NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4406 0.0000 0.0000 62.2803 32.6370 175.6602 2 I 3.8410 8.1833 120.7812 60.6039 37.7584 170.8052 3 V 4.5438 8.4879 118.8044 59.7135 35.0938 175.3232 4 D 4.9234 8.5178 120.2803 53.1276 39.7970 175.3534 5 T 4.6797 7.4162 114.2739 63.5383 73.5694 176.1830 6 G 3.8357 8.7483 111.1155 46.6584 0.0000 174.6129 7 S 4.6616 8.3350 117.6546 56.6383 65.4684 173.1540 8 V 4.4661 7.8935 116.0911 58.9189 35.0964 175.7881 9 A 4.1003 8.3885 125.3292 51.4022 18.8397 175.8164 10 P 4.3717 0.0000 0.0000 62.6580 32.0234 175.9224 11 L 4.5451 8.0808 119.7694 54.0301 42.7347 177.9058 12 S 4.4909 9.3277 118.7064 57.5733 65.6702 175.2875 13 A 3.9478 8.5788 124.3512 55.3188 18.1292 180.1146 14 A 3.9435 7.9007 118.7779 55.4632 18.5570 179.5642 15 E 3.9692 8.1832 117.1508 59.4804 29.4356 179.6810 16 K 3.9479 8.2774 118.6504 59.7806 32.2136 179.4896 17 T 3.8939 7.8122 115.4171 66.5534 68.3334 176.8786 18 K 4.0182 7.9555 119.8458 59.4581 32.0218 179.2539 19 I 3.8966 7.9780 120.1074 64.8504 37.1566 178.5190 20 R 4.0874 8.3695 118.8675 59.5190 29.6282 179.4307 21 S 4.1389 7.8350 113.3892 61.7409 62.5346 176.3024 22 A 4.1312 8.4709 123.7839 54.6864 17.9268 179.6315 23 W 4.1570 8.9995 127.1960 61.0637 30.9241 178.1749 24 A 4.0038 8.1604 120.7354 54.7971 17.6526 177.7147 25 P 4.1066 0.0000 0.0000 65.6040 31.6995 178.6829 26 V 3.5398 6.8948 113.5608 66.2948 31.2164 177.5517 27 Y 3.8510 7.1045 117.5469 60.2029 38.5538 177.1097 28 S 4.1613 7.6607 113.9833 60.4693 63.3716 174.2186 29 T 4.4688 7.5123 111.2171 59.6611 68.7862 174.8868 30 Y 4.1368 7.5073 121.7585 61.3674 37.6173 177.6518 31 E 4.1991 7.2984 119.6679 59.0274 29.4948 178.9942 32 T 3.9398 7.5274 114.9700 66.0025 69.1075 176.9065 33 S 4.2059 7.9305 117.1307 61.7147 62.8777 176.8251 34 G 3.9108 8.5138 108.4764 48.2356 0.0000 175.7074 35 V 3.6483 7.4114 120.4621 65.6067 31.4341 177.8975 36 D 4.3510 8.2551 118.6584 57.4214 40.7314 178.6786 37 I 3.7780 8.1578 120.7170 64.4538 37.0601 178.3324 38 L 4.1585 8.2474 121.1920 58.1880 41.9877 179.1183 39 V 3.5821 8.3396 118.7550 65.6348 31.4345 177.9889 40 K 3.9498 8.4956 119.8387 59.4909 31.9257 178.4894 41 F 4.2048 8.1371 119.4622 61.2921 39.0958 176.5482 42 F 3.7841 8.5423 120.5839 61.4194 39.0163 177.2556 43 T 3.8003 7.8588 108.3095 64.2634 68.6785 175.6511 44 S 4.5308 7.6268 113.9016 58.0826 65.1369 174.5335 45 T 4.5093 6.9256 118.0042 60.2175 68.9341 172.2541 46 P 4.0623 0.0000 0.0000 65.8471 31.6256 177.9648 47 A 4.0301 7.9651 117.3229 54.7050 18.6999 178.4697 48 A 4.1020 7.7561 117.4475 53.0365 19.0548 179.2917 49 Q 4.2485 7.7717 117.6760 58.6176 28.5171 178.1855 50 E 4.0381 8.0510 116.2245 58.3201 29.6414 177.2668 51 F 4.5150 7.9475 117.1527 57.7629 39.6526 176.2423 52 F 4.5389 8.1857 120.7583 54.4158 38.7179 173.7495 53 P 4.2596 0.0000 0.0000 65.6912 31.6622 178.8987 54 K 4.2771 7.9931 113.7978 58.0887 32.1475 177.2403 55 F 4.9853 8.4282 118.0790 56.7309 39.4640 175.6929 56 K 4.1571 7.9029 121.0320 58.5207 32.3902 175.2682 57 G 4.2938 9.0855 111.0679 45.6629 0.0000 174.3145 58 L 4.1983 7.5692 119.1315 54.9689 42.0705 175.8163 59 T 4.6880 8.2408 112.4262 62.4159 72.0006 175.0077 60 T 4.0000 7.7463 114.0063 60.7608 70.9159 174.8419 61 A 4.0589 8.5279 124.3008 54.9106 18.2291 179.7248 62 D 4.2553 7.9213 116.0106 57.3769 41.7404 177.8483 63 Q 4.0964 8.4081 119.0001 58.9037 28.7390 178.5227 64 L 3.6500 7.5132 119.6657 57.9037 41.5456 179.7817 65 K 3.8890 7.6148 116.2140 58.7546 32.0729 178.4013 66 K 4.3099 7.4769 117.0690 56.0892 33.4651 176.9161 67 S 4.1393 7.5413 115.0923 57.8644 62.9822 174.8636 68 A 4.1550 8.6004 129.0762 54.9313 18.2103 179.5484 69 D 4.5025 7.8480 117.0036 57.5440 40.9093 179.0224 70 V 3.6130 7.6280 118.2430 66.1108 31.5050 178.0733 71 R 4.0123 7.9086 117.4238 59.0017 29.8968 178.9465 72 W 4.7105 8.4492 128.1897 60.9553 30.7744 177.5695 73 H 4.0070 8.5200 118.0254 59.2070 29.2332 177.1280 74 A 4.0983 8.4104 122.6776 55.2751 18.1948 179.5000 75 E 4.1104 8.6338 117.3555 59.5227 29.2850 179.9351 76 R 3.6564 7.5084 117.4243 59.0391 30.5268 178.7693 77 I 3.8546 7.6585 119.5717 64.5655 37.1288 178.4232 78 I 3.9492 8.1183 119.4385 64.1080 37.7931 177.3482 79 N 4.5609 8.1547 116.4261 55.2520 38.4513 177.3616 80 A 3.9287 7.7401 122.4862 55.0003 18.4102 179.7231 81 V 3.3067 7.7165 116.3253 66.0919 31.5480 177.4521 82 N 3.9863 7.9288 116.3971 56.7920 38.4622 176.4894 83 D 4.2265 7.7926 119.0508 57.1236 41.1465 178.3503 84 A 3.9690 7.6228 121.2041 55.1434 18.0975 179.7653 85 V 3.2493 7.6444 116.8780 65.9898 31.2880 177.7246 86 A 4.2423 8.0537 118.6284 53.5917 18.5184 177.9791 87 S 4.6243 7.6324 112.8229 58.2896 63.4655 175.9150 88 M 4.2294 7.5060 120.9250 58.1026 31.6683 177.0590 89 D 4.6557 7.8981 115.8800 54.7199 42.0543 176.2365 90 D 4.7220 8.2758 119.2578 51.3863 41.0505 175.4263 91 T 3.8796 7.8566 116.9139 64.2246 67.7259 174.5709 92 E 3.9025 8.1101 121.1916 59.1344 29.9412 178.3322 93 K 3.9359 8.0485 119.5590 59.5795 32.3083 178.3878 94 M 3.9662 7.9450 118.4970 58.6621 32.0793 178.5099 95 S 4.0129 7.8286 114.8698 61.8070 63.0853 176.1693 96 M 3.9294 7.6936 120.8527 58.5336 31.9092 178.7745 97 K 3.8641 7.8086 118.8404 59.6358 32.3596 178.8342 98 L 3.9661 7.7274 118.6973 57.7269 41.5418 179.6270 99 R 3.9295 8.4780 118.4990 59.0916 29.8717 178.5576 100 D 4.2555 8.0069 117.8747 57.3647 41.3360 178.1637 101 L 3.9982 7.7053 120.3986 57.9474 42.0111 178.8631 102 S 4.1373 8.4616 113.8681 61.2829 62.3873 176.2204 103 G 3.5664 8.0408 108.3510 47.8808 0.0000 175.6931 104 K 3.6306 7.7050 120.5378 59.3457 31.9728 179.2290 105 H 4.3123 8.1757 116.1143 58.6546 28.4196 177.7304 106 A 3.6218 7.5496 121.6754 54.5682 18.4224 179.2880 107 K 4.0725 8.1414 115.6656 57.6990 32.4276 177.4319 108 S 4.5195 7.3637 112.0724 60.1513 64.6850 175.8363 109 F 4.4868 7.3202 117.0672 58.7457 39.4136 175.4369 110 Q 3.4992 7.9304 118.0805 56.9049 25.8336 173.7004 111 V 4.0073 7.7500 109.6453 59.2715 33.8166 176.4821 112 D 4.1888 6.8936 123.2504 53.5358 41.5739 175.3742 113 P 3.2845 0.0000 0.0000 64.7854 30.8259 178.2411 114 Q 3.8460 7.5633 117.1674 59.0111 28.7417 177.3544 115 Y 4.2841 7.0259 116.4106 59.3261 37.9648 177.3077 116 F 4.4180 7.1264 118.7958 60.8370 39.1274 177.8038 117 K 4.0402 8.1070 117.4674 59.6849 32.0355 179.2302 118 V 3.6804 7.7184 119.1575 65.9559 31.6490 177.6601 119 L 3.7513 8.0609 119.9020 57.8328 41.7674 178.5174 120 A 4.0215 8.2746 120.7602 55.1526 18.1659 179.4367 121 A 4.0028 8.1908 119.1385 55.4064 18.4892 180.0180 122 V 3.6413 7.6404 116.1531 66.3161 31.6308 178.3304 123 I 3.8940 8.0746 119.3760 64.2662 36.8901 178.3478 124 A 4.3513 8.3915 121.8396 55.2411 18.0519 179.3192 125 D 4.3315 8.2785 116.6059 57.9339 41.0476 178.8652 126 T 4.0177 7.6333 114.5508 66.6444 68.5513 176.6924 127 V 3.7375 7.6424 118.2913 64.6575 33.2717 177.0966 128 A 4.5157 7.6753 121.0556 50.1624 20.1874 174.2578 129 A 4.1539 7.8686 123.2151 53.3388 19.2647 177.4902 130 G 4.1332 9.0029 111.1787 45.7939 0.0000 174.1342 131 D 4.3928 7.9564 119.4694 54.2844 42.1057 176.8544 132 A 4.1599 8.7817 129.3299 54.9113 18.6281 179.3255 133 G 3.6908 8.1717 103.9557 48.2547 0.0000 175.5108 134 F 4.0722 8.6984 123.5351 60.8110 39.5046 177.0459 135 E 4.0624 8.1266 118.3348 58.9199 29.2113 179.2198 136 K 3.9242 8.0609 120.1541 59.2694 32.2565 178.6918 137 L 3.7954 7.5788 120.5922 58.3031 41.9100 178.8909 138 M 3.9133 7.7357 118.6330 58.0271 31.7695 178.9801 139 S 4.3163 7.6241 116.5716 61.1936 63.0054 176.3976 140 M 3.9688 7.8031 121.2699 58.5389 31.6654 178.9080 141 I 3.5771 7.3729 119.3252 64.5408 37.0932 178.3988 142 C 3.9982 8.1265 117.5795 62.7112 27.7358 176.1386 143 I 3.8350 7.8626 120.8747 64.4830 36.9946 178.2272 144 L 4.1001 7.9801 119.7693 57.5935 41.2422 179.4031 145 L 3.8701 7.8043 117.8526 56.6099 41.5590 178.5393 146 R 4.7858 7.5299 117.1150 56.1911 30.3434 178.1026 147 S 4.2075 7.9667 114.7372 60.9278 63.0133 175.0249 148 A 4.2323 8.2588 124.3598 53.5095 19.0773 176.7485 149 Y 4.1616 7.8377 118.0292 58.2974 37.9206 175.4183 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 4.44 0.00 2.20 2.14 0.00 3.73 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 2.00 0.00 2 I 8.18 3.84 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 1.42 0.68 0.90 0.00 0.00 3 V 8.49 4.54 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 0.79 0.00 0.00 0.91 0.00 0.00 4 D 8.52 4.92 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 5 T 7.42 4.68 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 1.20 0.00 0.00 6 G 8.75 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.34 4.66 0.00 3.76 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 8 V 7.89 4.47 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 0.75 0.00 0.00 0.88 0.00 0.00 9 A 8.39 4.10 1.22 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 0.00 0.00 0.00 10 P 0.00 4.37 0.00 2.03 2.00 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 11 L 8.08 4.55 0.00 1.59 1.56 0.84 0.82 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 12 S 9.33 4.49 0.00 3.99 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 13 A 8.58 3.95 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 14 A 7.90 3.94 1.33 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 15 E 8.18 3.97 0.00 2.17 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 2.34 2.36 0.00 16 K 8.28 3.95 0.00 1.94 1.86 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.69 7.81 17 T 7.81 3.89 4.44 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 0.00 0.00 0.00 1.24 0.00 0.00 18 K 7.96 4.02 0.00 2.02 1.91 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.71 7.81 19 I 7.98 3.90 2.11 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 1.79 1.02 1.01 0.00 0.00 20 R 8.37 4.09 0.00 2.04 2.08 0.00 3.16 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.99 0.00 21 S 7.84 4.14 0.00 4.11 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 22 A 8.47 4.13 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 23 W 9.00 4.16 0.00 3.61 3.31 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 24 A 8.16 4.00 1.47 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 25 P 0.00 4.11 0.00 1.98 2.08 0.00 3.86 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 2.02 2.13 0.00 26 V 6.89 3.54 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 0.71 0.00 0.00 0.86 0.00 0.00 27 Y 7.10 3.85 0.00 1.86 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 28 S 7.66 4.16 0.00 4.10 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 29 T 7.51 4.47 4.09 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 0.00 0.00 0.00 1.10 0.00 0.00 30 Y 7.51 4.14 0.00 3.14 3.12 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 0.00 0.00 0.00 31 E 7.30 4.20 0.00 1.86 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 1.67 2.00 0.00 32 T 7.53 3.94 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 1.22 0.00 0.00 33 S 7.93 4.21 0.00 3.88 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 34 G 8.51 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 35 V 7.41 3.65 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 0.99 0.00 0.00 1.09 0.00 0.00 36 D 8.26 4.35 0.00 2.91 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 37 I 8.16 3.78 2.11 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.22 1.03 0.00 0.00 38 L 8.25 4.16 0.00 1.92 1.77 1.10 0.89 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 39 V 8.34 3.58 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 0.94 0.00 0.00 0.94 0.00 0.00 40 K 8.50 3.95 0.00 2.04 2.05 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.49 7.81 41 F 8.14 4.20 0.00 3.15 3.42 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 42 F 8.54 3.78 0.00 2.96 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 43 T 7.86 3.80 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 1.33 0.00 0.00 44 S 7.63 4.53 0.00 4.04 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 45 T 6.93 4.51 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 1.25 0.00 0.00 46 P 0.00 4.06 0.00 2.06 2.00 0.00 3.50 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 47 A 7.97 4.03 1.44 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 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.76 4.10 0.67 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 0.00 0.00 49 Q 7.77 4.25 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.77 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 50 E 8.05 4.04 0.00 1.83 1.90 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 1.55 1.47 0.00 51 F 7.95 4.52 0.00 3.09 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 52 F 8.19 4.54 0.00 3.09 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 0.00 0.00 0.00 53 P 0.00 4.26 0.00 2.16 2.13 0.00 3.49 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 54 K 7.99 4.28 0.00 1.81 2.19 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.45 7.81 55 F 8.43 4.99 0.00 3.08 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 K 7.90 4.16 0.00 1.83 1.84 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.55 1.74 7.81 57 G 9.09 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 58 L 7.57 4.20 0.00 1.77 1.50 0.83 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 59 T 8.24 4.69 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 1.26 0.00 0.00 60 T 7.75 4.00 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 1.25 0.00 0.00 61 A 8.53 4.06 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 62 D 7.92 4.26 0.00 2.67 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 63 Q 8.41 4.10 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 64 L 7.51 3.65 0.00 1.66 1.43 0.87 0.72 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 65 K 7.61 3.89 0.00 1.72 1.86 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.67 7.81 66 K 7.48 4.31 0.00 1.86 1.82 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.50 7.81 67 S 7.54 4.14 0.00 3.73 3.63 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 68 A 8.60 4.15 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 69 D 7.85 4.50 0.00 2.93 3.06 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 70 V 7.63 3.61 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 0.72 0.00 0.00 -0.17 0.00 0.00 71 R 7.91 4.01 0.00 2.02 2.25 0.00 3.21 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 72 W 8.45 4.71 0.00 3.48 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 73 H 8.52 4.01 0.00 3.59 3.65 0.00 5.66 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 74 A 8.41 4.10 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 0.00 0.00 0.00 0.00 0.00 75 E 8.63 4.11 0.00 2.48 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 2.82 2.62 0.00 76 R 7.51 3.66 0.00 1.53 1.68 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 77 I 7.66 3.85 1.95 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.42 0.97 0.00 0.00 78 I 8.12 3.95 2.24 0.00 0.00 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 1.75 1.80 1.15 0.00 0.00 79 N 8.15 4.56 0.00 2.92 2.80 0.00 0.00 6.79 8.38 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 80 A 7.74 3.93 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 81 V 7.72 3.31 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 0.51 0.00 0.00 0.93 0.00 0.00 82 N 7.93 3.99 0.00 2.88 2.81 0.00 0.00 7.26 9.28 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 83 D 7.79 4.23 0.00 2.81 2.64 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 84 A 7.62 3.97 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 85 V 7.64 3.25 1.70 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 0.82 0.00 0.00 -0.02 0.00 0.00 86 A 8.05 4.24 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 87 S 7.63 4.62 0.00 3.88 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 M 7.51 4.23 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.40 0.00 89 D 7.90 4.66 0.00 2.64 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 90 D 8.28 4.72 0.00 2.56 2.44 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 0.00 0.00 0.00 0.00 91 T 7.86 3.88 4.20 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 1.18 0.00 0.00 92 E 8.11 3.90 0.00 2.05 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 2.35 2.33 0.00 93 K 8.05 3.94 0.00 1.92 1.89 0.00 1.67 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.41 7.81 94 M 7.94 3.97 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 95 S 7.83 4.01 0.00 4.00 3.84 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 0.00 0.00 0.00 0.00 96 M 7.69 3.93 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.54 0.00 97 K 7.81 3.86 0.00 1.98 1.75 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.46 7.81 98 L 7.73 3.97 0.00 1.75 1.58 0.79 0.90 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 99 R 8.48 3.93 0.00 1.75 1.94 0.00 3.09 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.82 0.00 100 D 8.01 4.26 0.00 2.91 2.79 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 0.00 101 L 7.71 4.00 0.00 1.97 1.82 1.04 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 102 S 8.46 4.14 0.00 3.97 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 0.00 103 G 8.04 3.57 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 0.00 0.00 0.00 104 K 7.70 3.63 0.00 1.73 1.03 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.26 1.54 7.81 105 H 8.18 4.31 0.00 3.67 3.86 0.00 5.80 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 0.00 106 A 7.55 3.62 0.36 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 0.00 107 K 8.14 4.07 0.00 1.58 1.75 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.30 7.81 108 S 7.36 4.52 0.00 3.22 3.69 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 0.00 109 F 7.32 4.49 0.00 3.01 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 0.00 110 Q 7.93 3.50 0.00 2.30 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.78 0.00 0.00 0.00 0.00 0.00 2.32 2.55 0.00 111 V 7.75 4.01 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 0.74 0.00 0.00 1.04 0.00 0.00 112 D 6.89 4.19 0.00 2.32 2.37 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 0.00 113 P 0.00 3.28 0.00 1.74 0.49 0.00 3.48 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.50 0.00 114 Q 7.56 3.85 0.00 1.88 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 7.02 0.00 0.00 0.00 0.00 0.00 1.71 1.16 0.00 115 Y 7.03 4.28 0.00 3.08 3.28 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 0.00 116 F 7.13 4.42 0.00 3.08 2.93 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 0.00 117 K 8.11 4.04 0.00 2.00 2.09 0.00 1.50 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.49 7.81 118 V 7.72 3.68 2.64 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 1.44 0.00 0.00 1.06 0.00 0.00 119 L 8.06 3.75 0.00 0.47 1.47 0.77 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.27 4.02 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 0.00 121 A 8.19 4.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.64 3.64 2.34 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 1.21 0.00 0.00 1.19 0.00 0.00 123 I 8.07 3.89 2.22 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 1.61 1.03 1.29 0.00 0.00 124 A 8.39 4.35 1.61 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 0.00 125 D 8.28 4.33 0.00 2.85 2.79 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 0.00 126 T 7.63 4.02 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 1.23 0.00 0.00 127 V 7.64 3.74 1.47 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 0.64 0.00 0.00 1.32 0.00 0.00 128 A 7.68 4.52 1.01 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 0.00 129 A 7.87 4.15 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 0.00 130 G 9.00 4.13 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 0.00 131 D 7.96 4.39 0.00 2.86 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 0.00 132 A 8.78 4.16 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 0.00 133 G 8.17 3.69 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 0.00 134 F 8.70 4.07 0.00 3.32 3.12 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 0.00 0.00 0.00 135 E 8.13 4.06 0.00 2.24 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 2.42 2.63 0.00 136 K 8.06 3.92 0.00 1.91 1.95 0.00 1.60 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.40 7.81 137 L 7.58 3.80 0.00 1.49 1.30 0.38 0.77 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 0.00 138 M 7.74 3.91 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.30 0.00 139 S 7.62 4.32 0.00 4.03 3.85 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 0.00 0.00 0.00 140 M 7.80 3.97 0.00 1.99 2.13 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 2.73 2.51 0.00 141 I 7.37 3.58 1.86 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.56 0.73 0.00 0.00 142 C 8.13 4.00 0.00 2.93 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 0.00 143 I 7.86 3.84 1.94 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 1.48 0.56 0.92 0.00 0.00 144 L 7.98 4.10 0.00 1.58 1.62 0.83 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 145 L 7.80 3.87 0.00 1.20 0.34 0.28 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 146 R 7.53 4.79 0.00 1.82 1.99 0.00 3.30 0.00 0.00 3.47 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.93 0.00 147 S 7.97 4.21 0.00 4.03 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 0.00 148 A 8.26 4.23 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 0.00 149 Y 7.84 4.16 0.00 3.10 2.93 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