NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2334 8.3144 121.7897 55.8643 33.1253 175.0572 2 E 3.9651 8.3716 125.6468 54.1431 30.4678 175.0810 3 T 4.1356 8.6795 117.9672 61.2533 72.0717 175.0244 4 A 3.9950 8.5148 123.4519 55.3885 18.4475 179.9797 5 A 4.1490 8.0007 118.5791 55.2856 18.5501 179.5954 6 A 4.2895 8.1585 120.7109 54.5996 18.3776 179.7962 7 K 4.2500 8.3135 119.7110 59.1102 32.2174 178.8091 8 F 4.0625 8.4107 120.9823 61.2114 38.7679 176.9000 9 E 4.0565 8.4459 118.2306 59.5785 29.1359 179.3396 10 R 3.9255 7.8343 117.1094 59.6442 30.2295 178.2441 11 Q 3.9233 7.9968 116.7869 57.9855 29.0035 176.3105 12 H 4.7044 7.8839 113.9758 54.2190 31.2133 173.2981 13 M 4.7117 8.0493 119.0469 53.7848 33.4510 176.6626 14 D 4.7894 8.8827 123.0288 53.4546 41.9297 175.5146 15 S 4.5816 8.3910 115.0657 58.8643 63.7100 175.4761 16 S 4.3891 7.8154 114.2902 59.7503 63.2486 174.3063 17 T 4.7241 7.4347 110.3505 59.6615 71.4867 174.1343 18 S 4.1669 8.6790 117.4050 60.8790 63.6109 173.6597 19 A 3.8159 6.9582 120.3075 50.9672 21.1999 175.2970 20 A 3.5257 8.1628 122.9861 52.4599 18.1631 177.7638 21 S 4.6436 8.4579 118.0446 58.5166 63.5960 174.0478 22 S 4.6794 7.3863 114.5042 56.7088 64.9813 175.0378 23 S 4.3119 8.6730 119.8258 60.6537 63.2018 174.5678 24 N 4.7374 8.6269 118.4182 53.4625 39.1022 175.9617 25 Y 3.9996 8.0766 121.0222 61.2122 38.7263 177.6532 26 C 4.2240 8.4037 117.0899 60.0316 39.6378 175.7757 27 N 4.3912 8.2027 117.5851 56.3648 38.0812 177.0626 28 Q 3.8418 7.9236 120.6739 59.5604 29.2426 178.1564 29 M 3.7094 7.6762 121.3655 57.9489 31.7144 178.7579 30 M 4.0281 8.1942 119.2945 57.9241 31.9854 178.8560 31 K 3.9305 7.6466 119.0822 59.6152 32.0722 179.2310 32 S 4.1571 8.1979 114.6502 61.0432 62.5733 175.4914 33 R 4.3558 7.7913 119.2599 54.9993 30.4257 175.7964 34 N 4.2390 7.9590 114.9650 54.8779 36.5575 174.6953 35 L 4.6843 8.2911 114.9814 54.8141 42.1803 178.1051 36 T 5.4083 7.5169 105.9718 60.6212 69.3139 175.3262 37 K 4.0754 8.3012 121.3269 59.8987 32.2287 177.4167 38 D 4.8201 7.7940 115.1372 52.1988 41.9633 176.2874 39 R 3.6384 6.7793 115.4389 55.7479 30.8981 173.9811 40 C 4.9523 8.7420 117.6814 55.7639 40.6421 173.8070 41 K 4.1593 8.5844 127.3429 56.0101 32.5904 174.7569 42 P 4.7349 0.0000 0.0000 64.6957 32.3069 176.4673 43 V 5.0621 7.4930 116.5979 61.3461 34.9422 174.1749 44 N 4.4980 8.8676 123.1552 52.9039 42.9160 172.9461 45 T 4.7189 7.6328 121.9502 61.5771 71.5495 172.9587 46 F 4.8216 8.7650 124.1872 55.6024 42.3391 174.4805 47 V 4.5036 9.0583 122.9133 61.1327 33.4825 175.6064 48 H 5.8244 8.8486 127.3813 53.6604 26.2606 173.5400 49 E 4.7916 7.7306 117.6806 53.3049 34.5678 176.4587 50 S 4.3470 8.4588 115.3164 58.4063 64.8982 175.0496 51 L 3.9991 8.5469 124.2772 58.3610 41.8218 179.1097 52 A 4.1666 8.0276 120.1709 55.4507 18.1287 179.1571 53 D 4.3085 7.9700 116.1464 57.5191 41.2052 178.9739 54 V 3.8060 7.8545 118.6050 66.1145 31.6499 178.1730 55 Q 3.9169 8.6168 118.0705 58.7754 28.5208 178.5409 56 A 4.0361 8.2643 121.7297 54.6909 18.2414 179.6815 57 V 3.4644 7.5625 117.0170 66.0700 31.2941 177.1048 58 C 3.7910 7.7978 115.0688 58.1527 39.8748 174.2744 59 S 4.6609 7.4878 114.0203 57.9217 63.8077 174.7876 60 Q 4.1156 7.4503 122.5852 55.8728 27.3512 177.0955 61 K 4.2307 7.8631 128.1389 57.2599 33.0900 175.6020 62 N 4.2001 8.7351 127.4428 53.3024 38.6940 174.3934 63 V 4.5791 8.4019 118.4813 59.0265 36.5423 175.1595 64 A 4.2522 8.4520 125.1868 52.5102 19.1060 178.4779 65 C 4.7352 8.8542 119.0986 55.8727 41.3563 175.4501 66 K 3.7976 8.7748 121.5958 59.4619 31.6253 178.2345 67 N 4.5093 8.0226 113.5982 53.2043 37.7236 175.7110 68 G 3.9898 8.0246 108.0289 45.5030 0.0000 174.2845 69 Q 4.2253 8.9322 119.4219 56.3392 29.2226 176.3871 70 T 4.5932 8.3372 108.4750 61.6322 69.1301 174.0981 71 N 5.1645 8.0192 118.1700 53.7274 38.4953 174.4336 72 C 5.4016 7.4809 116.6949 56.7903 43.5646 172.6546 73 Y 5.0804 8.9625 118.5879 56.4573 42.4134 173.8654 74 Q 5.0373 9.1132 124.8836 53.9426 31.3719 174.6803 75 S 4.0373 8.8948 122.2210 59.0080 62.3587 174.0128 76 Y 4.5104 8.6927 124.6119 60.5209 37.9911 176.0115 77 S 5.0536 7.8402 112.3986 56.3545 65.0564 173.9320 78 T 4.2253 8.2662 113.4042 61.8602 69.8942 173.5272 79 M 5.0671 9.0252 121.5087 53.4274 37.0008 174.5868 80 S 4.9469 9.3660 117.2630 58.3744 63.7316 173.1425 81 I 5.1507 9.1938 119.9420 59.7178 41.9162 174.1860 82 T 4.9740 8.7778 118.5947 62.0582 72.4327 172.6579 83 D 4.8664 9.2616 127.4531 53.3526 43.2630 174.2267 84 C 5.6506 9.2975 123.4965 55.3730 38.7998 173.1822 85 R 5.4415 8.8541 121.8071 54.0855 33.9510 174.7245 86 E 4.0968 8.9800 123.2299 57.1877 30.8234 176.9835 87 T 4.3257 8.5341 114.3947 60.0062 71.0860 176.0875 88 G 3.6326 8.7013 110.2217 48.2393 0.0000 174.5191 89 S 4.5140 7.4730 113.4639 58.3798 62.8942 173.7073 90 S 4.3326 7.6693 116.2972 57.1717 62.9505 173.9347 91 K 4.1872 8.5739 127.5520 55.5835 33.8039 174.0115 92 Y 4.3650 8.6925 128.3197 57.7013 39.0231 174.8347 93 P 3.2555 0.0000 0.0000 63.0431 32.2624 176.9439 94 N 4.6619 7.9810 120.1448 52.1509 37.0024 173.8208 95 C 4.5725 7.8004 116.5749 56.8885 42.4382 173.5219 96 A 4.9792 8.6914 124.4024 50.6359 22.0216 174.7258 97 Y 5.1737 9.5425 120.0167 55.9835 42.0114 175.0991 98 K 4.4980 9.4094 124.0681 55.8200 34.2177 175.3151 99 T 5.0338 8.5615 123.4485 62.3224 70.4285 173.9804 100 T 4.5115 8.7898 123.5817 61.7356 71.3208 173.1150 101 Q 4.8267 8.6615 127.8355 55.6378 30.4926 174.3288 102 A 4.5244 8.6530 125.2528 51.5048 23.6836 174.9413 103 N 5.4551 8.7743 116.2324 51.7871 40.6841 174.3152 104 K 4.7632 8.8928 122.4177 54.6813 37.7266 175.6055 105 H 4.7054 8.6762 118.4385 56.0588 30.0666 174.8093 106 I 4.4389 8.3215 122.5468 59.8841 39.9503 174.6893 107 I 4.9138 7.7386 125.3208 59.7128 40.2478 175.0233 108 V 4.7773 8.5160 119.4771 59.3131 36.1811 174.5360 109 A 5.0306 8.8373 124.9043 51.1413 20.5813 175.8078 110 C 5.0924 8.4945 118.7439 55.3195 38.2247 172.9850 111 E 4.6224 8.5830 120.0096 56.8377 33.7278 176.1066 112 G 4.0691 9.3259 111.0677 44.6439 0.0000 171.5311 113 N 5.0472 8.2381 116.4278 50.7740 40.7163 172.5697 114 P 4.3072 0.0000 0.0000 62.9884 31.8386 175.9127 115 Y 4.9864 8.2529 121.3725 56.7875 38.5100 174.4204 116 V 4.3992 7.9330 119.1732 58.0788 36.5374 173.4193 117 P 4.3801 0.0000 0.0000 63.0469 31.0019 177.0214 118 V 4.4976 8.6132 115.5250 61.0723 33.9203 175.1621 119 H 5.0817 7.8890 119.5228 54.7308 33.4432 171.7601 120 W 4.7655 8.7652 135.0000 56.7499 30.7813 174.9222 121 D 4.4796 8.3009 127.6987 55.7110 41.5971 175.6276 122 A 4.4963 6.1561 117.0256 51.7788 22.6743 174.4585 123 S 4.9587 8.7157 111.1472 56.9566 66.4650 174.5499 124 V 4.1087 8.9297 120.7397 63.3407 31.3004 174.7832 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 1.78 0.00 1.77 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 1.33 1.39 7.81 2 E 8.37 3.97 0.00 2.13 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 2.45 2.37 0.00 3 T 8.68 4.14 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 1.22 0.00 0.00 4 A 8.51 4.00 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 8.00 4.15 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 8.16 4.29 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 7 K 8.31 4.25 0.00 2.01 2.04 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.31 7.81 8 F 8.41 4.06 0.00 3.24 3.25 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 0.00 9 E 8.45 4.06 0.00 2.35 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 2.64 0.00 10 R 7.83 3.93 0.00 1.81 2.07 0.00 3.39 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 8.00 3.92 0.00 1.49 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.46 0.00 0.00 0.00 0.00 0.00 2.23 2.48 0.00 12 H 7.88 4.70 0.00 2.05 2.68 0.00 5.60 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 8.05 4.71 0.00 1.98 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 2.70 2.73 0.00 14 D 8.88 4.79 0.00 2.64 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 15 S 8.39 4.58 0.00 3.94 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 7.82 4.39 0.00 4.02 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 17 T 7.43 4.72 4.30 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 1.23 0.00 0.00 18 S 8.68 4.17 0.00 3.98 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 19 A 6.96 3.82 1.17 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 20 A 8.16 3.53 0.70 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 21 S 8.46 4.64 0.00 3.84 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 22 S 7.39 4.68 0.00 3.82 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 23 S 8.67 4.31 0.00 4.05 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 24 N 8.63 4.74 0.00 2.75 2.88 0.00 0.00 6.43 7.38 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 25 Y 8.08 4.00 0.00 3.04 3.02 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 26 C 8.40 4.22 0.00 3.16 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 27 N 8.20 4.39 0.00 2.92 2.91 0.00 0.00 6.75 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 7.92 3.84 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.43 0.00 29 M 7.68 3.71 0.00 0.80 1.26 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.38 0.00 30 M 8.19 4.03 0.00 1.64 1.81 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.34 0.00 31 K 7.65 3.93 0.00 1.94 1.91 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.44 7.81 32 S 8.20 4.16 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 33 R 7.79 4.36 0.00 1.97 2.03 0.00 3.63 0.00 0.00 3.19 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.02 0.00 34 N 7.96 4.24 0.00 2.88 2.89 0.00 0.00 6.80 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 35 L 8.29 4.68 0.00 1.74 1.60 0.80 0.46 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 7.52 5.41 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 1.44 0.00 0.00 37 K 8.30 4.08 0.00 1.79 1.92 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.82 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.48 1.43 7.81 38 D 7.79 4.82 0.00 2.56 2.51 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 39 R 6.78 3.64 0.00 1.77 1.69 0.00 2.87 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.38 0.00 40 C 8.74 4.95 0.00 3.11 3.17 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 41 K 8.58 4.16 0.00 1.88 1.77 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.42 7.81 42 P 0.00 4.73 0.00 2.14 2.10 0.00 3.90 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.94 0.00 43 V 7.49 5.06 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 0.78 0.00 0.00 0.97 0.00 0.00 44 N 8.87 4.50 0.00 2.54 2.23 0.00 0.00 6.90 6.82 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 45 T 7.63 4.72 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 0.77 0.00 0.00 46 F 8.77 4.82 0.00 2.93 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 47 V 9.06 4.50 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 1.10 0.00 0.00 1.16 0.00 0.00 48 H 8.85 5.82 0.00 3.10 3.45 0.00 5.83 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 7.73 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 2.28 2.30 0.00 50 S 8.46 4.35 0.00 4.07 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 51 L 8.55 4.00 0.00 1.83 1.75 1.02 1.19 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 52 A 8.03 4.17 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 7.97 4.31 0.00 2.89 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 7.85 3.81 2.33 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 1.27 0.00 0.00 1.07 0.00 0.00 55 Q 8.62 3.92 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 56 A 8.26 4.04 1.39 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 0.00 0.00 0.00 57 V 7.56 3.46 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 1.05 0.00 0.00 0.95 0.00 0.00 58 C 7.80 3.79 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 7.49 4.66 0.00 3.92 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 60 Q 7.45 4.12 0.00 1.81 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.93 0.00 0.00 0.00 0.00 0.00 1.72 2.17 0.00 61 K 7.86 4.23 0.00 2.16 1.87 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.44 7.81 62 N 8.74 4.20 0.00 2.56 2.58 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 8.40 4.58 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 0.66 0.00 0.00 0.81 0.00 0.00 64 A 8.45 4.25 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 8.85 4.74 0.00 3.16 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 8.77 3.80 0.00 1.77 1.88 0.00 1.69 0.00 0.00 1.97 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.36 7.81 67 N 8.02 4.51 0.00 2.82 2.93 0.00 0.00 6.31 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 8.02 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 8.93 4.23 0.00 2.20 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 70 T 8.34 4.59 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 8.02 5.16 0.00 3.14 3.17 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 7.48 5.40 0.00 3.18 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 8.96 5.08 0.00 2.79 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 9.11 5.04 0.00 2.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.95 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 75 S 8.89 4.04 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 76 Y 8.69 4.51 0.00 3.05 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 77 S 7.84 5.05 0.00 3.94 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 78 T 8.27 4.23 4.16 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 1.00 0.00 0.00 79 M 9.03 5.07 0.00 1.96 2.02 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 2.50 0.00 80 S 9.37 4.95 0.00 3.92 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 81 I 9.19 5.15 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.85 1.15 0.00 0.00 82 T 8.78 4.97 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 1.17 0.00 0.00 83 D 9.26 4.87 0.00 2.79 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 9.30 5.65 0.00 2.88 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 85 R 8.85 5.44 0.00 1.81 1.81 0.00 3.42 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 86 E 8.98 4.10 0.00 1.85 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.98 0.00 87 T 8.53 4.33 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 1.23 0.00 0.00 88 G 8.70 3.63 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 0.00 89 S 7.47 4.51 0.00 3.89 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 90 S 7.67 4.33 0.00 3.84 3.71 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 91 K 8.57 4.19 0.00 1.85 1.61 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.35 1.42 7.81 92 Y 8.69 4.36 0.00 3.01 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 93 P 0.00 3.26 0.00 1.75 0.98 0.00 3.63 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 94 N 7.98 4.66 0.00 2.89 2.76 0.00 0.00 7.00 7.76 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 95 C 7.80 4.57 0.00 3.12 3.05 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 96 A 8.69 4.98 1.12 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 0.00 0.00 97 Y 9.54 5.17 0.00 2.90 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 98 K 9.41 4.50 0.00 1.83 1.85 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.45 7.81 99 T 8.56 5.03 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 1.31 0.00 0.00 100 T 8.79 4.51 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 8.66 4.83 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 102 A 8.65 4.52 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 0.00 103 N 8.77 5.46 0.00 2.56 2.76 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 8.89 4.76 0.00 1.78 1.65 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.61 7.81 105 H 8.68 4.71 0.00 3.08 3.21 0.00 5.60 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.32 4.44 1.87 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 0.85 0.56 0.00 0.00 107 I 7.74 4.91 1.67 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.56 0.80 0.00 0.00 108 V 8.52 4.78 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 0.76 0.00 0.00 0.80 0.00 0.00 109 A 8.84 5.03 1.25 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 0.00 0.00 0.00 110 C 8.49 5.09 0.00 1.83 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 0.00 0.00 0.00 111 E 8.58 4.62 0.00 1.99 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 2.15 2.25 0.00 112 G 9.33 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 0.00 113 N 8.24 5.05 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 4.31 0.00 2.22 2.05 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 1.99 1.96 0.00 115 Y 8.25 4.99 0.00 2.85 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 0.00 116 V 7.93 4.40 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 0.67 0.00 0.00 0.83 0.00 0.00 117 P 0.00 4.38 0.00 0.49 1.00 0.00 3.33 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 118 V 8.61 4.50 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 0.63 0.00 0.00 0.91 0.00 0.00 119 H 7.89 5.08 0.00 3.21 3.13 0.00 5.66 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 W 8.77 4.77 0.00 3.10 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 0.00 121 D 8.30 4.48 0.00 2.58 2.50 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 0.00 122 A 6.16 4.50 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 0.00 123 S 8.72 4.96 0.00 4.08 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 0.00 124 V 8.93 4.11 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 0.76 0.00 0.00 0.91 0.00 0.00