NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9665 8.3393 109.7429 46.1542 0.0000 172.0789 2 H 4.4014 8.0286 113.0127 54.5921 30.4461 171.2678 3 M 4.5182 9.2680 120.9380 54.2051 34.2065 177.6773 4 E 4.2669 9.1075 124.2652 55.9843 30.0034 175.7157 5 L 4.7957 8.4990 125.7438 53.5245 41.0398 175.5869 6 F 5.2117 8.3672 119.3270 53.7679 40.8790 173.4645 7 P 4.9601 0.0000 0.0000 63.0380 32.1705 175.4963 8 V 4.5495 9.4356 124.2313 60.9780 34.3165 173.5679 9 E 4.8652 8.9897 128.5022 54.5895 31.4651 174.9480 10 L 4.7370 8.5617 126.7711 52.9163 44.1299 175.8515 11 E 4.5833 8.4488 118.1410 54.2125 31.0240 176.0797 12 K 4.3323 8.4992 123.0654 56.3210 33.8989 176.6215 13 D 4.7654 8.3732 120.3525 53.1976 42.7358 177.2782 14 S 4.1742 8.4635 113.2275 61.3446 62.7213 175.4643 15 E 4.0866 8.2064 120.6366 60.3717 30.7565 175.1517 16 G 4.0695 6.8708 105.1487 44.6543 0.0000 174.7981 17 L 4.7607 8.4486 128.1629 53.7000 44.1307 177.0996 18 G 4.2938 8.0483 105.3549 44.1240 0.0000 170.4911 19 I 5.0662 7.1310 112.3075 60.9620 41.4417 175.1344 20 S 4.8368 8.9226 116.5510 57.6589 67.6665 173.5294 21 I 5.1862 8.1910 113.9828 59.4042 41.0803 174.3520 22 I 4.6924 8.8374 122.2833 59.4942 41.7452 174.4773 23 G 3.9048 9.1143 117.0564 46.0171 0.0000 172.4530 24 M 4.7769 9.1391 127.1333 52.8197 35.9061 175.5367 25 G 4.2102 9.8090 105.4939 45.4187 0.0000 172.8998 26 A 4.5290 8.3427 120.5584 51.1817 22.7829 175.6921 27 G 3.6436 8.7170 109.9916 46.0279 0.0000 175.1848 28 A 4.7667 7.3993 122.1286 51.6497 17.2969 177.1803 29 D 4.4062 8.1807 118.5432 54.4008 42.1272 175.4577 30 M 3.0487 8.8256 118.6065 54.7996 28.4753 176.7403 31 G 4.0759 9.8688 114.7171 45.2364 0.0000 171.2554 32 L 4.1948 7.8810 129.1109 54.6335 45.1016 173.7037 33 E 4.4497 7.7213 118.5631 56.1854 26.3639 173.3256 34 K 4.5830 7.9390 122.2261 55.4749 30.9853 176.0408 35 L 4.8222 7.8853 127.5093 53.5893 46.4046 175.8205 36 G 3.6987 9.2359 107.2582 44.9009 0.0000 172.0251 37 I 5.4327 7.8993 128.7072 59.4302 36.5791 175.7657 38 F 4.6664 8.2909 125.5608 56.1922 41.2302 174.4989 39 V 4.0655 8.4271 121.3683 63.2399 31.0911 175.8588 40 K 4.2776 9.2228 130.1985 59.2865 33.0666 176.1027 41 T 4.5984 7.4963 112.1711 61.3329 71.1106 173.0075 42 V 4.8646 8.1881 123.5469 59.8781 32.9372 174.3295 43 T 4.0670 8.6047 125.1716 63.5955 68.7258 175.3728 44 E 3.6145 9.1407 125.1081 59.2396 29.5779 178.7643 45 G 3.6164 8.1555 107.4902 47.5568 0.0000 173.6955 46 G 4.0108 8.0268 108.5103 43.6911 0.0000 174.4391 47 A 3.9963 8.2345 119.8556 55.0386 18.0818 180.0162 48 A 4.0483 8.0317 118.9019 55.6817 18.2411 179.1934 49 H 4.1414 7.8185 115.5704 59.3727 30.0544 177.4176 50 R 4.1684 7.9409 118.5222 58.6051 30.1099 178.0927 51 D 4.4875 8.4282 117.9661 57.0614 41.7537 178.5042 52 G 3.8766 8.4900 105.7167 46.2006 0.0000 174.0294 53 R 4.2255 7.4578 117.9500 57.0989 31.7704 175.7416 54 I 4.1225 7.5411 125.7657 60.6868 37.2464 175.7326 55 Q 4.6115 9.1432 125.6702 53.8537 30.6099 177.2894 56 V 3.8725 8.2468 117.4948 63.3207 31.5118 176.1362 57 N 4.8400 8.0450 117.5768 53.5051 39.6243 173.2640 58 D 5.0032 7.9761 117.4950 53.6142 43.6939 175.0042 59 L 4.6783 7.9081 120.5816 53.3424 45.6641 175.4538 60 L 4.4096 7.8599 125.4719 54.4345 40.6545 176.9816 61 V 3.8228 8.5799 125.6326 65.3034 32.7287 175.4893 62 E 5.2075 7.8989 116.3615 55.3310 32.9047 175.5129 63 V 4.4910 8.5044 122.0186 60.1996 34.0669 174.8398 64 D 4.7160 8.4269 118.0669 56.5149 40.7946 178.7406 65 G 4.2626 7.5994 105.4473 44.2860 0.0000 173.1376 66 T 4.3542 7.6391 115.0880 62.5113 72.0692 173.6957 67 S 4.5735 8.6649 123.8537 58.3651 63.1910 173.9499 68 L 3.9889 8.2507 126.7410 54.7712 42.2503 178.3098 69 V 3.6526 7.6553 123.1372 61.8561 31.5302 172.1235 70 G 4.7749 6.6504 121.0166 44.6485 0.0000 171.4909 71 V 4.1061 6.9867 120.2012 59.6900 34.8066 176.2690 72 T 4.2874 7.9046 110.2385 61.6741 70.9668 175.1478 73 Q 4.0086 8.5630 122.6351 59.5533 29.0940 178.7823 74 S 4.1383 8.0888 115.8446 61.3353 62.9074 176.2579 75 F 3.9447 7.8373 122.7860 61.2609 38.8904 177.0455 76 A 4.1520 8.1721 119.8923 55.2878 17.9816 179.4715 77 A 3.9475 8.0846 118.2807 55.2111 18.7128 179.3571 78 S 4.2384 8.0478 111.7985 60.8337 62.5914 176.6894 79 V 3.6342 7.7952 122.2065 64.5395 31.0328 178.2170 80 L 4.2836 7.5065 119.2916 56.1938 41.5106 178.5611 81 R 4.3481 7.6824 116.8285 57.5838 30.7296 177.7765 82 N 4.5678 7.9806 115.0196 54.2781 38.8990 175.3553 83 T 4.3152 7.2165 110.4329 60.1095 70.2487 174.6825 84 K 4.3419 8.1834 121.4254 55.9645 33.0260 177.2387 85 G 3.6637 8.5479 107.6173 47.9453 0.0000 173.9201 86 R 4.4726 7.7896 118.9799 54.3378 32.1766 174.5266 87 V 4.3544 7.8270 117.4723 59.4736 35.6275 174.9229 88 R 4.2981 8.1405 121.9327 55.2985 31.7010 175.7547 89 F 4.9832 8.9716 122.5082 56.2466 42.6346 174.8509 90 M 5.0093 9.1454 120.8901 53.9729 33.5789 175.3079 91 I 4.9348 7.9496 125.9012 59.6946 39.0504 175.7128 92 G 4.6006 8.3840 113.3157 44.6423 0.0000 171.8113 93 R 4.6987 8.1442 123.1903 54.0511 32.4374 175.4584 94 E 4.3561 8.5389 123.2869 55.0752 27.3452 175.4914 95 R 4.0039 8.2647 123.7598 58.2576 30.9364 175.2726 96 P 4.5556 0.0000 0.0000 61.8433 32.6183 176.3886 97 G 4.6894 8.3533 117.4626 47.1631 0.0000 174.3307 98 E 4.1946 7.6689 116.5268 56.4232 29.6859 178.0209 99 Q 4.0816 8.0298 119.7901 59.3424 28.6941 176.4798 100 S 4.4136 7.7154 110.8117 58.4649 67.1174 174.1700 101 E 3.9964 8.7745 117.8546 57.1815 27.6652 173.5680 102 V 4.1638 7.1468 109.4594 61.0313 32.4291 174.3750 103 A 3.9307 8.3252 129.0446 53.2581 17.0049 178.8551 104 Q 4.0024 7.8606 115.4020 56.0492 29.8007 177.2954 105 L 4.3240 7.5856 116.5330 53.4325 40.4520 173.6312 106 I 3.6601 8.0992 118.4857 63.4277 37.3126 175.4085 107 Q 3.2750 7.8810 130.2514 56.5006 26.6501 173.4308 108 Q 4.3307 8.1434 123.8567 55.4057 26.9834 175.6971 109 T 4.1601 7.8315 116.1471 63.7464 68.3732 175.7915 110 L 4.3852 7.8262 118.8965 54.5470 41.4842 176.2860 111 E 4.6297 7.8891 120.0311 54.6532 30.4181 174.3588 112 Q 4.6100 8.3215 120.5893 55.3894 29.5964 175.7369 113 E 4.1238 8.3018 123.3280 57.2524 29.4445 176.7255 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 G 8.34 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 2 H 8.03 4.40 0.00 3.30 3.24 0.00 5.52 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 M 9.27 4.52 0.00 1.89 2.03 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 2.56 0.00 4 E 9.11 4.27 0.00 2.09 2.27 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 2.38 2.33 0.00 5 L 8.50 4.80 0.00 1.53 1.61 0.85 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.37 5.21 0.00 3.05 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 7 P 0.00 4.96 0.00 2.15 2.16 0.00 3.88 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 2.06 2.02 0.00 8 V 9.44 4.55 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 1.30 0.00 0.00 1.33 0.00 0.00 9 E 8.99 4.87 0.00 1.93 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 2.11 2.18 0.00 10 L 8.56 4.74 0.00 1.92 1.68 1.04 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.45 4.58 0.00 2.03 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 0.00 2.17 2.27 0.00 12 K 8.50 4.33 0.00 1.98 1.90 0.00 1.58 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.58 1.47 7.81 13 D 8.37 4.77 0.00 2.80 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 4.17 0.00 3.83 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 15 E 8.21 4.09 0.00 1.95 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 0.00 2.30 2.38 0.00 16 G 6.87 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 17 L 8.45 4.76 0.00 1.67 1.67 0.98 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 18 G 8.05 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 19 I 7.13 5.07 1.86 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 1.35 0.52 0.95 0.00 0.00 20 S 8.92 4.84 0.00 3.77 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 21 I 8.19 5.19 1.87 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 0.67 0.87 0.00 0.00 22 I 8.84 4.69 1.90 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 1.18 1.28 1.04 0.00 0.00 23 G 9.11 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 24 M 9.14 4.78 0.00 1.99 2.32 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 2.50 2.66 0.00 25 G 9.81 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 0.00 0.00 0.00 0.00 26 A 8.34 4.53 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 27 G 8.72 3.64 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 0.00 0.00 0.00 28 A 7.40 4.77 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 29 D 8.18 4.41 0.00 2.62 2.76 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 0.00 0.00 0.00 30 M 8.83 3.05 0.00 2.20 2.08 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 2.49 2.51 0.00 31 G 9.87 4.08 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 0.00 32 L 7.88 4.19 0.00 1.56 1.67 0.90 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.72 4.45 0.00 2.10 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 2.32 2.25 0.00 34 K 7.94 4.58 0.00 1.75 1.83 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.69 7.81 35 L 7.89 4.82 0.00 1.42 1.54 0.89 0.90 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 36 G 9.24 3.70 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 0.00 37 I 7.90 5.43 1.77 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 1.27 1.47 0.94 0.00 0.00 38 F 8.29 4.67 0.00 3.01 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 V 8.43 4.07 2.23 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 0.82 0.00 0.00 0.99 0.00 0.00 40 K 9.22 4.28 0.00 1.88 1.82 0.00 1.90 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.39 7.81 41 T 7.50 4.60 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 1.23 0.00 0.00 42 V 8.19 4.86 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 0.91 0.00 0.00 1.08 0.00 0.00 43 T 8.60 4.07 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 1.24 0.00 0.00 44 E 9.14 3.61 0.00 1.89 1.78 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 2.21 2.27 0.00 45 G 8.16 3.62 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 0.00 0.00 0.00 46 G 8.03 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 0.00 0.00 0.00 47 A 8.23 4.00 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 48 A 8.03 4.05 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 49 H 7.82 4.14 0.00 3.25 3.44 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 7.94 4.17 0.00 1.85 2.00 0.00 3.27 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 51 D 8.43 4.49 0.00 2.70 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 52 G 8.49 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 0.00 0.00 0.00 53 R 7.46 4.23 0.00 1.97 1.96 0.00 3.33 0.00 0.00 3.55 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 54 I 7.54 4.12 1.90 0.00 0.00 0.58 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 0.81 0.86 0.00 0.00 55 Q 9.14 4.61 0.00 2.29 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.92 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 56 V 8.25 3.87 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 0.69 0.00 0.00 0.94 0.00 0.00 57 N 8.04 4.84 0.00 2.69 2.86 0.00 0.00 6.97 8.43 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 58 D 7.98 5.00 0.00 2.84 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 59 L 7.91 4.68 0.00 1.15 1.43 0.03 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 60 L 7.86 4.41 0.00 1.52 1.51 0.75 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 61 V 8.58 3.82 2.24 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 0.93 0.00 0.00 0.86 0.00 0.00 62 E 7.90 5.21 0.00 2.18 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 0.00 2.26 2.33 0.00 63 V 8.50 4.49 2.29 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 0.94 0.00 0.00 1.21 0.00 0.00 64 D 8.43 4.72 0.00 2.54 2.75 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 65 G 7.60 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 0.00 0.00 0.00 0.00 66 T 7.64 4.35 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 67 S 8.66 4.57 0.00 3.86 3.78 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 68 L 8.25 3.99 0.00 1.76 1.51 0.94 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 69 V 7.66 3.65 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 0.76 0.00 0.00 0.88 0.00 0.00 70 G 6.65 4.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 6.99 4.11 1.38 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 -0.10 0.00 0.00 0.83 0.00 0.00 72 T 7.90 4.29 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 1.22 0.00 0.00 73 Q 8.56 4.01 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.47 0.00 74 S 8.09 4.14 0.00 3.96 3.92 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 75 F 7.84 3.94 0.00 3.17 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 76 A 8.17 4.15 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 77 A 8.08 3.95 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 78 S 8.05 4.24 0.00 4.00 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 79 V 7.80 3.63 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 0.89 0.00 0.00 0.99 0.00 0.00 80 L 7.51 4.28 0.00 1.80 1.83 0.90 0.79 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 81 R 7.68 4.35 0.00 1.92 1.97 0.00 3.15 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.81 0.00 82 N 7.98 4.57 0.00 2.77 2.84 0.00 0.00 7.09 7.44 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 83 T 7.22 4.32 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 1.30 0.00 0.00 84 K 8.18 4.34 0.00 1.75 1.82 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.37 7.81 85 G 8.55 3.66 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 0.00 86 R 7.79 4.47 0.00 1.70 1.75 0.00 3.15 0.00 0.00 3.44 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.79 0.00 87 V 7.83 4.35 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 0.71 0.00 0.00 0.74 0.00 0.00 88 R 8.14 4.30 0.00 1.67 1.77 0.00 3.06 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 89 F 8.97 4.98 0.00 2.89 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 90 M 9.15 5.01 0.00 1.88 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 2.55 2.52 0.00 91 I 7.95 4.93 1.59 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 1.14 1.02 0.51 0.00 0.00 92 G 8.38 4.60 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 0.00 0.00 0.00 93 R 8.14 4.70 0.00 1.96 2.07 0.00 3.37 0.00 0.00 3.39 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 94 E 8.54 4.36 0.00 2.04 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 2.36 2.30 0.00 95 R 8.26 4.00 0.00 1.94 1.99 0.00 3.46 0.00 0.00 3.48 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 96 P 0.00 4.56 0.00 2.22 2.05 0.00 3.97 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 1.95 1.91 0.00 97 G 8.35 4.69 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 0.00 0.00 0.00 98 E 7.67 4.19 0.00 2.09 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 2.27 2.33 0.00 99 Q 8.03 4.08 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.06 6.67 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 100 S 7.72 4.41 0.00 3.84 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 0.00 101 E 8.77 4.00 0.00 2.17 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 0.00 2.26 2.41 0.00 102 V 7.15 4.16 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 0.77 0.00 0.00 0.93 0.00 0.00 103 A 8.33 3.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.86 4.00 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.07 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 105 L 7.59 4.32 0.00 1.81 1.70 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.10 3.66 1.87 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 1.40 0.74 0.95 0.00 0.00 107 Q 7.88 3.28 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.49 0.00 0.00 0.00 0.00 0.00 2.24 2.42 0.00 108 Q 8.14 4.33 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 109 T 7.83 4.16 4.24 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 1.26 0.00 0.00 110 L 7.83 4.39 0.00 1.67 1.67 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 111 E 7.89 4.63 0.00 1.84 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 2.21 2.21 0.00 112 Q 8.32 4.61 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.74 0.00 0.00 0.00 0.00 0.00 2.24 2.33 0.00 113 E 8.30 4.12 0.00 1.96 1.91 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 2.31 2.37 0.00