NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7094 8.4093 119.2155 53.2939 40.1597 173.4272 4 Q 4.5683 8.4133 119.8374 55.6926 30.2015 173.3089 5 Y 4.8609 9.2807 119.0003 56.8391 40.7096 175.3110 6 Y 5.5415 8.1297 123.5905 55.1771 41.5406 174.7786 7 G 4.3101 7.1922 109.9866 44.8333 0.0000 171.4863 8 T 4.5438 7.9635 120.0141 61.8176 69.5954 174.8261 9 G 4.0219 8.5459 114.5404 45.7617 0.0000 172.6654 10 R 5.2097 8.1281 116.0509 56.6240 32.6284 174.3292 11 R 4.2400 8.7049 127.4965 55.9551 32.9272 174.6704 12 K 3.6010 9.3827 128.3262 57.8651 30.8845 175.2362 13 S 3.6930 7.8017 113.5765 58.6711 60.5284 169.3373 14 S 5.4793 7.4728 117.2508 57.7215 68.3027 173.9784 15 A 5.3385 8.7363 120.4361 49.5441 22.8033 175.6293 16 A 5.9400 8.1148 120.1927 50.5676 20.6892 174.0126 17 R 4.4396 8.3128 119.3792 56.2718 31.7106 175.7123 18 V 4.6541 8.3235 123.0342 61.0246 33.8038 173.2967 19 F 5.3105 9.1147 127.2195 56.3714 40.4288 174.6967 20 I 4.9878 9.0341 124.2629 59.2792 41.0936 174.2977 21 K 5.0355 9.6971 127.1517 54.1904 37.2279 173.6573 22 P 4.6827 0.0000 0.0000 61.3174 32.7816 176.5679 23 G 3.9719 7.3205 110.0457 45.1564 0.0000 173.2269 24 N 4.2117 8.4262 124.4126 52.8602 38.0859 175.8919 25 G 4.8643 8.6192 114.1887 45.1258 0.0000 170.9285 26 K 4.8368 7.6978 120.3035 55.1507 36.2541 177.1667 27 I 3.8638 8.3696 124.4678 61.2342 38.4797 175.4731 28 V 4.2445 8.5496 126.6372 61.0390 31.0162 173.3490 29 I 4.4040 8.6957 123.0771 59.3184 38.3887 173.8013 30 N 4.2443 9.1463 129.4713 55.1423 35.8305 174.6622 31 Q 3.5218 7.8376 110.7354 56.6442 28.5456 174.9559 32 R 4.4899 7.3183 115.1929 55.3275 33.8092 176.3193 33 S 5.1712 8.3542 116.3590 57.2691 63.9666 174.1127 34 L 3.8616 8.4366 120.8801 58.7495 41.8470 179.0560 35 E 4.0102 8.2195 116.3906 58.5130 29.9910 178.4702 36 Q 4.1983 7.4436 118.2160 58.6685 28.7032 178.1915 37 Y 4.9712 8.3364 110.1993 56.3742 40.0009 175.4177 38 F 4.3432 7.8069 117.2845 56.8410 39.6602 175.9174 39 G 3.6085 8.0424 110.2298 46.0982 0.0000 172.7917 40 R 3.7842 8.2418 126.6575 56.3163 27.7190 175.8739 41 E 3.9733 8.3382 120.2315 57.1355 28.9835 177.3090 42 T 4.2524 8.6115 121.2343 65.4638 70.7309 174.8854 43 A 4.5775 7.2646 120.2006 51.5160 21.9071 175.6973 44 R 4.6159 8.2184 116.5820 56.0140 32.7849 176.8165 45 M 4.3353 8.2036 116.9137 58.3276 32.2569 178.4456 46 V 3.5360 7.9200 111.4738 64.2711 31.6440 177.3949 47 V 4.0539 7.9709 110.3423 61.7711 32.1589 177.2322 48 R 4.2683 7.8338 118.7789 58.8414 31.1497 178.6944 49 Q 3.9431 8.6189 117.4103 59.0888 28.5498 178.0716 50 P 4.0482 0.0000 0.0000 65.8107 31.6936 177.3944 51 L 4.6427 7.8346 115.1824 54.7844 41.5942 178.6720 52 E 4.1617 8.2802 120.3641 58.5689 29.4791 178.1524 53 L 4.1220 7.2557 120.2614 57.8937 42.1407 178.3108 54 V 4.2265 7.9497 107.3849 60.6260 34.7862 169.8593 55 D 4.5286 8.2161 128.5565 53.8886 40.3551 172.3560 56 M 4.7625 8.1196 127.2456 54.6939 32.8100 176.1356 57 V 3.5246 8.5953 113.0671 62.6095 30.3040 173.8371 58 E 5.3684 7.3507 123.4583 57.0256 31.5940 177.7933 59 K 4.0637 7.6711 121.1017 58.4836 32.6217 175.7782 60 L 5.0766 7.4223 116.9945 53.8753 44.1319 175.6183 61 D 5.5348 8.8994 120.7872 53.3219 40.8956 175.5615 62 L 4.4845 8.3870 117.6352 54.1119 45.2917 175.0432 63 Y 4.8595 9.0632 127.4738 55.9965 39.6593 174.2230 64 I 5.1241 8.5370 126.8400 59.8808 40.7613 174.9332 65 T 5.5520 9.3736 120.6978 61.7402 73.2350 173.6179 66 V 5.3499 8.5296 124.9343 59.7492 33.7272 174.0490 67 K 4.5019 8.7002 126.8101 55.2223 35.5586 172.6236 68 G 4.2740 8.6247 120.5022 45.7033 0.0000 169.7590 69 G 4.4240 7.7316 109.4932 43.6590 0.0000 176.2855 70 G 3.8325 9.4229 113.3407 46.6495 0.0000 176.2519 71 I 2.4983 7.7206 117.0634 61.3241 41.6025 176.5979 72 S 4.1247 8.5125 119.0399 61.1316 63.4418 176.4517 73 G 3.7123 8.4659 108.2511 47.4695 0.0000 175.8242 74 Q 4.0017 7.9947 119.7977 58.9396 28.8549 177.6950 75 A 4.1675 8.4990 122.2369 55.4574 18.2540 179.8937 76 G 3.8063 8.0134 103.0525 48.0223 0.0000 175.6144 77 A 3.9252 7.5398 123.4438 55.0757 18.2429 179.4034 78 I 3.9719 8.4187 118.5238 64.1910 37.1882 178.1583 79 R 3.7531 9.0238 120.2915 60.4673 29.8151 177.3873 80 H 4.1912 9.1290 118.4148 59.3989 29.4595 176.8054 81 G 3.8233 9.1420 108.8860 48.1741 0.0000 175.1555 82 I 3.8436 8.4196 122.5094 64.4536 37.1096 178.6073 83 T 3.8875 7.8938 113.5632 64.7501 67.1665 175.7711 84 R 4.1123 8.7462 119.3267 57.1783 29.9496 177.1355 85 A 5.3709 7.7984 119.7299 51.0636 20.4345 176.4232 86 L 5.0012 7.3723 117.3202 52.3983 41.6167 176.2620 87 M 4.9498 8.5861 111.4339 56.4125 35.7808 176.5879 88 E 4.2123 8.4442 120.4719 59.3527 30.3618 177.7731 89 Y 4.2166 8.7123 118.7438 60.1019 39.0542 175.5543 90 D 4.9240 8.0757 117.6746 52.5759 44.1464 174.8809 91 E 4.6780 8.9757 125.5779 56.3902 29.8570 176.0255 92 S 4.7378 8.9186 111.1395 58.8010 63.4522 175.6510 93 L 4.1842 7.7826 122.6920 57.7951 41.4145 178.2296 94 R 3.8357 8.2194 117.6447 59.9007 29.7990 178.2074 95 S 4.1850 8.1128 112.7568 62.0626 62.6417 176.1788 96 E 4.1649 7.9414 119.5234 57.6589 29.5368 177.2805 97 L 4.6569 8.2692 117.7483 54.3463 44.2005 178.9657 98 R 3.8580 7.9815 118.4320 59.1202 29.8637 178.7922 99 K 3.8964 7.5751 116.8314 59.9169 32.4864 178.6785 100 A 3.8259 7.0263 118.6716 52.4463 19.2125 177.1377 101 G 3.4738 8.1837 103.7188 46.8441 0.0000 173.6770 102 F 5.2180 7.6080 112.7983 57.0673 41.4823 176.8540 103 V 3.9848 7.9157 112.4007 61.6251 31.8223 175.5758 104 T 4.3847 7.6518 117.6453 61.6572 69.2327 174.7357 105 R 3.9151 8.4770 128.1259 54.9988 28.7597 174.9565 106 D 4.3720 8.3640 123.9831 53.6728 38.5547 177.2397 107 A 4.3653 8.1091 135.0000 51.8873 18.1971 179.9374 108 R 4.3171 7.3238 122.6304 54.8919 29.2501 176.7846 109 Q 4.2929 7.6031 120.9142 54.6439 30.5705 175.4277 110 V 3.8411 8.0502 115.6092 61.3922 32.3053 174.9410 111 E 4.5267 8.2791 121.7404 54.2698 30.6952 175.6283 112 R 4.0054 8.4123 122.8868 55.4843 30.1292 176.3289 113 K 3.9043 8.6942 123.4427 56.7605 32.7491 175.5409 114 K 4.5135 8.4863 125.3240 54.0251 33.7713 175.9039 115 V 3.5892 8.4018 123.0565 63.8209 31.1904 176.5580 116 G 3.9713 9.3064 111.8652 44.9367 0.0000 172.7329 117 L 4.7795 7.9300 120.0224 52.4604 44.4472 177.7963 118 R 3.9257 8.4174 122.9966 58.4683 30.4831 176.7010 119 K 4.2054 8.0240 111.9248 56.9787 34.3974 173.6296 120 A 3.9092 8.8209 130.1092 52.6144 17.2144 178.1974 121 R 4.3774 7.5961 110.7531 57.0178 33.2646 174.4428 122 R 3.9616 7.7258 119.9659 56.2051 29.2877 174.4883 123 R 4.2910 8.0366 122.8521 54.9243 30.9813 174.6245 124 P 4.5801 0.0000 0.0000 62.0625 32.3328 175.8056 125 Q 4.6973 8.2528 119.1165 55.6615 30.8407 176.1817 126 F 4.9782 8.2280 111.0074 55.9124 37.4494 173.1233 127 S 3.9848 7.7792 116.4997 59.3799 63.9084 174.5845 128 K 3.8679 9.0638 117.3768 56.6280 30.3985 175.1798 129 R 4.0821 7.2682 121.0737 56.5398 30.5498 175.9872 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 3 N 8.41 4.71 0.00 2.73 2.87 0.00 0.00 7.03 6.19 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 4 Q 8.41 4.57 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.59 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 5 Y 9.28 4.86 0.00 3.09 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 6 Y 8.13 5.54 0.00 3.09 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 7 G 7.19 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 0.00 0.00 0.00 0.00 8 T 7.96 4.54 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 1.25 0.00 0.00 9 G 8.55 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 10 R 8.13 5.21 0.00 1.77 1.75 0.00 3.07 0.00 0.00 3.82 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.59 0.00 11 R 8.70 4.24 0.00 1.71 1.83 0.00 3.49 0.00 0.00 3.54 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.80 0.00 12 K 9.38 3.60 0.00 1.89 1.80 0.00 1.98 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.40 7.81 13 S 7.80 3.69 0.00 4.06 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 14 S 7.47 5.48 0.00 3.91 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 15 A 8.74 5.34 1.27 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 0.00 0.00 0.00 16 A 8.11 5.94 1.21 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 0.00 0.00 0.00 17 R 8.31 4.44 0.00 1.71 1.42 0.00 3.07 0.00 0.00 3.09 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 18 V 8.32 4.65 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 1.00 0.00 0.00 0.89 0.00 0.00 19 F 9.11 5.31 0.00 2.86 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 20 I 9.03 4.99 1.99 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.42 1.04 0.00 0.00 21 K 9.70 5.04 0.00 1.85 1.65 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.42 1.49 7.81 22 P 0.00 4.68 0.00 2.19 2.09 0.00 3.87 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 23 G 7.32 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 24 N 8.43 4.21 0.00 2.78 3.01 0.00 0.00 5.88 6.92 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 25 G 8.62 4.86 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 0.00 26 K 7.70 4.84 0.00 1.71 1.75 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.43 7.81 27 I 8.37 3.86 1.88 0.00 0.00 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 1.23 1.17 0.91 0.00 0.00 28 V 8.55 4.24 1.80 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 0.59 0.00 0.00 0.86 0.00 0.00 29 I 8.70 4.40 1.81 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.13 0.99 0.00 0.00 30 N 9.15 4.24 0.00 2.90 2.78 0.00 0.00 6.76 7.20 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 31 Q 7.84 3.52 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.92 6.69 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 32 R 7.32 4.49 0.00 1.73 1.68 0.00 3.08 0.00 0.00 2.88 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.80 0.00 33 S 8.35 5.17 0.00 4.01 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 34 L 8.44 3.86 0.00 1.76 1.72 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.22 4.01 0.00 2.04 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 0.00 2.34 2.36 0.00 36 Q 7.44 4.20 0.00 2.22 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 37 Y 8.34 4.97 0.00 3.16 2.96 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 38 F 7.81 4.34 0.00 2.45 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 39 G 8.04 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 R 8.24 3.78 0.00 1.97 1.96 0.00 3.20 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 41 E 8.34 3.97 0.00 1.74 1.59 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 2.02 2.26 0.00 42 T 8.61 4.25 4.18 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 1.18 0.00 0.00 43 A 7.26 4.58 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 44 R 8.22 4.62 0.00 1.77 1.82 0.00 3.23 0.00 0.00 3.52 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.79 0.00 45 M 8.20 4.34 0.00 2.17 2.12 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 2.70 2.65 0.00 46 V 7.92 3.54 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 0.68 0.00 0.00 0.99 0.00 0.00 47 V 7.97 4.05 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 0.69 0.00 0.00 1.00 0.00 0.00 48 R 7.83 4.27 0.00 1.82 1.95 0.00 3.32 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.58 0.00 49 Q 8.62 3.94 0.00 1.88 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 6.59 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 50 P 0.00 4.05 0.00 2.10 1.98 0.00 3.40 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 1.96 1.78 0.00 51 L 7.83 4.64 0.00 1.76 1.66 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.28 4.16 0.00 2.04 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 2.51 2.45 0.00 53 L 7.26 4.12 0.00 1.54 1.72 0.92 0.94 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 54 V 7.95 4.23 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 0.64 0.00 0.00 0.90 0.00 0.00 55 D 8.22 4.53 0.00 2.79 2.72 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 0.00 0.00 0.00 56 M 8.12 4.76 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.64 0.00 57 V 8.60 3.52 2.08 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 1.00 0.00 0.00 0.93 0.00 0.00 58 E 7.35 5.37 0.00 2.08 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 0.00 2.30 2.02 0.00 59 K 7.67 4.06 0.00 1.79 1.83 0.00 1.61 0.00 0.00 1.81 0.00 0.00 3.27 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.39 7.81 60 L 7.42 5.08 0.00 1.97 1.68 0.93 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.90 5.53 0.00 2.72 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 62 L 8.39 4.48 0.00 1.76 1.62 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 9.06 4.86 0.00 3.17 3.18 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 64 I 8.54 5.12 1.89 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 1.23 0.43 0.90 0.00 0.00 65 T 9.37 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 1.36 0.00 0.00 66 V 8.53 5.35 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 0.62 0.00 0.00 1.14 0.00 0.00 67 K 8.70 4.50 0.00 1.89 1.68 0.00 1.69 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.49 7.81 68 G 8.62 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 0.00 0.00 0.00 0.00 69 G 7.73 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 0.00 0.00 0.00 0.00 70 G 9.42 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 0.00 0.00 0.00 71 I 7.72 2.50 1.62 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.75 0.27 0.00 0.00 72 S 8.51 4.12 0.00 3.85 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 73 G 8.47 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 0.00 0.00 0.00 74 Q 7.99 4.00 0.00 2.59 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.53 2.63 0.00 75 A 8.50 4.17 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 76 G 8.01 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 0.00 0.00 0.00 77 A 7.54 3.93 1.43 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 0.00 0.00 0.00 78 I 8.42 3.97 2.05 0.00 0.00 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 1.38 1.12 0.88 0.00 0.00 79 R 9.02 3.75 0.00 1.79 2.04 0.00 2.21 0.00 0.00 2.75 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.08 0.00 80 H 9.13 4.19 0.00 3.35 3.45 0.00 5.87 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 G 9.14 3.82 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 0.00 0.00 0.00 82 I 8.42 3.84 1.91 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 1.39 0.75 0.90 0.00 0.00 83 T 7.89 3.89 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 1.39 0.00 0.00 84 R 8.75 4.11 0.00 1.78 1.77 0.00 3.30 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.54 0.00 85 A 7.80 5.37 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 86 L 7.37 5.00 0.00 1.53 1.57 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 87 M 8.59 4.95 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.63 0.00 88 E 8.44 4.21 0.00 2.10 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 0.00 2.27 2.35 0.00 89 Y 8.71 4.22 0.00 3.01 2.97 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 90 D 8.08 4.92 0.00 2.78 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 E 8.98 4.68 0.00 1.98 1.95 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 2.25 2.36 0.00 92 S 8.92 4.74 0.00 3.96 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 93 L 7.78 4.18 0.00 1.71 1.77 0.91 0.97 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 94 R 8.22 3.84 0.00 1.82 1.96 0.00 3.32 0.00 0.00 3.40 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 95 S 8.11 4.19 0.00 4.03 4.15 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 96 E 7.94 4.16 0.00 2.01 2.04 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 2.48 2.49 0.00 97 L 8.27 4.66 0.00 1.76 1.69 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.98 3.86 0.00 1.94 1.95 0.00 3.12 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 99 K 7.58 3.90 0.00 1.80 1.91 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.39 7.81 100 A 7.03 3.83 1.06 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 0.00 0.00 101 G 8.18 3.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 F 7.61 5.22 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 0.00 103 V 7.92 3.98 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 0.73 0.00 0.00 0.94 0.00 0.00 104 T 7.65 4.38 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 0.00 105 R 8.48 3.92 0.00 1.73 1.85 0.00 3.37 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.49 0.00 106 D 8.36 4.37 0.00 2.81 2.74 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 0.00 107 A 8.11 4.37 1.27 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 0.00 0.00 0.00 108 R 7.32 4.32 0.00 1.81 1.90 0.00 3.21 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 109 Q 7.60 4.29 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 7.02 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 110 V 8.05 3.84 2.08 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 0.73 0.00 0.00 0.93 0.00 0.00 111 E 8.28 4.53 0.00 1.90 1.83 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 2.22 2.34 0.00 112 R 8.41 4.01 0.00 1.96 1.93 0.00 3.10 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 113 K 8.69 3.90 0.00 1.73 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.48 7.81 114 K 8.49 4.51 0.00 1.83 1.69 0.00 1.98 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.65 7.81 115 V 8.40 3.59 2.08 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 0.69 0.00 0.00 0.93 0.00 0.00 116 G 9.31 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 0.00 117 L 7.93 4.78 0.00 1.81 1.53 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.42 3.93 0.00 1.93 2.02 0.00 3.24 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.60 0.00 119 K 8.02 4.21 0.00 1.97 1.93 0.00 1.44 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.17 1.19 7.81 120 A 8.82 3.91 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 0.00 121 R 7.60 4.38 0.00 1.76 1.93 0.00 3.41 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 122 R 7.73 3.96 0.00 1.92 1.99 0.00 3.15 0.00 0.00 3.10 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 123 R 8.04 4.29 0.00 1.78 1.81 0.00 3.25 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.71 0.00 124 P 0.00 4.58 0.00 2.11 2.00 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 125 Q 8.25 4.70 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.43 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 126 F 8.23 4.98 0.00 3.13 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 0.00 127 S 7.78 3.98 0.00 3.95 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 0.00 128 K 9.06 3.87 0.00 1.86 1.89 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.49 7.81 129 R 7.27 4.08 0.00 2.03 1.90 0.00 3.37 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.66 0.00