NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 R 4.2728 8.2549 120.8528 56.4921 30.6821 174.9043 23 S 4.3347 8.5281 121.2701 57.2442 64.0653 173.3810 24 S 4.9344 7.7934 115.2722 58.6062 64.7542 173.2098 25 S 4.8941 9.1122 115.2562 57.6649 66.8941 172.0229 26 Y 5.2554 8.5757 120.6585 56.0229 41.7451 174.2368 27 S 4.3677 9.1610 122.2695 56.3622 66.1828 174.1678 28 G 2.1971 7.5396 110.3550 43.0382 0.0000 171.9562 29 E 3.8027 8.0773 121.0806 55.7130 30.3670 175.9398 30 Y 4.0960 8.5615 124.1780 56.7706 39.7811 172.6616 31 G 3.6078 6.9171 111.3901 44.2981 0.0000 170.9167 32 S 4.6607 8.5933 119.1173 56.7171 65.2150 173.9438 33 G 3.9157 8.6656 107.8335 45.4634 0.0000 173.9882 34 G 3.8510 7.9602 109.2501 45.2024 0.0000 173.8161 35 G 3.9711 8.5033 107.4452 44.6044 0.0000 172.5938 36 K 4.8751 8.4213 117.5988 53.9995 35.4806 176.4855 37 R 4.6501 8.6937 120.4046 56.6076 30.2530 175.6125 38 F 5.1737 8.8680 115.7763 55.6366 41.9905 173.5259 39 S 4.8553 8.6605 112.7775 57.7462 65.2752 173.2295 40 H 4.9848 9.2485 123.0253 55.2493 28.7645 176.8140 41 S 2.7900 7.7596 117.3177 61.2337 61.4291 176.8800 42 G 3.5670 7.7047 107.2290 47.6814 0.0000 175.1297 43 N 4.1524 7.8408 118.8010 55.5240 38.4513 177.1552 44 Q 4.1031 7.1319 119.1777 58.6706 28.3579 178.4401 45 L 4.0396 7.2584 120.0163 57.6634 41.7134 178.6361 46 D 4.5718 8.1634 119.0077 55.2244 40.6568 176.3764 47 G 4.3284 7.0255 105.0637 42.2272 0.0000 170.7127 48 P 4.5844 0.0000 0.0000 62.3694 32.6629 175.9926 49 I 3.9822 8.3578 122.3031 62.1780 37.1341 175.9129 50 T 4.5779 8.6377 115.3195 61.1239 70.7719 173.0766 51 A 4.6545 6.9322 121.9300 51.3065 22.6815 174.9285 52 L 5.0615 8.6092 118.6284 53.0485 46.0878 175.9900 53 R 4.9682 9.3518 122.3514 54.3135 33.4180 175.0005 54 V 4.5601 8.7833 123.2722 61.0672 34.8806 173.9490 55 R 4.9526 8.9122 129.2646 55.5699 31.6083 175.3965 56 V 5.0605 9.0082 119.3124 59.8162 35.6394 174.7386 57 N 5.2152 8.6051 122.5830 51.9494 39.2589 174.1956 58 T 3.7655 8.6303 112.4551 66.6091 68.6336 174.4441 59 Y 4.5537 7.7178 116.0230 58.0804 40.3426 174.8172 60 Y 5.2933 8.5126 116.1417 55.9714 42.2419 174.0859 61 I 4.5367 8.9334 122.7410 61.2778 37.6354 177.1385 62 V 3.8823 9.4302 128.6392 65.0544 32.9561 175.7258 63 G 4.5450 7.5876 104.6516 46.0374 0.0000 172.0477 64 L 5.2308 8.1876 119.4823 53.0929 46.6129 175.4542 65 Q 4.8537 9.0748 122.3938 54.6827 33.1990 173.5428 66 V 4.8382 9.1177 124.4329 61.1167 35.4312 173.8803 67 R 4.2371 8.0823 127.9317 54.8348 31.6326 174.2583 68 Y 4.7256 8.9240 125.1990 55.7668 40.0530 176.7141 69 G 3.8142 9.1025 115.4087 46.1132 0.0000 173.9928 70 K 4.2846 8.8997 122.6644 55.5184 32.3898 175.2366 71 V 4.4104 7.6721 120.9319 60.5817 33.5378 174.9927 72 W 4.8723 8.8853 128.5716 56.4302 29.6517 176.4314 73 S 4.4946 9.2834 119.5838 58.1075 63.4950 173.8460 74 D 4.5231 8.5326 120.6765 54.1336 41.4451 176.1235 75 Y 4.0985 8.6375 124.4957 57.7363 39.6454 175.1828 76 V 4.3243 7.5955 119.3646 60.4581 35.1208 175.4179 77 G 3.4742 8.6319 107.4510 44.1089 0.0000 171.4566 78 G 4.5999 8.0566 108.9641 43.5574 0.0000 173.1228 79 R 4.4604 8.4112 115.7379 56.1045 31.8553 176.6265 80 N 4.5847 7.8641 118.6297 50.2948 37.2741 172.5630 81 G 4.0574 7.1527 107.0953 46.0259 0.0000 170.0797 82 D 5.0215 8.5153 120.0350 52.5760 42.9006 176.1427 83 L 4.5214 8.4867 125.2747 54.7345 43.0555 175.4842 84 E 4.9465 9.4212 126.0597 54.6410 32.7090 174.6681 85 E 5.2050 8.7776 123.0167 54.7129 33.0659 174.4506 86 I 4.7636 8.9021 126.7272 59.6778 41.2956 174.2226 87 F 4.7330 8.9940 125.4830 56.3618 40.1094 175.7105 88 L 4.4551 8.5738 123.5641 54.3738 42.6584 176.9007 89 H 4.5301 9.2114 119.3264 54.6891 29.4354 173.5654 90 P 4.3179 0.0000 0.0000 64.5583 31.4200 177.0912 91 G 3.9093 8.9234 110.2224 45.4954 0.0000 172.4065 92 E 4.5984 8.1488 121.0866 55.4221 30.5009 175.8003 93 S 4.9203 9.4037 122.2472 56.6318 67.2483 173.0856 94 V 4.6256 8.3990 122.6665 62.3954 32.2943 176.0081 95 I 4.6589 9.0744 120.6469 61.0768 39.0573 175.4325 96 Q 4.9548 7.9185 120.3854 55.1031 33.5723 173.2938 97 V 4.8324 9.2121 122.1303 61.3439 34.8269 174.6265 98 S 4.4995 8.3050 122.1851 56.6645 66.6024 173.0631 99 G 3.6393 6.6589 105.4387 46.0635 0.0000 172.1989 100 K 5.3490 8.5716 117.9049 55.2159 37.0313 175.4975 101 Y 5.5429 8.4730 121.0480 55.7439 42.4705 176.5868 102 K 4.6569 9.4661 119.0893 57.1688 31.7323 179.0570 103 W 4.0064 9.4484 119.0715 58.1853 29.6131 175.2652 104 Y 4.9915 7.4474 114.6104 55.3791 41.4557 174.0556 105 L 4.6088 9.0250 124.5814 55.7652 42.9774 177.4753 106 K 4.6949 9.6894 124.2237 57.1943 35.6033 176.0785 107 K 5.2970 8.0160 119.0543 54.8698 36.1400 175.0604 108 L 5.1702 9.2319 125.1978 52.9903 46.3244 175.5236 109 V 4.7799 8.8384 122.9511 61.2060 34.5473 174.2081 110 F 4.8900 9.5736 128.3605 56.4301 40.4302 175.0493 111 V 4.4001 8.8740 125.7384 61.7026 33.0372 175.1558 112 T 5.1692 8.3965 118.0925 59.6834 71.8364 174.6408 113 D 4.5894 8.9444 120.4960 54.2343 39.5493 176.9564 114 K 4.3485 8.0113 118.2582 56.3473 32.2754 176.9094 115 G 3.8989 8.0375 106.5992 45.7983 0.0000 173.9650 116 R 4.5437 7.5442 117.8643 55.2000 32.3985 175.3126 117 Y 4.7075 8.6284 119.3446 56.3035 39.7083 174.9814 118 L 4.3758 9.2143 125.8730 53.7535 42.5499 175.5207 119 S 5.3143 8.2592 118.8204 56.4953 64.5554 173.2514 120 F 4.8090 9.5425 124.6503 57.4262 43.4188 174.8384 121 G 4.2589 9.2580 108.2865 44.3947 0.0000 171.8144 122 K 4.5195 8.0108 117.8940 54.6877 34.0931 177.5924 123 D 4.7003 8.4402 124.7651 53.0054 39.4551 175.1920 124 S 4.5147 7.7202 113.7323 57.7200 66.1450 171.7838 125 G 3.6951 8.6023 110.5913 44.0793 0.0000 172.6270 126 T 3.9310 8.4764 116.5946 63.2682 69.1875 174.7001 127 S 4.7906 8.4761 121.6205 58.0505 63.5641 172.8844 128 F 5.0236 8.6634 119.9116 55.4597 41.8289 173.4657 129 N 4.9280 8.7696 118.1964 52.5967 41.0450 172.8495 130 A 5.0145 9.3687 129.6247 50.4490 21.2472 175.8656 131 V 4.4350 8.2280 114.9921 58.3838 35.7144 174.0071 132 P 3.3045 0.0000 0.0000 61.9726 32.0262 176.7055 133 L 3.9102 8.1380 121.1769 57.5905 41.6731 177.4285 134 H 4.9579 7.5163 113.0756 52.9239 29.6733 172.6816 135 P 4.2471 0.0000 0.0000 64.2590 31.9551 176.5319 136 N 4.2691 8.5298 118.8491 54.7319 36.1734 173.8802 137 T 4.8243 7.1302 105.0161 60.2327 71.6613 173.7131 138 V 4.9582 8.6371 115.2810 59.4798 36.9968 174.1885 139 L 4.2156 9.1099 124.6848 55.6021 41.4790 176.4786 140 R 4.7769 8.8765 126.1308 57.6213 32.2084 176.0806 141 F 5.3277 7.5102 111.6928 56.2106 41.1940 172.9655 142 I 5.1923 8.6448 111.7638 59.3956 41.0247 174.3575 143 S 4.6878 9.2781 116.8628 56.6767 67.0121 172.9874 144 G 3.6480 5.8854 104.2512 46.1376 0.0000 171.1937 145 R 5.3553 8.0351 119.2827 54.7301 34.7400 174.8410 146 S 5.2961 9.7226 116.3679 57.1731 66.8547 174.9911 147 G 4.5152 9.4710 110.4665 46.7803 0.0000 175.4614 148 S 4.5463 9.4524 123.9222 58.8251 63.9408 173.1188 149 L 5.1766 7.2236 120.1986 53.3139 45.6928 174.5263 150 I 4.5582 8.3066 120.4390 60.8089 37.2649 177.0951 151 D 4.7456 9.3302 128.8304 57.2034 41.9985 176.5035 152 A 4.8644 7.6370 116.7528 51.1925 22.6211 175.1366 153 I 4.9733 8.7193 119.6021 59.3286 42.1868 174.3554 154 G 4.4037 9.1690 113.9591 44.3697 0.0000 171.1806 155 L 4.9632 8.5068 121.8989 52.6969 45.2699 175.1894 156 H 4.8954 8.2794 120.2207 53.7243 31.3738 172.9254 157 W 5.4129 8.8936 124.1122 55.5547 31.6467 174.9005 158 D 4.8236 8.9989 121.7703 53.4402 45.2678 175.9616 159 V 3.8861 8.4247 113.1025 61.7196 31.5626 176.4899 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 22 R 8.25 4.27 0.00 1.76 1.90 0.00 3.28 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 23 S 8.53 4.33 0.00 4.01 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 24 S 7.79 4.93 0.00 4.00 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 25 S 9.11 4.89 0.00 3.99 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 8.58 5.26 0.00 2.80 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 27 S 9.16 4.37 0.00 3.93 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 28 G 7.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.08 3.80 0.00 1.86 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 2.10 2.29 0.00 30 Y 8.56 4.10 0.00 2.22 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 0.00 0.00 0.00 31 G 6.92 3.61 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 0.00 0.00 0.00 32 S 8.59 4.66 0.00 3.57 3.90 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 0.00 0.00 0.00 33 G 8.67 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 34 G 7.96 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 35 G 8.50 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 36 K 8.42 4.88 0.00 1.66 1.73 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.52 7.81 37 R 8.69 4.65 0.00 1.75 1.91 0.00 2.96 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 38 F 8.87 5.17 0.00 3.13 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 39 S 8.66 4.86 0.00 3.75 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 40 H 9.25 4.98 0.00 3.60 3.05 0.00 5.73 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.76 2.79 0.00 3.45 3.55 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 42 G 7.70 3.57 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 0.00 43 N 7.84 4.15 0.00 1.69 1.69 0.00 0.00 6.65 8.32 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 44 Q 7.13 4.10 0.00 2.38 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 45 L 7.26 4.04 0.00 1.69 1.74 0.86 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 46 D 8.16 4.57 0.00 2.88 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 47 G 7.03 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 0.00 0.00 0.00 0.00 48 P 0.00 4.58 0.00 2.14 2.23 0.00 3.73 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 49 I 8.36 3.98 1.75 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 0.80 0.48 0.60 0.00 0.00 50 T 8.64 4.58 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 51 A 6.93 4.65 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 52 L 8.61 5.06 0.00 1.42 1.14 0.11 0.51 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 53 R 9.35 4.97 0.00 1.48 1.64 0.00 2.21 0.00 0.00 2.57 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.98 0.00 54 V 8.78 4.56 1.61 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 0.91 0.00 0.00 -0.11 0.00 0.00 55 R 8.91 4.95 0.00 2.06 1.97 0.00 3.34 0.00 0.00 3.53 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 56 V 9.01 5.06 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 0.89 0.00 0.00 1.01 0.00 0.00 57 N 8.61 5.22 0.00 2.77 3.00 0.00 0.00 6.99 7.26 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 58 T 8.63 3.77 3.54 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 0.56 0.00 0.00 59 Y 7.72 4.55 0.00 1.91 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 0.00 0.00 0.00 60 Y 8.51 5.29 0.00 3.05 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 61 I 8.93 4.54 2.04 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.97 0.98 0.00 0.00 62 V 9.43 3.88 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 1.15 0.00 0.00 1.09 0.00 0.00 63 G 7.59 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 0.00 0.00 0.00 0.00 64 L 8.19 5.23 0.00 1.27 1.41 1.05 0.62 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 Q 9.07 4.85 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.76 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 66 V 9.12 4.84 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 0.17 0.00 0.00 0.99 0.00 0.00 67 R 8.08 4.24 0.00 0.67 0.92 0.00 2.22 0.00 0.00 2.78 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.00 68 Y 8.92 4.73 0.00 2.84 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 69 G 9.10 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 70 K 8.90 4.28 0.00 1.73 1.82 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.38 7.81 71 V 7.67 4.41 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 1.09 0.00 0.00 0.95 0.00 0.00 72 W 8.89 4.87 0.00 3.27 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 73 S 9.28 4.49 0.00 3.71 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.53 4.52 0.00 2.72 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 75 Y 8.64 4.10 0.00 2.98 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 76 V 7.60 4.32 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 0.40 0.00 0.00 -0.06 0.00 0.00 77 G 8.63 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.06 4.60 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 0.00 0.00 0.00 79 R 8.41 4.46 0.00 1.77 1.91 0.00 3.13 0.00 0.00 3.06 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.56 0.00 80 N 7.86 4.58 0.00 2.67 2.78 0.00 0.00 6.85 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 81 G 7.15 4.06 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 0.00 0.00 0.00 82 D 8.52 5.02 0.00 2.61 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 83 L 8.49 4.52 0.00 1.61 1.54 0.92 0.77 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 84 E 9.42 4.95 0.00 2.33 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 2.32 2.35 0.00 85 E 8.78 5.21 0.00 1.88 1.81 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 1.96 2.28 0.00 86 I 8.90 4.76 2.04 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 1.28 0.76 0.95 0.00 0.00 87 F 8.99 4.73 0.00 2.98 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 88 L 8.57 4.46 0.00 1.62 1.57 0.82 1.33 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 89 H 9.21 4.53 0.00 3.21 3.21 0.00 5.64 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.32 0.00 2.05 2.03 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 91 G 8.92 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 92 E 8.15 4.60 0.00 2.06 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 2.31 2.31 0.00 93 S 9.40 4.92 0.00 3.95 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 94 V 8.40 4.63 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 1.46 0.00 0.00 1.02 0.00 0.00 95 I 9.07 4.66 1.85 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 1.35 0.83 0.96 0.00 0.00 96 Q 7.92 4.95 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 97 V 9.21 4.83 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 0.69 0.00 0.00 1.01 0.00 0.00 98 S 8.30 4.50 0.00 3.70 3.75 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 99 G 6.66 3.64 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 0.00 0.00 0.00 100 K 8.57 5.35 0.00 1.75 1.63 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.22 1.30 7.81 101 Y 8.47 5.54 0.00 3.22 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 0.00 102 K 9.47 4.66 0.00 1.95 1.30 0.00 2.19 0.00 0.00 2.07 0.00 0.00 3.00 0.00 0.00 3.45 0.00 0.00 0.00 0.00 1.82 1.68 7.81 103 W 9.45 4.01 0.00 2.72 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 0.00 104 Y 7.45 4.99 0.00 2.53 2.73 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 0.00 105 L 9.03 4.61 0.00 1.94 1.80 1.30 0.87 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 0.00 106 K 9.69 4.69 0.00 2.00 1.93 0.00 1.91 0.00 0.00 1.80 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.89 1.86 7.81 107 K 8.02 5.30 0.00 2.04 1.58 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.64 7.81 108 L 9.23 5.17 0.00 1.77 1.27 1.11 0.89 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 0.00 109 V 8.84 4.78 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 1.12 0.00 0.00 0.91 0.00 0.00 110 F 9.57 4.89 0.00 3.11 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.87 4.40 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 0.37 0.00 0.00 0.91 0.00 0.00 112 T 8.40 5.17 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 1.24 0.00 0.00 113 D 8.94 4.59 0.00 2.81 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.01 4.35 0.00 1.97 1.89 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.42 1.55 7.81 115 G 8.04 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 116 R 7.54 4.54 0.00 1.78 1.88 0.00 3.12 0.00 0.00 3.44 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 117 Y 8.63 4.71 0.00 2.82 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 0.00 118 L 9.21 4.38 0.00 1.87 1.73 0.96 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.26 5.31 0.00 3.86 3.64 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 0.00 120 F 9.54 4.81 0.00 3.03 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 0.00 121 G 9.26 4.26 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 0.00 122 K 8.01 4.52 0.00 1.81 1.77 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.63 7.81 123 D 8.44 4.70 0.00 2.63 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 0.00 124 S 7.72 4.51 0.00 3.84 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 0.00 125 G 8.60 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 0.00 126 T 8.48 3.93 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 0.95 0.00 0.00 127 S 8.48 4.79 0.00 3.78 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 0.00 128 F 8.66 5.02 0.00 2.68 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 0.00 129 N 8.77 4.93 0.00 2.62 2.71 0.00 0.00 6.86 7.96 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 0.00 130 A 9.37 5.01 1.68 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 0.00 131 V 8.23 4.44 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 0.70 0.00 0.00 0.82 0.00 0.00 132 P 0.00 3.30 0.00 1.77 1.01 0.00 3.14 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 1.54 1.35 0.00 133 L 8.14 3.91 0.00 1.46 1.39 0.88 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 134 H 7.52 4.96 0.00 3.30 3.20 0.00 5.71 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 0.00 135 P 0.00 4.25 0.00 2.19 1.97 0.00 3.78 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 136 N 8.53 4.27 0.00 2.82 2.85 0.00 0.00 6.88 7.54 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 0.00 137 T 7.13 4.82 4.52 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 1.37 0.00 0.00 138 V 8.64 4.96 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 0.76 0.00 0.00 1.05 0.00 0.00 139 L 9.11 4.22 0.00 1.49 1.62 0.29 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 140 R 8.88 4.78 0.00 1.83 2.35 0.00 3.55 0.00 0.00 3.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.84 0.00 141 F 7.51 5.33 0.00 3.17 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 0.00 142 I 8.64 5.19 2.08 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.87 1.04 0.00 0.00 143 S 9.28 4.69 0.00 3.78 4.01 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 0.00 144 G 5.89 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 R 8.04 5.36 0.00 1.77 1.95 0.00 3.17 0.00 0.00 3.43 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 146 S 9.72 5.30 0.00 3.84 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 0.00 147 G 9.47 4.52 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 0.00 148 S 9.45 4.55 0.00 3.99 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 L 7.22 5.18 0.00 1.28 1.36 -0.27 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 150 I 8.31 4.56 2.06 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.07 1.10 0.00 0.00 151 D 9.33 4.75 0.00 2.84 2.82 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 0.00 0.00 0.00 152 A 7.64 4.86 1.15 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 0.00 0.00 153 I 8.72 4.97 1.98 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.71 0.96 0.00 0.00 154 G 9.17 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 0.00 0.00 0.00 0.00 155 L 8.51 4.96 0.00 1.12 0.61 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 156 H 8.28 4.90 0.00 1.54 2.33 0.00 5.59 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 W 8.89 5.41 0.00 3.28 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 D 9.00 4.82 0.00 2.82 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 0.00 159 V 8.42 3.89 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.98 0.00 0.00