NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6046 8.3649 120.1969 54.3536 42.2521 175.2731 2 C 4.6022 8.3377 122.2697 53.1996 38.7194 170.5276 3 P 4.4334 0.0000 0.0000 62.5545 32.1994 175.3908 4 S 4.3879 8.3914 115.3128 60.1147 62.8821 175.1594 5 G 4.0090 9.3197 113.7561 44.6798 0.0000 172.7456 6 W 4.8789 7.8218 118.3165 55.1463 31.7038 175.6212 7 S 5.0985 9.3913 118.0031 57.0328 65.8152 173.1295 8 S 5.6640 8.5764 116.2568 56.4928 64.8171 173.2034 9 Y 4.0602 8.7262 123.8242 57.7949 41.0510 174.1647 10 E 3.5008 9.1527 129.3768 57.6457 27.2617 175.0910 11 G 3.9705 7.7842 101.2546 46.2246 0.0000 171.7541 12 H 4.9116 7.7174 113.4881 54.7698 34.4714 173.6171 13 C 5.8223 9.3199 117.9640 55.6119 42.1206 172.7993 14 Y 5.4743 9.9405 120.1586 56.1875 41.6839 174.6534 15 K 4.1888 8.4523 124.0444 53.6210 35.1350 173.2136 16 P 4.5787 0.0000 0.0000 62.3214 32.5174 175.5085 17 F 4.4141 8.6053 122.6059 54.6126 41.8740 175.8646 18 K 4.3709 7.9496 124.5098 55.3264 31.2760 175.3744 19 L 4.3724 6.5743 120.1784 53.0572 46.1145 177.2910 20 Y 4.9597 8.2808 120.6747 56.7544 38.2449 174.8441 21 K 4.9857 8.7963 123.2262 54.2308 36.8587 176.3761 22 T 5.5478 8.3381 111.0139 60.3754 70.1808 175.3429 23 W 2.6323 7.9548 131.4524 60.6067 30.2388 177.7872 24 D 4.5101 8.1811 117.8965 57.6806 40.1427 178.4090 25 D 4.3330 7.7041 118.5174 56.3393 41.1232 178.4673 26 A 3.3597 7.5613 121.5305 53.9250 18.0790 179.3556 27 E 3.3084 7.3060 118.1586 59.3020 29.7465 178.9977 28 R 3.7814 7.4214 118.8725 59.2875 29.8565 178.2469 29 F 4.0023 7.6412 119.5646 61.2546 39.0985 176.2637 30 C 4.5495 8.0091 116.1494 59.8006 39.7589 176.0656 31 T 3.9898 7.6539 112.5153 63.3888 68.5678 174.5555 32 E 4.4791 7.3785 117.9096 56.6222 30.2542 176.8195 33 Q 4.3944 7.8095 117.6605 57.0693 31.3823 174.8767 34 A 4.2054 7.3598 117.9318 50.7744 21.8352 175.1133 35 K 3.8968 8.3560 120.9817 56.9569 32.1790 176.8536 36 G 3.7349 8.5191 117.3289 46.5405 0.0000 172.8695 37 G 3.9795 7.3677 104.9836 45.4584 0.0000 173.0217 38 H 4.7639 8.4066 115.9459 54.7460 34.0826 173.1004 39 L 4.7157 8.1997 120.1136 54.3251 42.2517 178.0808 40 V 3.9287 8.8118 122.5913 62.5691 32.4151 175.3433 41 S 4.8288 8.8036 118.4276 56.7026 63.7927 174.3321 42 I 4.4454 8.3498 127.6350 60.4966 35.9980 175.1918 43 E 4.7435 9.4506 124.0557 55.9323 30.1436 176.5073 44 S 4.6784 7.5510 113.4876 56.0677 67.0501 175.1812 45 A 4.0546 8.5722 123.6045 55.3407 18.2761 179.8520 46 G 3.9046 8.1796 105.0661 47.4059 0.0000 174.9674 47 E 3.7408 8.2875 121.0854 59.0152 29.7270 178.8718 48 A 4.1018 8.0061 120.2088 55.2740 18.4421 179.3822 49 D 4.3055 8.1994 117.5053 57.3773 40.8869 178.8027 50 F 3.8145 7.9720 121.2364 61.1595 39.2278 177.4730 51 V 3.2861 7.9119 117.6789 65.5346 31.2382 177.9443 52 A 3.9928 7.8224 120.5992 54.9819 18.2815 179.6207 53 Q 3.8120 7.9563 116.6120 58.8346 28.8495 178.6277 54 L 3.5436 7.3039 121.1628 58.1514 42.0518 179.1440 55 V 3.2157 7.6648 118.3637 66.0612 31.0650 178.2160 56 T 3.7084 7.3490 114.4320 66.5681 68.5131 176.1803 57 E 4.0602 8.3234 119.0930 57.8432 29.6630 176.5953 58 N 4.7096 7.4689 113.5257 55.1169 41.3245 175.9004 59 I 3.7413 7.9334 118.6881 64.3495 37.9314 174.1987 60 Q 3.9590 7.4778 122.5505 56.0202 28.9629 176.2068 61 N 4.9447 8.9063 113.4860 52.3757 39.5370 175.9666 62 T 4.2190 8.0107 115.3133 62.9005 70.2475 172.9088 63 K 4.3958 7.2813 127.7041 56.2086 31.3247 174.8277 64 S 4.2606 7.6868 120.3683 58.4615 65.3430 175.2682 65 Y 4.6402 8.2826 118.3288 57.3672 39.8734 175.5009 66 V 4.5549 8.5300 119.2871 60.8950 34.3470 175.1017 67 W 5.3314 9.0317 128.4593 57.4186 29.8444 175.3526 68 I 4.8576 8.6159 113.7458 59.2756 40.6350 176.3911 69 G 3.7396 9.1497 112.1585 47.2829 0.0000 173.7762 70 L 4.1342 7.4498 123.8620 55.0134 42.9821 175.6974 71 R 4.2563 7.9955 124.6727 54.6926 33.0668 174.6252 72 V 3.5337 7.5350 125.2130 61.8478 31.5503 176.6984 73 Q 4.0752 8.5266 126.7145 53.7649 26.8435 175.3183 74 G 3.8837 7.1848 109.4484 45.4544 0.0000 170.5836 75 K 4.3247 8.3780 118.3956 55.7629 31.7275 175.6812 76 E 4.1005 7.8632 118.7404 56.4626 29.5456 177.6426 77 K 3.9316 8.6057 125.8341 58.3010 32.6409 176.1063 78 Q 4.6474 7.3209 111.7020 55.3259 31.5304 174.0529 79 C 4.6863 8.4019 113.4168 59.0278 30.0088 174.5001 80 S 4.3395 7.9662 115.4502 57.5010 62.8218 173.8042 81 S 4.2245 8.8985 122.8018 61.0921 62.4093 174.4851 82 E 5.2334 7.6648 116.5878 54.1357 33.5881 174.7356 83 W 4.5008 8.8776 119.9617 55.7562 30.1754 178.0650 84 S 4.3018 9.0152 116.5229 61.9570 62.2392 175.6725 85 D 4.4832 8.1696 116.8791 54.0052 39.6024 176.8919 86 G 3.9651 8.7241 108.9205 46.2894 0.0000 173.6592 87 S 4.7409 8.2864 115.5212 56.8114 64.3858 173.7681 88 S 4.5596 8.5058 119.2162 58.2805 63.0919 175.4403 89 V 4.4182 8.0801 125.8064 61.1182 29.7632 175.6443 90 S 4.8488 8.6087 122.5457 57.9859 63.5925 173.6542 91 Y 4.8543 8.0274 120.6071 56.8092 41.5182 173.6039 92 E 4.0689 7.7972 123.0814 55.1265 33.3264 174.9809 93 N 4.8221 7.5339 115.0095 52.4649 39.5727 174.6153 94 W 4.3662 7.6541 119.3448 56.8080 30.5382 176.7208 95 I 4.3113 8.4352 122.1593 60.1889 38.1995 176.7332 96 E 3.7268 8.8328 125.4815 59.2411 29.6923 178.7756 97 A 2.7932 7.4780 119.6112 54.4615 18.3470 177.7863 98 E 4.1943 7.7352 113.4035 57.2280 29.8354 177.2816 99 S 3.6165 7.2081 114.8117 56.3335 61.0062 173.3003 100 K 4.4124 7.7719 126.0749 55.4850 30.4690 176.6587 101 T 4.2589 7.7722 111.5237 61.9455 70.9060 175.5444 102 C 4.7901 8.1857 120.2654 55.3073 41.4667 172.8613 103 L 5.2470 8.1466 120.9444 53.6779 44.6259 176.0829 104 G 4.5061 8.8243 106.7610 45.4172 0.0000 171.0273 105 L 5.8367 8.7554 117.8578 53.5732 46.6938 175.6321 106 E 4.6434 8.3639 116.0622 55.2989 32.1052 176.2964 107 K 2.8542 7.8102 122.2017 58.9286 32.5952 178.4531 108 E 3.8078 7.9434 118.8774 58.7051 29.6119 177.2586 109 T 4.4537 7.2388 104.9253 61.0004 69.0798 174.3647 110 G 3.8474 8.4971 108.2864 47.9704 0.0000 174.0439 111 F 4.0560 7.7900 113.4470 58.1460 37.2685 176.6378 112 R 4.6598 8.0249 116.3801 55.8608 30.5920 176.2816 113 K 4.6251 7.7413 116.6236 54.0740 35.7368 175.5448 114 W 5.0563 8.6214 122.3955 56.5463 30.0485 175.7107 115 V 4.4542 8.6533 125.4686 60.7913 33.4122 174.3029 116 N 4.9391 9.0297 126.0643 53.6282 38.9322 174.3335 117 I 4.6334 9.0340 117.5508 58.5323 41.8819 174.1729 118 Y 4.6622 8.4823 124.5898 57.9244 39.3134 177.5805 119 C 4.2146 9.1568 124.3791 59.7741 40.5352 175.2284 120 G 3.3966 5.5272 105.9102 45.5715 0.0000 173.1643 121 Q 4.3641 7.8502 120.1967 56.0005 30.4764 175.4712 122 Q 5.4433 8.4474 117.5987 53.6220 31.1576 174.5514 123 N 5.4150 8.7250 120.5412 50.6911 44.0704 172.9991 124 P 5.4497 0.0000 0.0000 63.2878 34.0698 174.2350 125 F 5.0362 7.5015 112.9193 56.9853 41.8252 172.7169 126 V 4.8528 8.4420 117.8024 61.4841 34.4002 175.1570 127 C 5.5405 9.2241 124.9039 55.8245 37.5748 172.2343 128 E 5.3400 9.5144 120.7117 54.8544 33.4380 174.9420 129 A 4.2646 8.9394 127.0375 52.2047 19.6277 175.7300 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 D 8.36 4.60 0.00 2.66 2.65 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 2 C 8.34 4.60 0.00 3.16 3.03 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 3 P 0.00 4.43 0.00 2.13 2.01 0.00 3.44 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.18 0.00 4 S 8.39 4.39 0.00 3.96 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 5 G 9.32 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 0.00 0.00 0.00 6 W 7.82 4.88 0.00 3.30 3.30 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 7 S 9.39 5.10 0.00 4.05 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 8 S 8.58 5.66 0.00 3.97 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 9 Y 8.73 4.06 0.00 1.43 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 10 E 9.15 3.50 0.00 1.63 1.65 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 1.52 1.47 0.00 11 G 7.78 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 12 H 7.72 4.91 0.00 3.42 3.02 0.00 5.75 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 C 9.32 5.82 0.00 2.82 3.32 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 14 Y 9.94 5.47 0.00 3.10 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 15 K 8.45 4.19 0.00 0.79 0.74 0.00 0.61 0.00 0.00 1.21 0.00 0.00 3.00 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.44 7.81 16 P 0.00 4.58 0.00 1.80 1.76 0.00 3.32 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.72 0.00 17 F 8.61 4.41 0.00 1.60 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 18 K 7.95 4.37 0.00 1.47 1.52 0.00 1.71 0.00 0.00 1.54 0.00 0.00 3.17 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.20 1.25 7.81 19 L 6.57 4.37 0.00 1.33 1.27 0.13 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.28 4.96 0.00 2.95 2.98 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 21 K 8.80 4.99 0.00 1.64 1.62 0.00 1.49 0.00 0.00 1.37 0.00 0.00 2.59 0.00 0.00 2.22 0.00 0.00 0.00 0.00 1.35 1.54 7.81 22 T 8.34 5.55 4.39 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 1.31 0.00 0.00 23 W 7.95 2.63 0.00 1.78 2.58 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 24 D 8.18 4.51 0.00 2.70 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 7.70 4.33 0.00 2.76 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 26 A 7.56 3.36 0.23 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 0.00 0.00 0.00 27 E 7.31 3.31 0.00 1.16 1.60 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 1.96 2.12 0.00 28 R 7.42 3.78 0.00 1.98 1.84 0.00 3.15 0.00 0.00 3.04 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 29 F 7.64 4.00 0.00 3.05 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 C 8.01 4.55 0.00 3.13 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 31 T 7.65 3.99 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 32 E 7.38 4.48 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.85 0.00 33 Q 7.81 4.39 0.00 2.35 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.75 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 34 A 7.36 4.21 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.36 3.90 0.00 1.60 1.63 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.34 1.42 7.81 36 G 8.52 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 0.00 0.00 0.00 37 G 7.37 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 0.00 0.00 0.00 38 H 8.41 4.76 0.00 3.09 3.12 0.00 5.62 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.20 4.72 0.00 1.34 1.58 -0.20 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.81 3.93 2.37 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 1.05 0.00 0.00 1.35 0.00 0.00 41 S 8.80 4.83 0.00 3.99 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 42 I 8.35 4.45 2.32 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.65 1.21 0.00 0.00 43 E 9.45 4.74 0.00 2.03 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 2.35 2.33 0.00 44 S 7.55 4.68 0.00 4.09 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.57 4.05 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 46 G 8.18 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 47 E 8.29 3.74 0.00 2.35 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 2.47 2.46 0.00 48 A 8.01 4.10 1.52 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 49 D 8.20 4.31 0.00 2.85 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 F 7.97 3.81 0.00 2.32 2.45 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 0.00 51 V 7.91 3.29 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 1.04 0.00 0.00 1.07 0.00 0.00 52 A 7.82 3.99 1.53 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 0.00 0.00 53 Q 7.96 3.81 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 54 L 7.30 3.54 0.00 1.12 1.40 0.66 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 55 V 7.66 3.22 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 -0.38 0.00 0.00 0.77 0.00 0.00 56 T 7.35 3.71 4.37 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 1.25 0.00 0.00 57 E 8.32 4.06 0.00 1.88 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 58 N 7.47 4.71 0.00 2.62 2.59 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 59 I 7.93 3.74 1.68 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.55 0.80 0.00 0.00 60 Q 7.48 3.96 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.83 0.00 0.00 0.00 0.00 0.00 2.60 2.49 0.00 61 N 8.91 4.94 0.00 2.78 2.82 0.00 0.00 6.61 7.56 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 62 T 8.01 4.22 4.32 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 1.17 0.00 0.00 63 K 7.28 4.40 0.00 1.69 1.64 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.41 7.81 64 S 7.69 4.26 0.00 3.96 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 65 Y 8.28 4.64 0.00 2.66 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 66 V 8.53 4.55 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 1.03 0.00 0.00 0.94 0.00 0.00 67 W 9.03 5.33 0.00 3.28 2.90 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 68 I 8.62 4.86 1.81 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.87 1.01 0.00 0.00 69 G 9.15 3.74 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 0.00 0.00 0.00 70 L 7.45 4.13 0.00 1.54 1.30 0.86 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.00 4.26 0.00 0.67 0.96 0.00 2.21 0.00 0.00 2.37 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.78 0.00 72 V 7.54 3.53 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 0.57 0.00 0.00 0.82 0.00 0.00 73 Q 8.53 4.08 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.49 2.24 0.00 74 G 7.18 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 75 K 8.38 4.32 0.00 1.66 1.75 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.37 7.81 76 E 7.86 4.10 0.00 2.06 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 2.37 2.33 0.00 77 K 8.61 3.93 0.00 1.64 1.58 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.58 1.09 7.81 78 Q 7.32 4.65 0.00 2.31 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.63 0.00 0.00 0.00 0.00 0.00 2.26 2.45 0.00 79 C 8.40 4.69 0.00 2.90 2.90 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 80 S 7.97 4.34 0.00 3.90 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 0.00 81 S 8.90 4.22 0.00 3.89 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 82 E 7.66 5.23 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 83 W 8.88 4.50 0.00 3.56 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 84 S 9.02 4.30 0.00 3.94 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 85 D 8.17 4.48 0.00 2.78 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 86 G 8.72 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 87 S 8.29 4.74 0.00 4.09 3.84 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 0.00 0.00 0.00 88 S 8.51 4.56 0.00 3.95 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 89 V 8.08 4.42 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.72 0.00 0.00 90 S 8.61 4.85 0.00 4.03 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 91 Y 8.03 4.85 0.00 2.95 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 92 E 7.80 4.07 0.00 1.81 1.64 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 2.23 2.31 0.00 93 N 7.53 4.82 0.00 2.65 2.70 0.00 0.00 7.05 7.95 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 94 W 7.65 4.37 0.00 3.20 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 95 I 8.44 4.31 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.69 0.88 0.00 0.00 96 E 8.83 3.73 0.00 2.00 1.75 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 2.48 2.36 0.00 97 A 7.48 2.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 7.74 4.19 0.00 2.44 2.32 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 2.36 2.49 0.00 99 S 7.21 3.62 0.00 2.72 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.77 4.41 0.00 1.74 1.78 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.41 7.81 101 T 7.77 4.26 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 1.03 0.00 0.00 102 C 8.19 4.79 0.00 3.08 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 0.00 103 L 8.15 5.25 0.00 1.49 1.58 0.88 1.15 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 0.00 104 G 8.82 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 0.00 0.00 0.00 0.00 105 L 8.76 5.84 0.00 2.12 1.93 1.23 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 106 E 8.36 4.64 0.00 1.66 1.63 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 2.46 2.28 0.00 107 K 7.81 2.85 0.00 1.35 1.51 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.30 7.81 108 E 7.94 3.81 0.00 1.84 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 2.24 2.26 0.00 109 T 7.24 4.45 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 1.20 0.00 0.00 110 G 8.50 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 0.00 111 F 7.79 4.06 0.00 3.14 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 R 8.02 4.66 0.00 1.81 1.95 0.00 3.30 0.00 0.00 3.36 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 113 K 7.74 4.63 0.00 1.69 1.70 0.00 1.60 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.28 1.37 7.81 114 W 8.62 5.06 0.00 3.21 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 V 8.65 4.45 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 1.11 0.00 0.00 1.18 0.00 0.00 116 N 9.03 4.94 0.00 2.65 2.92 0.00 0.00 6.91 7.45 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 0.00 117 I 9.03 4.63 1.74 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.16 0.05 0.00 0.00 118 Y 8.48 4.66 0.00 3.19 2.91 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 0.00 119 C 9.16 4.21 0.00 2.81 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 0.00 120 G 5.53 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 0.00 0.00 0.00 121 Q 7.85 4.36 0.00 2.19 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.69 0.00 0.00 0.00 0.00 0.00 2.45 2.54 0.00 122 Q 8.45 5.44 0.00 1.95 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.31 0.00 123 N 8.73 5.41 0.00 1.75 2.72 0.00 0.00 6.81 8.03 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 0.00 124 P 0.00 5.45 0.00 1.99 1.98 0.00 4.20 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.81 0.00 125 F 7.50 5.04 0.00 3.17 3.38 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 0.00 126 V 8.44 4.85 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 1.23 0.00 0.00 0.88 0.00 0.00 127 C 9.22 5.54 0.00 3.16 3.35 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 0.00 128 E 9.51 5.34 0.00 1.97 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.47 0.00 129 A 8.94 4.26 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00