NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7220 8.4249 118.1242 53.2916 38.8541 172.9324 3 T 3.7172 7.9554 119.1650 62.3952 69.2934 172.8943 4 K 4.2091 8.9871 126.5367 55.3391 34.1618 175.4416 5 Y 4.8534 9.0228 122.1900 56.1521 39.9779 175.7519 6 N 4.5504 8.7436 121.5379 53.3236 40.5205 175.8548 7 K 3.8249 8.8952 128.3615 59.8324 32.2941 178.6333 8 E 3.9110 8.2893 118.2675 59.3758 29.4398 178.9198 9 F 4.2256 8.2306 120.2130 61.2991 39.4455 177.0396 10 L 3.8217 8.1806 118.7706 57.3065 41.2613 179.4879 11 L 3.6411 7.9755 119.5570 57.7109 41.4946 178.8568 12 Y 3.9259 7.8032 119.2675 60.6941 38.8137 177.6804 13 L 3.9726 8.0534 121.1396 58.1418 42.0168 178.7423 14 A 4.2063 8.3803 121.2340 55.0231 18.3976 179.9420 15 G 3.3876 7.6967 104.4722 47.8437 0.0000 175.8472 16 F 3.7144 8.1447 123.4554 60.6797 39.2632 177.4505 17 V 3.6628 8.4065 118.4012 66.2480 31.2279 177.8263 18 D 4.4201 8.1683 117.3959 57.4986 40.5904 178.1016 19 G 3.5609 7.5786 105.8273 45.4877 0.0000 174.3743 20 D 4.7449 8.1265 119.0916 52.3609 41.6557 176.7546 21 G 3.9058 7.6536 108.1326 45.6359 0.0000 173.4144 22 S 4.6127 9.1580 114.3026 57.0310 66.2183 172.8963 23 I 4.7971 8.5647 128.1097 59.9760 38.6066 174.5532 24 I 4.6151 8.9342 128.6802 59.1569 39.9275 174.7642 25 A 5.2379 8.6672 127.7416 50.2902 21.1935 175.2842 26 Q 4.6226 9.6254 121.0486 54.1205 33.4857 174.9660 27 I 4.6994 8.4535 122.0559 59.7613 38.9838 174.5765 28 A 4.6589 8.7985 130.7429 49.2044 20.4951 174.3609 29 P 4.4959 0.0000 0.0000 63.6054 32.1051 175.9251 30 N 4.7543 8.8068 123.9756 52.3540 41.2875 174.9417 31 Q 4.1847 9.0816 126.4365 57.8933 28.9255 177.5540 32 S 4.5317 8.4564 111.8184 58.4704 63.8571 173.5486 33 Y 4.5461 7.9281 119.8830 56.0126 39.6963 176.1061 34 K 3.5108 8.5612 124.6330 59.8357 31.1865 177.5791 35 F 4.7291 7.5309 114.9598 56.9963 39.0292 176.5197 36 K 4.2636 8.6686 118.8145 57.2410 29.9630 174.4675 37 H 5.2412 7.6295 114.2485 54.7635 33.2227 172.8188 38 Q 4.0630 8.8053 124.3898 54.4440 30.9911 174.4010 39 L 4.8229 8.6609 126.3037 53.9311 42.5542 175.6093 40 S 4.8800 9.0367 120.1272 56.3831 64.6536 172.7474 41 L 5.3531 8.5596 125.8431 53.4406 44.7614 176.0477 42 T 4.7254 9.3003 118.9809 62.1229 73.7372 172.3846 43 F 5.2860 9.0029 128.5650 56.6904 41.2701 174.5517 44 V 4.9781 8.5724 125.8228 59.8527 35.5480 174.4189 45 V 4.4948 8.0394 124.5656 61.6841 34.4055 173.9807 46 T 5.0659 8.0364 124.5863 62.4551 70.5982 174.0257 47 Q 4.5713 8.7977 123.6882 54.5424 33.2828 173.2590 48 K 4.2314 8.7257 125.5360 57.3119 32.8571 177.8741 49 T 3.9782 8.9727 123.3307 66.4467 68.5737 176.4480 50 Q 4.2315 8.1629 117.7561 57.9508 28.9669 176.8189 51 R 4.7118 8.0320 118.0928 55.8774 30.7598 177.8033 52 R 4.0287 8.2036 118.9926 58.8359 29.0349 178.4234 53 W 4.3132 8.3755 117.5449 59.7111 27.8526 177.8081 54 F 3.2658 7.0171 121.1404 60.8086 38.8108 177.1877 55 L 4.0665 7.7440 118.0897 57.9144 41.1428 179.0581 56 D 4.4697 9.0183 119.6333 57.0320 40.7175 178.7316 57 K 3.9010 8.4456 120.6509 59.5227 32.1877 178.8219 58 L 3.7807 7.5246 119.2065 57.5035 41.3040 179.5295 59 V 3.6933 7.5111 117.7395 66.1916 31.2362 177.5912 60 D 4.2794 7.4612 115.5948 57.5580 41.1787 177.7825 61 E 3.9064 7.8587 117.7017 59.1677 29.4974 178.9630 62 I 3.7778 8.1697 119.4878 61.8823 37.2876 177.4552 63 G 4.0328 9.5647 106.7741 45.3782 0.0000 173.0226 64 V 4.3794 7.5116 116.9209 60.9542 34.1277 173.8111 65 G 3.7932 10.1731 106.7038 45.3457 0.0000 171.3812 66 Y 4.8172 7.4565 114.9186 56.4888 41.7128 173.2350 67 V 5.0249 8.6993 119.8510 61.0380 33.7970 174.6582 68 R 4.8717 8.8490 123.7438 54.5475 32.5011 174.0663 69 D 5.1205 8.7789 121.6447 52.5289 42.3311 176.4841 70 R 4.6167 8.5764 119.8746 56.1170 31.4457 175.4416 71 G 4.1985 8.6411 108.1506 45.5709 0.0000 176.7615 72 S 4.4006 9.5388 124.6267 59.8379 64.8030 174.3824 73 V 4.9045 7.7494 119.8321 61.1805 35.2420 174.1419 74 S 5.3326 9.3353 120.6210 56.8993 67.5484 172.6615 75 D 5.3071 8.9256 120.2642 52.8622 45.2488 174.1479 76 Y 4.8170 9.1903 124.8287 56.7530 40.4353 174.1072 77 I 4.4800 8.0242 127.4684 59.0437 41.2259 174.2761 78 L 4.6223 8.3196 127.0782 53.8425 44.3202 176.4693 79 S 4.4479 8.8245 121.8480 59.7446 65.3014 174.8578 80 E 3.8909 8.2374 119.7393 56.6129 29.8230 177.4930 81 I 3.7616 8.6894 125.4618 64.6042 37.2970 177.9052 82 K 3.9467 8.0896 119.2514 59.4193 32.1840 176.9822 83 P 4.4305 0.0000 0.0000 65.2686 31.1474 178.4514 84 L 4.1632 8.2027 119.6735 58.2026 42.0286 178.4646 85 H 4.0984 8.5341 118.3598 59.3323 29.9400 176.8010 86 N 4.4369 8.3927 118.9546 56.5298 38.7647 176.6880 87 F 4.5773 8.4861 122.0819 61.5794 39.6193 177.3508 88 L 3.6025 8.2366 118.7465 57.7089 41.0608 179.7481 89 T 3.7543 7.6294 115.2602 66.7500 68.4601 176.3840 90 Q 4.1485 7.4566 117.4214 58.5331 29.0084 178.0795 91 L 4.0643 7.8034 121.5284 58.0142 42.0834 178.5689 92 Q 3.7568 7.8754 120.0961 58.6891 28.8687 177.4286 93 P 4.1629 0.0000 0.0000 64.4295 31.2631 176.2858 94 F 4.8646 7.5208 116.0172 57.3298 40.0836 175.9808 95 L 4.3670 7.6005 121.2283 54.4114 42.1153 176.8112 96 K 4.4871 9.6081 120.1034 56.6391 34.5320 177.4134 97 L 4.5201 8.1407 116.5937 55.0433 43.1278 177.1736 98 K 5.3433 7.7625 116.4565 54.7654 33.4417 178.0487 99 Q 3.9199 8.2745 122.4050 59.0651 28.8851 177.5634 100 K 3.8760 7.9646 119.2895 59.6143 32.2663 179.1058 101 Q 3.9416 8.0909 117.0397 59.1427 28.3953 178.2779 102 A 3.9658 7.9086 122.4674 55.2652 18.4869 179.4612 103 N 4.2727 8.3556 114.9673 56.0980 38.5313 177.8202 104 L 3.8160 8.0004 121.0260 57.4293 41.6297 179.5414 105 V 3.6024 8.0633 118.5144 66.0923 31.4136 177.8406 106 L 3.9159 7.9254 118.7077 57.8933 41.2272 179.6010 107 K 3.9186 7.7836 118.2213 59.3855 32.3417 178.6516 108 I 4.0897 7.8084 120.0295 64.7556 36.7402 178.3020 109 I 3.8376 8.0260 120.5971 64.7335 36.7207 178.0874 110 E 4.2765 7.9936 117.7250 58.0734 29.6163 178.0751 111 Q 4.6674 8.2144 117.2415 55.3670 29.3512 177.1118 112 L 4.0889 7.6318 121.4302 57.5779 41.5543 177.6628 113 P 4.3563 0.0000 0.0000 65.9946 31.4193 177.9703 114 S 4.2788 8.1355 112.2699 61.0887 62.4098 175.7254 115 A 4.1408 8.5344 124.0648 55.0734 17.9233 179.4241 116 K 4.2061 8.1927 117.0277 59.1122 32.3350 178.3237 117 E 4.3362 8.0427 117.9163 57.1471 30.1932 176.5937 118 S 4.7867 7.5741 112.1902 54.8709 65.9059 172.9007 119 P 3.2385 0.0000 0.0000 65.4654 31.0610 178.6346 120 D 4.3210 7.8267 117.5625 56.5266 40.7099 178.9621 121 K 3.9095 7.7155 119.0018 59.1010 32.2535 178.8044 122 F 3.9862 8.2964 121.2205 61.0917 39.0252 176.9149 123 L 3.7133 7.6916 118.9311 57.9416 42.1603 178.1651 124 E 3.5896 7.7428 119.2087 59.1599 29.4329 178.9942 125 V 2.4303 7.5251 118.4810 65.8083 31.6427 177.6805 126 C 3.8449 7.6780 116.4906 63.0292 27.5120 176.3067 127 T 4.2807 7.2606 118.6809 65.6714 67.7583 176.8040 128 W 4.6589 8.1370 121.6555 59.7466 29.0370 178.6700 129 V 3.6398 7.7308 117.8192 66.0476 30.9118 177.4829 130 D 4.3850 7.9680 118.1648 57.7270 40.7360 178.9230 131 Q 4.0485 7.8918 118.0051 59.0058 28.6765 179.1439 132 I 3.7151 7.6935 120.5396 64.1935 36.9481 178.2237 133 A 3.9642 7.8370 120.1369 55.2614 18.3256 179.1108 134 A 4.0819 8.0687 118.1601 55.4695 18.4771 179.5998 135 L 4.0934 7.7593 116.4970 57.2236 41.9022 177.5282 136 N 4.6702 7.7325 115.5633 52.7676 40.1880 174.9669 137 D 4.6577 8.0928 119.0247 53.4559 39.8233 177.7564 138 S 4.2019 7.7034 113.5331 58.5873 63.2242 173.4435 139 K 4.6636 8.6465 125.0495 56.1527 34.1237 176.3393 140 T 4.6969 7.5849 108.4176 60.9901 69.2515 173.7979 141 R 4.1170 8.1920 122.0976 57.3253 30.9230 174.4511 142 K 4.3268 8.6152 122.4955 58.2546 34.2422 176.6993 143 T 4.1941 7.8108 117.3681 63.0100 68.7091 174.1744 144 T 4.6605 8.0969 117.6823 59.3100 71.6243 175.1954 145 S 4.0941 8.4369 115.1702 61.3689 62.3432 175.9504 146 E 3.9278 7.9845 122.9862 59.1125 29.0635 178.8521 147 T 4.0026 7.4274 115.1274 66.4537 68.7348 176.7481 148 V 3.6420 7.5441 119.7602 65.5599 31.5900 178.0045 149 R 3.8089 8.2022 118.5724 59.4133 29.8267 178.2589 150 A 4.2983 7.4378 117.9692 54.8899 18.3438 179.3204 151 V 3.7782 7.2681 116.4732 62.5211 31.8018 176.6889 152 L 4.2202 7.7520 121.2310 54.9769 41.1419 176.7452 153 D 4.2573 8.5004 119.0108 54.4785 38.6775 176.4629 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 N 8.42 4.72 0.00 2.70 2.86 0.00 0.00 6.98 6.65 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 3 T 7.96 3.72 3.86 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 0.00 0.00 0.00 0.75 0.00 0.00 4 K 8.99 4.21 0.00 1.64 1.70 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.35 1.42 7.81 5 Y 9.02 4.85 0.00 3.23 3.12 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 0.00 0.00 0.00 6 N 8.74 4.55 0.00 2.89 2.81 0.00 0.00 6.72 6.87 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 7 K 8.90 3.82 0.00 1.91 1.79 0.00 1.87 0.00 0.00 1.95 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.21 1.17 7.81 8 E 8.29 3.91 0.00 2.09 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 2.39 2.37 0.00 9 F 8.23 4.23 0.00 3.12 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.18 3.82 0.00 1.80 1.79 1.26 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.98 3.64 0.00 1.65 1.56 0.71 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.80 3.93 0.00 3.06 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 13 L 8.05 3.97 0.00 1.27 1.35 1.07 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.38 4.21 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 G 7.70 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 F 8.14 3.71 0.00 2.85 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 17 V 8.41 3.66 2.42 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 1.26 0.00 0.00 1.45 0.00 0.00 18 D 8.17 4.42 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 19 G 7.58 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 20 D 8.13 4.74 0.00 2.11 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 21 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 22 S 9.16 4.61 0.00 3.74 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 23 I 8.56 4.80 1.93 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.93 0.96 0.00 0.00 24 I 8.93 4.62 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.63 0.92 0.00 0.00 25 A 8.67 5.24 1.22 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 26 Q 9.63 4.62 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 27 I 8.45 4.70 1.86 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.55 0.92 0.00 0.00 28 A 8.80 4.66 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 29 P 0.00 4.50 0.00 2.04 2.09 0.00 3.77 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 1.98 0.00 30 N 8.81 4.75 0.00 2.63 2.43 0.00 0.00 6.77 6.15 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 31 Q 9.08 4.18 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 32 S 8.46 4.53 0.00 3.95 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 33 Y 7.93 4.55 0.00 3.09 2.86 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 0.00 0.00 0.00 0.00 34 K 8.56 3.51 0.00 1.34 1.12 0.00 1.39 0.00 0.00 0.82 0.00 0.00 2.67 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.37 1.08 7.81 35 F 7.53 4.73 0.00 2.29 2.55 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 0.00 36 K 8.67 4.26 0.00 2.03 1.79 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.36 1.43 7.81 37 H 7.63 5.24 0.00 3.43 3.29 0.00 5.83 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 38 Q 8.81 4.06 0.00 0.93 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 39 L 8.66 4.82 0.00 1.71 1.67 0.79 0.66 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 40 S 9.04 4.88 0.00 3.90 3.71 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 41 L 8.56 5.35 0.00 1.60 1.60 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 42 T 9.30 4.73 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 43 F 9.00 5.29 0.00 3.33 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 44 V 8.57 4.98 1.92 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 1.19 0.00 0.00 0.81 0.00 0.00 45 V 8.04 4.49 2.24 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 1.09 0.00 0.00 0.91 0.00 0.00 46 T 8.04 5.07 4.19 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 1.22 0.00 0.00 47 Q 8.80 4.57 0.00 2.16 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.12 2.27 0.00 48 K 8.73 4.23 0.00 1.87 1.69 0.00 1.78 0.00 0.00 1.84 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.61 7.81 49 T 8.97 3.98 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 1.31 0.00 0.00 50 Q 8.16 4.23 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.32 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 51 R 8.03 4.71 0.00 1.99 1.75 0.00 3.29 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.73 0.00 52 R 8.20 4.03 0.00 2.10 2.36 0.00 2.86 0.00 0.00 3.30 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.90 0.00 53 W 8.38 4.31 0.00 3.64 3.42 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 54 F 7.02 3.27 0.00 1.81 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 7.74 4.07 0.00 1.92 1.83 0.99 1.29 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 56 D 9.02 4.47 0.00 2.90 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 57 K 8.45 3.90 0.00 1.92 1.64 0.00 1.75 0.00 0.00 1.19 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.41 7.81 58 L 7.52 3.78 0.00 1.42 0.93 0.80 0.67 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 59 V 7.51 3.69 2.35 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 1.17 0.00 0.00 1.19 0.00 0.00 60 D 7.46 4.28 0.00 2.68 2.81 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 61 E 7.86 3.91 0.00 1.72 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 2.07 2.31 0.00 62 I 8.17 3.78 1.79 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.17 0.55 0.00 0.00 63 G 9.56 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 V 7.51 4.38 2.17 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 0.77 0.00 0.00 1.01 0.00 0.00 65 G 10.17 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 66 Y 7.46 4.82 0.00 3.07 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 67 V 8.70 5.02 2.20 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 0.93 0.00 0.00 1.14 0.00 0.00 68 R 8.85 4.87 0.00 2.05 2.23 0.00 2.89 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 69 D 8.78 5.12 0.00 2.61 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 70 R 8.58 4.62 0.00 1.89 1.98 0.00 3.04 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 71 G 8.64 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 0.00 0.00 0.00 0.00 72 S 9.54 4.40 0.00 3.92 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 73 V 7.75 4.90 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 0.93 0.00 0.00 74 S 9.34 5.33 0.00 3.74 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 75 D 8.93 5.31 0.00 2.55 2.41 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 76 Y 9.19 4.82 0.00 3.06 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 I 8.02 4.48 0.59 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.16 0.62 0.00 0.00 78 L 8.32 4.62 0.00 1.75 1.68 0.98 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.82 4.45 0.00 3.95 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 80 E 8.24 3.89 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 2.49 2.53 0.00 81 I 8.69 3.76 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.00 0.99 0.00 0.00 82 K 8.09 3.95 0.00 1.91 1.86 0.00 1.64 0.00 0.00 1.85 0.00 0.00 3.09 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.65 7.81 83 P 0.00 4.43 0.00 2.29 2.18 0.00 3.82 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 2.18 2.21 0.00 84 L 8.20 4.16 0.00 2.02 2.00 1.12 0.78 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 85 H 8.53 4.10 0.00 3.41 3.47 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.39 4.44 0.00 2.99 2.94 0.00 0.00 6.91 7.47 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 87 F 8.49 4.58 0.00 3.31 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 88 L 8.24 3.60 0.00 1.72 1.58 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.63 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 1.19 0.00 0.00 90 Q 7.46 4.15 0.00 2.34 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.98 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 91 L 7.80 4.06 0.00 0.92 1.05 0.85 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 7.88 3.76 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.61 0.00 0.00 0.00 0.00 0.00 2.25 2.45 0.00 93 P 0.00 4.16 0.00 1.53 1.82 0.00 3.59 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.65 0.00 94 F 7.52 4.86 0.00 3.15 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 95 L 7.60 4.37 0.00 1.71 1.58 0.95 0.78 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 96 K 9.61 4.49 0.00 1.73 1.79 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.37 7.81 97 L 8.14 4.52 0.00 1.74 1.67 0.87 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.76 5.34 0.00 1.78 1.75 0.00 1.97 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.40 1.33 7.81 99 Q 8.27 3.92 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.72 6.90 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 100 K 7.96 3.88 0.00 1.80 1.80 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.46 7.81 101 Q 8.09 3.94 0.00 2.25 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.63 2.39 0.00 102 A 7.91 3.97 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 0.00 103 N 8.36 4.27 0.00 2.82 2.77 0.00 0.00 7.09 7.16 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 0.00 104 L 8.00 3.82 0.00 1.82 1.66 0.90 0.75 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 0.00 105 V 8.06 3.60 2.27 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 1.17 0.00 0.00 1.05 0.00 0.00 106 L 7.93 3.92 0.00 1.94 1.64 0.83 0.36 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 0.00 107 K 7.78 3.92 0.00 1.64 1.73 0.00 1.41 0.00 0.00 1.31 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.37 7.81 108 I 7.81 4.09 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.87 1.02 0.00 0.00 109 I 8.03 3.84 2.14 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 1.63 1.11 1.01 0.00 0.00 110 E 7.99 4.28 0.00 2.15 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 0.00 2.39 2.60 0.00 111 Q 8.21 4.67 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.78 0.00 0.00 0.00 0.00 0.00 2.43 2.82 0.00 112 L 7.63 4.09 0.00 1.92 1.83 1.02 1.04 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 0.00 113 P 0.00 4.36 0.00 2.27 2.24 0.00 3.74 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.07 0.00 114 S 8.14 4.28 0.00 3.98 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 0.00 115 A 8.53 4.14 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.19 4.21 0.00 1.92 2.11 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.48 7.81 117 E 8.04 4.34 0.00 2.24 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 2.37 2.63 0.00 118 S 7.57 4.79 0.00 3.96 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 P 0.00 3.24 0.00 2.08 1.82 0.00 3.65 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.35 0.00 120 D 7.83 4.32 0.00 2.60 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 0.00 121 K 7.72 3.91 0.00 1.96 1.85 0.00 1.82 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.49 7.81 122 F 8.30 3.99 0.00 3.23 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 0.00 123 L 7.69 3.71 0.00 1.84 1.63 0.79 0.80 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 0.00 124 E 7.74 3.59 0.00 1.93 1.74 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 1.47 1.77 0.00 125 V 7.53 2.43 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 1.04 0.00 0.00 0.84 0.00 0.00 126 C 7.68 3.84 0.00 2.90 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 0.00 127 T 7.26 4.28 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 1.23 0.00 0.00 128 W 8.14 4.66 0.00 3.38 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 0.00 129 V 7.73 3.64 2.24 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 1.06 0.00 0.00 0.94 0.00 0.00 130 D 7.97 4.39 0.00 2.92 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 0.00 131 Q 7.89 4.05 0.00 2.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.67 0.00 132 I 7.69 3.72 2.05 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 1.46 1.04 0.93 0.00 0.00 133 A 7.84 3.96 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 0.00 134 A 8.07 4.08 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 0.00 135 L 7.76 4.09 0.00 1.84 1.73 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 136 N 7.73 4.67 0.00 2.87 2.77 0.00 0.00 7.01 7.73 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 0.00 137 D 8.09 4.66 0.00 2.64 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 7.70 4.20 0.00 3.98 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 K 8.65 4.66 0.00 1.72 1.77 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.58 7.81 140 T 7.58 4.70 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 141 R 8.19 4.12 0.00 1.79 1.87 0.00 3.18 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 142 K 8.62 4.33 0.00 1.75 1.80 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.41 7.81 143 T 7.81 4.19 4.40 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 1.30 0.00 0.00 144 T 8.10 4.66 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 1.20 0.00 0.00 145 S 8.44 4.09 0.00 3.95 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 0.00 146 E 7.98 3.93 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 2.29 2.37 0.00 147 T 7.43 4.00 4.40 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 1.24 0.00 0.00 148 V 7.54 3.64 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 1.17 0.00 0.00 0.83 0.00 0.00 149 R 8.20 3.81 0.00 1.87 1.88 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 150 A 7.44 4.30 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 0.00 151 V 7.27 3.78 2.24 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 0.95 0.00 0.00 1.02 0.00 0.00 152 L 7.75 4.22 0.00 1.73 1.79 0.94 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.50 4.26 0.00 2.86 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