NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3039 8.2649 123.5820 52.4561 20.1832 175.0491 2 T 4.3304 8.0909 111.1042 61.9386 70.1346 170.0357 3 V 3.5868 9.3496 121.5428 65.2887 32.3221 178.2814 4 N 4.3163 8.1420 115.0101 56.4988 38.2650 177.2485 5 Q 4.0455 7.7849 117.9829 58.1459 28.9600 178.2485 6 L 4.3305 7.9908 120.2684 56.9453 42.2029 178.7151 7 V 3.6196 7.8793 116.6657 65.8216 31.1643 177.4054 8 R 4.1238 7.5293 114.6127 58.4024 29.6670 177.7491 9 K 4.5342 7.6710 119.2553 53.3125 32.9246 173.6424 10 P 4.3092 0.0000 0.0000 63.1646 32.1530 176.4804 11 R 4.0478 8.3795 119.2224 56.9372 30.6092 175.8513 12 A 4.7143 7.9072 120.3465 50.6736 22.2242 176.3585 13 R 4.1033 8.3232 119.5357 55.5401 30.9616 177.1695 14 K 4.0611 8.3697 123.3523 54.7903 31.1628 175.5570 15 V 3.4439 8.3987 126.1205 62.6387 31.2002 175.6394 16 A 4.1012 8.3998 130.8617 51.6886 18.8756 176.6508 17 K 4.1008 8.4535 122.2576 55.7251 33.3960 176.6600 18 S 4.1192 8.6282 119.2139 58.1642 61.6530 173.9198 19 N 4.5065 8.6563 122.0910 53.6743 36.5180 176.1013 20 V 4.3149 7.8625 119.7910 60.7285 32.0257 173.1349 21 P 4.3455 0.0000 0.0000 65.4403 31.8790 180.3125 22 A 3.6895 8.2764 123.0122 51.3418 16.8167 176.9183 23 L 4.3741 7.2388 121.4171 55.6054 45.1366 176.3504 24 E 3.5560 8.6028 115.2373 57.3901 26.9807 177.1291 25 A 3.7238 8.0815 119.2321 53.2595 18.1053 178.2401 26 C 4.2783 8.0425 114.9896 58.9164 27.9912 172.8949 27 P 4.4117 0.0000 0.0000 64.1018 31.1043 175.9701 28 Q 4.7532 6.8791 115.1207 56.0772 31.5345 173.2279 29 K 4.6597 7.7676 118.4242 54.7346 37.4218 177.4147 30 R 4.0045 8.3019 121.9307 57.1901 32.2475 173.8012 31 G 4.4632 7.6867 105.0268 44.9376 0.0000 171.8667 32 V 4.2976 8.0734 113.8047 62.3025 35.9321 173.1485 33 C 3.6559 8.2036 119.1643 59.7163 24.0546 172.4876 34 T 3.9407 9.1986 120.5844 65.4588 68.7911 175.0418 35 R 4.5337 6.8291 119.8261 56.1304 32.5261 172.8098 36 V 4.7163 7.8851 114.6191 59.8978 34.9058 175.0982 37 Y 4.6501 8.4283 119.5229 57.3785 41.5876 174.0850 38 T 4.9135 8.9273 116.1760 61.9546 71.0172 174.0930 39 T 4.5365 8.3112 118.2835 60.8178 71.9468 173.3967 40 T 4.9593 8.1761 110.8746 59.3983 71.4985 173.4564 41 P 4.7610 0.0000 0.0000 62.1809 34.2375 176.7341 42 K 4.4173 8.5950 123.7755 57.0795 30.4149 177.4207 43 K 4.4526 9.2078 114.6328 57.2509 34.5254 176.2169 44 P 4.3619 0.0000 0.0000 64.5066 31.5865 175.3395 45 N 5.0307 7.1607 112.8727 51.8349 41.3947 173.1402 46 S 4.1787 7.7736 113.8369 58.5021 65.4630 169.4803 47 A 3.6542 8.7087 133.6174 52.2908 18.5553 177.6255 48 L 5.0798 8.2449 122.6470 54.2068 40.6603 176.8394 49 R 4.4469 8.5666 124.3150 56.1737 32.2561 175.2998 50 K 4.8220 8.5456 119.0524 54.9922 34.6105 176.0840 51 V 5.0714 8.3575 123.5566 61.6109 35.9461 173.3413 52 C 4.9397 9.1017 115.5301 57.2917 33.2633 173.3501 53 R 4.7554 9.3571 123.1301 54.9604 30.0398 174.0909 54 V 4.5282 8.3275 124.6683 61.2822 34.0482 174.1635 55 R 4.7259 8.4087 127.3593 54.7776 31.5646 176.0296 56 L 4.7958 8.7307 125.9438 53.8286 42.5322 178.1744 57 T 3.9201 8.4100 110.5537 64.4739 69.0492 174.5403 58 N 4.7040 8.2420 118.7553 52.4010 37.5717 176.0166 59 G 3.9232 7.9581 104.6986 46.9720 0.0000 174.9974 60 F 4.1789 7.5998 121.1580 56.0620 38.3779 175.9235 61 E 3.9536 7.8250 120.8656 57.2330 30.2328 175.8175 62 V 4.6102 8.6354 124.1190 60.9835 35.6998 173.0170 63 T 5.0528 8.5810 114.3679 60.6466 69.5618 172.7841 64 S 5.7126 9.6689 122.2262 55.8262 66.9131 171.8576 65 Y 4.5400 8.4433 123.1786 56.3454 41.2104 174.1920 66 I 4.8046 5.8764 123.0306 58.3823 36.8494 175.8600 67 G 4.0788 8.2965 114.4843 46.4431 0.0000 171.5440 68 G 4.0986 8.9643 104.2510 45.1933 0.0000 173.1131 69 E 4.0217 8.4062 119.2759 56.4462 30.0484 177.5477 70 G 3.9777 8.9610 113.9456 45.1295 0.0000 172.1532 71 H 4.4613 7.7582 110.5137 55.1530 30.0793 173.8113 72 N 4.5362 8.8991 119.2257 53.4100 39.2618 174.3475 73 L 3.9478 7.9154 117.0873 56.4367 42.9503 175.9346 74 Q 4.5637 8.0556 125.9357 55.9877 26.5794 175.1871 75 E 4.4846 8.3217 112.5435 58.0985 32.4722 176.5411 76 H 4.4440 7.9143 117.6276 57.0059 29.3095 175.8432 77 S 4.1815 7.4236 114.5089 58.7331 62.6794 174.6900 78 V 4.1111 8.4737 125.1879 62.6368 32.5797 174.4483 79 I 4.8910 8.0794 117.8780 59.5576 42.2046 173.0713 80 L 4.9071 8.2418 123.9716 53.0227 43.7663 175.1669 81 I 3.9461 8.8408 128.5352 61.8023 38.6700 175.5974 82 R 4.0969 10.0733 130.2764 59.5121 30.8088 175.1270 83 G 3.9267 9.6492 105.3716 44.8035 0.0000 168.2233 84 G 4.1132 8.5959 118.9684 44.8702 0.0000 173.9540 85 R 4.4136 8.0609 120.8191 54.5021 31.9798 174.1944 86 V 4.3289 7.8014 116.2199 62.2396 34.3903 173.9640 87 K 4.3528 8.1028 117.7773 58.1501 33.7384 177.9378 88 D 4.0093 7.9822 117.9572 56.3489 40.4760 176.4244 89 L 4.4920 7.2808 119.7111 52.0253 41.6469 174.0155 90 P 4.4511 0.0000 0.0000 63.6743 32.1929 175.3625 91 G 4.2322 9.0431 113.1418 45.7416 0.0000 172.9743 92 V 3.6945 6.8905 119.6678 63.4546 30.4041 175.5915 93 R 4.4668 8.3675 122.9481 55.6100 30.6944 175.6243 94 Y 5.0539 7.4712 114.9546 56.7167 42.8133 173.4003 95 H 5.6365 9.5094 120.5303 53.4519 33.9029 172.2226 96 T 4.5786 8.2977 114.9075 60.6142 69.7733 174.5463 97 V 3.7814 8.2346 127.2770 62.7409 31.7824 176.2462 98 R 4.1604 8.7864 127.2869 56.5965 31.2110 175.9711 99 G 3.8934 8.6657 105.1278 45.7587 0.0000 173.9747 100 A 4.4524 8.3906 117.6347 51.8658 24.0778 176.0325 101 L 3.6880 9.1532 123.4174 55.2247 40.1134 175.0766 102 D 4.7514 6.0500 122.1268 56.0413 43.9833 177.0217 103 C 4.2319 7.9102 120.0982 59.1543 32.0751 172.6776 104 S 4.7930 8.4708 121.6977 57.2367 64.0640 173.8705 105 G 4.5511 8.1889 109.2050 45.1081 0.0000 173.1451 106 V 3.9561 8.4670 113.5051 61.8249 32.4209 175.9178 107 K 4.4611 8.2716 120.5042 55.1600 34.3055 176.2687 108 D 4.2630 8.6451 124.1980 55.5493 38.2563 174.8704 109 R 4.2986 7.9040 118.8161 55.0280 29.9205 177.5350 110 K 4.4233 7.8739 128.6094 54.6277 32.0047 177.7047 111 Q 4.2327 8.0292 113.5704 56.5195 32.2222 172.8154 112 A 3.8171 8.4877 129.0286 53.3170 15.9588 179.0314 113 R 4.1436 8.1969 120.0163 59.9359 30.7712 178.8576 114 S 4.2282 8.3247 113.6589 61.5173 62.8196 174.9435 115 K 4.1675 7.5013 117.8255 56.0880 34.1632 179.5598 116 Y 3.4306 7.9278 120.7261 58.5515 36.7031 174.1227 117 G 4.4573 8.9547 126.3226 46.7140 0.0000 172.8370 118 V 4.3252 8.0072 120.6536 59.9128 33.3315 174.8887 119 K 4.1416 8.4789 125.4434 56.3106 31.4178 173.5208 120 R 3.6988 8.4621 130.0347 55.0682 29.6166 174.6220 121 P 4.3303 0.0000 0.0000 64.1872 31.6645 177.1469 122 K 4.1932 8.0167 115.7985 55.2108 35.9831 175.1543 123 A 4.0508 8.1485 128.1597 52.9881 18.5937 177.1150 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 A 8.26 4.30 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 2 T 8.09 4.33 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 1.24 0.00 0.00 3 V 9.35 3.59 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 0.86 0.00 0.00 0.93 0.00 0.00 4 N 8.14 4.32 0.00 2.80 2.87 0.00 0.00 6.97 7.46 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 5 Q 7.78 4.05 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 6 L 7.99 4.33 0.00 1.88 1.69 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.88 3.62 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 0.89 0.00 0.00 0.97 0.00 0.00 8 R 7.53 4.12 0.00 1.94 2.04 0.00 3.18 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.62 0.00 9 K 7.67 4.53 0.00 1.82 1.80 0.00 1.52 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.45 7.81 10 P 0.00 4.31 0.00 2.06 2.05 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.26 0.00 11 R 8.38 4.05 0.00 1.79 1.90 0.00 3.34 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 12 A 7.91 4.71 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.32 4.10 0.00 1.81 1.86 0.00 3.20 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 14 K 8.37 4.06 0.00 1.71 1.76 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.42 7.81 15 V 8.40 3.44 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 0.83 0.00 0.00 0.93 0.00 0.00 16 A 8.40 4.10 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 17 K 8.45 4.10 0.00 1.88 1.85 0.00 1.59 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.42 7.81 18 S 8.63 4.12 0.00 3.88 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 19 N 8.66 4.51 0.00 2.80 2.88 0.00 0.00 5.96 7.68 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 20 V 7.86 4.31 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 1.05 0.00 0.00 0.84 0.00 0.00 21 P 0.00 4.35 0.00 2.58 2.33 0.00 3.99 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 2.35 2.19 0.00 22 A 8.28 3.69 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 23 L 7.24 4.37 0.00 1.67 1.80 0.97 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.60 3.56 0.00 2.07 1.88 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 2.21 2.11 0.00 25 A 8.08 3.72 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 26 C 8.04 4.28 0.00 3.12 3.03 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.41 0.00 2.18 2.18 0.00 3.82 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 1.99 1.95 0.00 28 Q 6.88 4.75 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.74 0.00 0.00 0.00 0.00 0.00 2.10 2.31 0.00 29 K 7.77 4.66 0.00 1.71 1.63 0.00 1.65 0.00 0.00 1.53 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.29 1.42 7.81 30 R 8.30 4.00 0.00 1.89 1.84 0.00 3.20 0.00 0.00 3.34 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 31 G 7.69 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 0.00 0.00 0.00 0.00 32 V 8.07 4.30 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 0.84 0.00 0.00 1.00 0.00 0.00 33 C 8.20 3.66 0.00 3.29 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 34 T 9.20 3.94 4.39 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 1.24 0.00 0.00 35 R 6.83 4.53 0.00 1.86 1.76 0.00 3.12 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.37 0.00 36 V 7.89 4.72 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 0.74 0.00 0.00 0.97 0.00 0.00 37 Y 8.43 4.65 0.00 3.01 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 38 T 8.93 4.91 4.36 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 1.37 0.00 0.00 39 T 8.31 4.54 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 1.22 0.00 0.00 40 T 8.18 4.96 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 41 P 0.00 4.76 0.00 2.20 2.16 0.00 3.78 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 42 K 8.60 4.42 0.00 1.72 1.11 0.00 1.70 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.45 7.81 43 K 9.21 4.45 0.00 1.80 1.76 0.00 1.71 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.37 7.81 44 P 0.00 4.36 0.00 2.17 2.18 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 45 N 7.16 5.03 0.00 2.72 2.80 0.00 0.00 6.75 7.45 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 46 S 7.77 4.18 0.00 3.80 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 47 A 8.71 3.65 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 48 L 8.24 5.08 0.00 1.77 1.77 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 49 R 8.57 4.45 0.00 2.03 2.43 0.00 3.26 0.00 0.00 3.46 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.97 0.00 50 K 8.55 4.82 0.00 1.52 1.63 0.00 1.52 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.49 7.81 51 V 8.36 5.07 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 1.17 0.00 0.00 1.09 0.00 0.00 52 C 9.10 4.94 0.00 2.95 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 R 9.36 4.76 0.00 1.89 1.87 0.00 3.09 0.00 0.00 3.12 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.57 0.00 54 V 8.33 4.53 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 0.88 0.00 0.00 0.92 0.00 0.00 55 R 8.41 4.73 0.00 1.93 1.78 0.00 3.31 0.00 0.00 3.34 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 56 L 8.73 4.80 0.00 1.83 1.58 0.83 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.41 3.92 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 1.20 0.00 0.00 58 N 8.24 4.70 0.00 2.96 3.06 0.00 0.00 6.18 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 59 G 7.96 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 0.00 0.00 0.00 60 F 7.60 4.18 0.00 2.99 2.98 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 61 E 7.83 3.95 0.00 1.94 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 62 V 8.64 4.61 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 0.50 0.00 0.00 1.18 0.00 0.00 63 T 8.58 5.05 4.30 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 1.30 0.00 0.00 64 S 9.67 5.71 0.00 3.91 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 65 Y 8.44 4.54 0.00 3.11 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 66 I 5.88 4.80 1.52 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.50 0.77 0.00 0.00 67 G 8.30 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 68 G 8.96 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 69 E 8.41 4.02 0.00 1.91 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 70 G 8.96 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 0.00 0.00 0.00 71 H 7.76 4.46 0.00 3.14 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.90 4.54 0.00 2.71 2.87 0.00 0.00 7.03 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.92 3.95 0.00 1.46 1.57 0.79 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.06 4.56 0.00 2.03 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 75 E 8.32 4.48 0.00 1.87 1.66 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 2.21 2.14 0.00 76 H 7.91 4.44 0.00 3.15 3.33 0.00 5.71 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 77 S 7.42 4.18 0.00 3.91 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 78 V 8.47 4.11 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 1.05 0.00 0.00 0.94 0.00 0.00 79 I 8.08 4.89 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 1.21 0.57 0.90 0.00 0.00 80 L 8.24 4.91 0.00 1.77 1.58 0.99 0.75 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 81 I 8.84 3.95 1.81 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.20 0.94 0.00 0.00 82 R 10.07 4.10 0.00 1.86 2.24 0.00 3.27 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 83 G 9.65 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 84 G 8.60 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.06 4.41 0.00 1.92 1.86 0.00 2.52 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.50 0.00 86 V 7.80 4.33 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 0.58 0.00 0.00 0.82 0.00 0.00 87 K 8.10 4.35 0.00 1.79 1.66 0.00 1.64 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.45 7.81 88 D 7.98 4.01 0.00 2.67 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 89 L 7.28 4.49 0.00 1.49 1.64 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.45 0.00 2.18 2.05 0.00 3.80 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 91 G 9.04 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 0.00 0.00 0.00 0.00 92 V 6.89 3.69 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 1.10 0.00 0.00 1.04 0.00 0.00 93 R 8.37 4.47 0.00 1.51 1.24 0.00 3.32 0.00 0.00 3.09 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.47 0.00 94 Y 7.47 5.05 0.00 3.05 2.82 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 95 H 9.51 5.64 0.00 3.30 3.19 0.00 5.62 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.30 4.58 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 97 V 8.23 3.78 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 0.76 0.00 0.00 1.00 0.00 0.00 98 R 8.79 4.16 0.00 2.05 1.94 0.00 3.89 0.00 0.00 3.50 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 99 G 8.67 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.39 4.45 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 0.00 101 L 9.15 3.69 0.00 1.80 1.56 0.92 1.01 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 0.00 102 D 6.05 4.75 0.00 2.71 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 0.00 103 C 7.91 4.23 0.00 2.95 2.82 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 0.00 104 S 8.47 4.79 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 0.00 105 G 8.19 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.47 3.96 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 0.46 0.00 0.00 0.87 0.00 0.00 107 K 8.27 4.46 0.00 1.55 1.68 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.48 7.81 108 D 8.65 4.26 0.00 2.77 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 0.00 109 R 7.90 4.30 0.00 1.70 1.80 0.00 3.23 0.00 0.00 3.01 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.17 0.00 110 K 7.87 4.42 0.00 1.73 1.79 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.39 7.81 111 Q 8.03 4.23 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 112 A 8.49 3.82 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.20 4.14 0.00 1.86 2.25 0.00 3.28 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.69 0.00 114 S 8.32 4.23 0.00 3.86 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 0.00 115 K 7.50 4.17 0.00 1.38 0.74 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.20 1.23 7.81 116 Y 7.93 3.43 0.00 3.14 2.40 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 0.00 117 G 8.95 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 0.00 0.00 0.00 0.00 118 V 8.01 4.33 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 1.10 0.00 0.00 119 K 8.48 4.14 0.00 1.87 1.88 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.47 7.81 120 R 8.46 3.70 0.00 1.98 1.96 0.00 3.22 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 121 P 0.00 4.33 0.00 2.17 2.11 0.00 3.81 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 1.99 1.96 0.00 122 K 8.02 4.19 0.00 1.83 1.88 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.39 7.81 123 A 8.15 4.05 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