NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2003 8.3144 120.1377 56.0956 34.1357 176.3995 4 C 4.7647 7.9243 119.0929 54.0891 44.0226 170.8396 5 S 4.9014 9.5895 123.3505 56.3723 65.1416 173.6219 6 L 4.0467 8.2965 126.3327 57.1302 41.8361 177.9141 7 T 4.0198 7.1876 114.6653 63.4641 69.1291 174.0335 8 G 3.5180 7.5966 112.9956 44.1294 0.0000 171.4302 9 K 4.9865 7.9758 119.1974 54.4126 35.0558 175.6246 10 W 5.5824 9.3710 123.6129 55.3537 33.7880 174.1048 11 T 5.3436 9.5438 116.1098 60.7560 71.2399 172.4484 12 N 5.7580 8.9440 123.8920 49.9743 40.2765 174.6433 13 D 4.4419 8.6616 116.9139 55.7021 39.7083 176.8174 14 L 4.3506 8.2115 118.4001 54.3917 41.9080 177.4047 15 G 3.9767 8.0274 107.3020 45.1580 0.0000 174.2741 16 S 4.5634 7.9341 115.6809 58.5999 64.3377 172.8739 17 N 5.7664 8.9292 119.5638 51.8212 42.3649 173.4724 18 M 5.1044 9.1098 117.9792 54.0867 35.1450 173.8294 19 T 5.1137 8.6939 117.6530 61.9015 71.9712 173.1866 20 I 4.6895 8.7275 126.0076 59.5959 40.6881 176.3699 21 G 4.0631 8.6257 115.0388 45.6051 0.0000 172.9440 22 A 4.2470 8.5999 123.4647 51.9135 19.1097 177.5888 23 V 4.4177 7.5113 122.3563 60.1474 32.8096 176.4791 24 N 4.7231 8.5799 122.9734 51.9786 38.4131 175.6669 25 S 4.2478 8.4613 111.7189 61.0245 63.2606 175.1280 26 R 4.1100 8.1207 118.0527 56.4188 30.3380 177.1589 27 G 4.0997 8.2593 106.7873 46.3147 0.0000 173.0448 28 E 4.7580 8.4378 120.0669 56.0001 30.9382 175.7900 29 F 5.2441 8.3801 116.9815 56.0310 41.9824 173.0645 30 T 5.0061 8.2714 115.2842 62.3310 73.0593 172.9884 31 G 4.3582 8.0331 108.1963 46.6433 0.0000 172.1999 32 T 5.1977 8.6283 115.5046 61.7704 72.9453 172.9305 33 Y 4.9949 9.3141 125.8346 56.1975 41.8506 174.1251 34 T 5.7468 9.0465 123.5772 61.4577 71.4609 173.5354 35 T 5.0852 8.5902 121.2921 61.3681 73.0659 173.3960 36 A 4.4753 8.7262 125.6075 51.3973 19.5255 178.0238 37 V 4.7262 7.5540 119.0532 61.5316 31.6516 170.0724 38 T 4.6609 8.1585 114.1687 63.6079 76.3386 175.3200 39 A 4.1054 8.2998 125.9985 51.9398 19.4288 179.3325 40 T 3.6385 7.6413 111.1409 64.2859 71.5147 173.4419 41 S 4.4111 7.7995 118.4113 57.0189 63.7817 171.7679 42 N 5.1439 8.4563 120.8927 51.9636 41.8877 176.4895 43 E 4.7300 8.3621 120.7075 56.2518 31.3464 175.2390 44 I 4.8905 8.2201 119.8845 60.0511 41.4022 174.9901 45 K 4.7625 8.8384 120.9201 54.5909 35.7246 175.2206 46 E 5.3321 8.9777 122.4748 54.8214 32.0610 175.5620 47 S 5.0589 9.2370 120.2102 55.9294 67.1936 172.0905 48 P 4.9983 0.0000 0.0000 62.5699 33.0476 174.8362 49 L 5.2422 8.6198 120.5333 54.4520 44.2246 175.0311 50 H 5.1493 8.9002 117.0156 54.5194 33.3797 172.9562 51 G 4.1656 8.0622 108.8051 45.7827 0.0000 171.3987 52 T 5.1415 8.5070 108.4611 60.0791 72.2571 172.5459 53 E 5.3222 9.5523 125.1679 54.5021 32.2863 174.3330 54 N 4.7093 9.0823 126.1742 53.7526 39.2480 174.7010 55 T 4.4538 8.5496 114.9535 61.2847 69.5228 174.1278 56 I 3.8450 8.2440 124.7672 62.9209 37.2563 175.6520 57 N 4.1623 8.7988 120.9808 53.4796 36.2217 174.8843 58 K 3.9148 7.6090 115.6261 57.2720 30.0475 175.4023 59 R 4.1199 7.6203 117.9413 56.5282 31.3170 178.0500 60 T 4.1251 8.4862 110.7006 63.9767 69.4394 173.5353 61 Q 4.7433 7.8262 120.2840 52.0951 28.7647 173.3440 62 P 4.6718 0.0000 0.0000 62.3346 33.6662 176.6530 63 T 4.7781 8.3672 111.2566 61.8132 70.8877 172.9762 64 F 5.4323 8.2915 116.6182 56.3497 42.0438 172.9485 65 G 4.7488 9.4932 105.5109 45.2378 0.0000 171.7335 66 F 5.5721 9.1941 115.5974 55.8938 42.0138 172.9204 67 T 5.0535 8.9695 116.9171 61.8862 71.5963 173.2574 68 V 4.2778 8.9732 126.4017 61.2450 33.5452 174.2157 69 N 4.4971 8.0939 127.6181 51.1081 38.1078 173.3449 70 W 4.2872 7.5665 122.9832 56.8960 29.5738 176.8446 71 K 4.3644 9.1019 122.4934 57.1449 31.9802 177.3577 72 F 5.0000 7.3976 112.5812 56.0265 38.3503 174.1621 73 S 4.5061 7.3468 114.2021 58.1615 65.2571 173.6341 74 E 4.3568 8.4787 117.9576 56.6660 28.0937 176.9431 75 S 4.8018 7.6330 116.3782 58.5996 64.8333 173.2420 76 T 5.0007 8.7735 117.0873 62.3422 72.7526 173.2401 77 T 5.1897 8.3982 121.3721 61.9216 71.7218 173.6625 78 V 4.9547 8.5110 118.1691 59.6275 35.0979 174.7011 79 F 5.2482 9.2304 122.0360 55.9696 42.5403 174.1657 80 T 4.7188 8.8947 116.8048 60.6989 71.1448 173.4382 81 G 3.6641 6.8843 111.8026 46.4092 0.0000 171.4993 82 Q 4.8999 8.1432 120.8213 54.4263 32.8936 174.7736 83 C 5.0519 8.8193 125.8592 56.0477 44.1395 172.2272 84 F 5.2789 9.5377 125.7003 55.8312 41.9023 174.8965 85 I 4.6802 8.7239 122.8780 60.7213 37.8341 175.7357 86 D 4.6735 8.9570 127.2562 52.1684 43.3190 175.4555 87 R 3.8555 8.2760 121.0210 56.0083 30.6478 174.0681 88 N 3.6470 12.0000 112.2023 53.2977 39.5043 173.0125 89 G 4.3515 8.7882 114.7284 45.1364 0.0000 172.1384 90 K 4.3134 7.7833 119.6550 56.2420 34.0308 176.0154 91 E 5.2670 8.8459 123.4582 55.9046 31.1246 176.2154 92 V 4.9767 9.1508 122.3241 60.2992 35.3234 173.9656 93 L 5.0788 9.0668 124.7834 53.5400 43.4563 175.6012 94 K 5.0334 9.2075 124.9774 55.2389 33.8053 175.8602 95 T 5.3052 9.1900 115.1375 60.1629 72.7280 172.7560 96 M 5.2961 9.2364 121.5395 53.3149 36.3343 174.7078 97 W 5.3735 8.3307 117.3481 54.6905 32.5814 173.8075 98 L 5.2568 8.7850 120.3444 52.9871 44.6267 175.1929 99 L 5.0296 9.3598 126.6755 53.5741 44.0889 174.9119 100 R 4.8954 9.0743 128.4335 54.9526 31.3387 175.6327 101 S 4.7757 8.7247 123.4438 57.4188 63.9705 174.2355 102 S 4.3271 8.5614 118.1615 58.3083 62.6991 173.7523 103 V 4.5247 8.2318 119.5238 59.5640 34.5005 175.5188 104 N 4.5000 8.7095 119.5305 55.0889 39.1855 175.2658 105 D 4.9520 7.6863 116.8984 51.8307 43.5974 176.5754 106 I 3.7664 8.4830 125.7039 63.7971 38.1449 177.9633 107 G 3.7573 8.9563 108.7911 48.0099 0.0000 173.9187 108 D 4.7529 8.1930 118.5879 54.0370 41.5263 177.5765 109 D 4.3569 7.9938 120.8607 56.9750 41.2989 178.6071 110 W 4.2907 8.3457 115.1489 58.4731 28.1617 176.6198 111 K 3.7705 6.4923 115.5197 56.1233 31.9467 176.5798 112 A 4.1593 7.7311 121.9800 53.2540 18.8291 177.1926 113 T 5.0315 7.5421 112.6368 61.7852 71.0732 173.9277 114 R 4.7937 9.1162 126.3117 54.8284 32.7408 175.9018 115 V 4.2858 7.6928 119.6017 60.2995 34.7798 175.2350 116 G 3.2995 5.7164 106.5946 45.7891 0.0000 171.8354 117 I 5.1332 8.2499 112.2814 59.2606 40.9171 174.7204 118 N 5.3767 9.1678 119.0564 51.9486 43.6291 173.4544 119 I 5.0864 9.2205 123.7525 59.6674 40.0459 174.5500 120 F 5.6114 9.5172 125.8872 55.9733 41.9091 174.7334 121 T 5.4230 9.2075 112.3461 59.5675 72.4368 173.4144 122 R 3.7999 8.5009 121.4524 56.1134 30.8271 176.6074 123 L 4.1795 8.2810 124.7383 55.3208 41.7169 176.3382 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 K 8.31 4.20 0.00 1.80 1.97 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.41 7.81 4 C 7.92 4.76 0.00 2.99 3.15 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 5 S 9.59 4.90 0.00 3.85 3.71 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 6 L 8.30 4.05 0.00 1.13 0.95 -0.04 0.00 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 7 T 7.19 4.02 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 1.17 0.00 0.00 8 G 7.60 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.98 4.99 0.00 1.50 1.58 0.00 1.53 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.30 7.81 10 W 9.37 5.58 0.00 3.03 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 11 T 9.54 5.34 4.35 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 1.33 0.00 0.00 12 N 8.94 5.76 0.00 2.35 1.58 0.00 0.00 6.64 7.50 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 13 D 8.66 4.44 0.00 2.82 2.85 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 14 L 8.21 4.35 0.00 1.82 1.78 1.04 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.03 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 16 S 7.93 4.56 0.00 3.89 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 17 N 8.93 5.77 0.00 2.57 2.65 0.00 0.00 6.65 7.19 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 18 M 9.11 5.10 0.00 1.54 1.87 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 19 T 8.69 5.11 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 1.20 0.00 0.00 20 I 8.73 4.69 1.88 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.54 0.45 0.00 0.00 21 G 8.63 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 0.00 0.00 0.00 0.00 22 A 8.60 4.25 1.25 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 0.00 0.00 0.00 23 V 7.51 4.42 2.16 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 0.68 0.00 0.00 1.02 0.00 0.00 24 N 8.58 4.72 0.00 3.01 3.05 0.00 0.00 6.33 7.78 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 25 S 8.46 4.25 0.00 4.01 4.05 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 26 R 8.12 4.11 0.00 2.02 2.05 0.00 3.23 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 27 G 8.26 4.10 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 0.00 0.00 0.00 28 E 8.44 4.76 0.00 2.05 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 0.00 2.26 2.24 0.00 29 F 8.38 5.24 0.00 3.00 3.04 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 30 T 8.27 5.01 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 1.15 0.00 0.00 31 G 8.03 4.36 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 0.00 32 T 8.63 5.20 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 1.34 0.00 0.00 33 Y 9.31 4.99 0.00 2.86 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 34 T 9.05 5.75 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 1.25 0.00 0.00 35 T 8.59 5.09 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 1.28 0.00 0.00 36 A 8.73 4.48 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 37 V 7.55 4.73 1.89 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 0.54 0.00 0.00 0.82 0.00 0.00 38 T 8.16 4.66 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 39 A 8.30 4.11 1.25 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 0.00 0.00 0.00 40 T 7.64 3.64 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 41 S 7.80 4.41 0.00 3.90 3.81 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 0.00 0.00 0.00 42 N 8.46 5.14 0.00 2.59 2.53 0.00 0.00 7.14 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 43 E 8.36 4.73 0.00 1.93 1.62 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 2.18 2.24 0.00 44 I 8.22 4.89 1.88 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 1.35 0.54 0.90 0.00 0.00 45 K 8.84 4.76 0.00 1.42 1.78 0.00 1.24 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 1.04 1.32 7.81 46 E 8.98 5.33 0.00 1.89 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 2.26 2.35 0.00 47 S 9.24 5.06 0.00 3.86 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 48 P 0.00 5.00 0.00 2.07 2.15 0.00 3.84 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 49 L 8.62 5.24 0.00 1.77 1.64 0.67 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 50 H 8.90 5.15 0.00 3.00 3.07 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.06 4.17 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 0.00 0.00 0.00 52 T 8.51 5.14 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 1.13 0.00 0.00 53 E 9.55 5.32 0.00 2.28 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 0.00 2.31 2.34 0.00 54 N 9.08 4.71 0.00 2.80 2.75 0.00 0.00 7.10 8.56 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 55 T 8.55 4.45 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 1.25 0.00 0.00 56 I 8.24 3.84 2.02 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 1.31 0.81 0.92 0.00 0.00 57 N 8.80 4.16 0.00 2.89 2.95 0.00 0.00 7.38 7.61 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 58 K 7.61 3.91 0.00 1.83 1.92 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.55 7.81 59 R 7.62 4.12 0.00 1.80 1.86 0.00 3.59 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.57 0.00 60 T 8.49 4.13 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 61 Q 7.83 4.74 0.00 1.79 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.08 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 62 P 0.00 4.67 0.00 2.18 2.19 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 63 T 8.37 4.78 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 1.14 0.00 0.00 64 F 8.29 5.43 0.00 3.52 3.27 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 65 G 9.49 4.75 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 0.00 0.00 0.00 66 F 9.19 5.57 0.00 3.12 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 67 T 8.97 5.05 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 1.17 0.00 0.00 68 V 8.97 4.28 1.13 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 -0.73 0.00 0.00 0.73 0.00 0.00 69 N 8.09 4.50 0.00 2.73 2.64 0.00 0.00 7.28 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 70 W 7.57 4.29 0.00 3.17 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 0.00 0.00 0.00 0.00 71 K 9.10 4.36 0.00 1.95 1.99 0.00 1.71 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.53 1.60 7.81 72 F 7.40 5.00 0.00 3.11 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 73 S 7.35 4.51 0.00 3.85 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 74 E 8.48 4.36 0.00 1.96 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 2.27 2.31 0.00 75 S 7.63 4.80 0.00 3.70 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 76 T 8.77 5.00 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 77 T 8.40 5.19 4.37 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 0.88 0.00 0.00 78 V 8.51 4.95 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 0.73 0.00 0.00 0.91 0.00 0.00 79 F 9.23 5.25 0.00 1.51 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 80 T 8.89 4.72 4.16 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 1.13 0.00 0.00 81 G 6.88 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 82 Q 8.14 4.90 0.00 1.90 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.86 0.00 0.00 0.00 0.00 0.00 1.40 2.08 0.00 83 C 8.82 5.05 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 84 F 9.54 5.28 0.00 3.03 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 85 I 8.72 4.68 1.97 0.00 0.00 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 1.20 0.84 0.98 0.00 0.00 86 D 8.96 4.67 0.00 2.88 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 87 R 8.28 3.86 0.00 1.81 1.97 0.00 3.29 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 1.64 1.71 0.00 88 N 12.00 3.65 0.00 2.86 3.04 0.00 0.00 7.13 7.53 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 89 G 8.79 4.35 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 0.00 90 K 7.78 4.31 0.00 1.89 1.98 0.00 1.54 0.00 0.00 2.00 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.56 7.81 91 E 8.85 5.27 0.00 2.09 2.30 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 2.43 2.40 0.00 92 V 9.15 4.98 2.26 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 1.03 0.00 0.00 1.13 0.00 0.00 93 L 9.07 5.08 0.00 1.80 1.81 -0.62 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 94 K 9.21 5.03 0.00 1.99 1.90 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.71 1.65 7.81 95 T 9.19 5.31 4.69 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 1.74 0.00 0.00 96 M 9.24 5.30 0.00 1.73 1.87 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.35 0.00 97 W 8.33 5.37 0.00 2.71 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 0.00 0.00 0.00 98 L 8.78 5.26 0.00 1.60 1.60 0.89 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 99 L 9.36 5.03 0.00 1.74 1.81 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 100 R 9.07 4.90 0.00 1.94 1.95 0.00 3.35 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 101 S 8.72 4.78 0.00 3.73 3.72 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 0.00 102 S 8.56 4.33 0.00 3.87 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 0.00 103 V 8.23 4.52 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 0.71 0.00 0.00 0.96 0.00 0.00 104 N 8.71 4.50 0.00 2.71 2.87 0.00 0.00 6.74 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 0.00 105 D 7.69 4.95 0.00 2.66 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 0.00 106 I 8.48 3.77 1.89 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 1.38 1.21 0.94 0.00 0.00 107 G 8.96 3.76 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 0.00 0.00 0.00 108 D 8.19 4.75 0.00 2.84 2.57 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 0.00 109 D 7.99 4.36 0.00 2.87 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 0.00 110 W 8.35 4.29 0.00 3.60 3.21 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 0.00 111 K 6.49 3.77 0.00 1.03 0.74 0.00 1.10 0.00 0.00 0.99 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 0.74 7.81 112 A 7.73 4.16 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 0.00 113 T 7.54 5.03 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 1.22 0.00 0.00 114 R 9.12 4.79 0.00 2.00 2.07 0.00 3.14 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 115 V 7.69 4.29 1.90 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 0.55 0.00 0.00 0.67 0.00 0.00 116 G 5.72 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 0.00 0.00 0.00 117 I 8.25 5.13 1.91 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 1.33 0.84 0.82 0.00 0.00 118 N 9.17 5.38 0.00 3.20 2.49 0.00 0.00 7.19 7.41 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 0.00 119 I 9.22 5.09 1.91 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 1.32 1.25 1.02 0.00 0.00 120 F 9.52 5.61 0.00 2.94 3.13 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 0.00 0.00 0.00 121 T 9.21 5.42 4.37 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 1.36 0.00 0.00 122 R 8.50 3.80 0.00 1.46 1.56 0.00 2.76 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.06 0.00 123 L 8.28 4.18 0.00 1.63 1.43 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00