NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 4.2023 8.1014 119.7204 55.4145 30.5590 174.9243 -1 G 4.1070 8.7159 116.5790 45.3959 0.0000 172.7150 0 S 4.2060 8.7717 115.5880 61.7657 63.7072 175.1172 1 M 4.0527 8.1702 120.1087 58.5722 32.0277 177.9662 2 A 4.1889 7.6739 121.8111 54.7026 18.6916 179.2144 3 L 3.6748 7.7293 117.7411 58.4054 42.2395 179.4468 4 K 4.0474 8.1666 118.3513 59.3092 31.9356 179.4277 5 R 3.9025 7.9586 119.1895 59.1577 30.0148 178.4762 6 I 3.2301 7.9859 120.0984 64.6892 37.2014 177.9693 7 H 4.3418 8.1654 118.8164 59.0513 29.6110 177.2054 8 K 4.0017 7.9603 121.4750 59.3325 32.0121 178.7486 9 E 4.0442 8.3107 119.1445 59.3288 29.3884 179.0659 10 L 4.3376 8.3675 120.7345 58.0406 42.1683 178.7582 11 N 4.4144 8.2310 116.9490 56.0913 37.1191 177.1314 12 D 4.4031 7.8559 119.9810 56.8766 40.8893 178.1606 13 L 4.1493 8.2178 120.8675 57.9859 41.8683 178.8745 14 A 4.1479 7.8992 120.1501 54.8461 18.5176 179.0600 15 R 4.2312 7.9275 113.8022 56.9932 31.3302 176.4695 16 D 4.6579 7.7830 117.1714 53.7733 41.4148 174.0663 17 P 4.1978 0.0000 0.0000 61.5019 31.0802 175.0097 18 P 4.2301 0.0000 0.0000 61.9751 31.8156 176.2746 19 A 3.8815 8.6372 124.2912 53.3605 18.6867 177.9233 20 Q 3.3338 8.7466 124.4576 57.4871 26.5927 174.1199 21 C 4.9592 7.7161 112.5672 58.2731 32.4770 174.9108 22 S 4.9241 8.7967 117.8228 56.7222 65.5570 172.5393 23 A 4.8678 7.8221 121.8488 51.3158 21.7867 175.7857 24 G 3.0058 8.2319 108.8850 44.2900 0.0000 170.8564 25 P 4.4564 0.0000 0.0000 62.8150 31.9446 177.2070 26 V 3.7251 8.3919 123.8661 61.8172 30.0722 176.4156 27 G 4.0318 8.7450 116.4066 44.6815 0.0000 171.9308 28 D 4.7088 8.5834 123.8523 53.7953 41.8192 175.1020 29 D 4.8077 7.8325 120.6194 52.7598 41.5141 176.5658 30 M 4.3778 8.8476 126.8386 57.7303 32.6860 176.3970 31 F 4.5798 8.7925 116.1730 58.0039 39.5817 174.1332 32 H 5.4161 8.6861 121.5900 54.4926 32.2647 172.3517 33 W 5.4220 9.6654 125.5965 54.9610 33.3588 174.4067 34 Q 5.0525 9.2883 121.3328 54.5584 32.3713 173.5782 35 A 5.4277 9.1408 126.3939 50.4186 23.1215 174.7958 36 T 4.7665 8.7604 110.6541 59.7903 71.7271 172.8752 37 I 4.7517 9.1524 127.5975 59.6053 40.3357 174.3463 38 M 4.8629 8.2478 126.1716 53.8133 33.0037 176.5500 39 G 4.2162 9.3188 111.3871 46.2742 0.0000 171.6471 40 P 4.5634 0.0000 0.0000 62.6648 32.1385 177.0269 41 N 4.4106 9.0164 119.1197 56.1046 38.5969 175.8220 42 D 5.0583 8.0054 116.7809 54.0544 42.0168 175.6942 43 S 4.9224 7.6508 112.8755 55.5943 65.9128 172.9529 44 P 4.4008 0.0000 0.0000 64.5109 31.1784 176.8804 45 Y 5.1002 7.8369 116.1930 57.1466 38.4730 175.4112 46 Q 4.5633 7.9477 119.6694 58.0096 28.7664 176.8166 47 G 4.0321 9.3272 110.7330 44.8706 0.0000 173.5351 48 G 3.8528 8.1393 106.7905 45.1033 0.0000 173.0429 49 V 4.5453 8.0078 121.8397 60.6581 33.6236 174.7181 50 F 4.8873 9.3482 127.9540 55.7688 41.4814 174.5742 51 F 5.2198 9.3209 123.0874 56.1403 41.0752 175.0566 52 L 5.1960 9.2034 121.8214 53.2827 46.3383 175.3616 53 T 5.0409 8.7383 117.4279 61.9586 71.6076 173.5443 54 I 4.8530 8.8081 125.6334 59.7889 41.2919 174.2820 55 H 5.3654 8.7060 122.8029 54.0145 32.1688 172.7150 56 F 4.4182 8.7777 123.6399 55.9480 39.6060 174.5540 57 P 4.5103 0.0000 0.0000 62.6978 31.8598 177.1876 58 T 4.1935 8.5599 113.8168 64.3794 67.5625 174.2870 59 D 5.1474 8.0946 119.5164 54.5077 41.6993 174.7396 60 Y 4.4563 8.2224 121.3714 57.9695 39.3226 174.9078 61 P 3.4079 0.0000 0.0000 62.5117 31.4386 177.3491 62 F 4.6471 7.3221 117.4816 59.0463 39.2042 175.6812 63 K 4.8821 7.8787 119.2642 53.5695 35.6586 174.2686 64 P 2.9700 0.0000 0.0000 61.0633 31.9534 174.1624 65 P 4.2393 0.0000 0.0000 62.3127 32.8957 175.5791 66 K 4.2623 8.5774 121.0081 55.1526 33.3293 175.7467 67 V 4.8524 8.1160 124.8890 61.0400 33.8828 174.4949 68 A 4.9300 8.4364 127.2737 50.6557 23.1136 175.2770 69 F 4.5636 9.4964 120.0816 57.8991 39.7849 176.5246 70 T 4.5064 9.3809 118.9784 64.0788 70.1414 174.7661 71 T 4.7652 8.0665 117.9469 61.7709 70.0545 175.2708 72 R 4.1609 8.6860 125.0626 56.4875 30.8131 175.9409 73 I 4.8210 8.0519 119.9639 59.9475 40.9355 173.7498 74 Y 3.9722 8.7922 128.2942 56.9038 38.1577 173.9670 75 H 4.6851 7.8063 124.5627 54.7943 32.9134 171.9032 76 P 4.2023 0.0000 0.0000 65.1630 31.3101 177.2002 77 N 4.9506 8.1138 114.5337 52.3673 38.9047 174.6337 78 I 5.0257 7.5281 119.0208 59.7424 40.2983 174.7810 79 N 4.7364 8.3860 124.9515 51.7193 39.4142 175.4998 80 S 4.2740 8.5133 111.4222 61.1719 63.2835 174.4815 81 N 4.4929 8.6702 117.6013 53.3374 38.6578 176.0213 82 G 4.1977 8.1747 106.9017 46.3557 0.0000 173.7110 83 S 4.4595 8.0191 116.5148 58.5566 63.8065 173.7623 84 I 4.6304 7.8791 126.7657 59.9665 38.7182 174.0858 84 L 4.8004 8.0391 128.6657 53.9665 42.3182 175.2858 87 D 4.5782 8.8866 126.5149 56.8070 39.0030 178.7692 88 I 4.0818 7.6753 113.5876 62.2520 37.6823 176.8728 89 L 4.4065 7.7191 118.9467 53.4094 41.9632 176.1314 90 R 4.7796 7.9577 118.1408 56.9681 33.6122 177.3399 91 S 4.1725 9.5277 120.7405 62.0973 63.4633 174.5167 92 Q 4.4663 8.4674 120.8725 55.6726 28.8032 174.3793 93 W 4.8138 7.7452 126.5689 56.3484 31.5858 175.4509 94 S 4.2338 6.7519 118.4887 55.4578 64.7823 172.7781 95 P 4.2722 0.0000 0.0000 63.8464 31.1600 176.9716 96 A 4.1148 7.4345 120.1087 52.4051 18.7613 177.2570 97 L 4.4916 6.8633 116.3409 53.5514 43.4223 176.1894 98 T 5.0613 7.9143 110.1949 59.3559 73.2914 174.7548 99 I 3.7457 9.2596 120.9917 64.0776 37.9502 177.8522 100 S 4.1580 8.1359 113.8880 61.3120 62.2223 176.1371 101 K 4.0629 7.9042 121.3350 59.3184 31.7712 179.5380 102 V 3.6442 7.9976 118.6607 65.9183 31.4481 178.0662 103 L 3.9751 8.2619 118.9957 57.8389 41.4892 179.3797 104 L 4.0210 7.8018 118.3929 58.1725 41.4614 179.8988 105 S 4.1710 8.4383 115.1134 61.4958 62.6592 176.9329 106 I 3.7985 7.7642 122.6699 64.3224 37.0156 177.8429 107 C 4.0160 8.4740 118.0511 63.2490 27.9272 176.5250 108 S 4.1615 8.2376 116.4201 61.5149 62.1711 176.4181 109 L 3.7181 7.3937 122.0186 58.2272 41.8082 178.8092 110 L 3.9989 7.5686 118.0811 57.9157 41.5918 178.9084 111 C 4.6914 7.7823 115.3283 61.2069 28.9684 173.3499 112 D 4.6156 8.7986 120.5794 51.1170 41.2329 172.7621 113 P 4.4551 0.0000 0.0000 62.4296 32.3887 176.9958 114 N 4.7913 8.7625 118.1747 50.6070 37.8648 172.9850 115 P 4.2747 0.0000 0.0000 64.3567 31.8649 178.1839 116 D 4.5067 7.9722 117.7576 55.0262 40.1658 176.3129 117 D 4.8924 7.6505 120.1050 51.7675 40.4131 173.2975 118 P 4.5553 0.0000 0.0000 62.1692 32.7587 177.0350 119 L 4.2612 8.8520 122.8063 55.6282 43.0680 176.9084 120 V 4.2065 7.1501 116.6243 59.2827 32.9143 173.4282 121 P 4.1579 0.0000 0.0000 65.7582 31.3898 177.7341 122 E 3.9544 8.1544 117.1090 59.4137 29.5920 178.7730 123 I 3.7246 7.6620 119.2444 64.0858 37.1418 178.0762 124 A 3.9583 7.9510 121.8411 54.9727 18.1195 179.5893 125 R 3.7942 8.1532 117.2895 59.6522 30.1784 178.4829 126 I 3.7453 7.9174 119.5279 64.7418 36.9974 177.4596 127 Y 4.0421 7.9193 118.5926 60.9265 38.6136 178.3073 128 K 4.0151 8.0521 117.9376 59.0016 32.2934 178.6814 129 T 4.4205 8.0878 107.9021 61.7858 71.1616 175.0024 130 D 4.7434 8.6264 121.7640 52.0902 42.5881 175.6095 131 R 3.9791 7.8586 122.0707 58.8079 30.5669 178.3656 132 E 4.0442 8.1815 117.4047 59.1749 29.7044 179.2082 133 K 3.9514 8.3928 119.5209 59.2020 32.0882 178.3215 134 Y 4.1214 8.0432 119.9232 61.2456 38.6434 178.3481 135 N 4.4796 8.4863 116.9235 56.2302 38.5250 177.7949 136 R 3.8610 7.7217 119.1077 59.3530 30.1858 179.1818 137 I 3.6609 7.7568 119.6035 64.0725 36.7837 178.3590 138 A 3.8021 7.7420 122.0035 55.0161 17.8891 179.7229 139 R 4.4238 7.6798 117.7195 58.9814 30.4388 178.2421 140 E 4.1542 8.2472 118.5234 59.4728 29.5195 179.5442 141 W 4.3061 8.7098 118.6800 59.8642 28.9655 178.7259 142 T 4.2907 8.0637 115.7910 66.2161 67.5837 176.8226 143 Q 4.0022 7.8065 119.7060 58.8527 29.0589 178.2456 144 K 3.8542 7.7522 117.5067 58.4780 32.0755 177.3988 145 Y 4.7215 7.9434 114.6099 58.1394 40.3538 176.2573 146 A 4.5542 8.0616 120.6478 51.8179 19.4653 176.7122 147 M 4.3348 7.8430 122.3939 56.0743 32.8185 175.4937 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 R 8.10 4.20 0.00 1.77 1.65 0.00 2.88 0.00 0.00 3.13 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.10 0.00 -1 G 8.72 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0 S 8.77 4.21 0.00 3.93 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 1 M 8.17 4.05 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.72 0.00 2 A 7.67 4.19 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 0.00 0.00 3 L 7.73 3.67 0.00 2.04 1.94 0.89 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.17 4.05 0.00 1.84 1.85 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.87 1.62 7.81 5 R 7.96 3.90 0.00 1.88 1.99 0.00 2.78 0.00 0.00 2.73 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 6 I 7.99 3.23 1.57 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 0.44 0.24 0.00 0.00 7 H 8.17 4.34 0.00 3.30 3.27 0.00 5.60 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.96 4.00 0.00 1.99 2.03 0.00 1.74 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.53 7.81 9 E 8.31 4.04 0.00 2.23 2.04 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 2.38 2.63 0.00 10 L 8.37 4.34 0.00 2.26 2.03 0.70 0.25 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 11 N 8.23 4.41 0.00 3.00 3.21 0.00 0.00 6.94 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 12 D 7.86 4.40 0.00 2.85 2.80 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 13 L 8.22 4.15 0.00 2.05 1.93 1.22 0.93 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 14 A 7.90 4.15 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.93 4.23 0.00 1.90 2.00 0.00 3.15 0.00 0.00 3.16 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 16 D 7.78 4.66 0.00 2.62 2.65 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 17 P 0.00 4.20 0.00 2.10 2.02 0.00 3.75 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 2.04 2.34 0.00 18 P 0.00 4.23 0.00 2.21 2.02 0.00 3.72 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 19 A 8.64 3.88 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 20 Q 8.75 3.33 0.00 2.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.32 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 21 C 7.72 4.96 0.00 2.80 2.78 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 22 S 8.80 4.92 0.00 3.83 3.64 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 23 A 7.82 4.87 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 24 G 8.23 3.01 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 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.46 0.00 1.92 1.82 0.00 2.84 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 26 V 8.39 3.73 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 0.73 0.00 0.00 0.78 0.00 0.00 27 G 8.74 4.03 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 0.00 0.00 0.00 28 D 8.58 4.71 0.00 2.65 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 0.00 29 D 7.83 4.81 0.00 2.84 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.85 4.38 0.00 1.88 2.09 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 31 F 8.79 4.58 0.00 3.40 3.17 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 32 H 8.69 5.42 0.00 3.36 3.41 0.00 5.72 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.67 5.42 0.00 3.20 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 34 Q 9.29 5.05 0.00 2.04 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 35 A 9.14 5.43 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.76 4.77 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 1.31 0.00 0.00 37 I 9.15 4.75 1.92 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.89 0.97 0.00 0.00 38 M 8.25 4.86 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.83 0.00 39 G 9.32 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.56 0.00 2.33 2.09 0.00 3.89 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.21 0.00 41 N 9.02 4.41 0.00 2.73 2.94 0.00 0.00 6.78 8.06 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 42 D 8.01 5.06 0.00 2.66 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 43 S 7.65 4.92 0.00 4.12 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 0.00 44 P 0.00 4.40 0.00 1.91 2.27 0.00 3.63 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.91 0.00 45 Y 7.84 5.10 0.00 3.21 3.35 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 46 Q 7.95 4.56 0.00 2.27 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 47 G 9.33 4.03 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 0.00 0.00 0.00 48 G 8.14 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 49 V 8.01 4.55 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 0.25 0.00 0.00 0.80 0.00 0.00 50 F 9.35 4.89 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 51 F 9.32 5.22 0.00 3.02 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 52 L 9.20 5.20 0.00 1.36 1.46 0.65 -0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.74 5.04 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 1.23 0.00 0.00 54 I 8.81 4.85 1.86 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 1.07 0.70 0.09 0.00 0.00 55 H 8.71 5.37 0.00 2.93 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.78 4.42 0.00 2.80 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 0.00 57 P 0.00 4.51 0.00 2.34 2.21 0.00 3.76 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.25 0.00 58 T 8.56 4.19 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 1.25 0.00 0.00 59 D 8.09 5.15 0.00 2.89 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 60 Y 8.22 4.46 0.00 3.37 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 61 P 0.00 3.41 0.00 1.78 1.33 0.00 2.75 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.36 0.00 62 F 7.32 4.65 0.00 3.31 3.22 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 0.00 0.00 0.00 0.00 63 K 7.88 4.88 0.00 1.85 1.71 0.00 1.81 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.54 7.81 64 P 0.00 2.97 0.00 1.48 0.89 0.00 3.63 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 1.68 1.72 0.00 65 P 0.00 4.24 0.00 1.32 1.10 0.00 2.67 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 66 K 8.58 4.26 0.00 1.51 1.68 0.00 1.53 0.00 0.00 1.41 0.00 0.00 2.70 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.46 7.81 67 V 8.12 4.85 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 0.69 0.00 0.00 0.71 0.00 0.00 68 A 8.44 4.93 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 69 F 9.50 4.56 0.00 3.15 3.24 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 0.00 70 T 9.38 4.51 4.43 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 1.23 0.00 0.00 71 T 8.07 4.77 4.74 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 1.55 0.00 0.00 72 R 8.69 4.16 0.00 1.28 1.49 0.00 2.82 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.37 0.00 73 I 8.05 4.82 1.83 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.64 0.39 0.00 0.00 74 Y 8.79 3.97 0.00 2.05 2.60 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 75 H 7.81 4.69 0.00 2.93 2.81 0.00 5.61 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.20 0.00 2.03 2.09 0.00 3.20 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.38 0.00 77 N 8.11 4.95 0.00 2.64 2.78 0.00 0.00 6.68 7.45 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 78 I 7.53 5.03 1.49 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 -0.36 0.46 0.00 0.00 79 N 8.39 4.74 0.00 2.93 2.95 0.00 0.00 5.96 7.81 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 80 S 8.51 4.27 0.00 4.02 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 0.00 81 N 8.67 4.49 0.00 2.84 2.90 0.00 0.00 7.04 7.29 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 82 G 8.17 4.20 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 0.00 83 S 8.02 4.46 0.00 3.98 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 84 I 7.88 4.63 1.89 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.68 0.92 0.00 0.00 84 L 8.04 4.80 0.00 1.36 1.41 1.11 0.97 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 87 D 8.89 4.58 0.00 3.01 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 88 I 7.68 4.08 2.07 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 1.72 1.31 0.97 0.00 0.00 89 L 7.72 4.41 0.00 1.84 1.67 0.89 0.67 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 90 R 7.96 4.78 0.00 1.88 1.59 0.00 3.16 0.00 0.00 3.33 7.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 91 S 9.53 4.17 0.00 3.89 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 92 Q 8.47 4.47 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.01 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 93 W 7.75 4.81 0.00 3.55 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 94 S 6.75 4.23 0.00 3.57 3.22 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 0.00 0.00 0.00 0.00 95 P 0.00 4.27 0.00 1.88 1.77 0.00 3.55 0.00 0.00 5.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 96 A 7.43 4.11 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 97 L 6.86 4.49 0.00 0.95 1.57 0.70 0.61 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 98 T 7.91 5.06 4.48 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 0.00 0.00 0.00 1.24 0.00 0.00 99 I 9.26 3.75 1.87 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 1.40 1.39 1.03 0.00 0.00 100 S 8.14 4.16 0.00 4.01 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 0.00 101 K 7.90 4.06 0.00 2.04 1.88 0.00 1.80 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.48 7.81 102 V 8.00 3.64 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 1.01 0.00 0.00 1.18 0.00 0.00 103 L 8.26 3.98 0.00 1.88 1.72 0.90 0.85 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 0.00 104 L 7.80 4.02 0.00 1.90 1.75 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.44 4.17 0.00 4.07 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 0.00 106 I 7.76 3.80 2.00 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 1.55 0.73 1.00 0.00 0.00 107 C 8.47 4.02 0.00 3.22 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 0.00 108 S 8.24 4.16 0.00 4.05 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 0.00 109 L 7.39 3.72 0.00 1.69 1.87 0.88 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.57 4.00 0.00 1.88 1.64 -0.37 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.78 4.69 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 0.00 112 D 8.80 4.62 0.00 2.50 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 0.00 113 P 0.00 4.46 0.00 1.52 1.53 0.00 3.72 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.22 0.00 114 N 8.76 4.79 0.00 2.67 2.64 0.00 0.00 7.37 7.64 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 0.00 115 P 0.00 4.27 0.00 2.28 2.12 0.00 3.77 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.21 0.00 116 D 7.97 4.51 0.00 2.80 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 0.00 117 D 7.65 4.89 0.00 2.95 2.60 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 0.00 118 P 0.00 4.56 0.00 2.13 1.99 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 119 L 8.85 4.26 0.00 1.50 1.71 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.15 4.21 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 0.99 0.00 0.00 0.89 0.00 0.00 121 P 0.00 4.16 0.00 2.19 2.12 0.00 3.64 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 2.12 2.17 0.00 122 E 8.15 3.95 0.00 2.10 1.97 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 2.43 2.53 0.00 123 I 7.66 3.72 1.74 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.19 0.27 0.00 0.00 124 A 7.95 3.96 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 0.00 125 R 8.15 3.79 0.00 2.03 2.09 0.00 3.14 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 126 I 7.92 3.75 2.16 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.19 1.08 0.00 0.00 127 Y 7.92 4.04 0.00 2.73 3.08 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 0.00 0.00 0.00 0.00 128 K 8.05 4.02 0.00 2.04 1.85 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.57 7.81 129 T 8.09 4.42 4.23 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 1.21 0.00 0.00 130 D 8.63 4.74 0.00 2.61 2.56 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 0.00 0.00 0.00 0.00 131 R 7.86 3.98 0.00 1.71 1.78 0.00 2.48 0.00 0.00 3.03 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.40 0.00 132 E 8.18 4.04 0.00 2.19 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 0.00 2.56 2.40 0.00 133 K 8.39 3.95 0.00 2.07 1.90 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.73 7.81 134 Y 8.04 4.12 0.00 3.16 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 0.00 135 N 8.49 4.48 0.00 3.02 2.87 0.00 0.00 7.13 7.24 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 0.00 136 R 7.72 3.86 0.00 1.99 1.92 0.00 3.10 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 137 I 7.76 3.66 0.82 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.58 -0.22 0.00 0.00 138 A 7.74 3.80 0.94 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 0.00 139 R 7.68 4.42 0.00 1.92 2.11 0.00 3.11 0.00 0.00 3.08 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.52 0.00 140 E 8.25 4.15 0.00 2.38 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 0.00 2.34 2.52 0.00 141 W 8.71 4.31 0.00 3.57 3.75 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 0.00 142 T 8.06 4.29 4.57 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 1.39 0.00 0.00 143 Q 7.81 4.00 0.00 2.28 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.01 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 144 K 7.75 3.85 0.00 0.79 0.74 0.00 1.42 0.00 0.00 1.15 0.00 0.00 2.76 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.09 1.22 7.81 145 Y 7.94 4.72 0.00 3.20 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 0.00 146 A 8.06 4.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.84 4.33 0.00 1.96 1.91 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.47 0.00