NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 F 4.2992 8.3249 119.4238 56.2194 40.6328 174.6093 3 P 4.2902 0.0000 0.0000 61.8994 31.7977 176.1657 4 A 4.1353 9.7397 127.0302 54.7771 19.6589 178.0772 5 R 4.6615 8.0733 112.4401 55.7385 30.8532 177.5776 6 W 4.4335 8.4822 131.1711 60.9684 30.6992 177.2658 7 H 4.4387 8.3430 112.5125 57.0614 28.3458 175.4882 8 N 4.3527 7.9324 116.4391 54.0283 38.5562 174.5753 9 Y 4.5267 6.8219 115.5492 55.2423 41.6526 175.2859 10 L 3.8143 8.8669 122.8909 55.3489 42.5097 178.5853 11 Q 3.2947 8.2946 120.8564 58.6041 28.7765 175.6567 12 C 5.1755 6.9729 115.0964 57.7245 34.8989 174.5961 13 G 4.0026 9.0374 113.8391 45.7772 0.0000 172.6149 14 Q 4.6501 8.5312 119.8467 54.2087 30.6135 176.3709 15 V 3.9892 8.1922 120.6145 63.0767 32.0357 175.8134 16 I 3.9709 8.6654 129.4232 60.7894 37.7525 176.1282 17 K 3.8119 8.8299 126.8306 58.4147 32.6802 176.1878 18 D 4.4257 8.8039 125.1100 54.6401 38.3924 172.2755 19 S 4.6756 7.7076 110.5079 57.8511 66.3663 173.2435 20 N 5.0466 8.7741 114.4278 52.6841 38.4767 173.5289 21 L 5.2328 8.1206 119.6760 53.8773 44.1328 175.4406 22 I 5.0615 8.6358 122.2911 59.5929 41.8621 173.5766 23 C 5.8281 8.9842 124.8920 57.3518 32.2416 172.6534 24 F 5.3841 7.8306 115.2862 55.8378 41.0090 173.1713 25 K 4.4055 8.7297 119.3417 56.2347 33.7248 176.7724 26 T 4.2558 8.7356 116.8136 61.7094 67.7935 172.2707 27 P 4.9873 0.0000 0.0000 62.9593 32.4951 174.6478 28 L 5.2730 8.4096 119.3678 51.5040 45.9717 176.7841 29 R 4.1612 8.1766 118.6875 55.3659 30.8435 176.3231 30 P 4.5039 0.0000 0.0000 65.9099 31.6186 178.6187 31 E 3.9685 8.1522 116.4592 59.1844 29.5702 178.0468 32 L 4.0055 7.5044 119.9918 57.5027 43.0454 178.2252 33 F 4.8107 7.2453 124.5767 57.3958 38.1625 175.4105 *42 V 3.6275 8.0529 121.1449 62.0695 32.5533 175.7147 43 W 4.7654 7.9532 132.4134 56.3083 29.2294 175.1509 44 T 4.8053 7.3497 113.8360 58.7380 72.5188 174.8670 45 A 3.3463 7.8816 122.2904 55.2353 18.0957 179.4802 46 E 3.7648 7.7311 117.0524 59.4257 29.6665 178.8707 47 Q 3.9700 7.6735 117.8689 58.7759 28.7021 178.7354 48 I 3.0524 7.2742 120.8582 64.0418 36.8186 178.6055 49 V 3.5176 7.3995 117.5605 65.8396 31.4884 177.4585 50 K 3.9984 8.0954 118.2402 59.8581 32.1488 178.3658 51 Q 4.3000 8.1999 116.0897 56.9958 30.4340 176.1028 52 N 5.0715 7.8257 117.2794 50.5844 38.9054 173.2919 53 P 4.3092 0.0000 0.0000 65.2350 32.2413 178.3565 54 S 4.2886 7.9718 112.3936 59.3355 62.7511 172.9128 55 I 4.3786 7.6547 121.8071 61.9425 36.9532 176.1150 56 G 4.0611 9.3275 114.1874 46.4542 0.0000 172.6591 57 A 5.0918 7.4779 120.5890 50.8795 22.9349 175.1408 58 I 5.0529 8.7088 120.6065 59.5943 41.3737 174.4969 59 I 4.8210 9.1002 128.0607 59.6252 39.6141 174.0172 60 D 4.8255 8.9306 128.0642 52.7562 42.7082 176.1239 61 L 5.5880 9.1439 126.1263 54.0074 42.6565 177.2059 62 T 4.3955 8.5067 110.9123 61.9525 69.5731 174.0671 63 N 4.6737 8.2661 121.1733 52.8396 38.9740 173.8004 64 T 4.1544 7.1355 109.1392 62.1692 70.1693 172.2274 65 S 4.6270 8.4523 118.8943 58.2553 63.5714 175.5032 66 K 4.1059 7.4282 120.0698 58.4758 32.3759 178.1281 67 Y 4.4682 7.7574 117.1643 60.9295 38.0378 174.8313 68 Y 4.5401 7.2963 114.0659 56.5821 40.5061 172.4620 69 D 4.5744 8.3780 119.7813 52.2004 42.0394 177.1014 70 G 2.8491 8.1379 116.4646 47.5961 0.0000 174.8280 71 V 3.5173 7.6661 119.3312 66.4921 30.6884 177.6396 72 H 4.0995 7.9308 115.5839 58.6623 28.4261 177.7967 73 F 4.4507 7.8659 119.5974 60.5333 38.7764 177.6278 74 L 4.3625 7.9368 119.5141 57.4009 41.2651 179.4502 75 R 3.9007 8.2960 117.5157 58.8467 30.0252 177.3835 76 A 4.4715 7.4251 117.2350 51.7866 18.9916 177.8482 77 G 3.8928 8.1397 106.3374 45.1839 0.0000 173.8026 78 L 4.6633 7.7548 119.7457 53.5425 43.5678 176.4830 79 L 4.1972 8.2833 121.7345 55.0135 43.0581 175.4990 80 Y 5.3255 8.1411 121.4377 56.3645 42.0422 173.9626 81 K 4.4671 8.6442 126.6867 54.7524 36.2930 174.6278 82 K 4.6836 8.3830 126.2057 55.3657 33.7118 176.3365 83 I 4.4123 8.6319 125.7580 59.1052 39.6123 174.3460 84 Q 4.5565 8.6051 126.0898 55.3270 29.3084 176.0458 85 V 4.2836 8.2614 124.7816 60.2055 33.1444 173.4996 86 P 4.4012 0.0000 0.0000 62.5561 31.8145 177.1118 87 G 3.7798 8.6126 112.4147 46.5542 0.0000 172.7301 88 Q 3.9635 8.6199 121.9516 56.5550 26.9138 174.7558 89 T 4.0087 7.5380 113.4706 63.0395 69.1495 174.1992 90 L 3.6071 8.3543 127.3192 54.1457 42.5794 175.0268 91 P 4.1655 0.0000 0.0000 61.8883 31.9273 175.0791 92 P 4.3099 0.0000 0.0000 62.7660 33.1658 177.0430 93 E 3.9972 8.8268 121.1766 59.4921 29.5568 179.4905 94 S 4.1040 8.0263 113.9458 61.4197 62.9589 176.4370 95 I 3.8144 7.5478 122.9109 63.8285 36.9943 178.1974 96 V 3.6160 7.8161 119.2421 66.1329 31.2840 177.9333 97 Q 3.9287 8.3690 119.4876 59.0186 28.8897 177.6185 98 E 3.8632 8.1483 120.3725 59.1755 29.5655 178.5250 99 F 3.9887 8.5030 120.8666 61.3692 39.4872 177.1270 100 I 3.7168 8.0330 119.3305 64.5988 36.8783 178.0215 101 D 4.3454 8.3037 119.9733 57.8447 40.5756 179.2761 102 T 3.3696 7.6246 116.0322 66.1861 68.2838 177.0022 103 V 3.1593 7.2215 120.3773 65.7587 31.3937 178.2551 104 K 3.9786 7.9113 118.0775 59.3839 31.9055 178.9342 105 E 3.9472 8.2213 119.6954 59.5000 29.4750 178.9826 106 F 4.5558 8.4969 118.2191 60.7029 38.6676 177.8819 107 T 3.8858 8.0055 115.0133 66.6573 68.3687 175.8629 108 E 4.1024 8.0405 119.7856 59.2005 29.8128 178.4702 109 K 4.2889 8.0253 115.8934 57.3095 33.8508 176.6738 110 C 4.9154 7.7677 116.6384 57.3852 28.5344 172.2923 111 P 4.4687 0.0000 0.0000 64.1537 31.7256 177.4801 112 G 3.9010 8.9437 108.9923 46.0751 0.0000 172.4780 113 M 4.9160 7.7903 118.0487 53.1736 35.2815 175.4342 114 L 4.6518 8.9437 120.3640 54.2767 44.1294 176.1138 115 V 4.6503 8.9709 122.3131 61.3234 33.5600 174.7825 116 G 4.5741 9.3483 116.3149 45.3764 0.0000 172.4794 117 V 5.1337 8.6317 124.0032 61.1578 34.9291 173.9644 118 H 5.1793 8.8937 121.7956 54.2689 32.0053 171.8051 119 C 5.1516 8.0155 114.3600 58.4987 32.2587 174.7549 120 T 4.1092 8.9916 111.2241 67.0578 68.5732 176.3919 121 H 4.4637 8.4004 114.9342 54.9642 29.9703 175.4296 122 G 4.0310 8.2003 106.0058 47.1555 0.0000 173.5936 123 I 4.5125 7.3356 116.7522 62.4196 40.1733 177.7168 124 N 4.4484 7.8671 116.5484 56.2395 38.9188 177.9056 125 R 4.0181 7.8969 118.6281 59.6603 30.2738 179.1071 126 T 3.7736 7.9247 115.1022 66.5050 68.5139 176.6672 127 G 2.0826 7.5937 107.1828 47.3057 0.0000 175.0346 128 Y 3.8025 8.0763 122.5898 60.5111 38.7985 178.0836 129 M 3.6158 7.8153 119.5256 58.1841 31.8062 178.9223 130 V 3.7894 7.6517 118.6555 66.2000 31.5996 177.8407 131 C 4.0842 7.8685 116.3342 62.9133 28.0039 176.1179 132 R 3.7216 7.6543 119.6297 59.4263 29.5111 178.4744 133 Y 4.1026 8.2213 119.0610 60.8176 38.8691 178.1396 134 L 3.8454 8.3476 120.1695 57.9467 41.6805 179.4956 135 M 4.1329 8.3015 119.0323 58.4818 31.6655 178.2979 136 H 4.0349 7.9381 117.4451 59.5287 30.1882 177.1212 137 T 3.8848 7.6347 110.3324 63.8067 68.9055 175.8243 138 L 4.4908 7.8151 119.3144 53.2176 42.7643 177.2569 139 G 3.8542 7.7713 106.5041 46.0859 0.0000 173.9423 140 I 4.0093 7.5048 111.6906 59.5592 38.8472 176.0302 141 A 4.2386 8.2092 123.2767 51.1664 20.3607 176.9680 142 P 4.1638 0.0000 0.0000 66.1626 31.1434 178.9137 143 Q 4.0153 8.0489 117.2430 58.8218 28.6404 178.3241 144 E 3.9181 8.1584 119.5822 58.9799 29.7700 178.4257 145 A 4.0120 8.2071 120.9760 55.3515 18.4333 179.6370 146 I 3.7690 8.2614 118.5763 64.7297 37.1100 178.4112 147 D 4.4139 8.3991 119.8206 57.5065 40.7384 179.1870 148 R 3.9375 8.2947 118.6403 59.0470 29.9877 178.8360 149 F 4.1647 8.4236 120.4544 61.5131 39.4787 177.1299 150 E 3.9431 8.6035 119.8831 58.4659 29.0283 179.1036 151 K 3.8201 8.0606 118.8041 59.5738 32.5753 178.4060 152 A 4.0682 7.7071 120.4129 55.1583 18.0842 179.6481 153 R 3.7831 7.5945 116.6379 57.5849 30.1798 177.7603 154 G 3.9275 8.7127 105.9490 45.2156 0.0000 172.6383 155 H 4.9691 7.5138 115.2816 53.8770 32.8684 172.5686 156 K 4.6238 8.4234 120.6502 55.0938 33.4133 177.0617 157 I 4.0108 8.8180 123.3984 61.8348 37.6707 175.9648 158 E 4.3682 9.2274 124.2886 58.1528 30.8187 177.6929 159 R 3.8878 7.9168 119.0402 55.9964 30.8028 177.4291 160 Q 4.0501 8.6534 124.2906 58.9344 28.9127 178.4565 161 N 4.5914 8.1058 117.6509 56.0197 37.4149 176.9064 162 Y 4.0446 7.9931 118.6731 61.0143 38.2355 178.3302 163 V 3.7062 7.9617 119.2072 66.0467 31.6533 177.9454 164 Q 4.0373 8.6891 118.2228 59.1803 28.3740 178.4890 165 D 4.4331 7.9479 117.6002 57.3842 41.3342 177.9680 166 L 4.1128 7.9381 118.6089 57.3817 41.6610 178.7383 167 L 4.3744 7.6755 117.2039 55.5552 42.1801 176.8051 168 I 4.0946 8.2372 123.8807 61.3003 37.4500 175.1809 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 F 8.32 4.30 0.00 2.93 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 3 P 0.00 4.29 0.00 2.43 2.06 0.00 3.33 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.83 0.00 4 A 9.74 4.14 1.37 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 0.00 0.00 0.00 5 R 8.07 4.66 0.00 2.03 2.05 0.00 3.19 0.00 0.00 3.30 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 6 W 8.48 4.43 0.00 3.55 3.31 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 7 H 8.34 4.44 0.00 3.26 3.32 0.00 5.75 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 N 7.93 4.35 0.00 2.12 2.07 0.00 0.00 6.71 6.82 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 9 Y 6.82 4.53 0.00 2.83 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.87 3.81 0.00 1.73 1.55 0.80 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.29 3.29 0.00 0.93 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.84 0.00 0.00 0.00 0.00 0.00 1.79 1.16 0.00 12 C 6.97 5.18 0.00 2.73 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 13 G 9.04 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 14 Q 8.53 4.65 0.00 1.89 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 15 V 8.19 3.99 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 0.83 0.00 0.00 0.98 0.00 0.00 16 I 8.67 3.97 1.96 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.72 1.00 0.00 0.00 17 K 8.83 3.81 0.00 1.73 1.76 0.00 1.94 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.49 7.81 18 D 8.80 4.43 0.00 2.84 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 19 S 7.71 4.68 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 20 N 8.77 5.05 0.00 2.94 3.06 0.00 0.00 5.85 6.67 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 21 L 8.12 5.23 0.00 1.72 1.69 1.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.64 5.06 1.99 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 1.49 2.01 1.14 0.00 0.00 23 C 8.98 5.83 0.00 2.94 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 24 F 7.83 5.38 0.00 3.62 3.33 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 0.00 25 K 8.73 4.41 0.00 1.92 1.90 0.00 0.61 0.00 0.00 1.09 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.13 7.81 26 T 8.74 4.26 4.66 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 1.18 0.00 0.00 27 P 0.00 4.99 0.00 1.69 1.50 0.00 3.51 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.46 0.00 28 L 8.41 5.27 0.00 0.96 0.94 -0.91 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 29 R 8.18 4.16 0.00 1.76 2.00 0.00 3.10 0.00 0.00 3.45 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.92 0.00 30 P 0.00 4.50 0.00 2.19 2.15 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.11 0.00 31 E 8.15 3.97 0.00 1.88 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 2.30 2.36 0.00 32 L 7.50 4.01 0.00 1.20 1.19 0.71 -0.08 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 33 F 7.25 4.81 0.00 3.24 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 *42 V 8.05 3.63 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.59 0.00 0.00 43 W 7.95 4.77 0.00 3.57 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 44 T 7.35 4.81 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 1.30 0.00 0.00 45 A 7.88 3.35 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 7.73 3.76 0.00 1.96 1.82 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 2.31 2.38 0.00 47 Q 7.67 3.97 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.28 2.73 0.00 48 I 7.27 3.05 1.73 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 -0.30 -0.36 0.36 0.00 0.00 49 V 7.40 3.52 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.15 0.00 0.00 50 K 8.10 4.00 0.00 1.97 1.94 0.00 1.82 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.48 7.81 51 Q 8.20 4.30 0.00 2.18 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.01 0.00 0.00 0.00 0.00 0.00 2.44 2.56 0.00 52 N 7.83 5.07 0.00 2.82 2.69 0.00 0.00 6.57 8.08 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 53 P 0.00 4.31 0.00 2.18 2.19 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 54 S 7.97 4.29 0.00 3.89 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 55 I 7.65 4.38 1.95 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 1.22 0.67 0.92 0.00 0.00 56 G 9.33 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 57 A 7.48 5.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.71 5.05 1.93 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 0.76 -0.36 1.13 0.00 0.00 59 I 9.10 4.82 1.94 0.00 0.00 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 1.00 0.93 0.96 0.00 0.00 60 D 8.93 4.83 0.00 3.18 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 61 L 9.14 5.59 0.00 1.65 1.64 0.71 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 62 T 8.51 4.40 4.59 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 0.00 0.00 0.00 1.63 0.00 0.00 63 N 8.27 4.67 0.00 2.91 2.86 0.00 0.00 6.81 7.70 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 64 T 7.14 4.15 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 0.70 0.00 0.00 65 S 8.45 4.63 0.00 3.81 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 66 K 7.43 4.11 0.00 1.41 1.70 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.39 7.81 67 Y 7.76 4.47 0.00 3.32 3.26 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 68 Y 7.30 4.54 0.00 2.98 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 69 D 8.38 4.57 0.00 2.75 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 70 G 8.14 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 0.00 0.00 0.00 71 V 7.67 3.52 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 0.96 0.00 0.00 0.95 0.00 0.00 72 H 7.93 4.10 0.00 3.07 3.11 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 F 7.87 4.45 0.00 3.24 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.94 4.36 0.00 1.85 1.75 0.98 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 75 R 8.30 3.90 0.00 1.86 2.09 0.00 3.18 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 76 A 7.43 4.47 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 77 G 8.14 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 0.00 0.00 0.00 78 L 7.75 4.66 0.00 1.95 1.54 1.01 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.28 4.20 0.00 0.55 0.73 0.57 0.46 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 80 Y 8.14 5.33 0.00 3.02 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 81 K 8.64 4.47 0.00 1.99 1.49 0.00 1.57 0.00 0.00 1.43 0.00 0.00 2.74 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.22 1.37 7.81 82 K 8.38 4.68 0.00 1.65 1.71 0.00 1.90 0.00 0.00 1.79 0.00 0.00 2.74 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.48 7.81 83 I 8.63 4.41 1.91 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 1.19 0.69 0.93 0.00 0.00 84 Q 8.61 4.56 0.00 1.94 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.83 0.00 0.00 0.00 0.00 0.00 2.54 2.20 0.00 85 V 8.26 4.28 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 0.74 0.00 0.00 0.94 0.00 0.00 86 P 0.00 4.40 0.00 1.98 1.98 0.00 3.72 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 87 G 8.61 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 88 Q 8.62 3.96 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 89 T 7.54 4.01 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 1.20 0.00 0.00 90 L 8.35 3.61 0.00 1.49 1.46 0.41 1.00 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 91 P 0.00 4.17 0.00 1.94 1.85 0.00 2.43 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.76 0.00 92 P 0.00 4.31 0.00 2.13 1.96 0.00 3.56 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 93 E 8.83 4.00 0.00 2.07 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 2.38 2.43 0.00 94 S 8.03 4.10 0.00 4.08 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 95 I 7.55 3.81 1.98 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 1.51 0.94 0.90 0.00 0.00 96 V 7.82 3.62 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 0.99 0.00 0.00 1.07 0.00 0.00 97 Q 8.37 3.93 0.00 2.27 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 98 E 8.15 3.86 0.00 2.19 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 2.25 2.27 0.00 99 F 8.50 3.99 0.00 3.10 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 0.00 100 I 8.03 3.72 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.14 1.00 0.00 0.00 101 D 8.30 4.35 0.00 2.77 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 0.00 102 T 7.62 3.37 3.84 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 0.00 0.00 0.12 0.00 0.00 103 V 7.22 3.16 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 0.13 0.00 0.00 -0.29 0.00 0.00 104 K 7.91 3.98 0.00 2.00 1.86 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.78 7.81 105 E 8.22 3.95 0.00 2.07 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 2.33 2.58 0.00 106 F 8.50 4.56 0.00 3.02 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 0.00 107 T 8.01 3.89 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 1.26 0.00 0.00 108 E 8.04 4.10 0.00 2.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 109 K 8.03 4.29 0.00 1.83 1.85 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.70 1.69 7.81 110 C 7.77 4.92 0.00 2.99 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 0.00 111 P 0.00 4.47 0.00 2.18 2.08 0.00 3.94 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 1.99 1.98 0.00 112 G 8.94 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 0.00 113 M 7.79 4.92 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.79 0.00 114 L 8.94 4.65 0.00 1.59 1.71 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.97 4.65 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 0.99 0.00 0.00 0.98 0.00 0.00 116 G 9.35 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.63 5.13 2.12 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 1.11 0.00 0.00 1.04 0.00 0.00 118 H 8.89 5.18 0.00 3.41 2.47 0.00 5.45 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 C 8.02 5.15 0.00 3.10 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 0.00 120 T 8.99 4.11 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 1.01 0.00 0.00 121 H 8.40 4.46 0.00 2.79 2.59 0.00 5.97 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 8.20 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 0.00 123 I 7.34 4.51 1.67 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.46 0.97 0.00 0.00 124 N 7.87 4.45 0.00 2.68 2.65 0.00 0.00 6.94 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 0.00 125 R 7.90 4.02 0.00 1.89 1.97 0.00 3.27 0.00 0.00 3.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.90 0.00 126 T 7.92 3.77 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 1.29 0.00 0.00 127 G 7.59 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 0.00 0.00 0.00 0.00 0.00 0.00 128 Y 8.08 3.80 0.00 2.97 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 0.00 129 M 7.82 3.62 0.00 0.51 1.28 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.52 0.00 130 V 7.65 3.79 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 1.33 0.00 0.00 1.11 0.00 0.00 131 C 7.87 4.08 0.00 2.95 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 0.00 132 R 7.65 3.72 0.00 1.79 1.86 0.00 2.93 0.00 0.00 2.62 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.23 0.00 133 Y 8.22 4.10 0.00 3.33 3.33 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 0.00 134 L 8.35 3.85 0.00 1.89 1.71 1.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 135 M 8.30 4.13 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.65 0.00 136 H 7.94 4.03 0.00 3.14 3.36 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 T 7.63 3.88 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 0.58 0.00 0.00 138 L 7.82 4.49 0.00 1.68 1.70 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 139 G 7.77 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 I 7.50 4.01 1.87 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 1.45 0.62 0.90 0.00 0.00 141 A 8.21 4.24 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 0.00 142 P 0.00 4.16 0.00 2.27 2.41 0.00 3.70 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.14 0.00 143 Q 8.05 4.02 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.50 0.00 144 E 8.16 3.92 0.00 2.08 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 2.38 2.45 0.00 145 A 8.21 4.01 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 0.00 146 I 8.26 3.77 1.96 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 1.55 0.82 1.06 0.00 0.00 147 D 8.40 4.41 0.00 2.91 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 0.00 148 R 8.29 3.94 0.00 2.07 2.04 0.00 3.17 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.84 0.00 149 F 8.42 4.16 0.00 3.19 3.26 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 0.00 150 E 8.60 3.94 0.00 2.13 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 2.67 2.60 0.00 151 K 8.06 3.82 0.00 1.81 1.85 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.49 7.81 152 A 7.71 4.07 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 R 7.59 3.78 0.00 0.88 1.41 0.00 3.21 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.60 0.00 154 G 8.71 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 0.00 0.00 0.00 155 H 7.51 4.97 0.00 3.19 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.42 4.62 0.00 1.81 1.90 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.56 1.49 7.81 157 I 8.82 4.01 1.97 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.73 1.06 0.00 0.00 158 E 9.23 4.37 0.00 2.04 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 2.33 2.50 0.00 159 R 7.92 3.89 0.00 1.27 1.49 0.00 2.45 0.00 0.00 2.95 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.28 0.00 160 Q 8.65 4.05 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.90 0.00 0.00 0.00 0.00 0.00 2.45 2.37 0.00 161 N 8.11 4.59 0.00 2.96 3.10 0.00 0.00 6.27 7.57 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 0.00 162 Y 7.99 4.04 0.00 3.16 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 0.00 163 V 7.96 3.71 2.25 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 1.08 0.00 0.00 1.07 0.00 0.00 164 Q 8.69 4.04 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.41 2.70 0.00 165 D 7.95 4.43 0.00 2.87 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 L 7.94 4.11 0.00 1.88 1.69 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 167 L 7.68 4.37 0.00 1.68 1.73 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 168 I 8.24 4.09 1.99 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 1.17 0.61 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.