NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 K 4.2121 8.3101 120.1341 56.2945 32.3079 175.2601 14 A 4.0080 8.2662 128.1637 53.1057 19.0584 175.2927 15 K 4.7098 7.3072 114.6286 54.1197 36.6861 175.1848 16 T 4.1827 8.1881 111.7557 61.2214 69.6498 175.5386 17 R 3.9566 8.6837 122.2156 60.6015 30.1866 178.4201 18 S 4.1144 8.3639 114.5386 60.7195 62.6464 176.0461 19 S 4.1333 8.0506 117.6145 62.2011 62.5480 177.3934 20 R 3.8845 7.5296 119.8465 59.0769 29.9832 178.3611 21 A 4.2559 8.2451 118.4021 52.1227 18.7764 177.3305 22 G 3.7929 7.9829 105.1308 46.7986 0.0000 173.6698 23 L 4.9152 7.8676 117.5457 52.7449 44.3701 176.9601 24 Q 4.3317 9.7660 120.8270 57.6269 29.4317 177.0027 25 F 4.2005 8.4705 116.1187 56.0794 39.3713 173.2408 26 P 4.4237 0.0000 0.0000 62.5113 31.7909 177.4505 27 V 3.8495 8.4616 124.3318 65.5557 31.4809 178.2754 28 G 3.6153 8.0134 105.3387 47.7171 0.0000 175.5849 29 R 3.9596 7.9476 120.7272 59.1416 30.0423 178.6447 30 V 3.7133 7.6183 117.2648 66.0455 31.6065 177.5998 31 H 4.0975 8.2560 117.9845 59.1324 29.7315 177.3098 32 R 3.9642 8.0260 120.4707 59.5064 29.6548 178.4215 33 L 4.2301 8.4934 118.5937 57.0458 41.3658 179.2910 34 L 4.4558 7.5331 118.9560 57.4302 41.8260 179.2173 35 R 4.1321 7.9686 117.8502 59.2354 29.9685 179.3081 36 K 4.0256 8.0108 116.2504 59.2195 32.7365 178.0016 37 G 3.4629 7.5522 107.4558 45.3989 0.0000 172.8156 38 N 4.0669 7.3811 116.2849 54.5984 36.1802 173.9949 39 Y 4.4057 7.8680 115.9601 59.4790 39.5543 176.3390 40 A 4.7474 7.5777 118.7290 50.1548 22.5691 175.2939 41 E 4.1168 8.9612 120.2114 58.7479 29.7673 177.6037 42 R 4.6511 7.6893 114.7182 54.2475 33.6607 175.2783 43 V 4.1947 8.0823 120.5006 60.2672 32.0116 174.7203 44 G 3.9730 8.4230 114.8597 45.1700 0.0000 172.3060 45 A 4.3295 8.5879 123.8450 53.4987 19.2776 179.6118 46 G 3.8025 8.0815 102.6765 47.1039 0.0000 175.8025 47 A 4.0550 7.6913 122.1953 54.5119 18.4170 177.8198 48 P 4.3713 0.0000 0.0000 65.2018 31.5420 178.8837 49 V 3.6101 7.7756 118.7481 66.0202 31.4963 177.2401 50 Y 3.8388 7.9918 118.8046 60.6035 38.7174 177.3343 51 L 3.9649 8.1004 120.8742 58.0804 42.1758 178.4098 52 A 4.0368 8.0281 120.4627 55.4801 18.2439 179.4036 53 A 3.8244 7.7703 118.3890 55.3599 18.4407 180.0441 54 V 3.5284 7.7030 116.6418 66.1627 31.5722 178.3253 55 L 3.9211 8.2499 119.1530 57.3087 41.2709 179.1901 56 E 2.7816 7.7410 119.6504 58.9686 29.5775 178.0682 57 Y 4.0912 8.0705 119.9193 60.7820 38.8554 178.2434 58 L 3.5366 7.7957 119.7412 57.8297 41.7135 179.3917 59 T 3.7947 7.7900 115.5394 66.7673 68.4962 176.4850 60 A 3.9791 8.0616 122.7312 54.8242 18.3108 179.3918 61 E 3.7027 7.9206 117.9054 59.5175 29.7199 179.1643 62 I 3.6878 7.4841 119.7456 64.3750 37.1717 178.4998 63 L 4.0807 7.9358 119.7058 57.1890 41.3623 179.2286 64 E 3.8449 7.8421 119.2288 59.4592 29.7272 178.8809 65 L 4.0769 7.7863 118.1224 57.1846 41.6873 179.2686 66 A 4.1620 8.1185 121.3192 54.6366 18.6175 179.5727 67 G 3.6790 7.9916 104.3042 48.3050 0.0000 175.6110 68 N 4.3465 8.2752 118.6266 55.8660 38.4163 177.4196 69 A 3.9734 7.9043 121.9915 55.1500 18.3978 179.6005 70 A 3.4316 8.4560 119.6020 54.9634 18.4793 179.9021 71 R 3.8139 7.7531 117.0622 59.5720 29.9588 178.3395 72 D 4.4106 8.4165 118.1887 57.3069 40.9077 177.8216 73 N 4.5624 7.5563 114.3292 53.0483 38.8974 175.0986 74 K 3.9549 7.8629 118.4741 57.4884 29.6881 176.0909 75 K 4.6532 8.2460 117.2391 54.9574 35.1626 176.8181 76 T 4.2562 8.5351 111.9459 61.6644 69.7661 174.3288 77 R 4.5050 7.6617 122.5911 53.9954 31.7793 175.0531 78 I 3.8899 8.5300 127.0087 61.6078 37.6931 175.4591 79 I 4.5097 8.0639 117.8157 57.9552 40.4827 174.4745 80 P 4.2282 0.0000 0.0000 65.5294 30.8522 178.5366 81 R 3.8258 7.9884 117.1146 60.1957 29.8696 178.0230 82 H 4.2946 7.8252 114.9319 58.8118 28.5217 177.9221 83 L 3.9953 7.8737 121.0118 57.6278 41.3350 178.9289 84 Q 3.9951 8.0681 118.9781 59.3828 29.0026 178.0360 85 L 3.9604 7.8922 119.5233 58.0036 41.4905 179.7039 86 A 3.9242 7.8776 119.0682 55.1167 18.7953 179.6569 87 V 3.6491 8.4453 117.1767 66.4058 31.4958 178.5477 88 R 4.0424 8.6590 117.5448 59.3077 29.9993 177.9169 89 N 4.5128 8.0908 113.1702 54.3311 39.0214 174.2914 90 D 4.8769 7.5019 117.9851 51.8719 42.8899 176.3694 91 E 3.9505 8.9126 127.1150 59.5752 30.2836 178.7363 92 E 4.0566 8.5068 117.6341 59.3279 29.8356 178.8374 93 L 3.9716 8.6972 119.3310 57.6511 41.4168 178.8742 94 N 4.2246 7.7030 115.8115 56.8910 38.9159 176.4943 95 K 4.0853 7.5461 119.1569 59.1608 32.3020 178.3676 96 L 4.1135 7.6498 119.7969 57.8666 42.1610 179.3105 97 L 4.5731 8.4033 119.0175 55.1198 42.5470 179.5520 98 G 3.6948 8.2014 109.8372 47.8524 0.0000 175.2000 99 R 4.6146 7.9010 117.7230 55.7078 31.0581 175.0248 100 V 4.3706 7.3625 116.6648 61.2565 33.3522 174.8092 101 T 4.5094 8.3694 122.9738 61.7793 70.3275 173.7331 102 I 4.1865 8.2115 127.1409 59.4907 37.9613 175.5451 103 A 4.0986 8.4737 129.0555 53.1917 18.9130 176.6064 104 Q 3.5222 8.6223 119.1849 57.3101 26.2235 174.8497 105 G 3.8310 8.2421 106.0543 44.4200 0.0000 175.8266 106 G 3.8540 8.0003 107.8154 44.9331 0.0000 172.2145 107 V 4.5554 7.8826 111.1588 58.9189 35.5972 175.1000 108 L 4.0679 8.2226 120.7831 53.9722 41.8505 175.6999 109 P 4.2687 0.0000 0.0000 63.2082 30.4141 175.4908 110 N 4.7990 8.3612 121.6996 52.2859 41.3679 173.5542 111 I 4.5563 8.0907 126.2612 59.1356 40.1024 175.6567 112 Q 4.1988 8.4307 123.6276 55.7091 29.5646 177.7055 113 S 4.1726 8.7276 116.7470 61.2536 63.3650 176.8419 114 V 3.6923 7.7801 119.3502 64.0385 31.0327 176.8296 115 L 4.2260 7.5788 118.9543 55.8268 41.8813 177.2363 116 L 4.2838 7.8857 118.7882 53.7513 42.3453 174.4333 117 P 3.9540 0.0000 0.0000 62.2541 32.7706 175.5796 118 K 3.7193 9.4837 119.4424 57.6689 30.0207 172.6787 119 K 4.0595 7.6670 123.8186 57.1956 32.3729 175.8090 120 T 4.7312 7.4944 113.8882 63.3142 70.6854 174.0617 121 E 4.2780 7.8187 126.7113 56.5457 29.7856 175.9877 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 13 K 8.31 4.21 0.00 1.76 1.86 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.45 7.81 14 A 8.27 4.01 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 15 K 7.31 4.71 0.00 1.70 1.68 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.33 7.81 16 T 8.19 4.18 4.25 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 1.21 0.00 0.00 17 R 8.68 3.96 0.00 1.82 2.09 0.00 3.24 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 18 S 8.36 4.11 0.00 3.88 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 19 S 8.05 4.13 0.00 3.95 4.18 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 20 R 7.53 3.88 0.00 2.07 2.05 0.00 3.29 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 1.67 1.66 0.00 21 A 8.25 4.26 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 22 G 7.98 3.79 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 0.00 0.00 0.00 23 L 7.87 4.92 0.00 1.66 1.76 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 9.77 4.33 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.53 0.00 25 F 8.47 4.20 0.00 2.94 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 26 P 0.00 4.42 0.00 2.21 2.16 0.00 3.62 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.84 0.00 27 V 8.46 3.85 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 1.05 0.00 0.00 1.06 0.00 0.00 28 G 8.01 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 0.00 0.00 0.00 29 R 7.95 3.96 0.00 1.89 1.95 0.00 3.16 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 30 V 7.62 3.71 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 1.01 0.00 0.00 1.11 0.00 0.00 31 H 8.26 4.10 0.00 3.44 3.29 0.00 5.64 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.03 3.96 0.00 2.10 2.08 0.00 3.16 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 33 L 8.49 4.23 0.00 1.87 1.78 0.96 0.59 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 34 L 7.53 4.46 0.00 1.82 1.74 0.90 0.67 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 35 R 7.97 4.13 0.00 2.09 2.01 0.00 3.19 0.00 0.00 3.27 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.84 0.00 36 K 8.01 4.03 0.00 1.89 1.97 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.41 7.81 37 G 7.55 3.46 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 38 N 7.38 4.07 0.00 2.61 2.76 0.00 0.00 6.88 7.35 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 39 Y 7.87 4.41 0.00 2.96 2.96 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 40 A 7.58 4.75 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 41 E 8.96 4.12 0.00 1.95 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 2.30 2.35 0.00 42 R 7.69 4.65 0.00 1.79 1.77 0.00 3.21 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 43 V 8.08 4.19 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 0.71 0.00 0.00 0.95 0.00 0.00 44 G 8.42 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 45 A 8.59 4.33 1.33 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 0.00 0.00 0.00 46 G 8.08 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 47 A 7.69 4.06 1.30 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 0.00 0.00 0.00 0.00 0.00 48 P 0.00 4.37 0.00 2.34 2.32 0.00 3.67 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 2.15 2.14 0.00 49 V 7.78 3.61 2.33 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 1.01 0.00 0.00 0.98 0.00 0.00 50 Y 7.99 3.84 0.00 3.11 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 51 L 8.10 3.96 0.00 1.99 1.68 0.93 1.22 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 52 A 8.03 4.04 1.45 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 53 A 7.77 3.82 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 54 V 7.70 3.53 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 1.06 0.00 0.00 0.93 0.00 0.00 55 L 8.25 3.92 0.00 1.68 1.59 1.01 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 56 E 7.74 2.78 0.00 1.73 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 2.21 2.20 0.00 57 Y 8.07 4.09 0.00 2.96 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 58 L 7.80 3.54 0.00 1.69 1.57 0.97 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.79 3.79 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 1.38 0.00 0.00 60 A 8.06 3.98 1.33 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 0.00 0.00 0.00 61 E 7.92 3.70 0.00 1.55 1.71 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 2.11 2.26 0.00 62 I 7.48 3.69 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.51 0.89 0.00 0.00 63 L 7.94 4.08 0.00 1.76 1.71 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.84 3.84 0.00 2.16 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 2.29 2.37 0.00 65 L 7.79 4.08 0.00 1.70 1.68 0.89 1.35 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 66 A 8.12 4.16 1.45 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 67 G 7.99 3.68 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 0.00 0.00 0.00 68 N 8.28 4.35 0.00 2.91 2.86 0.00 0.00 6.94 6.51 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 69 A 7.90 3.97 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 70 A 8.46 3.43 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 71 R 7.75 3.81 0.00 2.07 2.03 0.00 3.10 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 1.61 1.65 0.00 72 D 8.42 4.41 0.00 2.79 2.72 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 0.00 0.00 0.00 0.00 73 N 7.56 4.56 0.00 2.79 2.89 0.00 0.00 7.14 7.48 0.00 0.00 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 K 7.86 3.95 0.00 1.98 1.98 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.34 1.54 7.81 75 K 8.25 4.65 0.00 1.80 1.70 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.38 1.37 7.81 76 T 8.54 4.26 4.24 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 1.21 0.00 0.00 77 R 7.66 4.50 0.00 1.76 1.85 0.00 3.25 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 78 I 8.53 3.89 1.90 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 1.49 0.66 0.95 0.00 0.00 79 I 8.06 4.51 1.81 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.48 0.89 0.00 0.00 80 P 0.00 4.23 0.00 2.36 2.24 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 81 R 7.99 3.83 0.00 1.85 1.78 0.00 3.30 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 82 H 7.83 4.29 0.00 3.36 3.32 0.00 5.69 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 83 L 7.87 4.00 0.00 1.85 1.71 0.93 0.85 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 84 Q 8.07 4.00 0.00 2.15 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.69 2.52 0.00 85 L 7.89 3.96 0.00 1.93 1.74 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.88 3.92 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.45 3.65 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 1.02 0.00 0.00 0.95 0.00 0.00 88 R 8.66 4.04 0.00 1.82 1.98 0.00 3.37 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.75 0.00 89 N 8.09 4.51 0.00 3.05 2.86 0.00 0.00 6.87 8.19 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 90 D 7.50 4.88 0.00 2.79 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 91 E 8.91 3.95 0.00 2.04 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 2.38 2.35 0.00 92 E 8.51 4.06 0.00 2.18 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 2.40 2.40 0.00 93 L 8.70 3.97 0.00 1.81 1.70 0.90 0.53 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 94 N 7.70 4.22 0.00 2.85 3.11 0.00 0.00 7.21 8.01 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 95 K 7.55 4.09 0.00 1.90 1.94 0.00 1.86 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.45 7.81 96 L 7.65 4.11 0.00 1.70 1.86 0.93 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.40 4.57 0.00 1.69 1.65 0.91 0.91 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 98 G 8.20 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 0.00 0.00 0.00 99 R 7.90 4.61 0.00 1.77 1.90 0.00 3.34 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 100 V 7.36 4.37 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 0.79 0.00 0.00 0.94 0.00 0.00 101 T 8.37 4.51 4.24 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 1.21 0.00 0.00 102 I 8.21 4.19 2.02 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 1.35 0.52 0.91 0.00 0.00 103 A 8.47 4.10 1.23 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 0.00 0.00 104 Q 8.62 3.52 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 105 G 8.24 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 0.00 0.00 0.00 106 G 8.00 3.85 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 0.00 0.00 0.00 107 V 7.88 4.56 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 0.93 0.00 0.00 108 L 8.22 4.07 0.00 1.63 1.60 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.27 0.00 2.04 2.05 0.00 3.67 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 2.03 2.07 0.00 110 N 8.36 4.80 0.00 2.62 2.65 0.00 0.00 7.05 7.94 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 0.00 111 I 8.09 4.56 1.87 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 1.41 0.78 0.91 0.00 0.00 112 Q 8.43 4.20 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.29 0.00 113 S 8.73 4.17 0.00 4.00 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 0.00 114 V 7.78 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 0.74 0.00 0.00 0.93 0.00 0.00 115 L 7.58 4.23 0.00 1.78 1.76 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.89 4.28 0.00 1.63 1.59 0.97 1.00 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 0.00 117 P 0.00 3.95 0.00 2.11 1.95 0.00 4.00 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 2.11 2.01 0.00 118 K 9.48 3.72 0.00 1.98 1.89 0.00 1.62 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.40 7.81 119 K 7.67 4.06 0.00 1.93 1.91 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.28 1.44 7.81 120 T 7.49 4.73 4.24 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 1.21 0.00 0.00 121 E 7.82 4.28 0.00 2.25 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 2.32 2.35 0.00