NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 5.2458 8.2148 121.8719 56.7647 32.8835 173.4881 3 R 5.0222 8.5474 124.9896 53.8660 32.7400 173.4709 4 I 4.9968 9.2478 124.7262 59.4810 40.6153 174.3391 5 G 3.7884 9.1706 113.8506 44.5018 0.0000 172.1519 6 L 5.0845 8.4554 127.2879 53.5905 44.5626 175.0629 7 T 5.5236 8.6218 120.5502 59.4042 71.8374 172.0005 8 G 4.3686 7.9284 109.6057 46.6303 0.0000 172.0356 9 N 4.7783 7.7929 117.1583 51.3072 40.0677 174.8097 10 I 3.8588 8.3813 121.0219 62.8855 38.2432 176.2816 11 G 4.1433 9.2414 115.2021 45.7729 0.0000 174.2763 12 C 4.2013 7.9217 116.4229 59.9128 28.9822 173.3507 13 G 3.7644 8.1095 107.5750 46.7258 0.0000 175.4776 14 K 4.1075 7.8278 119.3739 59.5393 33.1936 178.2305 15 S 4.6997 7.9152 116.8292 60.4220 62.6450 176.2402 16 T 3.9916 7.4068 118.4195 66.1063 68.2580 176.8804 17 V 3.6863 7.6559 118.8562 65.9471 32.0726 177.1264 18 A 4.2919 8.4639 120.9554 55.5522 18.1064 180.2377 19 Q 3.5998 7.9961 115.3862 57.1266 29.6968 178.4160 *21 F 4.2831 8.0217 118.3864 57.0920 41.2102 177.4915 22 R 4.7420 7.9769 118.7267 58.8935 29.9673 178.9189 23 E 3.9837 7.8414 115.6559 59.3393 29.4634 178.4365 24 L 3.8896 7.2161 116.6230 54.9870 41.8567 176.6800 25 G 3.7357 7.9679 109.5529 45.6556 0.0000 174.6871 26 A 4.3004 7.8418 121.4024 52.5092 20.1013 176.2267 27 Y 4.7217 8.7644 121.0163 56.1824 40.3070 174.3912 28 V 4.6221 8.0495 126.9307 60.9417 33.6093 174.3703 29 L 4.5064 8.4766 130.3542 53.2403 44.5535 175.3188 30 D 4.8276 8.7116 126.1663 53.5862 39.9792 175.8141 31 A 3.9971 8.7720 128.6048 54.9183 18.3999 178.8673 32 D 4.2359 7.9918 115.9853 57.3161 40.9823 178.4227 33 K 4.0748 8.7499 120.6266 58.8294 32.1372 178.7947 34 L 3.8810 7.6086 120.4255 58.2860 41.9124 178.9971 35 I 2.2408 7.3420 118.3427 64.1012 37.0445 177.5536 36 H 4.4984 7.7247 119.4758 58.7738 29.4150 176.4834 37 S 4.6981 7.7738 113.3732 59.0428 62.9608 175.3489 38 F 4.5914 7.9584 121.8327 59.0874 39.0533 175.8679 39 Y 4.6573 7.8674 114.8285 57.6994 38.5844 176.6116 40 R 3.8435 8.2748 119.2633 57.1508 29.6193 176.6017 41 K 2.9802 8.1631 129.6365 57.5119 37.4460 177.5471 42 G 3.7322 8.1147 107.6334 48.1356 0.0000 173.2049 43 H 4.2336 7.7820 120.5613 54.9539 30.7768 173.8127 44 P 4.2252 0.0000 0.0000 66.4580 30.7213 178.4572 45 V 3.4755 7.9245 117.4900 65.9274 30.5845 177.1538 46 Y 4.0989 8.0707 118.9010 60.8367 38.5302 177.8210 47 E 4.0424 8.1374 117.1554 58.1437 29.6283 178.5484 48 E 4.2423 7.7107 118.7693 58.8732 30.2414 178.4629 49 V 3.6878 8.3597 118.2874 65.5935 31.4987 177.8989 50 V 4.7132 7.1861 111.8564 62.4301 31.8064 177.5696 51 K 4.3413 7.4037 115.3520 57.0553 31.7239 177.5299 52 T 4.4114 7.6538 108.0309 62.4089 71.3531 174.5925 53 F 4.2366 8.4408 117.4415 56.5724 39.4055 176.3847 54 G 3.9843 8.2850 107.4811 45.4555 0.0000 173.3748 55 K 4.7037 7.7914 117.3760 53.4943 31.2635 173.5503 56 G 4.1778 7.0440 113.3835 45.8227 0.0000 173.3773 57 I 3.7429 7.9345 125.7153 62.6600 38.3059 176.3768 58 L 4.7979 7.4491 119.7747 53.7626 40.2088 177.4131 59 D 4.6790 8.2502 116.2320 55.1714 43.8546 176.2038 60 E 4.4337 8.5680 125.8705 54.9919 29.5311 176.2535 61 E 3.7584 8.6679 124.8055 56.2694 28.2636 176.7132 62 G 3.8508 7.1614 114.5817 45.5874 0.0000 175.0780 63 N 5.4300 8.3692 117.2339 49.3670 42.7492 173.8422 64 I 4.8945 8.5692 112.3090 61.1781 37.9710 175.8645 65 D 4.7880 8.2201 120.6788 51.7269 39.9597 176.1784 66 R 3.9306 8.1769 123.9232 58.5114 29.8749 177.5588 67 K 4.0234 8.0594 117.1431 58.1059 32.4878 178.3652 68 K 3.9913 9.0016 119.9554 58.4370 32.3075 178.6796 69 L 4.0298 8.6189 121.2224 57.9714 41.8216 178.4085 70 A 4.0321 7.2840 119.4295 55.4571 18.4899 179.1464 71 D 4.5725 7.7269 117.3414 57.4337 40.8152 178.5417 72 I 4.1499 7.4515 109.8438 62.2713 37.9591 177.1941 73 V 4.3948 7.5179 119.3498 62.1365 32.5480 176.7200 74 F 4.7179 7.9641 121.4237 60.3326 39.3597 176.6573 75 K 3.8989 7.8242 114.9627 55.9173 31.8631 176.2998 76 D 4.2387 7.5646 114.0882 52.3539 43.4767 176.0650 77 E 4.0221 8.4293 129.2787 59.0788 29.6037 178.1497 78 E 4.0529 8.3114 117.1852 58.8991 29.6027 179.0089 79 K 4.0618 8.1210 119.4250 58.6305 32.4457 178.5441 80 L 4.0579 8.0427 120.2168 58.5690 41.9704 179.1002 81 R 3.9905 7.9913 117.6659 59.2988 30.1197 178.9770 82 K 4.0801 7.7176 118.7919 59.2907 32.2132 178.5923 83 L 4.2050 8.2205 120.7486 57.9019 41.8764 178.1501 84 E 4.1942 8.7539 118.8038 58.2473 29.1730 178.0725 85 E 4.0416 8.8683 120.2865 58.9144 28.3149 177.9735 86 I 3.7603 7.5277 111.6992 62.8250 36.8828 177.3448 87 T 4.2267 7.9609 113.8066 63.7434 67.4802 174.9995 88 H 4.5058 8.0863 116.3028 56.1735 29.5486 175.7104 89 R 4.4881 7.7214 119.8095 56.9294 30.2975 177.6383 90 A 4.0862 7.5036 120.4655 55.0659 18.8633 178.9648 91 L 4.1631 7.6471 118.9902 58.8303 42.0788 178.4999 92 Y 4.0757 7.7884 117.9155 60.7534 38.1252 178.0554 93 K 3.8822 7.8201 119.7818 58.8419 32.2713 178.5072 94 E 4.0420 8.2416 120.0307 59.1716 29.5331 178.6935 95 I 3.7309 8.0620 120.1993 64.1012 37.0308 177.6927 96 E 3.7389 7.6527 120.3703 59.1807 29.1922 178.9936 97 K 3.8439 7.3910 116.7292 60.0452 32.7408 178.7933 98 I 3.7803 7.6466 120.8935 64.4318 37.1624 178.5348 99 T 3.4469 8.1352 117.1166 66.3324 67.9566 176.4070 100 K 3.8483 8.3178 120.9135 58.5918 32.0952 176.8328 101 N 4.9818 7.6415 115.0200 52.7798 39.1631 174.1081 102 L 4.7332 7.3295 117.3051 52.3595 44.2640 176.8595 103 S 4.2092 8.5017 116.7154 58.3043 62.8461 174.8064 104 E 3.8386 8.7118 126.0152 59.1977 29.4604 178.0042 105 D 4.4911 8.4847 118.9696 57.4643 41.2504 176.1198 106 T 3.7526 6.9132 107.5837 58.6154 69.8366 173.6399 107 L 4.5808 8.4584 128.0865 53.2881 41.9745 173.1194 108 F 4.8664 8.5691 125.8037 57.9376 40.8867 173.1866 109 I 4.7011 8.7993 127.1126 59.2043 40.5651 174.0968 110 L 4.5859 8.3145 129.6084 53.0559 43.9968 174.6978 111 E 4.6801 8.8592 128.9099 55.7682 30.8172 175.1306 112 A 4.8204 9.1422 127.2035 51.6363 23.0401 176.9265 113 S 4.1262 9.3509 116.8172 61.3823 63.6818 177.4752 114 L 4.9941 7.5742 116.9861 54.5022 41.4326 178.9211 115 L 4.0087 8.0656 123.8359 58.4257 41.7831 178.9729 116 V 3.4903 7.6405 117.2444 66.1426 31.7234 177.3698 117 E 3.7613 7.9204 117.4294 59.8537 28.2130 179.6137 118 K 4.2564 8.3629 117.5123 57.1950 31.7357 178.9076 119 G 3.9970 8.5940 108.5143 46.0779 0.0000 175.2053 120 T 3.9834 7.5262 110.5132 62.6537 69.7883 176.2351 121 Y 4.5667 8.4113 121.6546 60.2878 37.8359 178.7989 122 K 3.8400 6.3211 118.1773 58.5383 32.0831 177.2065 123 N 4.5790 8.2614 115.7893 53.2970 38.7383 174.2426 124 Y 4.7443 7.5890 115.7829 55.8927 41.6901 176.3664 125 D 4.4359 9.2168 122.7071 57.3086 42.1507 176.4848 126 K 5.1276 8.0096 114.3000 54.9539 37.5212 174.8751 127 L 5.2570 10.2035 125.2167 53.4632 44.9566 175.0126 128 I 5.1009 9.7302 127.3014 59.5437 40.1335 174.5716 129 V 4.9152 8.7107 126.6778 60.9931 34.1761 174.4364 130 V 4.7437 8.6317 128.1599 60.9648 32.8595 174.9333 131 Y 4.8138 8.8926 125.9256 56.0547 41.4999 174.3689 132 A 4.3131 6.9288 122.6085 50.4982 21.6882 174.5697 133 P 4.1612 0.0000 0.0000 64.1161 32.1908 177.2292 134 Y 3.1968 8.5662 122.1306 60.4566 38.7848 178.0018 135 E 3.5619 8.2463 119.8034 59.5649 29.6078 178.9722 136 V 3.4642 7.6498 117.7916 66.0790 31.5357 177.7836 137 C 4.3825 7.6813 117.3745 61.9326 27.9825 175.7093 138 K 2.0000 7.5614 121.4753 59.4792 31.5935 177.8502 139 E 3.6485 7.5210 118.1482 59.1748 29.0014 179.6242 140 R 3.7618 7.8821 119.6532 59.4673 30.7645 178.4706 141 A 4.1021 7.8793 120.2575 55.2602 18.2224 179.4026 142 I 3.4834 7.7455 118.1985 64.6711 37.0703 178.3338 143 K 3.4802 8.0049 119.0809 59.7981 31.9360 177.8681 144 R 4.4453 7.6167 115.2569 55.4273 30.6825 174.8780 145 G 3.4994 8.6730 111.5292 45.9287 0.0000 173.1911 *147 S 4.1839 7.9885 118.7460 57.3161 64.7830 173.1232 148 E 3.8870 8.6759 128.6546 59.5468 29.4619 178.9755 149 E 4.0355 8.0891 118.4755 59.5027 29.5868 177.8253 150 D 4.3901 8.2473 117.6062 57.5547 41.0801 177.7630 151 F 4.2019 8.6195 121.2432 61.5030 39.4409 176.9359 152 E 3.9855 8.2747 116.7405 59.1868 29.0233 179.5187 153 R 3.8548 7.6042 117.7067 59.5944 30.5611 178.4799 154 R 3.9848 7.5721 117.3303 58.9166 30.1924 178.8321 155 W 3.7650 7.9620 128.1306 60.3948 30.4615 178.0906 156 K 4.1800 8.3781 117.0997 58.5415 31.4939 178.8308 157 K 4.0790 7.5222 119.7047 57.6277 32.5934 177.5328 158 Q 4.3746 7.5774 120.2682 54.7626 27.3384 177.4718 *160 P 3.9698 0.0000 0.0000 62.8862 32.3427 176.3378 161 I 3.6078 8.3470 123.4459 64.7252 37.4505 177.3887 162 E 4.2943 8.2634 117.7179 59.2359 29.6704 178.2527 163 E 4.2244 8.8141 119.4543 58.1875 29.6587 178.6375 164 K 3.8827 7.8138 119.8365 59.3972 32.3015 178.9081 165 V 3.5667 8.3698 119.5140 64.4829 30.7701 177.9794 166 K 4.0644 7.5722 119.1139 59.3908 32.0385 177.4024 167 Y 3.8466 8.7142 116.9958 60.3497 38.0543 176.0821 168 A 4.2634 7.2675 121.3355 52.8114 19.0175 176.3972 169 D 4.6819 8.6309 118.5086 55.2019 42.7448 177.1639 170 Y 4.8634 7.8502 114.6528 55.9608 42.2804 174.6993 171 V 4.9157 8.6262 122.5374 61.2937 34.1435 174.6616 172 I 4.4015 8.5694 129.6407 59.9245 38.3842 174.9855 173 D 4.8459 9.2049 128.8722 53.7936 40.6712 174.9243 174 N 5.1070 8.9349 125.7634 52.7671 38.9650 176.0477 175 S 4.4703 8.4915 114.2679 59.8177 64.6669 175.0606 176 G 4.0436 7.2771 116.2890 45.2836 0.0000 173.2421 177 S 4.4609 8.5046 116.7254 57.4281 64.5386 175.1344 178 I 3.6550 8.5761 116.6941 64.5821 36.8933 177.5646 179 E 3.9019 7.6001 119.4955 59.1909 28.9382 178.6196 180 E 4.0369 8.1610 118.8288 59.2695 29.0475 179.0562 181 T 3.9400 7.7200 115.5913 66.6210 68.8136 175.7325 182 Y 4.0023 8.6573 121.9469 60.7855 38.6929 178.4459 183 K 3.8896 8.1970 118.9616 59.6332 32.1529 179.2633 184 Q 3.9142 7.6961 117.2542 58.9843 28.6710 178.6002 185 V 3.2634 7.7357 119.5641 66.0243 31.3326 177.6270 186 K 3.5717 7.4934 118.6612 59.4802 31.7576 178.2152 187 K 3.7865 7.7036 118.2620 59.6729 32.3131 178.4276 188 V 3.5178 8.4051 118.6040 66.0529 31.5787 177.2456 189 Y 4.1480 8.3398 119.6201 60.9835 38.4953 178.0776 190 E 3.9256 8.6702 120.6524 58.1359 29.2568 178.4187 191 E 4.0815 7.7524 118.2961 57.6793 29.9440 177.2804 192 L 4.3875 7.5243 116.7428 55.1690 42.6251 176.7464 193 T 4.3020 7.2695 107.6155 60.7957 70.1038 174.4263 194 R 3.9821 7.4427 127.5754 56.9525 29.9694 175.6783 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 K 8.21 5.25 0.00 1.82 1.89 0.00 1.57 0.00 0.00 2.38 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.51 7.81 3 R 8.55 5.02 0.00 2.15 2.38 0.00 3.22 0.00 0.00 3.36 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.06 0.00 4 I 9.25 5.00 1.75 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.11 0.90 0.00 0.00 5 G 9.17 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.46 5.08 0.00 1.48 1.38 0.92 0.40 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 7 T 8.62 5.52 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 8 G 7.93 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 0.00 0.00 0.00 0.00 9 N 7.79 4.78 0.00 2.59 2.16 0.00 0.00 6.45 6.93 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 10 I 8.38 3.86 1.88 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 1.47 0.85 1.02 0.00 0.00 11 G 9.24 4.14 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 0.00 0.00 0.00 12 C 7.92 4.20 0.00 3.16 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 13 G 8.11 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 14 K 7.83 4.11 0.00 2.00 2.10 0.00 1.48 0.00 0.00 1.87 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.68 7.81 15 S 7.92 4.70 0.00 3.89 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 16 T 7.41 3.99 4.44 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 1.22 0.00 0.00 17 V 7.66 3.69 2.39 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 1.13 0.00 0.00 0.99 0.00 0.00 18 A 8.46 4.29 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 19 Q 8.00 3.60 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.34 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 *21 F 8.02 4.28 0.00 3.38 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.98 4.74 0.00 2.06 1.93 0.00 3.09 0.00 0.00 3.15 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.76 0.00 23 E 7.84 3.98 0.00 1.94 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 2.53 2.43 0.00 24 L 7.22 3.89 0.00 1.17 0.36 0.49 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.97 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 0.00 0.00 0.00 26 A 7.84 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 27 Y 8.76 4.72 0.00 3.17 2.92 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 0.00 0.00 0.00 28 V 8.05 4.62 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 0.73 0.00 0.00 0.97 0.00 0.00 29 L 8.48 4.51 0.00 2.04 1.48 1.03 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.71 4.83 0.00 2.78 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 31 A 8.77 4.00 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 32 D 7.99 4.24 0.00 2.75 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 33 K 8.75 4.07 0.00 1.99 1.89 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.42 7.81 34 L 7.61 3.88 0.00 1.80 1.70 1.12 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 35 I 7.34 2.24 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.49 0.95 0.00 0.00 36 H 7.72 4.50 0.00 3.31 3.45 0.00 5.77 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.77 4.70 0.00 4.16 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 38 F 7.96 4.59 0.00 3.03 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 7.87 4.66 0.00 2.89 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 40 R 8.27 3.84 0.00 1.78 1.69 0.00 3.29 0.00 0.00 3.30 7.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 41 K 8.16 2.98 0.00 1.53 1.55 0.00 1.55 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.30 0.71 7.81 42 G 8.11 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 43 H 7.78 4.23 0.00 3.32 3.30 0.00 5.62 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.23 0.00 2.24 2.26 0.00 3.37 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 45 V 7.92 3.48 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.38 0.00 0.00 46 Y 8.07 4.10 0.00 3.03 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 47 E 8.14 4.04 0.00 2.07 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 2.51 2.53 0.00 48 E 7.71 4.24 0.00 2.14 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 2.54 2.26 0.00 49 V 8.36 3.69 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 0.95 0.00 0.00 0.85 0.00 0.00 50 V 7.19 4.71 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 0.59 0.00 0.00 0.82 0.00 0.00 51 K 7.40 4.34 0.00 1.80 1.82 0.00 1.49 0.00 0.00 1.99 0.00 0.00 3.18 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 52 T 7.65 4.41 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 1.26 0.00 0.00 53 F 8.44 4.24 0.00 3.32 3.18 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 54 G 8.28 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 55 K 7.79 4.70 0.00 1.65 1.69 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.35 7.81 56 G 7.04 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 0.00 0.00 0.00 57 I 7.93 3.74 1.93 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 1.50 0.61 0.96 0.00 0.00 58 L 7.45 4.80 0.00 1.79 1.83 1.07 0.82 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 59 D 8.25 4.68 0.00 2.78 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 60 E 8.57 4.43 0.00 1.98 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 0.00 2.25 2.47 0.00 61 E 8.67 3.76 0.00 2.03 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 0.00 2.26 2.37 0.00 62 G 7.16 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 63 N 8.37 5.43 0.00 2.85 2.77 0.00 0.00 7.35 6.91 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 64 I 8.57 4.89 2.01 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.56 1.20 0.00 0.00 65 D 8.22 4.79 0.00 2.85 2.59 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 0.00 66 R 8.18 3.93 0.00 1.76 1.89 0.00 3.06 0.00 0.00 2.82 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.44 0.00 67 K 8.06 4.02 0.00 1.97 1.82 0.00 1.50 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.51 7.81 68 K 9.00 3.99 0.00 1.94 1.81 0.00 1.54 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.56 7.81 69 L 8.62 4.03 0.00 1.74 1.76 0.50 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.28 4.03 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 71 D 7.73 4.57 0.00 2.82 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 72 I 7.45 4.15 1.99 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.79 1.03 0.00 0.00 73 V 7.52 4.39 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 0.91 0.00 0.00 1.03 0.00 0.00 74 F 7.96 4.72 0.00 3.09 3.34 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 75 K 7.82 3.90 0.00 1.79 1.75 0.00 1.74 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.81 1.44 7.81 76 D 7.56 4.24 0.00 2.71 2.52 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 77 E 8.43 4.02 0.00 2.05 1.91 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 2.38 2.38 0.00 78 E 8.31 4.05 0.00 2.26 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 2.37 2.85 0.00 79 K 8.12 4.06 0.00 2.20 2.21 0.00 0.71 0.00 0.00 1.22 0.00 0.00 2.58 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.54 1.53 7.81 80 L 8.04 4.06 0.00 2.04 1.93 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 81 R 7.99 3.99 0.00 1.95 2.00 0.00 3.19 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.95 0.00 82 K 7.72 4.08 0.00 2.16 2.16 0.00 1.53 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.60 7.81 83 L 8.22 4.20 0.00 1.74 1.91 0.91 0.45 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 84 E 8.75 4.19 0.00 2.16 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 85 E 8.87 4.04 0.00 2.08 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 0.00 2.32 2.47 0.00 86 I 7.53 3.76 1.89 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 1.77 0.72 1.03 0.00 0.00 87 T 7.96 4.23 4.47 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 1.45 0.00 0.00 88 H 8.09 4.51 0.00 3.59 3.40 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 R 7.72 4.49 0.00 2.10 1.95 0.00 3.09 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 90 A 7.50 4.09 1.19 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 0.00 0.00 0.00 0.00 0.00 91 L 7.65 4.16 0.00 2.10 1.83 1.02 0.80 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 92 Y 7.79 4.08 0.00 3.24 3.08 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 93 K 7.82 3.88 0.00 2.28 1.96 0.00 1.56 0.00 0.00 1.58 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.47 7.81 94 E 8.24 4.04 0.00 2.40 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 0.00 2.51 2.52 0.00 95 I 8.06 3.73 1.89 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.11 0.79 0.00 0.00 96 E 7.65 3.74 0.00 1.82 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 2.14 2.02 0.00 97 K 7.39 3.84 0.00 1.95 1.89 0.00 1.65 0.00 0.00 1.89 0.00 0.00 3.16 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.54 7.81 98 I 7.65 3.78 1.90 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 1.60 1.63 0.72 0.00 0.00 99 T 8.14 3.45 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 0.95 0.00 0.00 100 K 8.32 3.85 0.00 1.67 1.93 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.45 7.81 101 N 7.64 4.98 0.00 2.66 2.76 0.00 0.00 6.83 9.17 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 0.00 102 L 7.33 4.73 0.00 1.62 1.43 0.25 0.76 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 0.00 103 S 8.50 4.21 0.00 3.87 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 E 8.71 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 2.30 2.41 0.00 105 D 8.48 4.49 0.00 2.75 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 0.00 106 T 6.91 3.75 4.38 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 1.29 0.00 0.00 107 L 8.46 4.58 0.00 1.89 1.82 1.06 0.95 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 F 8.57 4.87 0.00 3.04 2.97 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 0.00 109 I 8.80 4.70 1.61 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.79 0.57 0.00 0.00 110 L 8.31 4.59 0.00 1.55 1.12 1.20 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.86 4.68 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 112 A 9.14 4.82 1.14 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 0.00 0.00 113 S 9.35 4.13 0.00 3.86 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 0.00 114 L 7.57 4.99 0.00 1.69 1.65 0.85 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.07 4.01 0.00 1.74 1.69 0.94 0.52 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 0.00 116 V 7.64 3.49 1.70 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 -0.20 0.00 0.00 0.50 0.00 0.00 117 E 7.92 3.76 0.00 2.04 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 2.31 2.40 0.00 118 K 8.36 4.26 0.00 1.98 1.90 0.00 1.82 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.58 7.81 119 G 8.59 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 0.00 120 T 7.53 3.98 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 121 Y 8.41 4.57 0.00 3.28 3.36 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 0.00 122 K 6.32 3.84 0.00 1.16 1.68 0.00 1.61 0.00 0.00 1.59 0.00 0.00 3.03 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.36 1.21 7.81 123 N 8.26 4.58 0.00 2.54 2.42 0.00 0.00 6.74 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 0.00 124 Y 7.59 4.74 0.00 3.28 3.08 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 0.00 125 D 9.22 4.44 0.00 2.75 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 0.00 126 K 8.01 5.13 0.00 1.83 1.87 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.76 7.81 127 L 10.20 5.26 0.00 1.87 1.60 1.05 1.08 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 0.00 128 I 9.73 5.10 1.84 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.68 1.05 0.00 0.00 129 V 8.71 4.92 2.15 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 1.06 0.00 0.00 0.94 0.00 0.00 130 V 8.63 4.74 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 0.83 0.00 0.00 1.05 0.00 0.00 131 Y 8.89 4.81 0.00 3.12 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 0.00 132 A 6.93 4.31 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 P 0.00 4.16 0.00 2.24 2.27 0.00 3.55 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 134 Y 8.57 3.20 0.00 2.69 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 0.00 135 E 8.25 3.56 0.00 2.03 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 136 V 7.65 3.46 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 0.92 0.00 0.00 0.88 0.00 0.00 137 C 7.68 4.38 0.00 2.97 3.36 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 0.00 138 K 7.56 2.00 0.00 0.79 1.20 0.00 1.24 0.00 0.00 1.50 0.00 0.00 2.57 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 0.58 7.81 139 E 7.52 3.65 0.00 1.97 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 0.00 2.12 2.44 0.00 140 R 7.88 3.76 0.00 1.88 1.97 0.00 3.35 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.86 0.00 141 A 7.88 4.10 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 0.00 142 I 7.75 3.48 1.83 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.69 0.83 0.00 0.00 143 K 8.00 3.48 0.00 1.80 1.95 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.60 7.81 144 R 7.62 4.45 0.00 2.13 1.94 0.00 3.23 0.00 0.00 3.38 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 145 G 8.67 3.50 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 0.00 *147 S 7.99 4.18 0.00 3.94 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 0.00 148 E 8.68 3.89 0.00 2.09 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 2.47 0.00 149 E 8.09 4.04 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 150 D 8.25 4.39 0.00 2.81 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 0.00 151 F 8.62 4.20 0.00 3.17 3.23 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 0.00 152 E 8.27 3.99 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.76 0.00 153 R 7.60 3.85 0.00 1.98 2.08 0.00 3.21 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 154 R 7.57 3.98 0.00 1.93 1.88 0.00 3.18 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 155 W 7.96 3.76 0.00 2.83 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 0.00 156 K 8.38 4.18 0.00 1.85 1.86 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.64 7.81 157 K 7.52 4.08 0.00 1.72 1.93 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.42 7.81 158 Q 7.58 4.37 0.00 1.74 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.20 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 *160 P 0.00 3.97 0.00 2.20 2.06 0.00 3.57 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 161 I 8.35 3.61 1.83 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 1.67 1.06 1.19 0.00 0.00 162 E 8.26 4.29 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 2.56 2.57 0.00 163 E 8.81 4.22 0.00 2.07 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 2.32 2.41 0.00 164 K 7.81 3.88 0.00 1.72 1.81 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.72 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.39 7.81 165 V 8.37 3.57 2.31 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 0.89 0.00 0.00 0.96 0.00 0.00 166 K 7.57 4.06 0.00 1.93 2.13 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.37 1.38 7.81 167 Y 8.71 3.85 0.00 2.87 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 0.00 168 A 7.27 4.26 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 0.00 169 D 8.63 4.68 0.00 2.42 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 0.00 0.00 0.00 0.00 170 Y 7.85 4.86 0.00 2.99 2.84 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 0.00 171 V 8.63 4.92 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 0.88 0.00 0.00 0.96 0.00 0.00 172 I 8.57 4.40 1.98 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 1.27 1.07 0.95 0.00 0.00 173 D 9.20 4.85 0.00 2.73 2.69 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 0.00 174 N 8.93 5.11 0.00 2.87 3.03 0.00 0.00 7.15 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 0.00 175 S 8.49 4.47 0.00 4.11 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 0.00 176 G 7.28 4.04 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 0.00 0.00 0.00 177 S 8.50 4.46 0.00 4.02 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 0.00 178 I 8.58 3.66 1.88 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 1.04 0.92 0.00 0.00 179 E 7.60 3.90 0.00 2.08 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 2.31 2.41 0.00 180 E 8.16 4.04 0.00 2.17 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 0.00 2.34 2.43 0.00 181 T 7.72 3.94 4.45 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 1.22 0.00 0.00 182 Y 8.66 4.00 0.00 3.01 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 0.00 183 K 8.20 3.89 0.00 2.03 1.86 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.69 7.81 184 Q 7.70 3.91 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.61 0.00 185 V 7.74 3.26 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 -0.18 0.00 0.00 0.82 0.00 0.00 186 K 7.49 3.57 0.00 1.38 1.71 0.00 1.55 0.00 0.00 1.53 0.00 0.00 3.10 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.34 7.81 187 K 7.70 3.79 0.00 1.88 1.98 0.00 1.88 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.47 7.81 188 V 8.41 3.52 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.01 0.00 0.00 189 Y 8.34 4.15 0.00 3.01 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 E 8.67 3.93 0.00 1.98 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 2.41 2.51 0.00 191 E 7.75 4.08 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 192 L 7.52 4.39 0.00 1.51 1.62 0.82 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 193 T 7.27 4.30 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 0.69 0.00 0.00 194 R 7.44 3.98 0.00 1.96 1.84 0.00 3.29 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.