 175.0606 100 T 5.0856 7.8529 112.6814 61.2830 71.3063 172.1553 101 S 4.9898 8.8310 119.4732 56.9854 67.7139 172.9918 102 H 5.3764 9.2140 120.8857 54.3584 31.1067 173.3284 103 I 4.7575 8.4968 125.2825 59.9617 39.0719 174.9665 104 T 4.8150 8.1754 124.1831 61.7627 71.6644 174.3049 105 V 4.3971 8.4079 124.7185 61.4228 34.8676 173.5668 106 I 4.8102 9.0225 122.5769 59.1843 39.9672 174.7596 107 L 4.8502 8.8769 126.0120 53.1244 44.6597 175.6199 108 G 4.4485 8.2782 107.2963 44.1869 0.0000 171.8469 109 E 4.4487 8.3200 118.8800 56.3673 30.1926 177.6875 110 K 3.9986 8.0368 124.9401 58.3131 32.3832 176.0262 111 H 4.4122 7.8057 110.8613 56.0338 30.3060 174.3066 112 G 3.6322 8.4238 107.5460 46.1165 0.0000 172.7893 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 8.15 4.56 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.54 0.00 2 E 8.59 4.69 0.00 2.04 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 2.19 2.35 0.00 3 A 9.24 4.23 1.16 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 4 K 8.55 4.48 0.00 1.63 1.77 0.00 1.86 0.00 0.00 1.75 0.00 0.00 2.73 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.44 7.81 5 A 7.22 4.53 1.21 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 0.00 0.00 0.00 6 I 8.48 5.03 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.65 0.90 0.00 0.00 7 A 8.67 4.58 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 8 R 8.56 4.46 0.00 1.67 2.12 0.00 3.29 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 1.63 0.00 9 Y 9.14 3.55 0.00 2.98 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 10 V 8.04 3.52 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 0.17 0.00 0.00 0.96 0.00 0.00 11 R 8.49 4.74 0.00 1.82 1.80 0.00 3.47 0.00 0.00 3.12 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 12 I 7.56 4.11 1.72 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.94 0.61 0.00 0.00 13 S 8.29 4.32 0.00 3.88 3.70 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 14 P 0.00 4.25 0.00 2.18 2.04 0.00 3.66 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 2.26 2.27 0.00 15 R 7.99 3.91 0.00 1.77 2.05 0.00 3.21 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.77 0.00 16 K 7.96 4.13 0.00 2.07 1.89 0.00 1.67 0.00 0.00 1.84 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.54 7.81 17 V 7.63 3.87 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 0.84 0.00 0.00 0.97 0.00 0.00 18 R 8.39 3.95 0.00 2.08 1.97 0.00 3.12 0.00 0.00 3.20 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.73 0.00 19 L 7.33 4.01 0.00 2.00 1.74 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.13 3.77 2.25 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 1.03 0.00 0.00 0.97 0.00 0.00 21 V 7.81 3.61 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 0.88 0.00 0.00 1.00 0.00 0.00 22 D 7.87 4.53 0.00 2.78 2.73 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 23 L 7.76 4.39 0.00 1.77 1.77 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.93 4.33 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 1.40 0.82 0.93 0.00 0.00 25 R 8.12 3.78 0.00 1.82 1.93 0.00 3.43 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 26 G 8.80 4.46 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 27 K 7.43 4.69 0.00 2.05 1.64 0.00 1.65 0.00 0.00 1.94 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.68 7.81 28 S 8.54 4.52 0.00 3.94 3.74 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 29 L 8.05 3.94 0.00 1.80 1.67 0.92 0.81 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 30 E 8.16 3.93 0.00 2.07 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 2.36 2.36 0.00 31 E 8.02 3.86 0.00 2.03 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 0.00 2.31 2.32 0.00 32 A 8.16 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.16 3.84 0.00 2.03 2.03 0.00 3.22 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 34 N 7.80 4.21 0.00 2.87 2.79 0.00 0.00 7.09 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 35 I 8.46 3.62 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.09 0.94 0.00 0.00 36 L 8.41 3.95 0.00 1.80 1.76 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.72 4.02 0.00 2.06 2.32 0.00 3.31 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.84 0.00 38 Y 8.50 4.46 0.00 3.00 2.98 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 39 T 7.66 4.23 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 1.24 0.00 0.00 40 N 8.40 4.70 0.00 2.69 2.73 0.00 0.00 6.91 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 41 K 7.79 4.54 0.00 1.81 1.67 0.00 1.79 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.38 7.81 42 R 9.01 3.98 0.00 1.90 2.02 0.00 3.22 0.00 0.00 3.43 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.74 0.00 43 G 8.27 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 44 A 8.07 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.48 3.82 0.00 2.84 2.39 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 46 F 7.67 4.29 0.00 3.21 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 47 V 8.10 3.63 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 1.04 0.00 0.00 1.06 0.00 0.00 48 A 8.59 3.89 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 49 K 7.81 3.67 0.00 1.62 1.89 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.40 1.35 7.81 50 V 7.93 3.54 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 0.89 0.00 0.00 51 L 8.22 3.81 0.00 1.74 1.96 0.90 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.59 3.98 0.00 2.24 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 2.27 2.33 0.00 53 S 8.43 4.05 0.00 3.92 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 54 A 8.19 3.90 1.34 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 55 A 7.65 3.88 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 56 A 8.18 3.89 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 57 N 8.35 4.20 0.00 2.96 2.96 0.00 0.00 7.04 7.09 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 58 A 8.63 4.03 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 59 V 7.83 3.82 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 1.03 0.00 0.00 0.99 0.00 0.00 60 N 8.02 4.89 0.00 2.69 2.81 0.00 0.00 6.89 8.86 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 61 N 7.87 4.97 0.00 2.76 2.42 0.00 0.00 6.67 7.97 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 62 H 8.26 4.63 0.00 3.19 3.22 0.00 5.90 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 7.56 4.41 0.00 2.87 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 64 M 7.79 4.76 0.00 2.27 2.05 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.65 0.00 65 L 8.02 4.35 0.00 1.86 1.61 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 66 E 9.01 3.86 0.00 1.92 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 0.00 2.31 2.37 0.00 67 D 8.02 4.75 0.00 2.72 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 68 R 8.50 4.75 0.00 1.86 2.12 0.00 2.82 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.78 0.00 69 L 8.38 5.30 0.00 1.79 1.94 0.98 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 70 Y 8.11 5.02 0.00 3.28 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 71 V 8.70 4.04 2.28 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 0.87 0.00 0.00 0.99 0.00 0.00 72 K 7.96 3.85 0.00 1.30 1.71 0.00 1.88 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.49 7.81 73 A 7.35 4.44 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 74 A 8.22 4.67 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 75 Y 7.39 5.07 0.00 2.95 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 76 V 8.39 4.84 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 0.78 0.00 0.00 0.96 0.00 0.00 77 D 9.02 4.98 0.00 2.75 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 78 E 8.64 4.51 0.00 1.95 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 2.20 2.40 0.00 79 G 8.08 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 80 P 0.00 4.27 0.00 2.06 1.97 0.00 3.44 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 81 A 8.17 4.20 1.21 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 0.00 0.00 0.00 82 L 8.43 4.53 0.00 1.70 1.64 0.90 0.66 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 83 K 8.43 4.77 0.00 1.67 1.71 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.45 7.81 84 R 9.20 4.77 0.00 1.62 1.75 0.00 3.27 0.00 0.00 3.16 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.71 0.00 85 V 8.31 4.24 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 0.64 0.00 0.00 0.93 0.00 0.00 86 L 8.62 4.55 0.00 1.58 1.65 0.92 0.85 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 87 P 0.00 4.34 0.00 1.97 2.00 0.00 3.67 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 2.03 2.11 0.00 88 R 8.45 4.76 0.00 1.81 1.78 0.00 3.33 0.00 0.00 3.41 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 89 A 8.81 4.01 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 90 R 9.87 3.54 0.00 1.90 1.98 0.00 3.18 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 91 G 8.03 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 92 R 7.72 4.25 0.00 1.78 1.87 0.00 3.13 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 93 A 8.11 4.39 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 94 D 8.80 4.67 0.00 2.65 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 95 I 8.09 4.70 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 1.22 0.63 0.90 0.00 0.00 96 I 9.04 3.97 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 1.22 1.18 0.93 0.00 0.00 97 K 8.64 4.47 0.00 1.66 1.73 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.45 7.81 98 K 9.14 4.30 0.00 1.81 1.74 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.40 7.81 99 R 8.30 4.66 0.00 1.73 1.93 0.00 3.10 0.00 0.00 3.53 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 100 T 7.85 5.09 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 1.13 0.00 0.00 101 S 8.83 4.99 0.00 3.68 3.62 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 0.00 102 H 9.21 5.38 0.00 3.08 3.22 0.00 5.60 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 0.00 103 I 8.50 4.76 1.85 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.68 0.88 0.00 0.00 104 T 8.18 4.82 2.69 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 1.00 0.00 0.00 105 V 8.41 4.40 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 0.92 0.00 0.00 0.86 0.00 0.00 106 I 9.02 4.81 1.83 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.71 0.91 0.00 0.00 107 L 8.88 4.85 0.00 1.54 1.50 0.82 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 108 G 8.28 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 0.00 109 E 8.32 4.45 0.00 1.95 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 2.37 2.44 0.00 110 K 8.04 4.00 0.00 1.96 1.95 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.59 1.59 7.81 111 H 7.81 4.41 0.00 3.25 3.17 0.00 5.59 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 0.00 112 G 8.42 3.63 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 0.00 0.00 0.00