NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4571 8.1633 120.3498 55.2814 33.6063 178.8027 2 E 3.8602 9.0140 118.2169 58.0261 29.3072 175.7106 3 D 4.3701 8.4559 118.1916 57.6506 41.4705 177.8434 4 E 4.0673 7.8585 119.0176 59.3048 29.7014 178.5467 5 N 4.4408 8.0305 116.0784 56.0450 38.6097 177.3083 6 I 3.7066 7.7427 121.4002 64.2590 37.1150 178.3049 7 L 3.9452 7.5043 118.3949 57.9186 41.4561 179.4075 8 R 3.9408 7.9450 117.8650 59.6935 30.0207 178.5445 9 N 4.2699 8.1946 116.0076 56.5715 38.9383 176.5996 10 A 3.9734 8.4468 122.6213 55.1786 18.3977 179.8458 11 V 3.4438 8.0810 116.7782 66.2795 31.7029 177.6190 12 N 4.1716 8.7556 116.7425 56.6500 38.4694 177.1234 13 L 3.8782 8.2090 121.5791 57.9506 42.0493 178.5805 14 Q 3.9566 7.9697 119.6655 59.1840 28.8134 178.5954 15 V 3.6062 8.0826 119.4956 65.9596 31.5666 177.9631 16 L 3.9902 7.7454 118.6627 57.8689 41.4567 179.5638 17 K 4.5265 8.0414 119.6770 58.8288 31.7152 178.9695 18 F 4.0923 7.6843 120.1327 61.8271 39.3877 176.6174 19 H 4.1924 7.7984 114.1350 57.1213 29.5619 175.2065 20 Y 4.7029 8.3041 118.5008 55.3628 39.2461 173.6114 21 P 4.7256 0.0000 0.0000 64.3415 31.3154 177.2024 22 E 3.8216 8.1617 118.2418 55.6194 29.7630 182.7617 23 I 2.5899 7.6508 108.9255 57.5035 42.2050 176.1499 24 E 4.1124 9.3316 127.7438 55.5872 30.1878 174.1529 25 S 4.6743 7.6610 111.6540 57.2931 66.3477 172.4336 26 I 4.5957 8.3902 127.3829 60.3089 38.1330 175.2114 27 I 4.1884 9.0264 128.7670 63.2764 37.8679 175.5045 28 D 4.7469 7.7103 118.7525 53.4254 44.7196 173.4911 29 I 5.1059 8.3620 122.1872 59.4072 40.7502 174.6878 30 A 4.7548 9.0918 129.3924 50.1145 20.2040 177.2836 31 S 3.9696 8.2736 118.2544 62.1918 63.1607 174.2906 32 H 4.9323 7.8734 121.1407 55.1790 32.3383 172.3845 33 V 5.1612 9.4804 126.5810 61.0779 34.8661 173.8667 34 A 5.1480 9.2320 128.5229 50.3795 21.6798 175.5626 35 V 4.8718 8.4280 121.5068 61.8430 33.6218 174.6222 36 Y 5.1257 9.6278 124.8727 56.5617 41.8455 174.2856 37 Q 4.9811 9.2662 120.9277 54.8305 33.0624 172.9891 38 F 4.3337 7.8969 128.5935 56.7132 39.2178 174.6259 39 D 4.5141 8.0880 126.7086 52.9676 42.0722 177.1685 40 V 3.3086 8.2217 126.2473 64.5581 31.7949 176.5848 41 G 3.4319 7.5605 117.0934 45.4149 0.0000 168.5398 42 S 3.7193 8.5308 128.7356 57.1713 64.0358 172.5909 43 Q 4.1060 8.4091 128.2958 55.3242 26.9954 175.3999 44 K 4.6731 6.8927 118.8493 53.9381 36.7036 177.1175 45 W 4.7091 9.0532 124.3343 56.6658 29.8883 175.5521 46 L 4.9628 9.6511 125.5735 52.5299 44.6160 175.7646 47 K 4.1083 8.7432 124.7065 56.6615 32.7245 176.7064 48 T 4.5115 7.9383 124.6205 62.8223 69.8544 174.9364 49 S 4.5355 8.5184 115.6719 58.2956 63.9816 174.1258 50 I 4.2667 7.4505 123.6359 61.0243 37.8568 174.5784 51 E 5.0694 8.0333 122.8151 55.0727 32.6933 174.8416 52 G 3.7640 8.0960 113.5314 46.2937 0.0000 171.4477 53 T 4.5580 7.7802 115.5219 63.0585 69.9593 173.3457 54 F 5.1462 9.1511 127.8761 56.4836 41.9952 174.1325 55 F 5.0073 9.0106 125.8537 55.3626 41.5170 174.2998 56 L 4.4950 8.8688 128.1553 54.8411 42.9298 176.1764 57 V 4.9197 9.2779 119.2875 59.4574 35.6189 174.4707 58 K 5.3559 9.1726 124.1110 54.2174 35.4467 175.2361 59 D 5.8500 8.1217 123.8680 50.7326 42.1926 174.4730 60 Q 4.2779 8.4680 117.9835 57.8712 29.0354 176.6322 61 R 4.0071 8.7409 120.2607 55.1832 27.4320 175.5903 62 A 3.9116 7.5454 118.5637 53.0265 16.8786 177.7395 63 R 4.3627 8.8031 118.4314 57.3404 31.9730 176.8513 64 V 4.4690 8.5175 116.6357 60.8044 33.5808 175.5497 65 G 4.5388 9.1743 111.7653 45.4405 0.0000 170.5584 66 Y 5.2002 8.6445 116.8577 55.0502 41.7535 174.5155 67 V 4.6080 8.5901 121.3196 61.1586 34.9990 174.0875 68 I 5.4354 8.7760 128.9636 58.9579 39.2729 175.2442 69 L 4.3299 8.8717 128.5499 53.6233 41.1671 176.1809 70 N 4.5335 8.7287 122.7063 54.1656 38.8963 174.8341 71 R 4.3204 9.0041 124.9999 58.0474 30.9890 177.8094 72 N 4.5256 8.4999 115.2543 55.7787 38.7215 174.7524 73 S 4.5782 7.4861 110.0576 56.8903 65.5234 172.0685 74 P 4.4670 0.0000 0.0000 62.8807 31.1842 175.7941 75 E 4.2256 7.7375 121.0605 55.5199 28.6315 175.5516 76 N 4.9984 8.4562 124.1625 52.5308 40.6800 174.0645 77 L 4.8324 8.5605 120.7239 53.6883 45.1087 174.7337 78 Y 5.5945 8.4786 126.1691 55.3057 40.9768 173.6526 79 L 4.4880 7.6600 126.2190 52.5251 45.3822 176.2441 80 F 4.7842 8.3915 121.1381 57.3741 40.2677 175.5588 81 I 4.3727 8.7198 124.0040 59.8574 37.0553 175.5029 82 N 4.5339 8.9958 125.9348 56.1217 38.9943 175.7321 83 H 4.8431 7.9633 116.1339 53.9257 33.0289 172.0480 84 P 4.3202 0.0000 0.0000 65.6790 31.2617 177.8344 85 S 4.5713 8.1382 109.7283 59.1988 63.3346 174.2918 86 N 4.7252 8.8041 119.6050 54.1748 39.0465 174.4530 87 V 5.1501 7.4492 118.4199 61.5497 33.6145 174.5163 88 H 5.1276 9.8723 123.2725 54.1857 33.7239 172.3367 89 L 4.7658 8.2301 121.3422 51.9382 43.3771 174.8505 90 V 4.1225 7.8860 124.7104 62.4931 34.0356 175.1243 91 D 3.8149 9.4169 122.1997 56.4593 37.3217 174.3144 92 R 3.2879 7.4397 116.8610 56.5978 28.9298 176.2204 93 Y 4.4996 7.5052 116.1550 56.9342 40.2656 174.6296 94 L 4.8008 8.6240 123.8963 53.4260 43.8959 174.8090 95 I 4.6848 8.7191 128.2517 60.9205 38.6285 174.4910 96 H 5.5749 10.1498 128.8710 54.3218 32.5030 172.3400 97 R 4.9231 8.8487 123.1398 55.1033 30.6896 176.8296 98 T 4.3859 8.1588 121.3774 61.8871 70.4165 174.5466 99 E 4.0617 8.8129 122.1000 59.9465 28.1548 178.3599 100 N 4.4818 8.1721 111.7970 53.8475 38.1456 175.5100 101 Q 3.5418 8.0036 115.5866 57.0106 27.0817 172.7523 102 H 4.7833 7.4087 115.2497 54.6528 30.1216 174.6372 103 V 4.3784 8.3539 124.5044 62.2682 32.9185 174.6724 104 V 4.9643 9.4844 128.0468 61.1417 34.6733 174.0691 105 G 4.4480 9.6211 115.2363 44.6377 0.0000 172.2229 106 L 5.2249 8.9549 125.5915 52.9723 44.1871 175.7528 107 W 4.7405 9.4230 135.0000 55.8076 30.7678 174.6833 108 M 4.4941 7.9709 126.0043 55.4546 31.4394 176.7424 109 F 4.3221 9.3745 122.4083 59.1767 40.3992 175.2760 110 D 4.8204 7.9664 119.0059 51.7693 42.3064 174.9453 111 P 4.0944 0.0000 0.0000 65.7590 31.1510 178.1265 112 N 4.4417 8.8062 115.1151 55.5331 38.4296 177.2633 113 D 4.3105 7.9516 120.7989 57.5268 40.8493 177.7634 114 M 3.8225 7.8647 118.4840 58.7703 32.1600 178.1734 115 S 4.1110 7.9781 114.2718 61.3522 62.9682 176.5499 116 R 3.8269 7.7744 122.2512 59.5065 30.0779 178.4615 117 I 3.7421 8.1460 119.9912 64.2170 36.8165 178.2229 118 F 4.1936 8.2308 120.9310 61.4532 39.5944 176.2701 119 N 4.2357 7.9340 115.6788 56.6252 38.1659 177.3131 120 I 3.6825 7.2893 119.3983 63.6250 37.6853 178.5206 121 V 4.3225 8.2307 117.4975 59.9570 33.2842 175.4720 122 K 5.0764 6.8414 130.2385 56.9022 36.3921 173.8469 123 E 5.0354 7.5437 126.4268 56.3925 29.5888 179.9593 124 S 4.6965 8.8262 123.7720 58.5791 63.1848 172.1915 125 L 4.7484 8.2808 119.4131 52.7918 45.0738 174.8973 126 L 4.5600 8.3926 125.4837 53.3555 43.4830 176.2731 127 R 4.1929 8.4921 124.8487 56.4453 30.2035 175.0515 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 8.16 4.46 0.00 2.07 1.08 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 2 E 9.01 3.86 0.00 2.18 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 0.00 2.40 2.49 0.00 3 D 8.46 4.37 0.00 2.74 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 4 E 7.86 4.07 0.00 2.10 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 2.31 2.35 0.00 5 N 8.03 4.44 0.00 2.90 2.87 0.00 0.00 7.14 7.34 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 6 I 7.74 3.71 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.84 0.92 0.00 0.00 7 L 7.50 3.95 0.00 1.96 1.72 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 8 R 7.94 3.94 0.00 2.04 2.05 0.00 3.16 0.00 0.00 3.11 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 9 N 8.19 4.27 0.00 2.96 2.83 0.00 0.00 7.20 8.32 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 10 A 8.45 3.97 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 11 V 8.08 3.44 2.20 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 1.10 0.00 0.00 0.94 0.00 0.00 12 N 8.76 4.17 0.00 2.97 2.87 0.00 0.00 6.76 7.39 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 13 L 8.21 3.88 0.00 1.81 1.88 0.87 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 7.97 3.96 0.00 2.35 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 15 V 8.08 3.61 2.17 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 1.01 0.00 0.00 0.93 0.00 0.00 16 L 7.75 3.99 0.00 1.78 1.59 0.57 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.04 4.53 0.00 2.00 1.91 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.65 1.33 7.81 18 F 7.68 4.09 0.00 2.87 3.26 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 19 H 7.80 4.19 0.00 3.10 2.86 0.00 5.67 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.30 4.70 0.00 3.04 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 0.00 21 P 0.00 4.73 0.00 2.06 2.13 0.00 3.78 0.00 0.00 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 22 E 8.16 3.82 0.00 2.11 1.94 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 2.38 2.38 0.00 23 I 7.65 2.59 1.85 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 1.58 1.03 0.88 0.00 0.00 24 E 9.33 4.11 0.00 2.33 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 0.00 2.18 2.24 0.00 25 S 7.66 4.67 0.00 3.94 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 26 I 8.39 4.60 1.91 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 1.36 0.72 1.03 0.00 0.00 27 I 9.03 4.19 1.92 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 1.15 0.69 0.95 0.00 0.00 28 D 7.71 4.75 0.00 2.82 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.36 5.11 1.87 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.88 0.77 0.00 0.00 30 A 9.09 4.75 1.13 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 0.00 0.00 0.00 0.00 0.00 0.00 31 S 8.27 3.97 0.00 4.12 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 0.00 32 H 7.87 4.93 0.00 3.06 3.08 0.00 5.62 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 9.48 5.16 2.22 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 1.01 0.00 0.00 0.77 0.00 0.00 34 A 9.23 5.15 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 0.00 0.00 0.00 0.00 0.00 35 V 8.43 4.87 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 1.15 0.00 0.00 1.14 0.00 0.00 36 Y 9.63 5.13 0.00 3.06 3.30 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 37 Q 9.27 4.98 0.00 2.20 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.86 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 38 F 7.90 4.33 0.00 1.51 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 0.00 0.00 0.00 0.00 39 D 8.09 4.51 0.00 2.54 2.32 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 40 V 8.22 3.31 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 0.75 0.00 0.00 0.94 0.00 0.00 41 G 7.56 3.43 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 0.00 42 S 8.53 3.72 0.00 3.96 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 43 Q 8.41 4.11 0.00 2.17 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.47 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 44 K 6.89 4.67 0.00 1.68 1.62 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.29 7.81 45 W 9.05 4.71 0.00 3.25 3.26 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 46 L 9.65 4.96 0.00 1.53 1.55 0.88 -0.36 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 47 K 8.74 4.11 0.00 1.69 1.68 0.00 0.76 0.00 0.00 0.75 0.00 0.00 2.81 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.29 1.35 7.81 48 T 7.94 4.51 4.46 0.00 0.00 0.00 0.00 0.00 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 49 S 8.52 4.54 0.00 3.97 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 50 I 7.45 4.27 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.12 1.02 0.00 0.00 51 E 8.03 5.07 0.00 1.98 1.77 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 2.30 2.30 0.00 52 G 8.10 3.76 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 0.00 0.00 0.00 53 T 7.78 4.56 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 0.43 0.00 0.00 54 F 9.15 5.15 0.00 3.02 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 55 F 9.01 5.01 0.00 2.91 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 56 L 8.87 4.49 0.00 1.92 1.77 1.15 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 57 V 9.28 4.92 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 0.58 0.00 0.00 0.68 0.00 0.00 58 K 9.17 5.36 0.00 1.84 1.66 0.00 1.65 0.00 0.00 1.83 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.23 7.81 59 D 8.12 5.85 0.00 2.95 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 60 Q 8.47 4.28 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 5.88 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 61 R 8.74 4.01 0.00 1.93 2.22 0.00 3.40 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 62 A 7.55 3.91 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 63 R 8.80 4.36 0.00 2.03 1.99 0.00 2.95 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 64 V 8.52 4.47 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 0.75 0.00 0.00 1.05 0.00 0.00 65 G 9.17 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.64 5.20 0.00 2.04 2.68 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 67 V 8.59 4.61 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 0.89 0.00 0.00 -0.15 0.00 0.00 68 I 8.78 5.44 2.05 0.00 0.00 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 1.53 1.60 1.05 0.00 0.00 69 L 8.87 4.33 0.00 1.73 1.76 1.01 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 70 N 8.73 4.53 0.00 2.84 2.95 0.00 0.00 7.22 7.65 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 71 R 9.00 4.32 0.00 1.97 1.96 0.00 3.14 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 72 N 8.50 4.53 0.00 2.94 2.88 0.00 0.00 6.80 6.88 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 73 S 7.49 4.58 0.00 3.95 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 74 P 0.00 4.47 0.00 2.23 2.22 0.00 3.77 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 1.99 1.97 0.00 75 E 7.74 4.23 0.00 1.93 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 2.34 2.31 0.00 76 N 8.46 5.00 0.00 2.85 3.07 0.00 0.00 6.87 7.85 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 77 L 8.56 4.83 0.00 1.88 1.63 0.99 0.99 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 78 Y 8.48 5.59 0.00 2.33 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 0.00 0.00 0.00 0.00 79 L 7.66 4.49 0.00 0.86 1.32 1.03 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 80 F 8.39 4.78 0.00 2.92 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 81 I 8.72 4.37 1.99 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 0.98 0.00 0.00 82 N 9.00 4.53 0.00 2.79 2.93 0.00 0.00 6.87 8.16 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 83 H 7.96 4.84 0.00 3.13 3.13 0.00 5.69 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 84 P 0.00 4.32 0.00 2.10 2.01 0.00 3.01 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 85 S 8.14 4.57 0.00 4.08 4.10 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 0.00 0.00 0.00 0.00 86 N 8.80 4.73 0.00 3.02 3.23 0.00 0.00 6.44 7.27 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 87 V 7.45 5.15 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 1.03 0.00 0.00 1.01 0.00 0.00 88 H 9.87 5.13 0.00 3.25 3.16 0.00 5.80 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.23 4.77 0.00 0.27 0.57 0.56 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 90 V 7.89 4.12 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 0.99 0.00 0.00 0.94 0.00 0.00 91 D 9.42 3.81 0.00 2.74 2.70 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 92 R 7.44 3.29 0.00 1.35 0.66 0.00 2.93 0.00 0.00 2.88 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.34 0.00 93 Y 7.51 4.50 0.00 2.96 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 94 L 8.62 4.80 0.00 1.70 1.48 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.72 4.68 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.67 1.06 0.00 0.00 96 H 10.15 5.57 0.00 3.29 3.36 0.00 5.58 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 97 R 8.85 4.92 0.00 1.87 1.93 0.00 3.10 0.00 0.00 3.19 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 98 T 8.16 4.39 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 1.26 0.00 0.00 99 E 8.81 4.06 0.00 2.06 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 2.37 2.40 0.00 100 N 8.17 4.48 0.00 2.88 2.73 0.00 0.00 7.11 7.74 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 0.00 101 Q 8.00 3.54 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 6.77 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 102 H 7.41 4.78 0.00 3.10 3.23 0.00 5.61 0.00 0.00 0.00 0.00 6.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 8.35 4.38 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 0.82 0.00 0.00 0.82 0.00 0.00 104 V 9.48 4.96 2.26 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 1.22 0.00 0.00 1.09 0.00 0.00 105 G 9.62 4.45 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 0.00 0.00 0.00 106 L 8.95 5.22 0.00 1.59 1.49 0.65 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 107 W 9.42 4.74 0.00 3.63 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 0.00 108 M 7.97 4.49 0.00 1.90 1.67 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 109 F 9.37 4.32 0.00 3.04 3.27 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 0.00 110 D 7.97 4.82 0.00 2.70 2.70 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 0.00 111 P 0.00 4.09 0.00 2.11 1.97 0.00 3.61 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 112 N 8.81 4.44 0.00 2.88 2.83 0.00 0.00 6.94 7.75 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 0.00 113 D 7.95 4.31 0.00 2.78 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 0.00 114 M 7.86 3.82 0.00 2.00 1.70 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 115 S 7.98 4.11 0.00 4.03 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 0.00 116 R 7.77 3.83 0.00 1.98 1.96 0.00 3.11 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 117 I 8.15 3.74 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 1.57 1.07 1.00 0.00 0.00 118 F 8.23 4.19 0.00 2.97 3.23 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 0.00 119 N 7.93 4.24 0.00 2.90 2.83 0.00 0.00 7.12 8.68 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 0.00 120 I 7.29 3.68 2.01 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 1.43 0.34 0.94 0.00 0.00 121 V 8.23 4.32 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 0.88 0.00 0.00 1.09 0.00 0.00 122 K 6.84 5.08 0.00 1.41 0.90 0.00 1.76 0.00 0.00 1.86 0.00 0.00 3.21 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.41 0.84 7.81 123 E 7.54 5.04 0.00 1.92 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 2.27 2.53 0.00 124 S 8.83 4.70 0.00 3.75 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.28 4.75 0.00 1.55 1.45 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.39 4.56 0.00 1.60 1.54 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 127 R 8.49 4.19 0.00 1.75 1.74 0.00 3.37 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.63 0.00