NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2298 8.3144 121.7896 55.6872 33.3930 174.8728 2 E 3.9221 8.4535 123.5076 54.2079 30.3163 175.8258 3 T 4.2077 8.7024 118.2376 61.1948 72.1358 175.0053 4 A 3.9886 8.5255 123.7112 55.4079 18.4319 180.0161 5 A 3.9280 7.9698 118.5149 55.3035 18.5658 179.6110 6 A 4.2869 7.9240 120.2321 54.5761 18.4063 179.8088 7 K 3.9353 8.2885 118.3701 59.4626 32.2173 178.9258 8 F 4.0890 8.3584 121.0939 61.2324 39.4609 176.9384 9 E 4.0575 8.4072 118.2699 59.4746 29.0920 179.3685 10 R 3.9860 7.8161 117.1943 59.7166 30.2883 178.3327 11 Q 3.9566 7.9315 116.3457 58.0955 29.0013 176.4024 12 H 4.6075 7.8924 114.2617 54.2311 31.6777 173.4824 13 M 4.6119 7.9486 118.9123 54.1488 33.0203 176.6520 14 D 4.7999 8.8646 123.2788 53.0449 41.2309 175.6588 15 S 4.5621 8.3775 114.8792 58.9437 63.8384 175.7277 16 S 4.2990 7.7957 113.9782 60.1017 63.1941 174.1952 17 T 4.6874 7.6038 114.1431 60.0105 69.9818 173.4899 18 S 4.3003 8.4779 119.5844 59.4775 63.8341 173.4733 19 A 3.7047 7.0012 121.1856 50.9453 21.1889 175.4752 20 A 3.1251 8.8796 123.9780 52.1933 18.6458 178.2638 21 S 4.1708 8.7512 118.9194 60.8108 63.5672 174.0531 22 S 4.8029 7.6161 114.2941 55.3939 65.8724 174.0522 23 S 4.3969 8.6294 113.2157 60.1225 63.1248 174.3594 24 N 4.7161 8.1304 118.5081 53.7442 39.2696 176.0487 25 Y 3.9997 7.9729 120.3211 61.2414 38.6581 177.5837 26 C 4.2328 8.4192 116.4936 60.0602 39.6907 175.7446 27 N 4.3646 8.1536 117.5102 56.4242 38.2236 177.1348 28 Q 3.9019 7.9970 119.2428 59.3949 28.8497 178.9457 29 M 3.6835 7.7781 119.7643 58.4873 31.7994 178.7960 30 M 4.0308 7.9886 119.0745 58.0089 31.9524 178.8545 31 K 4.0107 7.8613 120.3058 58.9096 32.3945 179.0560 32 S 4.2500 7.8669 112.1551 60.2601 63.0300 175.2656 33 R 4.3270 7.6478 120.5209 55.2798 30.2423 175.5676 34 N 4.2731 8.0123 115.1065 54.7491 36.3039 174.8307 35 L 4.5457 8.1381 116.5902 55.0136 42.4103 177.8221 36 T 5.5400 7.4897 108.3099 60.5000 67.2817 175.9920 37 K 4.3803 7.5885 122.1198 59.7267 32.7840 178.6937 38 D 4.4997 7.9292 122.5048 56.4951 41.7665 176.1744 39 R 2.8366 6.9946 112.5428 55.3428 32.2563 172.7221 40 A 5.0040 8.1546 121.2059 50.2414 20.0937 176.8935 41 K 4.1338 8.7786 125.7821 55.5967 32.7320 175.1187 42 P 4.6913 0.0000 0.0000 65.3440 32.5269 176.4532 43 V 5.0420 7.6005 118.2542 61.1346 34.6149 174.1949 44 N 4.8508 9.2241 124.6192 52.6478 42.7192 172.8783 45 T 4.8242 7.9426 120.4672 61.6373 71.9912 172.7457 46 F 4.8212 8.9104 124.4877 55.6833 42.1066 174.6679 47 V 4.5714 9.0236 123.0187 61.1763 33.3837 175.6746 48 H 5.9807 8.7016 128.8928 53.8064 26.1507 173.5108 49 E 4.8028 7.6961 118.1723 53.3322 34.5914 176.4165 50 S 4.3838 8.3595 114.9276 58.2198 65.0762 174.9764 51 L 4.0006 8.5185 124.4680 58.3320 41.9193 179.1590 52 A 4.0222 7.9971 120.2571 55.3839 18.1494 179.2088 53 D 4.3429 7.8534 116.1154 57.4429 41.2706 178.8911 54 V 3.8098 7.8776 118.7910 66.0177 31.7145 178.1971 55 Q 3.9141 8.6197 118.0878 58.6940 28.5060 178.4319 56 A 4.0554 8.0912 121.5467 54.5466 18.2861 179.6636 57 V 3.5079 7.5344 116.7560 65.8590 31.3248 176.9178 58 C 3.8254 7.7219 114.5993 57.9448 39.8613 174.1148 59 S 4.6624 7.4685 114.3932 57.8863 63.8486 174.5897 60 Q 4.2743 7.3620 120.6171 55.9885 30.6970 177.8203 61 K 4.1545 8.1349 132.1705 57.1985 32.9658 175.5363 62 N 4.1450 8.7601 127.7591 53.5327 39.4842 174.2686 63 V 4.5882 8.3025 118.4851 59.0710 36.7133 175.0415 64 A 4.3053 8.3728 124.4433 52.3123 19.0731 178.4015 65 C 4.5905 9.5060 119.7430 55.7082 41.3321 175.0988 66 K 3.7229 8.6335 122.6413 59.4547 31.7200 177.2162 67 N 4.6520 8.1019 113.8477 52.5814 37.3582 175.7018 68 G 3.9905 8.1283 108.9908 45.7054 0.0000 174.6795 69 Q 4.0698 9.1939 120.1061 56.8349 29.1523 176.7604 70 T 4.5759 8.3985 114.5070 61.9609 67.6991 173.9013 71 N 5.1211 7.9646 116.0407 52.5018 38.4542 174.4232 72 C 5.3502 7.5368 115.6534 56.7980 42.9267 172.6402 73 Y 4.9768 9.0251 118.8216 56.2914 41.8514 173.9741 74 Q 5.1357 9.0798 125.3964 54.0313 31.2210 174.9734 75 S 4.3576 8.6086 121.7345 58.7274 63.1916 174.3443 76 Y 4.4843 9.3161 121.4897 60.3649 37.8290 176.1629 77 S 4.8729 7.8588 112.3237 56.1395 65.7684 173.1818 78 T 4.2621 8.0295 110.5054 61.7976 69.8220 173.8207 79 M 5.0382 9.1582 121.5780 53.4283 37.0419 174.5745 80 S 5.0346 9.3262 117.2636 58.3226 63.6239 173.1319 81 I 5.2348 9.1579 120.2378 59.5914 41.8036 174.1517 82 T 5.0055 9.0239 119.0918 61.9145 72.0598 172.5549 83 D 4.9147 9.3472 127.1637 53.2931 43.1787 174.2283 84 C 5.5117 9.2599 123.7171 55.3012 38.2896 172.8949 85 R 5.2299 8.8416 124.0143 54.0986 33.0962 174.0935 86 E 4.1542 9.1718 128.3423 56.3408 30.4301 176.7685 87 T 4.2690 8.2809 116.2462 60.6686 69.9053 175.9236 88 G 3.7250 8.5891 110.9922 47.6769 0.0000 174.3966 89 S 4.6014 7.3169 112.6684 57.7892 63.5199 173.9159 90 S 4.1169 8.0389 117.5571 57.9933 62.8456 172.8060 91 K 4.6955 8.2160 127.1797 54.1896 33.3382 174.5158 92 Y 4.3779 8.7019 127.7187 57.5819 39.0100 174.6059 93 P 3.7075 0.0000 0.0000 64.1085 32.2077 176.9835 94 N 4.5545 7.7040 118.6454 52.3825 36.5244 172.8839 95 A 4.6313 8.1189 121.1208 51.0538 19.8178 176.9030 96 A 4.7761 8.3103 125.1413 50.5780 21.2164 175.1001 97 Y 4.9889 8.7786 119.7168 55.9276 41.5845 175.1236 98 K 4.4143 9.4619 125.2017 55.8948 33.9733 175.0269 99 T 5.0886 8.6114 121.8707 60.7306 69.3886 173.2193 100 T 4.5715 8.8832 125.8290 61.8196 71.1577 173.1029 101 Q 4.7633 8.6955 127.9338 55.6971 30.4398 174.3044 102 A 4.5411 8.6623 125.3628 51.4959 23.7024 174.7503 103 N 5.4508 8.6902 116.2169 51.8812 40.7887 174.3839 104 K 4.6660 8.8148 122.3045 55.1622 37.7663 175.2691 105 H 4.8770 8.8265 118.1779 55.8541 30.1221 174.8911 106 I 4.7793 8.6795 115.2275 59.2826 40.7682 174.3864 107 I 4.9431 8.2172 124.3587 59.7267 40.1519 175.0864 108 V 4.7763 8.5255 119.3020 59.3313 36.0680 174.3503 109 A 5.0182 8.5801 124.6402 51.0887 20.5131 175.7742 110 C 5.0266 8.8512 119.8623 55.4467 38.1814 173.0049 111 E 4.5512 8.5733 119.6755 56.5755 34.6237 176.3163 112 G 4.1397 8.9203 109.7910 44.8727 0.0000 171.6443 113 N 5.0414 8.3941 117.0955 50.9726 40.8954 172.9995 114 P 4.3836 0.0000 0.0000 62.3985 32.1627 175.7671 115 Y 4.7805 8.3239 120.8067 57.7692 38.5494 174.9541 116 V 4.5152 8.1626 119.5596 58.0087 36.4567 173.5107 117 P 4.3418 0.0000 0.0000 63.3322 30.9480 176.4363 118 V 4.3963 8.4068 114.7948 61.1617 34.0738 175.3977 119 H 5.1851 7.8446 116.6094 54.2106 33.5646 172.2081 120 F 4.7843 8.9990 124.5509 57.3284 39.3901 174.8035 121 D 4.5171 8.6720 127.2538 56.3238 41.7960 175.5815 122 A 4.6498 6.6216 117.1590 51.7973 22.6528 174.4736 123 S 5.1996 8.8291 111.5725 56.8566 66.4547 174.7448 124 V 4.1563 8.7325 120.5929 62.1120 31.0190 175.0717 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 4.23 0.00 1.74 1.79 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.45 3.92 0.00 2.06 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 2.37 2.37 0.00 3 T 8.70 4.21 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 4 A 8.53 3.99 1.31 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 5 A 7.97 3.93 1.31 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 6 A 7.92 4.29 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 7 K 8.29 3.94 0.00 1.94 1.99 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.56 7.81 8 F 8.36 4.09 0.00 3.18 3.19 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 9 E 8.41 4.06 0.00 2.32 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 2.47 2.63 0.00 10 R 7.82 3.99 0.00 1.82 2.07 0.00 3.37 0.00 0.00 3.22 7.55 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 7.93 3.96 0.00 1.62 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.49 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 12 H 7.89 4.61 0.00 2.09 2.72 0.00 5.61 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.95 4.61 0.00 1.98 2.22 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.71 0.00 14 D 8.86 4.80 0.00 2.72 2.48 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 0.00 0.00 0.00 0.00 15 S 8.38 4.56 0.00 3.93 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 7.80 4.30 0.00 4.03 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 17 T 7.60 4.69 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 1.35 0.00 0.00 18 S 8.48 4.30 0.00 3.99 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 19 A 7.00 3.70 1.11 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 0.00 0.00 20 A 8.88 3.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.75 4.17 0.00 4.00 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 22 S 7.62 4.80 0.00 3.99 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 23 S 8.63 4.40 0.00 4.04 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 24 N 8.13 4.72 0.00 2.86 3.03 0.00 0.00 6.48 7.50 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 25 Y 7.97 4.00 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 26 C 8.42 4.23 0.00 3.15 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 27 N 8.15 4.36 0.00 2.95 2.91 0.00 0.00 7.13 7.62 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 28 Q 8.00 3.90 0.00 2.23 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 29 M 7.78 3.68 0.00 0.80 1.22 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.62 0.00 30 M 7.99 4.03 0.00 1.66 1.79 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 2.42 0.00 31 K 7.86 4.01 0.00 1.90 1.89 0.00 1.57 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.33 7.81 32 S 7.87 4.25 0.00 4.01 3.89 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 33 R 7.65 4.33 0.00 2.00 2.03 0.00 3.60 0.00 0.00 3.20 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.06 0.00 34 N 8.01 4.27 0.00 2.89 2.95 0.00 0.00 6.85 7.47 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 35 L 8.14 4.55 0.00 1.80 1.63 0.84 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.49 5.54 4.42 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 1.40 0.00 0.00 37 K 7.59 4.38 0.00 1.92 1.82 0.00 1.59 0.00 0.00 1.80 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.56 7.81 38 D 7.93 4.50 0.00 2.62 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 39 R 6.99 2.84 0.00 1.66 1.53 0.00 2.72 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.33 0.00 40 A 8.15 5.00 1.48 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 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.78 4.13 0.00 1.73 1.76 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.37 7.81 42 P 0.00 4.69 0.00 2.17 2.29 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 43 V 7.60 5.04 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 0.82 0.00 0.00 0.97 0.00 0.00 44 N 9.22 4.85 0.00 2.63 2.27 0.00 0.00 6.74 8.07 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 45 T 7.94 4.82 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 0.80 0.00 0.00 46 F 8.91 4.82 0.00 3.05 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 47 V 9.02 4.57 2.16 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 1.08 0.00 0.00 1.04 0.00 0.00 48 H 8.70 5.98 0.00 3.13 3.45 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.70 4.80 0.00 1.95 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 2.28 0.00 50 S 8.36 4.38 0.00 4.07 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 8.52 4.00 0.00 1.83 1.74 1.02 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.00 4.02 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 7.85 4.34 0.00 2.86 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 54 V 7.88 3.81 2.30 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 1.23 0.00 0.00 1.05 0.00 0.00 55 Q 8.62 3.91 0.00 2.07 2.08 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 2.52 0.00 56 A 8.09 4.06 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 57 V 7.53 3.51 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 0.99 0.00 0.00 0.93 0.00 0.00 58 C 7.72 3.83 0.00 2.91 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 59 S 7.47 4.66 0.00 3.92 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 60 Q 7.36 4.27 0.00 1.75 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.00 0.00 0.00 0.00 0.00 0.00 1.93 2.27 0.00 61 K 8.13 4.15 0.00 1.93 1.81 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.44 7.81 62 N 8.76 4.14 0.00 2.74 2.64 0.00 0.00 7.00 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 8.30 4.59 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.84 0.00 0.00 64 A 8.37 4.31 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 9.51 4.59 0.00 3.10 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 66 K 8.63 3.72 0.00 1.89 1.83 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.38 7.81 67 N 8.10 4.65 0.00 2.83 2.87 0.00 0.00 6.21 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 8.13 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 0.00 0.00 0.00 69 Q 9.19 4.07 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 70 T 8.40 4.58 4.21 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 1.20 0.00 0.00 71 N 7.96 5.12 0.00 3.00 3.07 0.00 0.00 6.06 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 7.54 5.35 0.00 3.07 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 73 Y 9.03 4.98 0.00 2.78 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 74 Q 9.08 5.14 0.00 2.01 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 75 S 8.61 4.36 0.00 3.95 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 76 Y 9.32 4.48 0.00 3.01 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 77 S 7.86 4.87 0.00 3.99 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 78 T 8.03 4.26 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 1.01 0.00 0.00 79 M 9.16 5.04 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 80 S 9.33 5.03 0.00 3.91 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 81 I 9.16 5.23 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.81 1.08 0.00 0.00 82 T 9.02 5.01 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 1.25 0.00 0.00 83 D 9.35 4.91 0.00 2.69 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 84 C 9.26 5.51 0.00 2.99 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 85 R 8.84 5.23 0.00 2.10 1.78 0.00 3.13 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 86 E 9.17 4.15 0.00 2.03 1.70 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 1.98 1.47 0.00 87 T 8.28 4.27 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 88 G 8.59 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 7.32 4.60 0.00 4.09 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 90 S 8.04 4.12 0.00 3.89 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 91 K 8.22 4.70 0.00 1.86 1.62 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.31 1.38 7.81 92 Y 8.70 4.38 0.00 2.94 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 93 P 0.00 3.71 0.00 1.92 1.38 0.00 3.61 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.64 0.00 94 N 7.70 4.55 0.00 2.94 2.79 0.00 0.00 6.75 6.94 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 95 A 8.12 4.63 1.37 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 0.00 0.00 0.00 96 A 8.31 4.78 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 97 Y 8.78 4.99 0.00 2.89 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 98 K 9.46 4.41 0.00 1.83 1.73 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.42 7.81 99 T 8.61 5.09 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 1.31 0.00 0.00 100 T 8.88 4.57 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 1.23 0.00 0.00 101 Q 8.70 4.76 0.00 1.95 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 2.24 2.38 0.00 102 A 8.66 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 8.69 5.45 0.00 2.58 2.74 0.00 0.00 6.69 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 8.81 4.67 0.00 1.74 1.75 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.45 7.81 105 H 8.83 4.88 0.00 3.17 3.25 0.00 5.77 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 0.00 106 I 8.68 4.78 1.82 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 1.29 0.91 1.13 0.00 0.00 107 I 8.22 4.94 1.79 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.74 0.84 0.00 0.00 108 V 8.53 4.78 1.96 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 0.66 0.00 0.00 0.81 0.00 0.00 109 A 8.58 5.02 1.31 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 0.00 110 C 8.85 5.03 0.00 1.92 1.71 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 0.00 111 E 8.57 4.55 0.00 1.77 1.76 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 2.27 2.26 0.00 112 G 8.92 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 0.00 0.00 0.00 0.00 113 N 8.39 5.04 0.00 2.63 2.69 0.00 0.00 6.88 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 4.38 0.00 2.22 2.04 0.00 3.82 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 1.98 1.95 0.00 115 Y 8.32 4.78 0.00 2.82 2.92 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 0.00 116 V 8.16 4.52 1.92 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 0.69 0.00 0.00 0.87 0.00 0.00 117 P 0.00 4.34 0.00 0.49 1.51 0.00 3.44 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 1.42 1.68 0.00 118 V 8.41 4.40 1.89 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 0.63 0.00 0.00 0.88 0.00 0.00 119 H 7.84 5.19 0.00 3.08 3.17 0.00 5.60 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 0.00 120 F 9.00 4.78 0.00 2.69 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 0.00 121 D 8.67 4.52 0.00 2.60 2.57 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 0.00 122 A 6.62 4.65 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 0.00 123 S 8.83 5.20 0.00 4.09 4.12 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 0.00 124 V 8.73 4.16 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 0.69 0.00 0.00 0.95 0.00 0.00