NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3534 8.3149 121.7779 56.2905 33.2989 175.4737 2 H 4.3427 9.1344 124.4509 53.8304 29.3276 173.3136 3 S 4.7054 8.4061 116.2730 55.9202 66.8187 173.2691 4 L 4.0995 8.3428 123.7258 53.7890 41.6468 174.9710 5 P 4.5233 0.0000 0.0000 62.3952 32.0854 176.1684 6 D 4.5278 8.4269 120.3068 54.0734 41.4598 176.4670 7 L 4.0096 7.8058 121.6117 54.4389 42.1222 175.6135 8 P 4.5887 0.0000 0.0000 63.6489 32.2226 176.2455 *10 D 4.4895 7.5912 121.4100 54.3410 41.9192 177.6870 *12 G 3.9397 8.7579 119.1542 45.7087 0.0000 173.8326 13 A 4.0190 8.1339 123.4794 54.3006 18.6728 178.7332 14 L 4.5901 7.6764 114.1462 54.3905 42.2604 176.1853 15 E 4.3146 7.8834 119.7349 56.1641 29.7770 175.6040 16 P 4.7450 0.0000 0.0000 63.2030 31.9720 176.6595 17 H 4.3822 7.9882 117.3128 58.5045 28.8523 175.7808 18 I 4.6736 7.6589 119.3070 58.7663 39.8909 175.8606 19 N 5.1916 9.7060 125.3351 51.4115 39.7074 176.0596 20 A 3.9870 8.8863 122.7622 55.2406 18.2609 179.8992 21 Q 3.9053 8.1007 117.7331 59.2811 29.2456 178.3329 22 I 3.7350 8.4482 121.1833 64.7525 37.2060 178.2126 23 M 4.1070 8.0342 119.5275 58.4556 31.6538 178.7531 24 Q 3.8712 8.2235 119.5434 59.1484 29.3030 178.1520 25 L 3.9805 8.1152 120.1694 58.0533 41.6208 178.9098 26 H 4.3803 8.9054 118.5251 59.5407 29.6911 176.7275 27 H 4.4219 8.2867 120.0068 59.2155 29.7018 177.3644 28 S 4.2177 8.2817 114.3696 60.1087 63.2482 174.6736 29 K 4.3258 7.9977 119.7749 58.2850 33.8127 177.9556 30 H 3.7064 7.8597 115.4377 59.1123 28.8453 177.3054 31 H 4.4208 8.6039 119.7529 59.2948 29.7630 176.8757 32 A 3.9312 7.7834 122.3941 55.4353 18.0391 179.5614 33 A 3.8817 7.7857 118.8999 55.1103 18.3083 179.8017 34 F 4.5761 7.5329 117.4582 60.1558 38.9821 178.0030 35 V 3.5074 7.9946 117.7240 66.0957 31.3508 177.6188 36 N 4.3175 8.1323 116.7391 56.8449 38.7278 176.6264 37 N 4.4106 8.5559 118.1854 55.9322 38.4817 177.2162 38 L 3.9634 8.3180 122.2890 58.2453 42.2407 178.7527 39 N 4.3652 8.2808 116.4171 56.3759 38.4252 177.5991 40 V 3.6131 7.9680 119.5616 66.3566 31.4184 178.2092 41 T 3.9098 8.0476 114.6459 66.6457 68.3430 176.1428 42 E 4.1452 8.3491 119.9101 59.5146 29.8491 179.0155 43 E 4.1953 8.2823 118.5588 59.1105 29.5290 180.4825 44 K 4.2123 8.2396 117.3636 56.6856 32.1080 178.7889 *46 Q 4.2398 8.0602 121.7155 56.3092 31.1084 176.9613 47 E 3.9460 8.0952 116.5775 59.3652 29.4091 179.2437 48 A 3.9976 8.0702 120.7554 55.0531 18.4568 179.4252 49 L 3.8805 7.9091 118.1565 58.3299 42.0364 178.9367 50 A 4.0594 8.1100 119.7625 54.5768 18.3975 178.7965 51 K 4.3221 7.9014 114.1046 55.6511 32.4916 177.1623 52 G 3.8510 7.6975 107.2207 46.8550 0.0000 175.0299 53 D 4.5778 7.9607 121.1543 52.8742 40.1631 176.0116 54 V 3.6557 8.0026 125.7160 65.6867 31.7577 177.4225 55 T 3.8498 7.9620 115.0105 66.4775 68.5025 176.2368 56 A 3.9890 8.3983 122.6576 55.2175 18.1735 179.6232 57 Q 3.9647 7.9097 115.3595 59.3611 29.1323 179.0081 58 I 3.8669 7.9941 120.5473 64.2773 36.9214 178.4001 59 A 4.0970 8.1717 120.8288 54.6600 18.4779 178.9492 60 L 4.2529 7.7661 116.2428 56.3656 41.8234 179.0812 61 Q 4.0271 7.9078 119.0346 58.5441 28.6024 176.8328 62 P 4.2864 0.0000 0.0000 65.7109 31.3357 178.5438 63 A 4.1416 8.0110 119.0212 54.8871 18.2601 179.3681 64 L 3.9099 8.0844 119.0775 58.1795 42.1450 179.1404 65 K 3.9366 8.4577 120.0535 59.3661 32.1292 178.6398 66 F 4.2177 8.5658 121.1030 61.5466 39.3057 176.8901 67 N 4.4629 8.6925 116.3895 55.8311 38.4305 177.8737 68 G 3.6959 8.4771 107.7227 47.6441 0.0000 175.9105 69 G 3.9721 7.5648 110.2741 46.7628 0.0000 175.8190 70 G 2.2202 7.3745 108.3070 44.9901 0.0000 175.1717 71 H 4.2117 7.9702 120.8759 58.9283 29.9013 177.2111 72 I 3.4751 7.6716 121.7408 64.4892 36.4194 178.2057 73 N 3.8873 7.9377 117.2833 56.5833 38.2163 177.4023 74 H 3.7066 7.8358 117.4694 58.4972 28.4369 177.9607 75 S 4.2257 7.6644 116.2982 61.6745 62.8083 176.6336 76 I 3.8669 7.5662 122.2953 64.3109 36.9020 177.9882 77 F 4.2924 8.1927 121.7578 61.5013 38.6820 177.2954 78 W 4.5139 7.7407 118.5200 59.9311 28.6088 178.4435 79 T 4.1127 7.7263 108.6740 64.0316 68.7020 175.2218 80 N 4.5426 8.0580 118.2980 53.9233 39.0591 174.4411 81 L 5.1157 6.8845 117.4055 53.0978 44.9550 175.7313 82 S 4.5692 8.4398 113.2801 56.6449 65.6148 174.5154 83 P 4.3211 0.0000 0.0000 65.3551 31.2119 176.7027 84 N 4.8033 8.1357 114.2818 52.9815 39.3675 175.7646 85 G 3.9132 7.6542 111.2048 46.7859 0.0000 173.5705 86 G 4.2812 7.8670 109.1623 46.5820 0.0000 174.2200 87 G 3.8827 8.5421 105.2709 45.9832 0.0000 172.6747 88 E 3.5918 8.2139 120.7877 53.0680 32.0194 174.1069 89 P 4.0360 0.0000 0.0000 62.5169 32.0232 175.8776 90 K 4.3617 8.2007 118.8646 55.8035 34.8188 178.5350 91 G 3.8064 8.3022 107.7739 45.8911 0.0000 174.2945 92 E 3.9199 8.6837 117.7466 59.1998 29.5637 179.4908 93 L 3.9588 7.9131 120.1020 58.1336 42.0192 178.6248 94 L 3.8244 7.6574 119.9371 58.0997 41.9188 178.8259 95 E 3.9594 7.9918 117.9528 58.9654 29.4408 178.9132 96 A 3.9901 8.4263 121.4702 55.2170 18.4713 179.6282 97 I 3.8274 8.1034 118.7201 64.6339 37.1799 178.8652 98 K 4.1445 8.4310 119.5911 59.3994 31.6455 179.4195 99 R 3.8635 8.0294 118.1918 59.3117 30.1127 177.6811 100 D 4.3451 8.0260 116.8685 54.9826 41.3284 177.1456 101 F 4.9014 8.3574 114.9642 56.5035 41.0471 174.4570 102 G 4.2177 9.1800 108.6430 45.8355 0.0000 174.1083 103 S 4.6239 7.4461 111.8467 56.3810 66.0856 177.0884 104 F 4.2913 8.3793 123.5362 61.6697 39.0845 176.6183 105 D 4.0802 8.1729 117.9720 57.2383 40.6568 178.8677 106 K 3.9227 7.8993 118.4860 59.2582 31.9975 179.0857 107 F 3.7520 8.1892 120.8856 61.2546 39.1854 177.3348 108 K 2.7276 7.5375 118.1790 58.7829 31.4757 178.8972 109 E 3.7652 7.7376 119.5537 59.1502 29.4500 179.1537 110 K 3.8841 7.7836 118.3802 59.4268 32.1397 179.2421 111 L 3.8801 7.7538 120.9495 58.1141 41.9022 179.0911 112 T 3.8473 8.2051 115.9829 66.6243 68.5124 176.3442 113 A 3.9786 8.2585 122.7086 55.2225 18.1580 179.5433 114 A 3.9822 8.0327 118.3972 55.2014 18.5585 179.9192 115 S 4.1517 7.9518 113.6902 61.9267 62.8738 177.3776 116 V 3.6989 8.0291 114.0303 64.0658 31.3056 178.4831 117 G 3.8065 7.8325 104.1352 45.3855 0.0000 174.0349 118 V 3.5877 6.9477 121.7062 63.4815 31.9983 176.9662 119 Q 4.2805 9.3327 129.8523 52.1838 27.5579 175.6365 120 G 3.5207 7.2005 106.1210 44.7147 0.0000 170.9372 121 S 3.9111 7.8908 116.9855 57.1274 64.2329 174.6103 122 G 4.2248 6.9017 107.9503 46.1014 0.0000 171.0853 123 W 5.2083 8.3392 118.6640 54.9520 33.9029 174.6653 124 G 4.4914 8.5603 110.8520 44.0150 0.0000 172.6809 125 W 5.7181 9.4719 123.2563 54.6256 33.6977 174.0189 126 L 5.0494 9.5375 126.7965 54.1869 43.0157 175.6785 127 G 4.6875 9.6035 113.2928 44.4146 0.0000 170.7134 128 F 5.2378 9.1567 122.3603 56.2673 41.9335 173.9492 129 N 4.7352 8.4833 126.1768 52.2041 38.4275 175.6393 130 K 4.1577 8.6208 126.8556 59.1575 32.6646 178.6774 131 E 4.0422 8.2351 118.9110 58.7314 29.7083 177.5607 132 R 4.0448 8.1670 116.0916 55.6917 30.7254 176.3685 133 G 3.8319 8.1248 105.9727 46.0439 0.0000 172.4924 134 H 4.8385 6.6625 112.5889 53.6861 32.3812 172.6425 135 L 4.8566 8.8559 119.1794 55.2211 42.5813 176.9582 136 Q 4.7120 9.3272 121.7319 55.3886 32.8491 173.3006 137 I 5.1387 8.8362 126.9704 60.7308 38.9741 174.8487 138 A 4.8800 9.1328 125.4813 50.8135 22.9682 174.8838 139 A 5.3770 8.7151 121.1113 50.4378 21.9317 175.8121 140 C 5.1410 9.3848 118.3518 57.2318 32.2273 171.9844 141 P 4.8817 0.0000 0.0000 62.3767 32.8639 176.5107 142 N 4.2170 9.1251 119.7605 55.5119 38.0054 175.7743 143 Q 4.7775 9.1393 126.0674 56.5098 28.9494 174.1897 144 D 4.4938 8.3007 119.4845 54.2467 41.1343 175.4567 145 P 4.5721 0.0000 0.0000 61.0975 33.8657 176.9160 146 L 3.5900 7.4845 120.9023 58.3350 41.9966 179.2035 147 Q 4.4369 6.9974 120.3511 58.7226 28.9427 178.1665 148 G 3.5594 7.9227 104.8442 46.8403 0.0000 174.5062 149 T 4.4844 7.5177 109.7776 61.8981 70.1026 175.1039 150 T 4.4302 8.0297 109.0375 60.2741 70.3551 174.4228 151 G 4.0761 8.2643 110.5352 45.3869 0.0000 174.3030 152 L 4.1837 7.2169 118.5508 54.9442 42.2534 175.9709 153 I 4.4979 8.7002 124.8515 59.7662 38.3896 173.5669 154 P 4.4801 0.0000 0.0000 63.0898 31.3799 175.4659 155 L 4.7500 9.2752 123.1979 55.8117 43.9741 176.9145 156 L 5.0312 8.2956 120.1418 53.4718 45.4291 174.8922 157 G 3.3272 9.4030 113.5262 43.9598 0.0000 172.4789 158 I 4.3766 8.0778 123.9459 58.8616 40.0390 174.3965 159 D 3.3700 7.2647 127.7524 52.8712 41.3902 176.2280 160 V 4.3015 7.4216 120.1946 60.6121 32.9992 176.2932 161 W 3.9929 8.2499 120.5793 56.5108 29.4530 177.5327 162 E 3.9749 8.7621 121.4593 59.6554 29.0840 178.4421 163 H 4.3168 8.2028 112.8248 58.0395 28.6544 176.4162 164 A 4.1022 7.4725 122.5107 52.4822 17.4695 178.3372 *167 L 4.3153 7.9303 121.3223 55.9975 43.5190 177.7376 168 Q 4.3978 7.9613 116.3500 56.1852 30.5310 175.7683 *170 K 4.3840 7.3820 115.7455 56.9197 32.5903 177.8769 171 N 4.5142 8.8115 124.0501 55.3014 37.9758 176.2984 172 V 3.9428 7.1176 121.0779 60.8314 30.0659 175.5911 173 R 3.8717 8.1354 123.5968 58.7177 30.4690 175.8645 174 P 4.4008 0.0000 0.0000 65.5881 31.6999 177.7355 175 D 4.7991 8.1679 117.2257 54.8032 40.6248 178.2289 *177 L 4.1230 8.0461 121.3676 54.7260 43.5296 179.2518 178 K 4.2960 8.3851 119.0314 59.5794 32.0099 178.7671 179 A 4.1210 8.0986 121.1149 55.0579 18.3014 179.4415 180 I 3.5871 7.4148 115.8457 63.6410 38.0830 178.0381 181 W 4.3246 7.5617 119.7977 59.5880 28.6400 177.5538 182 N 4.7485 8.4498 115.7375 54.8225 37.7717 176.4487 183 V 4.6124 7.6938 112.6920 60.5864 33.3594 175.1792 184 I 3.7439 7.5305 122.3004 61.3411 37.3653 175.1810 185 N 4.7263 8.7483 124.6399 52.3346 37.6443 175.4432 186 W 4.5161 8.1817 126.8594 58.8885 29.4605 177.2297 187 E 4.0307 8.4760 119.4040 59.3715 29.0428 178.2864 188 N 4.3476 8.5215 117.0044 56.6966 38.8461 177.0490 189 V 3.7257 7.6669 118.5620 66.3744 31.7078 177.7903 190 T 4.0944 8.4780 114.9392 66.6009 68.5544 176.0279 191 E 4.2018 8.3271 120.4632 59.4997 27.9596 180.4977 192 R 4.1914 7.9455 114.6498 57.3046 29.9055 178.4287 *194 M 4.4854 8.1039 120.6771 55.2908 33.8738 177.4005 195 A 4.1304 7.6744 119.5934 54.0776 18.6018 177.7497 196 C 4.3099 6.9841 110.4133 60.0870 28.6653 175.5546 197 K 4.2850 7.2135 120.2200 55.8227 29.0685 177.2128 198 K 4.1478 7.8032 121.1472 56.6322 33.0300 176.0881 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 1 K 8.31 4.35 0.00 1.72 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.47 7.81 2 H 9.13 4.34 0.00 3.23 3.14 0.00 5.65 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 3 S 8.41 4.71 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 4 L 8.34 4.10 0.00 1.55 1.62 0.68 0.82 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 5 P 0.00 4.52 0.00 2.39 2.16 0.00 3.89 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.24 0.00 6 D 8.43 4.53 0.00 2.68 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 7 L 7.81 4.01 0.00 1.39 1.37 0.48 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.59 0.00 2.04 2.07 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 *10 D 7.59 4.49 0.00 2.69 1.72 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 *12 G 8.76 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 A 8.13 4.02 1.33 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 14 L 7.68 4.59 0.00 1.84 1.67 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 15 E 7.88 4.31 0.00 2.00 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 2.36 2.40 0.00 16 P 0.00 4.75 0.00 2.10 2.08 0.00 3.39 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 1.70 1.88 0.00 17 H 7.99 4.38 0.00 3.30 3.55 0.00 5.64 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 18 I 7.66 4.67 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 1.38 0.62 0.98 0.00 0.00 19 N 9.71 5.19 0.00 3.11 2.95 0.00 0.00 6.73 7.55 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 20 A 8.89 3.99 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 21 Q 8.10 3.91 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 22 I 8.45 3.73 2.04 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 1.55 0.51 1.06 0.00 0.00 23 M 8.03 4.11 0.00 1.90 2.06 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.92 0.00 24 Q 8.22 3.87 0.00 2.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 25 L 8.12 3.98 0.00 1.79 1.76 0.95 0.93 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 26 H 8.91 4.38 0.00 3.57 3.60 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 H 8.29 4.42 0.00 2.56 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.28 4.22 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 29 K 8.00 4.33 0.00 1.77 1.68 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.31 1.52 7.81 30 H 7.86 3.71 0.00 3.40 3.06 0.00 5.62 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 31 H 8.60 4.42 0.00 3.57 3.59 0.00 5.63 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 32 A 7.78 3.93 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 33 A 7.79 3.88 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 34 F 7.53 4.58 0.00 3.33 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 35 V 7.99 3.51 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 0.95 0.00 0.00 0.92 0.00 0.00 36 N 8.13 4.32 0.00 2.89 2.79 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.56 4.41 0.00 3.06 2.96 0.00 0.00 6.67 7.60 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 38 L 8.32 3.96 0.00 1.77 1.89 0.89 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 39 N 8.28 4.37 0.00 2.92 2.87 0.00 0.00 6.72 7.29 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 40 V 7.97 3.61 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 1.14 0.00 0.00 0.96 0.00 0.00 41 T 8.05 3.91 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 1.27 0.00 0.00 42 E 8.35 4.15 0.00 2.11 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 2.38 2.52 0.00 43 E 8.28 4.20 0.00 2.17 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 2.34 2.52 0.00 44 K 8.24 4.21 0.00 1.97 1.84 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.62 7.81 *46 Q 8.06 4.24 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.46 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 47 E 8.10 3.95 0.00 2.22 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 2.34 2.54 0.00 48 A 8.07 4.00 1.33 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 49 L 7.91 3.88 0.00 1.77 1.84 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.11 4.06 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 51 K 7.90 4.32 0.00 1.78 1.86 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.54 7.81 52 G 7.70 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 53 D 7.96 4.58 0.00 2.77 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 54 V 8.00 3.66 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.98 0.00 0.00 55 T 7.96 3.85 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 1.22 0.00 0.00 56 A 8.40 3.99 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 57 Q 7.91 3.96 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 58 I 7.99 3.87 1.88 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 1.46 0.64 0.92 0.00 0.00 59 A 8.17 4.10 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 60 L 7.77 4.25 0.00 1.93 1.74 0.94 0.62 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 61 Q 7.91 4.03 0.00 2.24 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.78 0.00 0.00 0.00 0.00 0.00 2.40 2.71 0.00 62 P 0.00 4.29 0.00 2.18 2.12 0.00 3.75 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 2.13 2.18 0.00 63 A 8.01 4.14 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 64 L 8.08 3.91 0.00 1.87 1.83 0.92 0.50 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 65 K 8.46 3.94 0.00 1.87 1.86 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.51 1.46 7.81 66 F 8.57 4.22 0.00 3.20 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 67 N 8.69 4.46 0.00 3.03 3.16 0.00 0.00 6.98 8.72 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 68 G 8.48 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 69 G 7.56 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 70 G 7.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 H 7.97 4.21 0.00 3.30 3.40 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.67 3.48 1.75 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 1.37 0.43 0.66 0.00 0.00 73 N 7.94 3.89 0.00 1.83 1.42 0.00 0.00 7.13 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 74 H 7.84 3.71 0.00 2.84 2.77 0.00 5.82 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 75 S 7.66 4.23 0.00 3.88 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 76 I 7.57 3.87 2.10 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.16 1.14 0.00 0.00 77 F 8.19 4.29 0.00 3.06 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 78 W 7.74 4.51 0.00 3.40 3.06 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 79 T 7.73 4.11 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 80 N 8.06 4.54 0.00 2.98 2.78 0.00 0.00 6.61 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 6.88 5.12 0.00 1.47 1.38 0.30 0.33 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 82 S 8.44 4.57 0.00 3.76 3.67 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 83 P 0.00 4.32 0.00 2.22 2.36 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 84 N 8.14 4.80 0.00 2.74 2.90 0.00 0.00 6.83 7.65 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 85 G 7.65 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.87 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 0.00 0.00 0.00 0.00 87 G 8.54 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.21 3.59 0.00 1.47 1.12 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 1.47 1.92 0.00 89 P 0.00 4.04 0.00 1.83 1.30 0.00 2.36 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.88 0.00 90 K 8.20 4.36 0.00 1.73 1.72 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.34 7.81 91 G 8.30 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.68 3.92 0.00 2.03 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 2.37 0.00 93 L 7.91 3.96 0.00 1.82 1.63 1.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 94 L 7.66 3.82 0.00 1.70 1.68 0.73 1.33 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 95 E 7.99 3.96 0.00 2.12 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 2.52 2.30 0.00 96 A 8.43 3.99 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 97 I 8.10 3.83 1.98 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.66 0.97 0.00 0.00 98 K 8.43 4.14 0.00 1.94 1.87 0.00 1.78 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.65 7.81 99 R 8.03 3.86 0.00 1.86 2.09 0.00 3.24 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 100 D 8.03 4.35 0.00 2.20 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 0.00 0.00 0.00 101 F 8.36 4.90 0.00 3.29 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 G 9.18 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 S 7.45 4.62 0.00 4.06 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 0.00 104 F 8.38 4.29 0.00 3.03 3.06 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 0.00 105 D 8.17 4.08 0.00 2.74 2.63 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 0.00 106 K 7.90 3.92 0.00 2.07 2.01 0.00 1.71 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.46 7.81 107 F 8.19 3.75 0.00 2.96 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 0.00 108 K 7.54 2.73 0.00 1.15 0.82 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.29 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 109 E 7.74 3.77 0.00 2.14 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 2.24 2.32 0.00 110 K 7.78 3.88 0.00 1.69 1.77 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.68 7.81 111 L 7.75 3.88 0.00 1.41 1.45 0.96 0.92 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 0.00 112 T 8.21 3.85 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 113 A 8.26 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 0.00 114 A 8.03 3.98 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 0.00 115 S 7.95 4.15 0.00 3.95 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 0.00 116 V 8.03 3.70 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.98 0.00 0.00 117 G 7.83 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 6.95 3.59 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 0.71 0.00 0.00 0.96 0.00 0.00 119 Q 9.33 4.28 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.53 0.00 120 G 7.20 3.52 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 0.00 0.00 0.00 121 S 7.89 3.91 0.00 2.85 2.63 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 0.00 122 G 6.90 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 W 8.34 5.21 0.00 3.32 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 0.00 124 G 8.56 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 9.47 5.72 0.00 3.42 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 9.54 5.05 0.00 2.23 1.92 1.31 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 127 G 9.60 4.69 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 0.00 128 F 9.16 5.24 0.00 3.15 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 0.00 129 N 8.48 4.74 0.00 2.80 2.55 0.00 0.00 6.81 6.46 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 0.00 130 K 8.62 4.16 0.00 1.83 1.95 0.00 1.86 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.72 1.53 7.81 131 E 8.24 4.04 0.00 1.89 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 0.00 2.23 2.29 0.00 132 R 8.17 4.04 0.00 1.39 1.34 0.00 3.40 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 133 G 8.12 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 0.00 0.00 0.00 134 H 6.66 4.84 0.00 3.36 3.26 0.00 5.48 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.86 4.86 0.00 1.59 1.94 1.06 1.38 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 0.00 136 Q 9.33 4.71 0.00 2.11 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.86 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 137 I 8.84 5.14 2.04 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 1.44 0.91 1.00 0.00 0.00 138 A 9.13 4.88 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 0.00 139 A 8.72 5.38 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 0.00 140 C 9.38 5.14 0.00 3.13 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 0.00 141 P 0.00 4.88 0.00 2.17 2.20 0.00 3.94 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 2.30 2.05 0.00 142 N 9.13 4.22 0.00 3.17 2.60 0.00 0.00 6.87 7.84 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 0.00 143 Q 9.14 4.78 0.00 1.97 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 7.04 0.00 0.00 0.00 0.00 0.00 2.21 1.27 0.00 144 D 8.30 4.49 0.00 2.85 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 0.00 145 P 0.00 4.57 0.00 2.02 1.93 0.00 3.81 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.74 0.00 146 L 7.48 3.59 0.00 0.35 0.81 0.81 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 147 Q 7.00 4.44 0.00 1.97 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.34 2.20 0.00 148 G 7.92 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 7.52 4.48 4.23 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 1.23 0.00 0.00 150 T 8.03 4.43 4.23 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 1.20 0.00 0.00 151 G 8.26 4.08 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 0.00 152 L 7.22 4.18 0.00 1.71 1.61 0.96 0.70 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 0.00 153 I 8.70 4.50 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 1.52 1.09 0.90 0.00 0.00 154 P 0.00 4.48 0.00 1.70 0.88 0.00 3.57 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.54 0.00 155 L 9.28 4.75 0.00 1.85 1.91 1.14 0.99 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 0.00 156 L 8.30 5.03 0.00 1.89 1.73 0.85 1.11 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 0.00 157 G 9.40 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 0.00 0.00 0.00 158 I 8.08 4.38 1.60 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.63 0.63 0.00 0.00 159 D 7.26 3.37 0.00 1.58 1.54 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 0.00 160 V 7.42 4.30 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 0.53 0.00 0.00 0.81 0.00 0.00 161 W 8.25 3.99 0.00 2.97 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 0.00 162 E 8.76 3.97 0.00 1.97 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 2.27 2.23 0.00 163 H 8.20 4.32 0.00 3.18 3.49 0.00 5.53 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 0.00 164 A 7.47 4.10 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 *167 L 7.93 4.32 0.00 1.69 1.80 0.94 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 168 Q 7.96 4.40 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.56 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 *170 K 7.38 4.38 0.00 1.85 1.40 0.00 1.73 0.00 0.00 1.87 0.00 0.00 3.04 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.43 1.38 7.81 171 N 8.81 4.51 0.00 2.81 2.92 0.00 0.00 5.79 7.68 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 0.00 172 V 7.12 3.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.92 0.00 0.00 173 R 8.14 3.87 0.00 1.76 1.93 0.00 3.23 0.00 0.00 3.13 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 174 P 0.00 4.40 0.00 2.22 2.09 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 175 D 8.17 4.80 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 *177 L 8.05 4.12 0.00 1.82 1.83 0.77 0.69 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 0.00 178 K 8.39 4.30 0.00 1.96 2.01 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.55 7.81 179 A 8.10 4.12 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 0.00 180 I 7.41 3.59 1.72 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 1.28 1.20 0.41 0.00 0.00 181 W 7.56 4.32 0.00 3.44 3.40 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 0.00 182 N 8.45 4.75 0.00 2.48 2.57 0.00 0.00 6.61 7.22 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 0.00 183 V 7.69 4.61 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 0.77 0.00 0.00 0.87 0.00 0.00 184 I 7.53 3.74 1.13 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.78 -0.51 0.00 0.00 185 N 8.75 4.73 0.00 2.65 2.73 0.00 0.00 6.87 8.36 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 0.00 186 W 8.18 4.52 0.00 3.49 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 0.00 187 E 8.48 4.03 0.00 2.10 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 0.00 2.56 2.42 0.00 188 N 8.52 4.35 0.00 2.85 2.96 0.00 0.00 6.88 7.81 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 0.00 189 V 7.67 3.73 2.48 0.00 0.00 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 1.04 0.00 0.00 190 T 8.48 4.09 4.54 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 1.24 0.00 0.00 191 E 8.33 4.20 0.00 2.23 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 2.36 2.73 0.00 192 R 7.95 4.19 0.00 2.07 1.97 0.00 3.42 0.00 0.00 3.39 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 *194 M 8.10 4.49 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.62 0.00 195 A 7.67 4.13 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 0.00 196 C 6.98 4.31 0.00 2.04 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 0.00 0.00 0.00 197 K 7.21 4.29 0.00 1.83 1.73 0.00 1.27 0.00 0.00 1.50 0.00 0.00 3.27 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.40 7.81 198 K 7.80 4.15 0.00 1.72 1.64 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.30 1.44 7.81 * Residues marked with a * may have inaccurate shift predictions.