NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3901 8.3044 120.3244 54.7112 33.4043 174.5160 2 K 3.9650 8.3702 122.6861 55.6722 32.8048 175.6128 3 K 4.0460 9.5369 127.5990 58.9572 33.1946 176.0894 4 H 4.8974 7.9642 112.9063 54.3289 31.8648 173.6326 5 G 3.8951 8.5427 107.5511 45.1847 0.0000 172.8869 6 I 3.8278 7.8535 118.1266 60.7856 38.5112 175.9964 7 L 4.0516 8.4581 128.5336 57.7436 42.4822 177.5777 8 N 4.4151 8.0728 118.0250 53.2964 39.6949 175.3484 9 S 4.0900 8.6415 123.6117 61.9278 62.6430 176.2144 10 H 4.2429 8.0027 119.3050 58.6817 28.4755 177.6902 11 L 4.0825 8.5971 120.7302 57.5880 41.4168 179.2767 12 A 3.9980 8.2548 120.9625 55.1939 18.0392 179.8824 13 K 3.9891 7.6723 116.2444 59.5885 32.1684 179.4267 14 I 3.9156 7.4398 119.1860 64.3419 37.0925 178.4972 15 L 4.0046 8.3135 119.9343 57.6491 41.1855 179.3231 16 A 4.0674 7.8937 120.0595 54.7315 18.3744 178.4074 17 D 4.6638 7.5146 114.3931 53.3806 41.6701 176.9502 18 L 4.2316 7.3964 121.2859 54.6586 42.3046 176.5621 19 G 4.1909 9.5028 111.6498 42.9940 0.0000 171.6017 20 H 4.4288 8.5793 118.8533 58.1125 29.8054 175.3296 21 T 3.4644 8.8213 116.2518 61.4897 68.4286 171.8354 22 D 4.6152 7.9172 122.5866 54.5768 42.3015 175.3880 23 K 5.2433 8.5643 119.7994 54.6124 36.0867 175.1366 24 I 4.9845 8.4024 115.6627 59.1254 41.3859 174.1666 25 V 4.8872 8.8510 123.5066 61.2915 34.6800 174.1082 26 I 5.0603 8.7973 127.5695 59.6540 39.4491 174.6105 27 A 5.2880 9.4688 128.4950 49.9801 23.2917 175.0758 28 D 5.2031 8.0443 116.1739 52.1253 41.4923 177.2565 29 A 4.1941 8.8829 121.3509 54.0638 18.2500 178.4517 30 G 3.8081 8.1001 103.4590 45.0840 0.0000 174.1035 31 L 3.9998 7.4227 121.8644 54.4404 42.4089 174.9937 32 P 4.4578 0.0000 0.0000 62.4539 32.2441 175.4688 33 V 4.2828 7.9571 119.5437 60.2543 33.2181 173.9700 34 P 4.3944 0.0000 0.0000 62.3801 31.9077 175.5797 35 D 4.5304 8.3723 121.4795 55.9606 41.2174 177.0770 36 G 3.9420 9.0118 111.6086 44.8662 0.0000 173.1827 37 V 4.1992 7.0260 119.3579 61.0077 32.8134 175.5601 38 L 4.0971 8.5741 130.0953 55.1981 43.2741 175.0631 39 K 4.9782 8.6561 127.1077 54.7337 34.3736 174.9520 40 I 4.3200 8.7413 128.9042 59.7010 39.3573 174.2616 41 D 4.9456 8.6849 128.0782 53.2301 41.4627 175.8412 42 L 4.7513 8.7315 125.9944 54.4227 42.6889 177.5873 43 S 4.4340 8.3449 114.5413 58.5012 63.6184 173.1127 44 L 4.5356 8.9314 123.4708 56.1054 43.7432 176.3089 45 K 4.4815 7.5402 114.7627 54.6149 35.1654 172.7629 46 P 3.9497 0.0000 0.0000 64.4525 31.1793 177.2601 47 G 3.8900 9.6561 111.5846 45.1286 0.0000 172.8050 48 L 4.7326 8.1797 122.3738 52.5858 45.0325 173.9672 49 P 4.8894 0.0000 0.0000 62.2139 33.4586 175.5550 50 A 4.5426 8.3893 122.3270 51.5074 19.8436 178.3720 51 F 4.0922 10.0930 122.0028 61.7260 39.4189 177.7217 52 Q 3.2644 8.0298 116.8642 58.9645 28.4143 178.6249 53 D 4.3273 7.8559 119.1693 57.5606 40.9038 178.9044 54 T 3.8164 7.8126 115.8726 66.6170 68.4538 176.6152 55 A 3.9746 7.9533 122.5993 55.0961 18.1054 179.5472 56 A 3.9065 7.8673 118.4147 55.2253 18.7402 179.7818 57 V 3.6864 7.6440 116.2997 66.1447 31.6692 178.2147 58 L 4.0069 7.9356 118.5000 57.8776 41.2632 179.3366 59 A 4.2007 8.0949 119.6609 55.0935 18.3188 178.7569 60 E 4.1404 7.8720 115.9495 57.7168 29.8928 176.7866 61 E 4.5697 7.9977 116.2104 56.1762 31.1311 174.8320 62 M 4.6193 7.9899 118.0321 53.2570 35.1620 174.5917 63 A 4.3465 8.5007 127.3003 51.4809 19.5317 175.9611 64 V 4.6084 8.3766 122.2485 62.3543 32.4810 175.3379 65 E 4.5833 9.1401 125.3952 56.8283 31.8807 175.5043 66 K 4.8274 7.6354 120.2338 55.0174 36.0197 174.4401 67 V 4.7060 8.7833 125.7959 61.0340 34.9160 174.1506 68 I 5.0194 8.6830 127.2162 59.5736 40.5744 174.4480 69 A 4.9029 8.6464 126.6467 49.9678 23.5171 175.0598 70 A 4.6256 7.9809 121.5759 51.5653 19.7052 178.9277 71 A 4.0887 9.3235 124.7747 55.3867 18.4287 180.1564 72 E 3.6229 7.9906 116.3864 59.2843 29.2391 179.2404 73 I 3.6922 7.4958 118.7430 63.8785 37.7383 177.9439 74 K 3.9052 7.7266 118.2270 58.9721 31.8785 178.3587 75 A 4.3100 7.6751 119.0263 53.9999 19.5876 178.7474 76 S 4.4899 7.8810 111.7584 59.3136 64.9108 174.4841 77 N 5.0328 8.1563 119.9543 50.9145 39.2685 174.2820 78 Q 4.0206 8.2119 122.5584 59.0236 29.4697 178.2349 79 E 3.9643 8.2179 119.5134 59.7406 29.6175 178.6510 80 N 4.5873 8.2341 116.1496 56.0998 38.5188 177.3208 81 A 4.1371 8.2592 122.3904 55.1621 18.4728 179.8717 82 K 3.9879 8.4346 117.1265 59.5017 32.0878 179.1812 83 F 4.1333 8.2796 120.7615 61.4160 39.3013 176.8616 84 L 4.0610 8.5426 119.9769 58.3730 41.6713 178.8375 85 E 4.0891 7.9386 117.1966 59.3330 29.4393 178.9300 86 N 4.4052 7.8919 115.6748 56.2039 38.7976 176.8984 87 L 3.6366 7.4270 120.5587 56.9492 41.4935 177.8884 88 F 5.4387 7.9528 117.0885 55.9723 39.1857 177.6952 89 S 4.4637 7.9769 116.7177 61.5075 63.6336 175.8808 90 E 4.0583 8.2744 119.4919 59.3716 29.5707 177.2960 91 Q 4.3433 7.4683 116.7883 55.4283 30.5830 174.8167 92 E 4.5113 8.3168 121.5637 55.8948 30.9527 175.0353 93 I 4.8081 8.3751 127.3016 59.4259 39.7209 174.3447 94 E 4.6630 8.9309 128.1954 54.4814 32.3108 173.8594 95 Y 5.8109 8.6606 123.9612 55.7240 39.9544 174.9122 96 L 5.1049 8.4366 122.8132 52.2699 46.5105 176.2321 97 S 4.5636 8.5514 114.4545 58.3916 63.8390 174.8621 98 H 4.3009 8.9537 121.3747 59.5308 29.3528 177.5767 99 E 3.9756 8.2188 120.0247 59.4798 29.1800 178.8099 100 E 3.9805 7.9174 117.7923 58.9102 29.9554 178.2788 101 F 4.2443 8.3498 120.9257 61.3284 39.4639 177.2033 102 K 3.9317 8.3481 118.1084 59.5596 31.7735 179.3123 103 L 4.0024 7.7470 119.2107 57.7369 41.6055 179.5756 104 L 3.9777 7.6205 118.7955 57.5955 41.6375 179.2048 105 T 3.8867 7.3639 108.7911 63.6824 68.3296 176.5047 106 K 3.9913 7.5907 121.0400 59.0677 32.1240 177.7381 107 D 4.6100 7.6264 115.9077 53.3534 41.4898 176.7144 108 A 4.3272 6.9353 122.8154 52.0298 18.9510 178.1080 109 K 4.2840 8.9459 120.3537 58.6814 32.8589 177.1714 110 A 4.5747 7.3434 118.6823 51.2066 22.5218 175.1123 111 V 4.6860 8.5901 120.3777 61.1989 34.4352 174.5188 112 I 4.7162 9.2419 130.4121 59.9410 38.7413 174.7299 113 R 4.6753 8.9262 129.5045 55.7824 31.3187 175.9647 114 T 4.9346 8.6946 117.2040 60.0703 71.7175 174.3598 115 G 4.1123 8.8429 106.6339 46.1633 0.0000 173.3294 116 E 4.4134 8.2455 122.7410 56.1640 30.6322 177.7443 117 F 4.9459 8.9147 127.4850 57.4760 40.0132 175.3046 118 T 4.6667 7.6730 109.2601 58.5357 71.4494 171.7542 119 P 3.8921 0.0000 0.0000 64.6862 31.4684 175.0782 120 Y 3.3835 7.5457 115.7106 59.1270 35.4190 171.6238 121 A 3.9618 7.3048 120.2488 50.7905 16.6216 176.9485 122 N 5.7281 7.2083 117.7911 51.4298 43.7063 175.1367 123 C 5.2010 9.1484 113.4064 57.7882 33.6518 172.5474 124 I 4.8962 9.2064 122.1369 59.7601 39.5300 174.4627 125 L 4.6140 8.7405 127.4765 53.1366 43.6622 175.1865 126 Q 4.8206 8.7714 126.4613 54.1575 30.5969 174.7071 127 A 4.3283 9.2583 129.6234 52.7902 19.4518 176.9079 128 G 4.2910 8.9741 111.2775 45.0933 0.0000 173.2575 129 V 4.4581 7.9152 119.1745 59.9472 34.3411 175.2894 130 L 4.4443 8.3662 120.5761 55.0537 41.9543 176.9941 131 F 4.4706 7.0876 119.6031 57.2645 37.4658 173.9559 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 M 8.30 4.39 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.37 3.97 0.00 1.79 1.71 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.51 7.81 3 K 9.54 4.05 0.00 1.48 1.54 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.39 7.81 4 H 7.96 4.90 0.00 3.11 3.18 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 G 8.54 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 6 I 7.85 3.83 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.87 0.97 0.00 0.00 7 L 8.46 4.05 0.00 1.63 1.68 0.92 0.97 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 8 N 8.07 4.42 0.00 2.80 2.70 0.00 0.00 6.96 7.63 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 9 S 8.64 4.09 0.00 4.03 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 10 H 8.00 4.24 0.00 3.36 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.60 4.08 0.00 1.70 1.73 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.25 4.00 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 13 K 7.67 3.99 0.00 1.87 1.90 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.73 7.81 14 I 7.44 3.92 2.02 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.92 0.92 0.00 0.00 15 L 8.31 4.00 0.00 1.69 1.73 0.94 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.89 4.07 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 17 D 7.51 4.66 0.00 2.65 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 18 L 7.40 4.23 0.00 1.76 1.62 0.93 0.81 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 19 G 9.50 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 0.00 0.00 0.00 20 H 8.58 4.43 0.00 3.00 3.19 0.00 5.80 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.82 3.46 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 0.94 0.00 0.00 22 D 7.92 4.62 0.00 2.72 2.61 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 23 K 8.56 5.24 0.00 1.60 1.59 0.00 1.54 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.51 7.81 24 I 8.40 4.98 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.72 0.91 0.00 0.00 25 V 8.85 4.89 2.11 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 1.17 0.00 0.00 0.86 0.00 0.00 26 I 8.80 5.06 2.05 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.55 0.95 0.00 0.00 27 A 9.47 5.29 1.28 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 0.00 0.00 0.00 28 D 8.04 5.20 0.00 2.93 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 29 A 8.88 4.19 1.28 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 0.00 0.00 0.00 30 G 8.10 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 31 L 7.42 4.00 0.00 1.72 1.65 1.10 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.46 0.00 2.22 2.03 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 33 V 7.96 4.28 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 0.88 0.00 0.00 0.94 0.00 0.00 34 P 0.00 4.39 0.00 2.19 1.93 0.00 3.64 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 35 D 8.37 4.53 0.00 2.66 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 36 G 9.01 3.94 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 0.00 0.00 0.00 37 V 7.03 4.20 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 0.74 0.00 0.00 0.97 0.00 0.00 38 L 8.57 4.10 0.00 1.81 1.68 0.91 0.51 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 39 K 8.66 4.98 0.00 1.78 1.66 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.44 7.81 40 I 8.74 4.32 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.55 0.94 0.00 0.00 41 D 8.68 4.95 0.00 2.69 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 42 L 8.73 4.75 0.00 1.59 1.70 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 43 S 8.34 4.43 0.00 4.06 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 44 L 8.93 4.54 0.00 1.64 1.66 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.54 4.48 0.00 1.85 1.81 0.00 1.53 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.36 1.38 7.81 46 P 0.00 3.95 0.00 1.59 0.66 0.00 3.51 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.29 0.00 47 G 9.66 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 0.00 0.00 0.00 48 L 8.18 4.73 0.00 1.68 1.47 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.89 0.00 2.16 2.16 0.00 3.78 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 2.10 1.99 0.00 50 A 8.39 4.54 1.30 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 0.00 0.00 51 F 10.09 4.09 0.00 3.14 3.14 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 52 Q 8.03 3.26 0.00 1.75 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 1.16 2.28 0.00 53 D 7.86 4.33 0.00 2.77 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 0.00 54 T 7.81 3.82 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 1.21 0.00 0.00 55 A 7.95 3.97 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 56 A 7.87 3.91 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 57 V 7.64 3.69 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 1.04 0.00 0.00 0.95 0.00 0.00 58 L 7.94 4.01 0.00 1.92 1.77 0.95 0.92 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 59 A 8.09 4.20 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 60 E 7.87 4.14 0.00 2.12 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 0.00 2.30 2.48 0.00 61 E 8.00 4.57 0.00 2.03 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 2.49 2.22 0.00 62 M 7.99 4.62 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 63 A 8.50 4.35 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 64 V 8.38 4.61 2.15 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 0.66 0.00 0.00 1.02 0.00 0.00 65 E 9.14 4.58 0.00 2.04 2.15 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 2.37 2.20 0.00 66 K 7.64 4.83 0.00 1.76 1.55 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.52 7.81 67 V 8.78 4.71 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 0.81 0.00 0.00 0.02 0.00 0.00 68 I 8.68 5.02 1.92 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 1.12 0.47 1.08 0.00 0.00 69 A 8.65 4.90 1.08 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 0.00 0.00 70 A 7.98 4.63 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 71 A 9.32 4.09 1.29 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 0.00 0.00 0.00 72 E 7.99 3.62 0.00 1.16 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 1.81 2.09 0.00 73 I 7.50 3.69 1.95 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 1.53 1.39 1.08 0.00 0.00 74 K 7.73 3.91 0.00 1.64 1.73 0.00 1.33 0.00 0.00 1.40 0.00 0.00 2.23 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.13 7.81 75 A 7.68 4.31 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 76 S 7.88 4.49 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 77 N 8.16 5.03 0.00 2.82 2.71 0.00 0.00 7.01 6.43 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 78 Q 8.21 4.02 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.64 0.00 0.00 0.00 0.00 0.00 2.67 2.43 0.00 79 E 8.22 3.96 0.00 2.06 1.98 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 2.43 2.46 0.00 80 N 8.23 4.59 0.00 2.86 2.88 0.00 0.00 6.99 7.22 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 81 A 8.26 4.14 1.51 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 82 K 8.43 3.99 0.00 2.09 1.95 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.61 7.81 83 F 8.28 4.13 0.00 3.26 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.54 4.06 0.00 2.29 1.97 1.41 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 85 E 7.94 4.09 0.00 2.20 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 2.65 2.59 0.00 86 N 7.89 4.41 0.00 2.68 2.75 0.00 0.00 6.99 7.78 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 87 L 7.43 3.64 0.00 0.54 0.91 0.51 0.25 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 88 F 7.95 5.44 0.00 3.31 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 89 S 7.98 4.46 0.00 3.98 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 90 E 8.27 4.06 0.00 2.02 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 0.00 2.32 2.33 0.00 91 Q 7.47 4.34 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 92 E 8.32 4.51 0.00 2.18 1.79 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 2.25 2.28 0.00 93 I 8.38 4.81 1.90 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 1.20 0.80 0.49 0.00 0.00 94 E 8.93 4.66 0.00 1.96 1.69 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 2.19 2.26 0.00 95 Y 8.66 5.81 0.00 2.86 2.87 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 96 L 8.44 5.10 0.00 1.69 1.61 0.97 0.99 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 97 S 8.55 4.56 0.00 4.03 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 98 H 8.95 4.30 0.00 3.48 3.51 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 E 8.22 3.98 0.00 2.06 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 0.00 2.46 2.35 0.00 100 E 7.92 3.98 0.00 1.99 2.18 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 2.35 2.33 0.00 101 F 8.35 4.24 0.00 3.31 3.20 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 0.00 102 K 8.35 3.93 0.00 2.00 1.84 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.52 1.57 7.81 103 L 7.75 4.00 0.00 1.77 1.69 0.92 0.71 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 0.00 104 L 7.62 3.98 0.00 1.64 1.45 0.86 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 105 T 7.36 3.89 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 0.91 0.00 0.00 106 K 7.59 3.99 0.00 1.73 1.88 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.62 7.81 107 D 7.63 4.61 0.00 2.62 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 A 6.94 4.33 1.30 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 0.00 0.00 109 K 8.95 4.28 0.00 1.60 1.88 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.58 1.53 7.81 110 A 7.34 4.57 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 0.00 111 V 8.59 4.69 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 1.10 0.00 0.00 0.94 0.00 0.00 112 I 9.24 4.72 1.98 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.69 0.95 0.00 0.00 113 R 8.93 4.68 0.00 1.92 1.83 0.00 3.08 0.00 0.00 3.63 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 114 T 8.69 4.93 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 1.35 0.00 0.00 115 G 8.84 4.11 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 0.00 116 E 8.25 4.41 0.00 2.29 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 0.00 2.32 2.37 0.00 117 F 8.91 4.95 0.00 2.91 3.04 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 0.00 118 T 7.67 4.67 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 1.30 0.00 0.00 119 P 0.00 3.89 0.00 2.21 1.95 0.00 3.89 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.02 0.00 120 Y 7.55 3.38 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 0.00 121 A 7.30 3.96 0.88 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 0.00 0.00 122 N 7.21 5.73 0.00 2.32 2.93 0.00 0.00 7.05 7.66 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 0.00 123 C 9.15 5.20 0.00 3.23 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 0.00 124 I 9.21 4.90 1.86 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.49 0.83 0.00 0.00 125 L 8.74 4.61 0.00 1.54 1.49 0.98 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.77 4.82 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.41 0.00 127 A 9.26 4.33 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 0.00 128 G 8.97 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 0.00 0.00 0.00 0.00 129 V 7.92 4.46 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 0.45 0.00 0.00 0.12 0.00 0.00 130 L 8.37 4.44 0.00 1.86 1.84 0.98 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 131 F 7.09 4.47 0.00 3.12 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