NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2871 8.1727 121.7980 56.3661 34.5396 177.6213 3 F 4.1683 8.2147 120.7245 60.0354 39.3037 175.1338 4 L 3.7647 8.2020 119.8852 58.1561 42.0135 178.0353 5 E 3.8709 7.9978 117.5396 59.0054 29.8921 177.9195 6 L 4.0270 7.6662 120.0157 58.4356 42.0482 178.8094 7 N 4.1341 7.7162 116.1526 56.1692 38.1830 177.5245 8 K 4.0454 7.9489 118.8621 58.0940 32.2254 178.4134 9 K 4.3397 7.3009 116.7661 55.7391 33.2957 176.3894 10 R 4.0845 6.9962 121.6968 56.3168 30.5233 175.0793 11 H 4.8311 8.3380 120.7814 53.5090 32.6830 173.2766 12 A 4.1033 8.4855 124.2591 52.4124 17.4973 177.2353 13 T 4.2269 8.4295 119.6799 63.3589 69.2431 175.6046 14 K 4.2706 8.2421 124.3506 56.1615 34.5685 175.7872 15 H 4.7926 7.3234 115.5938 53.7444 32.3673 172.4190 16 F 5.4997 8.7793 121.1531 55.7623 42.0509 175.4246 17 T 4.3868 8.8908 113.1203 61.3931 70.1610 174.0405 18 D 4.7027 8.5995 119.1560 54.0525 41.1569 177.0563 19 K 3.9614 7.6531 121.2735 56.3312 32.6089 176.5339 20 L 4.1568 8.3539 125.7756 54.6173 42.2961 176.5504 21 V 4.2880 8.0807 122.0768 60.8555 32.5611 174.9543 22 D 4.4489 8.6804 128.1696 53.3409 41.5959 174.8711 23 P 4.2904 0.0000 0.0000 65.9781 30.9170 178.5262 24 K 3.9622 8.2589 118.4134 59.5246 31.8794 178.9220 25 D 4.3456 8.0516 118.9748 57.1890 40.7251 178.9778 26 V 3.4830 7.6529 118.2935 66.0056 31.6151 177.8639 27 R 3.8196 7.9834 118.3852 59.6344 29.8320 178.6299 28 T 3.7780 7.9605 115.2643 66.6254 68.4092 176.4650 29 A 3.9683 8.0691 122.7217 55.2933 18.3238 179.8020 30 I 3.2396 7.6411 118.2981 64.1176 36.8679 178.2481 31 E 3.8585 7.8742 119.5182 59.1746 29.7896 178.6740 32 I 3.7968 8.1326 120.1495 64.2026 37.1638 178.1664 33 A 3.9069 8.0523 122.1167 55.2843 18.0340 179.3608 34 T 3.8758 7.4410 105.5181 63.3355 68.9979 176.1535 35 L 4.1136 7.7672 121.5742 56.0429 42.0016 177.0616 36 A 4.0451 7.2924 121.7344 51.7773 18.8070 175.6834 37 P 4.7352 0.0000 0.0000 62.7900 32.5775 175.7758 38 S 4.7844 8.3266 112.0606 56.1788 66.1236 173.2287 39 A 4.1295 8.7187 124.8034 54.5333 18.3155 178.3552 40 H 4.2722 9.2758 117.9739 55.4913 26.5760 174.1364 41 N 4.3517 8.3947 116.3706 54.4996 37.7364 175.4782 42 S 4.2436 8.7897 112.8718 59.1053 64.0456 174.0323 43 Q 2.0000 7.5150 119.0806 55.6949 27.7013 172.5413 44 P 4.7239 0.0000 0.0000 63.2494 31.3586 176.9850 45 W 5.6449 7.4303 114.8820 55.6941 32.0955 175.6990 46 K 4.6666 9.0649 122.0599 55.1818 35.2902 174.6399 47 F 4.9066 9.2065 126.4299 56.0921 40.4917 175.6001 48 V 4.1149 8.8147 125.8808 61.2055 32.6315 175.1697 49 V 4.1133 8.3644 129.4675 62.3146 31.9933 175.3537 50 V 4.2054 8.8779 130.2663 61.7642 32.0543 176.3594 51 R 4.5047 8.7339 125.6574 55.8972 32.6999 176.3015 52 E 4.3971 8.2579 115.5397 57.6696 30.9582 177.2131 53 K 4.5042 7.7244 116.4041 56.5201 32.6186 178.2583 54 N 4.2374 8.0885 119.8979 56.4961 38.2288 176.9348 55 A 3.9553 7.8380 120.5294 54.9495 18.9580 178.9633 56 E 4.0755 8.1637 116.6663 59.6654 29.5616 179.0184 57 L 3.9325 8.2345 120.1695 58.3795 42.1332 178.9204 58 A 3.9333 8.1587 120.4133 55.0276 17.9984 179.5170 59 K 4.3385 8.0083 115.5177 58.7673 32.4054 178.3722 60 L 4.3875 8.2450 118.4832 54.1854 42.0984 175.9135 61 A 4.6640 7.4226 122.5785 51.0987 20.2514 176.6857 62 Y 4.8068 8.5040 119.7552 58.0404 40.2757 176.9926 63 G 3.7701 8.6223 111.1197 46.9627 0.0000 176.0014 64 S 4.7425 8.5410 118.6539 59.4021 63.0001 175.7190 65 N 4.4313 8.4800 121.3269 56.1021 38.1984 176.6866 66 F 4.2776 8.3046 122.4721 61.6725 39.2578 177.1692 67 E 3.8691 8.3140 117.4563 59.1887 29.2919 179.2334 68 Q 4.1538 7.8942 118.1142 59.1685 28.6496 179.0891 69 V 3.5283 7.6689 117.8178 65.9242 31.5662 177.9234 70 S 4.0600 7.5302 114.3537 61.4139 62.6406 176.4417 71 S 4.2960 7.9029 116.6075 59.9520 63.1479 175.2288 72 A 3.2598 7.3869 123.5279 51.7443 18.3719 175.8673 73 P 4.2906 0.0000 0.0000 64.9282 31.9706 176.9304 74 V 4.6530 7.2962 116.5717 61.3305 35.4534 174.4531 75 T 4.9580 8.4240 122.1289 61.7947 72.5713 172.8069 76 I 4.8643 8.8594 127.0108 59.5274 39.4778 174.7158 77 A 4.5480 8.9292 130.9513 51.0229 19.9096 175.7295 78 L 4.4912 8.6028 126.1133 54.4646 43.4019 175.6931 79 F 5.3764 9.3768 125.6394 55.9746 42.4345 174.7317 80 T 5.2652 8.8284 110.4593 59.9195 72.3575 172.8329 81 D 4.5405 8.9478 124.0332 53.8254 40.7661 176.3255 82 T 3.8859 8.3597 117.4384 63.3465 69.7363 175.6573 83 D 4.4909 7.8613 123.2967 52.8775 39.7856 176.0724 84 L 3.5578 7.6108 125.0038 56.5803 41.7581 178.4189 85 A 4.0448 7.7313 120.4426 55.3128 18.3849 179.6340 86 K 3.8853 8.0686 116.5786 59.4718 32.0431 179.6563 87 R 3.8089 8.0647 118.9543 59.3011 30.1714 178.3482 88 A 4.1031 8.1947 120.6405 55.4358 18.3619 179.8986 89 R 3.8909 8.0231 116.5654 58.9982 30.0396 178.9765 90 K 3.8483 8.3103 119.8652 59.6778 32.0764 178.7629 91 I 3.5695 7.5646 119.4926 64.2966 36.9126 178.2307 92 A 3.9119 7.5690 121.1137 55.1308 17.9758 179.7354 93 R 3.8225 8.1388 116.4568 59.5718 30.2901 178.6453 94 V 3.8772 8.0287 117.3738 65.8165 31.5340 178.0373 95 G 3.7308 8.7427 106.1032 48.0541 0.0000 174.9021 96 G 4.1012 8.8033 110.2645 44.8112 0.0000 173.5144 97 A 4.5043 8.4917 119.5582 54.1151 18.6059 179.0211 98 N 4.5284 8.1808 112.2744 55.2289 38.8421 175.4527 99 N 4.6765 7.4593 113.3932 52.6943 40.6797 174.7229 100 F 5.3356 7.8960 116.3607 54.7804 42.6715 174.9333 101 S 4.4466 9.1615 119.7289 57.9671 65.1524 175.4299 102 E 4.0502 8.6557 120.8028 59.4295 29.0913 179.4277 103 E 3.9574 8.1647 118.1992 59.5892 29.6488 179.2115 104 Q 3.9765 7.9640 117.5554 59.0024 28.5714 178.9194 105 L 4.0290 7.9284 118.9158 57.8910 41.9846 179.0817 106 Q 4.0894 8.1436 119.4934 59.0537 28.8627 177.6157 107 Y 4.0135 7.9358 120.6356 60.6252 38.6266 179.0071 108 F 4.2211 7.5763 115.2201 57.7376 39.0977 176.7354 *110 K 4.3149 7.9967 119.4958 56.7530 34.0985 178.0928 111 N 4.1764 7.8976 115.8693 56.1230 38.4604 177.0317 112 L 3.1704 7.6190 122.0784 57.6970 42.0666 177.1783 113 P 4.2347 0.0000 0.0000 65.6621 30.9350 178.4389 114 A 3.9358 7.2792 118.7472 54.9375 18.4720 179.1342 115 E 3.9904 7.9014 117.0896 59.7119 29.5434 179.6889 116 F 3.3723 7.6163 117.3680 60.1541 38.6236 177.4811 117 A 4.0524 7.8933 119.5591 54.7488 18.1573 178.8523 118 R 4.3928 7.4914 113.7145 55.5500 30.7586 176.2769 119 Y 4.9150 7.8795 118.0825 56.9393 38.6217 176.5885 120 S 4.3719 8.7865 119.5853 58.4884 65.0079 175.2965 121 E 4.0068 8.6547 121.3992 59.5742 29.0606 179.4742 122 Q 4.0042 8.0283 119.2631 59.0270 29.3536 177.9326 123 Q 3.9492 8.3156 119.3340 58.9151 28.7994 178.7552 124 V 3.6892 7.9275 119.1416 66.3139 31.5904 177.9819 125 S 4.1492 8.1414 112.6203 61.5561 62.1583 175.8244 126 D 4.4143 8.5183 121.9327 57.3862 40.5552 178.1310 127 Y 4.0849 8.2822 120.0258 60.8086 38.8730 178.1798 128 L 4.1322 8.3430 119.6934 57.7902 41.7625 179.4070 129 A 4.0239 8.0694 120.7089 54.9120 18.3342 179.4402 130 L 3.8981 8.3004 119.1834 58.5928 42.2924 179.0535 131 N 4.4712 8.2862 116.1008 56.1758 38.3132 177.3115 132 A 4.2199 8.4556 122.6363 54.9731 18.2419 179.8295 133 G 3.5916 7.9708 103.2146 47.9435 0.0000 175.3070 134 L 4.1949 7.7732 120.7591 57.7846 42.0106 179.9756 135 V 3.6137 7.7150 117.9733 64.2468 31.2963 178.6192 136 A 4.2288 8.1022 119.4124 52.5615 18.0683 178.5441 *138 N 4.5760 8.1484 121.3416 55.1026 41.0888 176.3564 139 L 3.8683 8.1557 119.4680 58.3631 42.1017 179.4841 140 V 3.6350 7.8317 112.3059 64.2338 31.4171 178.6735 141 L 3.9523 7.8909 118.2373 57.6690 41.1066 179.0969 142 A 4.0256 8.3068 121.0749 55.0596 18.2032 179.6774 143 L 3.8916 8.0459 117.4615 58.2036 41.6987 179.7475 144 T 3.9265 8.0275 115.7580 66.9132 68.2381 175.9903 145 D 4.5113 8.3953 118.5217 57.1060 41.1400 177.4426 146 Q 4.4867 7.4777 115.3757 55.2717 28.9421 176.2728 147 G 3.9663 8.3341 108.5383 45.5682 0.0000 173.0961 148 I 3.9719 7.7681 120.4705 58.9617 38.9019 176.2811 149 G 4.1110 8.5895 114.6340 46.2916 0.0000 172.1454 150 S 5.7655 8.1185 112.2892 58.8425 66.1872 173.6499 151 N 5.2890 8.4760 117.0813 52.1777 42.6612 172.8933 152 I 4.7805 8.3982 125.9039 60.2631 38.7590 175.0106 153 I 4.5815 9.1150 127.9500 59.6241 39.4443 176.0299 154 L 4.5880 8.9574 127.7181 55.3958 43.7493 177.1087 155 G 4.0461 7.9282 108.9157 43.9604 0.0000 172.1243 156 F 4.2969 6.8295 117.9482 54.6273 41.1576 175.8423 157 D 4.5586 8.7735 121.9914 52.9760 39.9912 176.6762 158 K 4.0717 8.0994 126.5731 58.9315 32.0271 178.4955 159 S 4.2992 7.9289 113.1748 60.0596 63.2808 175.4075 160 K 4.5219 7.8460 120.4060 56.2815 32.7819 178.1347 161 V 3.6956 7.6811 120.1018 66.0181 31.4306 177.5066 162 N 4.4910 8.3355 115.8315 56.2973 38.3309 176.7376 163 E 3.9155 8.1880 120.0725 59.3884 29.6853 178.6586 164 V 3.6296 7.7611 116.9119 65.8109 31.7120 177.1403 165 L 4.3397 8.1509 115.2665 53.4795 42.9692 176.0482 166 E 3.7826 7.7486 117.7101 57.8653 27.1674 174.6366 167 I 4.4097 7.7804 117.6855 58.8218 40.6010 176.3640 168 E 4.0406 8.7694 123.3824 57.0718 29.7692 178.2055 169 D 4.5780 8.7386 122.3072 56.9316 41.4650 177.4296 170 R 3.8811 8.1802 119.7419 58.9420 31.0535 176.0014 171 F 5.2839 8.3505 118.3110 56.0603 40.1911 175.7888 172 R 4.9698 8.8936 121.1102 53.6992 31.8751 173.8883 173 P 3.7005 0.0000 0.0000 63.0220 31.5463 175.4529 174 E 4.5362 8.9704 123.1371 57.9473 31.1973 176.3680 175 L 4.9597 7.5585 116.3684 53.6463 46.6887 174.2335 176 L 4.7456 8.6345 122.0160 52.9766 44.4673 175.5601 177 I 4.9573 8.5970 125.2037 59.5358 39.4836 175.2327 178 T 4.4106 8.6351 118.5909 61.4644 70.2445 173.9008 179 V 4.6764 8.6285 123.5150 60.9856 35.0402 174.7352 180 G 3.6777 8.0772 114.0187 46.2434 0.0000 171.2915 181 Y 4.9107 8.0150 117.2258 57.6403 39.5991 175.1971 182 T 4.6359 8.6190 119.6778 62.8124 69.6645 173.9829 183 D 4.9945 8.6906 125.5654 53.7022 41.8359 175.6361 184 E 4.7030 7.7865 113.3332 54.0722 32.2825 174.9063 185 K 4.0046 8.6459 121.5610 57.0881 33.0855 176.1139 186 L 4.7315 8.1250 122.3287 52.7485 44.6592 175.7215 187 E 4.4724 8.3360 121.0853 54.0111 30.9440 174.6145 188 P 4.3080 0.0000 0.0000 63.2022 31.5565 176.5476 189 S 4.5000 8.3958 116.6962 57.2804 64.2159 172.9875 190 Y 4.1892 8.3933 122.1199 57.5700 39.0865 175.0740 191 R 4.3501 7.1855 124.5709 53.5723 33.5876 175.3625 192 L 4.0045 8.2433 121.7357 54.0948 42.4657 175.5003 193 P 4.3219 0.0000 0.0000 62.6696 32.0118 177.4901 194 V 3.5899 8.6113 121.9517 65.4456 30.8990 178.3851 195 D 4.3439 8.0604 117.5347 56.5804 40.6951 177.8829 196 E 4.1547 8.1980 119.5270 57.9023 29.6564 177.0436 197 I 4.4407 7.6731 109.6817 60.2315 38.3915 174.9190 198 I 4.4417 7.5893 121.7789 59.7186 38.8353 174.4478 199 E 4.6874 8.5569 124.3661 54.1331 32.3393 174.7392 200 K 4.6295 8.5538 124.3276 54.7996 34.1465 176.5829 201 R 4.2058 8.3261 121.5070 56.5305 31.1368 174.8818 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 8.17 4.29 0.00 1.84 1.93 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.44 1.46 7.81 3 F 8.21 4.17 0.00 3.20 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 4 L 8.20 3.76 0.00 1.79 1.65 0.86 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 5 E 8.00 3.87 0.00 1.99 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 0.00 2.27 2.35 0.00 6 L 7.67 4.03 0.00 1.79 1.48 1.03 0.49 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 7 N 7.72 4.13 0.00 2.62 2.62 0.00 0.00 7.11 6.35 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 8 K 7.95 4.05 0.00 1.67 1.83 0.00 1.66 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.49 7.81 9 K 7.30 4.34 0.00 1.88 1.90 0.00 1.59 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.64 1.39 7.81 10 R 7.00 4.08 0.00 1.67 1.77 0.00 3.18 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 11 H 8.34 4.83 0.00 3.08 3.10 0.00 5.95 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 12 A 8.49 4.10 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 13 T 8.43 4.23 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 0.73 0.00 0.00 14 K 8.24 4.27 0.00 1.49 1.54 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.31 7.81 15 H 7.32 4.79 0.00 2.97 3.08 0.00 5.75 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 16 F 8.78 5.50 0.00 2.90 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 17 T 8.89 4.39 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 1.35 0.00 0.00 18 D 8.60 4.70 0.00 2.70 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.65 3.96 0.00 1.59 1.65 0.00 1.28 0.00 0.00 0.61 0.00 0.00 2.46 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.19 1.21 7.81 20 L 8.35 4.16 0.00 1.69 1.60 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.08 4.29 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 0.72 0.00 0.00 0.85 0.00 0.00 22 D 8.68 4.45 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 23 P 0.00 4.29 0.00 2.28 2.29 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 24 K 8.26 3.96 0.00 1.81 1.89 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.64 1.62 7.81 25 D 8.05 4.35 0.00 2.87 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 V 7.65 3.48 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 0.97 0.00 0.00 0.87 0.00 0.00 27 R 7.98 3.82 0.00 1.96 1.87 0.00 3.12 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 1.57 1.62 0.00 28 T 7.96 3.78 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 1.18 0.00 0.00 29 A 8.07 3.97 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 30 I 7.64 3.24 1.58 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.51 0.01 0.00 0.00 31 E 7.87 3.86 0.00 1.98 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 2.29 2.32 0.00 32 I 8.13 3.80 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.88 0.88 0.00 0.00 33 A 8.05 3.91 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 34 T 7.44 3.88 4.55 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 35 L 7.77 4.11 0.00 1.78 1.80 0.91 0.78 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 36 A 7.29 4.05 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 37 P 0.00 4.74 0.00 2.27 2.14 0.00 3.80 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 2.06 2.00 0.00 38 S 8.33 4.78 0.00 3.97 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 39 A 8.72 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 9.28 4.27 0.00 3.65 3.66 0.00 6.05 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.39 4.35 0.00 3.02 3.20 0.00 0.00 7.12 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 42 S 8.79 4.24 0.00 4.20 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 0.00 43 Q 7.51 2.00 0.00 1.25 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.59 0.00 0.00 0.00 0.00 0.00 2.22 2.04 0.00 44 P 0.00 4.72 0.00 2.14 2.25 0.00 3.03 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 45 W 7.43 5.64 0.00 2.95 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 7.90 4.30 0.00 4.06 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 72 A 7.39 3.26 0.70 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 73 P 0.00 4.29 0.00 1.95 2.08 0.00 3.39 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 74 V 7.30 4.65 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 0.81 0.00 0.00 0.85 0.00 0.00 75 T 8.42 4.96 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 1.07 0.00 0.00 76 I 8.86 4.86 1.89 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 0.73 1.09 0.00 0.00 77 A 8.93 4.55 1.27 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 0.00 0.00 78 L 8.60 4.49 0.00 1.60 1.42 0.23 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 79 F 9.38 5.38 0.00 3.11 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 80 T 8.83 5.27 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 81 D 8.95 4.54 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 82 T 8.36 3.89 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 1.22 0.00 0.00 83 D 7.86 4.49 0.00 2.56 2.40 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 84 L 7.61 3.56 0.00 0.88 0.13 -0.30 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 A 7.73 4.04 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 0.00 0.00 0.00 0.00 0.00 86 K 8.07 3.89 0.00 1.90 1.83 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.63 7.81 87 R 8.06 3.81 0.00 2.02 1.97 0.00 3.38 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 88 A 8.19 4.10 1.57 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 89 R 8.02 3.89 0.00 2.01 1.98 0.00 3.12 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 90 K 8.31 3.85 0.00 1.95 1.99 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.52 7.81 91 I 7.56 3.57 1.50 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 1.29 0.40 0.05 0.00 0.00 92 A 7.57 3.91 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 93 R 8.14 3.82 0.00 1.86 2.16 0.00 3.27 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 94 V 8.03 3.88 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 0.88 0.00 0.00 0.99 0.00 0.00 95 G 8.74 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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4.23 0.00 2.10 2.07 0.00 3.45 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 2.04 2.13 0.00 114 A 7.28 3.94 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 0.00 0.00 0.00 0.00 0.00 115 E 7.90 3.99 0.00 1.79 1.66 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 2.31 2.27 0.00 116 F 7.62 3.37 0.00 2.95 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 0.00 117 A 7.89 4.05 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 0.00 118 R 7.49 4.39 0.00 2.00 2.06 0.00 3.20 0.00 0.00 3.24 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 119 Y 7.88 4.92 0.00 2.98 2.87 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 0.00 120 S 8.79 4.37 0.00 4.05 4.02 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 0.00 121 E 8.65 4.01 0.00 2.04 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 0.00 2.40 2.37 0.00 122 Q 8.03 4.00 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 123 Q 8.32 3.95 0.00 2.30 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.54 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 124 V 7.93 3.69 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 0.92 0.00 0.00 1.00 0.00 0.00 125 S 8.14 4.15 0.00 4.06 3.87 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 0.00 126 D 8.52 4.41 0.00 2.97 2.76 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 0.00 127 Y 8.28 4.08 0.00 3.42 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.34 4.13 0.00 1.83 1.90 0.97 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.07 4.02 1.42 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 0.00 0.00 0.00 130 L 8.30 3.90 0.00 1.78 1.63 0.93 0.58 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 0.00 131 N 8.29 4.47 0.00 2.89 3.03 0.00 0.00 6.99 7.27 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 0.00 132 A 8.46 4.22 1.43 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 0.00 0.00 0.00 133 G 7.97 3.59 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 0.00 0.00 0.00 134 L 7.77 4.19 0.00 1.93 1.84 1.06 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.72 3.61 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 0.00 0.00 0.56 0.00 0.00 0.33 0.00 0.00 136 A 8.10 4.23 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 *138 N 8.15 4.58 0.00 2.79 2.87 0.00 0.00 6.72 6.66 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 0.00 139 L 8.16 3.87 0.00 1.84 1.92 0.81 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 140 V 7.83 3.63 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 0.74 0.00 0.00 0.93 0.00 0.00 141 L 7.89 3.95 0.00 1.89 1.79 1.11 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.31 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 0.00 143 L 8.05 3.89 0.00 1.84 1.80 0.87 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.03 3.93 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 1.20 0.00 0.00 145 D 8.40 4.51 0.00 2.74 2.87 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 0.00 146 Q 7.48 4.49 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.85 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 147 G 8.33 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 0.00 0.00 0.00 148 I 7.77 3.97 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.71 0.60 0.00 0.00 149 G 8.59 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 0.00 0.00 0.00 150 S 8.12 5.77 0.00 3.91 3.92 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 0.00 151 N 8.48 5.29 0.00 3.09 2.70 0.00 0.00 7.54 7.85 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 0.00 152 I 8.40 4.78 1.89 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 1.35 0.71 0.93 0.00 0.00 153 I 9.11 4.58 1.94 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 1.15 0.79 1.01 0.00 0.00 154 L 8.96 4.59 0.00 1.63 1.71 0.90 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 155 G 7.93 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 F 6.83 4.30 0.00 3.04 2.76 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 0.00 157 D 8.77 4.56 0.00 2.87 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 0.00 158 K 8.10 4.07 0.00 1.70 1.79 0.00 1.46 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.25 0.59 7.81 159 S 7.93 4.30 0.00 4.04 4.02 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 0.00 160 K 7.85 4.52 0.00 1.90 1.90 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.45 7.81 161 V 7.68 3.70 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 1.25 0.00 0.00 1.19 0.00 0.00 162 N 8.34 4.49 0.00 2.89 3.09 0.00 0.00 6.76 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 0.00 163 E 8.19 3.92 0.00 2.08 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 2.41 2.40 0.00 164 V 7.76 3.63 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 0.92 0.00 0.00 1.01 0.00 0.00 165 L 8.15 4.34 0.00 1.81 1.71 1.06 1.16 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 0.00 166 E 7.75 3.78 0.00 2.03 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 2.25 2.26 0.00 167 I 7.78 4.41 1.52 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.21 0.28 0.00 0.00 168 E 8.77 4.04 0.00 2.23 2.00 0.00 0.00 0.00 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 2.38 0.00 169 D 8.74 4.58 0.00 2.69 2.76 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 0.00 170 R 8.18 3.88 0.00 1.75 1.76 0.00 2.98 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.33 0.00 171 F 8.35 5.28 0.00 3.06 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 R 8.89 4.97 0.00 1.94 2.09 0.00 2.79 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 173 P 0.00 3.70 0.00 2.14 1.45 0.00 3.80 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.12 0.00 174 E 8.97 4.54 0.00 1.89 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 0.00 2.42 2.45 0.00 175 L 7.56 4.96 0.00 1.52 1.49 0.93 0.67 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 0.00 176 L 8.63 4.75 0.00 1.24 1.25 0.40 0.27 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 0.00 177 I 8.60 4.96 1.85 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 1.37 0.94 0.91 0.00 0.00 178 T 8.64 4.41 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 1.18 0.00 0.00 179 V 8.63 4.68 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 0.79 0.00 0.00 0.91 0.00 0.00 180 G 8.08 3.68 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 0.00 0.00 0.00 181 Y 8.01 4.91 0.00 3.10 2.95 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 0.00 182 T 8.62 4.64 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 1.21 0.00 0.00 183 D 8.69 4.99 0.00 2.67 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 E 7.79 4.70 0.00 2.03 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 2.15 2.24 0.00 185 K 8.65 4.00 0.00 1.83 1.85 0.00 1.37 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.51 7.81 186 L 8.13 4.73 0.00 1.45 1.41 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 187 E 8.34 4.47 0.00 1.94 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 2.24 2.22 0.00 188 P 0.00 4.31 0.00 2.18 2.09 0.00 3.77 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 2.01 1.98 0.00 189 S 8.40 4.50 0.00 4.06 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 0.00 190 Y 8.39 4.19 0.00 2.98 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 0.00 191 R 7.19 4.35 0.00 1.53 1.57 0.00 3.37 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.44 0.00 192 L 8.24 4.00 0.00 1.59 1.63 0.96 1.22 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 0.00 193 P 0.00 4.32 0.00 2.22 2.19 0.00 3.77 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00 194 V 8.61 3.59 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.92 0.00 0.00 195 D 8.06 4.34 0.00 2.67 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 0.00 196 E 8.20 4.15 0.00 1.96 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 2.36 2.38 0.00 197 I 7.67 4.44 1.87 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 1.43 0.86 0.92 0.00 0.00 198 I 7.59 4.44 1.87 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 1.30 0.76 0.91 0.00 0.00 199 E 8.56 4.69 0.00 1.86 1.77 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 2.17 2.35 0.00 200 K 8.55 4.63 0.00 1.76 1.70 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.35 1.43 7.81 201 R 8.33 4.21 0.00 1.73 1.75 0.00 3.40 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 * Residues marked with a * may have inaccurate shift predictions.