NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2846 8.2993 120.1391 56.0899 32.4049 174.7541 2 K 3.9288 8.3147 123.7268 51.8432 34.0597 173.7714 3 P 4.5980 0.0000 0.0000 63.2374 33.3733 176.4496 4 K 5.0998 9.1904 120.2945 54.7959 36.4558 175.4143 5 L 5.0689 8.6089 121.7382 53.7204 44.5277 175.9810 6 L 4.9386 8.5596 119.6604 53.5259 44.5491 174.7074 7 Y 4.8069 8.9907 126.3215 55.8550 41.1779 173.8839 8 C 4.5414 8.7762 128.1167 56.8853 32.2394 174.3733 9 S 4.0368 8.6686 121.5473 59.8988 62.4269 174.5307 10 N 3.9982 7.3211 119.7664 55.5031 38.9324 174.7621 11 G 3.8772 7.7222 106.7693 44.8203 0.0000 173.0533 12 G 3.4079 7.7862 107.1248 44.6303 0.0000 173.3527 13 H 4.9531 7.3515 114.8544 53.4333 32.2608 173.9586 14 F 4.9736 8.8505 120.8922 56.6236 40.2001 175.1216 15 L 4.3880 9.1600 126.7429 55.5334 43.3463 175.7178 16 R 4.9085 9.0551 125.0793 54.7102 34.0476 173.8114 17 I 4.4666 8.1190 126.0925 59.3389 38.7763 175.7689 18 L 4.0522 8.7445 128.0271 53.5893 42.2594 176.8528 19 P 4.1998 0.0000 0.0000 65.9455 31.2621 177.3736 20 D 4.4577 7.9605 114.1056 53.8364 39.6063 177.0094 21 G 4.0504 8.3522 109.3307 45.3874 0.0000 173.8409 22 T 4.1627 8.3494 117.4648 63.5593 69.0200 173.3390 23 V 4.8121 8.0803 124.3136 61.1674 34.4177 174.3367 24 D 4.6228 8.4386 125.1585 52.9467 42.4661 174.0103 25 G 4.6265 9.1154 105.1638 45.2478 0.0000 172.2759 26 T 4.9950 8.8995 114.2870 60.2366 70.4601 175.1835 27 R 4.0806 8.9785 125.9667 58.2638 30.7955 176.4350 28 D 4.5361 8.0127 117.8440 53.4393 39.8714 176.4949 29 R 3.5373 8.4237 127.0548 58.1246 30.2292 177.6203 30 S 4.2067 7.9179 112.5344 60.6937 63.4470 174.1312 31 D 4.3037 7.9210 120.2901 54.8554 41.0139 177.5036 32 Q 3.9828 8.6364 125.0569 58.4341 29.2756 176.5097 33 H 4.8186 9.2795 115.5303 55.5103 28.7845 176.1467 34 I 4.4984 6.9635 111.8341 60.3408 38.5086 175.6750 35 Q 4.2177 7.8559 121.6921 55.8432 29.6124 174.9245 36 L 5.1796 8.8656 124.1766 52.9628 46.1401 175.3601 37 Q 4.8050 9.3695 125.2670 54.5337 30.8234 174.0607 38 L 5.2979 8.5580 126.7572 53.5828 43.5362 176.1533 39 S 4.8644 9.0958 116.7784 56.5792 66.8840 172.6144 40 A 5.4837 8.5424 123.8263 49.7488 20.1444 176.5569 41 E 4.2302 9.1847 123.4698 57.3319 29.0221 180.3638 42 S 4.4738 9.0219 116.9535 57.1960 63.9927 174.0664 43 V 3.4925 8.2055 120.2261 66.7529 31.2313 176.7984 44 G 4.1781 7.8802 104.3646 46.4789 0.0000 171.3107 45 E 5.2787 8.2980 120.4343 54.2482 32.3794 175.7900 46 V 5.0425 8.9347 117.3205 59.8118 36.2292 174.3120 47 Y 4.9834 9.1811 120.6675 56.9996 40.4698 174.9095 48 I 4.6762 8.7110 122.7501 59.5378 40.3461 174.2029 49 K 4.7108 8.7666 128.9167 54.0296 35.2882 175.1388 50 S 4.6415 9.0737 123.5382 58.8049 62.7983 174.6335 51 T 4.1019 8.6800 117.5241 63.3614 68.9569 175.9482 52 E 4.0652 8.3454 123.2043 58.5284 29.8388 176.9533 53 T 4.3813 7.6361 104.7518 60.2705 70.0891 174.5694 54 G 3.7627 7.9751 109.4642 46.1353 0.0000 173.9140 55 Q 4.4406 7.4708 118.9302 55.7662 30.5299 174.4160 56 Y 4.8173 8.9801 119.4488 55.8479 40.3859 175.3001 57 L 4.3155 9.0041 126.5885 56.1152 43.4451 175.6418 58 A 5.0523 8.4303 124.5624 51.0748 23.0751 174.6232 59 M 5.3773 8.5866 119.3346 53.9176 35.4515 175.4072 60 D 5.0565 9.4441 125.9989 52.2441 41.5140 177.0260 61 T 4.1836 8.5353 108.1929 64.1049 68.7947 174.5747 62 D 4.7457 8.7098 121.5340 54.1618 41.0721 177.1591 63 G 3.0044 8.4736 108.6041 44.4230 0.0000 173.1117 64 L 4.5749 7.7442 120.2046 53.6154 43.1353 176.3304 65 L 4.9029 8.5676 123.9608 55.3691 42.6151 175.7517 66 Y 4.9945 8.6867 119.5688 56.1386 41.9745 173.4052 67 G 4.2725 8.8779 108.6644 45.2058 0.0000 173.0973 68 S 5.0941 9.1642 121.2800 56.8922 63.6597 175.3266 69 Q 4.4306 9.1208 126.2142 58.2408 28.9560 176.2626 70 T 4.8674 7.5898 106.0877 58.6841 71.9295 171.6686 71 P 4.0416 0.0000 0.0000 62.6926 32.2656 175.2162 72 N 4.7691 8.0414 116.4547 52.1199 39.5252 174.5255 73 E 3.9809 8.7217 115.3581 59.1540 29.7603 177.3661 74 E 4.2354 8.1673 117.8462 57.0628 29.7912 176.8889 75 C 4.9604 7.8301 115.1253 58.4596 29.5952 173.2697 76 L 4.0788 7.2937 123.6064 54.1294 42.8052 175.2400 77 F 5.4041 8.9198 124.8298 55.6840 42.7749 174.5274 78 L 4.8489 9.1759 122.3844 53.7775 42.9371 175.3642 79 E 4.5068 8.9325 126.5640 55.2579 30.5618 175.6710 80 R 4.6705 8.7213 126.0594 54.0339 33.9323 174.5183 81 L 4.7022 8.5939 126.2458 54.6510 42.9336 175.9813 82 E 4.7212 9.4676 125.9840 54.3884 32.0390 176.7349 83 E 4.1195 8.9520 121.5864 58.5260 29.9178 177.8854 84 N 4.4306 8.0158 115.0746 56.0945 38.7550 176.0957 85 H 4.3425 8.8001 112.8332 55.8155 27.9677 174.9390 86 Y 4.4033 8.0431 117.0347 58.1399 39.1044 174.4561 87 N 5.5548 9.5768 119.6452 52.0008 41.6713 174.0765 88 T 5.1332 8.5050 111.4159 59.5426 72.2970 173.0969 89 Y 4.8710 8.7239 119.9484 56.5157 41.1788 173.9015 90 I 4.6513 8.6856 125.7093 58.7062 40.3188 174.8008 91 S 4.2277 8.9342 124.4243 59.1551 62.4477 174.2429 92 K 4.0030 8.7210 128.5454 59.2218 32.2577 178.9414 93 K 3.8822 7.8650 118.1823 58.8338 32.2484 176.4096 94 H 4.7293 7.7999 115.4247 55.0570 29.7525 175.9444 95 A 3.9070 7.8307 125.4160 55.0579 18.3835 180.8849 96 E 3.9105 7.9059 112.7317 58.7371 29.7297 177.7903 97 K 4.0215 7.2135 116.8975 55.4947 32.5690 175.5368 98 N 3.9306 7.5467 116.3608 54.2929 37.5294 174.1561 99 W 5.0259 7.8643 117.5761 55.7586 30.4583 176.4071 100 F 5.4441 9.0995 124.1543 55.6618 40.5283 176.2316 101 V 3.9036 8.9922 122.1757 63.2319 32.4330 175.2545 102 G 4.4447 8.7508 113.1716 45.0155 0.0000 171.1652 103 L 5.2701 8.6670 121.3606 52.3365 45.2387 177.1806 104 K 4.0739 9.1604 123.6142 55.7803 32.8049 178.0070 105 K 3.9665 8.3478 120.9092 59.1831 32.1954 177.0669 106 N 4.5912 8.1072 114.0424 52.6875 37.4332 176.1089 107 G 3.6184 8.1611 108.2178 45.8050 0.0000 174.4192 108 S 4.5382 8.1305 116.6888 58.2195 63.4864 173.4203 109 C 4.7956 8.2919 118.1131 58.2361 30.3616 173.3533 110 K 4.3979 8.9309 120.7144 56.0354 33.1266 176.7719 111 R 4.0857 8.6162 121.5101 55.8208 31.4344 177.8035 112 G 3.3098 8.5533 112.6806 48.3155 0.0000 174.1896 113 P 4.4501 0.0000 0.0000 63.9167 31.4910 177.3876 114 R 4.5263 7.7631 115.5024 55.8856 31.0252 176.3827 115 T 5.0467 7.9873 108.3402 60.9804 70.1811 173.7260 116 H 5.1129 8.4541 116.0966 54.2526 31.1669 172.3670 117 Y 3.8599 7.9686 123.2330 59.5702 39.0241 176.2578 118 G 3.9152 7.8506 113.6590 45.5064 0.0000 174.2159 119 Q 3.9566 7.4830 118.5630 55.4872 29.5518 177.4391 120 K 3.7011 8.6226 122.3347 59.3184 32.6614 178.4965 121 A 4.0002 8.1693 120.9729 53.9101 18.1578 178.3261 122 I 4.6309 7.1320 104.9335 59.9983 38.3957 174.5844 123 L 4.9930 7.3632 122.7561 53.4158 43.7226 175.4650 124 F 5.1840 9.6702 122.4105 55.6409 43.2282 173.5661 125 L 4.2783 9.0508 126.3349 53.2790 43.1028 173.7840 126 P 5.0375 0.0000 0.0000 62.5234 32.6111 176.5442 127 L 4.6304 8.7525 123.3470 52.1509 44.0048 172.6304 128 P 4.8248 0.0000 0.0000 62.0005 31.7359 176.5582 129 V 3.6149 8.3249 119.5830 62.3391 32.1925 177.1510 130 S 4.0236 8.6932 119.8985 59.1977 62.9095 172.1354 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 8.30 4.28 0.00 1.80 1.91 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.43 7.81 2 K 8.31 3.93 0.00 1.94 1.85 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.50 7.81 3 P 0.00 4.60 0.00 2.11 2.20 0.00 3.63 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 1.99 0.00 4 K 9.19 5.10 0.00 1.65 1.72 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.50 7.81 5 L 8.61 5.07 0.00 1.78 1.82 0.56 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.56 4.94 0.00 1.49 1.58 0.22 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 8.99 4.81 0.00 2.99 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 8 C 8.78 4.54 0.00 2.48 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 9 S 8.67 4.04 0.00 3.94 4.13 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 10 N 7.32 4.00 0.00 2.53 2.60 0.00 0.00 6.87 7.98 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 11 G 7.72 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 12 G 7.79 3.41 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 0.00 13 H 7.35 4.95 0.00 3.02 3.26 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.85 4.97 0.00 3.08 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 9.16 4.39 0.00 1.70 1.48 0.91 0.13 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 16 R 9.06 4.91 0.00 1.95 2.00 0.00 3.23 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.80 0.00 17 I 8.12 4.47 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 0.90 0.00 0.00 18 L 8.74 4.05 0.00 1.81 1.53 0.92 1.05 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 19 P 0.00 4.20 0.00 2.00 2.12 0.00 3.54 0.00 0.00 3.18 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 20 D 7.96 4.46 0.00 2.77 2.78 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 21 G 8.35 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 22 T 8.35 4.16 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 1.22 0.00 0.00 23 V 8.08 4.81 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 0.83 0.00 0.00 0.91 0.00 0.00 24 D 8.44 4.62 0.00 2.92 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 25 G 9.12 4.63 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 0.00 0.00 0.00 26 T 8.90 5.00 4.33 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 1.35 0.00 0.00 27 R 8.98 4.08 0.00 1.91 2.06 0.00 3.24 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.56 0.00 28 D 8.01 4.54 0.00 2.79 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 29 R 8.42 3.54 0.00 1.17 1.82 0.00 2.77 0.00 0.00 3.02 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 30 S 7.92 4.21 0.00 4.23 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 31 D 7.92 4.30 0.00 2.86 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 32 Q 8.64 3.98 0.00 1.79 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.97 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 33 H 9.28 4.82 0.00 3.35 3.47 0.00 5.79 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 6.96 4.50 1.95 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 1.48 0.90 1.01 0.00 0.00 35 Q 7.86 4.22 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.40 0.00 36 L 8.87 5.18 0.00 1.49 1.49 0.79 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 9.37 4.80 0.00 2.09 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.84 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 38 L 8.56 5.30 0.00 1.59 1.64 0.84 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 39 S 9.10 4.86 0.00 4.00 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 40 A 8.54 5.48 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 41 E 9.18 4.23 0.00 1.91 1.23 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 2.49 2.42 0.00 42 S 9.02 4.47 0.00 3.92 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 43 V 8.21 3.49 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 0.79 0.00 0.00 0.94 0.00 0.00 44 G 7.88 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 45 E 8.30 5.28 0.00 2.04 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 46 V 8.93 5.04 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 0.85 0.00 0.00 1.18 0.00 0.00 47 Y 9.18 4.98 0.00 3.06 3.17 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 48 I 8.71 4.68 1.78 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.64 0.70 0.00 0.00 49 K 8.77 4.71 0.00 1.51 1.53 0.00 1.25 0.00 0.00 1.37 0.00 0.00 2.63 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.88 0.21 7.81 50 S 9.07 4.64 0.00 3.82 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 8.68 4.10 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 1.16 0.00 0.00 52 E 8.35 4.07 0.00 2.03 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 2.11 2.36 0.00 53 T 7.64 4.38 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 1.24 0.00 0.00 54 G 7.98 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 55 Q 7.47 4.44 0.00 1.95 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 6.73 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 56 Y 8.98 4.82 0.00 2.96 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 57 L 9.00 4.32 0.00 1.63 1.58 0.82 0.35 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 58 A 8.43 5.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 M 8.59 5.38 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.68 0.00 60 D 9.44 5.06 0.00 2.93 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 61 T 8.54 4.18 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 1.36 0.00 0.00 62 D 8.71 4.75 0.00 2.63 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 63 G 8.47 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 4.57 0.00 1.97 1.63 0.90 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.57 4.90 0.00 1.57 1.63 0.93 0.93 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 66 Y 8.69 4.99 0.00 3.09 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.88 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 0.00 0.00 0.00 0.00 68 S 9.16 5.09 0.00 3.91 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 69 Q 9.12 4.43 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 70 T 7.59 4.87 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 1.26 0.00 0.00 71 P 0.00 4.04 0.00 1.53 0.49 0.00 3.67 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 1.64 1.36 0.00 72 N 8.04 4.77 0.00 2.89 2.95 0.00 0.00 5.94 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.72 3.98 0.00 2.05 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 2.26 2.28 0.00 74 E 8.17 4.24 0.00 2.15 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 0.00 2.45 2.39 0.00 75 C 7.83 4.96 0.00 3.25 3.22 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 76 L 7.29 4.08 0.00 1.46 1.23 -0.00 0.85 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 77 F 8.92 5.40 0.00 3.11 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 78 L 9.18 4.85 0.00 1.58 1.61 0.88 0.77 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 79 E 8.93 4.51 0.00 2.14 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 2.22 1.99 0.00 80 R 8.72 4.67 0.00 1.78 1.83 0.00 3.37 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.75 0.00 81 L 8.59 4.70 0.00 1.65 1.57 0.78 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 82 E 9.47 4.72 0.00 1.99 1.78 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 2.42 2.33 0.00 83 E 8.95 4.12 0.00 1.91 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 2.31 2.43 0.00 84 N 8.02 4.43 0.00 2.82 3.17 0.00 0.00 7.10 8.16 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 85 H 8.80 4.34 0.00 3.35 3.63 0.00 5.85 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 8.04 4.40 0.00 2.85 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 87 N 9.58 5.55 0.00 2.82 2.25 0.00 0.00 6.79 7.64 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 88 T 8.50 5.13 4.51 0.00 0.00 0.00 0.00 0.00 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 89 Y 8.72 4.87 0.00 2.93 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.69 4.65 1.58 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.32 0.86 0.00 0.00 91 S 8.93 4.23 0.00 4.18 4.07 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 92 K 8.72 4.00 0.00 1.73 1.67 0.00 1.57 0.00 0.00 1.45 0.00 0.00 2.80 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.33 1.29 7.81 93 K 7.86 3.88 0.00 1.74 1.63 0.00 1.70 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.04 1.31 7.81 94 H 7.80 4.73 0.00 3.22 2.47 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.83 3.91 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 96 E 7.91 3.91 0.00 1.98 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 2.09 2.15 0.00 97 K 7.21 4.02 0.00 0.79 1.11 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.55 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.07 0.95 7.81 98 N 7.55 3.93 0.00 2.92 3.09 0.00 0.00 7.10 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 99 W 7.86 5.03 0.00 3.34 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 0.00 100 F 9.10 5.44 0.00 3.03 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 0.00 101 V 8.99 3.90 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 0.59 0.00 0.00 0.50 0.00 0.00 102 G 8.75 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 0.00 0.00 0.00 0.00 103 L 8.67 5.27 0.00 1.49 1.48 0.99 0.80 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 0.00 104 K 9.16 4.07 0.00 1.87 1.71 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.35 7.81 105 K 8.35 3.97 0.00 1.66 1.80 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.53 7.81 106 N 8.11 4.59 0.00 2.84 2.88 0.00 0.00 6.09 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.16 3.62 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 0.00 0.00 0.00 108 S 8.13 4.54 0.00 4.01 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 0.00 109 C 8.29 4.80 0.00 3.00 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 0.00 110 K 8.93 4.40 0.00 1.65 1.77 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.40 7.81 111 R 8.62 4.09 0.00 1.64 1.61 0.00 3.06 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 112 G 8.55 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.45 0.00 1.99 2.23 0.00 3.07 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.76 0.00 114 R 7.76 4.53 0.00 1.90 1.93 0.00 3.31 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 115 T 7.99 5.05 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 1.41 0.00 0.00 116 H 8.45 5.11 0.00 3.44 3.53 0.00 5.68 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Y 7.97 3.86 0.00 3.24 3.04 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 0.00 118 G 7.85 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 0.00 0.00 0.00 119 Q 7.48 3.96 0.00 2.02 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.73 0.00 0.00 0.00 0.00 0.00 2.16 1.84 0.00 120 K 8.62 3.70 0.00 1.63 1.85 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.22 7.81 121 A 8.17 4.00 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 0.00 122 I 7.13 4.63 1.72 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.19 0.84 0.00 0.00 123 L 7.36 4.99 0.00 1.42 1.59 0.67 0.86 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 0.00 124 F 9.67 5.18 0.00 3.18 2.96 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 0.00 125 L 9.05 4.28 0.00 0.28 1.31 0.75 0.74 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 0.00 126 P 0.00 5.04 0.00 2.04 2.06 0.00 3.66 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 2.10 2.26 0.00 127 L 8.75 4.63 0.00 1.78 1.59 0.89 1.14 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 0.00 128 P 0.00 4.82 0.00 1.94 2.04 0.00 3.69 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 129 V 8.32 3.61 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 0.59 0.00 0.00 0.94 0.00 0.00 130 S 8.69 4.02 0.00 3.98 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