NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 L 4.2892 8.0427 122.7511 54.8296 43.8990 174.8291 11 L 4.7765 8.6236 128.3240 52.9651 44.2211 173.6996 12 L 4.7577 10.0299 129.6951 53.4894 43.5258 175.4919 13 Q 5.2379 8.6672 122.6692 53.3064 32.2852 174.9053 14 E 2.0000 8.6400 118.7861 57.5439 29.6179 176.8585 15 A 3.6690 8.2081 121.7524 52.9650 16.2859 176.8487 16 Q 4.6294 7.5986 115.7779 54.5309 32.8601 174.6388 17 A 4.1668 8.5349 121.6856 54.5193 18.6559 178.3664 18 G 3.9973 9.2306 110.4180 45.0099 0.0000 172.4633 19 F 4.7545 8.0233 122.4740 57.3945 39.8508 173.9766 20 C 4.6593 8.1511 126.1850 58.5212 42.4471 174.4539 21 R 4.6418 6.3565 115.0972 55.2424 32.9590 173.7347 22 V 4.6951 8.3686 123.9686 60.0318 34.4017 175.2827 23 D 4.4525 9.3997 124.7978 56.1289 40.5064 174.5774 24 G 4.0254 7.6866 116.4472 44.3619 0.0000 170.5553 25 T 4.7223 8.5752 114.2009 59.9226 73.0335 173.4433 26 I 4.6027 8.1322 122.6509 60.1910 38.3362 175.0002 27 D 4.7404 8.2550 126.8374 52.0155 44.8518 177.0170 28 N 4.1269 7.8266 112.9046 53.3137 37.7035 174.6545 29 N 4.8430 8.3138 114.1245 53.5996 38.0530 173.9888 30 H 5.2135 8.4828 116.5087 54.0816 31.4844 174.0209 31 T 4.1234 8.5471 113.8853 62.4559 69.2443 175.0428 32 G 4.1310 8.5767 110.3816 45.0723 0.0000 173.6643 33 F 3.3969 7.2430 114.5483 56.0000 38.9635 173.8324 34 T 4.5145 8.6943 110.9348 60.2408 71.7433 175.4779 35 G 3.8638 8.3937 109.3946 45.9174 0.0000 173.6747 36 S 4.6456 8.6319 113.3045 58.4285 64.7189 175.1804 37 G 2.9840 7.8730 111.3104 45.4038 0.0000 172.5201 38 F 5.1379 7.2473 117.1695 55.4835 42.0144 173.7787 39 A 4.7848 9.4727 122.8515 51.5349 20.2309 176.0890 40 N 5.4387 9.3884 122.1566 51.6438 40.7267 173.8795 41 T 4.5653 8.5588 116.2280 61.2402 69.6849 173.8837 42 N 4.2212 8.8314 120.9656 54.0893 40.0367 174.3507 43 N 5.2548 8.5419 119.3577 51.7088 37.0077 173.6638 44 A 4.6763 7.6450 121.7828 50.0010 23.3346 176.0237 45 Q 4.2013 8.7289 123.1724 57.6367 29.6095 177.0016 46 G 3.9379 9.1127 113.1244 45.0911 0.0000 173.7037 47 A 4.1646 7.7877 122.4004 52.3867 19.3618 176.5877 48 A 5.2111 9.1330 123.0775 49.9933 23.1677 174.8919 49 V 4.3784 8.4064 118.9559 60.8638 34.7021 174.7471 50 V 4.4906 7.5266 126.2093 60.8086 34.8670 174.2147 51 W 5.4005 9.3350 126.1285 54.7794 33.9365 173.8544 52 A 5.2960 9.1193 122.1823 50.3950 21.6414 175.2737 53 I 4.9409 8.9253 123.0983 59.4750 41.1862 174.0538 54 D 5.1842 9.4311 127.2321 53.2317 42.9222 174.6390 55 A 5.0867 8.8303 127.9246 50.4057 20.9996 177.0526 56 T 3.9343 8.7460 120.3374 66.3449 68.9670 174.8742 57 S 4.7236 7.7492 113.6609 56.3155 67.1073 173.6189 58 S 4.5565 8.6672 117.7625 58.3145 63.4650 174.2114 59 G 4.4143 8.0557 113.8782 45.9057 0.0000 171.9451 60 R 4.6262 8.3822 123.0075 56.3322 30.8589 175.8981 61 R 4.8748 9.2481 124.8121 54.6862 34.3620 174.5664 62 T 4.7958 8.8455 119.1743 61.7297 70.3769 173.6615 63 L 5.0127 8.7816 127.2728 53.3361 44.1918 175.6098 64 T 5.0227 8.9049 120.5627 61.8134 71.6642 172.9138 65 I 4.8600 8.9976 128.1441 59.5471 39.8465 174.5485 66 R 5.2900 8.8176 128.5219 55.2223 31.8281 174.6380 67 Y 5.8562 9.2031 123.0770 55.9667 42.2533 173.3454 68 A 4.4463 8.7740 121.1084 48.9848 22.4864 175.0582 69 N 4.4164 8.6887 120.1635 51.6572 40.4187 174.5667 70 G 2.2866 4.0000 110.6452 44.5218 0.0000 171.7635 71 G 3.9067 6.7811 109.2767 44.3959 0.0000 174.6610 72 T 3.8100 8.4106 113.2082 64.8798 67.4867 174.7682 73 A 4.3173 7.6166 122.0551 51.0806 19.3412 176.6897 74 N 4.5381 8.5762 116.9731 54.3384 39.6088 175.0114 75 R 4.9622 8.1967 118.5817 54.8254 29.3544 175.2901 76 N 4.6020 8.0991 118.6194 53.3557 40.6689 175.6633 77 G 4.4597 9.0668 107.9747 44.5500 0.0000 171.5798 78 S 5.2813 9.1772 116.6300 56.2237 64.7519 172.4459 79 L 5.3275 9.0074 129.2732 53.3311 44.4422 174.9647 80 V 4.8822 9.1209 126.3373 61.1548 34.7074 173.9229 81 I 4.7768 8.6378 127.9056 59.7685 39.0358 175.4749 82 N 4.0705 8.9142 126.2070 55.7680 36.1669 175.3651 83 G 3.9062 7.7968 108.0904 45.4085 0.0000 173.4227 *87 G 3.6272 8.4431 114.4704 44.8302 0.0000 170.9510 88 N 4.9015 7.6114 115.4679 51.5979 40.8822 173.6088 89 Y 4.9245 8.9829 117.7085 56.4778 42.1373 174.7446 90 T 5.0154 8.5854 110.7197 60.0724 71.4819 173.7845 91 V 4.4028 8.7719 123.9206 61.2789 34.3566 174.4235 92 S 4.8397 8.7191 124.2325 57.7856 63.9446 174.7834 93 L 4.4605 8.9536 123.7842 52.2253 41.4913 173.9466 94 P 5.0554 0.0000 0.0000 61.4765 33.0391 177.3905 95 T 3.8939 8.4643 114.7907 63.0431 67.4301 173.6139 96 T 4.1537 8.4645 116.7357 61.2369 69.5412 175.5156 97 G 3.8029 9.4684 111.1306 45.4466 0.0000 173.2825 98 A 4.1874 6.6831 119.4075 50.9034 21.5889 177.0989 99 W 4.0032 8.3301 119.7916 58.6919 29.2195 177.4293 100 T 4.6053 7.5478 106.2530 61.1953 68.8628 174.1919 101 T 4.5278 7.1844 120.3469 61.8175 70.4059 173.5041 102 W 4.7471 8.7796 125.8392 55.1076 32.1343 174.8671 103 Q 4.7452 8.6014 121.8943 54.5238 32.9684 173.7377 104 T 5.4621 8.5415 108.0771 60.3680 72.0891 173.1431 105 A 4.9877 9.3065 124.4727 50.4763 22.2087 175.0805 106 T 5.0622 8.3777 114.7521 60.5027 70.5034 173.1895 107 I 4.4536 8.4026 126.5322 60.0896 41.8385 172.9063 108 D 5.1998 8.6925 129.0990 53.6629 42.6852 175.8183 109 V 4.1488 8.4473 114.7774 59.6258 36.6193 173.8799 110 D 5.2097 8.9358 122.6479 53.3600 41.9602 176.3383 111 L 4.7726 8.8338 123.4874 53.1365 44.5698 175.8595 112 V 4.5318 8.5805 121.2671 60.6374 33.2332 175.4931 113 Q 3.9382 8.2216 126.0535 58.1547 29.9757 177.8506 114 G 3.8989 9.2402 110.9645 44.4306 0.0000 171.3701 115 N 5.0256 8.4448 120.3589 53.4209 40.1326 175.3461 116 N 5.3285 9.2799 122.8085 51.6031 42.6621 173.2268 117 I 4.7016 9.1855 125.0124 60.0379 39.3234 174.7757 118 V 4.8371 9.1320 127.7064 61.4062 33.7740 174.0307 119 Q 4.9939 9.2026 127.8670 54.0461 31.4421 174.3844 120 L 5.1841 8.9472 126.7638 53.7184 44.0645 175.1500 121 S 5.3031 9.1896 122.5484 56.2055 66.7824 173.6402 122 A 4.4915 8.9043 126.0797 52.6149 18.6979 178.4261 123 T 4.5249 8.6090 112.5027 62.6080 70.0616 174.7059 124 T 4.6482 7.6715 111.4912 59.3250 71.7113 174.3979 125 A 4.3052 8.4137 123.6535 54.0472 18.5032 178.4117 126 E 4.1061 7.9059 114.7709 56.6232 30.0830 178.5133 127 G 3.8796 7.7263 106.9480 45.3750 0.0000 173.1446 128 L 4.4522 8.0550 119.8146 52.8780 42.8311 174.3669 129 P 4.8831 0.0000 0.0000 62.5077 32.8972 175.4071 130 N 4.9728 9.4493 117.5827 53.5184 39.8697 174.8042 131 I 4.9380 9.1932 124.9247 60.1215 38.6886 175.9945 132 D 4.6533 9.9415 129.0281 57.0403 41.6400 176.2715 133 S 5.0247 7.9635 110.2704 57.4895 66.4686 173.0491 134 L 4.8600 8.7265 122.7746 53.2721 44.4412 174.8408 135 S 5.1534 8.9818 121.5838 56.5496 64.9543 172.8164 136 V 4.7557 8.5349 125.9689 61.1436 34.0825 174.6841 137 V 4.3576 9.6716 127.5653 60.2782 34.7692 172.7077 138 G 3.6862 10.3581 114.2372 45.0094 0.0000 173.8405 139 G 3.5956 8.2014 115.9047 47.3522 0.0000 173.5385 140 T 4.6579 8.3249 119.3353 61.7946 70.9262 173.6446 141 V 5.2007 8.3643 118.7309 59.8088 36.0859 174.5630 142 R 4.7622 8.8521 118.0387 54.3431 33.5907 173.8942 143 A 4.2013 8.7509 121.1738 53.1075 18.6429 177.9607 144 G 4.1511 8.9018 111.0186 45.2473 0.0000 171.8628 145 N 5.0782 8.5591 117.7277 51.4496 40.4720 175.6021 146 C 4.4852 8.5258 120.7691 56.8762 41.2215 173.9380 147 G 3.4554 8.7795 109.9287 45.3003 0.0000 173.5164 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 10 L 8.04 4.29 0.00 1.78 1.74 0.93 0.11 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 11 L 8.62 4.78 0.00 1.70 1.53 0.91 0.71 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 12 L 10.03 4.76 0.00 1.62 1.84 0.88 0.82 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 13 Q 8.67 5.24 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 14 E 8.64 2.00 0.00 1.29 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 2.04 2.00 0.00 15 A 8.21 3.67 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 16 Q 7.60 4.63 0.00 2.21 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 17 A 8.53 4.17 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 18 G 9.23 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.02 4.75 0.00 3.32 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 20 C 8.15 4.66 0.00 2.64 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 21 R 6.36 4.64 0.00 1.69 1.48 0.00 3.06 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 22 V 8.37 4.70 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 0.91 0.00 0.00 0.97 0.00 0.00 23 D 9.40 4.45 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 24 G 7.69 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 25 T 8.58 4.72 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 26 I 8.13 4.60 1.69 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.61 0.60 0.00 0.00 27 D 8.25 4.74 0.00 1.81 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 28 N 7.83 4.13 0.00 2.55 2.41 0.00 0.00 5.95 8.04 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 29 N 8.31 4.84 0.00 2.85 2.94 0.00 0.00 6.03 7.90 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 30 H 8.48 5.21 0.00 3.38 3.52 0.00 5.71 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 31 T 8.55 4.12 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 32 G 8.58 4.13 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 0.00 0.00 0.00 33 F 7.24 3.40 0.00 3.28 2.88 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 34 T 8.69 4.51 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 1.07 0.00 0.00 35 G 8.39 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 0.00 0.00 0.00 36 S 8.63 4.65 0.00 3.94 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 37 G 7.87 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 0.00 0.00 0.00 38 F 7.25 5.14 0.00 3.53 3.29 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 39 A 9.47 4.78 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.39 5.44 0.00 2.89 2.84 0.00 0.00 6.65 7.23 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 41 T 8.56 4.57 4.27 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 1.25 0.00 0.00 42 N 8.83 4.22 0.00 2.65 2.82 0.00 0.00 7.19 6.83 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 43 N 8.54 5.25 0.00 2.62 2.93 0.00 0.00 6.69 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 44 A 7.64 4.68 1.20 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 45 Q 8.73 4.20 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.63 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 46 G 9.11 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 0.00 0.00 0.00 47 A 7.79 4.16 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 48 A 9.13 5.21 1.17 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 49 V 8.41 4.38 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.13 0.00 0.00 0.92 0.00 0.00 50 V 7.53 4.49 1.76 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 0.74 0.00 0.00 0.79 0.00 0.00 51 W 9.33 5.40 0.00 3.25 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 52 A 9.12 5.30 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 53 I 8.93 4.94 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.85 0.95 0.00 0.00 54 D 9.43 5.18 0.00 2.77 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 8.83 5.09 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 56 T 8.75 3.93 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 57 S 7.75 4.72 0.00 3.79 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 58 S 8.67 4.56 0.00 3.76 3.88 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 59 G 8.06 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 0.00 0.00 0.00 0.00 60 R 8.38 4.63 0.00 1.84 1.85 0.00 3.19 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 61 R 9.25 4.87 0.00 1.69 1.69 0.00 3.27 0.00 0.00 3.14 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.72 0.00 62 T 8.85 4.80 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 1.21 0.00 0.00 63 L 8.78 5.01 0.00 1.49 1.39 0.74 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 64 T 8.90 5.02 4.21 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 1.23 0.00 0.00 65 I 9.00 4.86 1.94 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 1.04 0.76 1.10 0.00 0.00 66 R 8.82 5.29 0.00 2.00 1.90 0.00 3.09 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 67 Y 9.20 5.86 0.00 3.36 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 68 A 8.77 4.45 -0.36 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 69 N 8.69 4.42 0.00 2.78 2.75 0.00 0.00 6.91 8.17 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 70 G 4.00 2.29 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 71 G 6.78 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 72 T 8.41 3.81 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 1.21 0.00 0.00 73 A 7.62 4.32 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 74 N 8.58 4.54 0.00 2.83 2.90 0.00 0.00 6.64 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 75 R 8.20 4.96 0.00 1.67 2.05 0.00 3.30 0.00 0.00 3.58 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 76 N 8.10 4.60 0.00 2.72 2.73 0.00 0.00 6.63 7.62 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 77 G 9.07 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 78 S 9.18 5.28 0.00 3.87 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 79 L 9.01 5.33 0.00 1.86 1.62 1.03 0.84 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 80 V 9.12 4.88 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 1.05 0.00 0.00 0.97 0.00 0.00 81 I 8.64 4.78 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.24 0.97 0.00 0.00 82 N 8.91 4.07 0.00 2.85 2.90 0.00 0.00 7.01 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 83 G 7.80 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 *87 G 8.44 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 88 N 7.61 4.90 0.00 2.55 2.74 0.00 0.00 6.68 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 89 Y 8.98 4.92 0.00 2.83 2.81 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 90 T 8.59 5.02 4.27 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 1.23 0.00 0.00 91 V 8.77 4.40 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 1.01 0.00 0.00 0.96 0.00 0.00 92 S 8.72 4.84 0.00 3.78 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 93 L 8.95 4.46 0.00 1.40 1.09 0.88 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 5.06 0.00 2.10 2.08 0.00 3.51 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.85 0.00 95 T 8.46 3.89 4.39 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 1.14 0.00 0.00 96 T 8.46 4.15 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 0.76 0.00 0.00 97 G 9.47 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 98 A 6.68 4.19 1.08 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 0.00 0.00 99 W 8.33 4.00 0.00 2.97 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.55 4.61 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 1.33 0.00 0.00 101 T 7.18 4.53 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 1.12 0.00 0.00 102 W 8.78 4.75 0.00 3.10 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 0.00 103 Q 8.60 4.75 0.00 1.33 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.71 0.00 0.00 0.00 0.00 0.00 2.00 2.24 0.00 104 T 8.54 5.46 4.34 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 1.27 0.00 0.00 105 A 9.31 4.99 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 0.00 106 T 8.38 5.06 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 1.22 0.00 0.00 107 I 8.40 4.45 1.83 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 1.15 1.26 0.77 0.00 0.00 108 D 8.69 5.20 0.00 2.70 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 0.00 109 V 8.45 4.15 1.59 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 -0.23 0.00 0.00 0.76 0.00 0.00 110 D 8.94 5.21 0.00 2.67 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 0.00 111 L 8.83 4.77 0.00 1.57 1.56 0.90 0.91 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 0.00 112 V 8.58 4.53 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 0.76 0.00 0.00 0.96 0.00 0.00 113 Q 8.22 3.94 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.11 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 114 G 9.24 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 0.00 0.00 0.00 115 N 8.44 5.03 0.00 2.76 2.74 0.00 0.00 6.59 7.79 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 0.00 116 N 9.28 5.33 0.00 2.75 2.68 0.00 0.00 6.74 6.86 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 0.00 117 I 9.19 4.70 1.90 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 1.13 1.13 0.92 0.00 0.00 118 V 9.13 4.84 2.35 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 1.23 0.00 0.00 0.98 0.00 0.00 119 Q 9.20 4.99 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 120 L 8.95 5.18 0.00 2.13 1.72 1.06 1.04 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 0.00 121 S 9.19 5.30 0.00 3.74 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 0.00 122 A 8.90 4.49 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 0.00 123 T 8.61 4.52 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 1.22 0.00 0.00 124 T 7.67 4.65 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 1.22 0.00 0.00 125 A 8.41 4.31 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 0.00 126 E 7.91 4.11 0.00 1.97 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 0.00 2.38 2.28 0.00 127 G 7.73 3.88 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 0.00 128 L 8.05 4.45 0.00 1.72 1.71 1.05 1.33 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 0.00 129 P 0.00 4.88 0.00 2.50 2.22 0.00 3.81 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 2.07 1.84 0.00 130 N 9.45 4.97 0.00 2.62 2.85 0.00 0.00 7.31 7.07 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 0.00 131 I 9.19 4.94 2.20 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.15 1.40 0.00 0.00 132 D 9.94 4.65 0.00 2.37 2.90 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 0.00 133 S 7.96 5.02 0.00 3.95 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 0.00 134 L 8.73 4.86 0.00 0.45 0.59 0.45 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 135 S 8.98 5.15 0.00 3.86 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 0.00 136 V 8.53 4.76 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 0.73 0.00 0.00 0.78 0.00 0.00 137 V 9.67 4.36 2.05 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 0.74 0.00 0.00 0.90 0.00 0.00 138 G 10.36 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 0.00 139 G 8.20 3.60 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 0.00 0.00 0.00 140 T 8.32 4.66 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 0.00 141 V 8.36 5.20 2.07 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 0.73 0.00 0.00 0.91 0.00 0.00 142 R 8.85 4.76 0.00 1.84 1.99 0.00 2.80 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 143 A 8.75 4.20 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 0.00 144 G 8.90 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 0.00 0.00 0.00 0.00 145 N 8.56 5.08 0.00 2.71 2.75 0.00 0.00 6.80 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 0.00 146 C 8.53 4.49 0.00 2.97 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 0.00 147 G 8.78 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 * Residues marked with a * may have inaccurate shift predictions.