NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 S 4.4139 8.3193 116.7860 57.4584 64.3049 173.3699 11 P 4.0645 0.0000 0.0000 62.6751 31.7362 174.9199 12 H 4.7840 8.0779 119.0319 52.7896 29.4549 172.7072 13 P 4.2244 0.0000 0.0000 62.6002 31.6527 176.7033 14 V 3.8933 8.2746 122.2710 62.2745 31.9461 175.3069 15 L 4.4758 8.4095 125.8625 54.5244 43.3669 176.2994 16 L 4.2873 7.4084 116.8679 52.8793 43.9444 176.3239 17 N 4.5746 8.2524 123.1133 51.1662 37.4064 175.7637 18 L 3.7354 8.1327 123.1307 57.5806 41.8899 179.8041 19 E 4.1701 8.0894 113.9273 58.3054 29.4999 177.2303 20 Q 4.5443 8.1715 116.3715 55.3794 29.1507 175.2921 21 F 4.8201 8.4129 122.0104 57.0056 40.1975 175.4630 22 L 3.8167 8.2708 128.4886 58.1669 41.8007 176.9659 23 P 4.1184 0.0000 0.0000 65.6452 31.1253 178.0389 24 Y 4.0688 7.9615 117.7002 60.8443 38.9466 177.7445 25 R 3.9564 8.3856 119.1853 59.4480 30.1833 179.1329 26 L 4.0234 8.2959 119.2603 57.6277 41.6309 179.7037 27 S 4.0758 8.0329 114.3694 61.3413 62.9902 176.7624 28 V 3.3841 7.7668 122.3185 65.4259 31.1888 177.6785 29 L 3.9232 7.8028 120.0808 58.2667 41.8429 178.8480 30 S 4.0822 8.1803 113.0098 61.4372 62.2616 175.8105 31 N 4.3198 8.2465 119.1347 56.4919 38.3212 177.6466 32 R 3.9221 8.0851 119.3365 59.1671 30.1643 179.1854 33 I 3.7242 8.0017 119.7853 64.6199 37.1528 178.6922 34 S 4.3398 8.4586 116.3351 61.5670 62.4048 177.0460 35 G 3.6160 8.0943 107.6847 47.8031 0.0000 175.2783 36 N 4.4721 8.2740 118.7988 56.2238 38.6704 177.6862 37 I 3.7207 7.9447 120.9212 64.0788 37.1159 178.1659 38 A 2.7945 7.8247 121.2295 53.8734 17.8853 179.5098 39 K 3.8499 7.3569 116.1761 58.8817 32.0573 179.0694 40 V 3.7431 7.2123 118.3987 64.8550 31.8387 175.9418 41 Y 4.7909 6.9102 113.6371 56.0494 39.1506 176.4132 42 G 3.6882 7.3892 109.2908 50.0803 0.0000 175.2149 43 D 4.3933 7.7688 121.9894 56.1304 41.7343 178.2433 44 R 3.8589 8.1670 118.5133 59.0109 30.0599 176.5562 45 Y 4.5857 8.2693 111.7809 56.5163 38.5266 175.3076 46 G 3.7024 8.0072 108.4427 45.8509 0.0000 173.4945 *48 A 4.2977 7.7725 125.9912 51.2282 21.1948 176.7694 49 I 4.4521 8.6072 123.1664 63.7085 37.2747 177.2298 50 P 4.3860 0.0000 0.0000 65.7942 31.1005 178.3358 51 E 3.9932 8.2343 118.0990 59.0197 29.4724 178.7942 52 W 4.1116 8.2601 128.4855 60.3259 30.6677 177.8733 53 R 3.6221 8.0564 118.7178 59.3842 29.4180 178.5716 54 V 3.5046 7.7118 117.8902 66.0007 31.5708 177.9611 55 I 3.4620 7.4664 119.6681 64.5620 36.7902 178.5186 56 T 3.4411 7.1635 110.4751 64.6031 68.3737 176.6321 57 I 3.6946 7.5919 122.5508 64.1963 36.9711 178.4745 58 L 4.1183 7.8382 118.4322 57.3259 41.3897 179.1376 59 A 3.7450 7.1786 120.2957 54.6884 18.2022 178.9985 60 L 3.8516 7.1258 117.8576 56.5617 43.6664 176.7323 61 Y 4.8300 8.0343 115.7539 55.1084 37.9707 172.8540 62 P 4.2804 0.0000 0.0000 64.1736 32.3347 177.3778 63 G 3.9950 8.9172 111.5020 45.0772 0.0000 174.1337 64 S 4.4002 7.3996 115.8990 58.5787 63.5648 174.5655 65 S 5.2264 8.7450 119.5107 56.3157 66.0367 175.3635 66 A 3.9775 8.3220 123.9040 55.2767 18.1023 179.8634 67 S 4.0278 8.0045 111.2326 61.7416 62.5203 176.2082 68 E 3.9741 8.1008 120.8226 59.0843 29.0058 179.4748 69 V 3.5633 7.6780 118.5362 66.1442 31.4022 178.3374 70 S 4.1249 8.0983 114.9283 61.5770 62.3956 175.8497 71 D 4.3726 7.9267 120.1085 57.4793 41.0946 177.8206 72 R 3.9985 8.0608 115.7639 58.6640 29.6126 177.5589 73 T 4.0931 7.6118 106.5884 60.7097 69.5764 173.0462 74 A 3.4140 7.6105 127.5508 52.3340 15.7634 175.2005 *76 D 4.3807 7.8557 117.7964 53.7940 43.2647 175.5191 77 K 4.1040 8.4992 127.3372 59.0106 32.1439 179.5804 78 V 3.5658 7.8319 117.9077 65.8778 31.5685 177.8040 79 A 4.0040 8.4991 120.7510 55.0917 18.1207 179.8439 80 V 3.5581 7.8822 116.8092 66.2749 31.5605 178.4915 81 S 4.1015 8.2807 115.0795 61.4881 62.6494 176.6879 82 R 3.8494 8.2262 121.2787 59.3261 29.7882 178.4547 83 A 4.0146 8.1165 120.6045 55.1296 18.4031 179.7424 84 V 3.4911 8.0937 116.7596 66.0198 31.5945 178.0247 85 A 3.9930 8.2025 120.6258 55.3928 18.2346 179.8943 86 R 3.8750 8.0727 116.4798 59.4093 30.1457 179.3777 87 L 4.0207 8.2139 118.9301 57.5322 41.6708 179.6067 88 L 4.0105 8.0550 119.2750 57.6937 41.3666 179.0257 89 E 3.9269 7.9623 118.3611 59.0650 29.6600 178.3189 90 R 3.9529 7.7627 117.1465 56.6164 30.1336 177.0468 91 G 3.9502 7.5241 105.5350 46.4159 0.0000 174.3831 92 F 5.0757 8.2825 120.3330 58.7664 40.0540 175.3909 93 I 5.2391 7.7564 110.4493 59.1038 41.1053 174.5107 94 R 4.7808 9.1614 118.2728 54.7808 33.2087 174.2460 95 R 4.6182 8.3929 119.1221 56.4324 31.7663 176.2706 96 E 3.3763 8.5749 115.0095 58.7544 31.0782 176.4592 *105 S 4.2593 7.1927 115.8071 57.6800 65.3708 172.6163 *107 L 4.6335 7.2701 119.7735 53.9557 43.5904 175.0294 108 A 4.8625 8.4765 121.6353 50.5454 23.1477 175.7391 109 L 4.4346 8.3603 119.4770 54.8407 42.6310 177.2417 110 S 4.6402 8.5844 117.2312 56.4821 65.3898 173.3712 111 P 4.1789 0.0000 0.0000 65.6731 30.8535 178.8923 112 A 4.0711 8.0261 119.4006 55.0664 18.3517 179.7924 113 G 3.2152 8.0310 104.2680 47.6729 0.0000 176.0128 114 R 3.8990 8.2023 121.2637 59.1159 30.0063 178.3980 115 Q 3.9612 8.0100 119.6772 58.9626 28.9548 178.4203 116 V 3.1921 7.2930 118.8651 65.8929 31.4236 177.1857 117 Y 4.3854 8.1001 119.4841 61.1571 38.4344 178.2285 118 E 3.8431 8.5040 117.8309 59.1053 29.5385 178.9768 119 T 4.1536 7.3900 115.0493 65.8415 69.0353 176.7161 120 V 3.7560 8.0175 119.8645 65.1994 31.6439 177.5407 121 A 4.1138 8.1700 121.0715 55.1077 18.0989 177.6846 122 P 4.1572 0.0000 0.0000 65.9488 31.1958 178.8585 123 L 4.0156 7.7575 115.9141 57.6647 41.6336 179.2917 124 V 3.7580 7.5632 117.5947 65.9696 31.7864 177.5234 125 N 4.5686 8.5208 116.6664 56.1262 38.3137 177.5205 126 E 4.0762 8.0033 117.3228 57.0490 29.6738 177.8491 *128 E 4.2984 8.1587 120.3062 55.8456 31.5665 177.7847 129 Q 4.1475 8.1997 116.9454 59.0805 28.9854 178.0591 130 R 4.0149 7.9082 115.8256 59.2884 30.0961 178.5125 131 L 3.9127 7.3289 113.7876 56.2655 41.4928 177.6978 *133 S 4.4493 7.9367 111.1779 57.7620 64.5387 174.5675 134 V 3.9080 7.6393 112.7602 61.5762 31.6506 175.5209 135 F 5.2973 7.6395 118.7099 55.3228 41.7214 175.8835 136 S 4.5218 9.3327 119.7962 57.5361 65.2267 175.3515 137 A 3.9787 8.5143 123.6729 55.3946 17.9371 179.4840 138 E 3.8584 8.1349 117.0609 59.5605 29.7330 178.6917 139 E 3.8612 8.0734 118.3502 59.3652 29.4962 179.1268 140 Q 3.6497 8.1754 119.6177 59.1721 29.1116 178.1696 141 Q 3.9204 8.1073 120.4997 59.3840 28.9795 178.3009 142 T 3.7890 8.1344 117.1370 66.4101 68.4480 176.2087 143 L 3.8009 7.8409 122.2423 58.3732 42.0555 178.8092 144 E 3.9569 8.0116 118.3832 59.4356 29.3625 179.5217 145 R 3.8485 8.0305 118.7171 59.4286 30.1763 178.6530 146 L 4.0120 8.2024 119.1505 57.6836 41.5948 179.5589 147 I 3.6993 8.1513 120.2981 64.5104 36.9712 178.1999 148 D 4.3860 8.3253 119.8936 57.4068 40.5073 179.1501 149 R 3.9198 7.9742 118.5876 59.1572 30.0275 179.0757 150 L 3.9525 7.9909 118.6536 57.6300 41.3713 179.5101 151 A 3.9582 7.8536 119.6773 55.0941 18.4495 179.5765 152 K 4.0940 8.1929 115.9930 59.0262 32.4290 178.5118 153 D 4.9200 8.2924 116.5914 54.4768 42.5376 178.6997 154 G 3.7293 7.8615 106.1994 47.3332 0.0000 175.5460 155 L 3.9839 7.7770 120.8454 56.9718 41.7077 177.3244 156 P 4.3666 0.0000 0.0000 65.0453 31.6958 176.3819 157 R 4.1381 7.5470 119.5340 55.7855 29.7632 176.2817 *159 A 4.1198 7.8220 124.9470 52.5300 18.8710 177.0342 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 S 8.32 4.41 0.00 3.85 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.06 0.00 2.22 2.00 0.00 3.67 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.02 0.00 12 H 8.08 4.78 0.00 3.14 3.24 0.00 5.71 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.22 0.00 2.16 2.06 0.00 3.81 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 14 V 8.27 3.89 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 0.76 0.00 0.00 0.90 0.00 0.00 15 L 8.41 4.48 0.00 1.57 1.60 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 16 L 7.41 4.29 0.00 1.31 1.10 0.65 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.25 4.57 0.00 2.87 2.74 0.00 0.00 7.02 6.74 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 18 L 8.13 3.74 0.00 1.13 0.14 0.57 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.09 4.17 0.00 2.14 2.11 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 2.31 2.27 0.00 20 Q 8.17 4.54 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 21 F 8.41 4.82 0.00 3.21 3.20 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 22 L 8.27 3.82 0.00 1.51 1.45 0.87 0.96 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 23 P 0.00 4.12 0.00 2.04 2.01 0.00 2.20 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.82 0.00 24 Y 7.96 4.07 0.00 3.26 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 R 8.39 3.96 0.00 2.04 2.01 0.00 3.46 0.00 0.00 3.53 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 26 L 8.30 4.02 0.00 1.63 1.69 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.03 4.08 0.00 4.02 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 0.00 28 V 7.77 3.38 1.83 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 0.88 0.00 0.00 0.21 0.00 0.00 29 L 7.80 3.92 0.00 1.87 1.70 0.94 0.89 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 30 S 8.18 4.08 0.00 4.02 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 31 N 8.25 4.32 0.00 2.98 2.84 0.00 0.00 7.05 7.17 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 32 R 8.09 3.92 0.00 2.01 1.97 0.00 3.12 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 33 I 8.00 3.72 2.03 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 1.55 1.10 0.96 0.00 0.00 34 S 8.46 4.34 0.00 4.03 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 35 G 8.09 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.27 4.47 0.00 2.95 2.85 0.00 0.00 7.01 6.56 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 37 I 7.94 3.72 2.07 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.19 1.03 0.00 0.00 38 A 7.82 2.79 1.15 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 39 K 7.36 3.85 0.00 1.79 1.79 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.53 7.81 40 V 7.21 3.74 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 0.79 0.00 0.00 0.85 0.00 0.00 41 Y 6.91 4.79 0.00 3.18 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 42 G 7.39 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 43 D 7.77 4.39 0.00 2.64 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 44 R 8.17 3.86 0.00 1.66 1.92 0.00 3.08 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 1.27 0.00 45 Y 8.27 4.59 0.00 3.27 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 46 G 8.01 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 0.00 0.00 0.00 *48 A 7.77 4.30 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 49 I 8.61 4.45 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 1.07 0.00 0.00 50 P 0.00 4.39 0.00 2.30 2.36 0.00 3.71 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 2.14 2.11 0.00 51 E 8.23 3.99 0.00 2.35 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 2.45 2.42 0.00 52 W 8.26 4.11 0.00 2.50 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 53 R 8.06 3.62 0.00 2.02 2.10 0.00 3.18 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 54 V 7.71 3.50 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.98 0.00 0.00 55 I 7.47 3.46 1.63 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 1.50 1.03 0.60 0.00 0.00 56 T 7.16 3.44 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 0.15 0.00 0.00 57 I 7.59 3.69 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.90 0.98 0.00 0.00 58 L 7.84 4.12 0.00 1.42 1.62 0.86 1.07 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 59 A 7.18 3.75 0.38 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 60 L 7.13 3.85 0.00 1.28 1.35 0.59 0.60 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 61 Y 8.03 4.83 0.00 3.01 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 62 P 0.00 4.28 0.00 2.01 1.95 0.00 3.62 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 1.96 2.16 0.00 63 G 8.92 3.99 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 0.00 0.00 0.00 64 S 7.40 4.40 0.00 3.82 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 65 S 8.75 5.23 0.00 4.04 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 66 A 8.32 3.98 1.32 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 0.00 0.00 67 S 8.00 4.03 0.00 3.88 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 68 E 8.10 3.97 0.00 2.16 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 0.00 2.27 2.27 0.00 69 V 7.68 3.56 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.93 0.00 0.00 70 S 8.10 4.12 0.00 4.06 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 71 D 7.93 4.37 0.00 2.73 2.82 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 72 R 8.06 4.00 0.00 1.91 1.95 0.00 3.03 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.54 0.00 73 T 7.61 4.09 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 1.24 0.00 0.00 74 A 7.61 3.41 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 *76 D 7.86 4.38 0.00 2.84 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 77 K 8.50 4.10 0.00 1.84 1.84 0.00 1.99 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.36 7.81 78 V 7.83 3.57 2.32 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 1.05 0.00 0.00 0.94 0.00 0.00 79 A 8.50 4.00 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 80 V 7.88 3.56 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 1.10 0.00 0.00 1.01 0.00 0.00 81 S 8.28 4.10 0.00 4.04 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 82 R 8.23 3.85 0.00 1.94 2.11 0.00 3.11 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 83 A 8.12 4.01 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.09 3.49 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 0.99 0.00 0.00 0.95 0.00 0.00 85 A 8.20 3.99 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 86 R 8.07 3.88 0.00 2.03 1.98 0.00 3.14 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 87 L 8.21 4.02 0.00 1.83 1.77 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.05 4.01 0.00 1.87 1.70 0.92 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 89 E 7.96 3.93 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 90 R 7.76 3.95 0.00 1.63 1.51 0.00 3.03 0.00 0.00 2.45 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 91 G 7.52 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 92 F 8.28 5.08 0.00 2.91 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 93 I 7.76 5.24 1.97 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.67 0.93 0.00 0.00 94 R 9.16 4.78 0.00 1.79 2.01 0.00 2.76 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 95 R 8.39 4.62 0.00 1.81 1.88 0.00 3.25 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.59 0.00 96 E 8.57 3.38 0.00 2.14 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 *105 S 7.19 4.26 0.00 4.04 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 *107 L 7.27 4.63 0.00 1.73 1.65 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.48 4.86 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 0.00 109 L 8.36 4.43 0.00 1.44 1.51 0.53 0.72 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 0.00 110 S 8.58 4.64 0.00 3.94 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 0.00 111 P 0.00 4.18 0.00 2.19 2.15 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 112 A 8.03 4.07 1.50 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 0.00 0.00 113 G 8.03 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 0.00 0.00 0.00 114 R 8.20 3.90 0.00 1.84 2.05 0.00 3.10 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 115 Q 8.01 3.96 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 116 V 7.29 3.19 1.75 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 0.31 0.00 0.00 0.01 0.00 0.00 117 Y 8.10 4.39 0.00 3.01 3.11 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 0.00 118 E 8.50 3.84 0.00 1.94 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 2.41 2.77 0.00 119 T 7.39 4.15 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 1.32 0.00 0.00 120 V 8.02 3.76 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 0.17 0.00 0.00 0.87 0.00 0.00 121 A 8.17 4.11 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 0.00 122 P 0.00 4.16 0.00 2.14 2.09 0.00 3.55 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.12 0.00 123 L 7.76 4.02 0.00 1.71 1.70 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 124 V 7.56 3.76 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 1.00 0.00 0.00 0.89 0.00 0.00 125 N 8.52 4.57 0.00 2.93 2.86 0.00 0.00 6.66 8.14 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 0.00 126 E 8.00 4.08 0.00 2.04 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 2.30 2.31 0.00 *128 E 8.16 4.30 0.00 2.17 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 0.00 2.32 2.34 0.00 129 Q 8.20 4.15 0.00 2.32 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 130 R 7.91 4.01 0.00 1.82 1.98 0.00 3.16 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 131 L 7.33 3.91 0.00 1.69 1.91 0.94 1.01 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 *133 S 7.94 4.45 0.00 4.04 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 V 7.64 3.91 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 0.61 0.00 0.00 0.37 0.00 0.00 135 F 7.64 5.30 0.00 3.04 2.79 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 0.00 136 S 9.33 4.52 0.00 4.07 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 0.00 137 A 8.51 3.98 1.35 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 0.00 138 E 8.13 3.86 0.00 2.05 1.96 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 2.36 2.39 0.00 139 E 8.07 3.86 0.00 2.29 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 0.00 2.37 2.37 0.00 140 Q 8.18 3.65 0.00 2.13 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.32 0.00 141 Q 8.11 3.92 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 142 T 8.13 3.79 4.30 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 1.16 0.00 0.00 143 L 7.84 3.80 0.00 1.38 1.58 0.84 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 144 E 8.01 3.96 0.00 2.16 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 2.31 2.41 0.00 145 R 8.03 3.85 0.00 1.98 2.08 0.00 3.08 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 146 L 8.20 4.01 0.00 1.81 1.67 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 147 I 8.15 3.70 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.03 0.90 0.00 0.00 148 D 8.33 4.39 0.00 2.85 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 0.00 149 R 7.97 3.92 0.00 2.03 1.96 0.00 3.11 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 150 L 7.99 3.95 0.00 1.86 1.69 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 151 A 7.85 3.96 1.35 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 0.00 152 K 8.19 4.09 0.00 1.82 1.87 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.61 7.81 153 D 8.29 4.92 0.00 2.68 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 G 7.86 3.73 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 0.00 0.00 0.00 155 L 7.78 3.98 0.00 1.76 1.76 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 156 P 0.00 4.37 0.00 2.17 2.18 0.00 3.63 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 2.13 2.12 0.00 157 R 7.55 4.14 0.00 1.99 1.97 0.00 3.19 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 *159 A 7.82 4.12 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 * Residues marked with a * may have inaccurate shift predictions.