NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -3 M 4.1715 8.3044 118.1351 55.0902 32.3554 174.3033 -2 R 4.1986 7.6075 118.7886 54.1647 33.1028 173.0864 -1 G 4.2887 8.6968 114.0178 44.4341 0.0000 173.2985 0 S 4.4655 8.9977 117.3865 59.5131 63.8873 174.0233 1 T 4.4675 7.3636 113.0398 61.4249 69.5992 173.0749 2 R 3.8986 8.2621 123.8744 56.9063 30.5228 176.5565 3 D 4.6082 8.0538 118.1719 54.0259 39.9685 175.3281 4 Q 4.7000 9.5397 124.8817 55.3097 29.3182 176.2432 5 N 4.4737 8.1739 116.1009 53.7632 39.2395 175.3859 6 G 3.7805 7.4874 108.2064 44.2082 0.0000 171.2974 7 T 5.0600 7.9132 116.8649 61.4524 71.4135 173.9634 8 W 5.4819 9.2564 125.1580 53.6785 33.5331 173.6503 9 E 5.2208 8.5727 124.4894 54.1609 31.8810 174.5462 10 M 3.5615 8.9337 127.9280 56.0211 32.0253 175.4626 11 E 4.6513 8.9575 123.6490 56.6220 32.0053 176.0046 12 S 4.5801 7.3792 113.3426 57.3687 66.5573 173.2371 13 N 5.0817 8.3315 119.9730 52.8299 41.5361 173.2060 14 E 4.5837 8.9967 126.2064 54.9447 33.4330 175.8950 15 N 4.3446 9.0430 121.2441 54.6607 37.7849 175.8487 16 F 4.5559 8.3761 120.2402 60.7698 39.3610 175.6268 17 E 3.8707 8.3626 118.7916 59.2012 29.4473 178.8852 18 G 3.7892 8.1631 106.4688 47.3619 0.0000 174.7289 19 Y 4.1374 8.0147 122.0113 60.7715 38.8686 178.0992 20 M 3.7161 8.2791 119.8927 58.2459 31.9932 178.8767 21 K 3.8683 8.3339 118.7427 59.4678 32.0022 179.2598 22 A 3.9977 7.9093 119.9497 54.6377 18.3412 178.7302 23 L 4.0854 7.1335 114.6006 54.3949 41.8761 176.8359 24 D 4.4621 7.8116 117.5627 55.0124 38.8525 173.9719 25 I 3.7950 7.4199 120.5521 60.9782 37.6663 176.7245 26 D 4.5814 8.5021 124.8040 52.9406 41.3009 176.9913 27 F 3.9197 8.9521 122.8375 61.7507 39.3000 177.4204 28 A 4.0547 8.2668 119.4780 55.5227 18.2489 179.5233 29 T 3.8085 8.4927 114.4033 66.8565 68.5734 176.9928 30 R 3.7620 7.9772 119.9176 59.3021 29.8503 179.3419 31 K 3.7906 7.6427 117.0533 59.2294 31.9998 179.3213 32 I 3.6102 7.2747 119.0783 64.2139 37.4021 177.9509 33 A 4.4200 8.0680 121.3532 54.0751 18.3389 179.7632 34 V 3.8234 7.6408 116.9445 64.5841 31.3158 177.6022 35 R 4.6069 7.8226 116.1707 55.3384 30.6785 175.1157 36 L 4.3098 7.7497 118.5912 54.0145 42.2551 177.2141 37 T 3.8572 8.4804 120.8130 63.9741 69.0586 173.6388 38 Q 4.9467 8.3605 124.7272 54.9129 31.6486 174.5277 39 T 5.2676 8.8890 118.3061 61.7106 72.1673 172.9288 40 K 4.9658 9.4033 126.7737 54.5647 35.1756 174.6140 41 V 4.8392 8.9403 127.7143 61.2088 34.1158 174.0516 42 I 4.8562 9.0654 129.1032 59.5333 40.2575 173.9574 43 D 5.0734 9.1880 127.6767 52.5085 43.2009 174.3429 44 Q 4.4952 8.4617 126.9382 54.0652 31.9386 174.0603 45 D 4.6210 8.7816 126.0135 52.7567 43.7749 177.2513 46 G 3.9105 8.4218 119.2019 47.1425 0.0000 173.5836 47 D 4.9246 9.0819 127.0027 54.5826 41.5503 174.7160 48 N 5.1661 8.3089 118.9019 51.9555 40.1962 174.0164 49 F 4.9662 9.0850 123.2654 55.3221 42.3659 174.6819 50 K 5.2682 9.3594 122.4106 53.7445 35.2687 175.2934 51 T 5.1871 8.7734 115.0163 59.7583 72.3615 173.1257 52 K 5.1003 9.0232 122.3931 55.0379 36.4490 175.1633 53 T 5.1651 9.0438 121.8091 61.9873 71.0742 173.3695 54 T 5.1051 9.2317 116.9765 60.2279 72.4065 172.9804 55 S 5.0596 8.0128 116.6700 57.7742 66.3671 174.1747 56 T 4.2129 8.6827 108.1499 62.3212 68.1678 174.4524 57 F 4.9170 7.5234 122.6778 58.5635 41.2178 175.0157 58 R 4.4870 7.3661 117.0930 54.2397 33.9508 174.2298 59 N 5.5130 8.3671 116.7205 51.9453 41.4858 173.7125 60 Y 4.6866 9.1320 121.6720 56.3799 42.1914 173.3474 61 D 5.2568 8.1705 126.4939 52.5147 43.5070 176.3161 62 V 4.4745 8.3691 121.4782 60.3669 35.1217 173.5531 63 D 5.3484 8.5503 123.9937 52.6524 44.2027 174.8791 64 F 4.6417 8.1322 115.0334 56.3793 41.9330 172.6196 65 T 5.1714 8.2641 116.1359 61.4054 71.0394 174.3230 66 V 3.9214 8.9496 127.1622 64.7890 31.9362 175.9537 67 G 3.9715 9.6048 116.1866 44.8488 0.0000 173.2302 68 V 4.2861 7.2818 119.2003 60.6602 32.3558 175.0965 69 E 4.6045 8.7757 127.4928 56.9886 30.0174 176.3846 70 F 5.0340 8.8976 117.3703 55.2964 42.2631 173.3827 71 D 4.8600 8.9433 120.0329 53.7569 41.3256 175.1979 72 E 4.5950 8.9320 129.3688 55.2261 30.8391 174.4425 73 Y 5.1645 8.7785 130.1121 55.8485 39.5734 176.0980 74 T 4.7682 8.8724 123.7992 60.0835 67.4848 175.3755 75 K 4.5302 7.6224 120.9000 58.4293 33.4488 178.4335 76 S 4.0877 8.8425 114.5014 58.4779 63.5583 170.2631 77 L 4.1429 7.8883 119.3062 55.1813 40.6564 176.6367 78 D 4.6644 9.1679 125.1379 52.8890 41.2858 176.3584 79 N 4.0179 8.1370 116.9664 55.1980 36.5947 173.1665 80 R 5.0818 8.1640 115.5615 54.8481 34.5440 175.3900 81 H 5.4392 8.7284 116.9729 54.5781 30.4262 175.2223 82 V 4.5842 8.6863 115.6801 59.3032 35.9366 175.1743 83 K 4.5185 9.0922 126.0654 55.6994 32.6310 175.0156 84 A 4.7553 8.2681 130.6121 50.2814 21.0794 175.4521 85 L 4.7851 8.4842 123.4069 53.2182 45.6256 175.0697 86 V 4.4585 8.3151 126.1624 61.2258 33.7575 174.3601 87 T 4.8976 8.6497 117.2325 59.6046 72.7522 172.5712 88 W 5.1493 8.7103 122.1425 55.8904 30.6542 176.1019 89 E 4.5621 9.5906 125.1019 55.0975 30.8260 177.4781 90 G 3.8247 8.2942 116.2756 47.1471 0.0000 172.7554 91 D 4.7736 8.7873 122.3871 53.5854 41.4082 174.6026 92 V 4.7227 8.1777 119.9871 61.1357 34.0075 174.1440 93 L 4.2600 9.3525 131.1620 54.3285 43.3083 175.2567 94 V 4.5326 8.6920 127.1509 61.0683 34.1799 173.5188 95 C 4.5915 8.2767 128.4400 57.2505 33.9179 172.5415 96 V 4.3839 8.1277 119.2195 59.7387 33.8043 174.8824 97 Q 4.8331 8.8214 125.8612 53.9913 29.2036 174.6987 98 K 4.0719 8.9981 124.4164 55.4221 33.2605 177.0312 99 G 3.9816 8.0142 111.4162 46.2810 0.0000 172.4870 100 E 4.0282 9.1159 120.6137 59.1491 29.9270 178.6470 101 K 4.2135 7.7298 116.8406 55.9134 33.0769 176.7280 102 E 4.1639 8.5844 122.3413 57.2039 30.1994 176.3344 103 N 4.3411 8.5465 116.5511 54.3051 36.3788 174.0456 104 R 4.6719 7.8063 118.0987 54.8091 31.5230 175.8197 105 G 3.6322 8.2290 112.2217 46.6434 0.0000 171.0729 106 W 5.5008 7.1490 114.7077 55.7475 32.0040 173.7182 107 K 5.3408 9.6029 120.0745 54.9459 35.9175 175.3085 108 Q 5.3255 9.8929 125.5965 54.3300 32.5988 173.6915 109 W 5.7598 8.9578 121.9029 55.6622 32.3066 173.1701 110 I 4.7495 8.6358 121.7789 59.9957 39.1117 174.6980 111 E 4.9996 9.2256 126.2737 55.0729 32.8730 178.2303 112 G 4.0679 9.0332 115.4257 46.9902 0.0000 173.1392 113 D 5.1925 9.4055 120.6636 53.7838 43.1041 175.7715 114 K 5.1691 8.5836 118.2682 54.5134 36.5512 174.6420 115 L 4.5936 8.3097 124.5923 53.4004 44.1536 174.6688 116 Y 4.6020 8.4459 123.5076 55.8358 41.1449 174.5592 117 L 5.0396 8.5465 124.2649 53.5431 45.8608 174.4872 118 E 5.2724 9.7519 126.3125 54.6754 32.3268 174.7857 119 L 5.2640 8.9639 125.2858 53.0693 44.4003 175.6701 120 T 5.3336 9.0475 113.4009 60.3735 72.3882 172.5727 121 C 4.9834 9.3607 123.2460 58.4459 35.6344 173.3645 122 G 3.8706 9.2733 116.5453 47.2196 0.0000 173.7419 123 D 4.8482 9.0454 121.8805 52.5507 39.6605 175.3586 124 Q 4.7240 8.3036 119.4286 54.4673 30.8812 174.5617 125 V 4.9723 8.3247 121.0961 61.2886 34.3927 173.8034 126 C 5.0407 9.3859 128.5257 57.7479 33.9925 172.2849 127 R 5.1273 8.7960 124.8174 54.5787 32.5103 174.9420 128 Q 4.9371 9.2544 122.7512 53.9543 32.9888 174.6575 129 V 4.4593 8.1802 121.3368 60.9789 35.1485 174.1035 130 F 5.2484 9.1208 126.1128 55.4297 42.0123 174.9478 131 K 4.6981 9.0845 123.1955 55.8620 34.6033 176.0358 132 K 3.6579 8.1143 124.1673 56.9667 32.1162 176.1838 133 K 4.3506 8.5370 127.0708 57.7846 33.4498 176.9533 134 L 4.6386 7.0340 118.2709 53.1803 46.0823 175.4585 135 V 4.6591 7.9858 115.0654 58.7593 35.0918 174.1365 136 P 4.3544 0.0000 0.0000 65.6354 31.6415 176.5918 137 R 4.1428 7.6352 118.9704 56.4730 28.8579 174.3966 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 -3 M 8.30 4.17 0.00 1.23 0.82 0.00 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.13 0.00 -2 R 7.61 4.20 0.00 1.71 1.72 0.00 3.20 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 -1 G 8.70 4.29 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 0.00 0 S 9.00 4.47 0.00 4.01 4.07 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 1 T 7.36 4.47 4.29 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 1.37 0.00 0.00 2 R 8.26 3.90 0.00 1.49 1.36 0.00 2.56 0.00 0.00 2.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.12 0.00 3 D 8.05 4.61 0.00 2.67 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 4 Q 9.54 4.70 0.00 2.46 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.52 0.00 0.00 0.00 0.00 0.00 2.54 2.98 0.00 5 N 8.17 4.47 0.00 2.91 2.80 0.00 0.00 6.90 6.99 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 6 G 7.49 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 7 T 7.91 5.06 4.06 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 1.17 0.00 0.00 8 W 9.26 5.48 0.00 3.04 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 9 E 8.57 5.22 0.00 2.07 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 2.25 2.28 0.00 10 M 8.93 3.56 0.00 1.81 1.22 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 11 E 8.96 4.65 0.00 1.84 1.93 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 2.09 2.06 0.00 12 S 7.38 4.58 0.00 3.79 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 13 N 8.33 5.08 0.00 2.43 2.57 0.00 0.00 6.81 7.65 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 14 E 9.00 4.58 0.00 1.88 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 2.19 2.36 0.00 15 N 9.04 4.34 0.00 3.01 3.07 0.00 0.00 6.85 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 16 F 8.38 4.56 0.00 3.24 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 17 E 8.36 3.87 0.00 2.09 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 2.35 2.39 0.00 18 G 8.16 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 19 Y 8.01 4.14 0.00 3.18 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 20 M 8.28 3.72 0.00 1.80 1.78 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.14 0.00 21 K 8.33 3.87 0.00 1.89 1.83 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.56 7.81 22 A 7.91 4.00 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 23 L 7.13 4.09 0.00 1.49 1.52 0.33 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 24 D 7.81 4.46 0.00 2.80 2.75 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 25 I 7.42 3.80 1.87 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.34 0.85 0.00 0.00 26 D 8.50 4.58 0.00 2.92 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 27 F 8.95 3.92 0.00 3.16 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 28 A 8.27 4.05 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 29 T 8.49 3.81 4.41 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 1.43 0.00 0.00 30 R 7.98 3.76 0.00 1.72 1.75 0.00 2.96 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.89 0.00 31 K 7.64 3.79 0.00 1.62 1.68 0.00 1.41 0.00 0.00 1.34 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.53 1.02 7.81 32 I 7.27 3.61 1.26 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.32 -0.22 0.00 0.00 33 A 8.07 4.42 1.64 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 34 V 7.64 3.82 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 35 R 7.82 4.61 0.00 1.78 1.92 0.00 3.19 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 36 L 7.75 4.31 0.00 1.76 1.66 1.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.48 3.86 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 1.17 0.00 0.00 38 Q 8.36 4.95 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.85 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 39 T 8.89 5.27 4.29 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 1.30 0.00 0.00 40 K 9.40 4.97 0.00 1.24 1.36 0.00 0.96 0.00 0.00 1.21 0.00 0.00 2.16 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.28 7.81 41 V 8.94 4.84 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 0.98 0.00 0.00 0.93 0.00 0.00 42 I 9.07 4.86 2.23 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.82 1.07 0.00 0.00 43 D 9.19 5.07 0.00 2.66 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Q 8.46 4.50 0.00 1.26 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.68 0.00 0.00 0.00 0.00 0.00 1.85 1.16 0.00 45 D 8.78 4.62 0.00 2.65 2.43 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 46 G 8.42 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 47 D 9.08 4.92 0.00 2.88 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 48 N 8.31 5.17 0.00 2.78 2.70 0.00 0.00 6.71 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 49 F 9.08 4.97 0.00 1.51 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 0.00 0.00 0.00 0.00 50 K 9.36 5.27 0.00 1.58 1.60 0.00 1.41 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.27 1.26 7.81 51 T 8.77 5.19 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 1.30 0.00 0.00 52 K 9.02 5.10 0.00 1.66 1.67 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.35 7.81 53 T 9.04 5.17 4.42 0.00 0.00 0.00 0.00 0.00 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 54 T 9.23 5.11 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 1.22 0.00 0.00 55 S 8.01 5.06 0.00 3.81 3.93 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 56 T 8.68 4.21 4.29 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 1.24 0.00 0.00 57 F 7.52 4.92 0.00 2.88 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 58 R 7.37 4.49 0.00 1.35 1.48 0.00 2.56 0.00 0.00 3.10 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.50 0.00 59 N 8.37 5.51 0.00 2.56 2.78 0.00 0.00 6.63 7.46 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 60 Y 9.13 4.69 0.00 2.97 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 61 D 8.17 5.26 0.00 2.38 2.41 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 62 V 8.37 4.47 2.18 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 0.97 0.00 0.00 1.37 0.00 0.00 63 D 8.55 5.35 0.00 2.48 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.13 4.64 0.00 2.87 2.36 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 65 T 8.26 5.17 4.31 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 1.35 0.00 0.00 66 V 8.95 3.92 2.43 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 0.74 0.00 0.00 1.08 0.00 0.00 67 G 9.60 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 68 V 7.28 4.29 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 0.91 0.00 0.00 1.00 0.00 0.00 69 E 8.78 4.60 0.00 1.91 1.87 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 2.29 2.35 0.00 70 F 8.90 5.03 0.00 3.10 3.09 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 71 D 8.94 4.86 0.00 2.77 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 72 E 8.93 4.60 0.00 1.82 1.77 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 2.50 2.61 0.00 73 Y 8.78 5.16 0.00 2.90 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 74 T 8.87 4.77 4.15 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 1.27 0.00 0.00 75 K 7.62 4.53 0.00 1.72 1.25 0.00 1.69 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.31 1.35 7.81 76 S 8.84 4.09 0.00 4.09 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 77 L 7.89 4.14 0.00 1.62 1.22 0.13 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 78 D 9.17 4.66 0.00 2.72 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 79 N 8.14 4.02 0.00 2.97 3.00 0.00 0.00 6.76 7.14 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 80 R 8.16 5.08 0.00 1.75 1.86 0.00 3.29 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 81 H 8.73 5.44 0.00 3.04 3.23 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.69 4.58 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 0.70 0.00 0.00 0.94 0.00 0.00 83 K 9.09 4.52 0.00 1.74 1.64 0.00 1.58 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.32 7.81 84 A 8.27 4.76 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.48 4.79 0.00 1.64 1.33 0.91 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 86 V 8.32 4.46 1.67 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 0.25 0.00 0.00 0.04 0.00 0.00 87 T 8.65 4.90 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 1.14 0.00 0.00 88 W 8.71 5.15 0.00 3.23 3.30 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 89 E 9.59 4.56 0.00 1.98 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 2.23 2.21 0.00 90 G 8.29 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 91 D 8.79 4.77 0.00 2.87 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 92 V 8.18 4.72 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 0.98 0.00 0.00 0.72 0.00 0.00 93 L 9.35 4.26 0.00 1.54 1.70 -0.74 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.69 4.53 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 0.63 0.00 0.00 0.92 0.00 0.00 95 C 8.28 4.59 0.00 1.23 1.18 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 96 V 8.13 4.38 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 0.53 0.00 0.00 0.78 0.00 0.00 97 Q 8.82 4.83 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.84 0.00 0.00 0.00 0.00 0.00 2.22 2.16 0.00 98 K 9.00 4.07 0.00 1.61 1.68 0.00 1.73 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.48 7.81 99 G 8.01 3.98 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 0.00 0.00 0.00 100 E 9.12 4.03 0.00 1.94 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 0.00 2.28 2.28 0.00 101 K 7.73 4.21 0.00 1.77 1.70 0.00 1.85 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.35 7.81 102 E 8.58 4.16 0.00 1.99 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 2.39 2.26 0.00 103 N 8.55 4.34 0.00 3.08 2.91 0.00 0.00 6.86 7.66 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 0.00 104 R 7.81 4.67 0.00 1.85 1.97 0.00 3.26 0.00 0.00 3.35 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.68 0.00 105 G 8.23 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 0.00 106 W 7.15 5.50 0.00 3.42 3.09 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 0.00 107 K 9.60 5.34 0.00 1.93 1.87 0.00 1.59 0.00 0.00 1.51 0.00 0.00 2.74 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.40 7.81 108 Q 9.89 5.33 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.64 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 109 W 8.96 5.76 0.00 3.52 3.32 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 0.00 110 I 8.64 4.75 2.00 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.01 1.10 0.00 0.00 111 E 9.23 5.00 0.00 2.26 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 2.51 2.30 0.00 112 G 9.03 4.07 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 0.00 0.00 0.00 113 D 9.41 5.19 0.00 2.72 2.75 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 0.00 114 K 8.58 5.17 0.00 1.71 1.38 0.00 1.66 0.00 0.00 1.45 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.42 7.81 115 L 8.31 4.59 0.00 0.27 0.70 -0.16 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 8.45 4.60 0.00 1.43 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 0.00 117 L 8.55 5.04 0.00 1.50 1.42 0.81 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 118 E 9.75 5.27 0.00 2.21 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 2.43 2.74 0.00 119 L 8.96 5.26 0.00 0.82 0.45 0.59 0.14 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 0.00 120 T 9.05 5.33 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 1.28 0.00 0.00 121 C 9.36 4.98 0.00 3.02 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 0.00 122 G 9.27 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 0.00 123 D 9.05 4.85 0.00 2.78 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Q 8.30 4.72 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.63 0.00 125 V 8.32 4.97 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 0.85 0.00 0.00 0.99 0.00 0.00 126 C 9.39 5.04 0.00 3.27 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 R 8.80 5.13 0.00 1.83 1.87 0.00 3.19 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.64 0.00 128 Q 9.25 4.94 0.00 2.02 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.12 0.00 129 V 8.18 4.46 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 0.43 0.00 0.00 0.84 0.00 0.00 130 F 9.12 5.25 0.00 2.83 2.99 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 0.00 0.00 0.00 0.00 131 K 9.08 4.70 0.00 1.85 2.16 0.00 1.31 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.60 1.42 7.81 132 K 8.11 3.66 0.00 2.06 1.69 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.07 0.67 7.81 133 K 8.54 4.35 0.00 1.59 1.72 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.52 7.81 134 L 7.03 4.64 0.00 1.35 1.34 0.84 0.77 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 0.00 135 V 7.99 4.66 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 0.43 0.00 0.00 0.91 0.00 0.00 136 P 0.00 4.35 0.00 2.15 2.15 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.93 0.00 137 R 7.64 4.14 0.00 1.90 1.87 0.00 3.07 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00