NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5954 8.3649 120.1964 53.9234 42.1277 174.6041 2 I 3.9521 8.3741 128.1836 60.1109 38.2408 170.1055 3 V 4.2607 9.5284 128.7149 61.7834 33.7525 173.9115 4 M 5.0936 8.6693 127.2656 54.0283 33.8531 175.2554 5 T 4.6536 9.4280 121.5365 61.9606 71.3417 173.7369 6 Q 5.8287 8.6911 124.9164 53.8602 32.0149 175.0612 7 S 4.8687 8.0682 111.1533 57.5021 65.3431 174.2832 8 P 4.8772 0.0000 0.0000 61.9988 32.5815 176.1580 9 S 4.5706 8.7686 115.0265 61.5775 63.7080 174.1728 10 S 5.1510 7.8541 113.3140 57.0729 67.3553 174.8892 11 L 4.5017 9.0555 123.5542 53.8220 44.6570 174.6404 12 T 4.3670 8.4284 114.4246 62.0898 69.4134 173.8920 13 V 4.6646 9.6182 117.5923 60.1577 36.4882 174.7037 14 T 4.5407 8.3261 116.5899 61.1866 71.6247 173.7142 15 A 4.1964 8.4397 127.0151 55.0888 18.3083 177.0724 16 G 4.0170 8.5652 112.4250 46.2202 0.0000 173.9919 17 E 4.1801 8.1615 119.6064 56.1003 30.7805 175.9829 18 K 5.4425 8.6949 124.1930 54.8363 33.6164 176.0961 19 V 4.4978 8.1349 125.6253 60.2175 34.6366 174.3110 20 T 4.9106 8.4764 119.6637 62.0949 71.0789 173.4915 21 M 4.7031 9.3371 124.6593 53.8882 35.4975 173.7209 22 S 5.3197 9.0622 121.3635 56.9343 64.8574 171.8587 23 C 5.5297 9.4993 126.6148 54.9817 44.9897 172.6140 24 K 5.5337 9.7786 126.1552 54.7075 35.5339 175.6129 25 S 5.4229 8.8780 118.3823 56.8126 65.4533 175.0714 26 S 4.3923 8.7152 115.4863 60.4105 63.4408 173.9977 27 Q 4.5764 7.7368 117.5642 53.7800 32.7385 174.2526 28 S 5.1107 8.3081 113.6233 58.1593 63.1610 173.8269 29 L 4.0623 8.2698 125.9891 54.1799 42.9084 175.2220 30 L 4.7069 7.4719 121.4130 54.3529 43.3471 175.3011 31 N 4.8998 8.9586 125.6993 52.0470 39.5107 175.5771 32 S 4.4611 8.5299 121.7795 60.7767 63.3692 176.1232 33 G 3.7422 8.4183 109.1095 47.9277 0.0000 173.7484 34 N 4.7036 8.0126 113.8465 51.1931 38.2427 174.1133 35 Q 3.5684 8.6538 118.0616 57.5196 26.8505 173.0781 36 K 4.5470 7.6181 115.7609 54.4746 36.0174 176.3263 37 N 5.1962 8.6616 122.3296 52.5365 39.7268 174.9435 38 Y 5.1253 9.5591 126.0752 57.0856 36.2199 174.0241 39 L 5.1894 7.7381 122.3668 53.1756 46.0940 175.3310 40 T 5.0137 8.5077 115.6039 59.6755 72.3687 172.7321 41 W 5.2541 9.1072 122.7591 55.3727 32.1610 174.6694 42 Y 5.4063 10.1461 121.4339 56.3088 41.9362 174.4010 43 Q 4.6318 9.2774 124.5222 54.4623 31.8038 173.7536 44 Q 4.8423 8.7665 129.1022 54.3147 31.1710 175.1164 45 K 4.7811 8.5076 125.9114 54.3625 34.5267 174.4873 46 P 4.3236 0.0000 0.0000 64.1869 31.6860 176.2782 47 G 4.0268 9.1797 111.1270 44.8995 0.0000 173.0954 48 Q 4.6529 7.1315 117.2393 53.0270 31.1384 173.5530 49 P 4.4871 0.0000 0.0000 61.5207 32.3004 174.2107 50 P 4.4799 0.0000 0.0000 62.8649 32.2078 175.8874 51 K 4.6339 8.6679 122.6276 54.2071 35.0257 175.0988 52 L 4.0517 8.9689 130.0979 55.9311 42.2987 174.9632 53 L 4.5772 8.9633 125.0119 55.8382 43.7865 176.1194 54 I 5.2919 7.6187 118.5151 59.6938 41.5945 173.4438 55 Y 4.9722 8.3368 122.3770 55.0350 42.3080 174.5594 56 W 4.6087 9.7239 115.1762 57.1572 26.5968 177.2305 57 A 4.0071 8.7207 120.2021 53.5806 17.7888 179.6511 58 S 4.6034 8.1110 104.9136 58.7703 67.1101 174.2727 59 T 4.1198 8.2079 120.7549 62.8584 69.0216 174.4230 60 R 4.5313 8.3774 126.2183 55.9877 31.1953 176.5410 61 E 4.5089 9.2771 123.0800 55.5412 31.0823 176.4436 62 S 4.3207 8.0347 117.0384 60.2352 62.8379 174.9345 63 G 4.0336 8.8869 114.2749 45.4565 0.0000 173.8755 64 V 3.8313 7.4638 120.0185 61.7024 32.2190 174.2031 65 P 4.5751 0.0000 0.0000 62.5029 31.8933 177.2308 66 D 4.4953 8.6148 120.6244 57.1150 41.2257 178.0641 67 R 4.1730 7.9113 115.3958 57.7160 30.2806 176.1156 68 F 4.6346 7.8457 118.6116 56.9246 39.1713 175.7311 69 T 4.0917 8.5617 121.5063 64.9620 68.8481 172.3901 70 G 3.9344 9.4201 116.3086 45.2986 0.0000 172.5777 71 S 4.6108 8.3777 117.8698 56.9536 66.1348 173.4486 72 G 4.5050 7.9875 110.6820 44.6806 0.0000 174.3742 73 S 4.6771 7.2446 123.4778 58.3541 61.2041 176.8001 74 G 4.0716 8.4197 118.3680 47.0076 0.0000 173.7238 75 T 4.8103 7.0386 112.8307 63.8563 75.7843 172.8473 76 D 5.0850 7.7986 121.8980 52.9727 42.3908 175.9389 77 F 5.3667 9.2885 122.5420 56.1210 43.0181 174.9364 78 T 5.5141 9.8388 116.9114 62.4299 73.1237 172.8055 79 L 4.4911 9.0339 127.8739 53.4927 44.6698 174.9822 80 T 4.9193 7.9266 118.2986 60.7177 71.4528 172.2370 81 I 4.9155 8.6291 129.5226 58.8030 38.8719 176.0524 82 S 4.0279 8.6066 123.1482 61.1954 63.4436 174.9746 83 S 4.6605 7.5608 118.6196 56.2851 65.8079 174.0790 84 V 3.6366 8.6629 126.5182 63.1627 32.5294 174.8511 85 Q 4.9180 8.6773 125.7029 53.7516 31.3638 176.5195 86 A 4.1729 8.9069 125.2306 55.4423 18.5176 179.8960 87 E 4.1194 8.1117 112.4137 59.1994 29.9291 177.6734 88 D 4.7150 8.4543 118.2358 55.3977 41.0091 176.3183 89 L 4.0393 7.7922 120.0184 55.3917 41.9869 176.4606 90 A 4.2156 7.3783 127.2815 52.2856 24.3656 173.7786 91 V 4.7153 7.2104 114.9742 61.5323 34.2756 175.3516 92 Y 5.1824 8.6896 124.9780 56.5025 40.4638 174.2664 93 Y 5.6688 9.6471 122.2489 56.4181 41.8053 172.4459 94 C 4.5682 9.0138 116.5861 53.6814 45.7767 172.2320 95 Q 4.5791 8.6395 120.7527 54.3567 32.5451 173.7306 96 N 4.7655 8.7927 125.1179 52.5900 39.3557 174.0466 97 D 5.2118 8.6016 127.4541 54.4429 41.3713 176.7020 98 Y 4.3174 8.6052 120.3606 58.9226 39.3914 175.1747 99 S 4.2237 7.5550 110.4544 57.0899 65.5918 173.3293 100 Y 4.6678 7.9080 119.1975 57.2440 38.3159 173.8843 101 P 4.8017 0.0000 0.0000 61.4830 32.8281 175.7537 102 L 4.3424 8.6866 121.2992 55.6337 42.0562 176.5369 103 T 4.7941 8.1452 113.2896 59.8960 71.9736 172.9854 104 F 5.1905 8.9000 121.0639 55.7277 42.6184 174.9346 105 G 4.2004 8.5677 107.9700 45.1170 0.0000 174.0593 106 A 4.3270 8.8040 121.8006 52.9414 18.7553 178.6847 107 G 3.8993 8.8099 101.5973 45.9408 0.0000 173.4097 108 T 4.7540 8.7022 117.6515 61.4090 70.9552 173.3414 109 K 4.7006 9.1979 130.0282 55.6539 33.5134 175.4200 110 L 5.0252 9.0022 128.5410 53.7596 42.8060 175.7940 111 E 4.9373 8.6043 123.5647 53.9665 32.1998 175.6230 112 P 4.4165 0.0000 0.0000 64.6337 32.1989 176.5852 113 G 4.0192 8.3336 111.4762 45.6808 0.0000 173.3165 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 2.68 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 I 8.37 3.95 1.89 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 1.25 0.90 0.94 0.00 0.00 3 V 9.53 4.26 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 0.99 0.00 0.00 0.95 0.00 0.00 4 M 8.67 5.09 0.00 1.90 2.15 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 5 T 9.43 4.65 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 6 Q 8.69 5.83 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00 7 S 8.07 4.87 0.00 3.89 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 8 P 0.00 4.88 0.00 2.45 2.11 0.00 3.81 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 9 S 8.77 4.57 0.00 3.96 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 0.00 10 S 7.85 5.15 0.00 3.73 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 11 L 9.06 4.50 0.00 1.54 1.56 0.91 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 12 T 8.43 4.37 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 1.22 0.00 0.00 13 V 9.62 4.66 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 0.74 0.00 0.00 1.01 0.00 0.00 14 T 8.33 4.54 4.62 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 1.20 0.00 0.00 15 A 8.44 4.20 1.24 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 0.00 0.00 0.00 16 G 8.57 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 0.00 0.00 0.00 17 E 8.16 4.18 0.00 1.95 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 18 K 8.69 5.44 0.00 1.88 1.65 0.00 1.49 0.00 0.00 2.37 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.19 7.81 19 V 8.13 4.50 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 0.64 0.00 0.00 0.79 0.00 0.00 20 T 8.48 4.91 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 1.18 0.00 0.00 21 M 9.34 4.70 0.00 1.81 1.67 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 22 S 9.06 5.32 0.00 4.02 3.93 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 23 C 9.50 5.53 0.00 3.08 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 24 K 9.78 5.53 0.00 1.73 1.69 0.00 1.73 0.00 0.00 1.94 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.44 7.81 25 S 8.88 5.42 0.00 3.97 3.99 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 26 S 8.72 4.39 0.00 3.93 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 27 Q 7.74 4.58 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 28 S 8.31 5.11 0.00 3.77 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 29 L 8.27 4.06 0.00 1.62 1.63 0.84 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.47 4.71 0.00 1.61 1.49 0.90 1.03 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 31 N 8.96 4.90 0.00 2.84 2.86 0.00 0.00 6.65 7.23 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 32 S 8.53 4.46 0.00 4.02 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 G 8.42 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 34 N 8.01 4.70 0.00 2.68 2.90 0.00 0.00 7.11 6.89 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 35 Q 8.65 3.57 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 36 K 7.62 4.55 0.00 1.37 0.95 0.00 1.13 0.00 0.00 1.53 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 37 N 8.66 5.20 0.00 2.95 3.02 0.00 0.00 7.18 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 9.56 5.13 0.00 3.17 3.24 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 0.00 39 L 7.74 5.19 0.00 1.03 0.79 0.20 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.51 5.01 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 1.18 0.00 0.00 41 W 9.11 5.25 0.00 3.22 3.15 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 42 Y 10.15 5.41 0.00 3.08 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 43 Q 9.28 4.63 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 1.75 1.16 0.00 44 Q 8.77 4.84 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.60 0.00 0.00 0.00 0.00 0.00 2.27 2.46 0.00 45 K 8.51 4.78 0.00 1.77 1.69 0.00 1.57 0.00 0.00 1.85 0.00 0.00 3.05 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.49 1.47 7.81 46 P 0.00 4.32 0.00 2.18 2.07 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 1.99 1.96 0.00 47 G 9.18 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 48 Q 7.13 4.65 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.89 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 49 P 0.00 4.49 0.00 2.12 2.01 0.00 3.76 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 1.97 1.96 0.00 50 P 0.00 4.48 0.00 1.63 1.88 0.00 3.47 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 1.63 1.86 0.00 51 K 8.67 4.63 0.00 1.85 1.87 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.37 7.81 52 L 8.97 4.05 0.00 1.79 1.61 0.69 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.96 4.58 0.00 1.78 1.51 0.73 0.08 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 54 I 7.62 5.29 2.09 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.85 0.99 0.00 0.00 55 Y 8.34 4.97 0.00 2.67 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 56 W 9.72 4.61 0.00 3.39 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 57 A 8.72 4.01 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 0.00 0.00 0.00 0.00 0.00 58 S 8.11 4.60 0.00 3.98 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 59 T 8.21 4.12 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 0.86 0.00 0.00 60 R 8.38 4.53 0.00 1.69 1.87 0.00 3.23 0.00 0.00 3.55 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 61 E 9.28 4.51 0.00 2.09 1.91 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 2.58 2.46 0.00 62 S 8.03 4.32 0.00 3.84 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 63 G 8.89 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 7.46 3.83 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 0.86 0.00 0.00 0.95 0.00 0.00 65 P 0.00 4.58 0.00 2.31 2.02 0.00 4.10 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.24 0.00 66 D 8.61 4.50 0.00 2.66 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 67 R 7.91 4.17 0.00 1.65 2.00 0.00 2.79 0.00 0.00 3.17 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.77 0.00 68 F 7.85 4.63 0.00 3.14 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 69 T 8.56 4.09 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 1.21 0.00 0.00 70 G 9.42 3.93 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 0.00 0.00 0.00 71 S 8.38 4.61 0.00 4.01 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 72 G 7.99 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 73 S 7.24 4.68 0.00 3.57 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 74 G 8.42 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 0.00 0.00 0.00 75 T 7.04 4.81 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 1.32 0.00 0.00 76 D 7.80 5.09 0.00 2.53 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 77 F 9.29 5.37 0.00 3.26 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 78 T 9.84 5.51 4.31 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 1.28 0.00 0.00 79 L 9.03 4.49 0.00 0.27 0.59 0.45 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 80 T 7.93 4.92 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 1.13 0.00 0.00 81 I 8.63 4.92 1.65 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.91 0.62 0.00 0.00 82 S 8.61 4.03 0.00 3.80 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 83 S 7.56 4.66 0.00 3.64 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 84 V 8.66 3.64 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 1.00 0.00 0.00 0.89 0.00 0.00 85 Q 8.68 4.92 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.47 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 86 A 8.91 4.17 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.11 4.12 0.00 2.14 2.14 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 2.34 2.42 0.00 88 D 8.45 4.72 0.00 2.90 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 89 L 7.79 4.04 0.00 1.87 1.68 1.04 1.13 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 90 A 7.38 4.22 1.09 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 0.00 0.00 91 V 7.21 4.72 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 0.46 0.00 0.00 0.89 0.00 0.00 92 Y 8.69 5.18 0.00 3.05 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 9.65 5.67 0.00 3.14 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 94 C 9.01 4.57 0.00 1.78 1.18 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 95 Q 8.64 4.58 0.00 2.02 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 1.67 1.16 0.00 96 N 8.79 4.77 0.00 2.82 2.76 0.00 0.00 6.63 9.25 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 97 D 8.60 5.21 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 98 Y 8.61 4.32 0.00 2.97 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 99 S 7.55 4.22 0.00 3.82 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 0.00 100 Y 7.91 4.67 0.00 2.98 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 0.00 101 P 0.00 4.80 0.00 2.21 2.06 0.00 3.83 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 1.99 2.01 0.00 102 L 8.69 4.34 0.00 1.60 1.59 1.07 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 103 T 8.15 4.79 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 1.31 0.00 0.00 104 F 8.90 5.19 0.00 2.79 2.88 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 0.00 105 G 8.57 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 0.00 106 A 8.80 4.33 1.40 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 0.00 107 G 8.81 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 0.00 108 T 8.70 4.75 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 1.28 0.00 0.00 109 K 9.20 4.70 0.00 1.83 1.88 0.00 1.53 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.49 7.81 110 L 9.00 5.03 0.00 1.90 1.65 0.90 0.78 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 0.00 111 E 8.60 4.94 0.00 1.92 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 112 P 0.00 4.42 0.00 2.17 2.18 0.00 3.49 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 113 G 8.33 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 0.00 0.00 0.00