NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3248 8.3144 120.1355 56.3250 33.4443 174.2766 2 E 4.4656 8.0803 119.1965 52.1276 32.5196 173.2516 3 T 4.2379 8.7464 118.3533 61.2223 72.2347 175.0540 4 A 3.9913 8.5464 123.6404 55.3014 18.4678 180.0412 5 A 4.1392 7.9859 118.6404 55.3810 18.5861 179.6072 6 A 4.0390 8.1824 119.3556 55.1030 18.3370 179.8130 7 K 4.1822 8.3900 119.8875 58.9476 32.2596 178.8837 8 F 4.0707 8.4849 121.1290 61.3219 39.4296 176.9967 9 E 4.0834 8.3162 117.8105 59.4305 29.0440 179.3591 10 R 3.9046 7.8584 117.7680 59.4680 30.2439 178.1528 11 Q 3.9733 8.0229 116.8198 57.6913 29.2213 176.1825 12 H 4.9718 8.1377 113.9533 54.2647 31.0145 173.2145 13 M 4.8266 7.8438 118.8179 53.5397 33.6585 176.7209 14 D 4.8288 8.7372 122.6710 53.7317 42.1507 175.7443 15 S 4.2571 8.3881 118.6807 60.7762 63.6987 176.6440 16 S 4.3163 8.1773 115.5839 60.6272 62.7939 174.4005 17 T 4.6252 7.6509 110.0426 59.7357 71.4290 173.9823 18 S 4.1390 8.9010 120.8681 60.9646 63.3714 174.9257 19 A 4.3350 7.7659 121.9528 50.0180 21.4193 178.5456 20 A 3.0912 8.2258 118.9198 51.0196 17.1919 176.8048 21 S 3.2731 7.3758 112.6295 60.0873 63.6225 171.7560 22 S 4.5864 8.0894 110.9797 57.3464 64.6691 176.7108 23 S 3.5469 8.8917 116.9523 61.3129 62.6096 175.0332 24 N 4.8319 7.8259 115.3656 53.1797 38.8538 175.6788 25 Y 4.0394 8.8769 122.1504 61.4456 38.6655 177.8328 26 C 4.0856 8.8525 117.2842 60.1187 38.6317 175.9096 27 N 4.4128 8.2212 117.4631 56.4652 38.0345 177.2962 28 Q 4.1197 7.9671 119.2361 59.0379 28.9997 178.4363 29 M 3.9233 7.8977 121.3307 57.9565 31.7335 178.7745 30 M 4.0243 8.2039 119.2494 57.8014 31.9184 178.8052 31 K 4.0260 7.6904 121.8486 58.6412 32.4631 179.0568 32 S 4.0532 8.2180 114.2220 61.2706 62.9696 175.6250 33 R 4.4027 7.9953 117.6877 55.3816 29.7219 175.7997 34 N 4.1921 7.8227 114.1163 54.6934 36.7729 174.7569 35 L 4.5934 8.2082 115.5159 54.9129 42.3480 177.9048 36 T 5.6321 7.5001 107.1724 60.3690 69.6174 175.9182 37 K 4.1459 8.3559 123.4059 60.3033 32.4538 177.9394 38 D 4.4871 8.0386 116.9332 55.9773 41.3459 176.0889 39 R 3.5898 7.1396 113.9092 55.7386 30.9868 173.9776 40 C 4.8549 8.7046 116.0651 55.5636 39.4057 173.7974 41 K 4.0272 8.4778 126.8209 56.1657 32.3004 174.4093 42 P 4.6846 0.0000 0.0000 65.3074 31.9542 176.4727 43 V 5.0789 7.5770 116.0781 60.1376 34.5328 173.9525 44 N 4.7268 8.9758 121.1471 52.7731 43.0686 172.9104 45 T 4.7683 7.9556 121.8758 61.6439 71.6698 172.9212 46 F 5.0288 8.8872 124.1686 55.6408 42.0937 174.5160 47 V 4.4470 8.8831 123.7055 61.3036 33.2045 175.6407 48 H 5.5692 8.7346 128.3761 53.5626 26.1946 173.5321 49 E 4.7853 7.7183 118.3217 53.3760 34.5171 176.2768 50 S 4.3749 8.4006 115.0608 58.2160 65.0744 174.9096 51 L 3.9941 8.5720 124.5073 58.3699 41.8535 179.1947 52 A 4.0097 7.9998 120.1382 55.4304 18.1749 179.1912 53 D 4.3436 7.9862 116.0916 57.4541 41.1419 178.9722 54 V 3.8129 7.9169 118.8254 66.0925 31.7436 178.1584 55 Q 3.9167 8.6436 118.0277 58.8101 28.5382 178.5679 56 A 4.0899 8.2104 121.4188 54.4899 18.2706 179.6267 57 V 3.5802 7.6700 117.0653 65.9358 31.2965 177.0896 58 C 3.7707 7.8019 115.0040 58.2391 39.8876 174.2681 59 S 4.6674 7.5810 113.8526 57.9366 63.7410 174.8806 60 Q 4.6451 7.5637 122.3261 55.8690 27.7809 176.7757 61 K 4.0824 7.4492 128.7188 57.2746 33.0739 176.0227 62 N 4.6101 8.8210 127.6058 53.6258 39.0749 174.3787 63 V 4.5894 8.4923 118.6598 59.0428 36.5915 175.0391 64 A 4.1555 8.4064 125.4905 52.2833 19.0410 178.6051 65 C 4.6714 8.7516 120.0226 56.1732 41.1135 175.2774 66 K 3.6881 8.7799 122.3537 59.5365 31.6943 177.9362 67 N 4.5632 8.0763 113.4467 52.8497 37.5061 175.8165 68 G 3.9496 8.2349 108.8316 45.6420 0.0000 174.3231 69 Q 4.2005 8.6234 119.4156 56.2683 29.2199 176.5938 70 T 4.5271 8.2754 108.3568 61.6803 69.5492 174.1469 71 N 4.9283 7.7223 119.9630 53.8740 38.0572 175.0294 72 C 5.3979 7.3090 115.6553 56.6414 45.0071 173.3143 73 Y 5.1822 9.0246 118.5984 56.3396 42.1176 173.8910 74 Q 5.1299 9.0086 124.9338 54.0148 31.4561 174.8938 75 S 4.3686 8.5771 121.7516 58.6447 63.2511 174.2961 76 Y 4.2860 9.1021 121.4554 60.6128 37.9470 176.6247 77 S 4.8932 7.8680 113.9777 56.9176 64.9541 173.7506 78 T 4.2843 8.1115 112.4163 62.0212 69.9167 173.6066 79 M 5.0564 8.9832 121.8553 53.4366 36.8573 174.6205 80 S 5.0199 9.2832 117.3494 58.2749 63.7550 173.1467 81 I 5.1588 8.9933 119.9413 59.6659 41.9719 174.1774 82 T 4.9935 8.8482 118.2896 62.1254 72.3137 172.9852 83 D 4.9747 9.2457 127.4643 53.3357 43.1197 174.9292 84 C 5.3905 9.0676 120.7379 55.2442 43.4559 172.7916 85 R 5.2470 8.4215 123.4066 54.0113 32.4684 174.3870 86 E 3.9931 9.0161 128.6395 56.1594 30.0872 176.8345 87 T 4.1062 8.3647 117.7911 61.4047 69.5102 174.5289 88 G 3.7254 8.4582 109.9179 47.0217 0.0000 174.5894 89 S 4.5555 7.7266 112.3569 57.7040 63.8032 174.2149 90 S 4.0455 7.4940 116.5439 58.4904 62.6399 173.4000 91 K 4.4824 8.3739 126.0070 54.3055 34.4018 174.9709 92 Y 4.4130 8.8010 125.2198 57.6901 38.9436 174.4134 93 P 3.4324 0.0000 0.0000 63.1320 32.2707 176.6996 94 N 4.6110 7.5914 119.2362 52.2037 36.9376 174.0256 95 C 4.3255 7.9603 115.9654 56.8228 41.8539 173.3426 96 A 5.1699 8.7172 126.6825 50.3660 21.3058 174.6749 97 Y 5.1433 10.2971 119.7590 56.0524 42.2362 174.7490 98 K 4.5154 8.8336 122.7339 55.3753 34.1523 175.3146 99 T 4.6599 8.6584 124.7954 63.0967 69.3084 174.1969 100 T 4.6661 8.6778 123.7382 61.6548 71.5390 173.2337 101 Q 5.1053 8.5503 126.5724 54.8718 31.3447 173.9021 102 A 4.5402 8.4254 124.7684 51.4625 23.6588 175.0858 103 N 5.3254 8.7363 115.9250 51.7478 40.9778 174.1090 104 K 4.7003 8.6897 122.2243 54.7005 37.8691 175.3166 105 H 4.8683 9.0718 119.3336 55.7631 29.7229 175.3617 106 I 4.6580 8.4555 117.0498 59.8143 40.2526 174.7341 107 I 4.8863 8.2482 124.3910 59.7628 40.0726 175.0890 108 V 4.7457 8.6032 119.4878 59.3325 36.0380 174.4240 109 A 5.1433 8.7401 124.3676 50.8707 20.9834 175.6153 110 C 5.1882 8.6983 118.3454 55.3768 38.0803 173.2269 111 E 4.6671 8.5761 119.8190 56.4796 34.6035 175.7715 112 G 4.1726 9.4638 108.8292 44.9620 0.0000 171.7962 113 N 5.0584 8.2491 116.3223 50.7988 40.5539 172.3837 114 P 4.3102 0.0000 0.0000 62.8137 31.8991 175.7879 115 Y 4.8725 8.3167 121.4708 57.2214 38.8519 174.5207 116 V 4.4266 8.0635 119.0860 58.3417 36.7074 173.3948 117 P 4.4729 0.0000 0.0000 62.8210 31.2603 177.1023 118 V 4.5524 8.3832 114.7227 60.9023 34.1307 174.9642 119 H 4.8774 7.9724 118.6948 55.2340 33.2957 171.8958 120 F 4.6084 8.7947 127.9455 57.0490 39.6093 174.3808 121 D 4.5662 8.4116 127.0425 55.8654 42.2448 175.7519 122 A 4.4446 6.6546 119.0152 52.1613 21.6328 174.4118 123 S 5.1333 8.5264 112.3935 57.0299 66.2015 174.6328 124 V 4.0545 8.9219 115.2372 61.8616 32.4965 175.2410 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 8.31 4.32 0.00 1.77 1.85 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.39 7.81 2 E 8.08 4.47 0.00 2.02 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 2.28 2.38 0.00 3 T 8.75 4.24 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 1.23 0.00 0.00 4 A 8.55 3.99 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 5 A 7.99 4.14 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 6 A 8.18 4.04 1.41 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 7 K 8.39 4.18 0.00 2.03 2.04 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.30 7.81 8 F 8.48 4.07 0.00 3.20 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 9 E 8.32 4.08 0.00 2.31 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 2.53 2.68 0.00 10 R 7.86 3.90 0.00 1.83 2.09 0.00 3.36 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.02 3.97 0.00 1.65 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.49 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 12 H 8.14 4.97 0.00 1.82 2.69 0.00 5.59 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 13 M 7.84 4.83 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.70 0.00 14 D 8.74 4.83 0.00 2.82 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 15 S 8.39 4.26 0.00 3.97 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 16 S 8.18 4.32 0.00 4.00 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 17 T 7.65 4.63 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 1.20 0.00 0.00 18 S 8.90 4.14 0.00 3.97 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 19 A 7.77 4.33 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 20 A 8.23 3.09 0.66 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 0.00 0.00 21 S 7.38 3.27 0.00 3.97 3.44 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 22 S 8.09 4.59 0.00 3.98 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 23 S 8.89 3.55 0.00 4.02 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 24 N 7.83 4.83 0.00 2.83 2.86 0.00 0.00 6.45 7.36 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 25 Y 8.88 4.04 0.00 3.00 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 26 C 8.85 4.09 0.00 3.09 3.10 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 27 N 8.22 4.41 0.00 2.89 2.92 0.00 0.00 7.14 7.74 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 28 Q 7.97 4.12 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.55 0.00 29 M 7.90 3.92 0.00 0.73 1.17 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.56 0.00 30 M 8.20 4.02 0.00 1.58 1.79 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.33 0.00 31 K 7.69 4.03 0.00 2.01 1.89 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.29 7.81 32 S 8.22 4.05 0.00 3.95 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 33 R 8.00 4.40 0.00 1.96 2.12 0.00 3.62 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 34 N 7.82 4.19 0.00 2.86 2.90 0.00 0.00 6.83 7.43 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 35 L 8.21 4.59 0.00 1.75 1.61 0.79 0.83 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 36 T 7.50 5.63 4.41 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 1.44 0.00 0.00 37 K 8.36 4.15 0.00 1.79 1.91 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.89 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.51 7.81 38 D 8.04 4.49 0.00 2.67 2.66 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 39 R 7.14 3.59 0.00 1.78 1.74 0.00 2.87 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.44 0.00 40 C 8.70 4.85 0.00 3.07 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 41 K 8.48 4.03 0.00 1.89 1.79 0.00 1.78 0.00 0.00 1.61 0.00 0.00 3.17 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.43 7.81 42 P 0.00 4.68 0.00 2.14 2.13 0.00 3.62 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 43 V 7.58 5.08 2.12 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 0.73 0.00 0.00 0.99 0.00 0.00 44 N 8.98 4.73 0.00 2.66 2.34 0.00 0.00 6.82 6.83 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 45 T 7.96 4.77 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 0.90 0.00 0.00 46 F 8.89 5.03 0.00 3.00 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 47 V 8.88 4.45 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 1.06 0.00 0.00 1.09 0.00 0.00 48 H 8.73 5.57 0.00 3.15 3.49 0.00 5.64 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.72 4.79 0.00 1.96 1.85 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 2.27 2.29 0.00 50 S 8.40 4.37 0.00 4.08 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 51 L 8.57 3.99 0.00 1.83 1.75 1.02 1.18 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 52 A 8.00 4.01 1.34 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 0.00 0.00 53 D 7.99 4.34 0.00 2.85 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 54 V 7.92 3.81 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 1.26 0.00 0.00 1.05 0.00 0.00 55 Q 8.64 3.92 0.00 2.29 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 56 A 8.21 4.09 1.42 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 0.00 0.00 57 V 7.67 3.58 2.12 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 1.05 0.00 0.00 0.99 0.00 0.00 58 C 7.80 3.77 0.00 2.91 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 59 S 7.58 4.67 0.00 3.96 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 60 Q 7.56 4.65 0.00 2.07 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.94 0.00 0.00 0.00 0.00 0.00 2.61 2.46 0.00 61 K 7.45 4.08 0.00 1.34 1.55 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.75 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.42 7.81 62 N 8.82 4.61 0.00 2.85 2.70 0.00 0.00 7.01 7.71 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 63 V 8.49 4.59 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 0.64 0.00 0.00 0.79 0.00 0.00 64 A 8.41 4.16 1.19 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 0.00 0.00 0.00 65 C 8.75 4.67 0.00 3.15 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 66 K 8.78 3.69 0.00 1.76 1.89 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.56 7.81 67 N 8.08 4.56 0.00 2.81 2.89 0.00 0.00 6.23 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 68 G 8.23 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 0.00 0.00 0.00 69 Q 8.62 4.20 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.68 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 70 T 8.28 4.53 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 1.18 0.00 0.00 71 N 7.72 4.93 0.00 3.13 3.18 0.00 0.00 6.05 7.68 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 72 C 7.31 5.40 0.00 2.70 2.84 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 73 Y 9.02 5.18 0.00 2.80 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 74 Q 9.01 5.13 0.00 1.95 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 75 S 8.58 4.37 0.00 3.95 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 76 Y 9.10 4.29 0.00 3.06 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 77 S 7.87 4.89 0.00 3.93 3.83 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 78 T 8.11 4.28 4.17 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 1.00 0.00 0.00 79 M 8.98 5.06 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 80 S 9.28 5.02 0.00 3.92 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 81 I 8.99 5.16 1.93 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 1.42 0.65 1.03 0.00 0.00 82 T 8.85 4.99 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 1.41 0.00 0.00 83 D 9.25 4.97 0.00 2.60 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.07 5.39 0.00 2.90 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 85 R 8.42 5.25 0.00 1.96 1.82 0.00 3.13 0.00 0.00 3.12 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 86 E 9.02 3.99 0.00 1.78 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 2.08 1.82 0.00 87 T 8.36 4.11 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 1.22 0.00 0.00 88 G 8.46 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 89 S 7.73 4.56 0.00 3.96 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 90 S 7.49 4.05 0.00 3.84 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 91 K 8.37 4.48 0.00 1.76 1.68 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.62 1.33 7.81 92 Y 8.80 4.41 0.00 2.88 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 93 P 0.00 3.43 0.00 1.78 1.13 0.00 3.64 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 94 N 7.59 4.61 0.00 2.81 2.79 0.00 0.00 6.95 7.31 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 95 C 7.96 4.33 0.00 3.19 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 96 A 8.72 5.17 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 97 Y 10.30 5.14 0.00 2.69 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 98 K 8.83 4.52 0.00 1.89 1.73 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.44 7.81 99 T 8.66 4.66 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 1.37 0.00 0.00 100 T 8.68 4.67 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 101 Q 8.55 5.11 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.38 0.00 102 A 8.43 4.54 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 0.00 0.00 0.00 0.00 0.00 103 N 8.74 5.33 0.00 2.57 2.74 0.00 0.00 6.67 7.61 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 0.00 104 K 8.69 4.70 0.00 1.73 1.93 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.43 7.81 105 H 9.07 4.87 0.00 3.28 3.30 0.00 5.80 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.46 4.66 1.68 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 1.26 0.73 1.13 0.00 0.00 107 I 8.25 4.89 1.78 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 1.12 0.73 0.78 0.00 0.00 108 V 8.60 4.75 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 0.58 0.00 0.00 0.81 0.00 0.00 109 A 8.74 5.14 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 0.00 110 C 8.70 5.19 0.00 1.84 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 0.00 0.00 0.00 111 E 8.58 4.67 0.00 1.85 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 0.00 2.27 2.23 0.00 112 G 9.46 4.17 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 0.00 0.00 0.00 113 N 8.25 5.06 0.00 2.63 2.70 0.00 0.00 6.89 7.69 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 0.00 114 P 0.00 4.31 0.00 2.23 2.05 0.00 3.83 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 115 Y 8.32 4.87 0.00 2.83 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 0.00 116 V 8.06 4.43 1.93 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 0.75 0.00 0.00 0.88 0.00 0.00 117 P 0.00 4.47 0.00 0.49 0.86 0.00 3.28 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 118 V 8.38 4.55 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 0.63 0.00 0.00 0.94 0.00 0.00 119 H 7.97 4.88 0.00 3.27 3.12 0.00 5.84 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.79 4.61 0.00 2.58 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.41 4.57 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 0.00 122 A 6.65 4.44 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 0.00 0.00 0.00 0.00 0.00 123 S 8.53 5.13 0.00 4.04 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 0.00 124 V 8.92 4.05 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 0.70 0.00 0.00 0.99 0.00 0.00