NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.3833 0.0000 0.0000 62.7639 31.5431 175.2780 2 R 4.3353 7.9829 124.8968 53.5894 32.3017 174.5375 3 S 4.7721 8.8397 115.8198 56.2333 66.2478 174.7655 4 L 4.0122 8.4538 119.9079 57.3908 41.3886 178.6547 5 A 4.2793 7.7776 120.3676 53.7450 18.9390 177.9081 6 N 4.6410 7.8481 111.5258 54.3415 39.3884 174.9545 7 A 4.6998 7.3116 117.4575 49.9546 22.1239 174.4104 8 P 4.6954 0.0000 0.0000 62.5712 33.5524 175.0847 9 I 4.4187 8.7590 122.1167 60.9743 38.6210 174.7728 10 M 4.7347 8.7740 127.2691 54.5710 33.9460 174.7162 11 I 4.8310 8.7856 127.1547 59.7669 39.9070 174.2501 12 L 4.9899 8.7623 128.1059 53.1302 44.0138 175.6383 13 N 5.3320 8.9427 120.3885 51.7203 41.9473 175.1594 14 G 4.3377 8.7472 113.8194 43.8582 0.0000 171.6123 15 P 4.4796 0.0000 0.0000 63.7855 31.8922 176.8543 16 N 4.2709 9.1366 114.6282 54.1289 37.5698 176.3353 17 L 4.1041 7.4836 118.6683 56.6504 41.9906 178.7637 18 N 4.2767 8.2108 115.4206 55.3679 37.2062 175.4549 19 L 4.4483 7.7587 118.0636 54.0659 41.8419 175.8637 20 L 3.8598 7.7329 122.3681 56.9762 42.2313 177.9936 21 G 4.0986 8.9944 111.9750 46.8772 0.0000 173.5245 22 Q 4.6132 7.6457 115.3535 54.8847 30.3957 175.3942 23 R 4.4810 8.0526 112.1414 56.3786 32.3822 174.4345 24 Q 3.4276 8.8143 117.4554 56.3157 26.4168 173.5983 25 P 4.9936 0.0000 0.0000 66.3716 31.5554 178.4202 26 E 3.6309 8.2979 116.4523 60.2159 29.4814 180.2520 27 I 4.1952 7.4728 116.4566 63.5318 38.3167 176.6964 28 Y 4.6298 8.6382 114.1533 57.3061 39.4407 176.3070 29 G 3.9299 9.5361 108.5835 44.8677 0.0000 173.8796 30 S 4.6826 8.2280 110.7013 57.9062 63.2908 173.9439 31 D 4.6296 7.8776 121.5909 54.5686 41.6841 176.0507 32 T 4.6632 8.6778 115.1773 59.6181 72.0786 175.7285 33 L 3.9738 8.2660 121.0483 58.1039 42.0268 178.4109 34 A 3.8278 7.9031 120.4580 55.1486 18.3260 179.1233 35 D 4.2392 7.7714 117.1644 57.3886 40.7433 179.2703 36 V 3.4054 7.4528 118.5831 65.7057 31.4352 177.5408 37 E 2.8851 7.8991 119.2395 59.0441 29.2240 178.7873 38 A 3.8842 7.7624 120.5465 54.9633 18.3581 179.6274 39 L 3.9082 7.7060 117.6656 58.1711 41.5883 179.5528 40 C 4.2119 8.1677 116.9390 62.6741 28.0720 176.2588 41 V 3.5583 8.0749 120.3424 65.7579 31.0731 178.0683 42 K 3.8787 8.0639 119.1404 59.4712 31.8235 178.6348 43 A 4.0208 8.1602 120.8723 55.2625 18.2320 179.5259 44 A 4.0619 8.4571 119.3245 55.1030 18.3749 179.7448 45 A 4.0734 8.0187 119.2699 55.1254 18.2215 179.5201 46 A 3.9858 7.7931 117.8077 54.4686 18.4520 178.3336 47 H 4.8023 7.5402 109.6298 55.1956 29.5281 175.1254 48 G 3.9104 8.4767 109.5474 45.0496 0.0000 172.9439 49 G 4.4927 8.1460 107.0277 44.2100 0.0000 172.0693 50 T 4.9938 8.2700 108.1231 60.0779 72.7499 172.9819 51 V 5.0191 8.2993 113.6313 59.6537 36.0475 175.2327 52 D 4.6833 9.1461 121.3900 52.7793 43.8097 173.7756 53 F 5.1855 8.8515 128.6870 56.5830 41.1010 174.8237 54 R 4.7391 8.6030 124.2489 54.4588 34.6625 173.9237 55 Q 5.2221 8.6882 121.2147 54.7651 32.0983 174.0614 56 S 4.8116 9.1334 119.1590 57.2664 65.7840 173.3892 57 N 4.7351 8.9528 120.2472 53.5198 39.2979 174.9801 58 H 4.8386 8.2219 117.8662 53.6333 30.7798 174.5303 59 E 3.5532 8.7280 126.9191 59.4131 29.3885 179.2058 60 G 3.4348 7.7912 104.8447 47.4415 0.0000 175.1598 61 E 3.5212 7.7707 121.1971 58.8377 29.5751 178.5898 62 L 3.8395 7.5135 119.1151 57.5200 41.6445 179.6261 63 V 3.4391 7.6192 118.2110 66.0901 31.6053 177.7385 64 D 4.2925 7.9361 118.5751 57.3516 40.6746 179.0125 65 W 4.5462 8.3319 119.6754 59.8123 28.8612 178.6990 66 I 3.8221 8.0798 120.2239 64.6578 36.2809 178.0987 67 H 4.3061 8.0996 116.3031 58.8957 28.8235 177.1536 68 E 4.1312 8.2462 120.5637 59.2072 29.5139 178.7439 69 A 4.0879 8.1138 120.8522 55.0608 18.1536 179.7700 70 R 3.9648 7.7678 116.0263 58.8002 30.1183 178.2523 71 L 4.5182 7.8205 117.2346 55.1251 42.6516 176.8544 72 N 4.9434 8.1443 112.1991 52.9458 40.1785 173.1066 73 H 5.0874 8.1983 114.7408 54.1629 32.4706 173.0043 74 C 4.4584 8.5397 114.3948 58.0518 30.4081 173.3488 75 G 4.0783 6.9813 107.1061 46.3531 0.0000 172.0019 76 I 5.2101 8.2502 120.3312 59.3505 40.9207 174.9567 77 V 4.6912 8.7471 127.2480 61.2704 33.4752 174.2809 78 I 4.9130 8.8562 127.9394 59.3640 41.6128 173.3719 79 N 5.1626 9.0542 128.5622 50.5806 39.5355 172.8399 80 P 4.5318 0.0000 0.0000 62.0880 33.0662 177.8951 81 A 3.6589 8.1186 123.1853 52.4575 18.7192 180.1750 82 A 4.0659 8.4466 117.0099 57.5135 18.1141 179.0952 83 Y 4.5389 7.5015 116.3244 60.1673 37.8260 178.3241 84 S 4.1756 8.2167 117.1841 61.9027 62.7917 175.9247 85 H 4.9249 7.9272 115.6925 56.6774 29.3546 175.8359 86 T 4.6803 7.9130 107.4067 60.8231 70.3726 173.0678 87 S 4.5852 8.3224 117.8949 56.5976 61.8491 174.3911 88 V 3.2958 7.7417 128.0037 65.1864 31.3479 177.3797 89 A 3.9065 7.7220 120.4742 55.0470 18.1401 179.4838 90 I 3.6699 7.8775 118.5702 64.0653 37.1591 178.1533 91 L 3.9548 7.4712 119.8723 58.5949 41.7271 179.0256 92 D 4.3569 8.0619 116.8739 56.9679 40.9506 178.4528 93 A 4.1860 7.8466 121.4552 55.2397 18.5110 179.7364 94 L 4.0270 8.3038 117.7066 57.7583 41.4275 179.0919 95 N 4.5968 8.1174 115.2943 55.1091 38.6385 176.4327 96 T 4.2744 7.6952 110.0319 62.3168 70.9719 175.1245 97 C 4.4352 7.6840 122.7105 58.5232 26.8190 172.9593 98 D 4.4994 7.6608 119.5297 55.9377 41.1574 177.6105 99 G 3.9721 9.0098 113.3842 45.0414 0.0000 172.9265 100 L 4.2344 7.3971 121.9524 53.7981 42.8609 174.3990 101 P 4.7007 0.0000 0.0000 62.5197 32.7951 175.2625 102 V 4.8324 9.3998 124.3820 61.0248 34.7233 174.1418 103 V 4.8156 8.8103 127.7401 61.0390 33.9731 173.6948 104 E 4.7937 9.0640 129.5513 55.4029 31.1000 174.9861 105 V 4.6799 8.6687 126.3638 61.3502 35.1375 173.7710 106 H 4.8852 9.0049 123.7817 54.2698 32.2854 174.4993 107 I 4.0604 8.7742 124.2600 64.4789 37.9472 176.9331 108 S 4.4794 7.9778 114.2833 57.3761 64.2580 173.6115 109 N 4.6183 8.2220 120.2587 51.8708 37.7400 175.3632 110 I 3.6818 7.9946 120.1610 63.6155 37.7560 177.8435 111 H 4.1652 8.3118 116.9130 57.2833 28.6796 175.7677 112 Q 4.4957 7.9090 117.4977 55.5540 29.2642 175.8979 113 R 4.8014 7.2322 118.8323 54.7614 32.2667 175.5021 114 E 3.8764 8.2587 118.6842 56.7523 30.1675 176.0802 115 P 3.5160 0.0000 0.0000 65.4588 31.4944 178.5739 116 F 4.2773 7.4208 111.1768 58.8310 36.7200 176.0546 117 R 3.6734 7.1042 119.9775 57.1701 30.2838 178.0621 118 H 4.4035 8.0256 115.4269 57.7858 28.9387 174.9378 119 H 4.8414 7.3830 116.8517 54.0750 31.3710 173.5785 120 S 4.6995 7.7746 119.2992 55.8822 64.9554 174.2431 121 Y 4.1333 8.6433 126.0512 61.1464 37.5084 178.8008 122 V 3.6948 7.6961 118.4662 65.9702 31.3690 178.2189 123 S 4.3114 7.5656 115.4728 60.9030 62.6413 176.3294 124 Q 4.1444 7.8527 120.2629 58.1004 28.4402 177.0125 125 R 4.2983 7.8325 118.0472 57.1075 31.4860 176.4716 126 A 4.1494 7.9166 120.2621 52.4184 18.9711 177.0133 127 D 4.5557 8.9484 122.7548 56.9276 41.3504 177.1932 128 G 4.3257 7.9900 103.5564 44.3473 0.0000 171.5091 129 V 4.9340 8.3223 120.0597 60.8320 34.5715 174.6455 130 V 4.5829 8.9650 127.4661 61.0408 34.1621 173.9950 131 A 4.9782 8.4019 128.5861 51.0554 21.9083 175.9490 132 G 4.2397 8.9410 109.4957 46.2507 0.0000 173.4113 133 C 4.5354 8.0268 116.0155 59.0237 29.0801 175.2797 134 G 4.0418 7.9812 110.0252 46.0817 0.0000 175.2385 135 V 4.0009 8.2580 110.5062 64.0209 31.5871 177.8175 136 Q 3.9489 7.7305 119.5484 58.7953 28.6625 178.4628 137 G 3.5939 7.9199 106.6272 47.8624 0.0000 175.1827 138 Y 4.0542 8.0818 118.9110 60.9388 37.7249 179.0250 139 V 3.6531 7.7757 119.2331 65.9708 31.5812 178.0163 140 F 4.6762 7.9245 117.2723 60.6404 38.7804 177.5983 141 G 3.6994 8.3226 105.3359 48.0210 0.0000 175.8966 142 V 3.6989 7.9278 121.0934 65.6902 31.3661 177.9957 143 E 3.9961 8.6435 118.7369 59.2287 29.2797 179.3015 144 R 3.9185 8.4734 119.3342 59.3924 30.1694 178.5977 145 I 3.7194 7.9951 119.5096 64.3118 37.1125 178.1923 146 A 4.0269 8.1686 121.4126 55.1253 17.9259 179.4958 147 A 4.0322 7.4692 118.3374 54.7724 18.5996 179.3795 148 L 4.1651 7.6985 116.6958 57.4831 42.0041 178.9497 149 A 4.2407 8.5533 120.5471 54.6608 18.4169 177.6042 150 G 3.9086 7.8593 110.1341 46.2386 0.0000 173.0073 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 P 0.00 4.38 0.00 2.18 2.18 0.00 3.46 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 1.89 2.12 0.00 2 R 7.98 4.34 0.00 1.91 1.89 0.00 3.18 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 3 S 8.84 4.77 0.00 3.99 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 4 L 8.45 4.01 0.00 1.65 1.81 0.93 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 5 A 7.78 4.28 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 6 N 7.85 4.64 0.00 2.74 2.87 0.00 0.00 6.75 7.43 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 7 A 7.31 4.70 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 8 P 0.00 4.70 0.00 2.17 2.19 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 9 I 8.76 4.42 1.93 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 0.61 0.96 0.00 0.00 10 M 8.77 4.73 0.00 2.04 1.66 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 11 I 8.79 4.83 1.75 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.21 1.00 0.00 0.00 12 L 8.76 4.99 0.00 1.62 1.65 1.03 0.78 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 13 N 8.94 5.33 0.00 2.66 2.68 0.00 0.00 6.61 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 14 G 8.75 4.34 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 0.00 15 P 0.00 4.48 0.00 1.98 1.97 0.00 3.82 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.65 0.00 16 N 9.14 4.27 0.00 2.82 2.85 0.00 0.00 7.27 6.25 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 17 L 7.48 4.10 0.00 1.80 1.73 1.02 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 18 N 8.21 4.28 0.00 2.84 3.20 0.00 0.00 6.02 7.79 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 19 L 7.76 4.45 0.00 1.68 1.67 0.89 0.45 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 20 L 7.73 3.86 0.00 1.86 1.56 0.95 1.45 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 21 G 8.99 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 0.00 0.00 0.00 22 Q 7.65 4.61 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.54 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 23 R 8.05 4.48 0.00 1.89 1.85 0.00 3.30 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 24 Q 8.81 3.43 0.00 2.56 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.41 0.00 25 P 0.00 4.99 0.00 2.29 2.34 0.00 3.92 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.92 0.00 26 E 8.30 3.63 0.00 2.09 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 0.00 2.23 1.99 0.00 27 I 7.47 4.20 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.94 -0.05 0.00 0.00 28 Y 8.64 4.63 0.00 2.89 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 29 G 9.54 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 0.00 0.00 0.00 30 S 8.23 4.68 0.00 3.97 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 31 D 7.88 4.63 0.00 2.74 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 32 T 8.68 4.66 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 1.24 0.00 0.00 33 L 8.27 3.97 0.00 1.82 1.75 1.02 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.90 3.83 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 35 D 7.77 4.24 0.00 2.86 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 36 V 7.45 3.41 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 0.34 0.00 0.00 0.86 0.00 0.00 37 E 7.90 2.89 0.00 1.16 1.53 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 1.94 1.69 0.00 38 A 7.76 3.88 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 39 L 7.71 3.91 0.00 1.84 1.70 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.17 4.21 0.00 3.12 3.07 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 41 V 8.07 3.56 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 0.97 0.00 0.00 0.91 0.00 0.00 42 K 8.06 3.88 0.00 1.93 2.03 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.45 7.81 43 A 8.16 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.46 4.06 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 45 A 8.02 4.07 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 46 A 7.79 3.99 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 47 H 7.54 4.80 0.00 3.22 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.48 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 0.00 0.00 0.00 49 G 8.15 4.49 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 0.00 0.00 0.00 50 T 8.27 4.99 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 1.21 0.00 0.00 51 V 8.30 5.02 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 0.77 0.00 0.00 0.98 0.00 0.00 52 D 9.15 4.68 0.00 2.70 2.54 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 53 F 8.85 5.19 0.00 2.97 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 54 R 8.60 4.74 0.00 1.40 1.04 0.00 2.21 0.00 0.00 2.25 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.18 0.00 55 Q 8.69 5.22 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 56 S 9.13 4.81 0.00 3.73 3.53 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 57 N 8.95 4.74 0.00 2.67 2.75 0.00 0.00 6.84 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 58 H 8.22 4.84 0.00 2.99 3.11 0.00 5.63 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.73 3.55 0.00 1.16 1.60 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 2.05 1.81 0.00 60 G 7.79 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 61 E 7.77 3.52 0.00 1.66 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 1.47 1.47 0.00 62 L 7.51 3.84 0.00 1.81 1.70 1.08 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.62 3.44 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 0.82 0.00 0.00 0.83 0.00 0.00 64 D 7.94 4.29 0.00 2.65 2.71 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 65 W 8.33 4.55 0.00 3.51 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 66 I 8.08 3.82 2.02 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 1.56 1.25 0.96 0.00 0.00 67 H 8.10 4.31 0.00 3.34 3.37 0.00 5.68 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 8.25 4.13 0.00 2.19 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 0.00 2.38 2.39 0.00 69 A 8.11 4.09 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 70 R 7.77 3.96 0.00 1.92 2.04 0.00 3.17 0.00 0.00 3.25 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 71 L 7.82 4.52 0.00 1.66 1.73 0.95 0.78 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 72 N 8.14 4.94 0.00 2.73 2.72 0.00 0.00 6.68 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 73 H 8.20 5.09 0.00 3.19 3.34 0.00 5.83 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 C 8.54 4.46 0.00 3.23 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 75 G 6.98 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 76 I 8.25 5.21 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 1.11 0.84 0.92 0.00 0.00 77 V 8.75 4.69 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 1.01 0.00 0.00 0.98 0.00 0.00 78 I 8.86 4.91 1.88 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 1.19 1.76 0.96 0.00 0.00 79 N 9.05 5.16 0.00 2.64 2.73 0.00 0.00 7.10 8.06 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 80 P 0.00 4.53 0.00 2.40 2.14 0.00 3.76 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 2.14 2.10 0.00 81 A 8.12 3.66 1.11 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 82 A 8.45 4.07 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 83 Y 7.50 4.54 0.00 3.15 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 84 S 8.22 4.18 0.00 3.55 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 85 H 7.93 4.92 0.00 3.35 3.61 0.00 5.59 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 T 7.91 4.68 4.37 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 1.35 0.00 0.00 87 S 8.32 4.59 0.00 3.80 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 88 V 7.74 3.30 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 0.89 0.00 0.00 0.17 0.00 0.00 89 A 7.72 3.91 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 90 I 7.88 3.67 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 1.34 0.57 0.93 0.00 0.00 91 L 7.47 3.95 0.00 1.85 1.81 1.04 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 92 D 8.06 4.36 0.00 2.79 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 93 A 7.85 4.19 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 94 L 8.30 4.03 0.00 1.85 1.75 0.95 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.12 4.60 0.00 2.88 2.88 0.00 0.00 7.00 7.11 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 96 T 7.70 4.27 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 1.26 0.00 0.00 97 C 7.68 4.44 0.00 3.20 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 98 D 7.66 4.50 0.00 2.67 2.63 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 99 G 9.01 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 0.00 100 L 7.40 4.23 0.00 1.64 1.60 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.70 0.00 2.13 1.97 0.00 3.69 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 2.12 2.09 0.00 102 V 9.40 4.83 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 0.95 0.00 0.00 1.01 0.00 0.00 103 V 8.81 4.82 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 1.03 0.00 0.00 0.95 0.00 0.00 104 E 9.06 4.79 0.00 2.08 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 2.15 2.19 0.00 105 V 8.67 4.68 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.79 0.00 0.00 106 H 9.00 4.89 0.00 3.06 3.15 0.00 5.67 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.77 4.06 2.12 0.00 0.00 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 1.65 1.23 1.08 0.00 0.00 108 S 7.98 4.48 0.00 3.76 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 0.00 109 N 8.22 4.62 0.00 2.72 2.86 0.00 0.00 6.62 7.98 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 0.00 110 I 7.99 3.68 1.89 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.02 0.79 0.00 0.00 111 H 8.31 4.17 0.00 3.22 3.27 0.00 5.63 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 7.91 4.50 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 113 R 7.23 4.80 0.00 1.75 1.69 0.00 3.04 0.00 0.00 3.12 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 114 E 8.26 3.88 0.00 1.16 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 2.34 2.26 0.00 115 P 0.00 3.52 0.00 2.09 1.98 0.00 3.45 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 2.05 1.96 0.00 116 F 7.42 4.28 0.00 3.10 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 0.00 117 R 7.10 3.67 0.00 1.72 1.75 0.00 2.95 0.00 0.00 3.11 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.75 0.00 118 H 8.03 4.40 0.00 3.18 3.34 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 H 7.38 4.84 0.00 3.04 3.13 0.00 5.69 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 S 7.77 4.70 0.00 3.79 3.59 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 0.00 121 Y 8.64 4.13 0.00 3.18 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 0.00 122 V 7.70 3.69 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 1.13 0.00 0.00 1.00 0.00 0.00 123 S 7.57 4.31 0.00 4.01 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 0.00 124 Q 7.85 4.14 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.42 0.00 125 R 7.83 4.30 0.00 1.76 1.96 0.00 3.32 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.68 0.00 126 A 7.92 4.15 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 0.00 127 D 8.95 4.56 0.00 2.67 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 0.00 128 G 7.99 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 0.00 0.00 0.00 0.00 129 V 8.32 4.93 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 0.87 0.00 0.00 0.95 0.00 0.00 130 V 8.96 4.58 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 1.15 0.00 0.00 1.02 0.00 0.00 131 A 8.40 4.98 1.23 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 0.00 0.00 132 G 8.94 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 0.00 0.00 0.00 0.00 133 C 8.03 4.54 0.00 3.08 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 0.00 134 G 7.98 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 0.00 0.00 0.00 135 V 8.26 4.00 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 0.93 0.00 0.00 0.96 0.00 0.00 136 Q 7.73 3.95 0.00 1.98 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 1.32 2.05 0.00 137 G 7.92 3.59 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 0.00 138 Y 8.08 4.05 0.00 3.27 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 0.00 139 V 7.78 3.65 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 1.17 0.00 0.00 0.91 0.00 0.00 140 F 7.92 4.68 0.00 3.29 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 0.00 141 G 8.32 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 0.00 142 V 7.93 3.70 2.30 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 1.09 0.00 0.00 1.07 0.00 0.00 143 E 8.64 4.00 0.00 2.39 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 2.45 2.75 0.00 144 R 8.47 3.92 0.00 1.91 1.95 0.00 3.14 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 145 I 8.00 3.72 2.04 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 1.70 0.75 0.93 0.00 0.00 146 A 8.17 4.03 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 0.00 147 A 7.47 4.03 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 0.00 148 L 7.70 4.17 0.00 1.77 1.74 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.55 4.24 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 0.00 150 G 7.86 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 0.00 0.00 0.00