NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4418 8.3049 120.3126 55.4334 32.8417 174.3594 2 K 4.2676 8.0168 121.2607 55.5219 34.4360 175.7882 3 K 5.1818 9.5258 119.9954 55.0113 36.3791 175.3644 4 I 5.1722 8.8387 122.7712 59.5755 41.3733 174.0919 5 A 4.9397 8.9393 128.6882 51.0534 20.4027 175.7365 6 F 5.1380 9.4251 125.8358 56.4770 42.1365 174.6865 7 G 4.3189 7.6450 111.4727 45.0473 0.0000 170.9979 8 C 5.2311 8.5412 115.2793 57.8771 33.6587 173.7731 9 D 4.8198 8.0718 119.8735 52.3027 41.5744 176.3387 10 H 4.1717 8.7471 114.0272 58.9082 28.2980 177.0616 11 V 3.8962 7.6059 120.5911 65.5216 31.6854 178.0983 12 G 3.5410 8.4956 105.4527 47.4969 0.0000 175.0664 13 F 4.1550 8.3157 123.2218 61.4204 38.9715 177.1585 14 I 3.5738 7.4441 111.4276 63.1122 37.4228 177.1228 15 L 4.4266 7.7920 119.2151 54.7482 42.0583 177.8370 16 K 3.6715 7.7202 120.9832 60.1424 32.0336 178.0343 17 H 4.1177 7.4679 115.3644 58.9746 28.7400 177.6942 18 E 3.9857 7.9307 119.8380 59.3096 29.3961 179.2786 19 I 3.7505 7.9251 120.1049 64.2018 37.1460 178.4880 20 V 3.3727 7.8972 119.3222 65.9538 31.2331 177.8652 21 A 3.9439 7.9462 120.3250 55.4931 18.2170 179.0499 22 H 4.0975 8.2510 116.6964 59.3580 29.8921 177.5408 23 L 3.9962 8.1384 120.8654 57.6650 41.4198 179.5783 24 V 3.7092 7.9191 118.2615 66.1200 31.2830 177.5032 25 E 3.9558 8.2610 118.0101 59.3985 29.4806 178.2740 26 R 4.2515 7.7511 114.9829 56.3106 30.2228 177.1897 27 G 3.8922 8.2529 107.6097 45.5690 0.0000 173.5172 28 V 4.4957 7.5511 112.1583 59.4962 33.4583 175.3688 29 E 4.2653 9.0310 126.4082 55.7284 30.7263 175.1114 30 V 4.6385 8.4293 127.2497 61.6556 33.2561 174.7605 31 I 4.4005 9.0867 129.5073 59.8039 38.8354 174.2659 32 D 5.0496 8.8598 128.1085 53.6338 41.5241 175.9534 33 K 4.4872 9.5448 125.4421 56.1932 33.1573 177.2724 34 G 2.0000 8.5910 108.6614 43.8445 0.0000 172.7139 35 T 3.6936 6.8945 113.9510 60.9731 68.0869 174.0437 36 W 4.8159 8.3813 119.6028 56.1153 30.2655 174.9624 37 S 3.8561 6.7597 112.0440 57.0650 65.0262 173.8716 38 S 4.4303 8.1826 112.7106 58.2869 62.8211 173.8085 39 E 3.9678 7.7424 122.8668 55.8023 29.8212 176.4901 40 R 3.3134 8.3834 125.5470 57.3207 30.3071 175.0871 41 T 4.6341 7.9367 117.4514 61.2343 70.3036 171.7126 42 D 4.9381 8.5313 124.1642 52.7210 42.4601 177.6208 43 Y 4.2234 8.5700 123.0847 59.8090 38.0114 176.6168 44 P 4.2695 0.0000 0.0000 65.5134 31.3881 177.7630 45 H 3.9521 7.6041 116.8086 59.6042 29.6566 176.9230 46 Y 3.9268 7.7127 117.5699 60.4321 37.8210 177.3645 47 A 3.9429 8.0104 121.9519 55.4983 18.4804 179.7554 48 S 3.5721 8.1120 113.1962 61.7429 63.0385 176.9162 49 Q 3.8474 7.6702 120.3860 58.9824 28.5038 179.3733 50 V 3.4747 7.6365 118.6948 65.9351 31.5865 177.8185 51 A 3.8046 8.0159 120.8741 55.1186 18.0167 179.5539 52 L 3.7882 7.9488 117.4786 57.8330 41.4605 179.6958 53 A 4.2042 7.7118 121.5848 54.4514 18.4158 179.9838 54 V 3.5415 7.8942 116.5622 66.1244 31.4784 178.2164 55 A 4.1426 8.1813 119.8027 54.9836 18.3633 179.1986 56 G 3.7702 8.2699 101.7466 45.1048 0.0000 174.7802 57 G 3.9884 8.0242 109.4797 45.4929 0.0000 175.1737 58 E 3.9827 7.8545 118.2011 57.7474 29.9473 176.8242 59 V 4.5680 7.0099 117.6691 60.4577 34.5068 174.2847 60 D 4.5423 8.9120 121.4684 57.1773 41.7330 176.2478 61 G 4.2975 7.7357 103.6524 45.7359 0.0000 172.1745 62 G 4.6965 9.2789 105.7495 44.4630 0.0000 171.9888 63 I 4.9144 8.6937 122.3632 59.1175 41.0798 174.5252 64 L 5.4044 8.3831 125.9504 51.7077 45.7734 175.6142 65 I 4.8193 7.8499 122.2168 58.5912 40.9961 174.0314 66 C 5.0554 8.0104 121.8521 57.1032 32.7376 173.8848 67 G 3.8074 8.9428 104.0741 49.6937 0.0000 175.5546 68 T 4.4326 7.8773 107.0635 59.9504 70.8516 175.1434 69 G 3.7929 8.0657 110.1051 46.1295 0.0000 175.6609 70 V 3.5727 7.6694 119.7129 65.7823 31.5810 177.8821 71 G 3.3020 7.6578 104.7608 47.9024 0.0000 175.0895 72 I 3.9197 7.2090 121.2194 63.6392 38.0135 177.8861 73 S 4.1751 7.9464 114.7967 61.0933 62.8305 176.5213 74 I 3.6715 8.1483 123.6953 64.1579 36.6502 178.0417 75 A 4.0782 7.9235 119.9855 55.2940 18.5401 179.2225 76 A 4.2917 8.0028 118.7694 55.5438 18.2658 179.6570 77 N 4.4656 8.1602 113.6992 55.9982 38.6452 177.4314 78 K 4.0408 7.7146 119.1476 57.6398 32.4323 177.2388 79 F 4.3397 7.8716 118.7171 56.1883 39.8963 175.0381 80 A 4.2492 8.4653 127.4471 53.4435 18.7425 178.3670 81 G 3.9995 9.0810 110.2400 45.3980 0.0000 173.5880 82 I 4.3977 7.1921 120.6088 60.0890 38.4751 175.5157 83 R 4.5817 9.4498 123.6263 54.5219 32.9323 173.8643 84 A 5.3112 8.6418 126.1881 49.9528 21.2082 175.6815 85 V 4.3642 8.7010 123.4831 60.0717 33.6431 175.2809 86 V 5.1615 8.4417 124.3921 59.4593 33.2980 174.4781 87 C 4.7716 8.3815 117.5338 57.4779 32.4760 173.4084 88 S 4.7436 8.5478 110.5727 57.4599 62.0190 173.2164 89 E 4.7517 7.6856 117.6723 53.6817 32.2635 174.0843 90 P 4.4368 0.0000 0.0000 65.2921 31.5137 177.9768 91 Y 4.0493 8.1354 119.6219 60.9657 38.7866 177.8807 92 S 4.0054 8.6985 115.8474 61.4828 62.7866 176.6435 93 A 4.0373 7.4761 122.8213 55.2264 18.2194 179.2680 94 Q 3.9497 8.2585 118.2068 59.5099 29.1925 178.4456 95 L 3.8427 7.8310 121.7485 57.9826 41.9892 179.0598 96 S 4.9488 7.9775 115.5895 60.6228 62.8972 176.9205 97 R 3.8323 7.7737 122.0390 59.3317 29.9191 178.8589 98 Q 4.4490 7.9583 119.0867 58.1861 28.4847 178.0689 99 N 4.5557 8.5333 115.7457 53.8126 40.1630 175.5700 100 N 4.7280 7.9505 114.5976 51.9987 40.1660 173.7075 101 D 4.5704 7.9937 116.7714 54.7196 39.5606 173.7147 102 T 4.1708 7.7974 107.6281 62.0698 69.5792 173.6216 103 N 5.1567 9.0440 120.5164 52.6985 39.1719 173.9171 104 V 4.9634 7.9169 119.7339 61.2057 35.3323 173.4254 105 L 4.7155 8.1403 128.9527 52.9593 44.7244 174.8678 106 A 5.3788 9.0349 126.7944 49.3498 23.0526 174.4942 107 F 5.0506 7.4436 113.1055 56.2307 41.8256 172.5768 108 G 4.2782 8.6069 105.8854 44.2455 0.0000 174.5618 109 S 4.4249 9.2239 120.9423 60.6687 63.3805 175.2600 110 R 4.3636 8.2144 118.0006 56.4292 30.0937 176.8394 111 V 4.1169 7.8380 117.3569 64.0192 33.1200 175.7176 112 V 4.3274 7.5847 111.7898 59.4260 33.5136 176.8286 113 G 3.8991 8.1940 109.9994 43.7360 0.0000 174.6658 114 L 3.9281 8.2357 121.0149 58.1948 42.0362 178.7492 115 E 3.9425 8.0064 118.0385 58.9211 29.4814 178.7012 116 L 3.8243 7.8041 119.7803 58.0294 42.1200 178.5544 117 A 3.3705 7.8417 120.6037 55.0711 18.1456 179.7238 118 K 3.6364 7.9076 116.7766 59.7184 32.0541 179.2501 119 M 3.9944 7.9211 118.4339 58.5880 32.1498 178.3592 120 I 3.6667 7.8213 120.1679 64.2527 37.1741 178.4160 121 V 3.7374 7.8293 119.2512 66.3606 31.3849 177.8135 122 D 4.4137 8.4472 118.4103 57.3458 40.4180 178.6726 123 A 4.0570 8.0399 120.4487 54.7374 18.3725 179.3076 124 W 4.2660 8.4426 126.8287 60.8452 30.7055 178.3894 125 L 3.9452 8.3407 117.8164 57.5227 41.0991 179.3610 126 G 3.6720 8.1408 104.2540 45.5895 0.0000 173.7370 127 A 4.4085 6.9459 123.5391 51.1227 19.9078 176.2541 128 Q 4.5770 8.1276 121.6286 53.6954 31.5800 174.3608 129 Y 5.0205 8.3633 124.9240 57.7752 39.1196 176.3562 130 E 4.1351 9.1282 126.5930 56.0816 31.3472 178.8458 131 G 3.1371 6.1621 108.7849 44.1628 0.0000 174.8564 132 G 3.6683 8.2756 113.7536 45.9294 0.0000 176.7568 133 R 3.9508 8.6261 119.7683 59.0251 29.4447 178.2504 134 H 4.4607 7.9912 115.9424 58.1711 28.5366 177.3816 135 Q 4.2959 7.9643 123.2843 58.8274 28.9090 178.0483 136 Q 4.2218 8.1635 118.5611 59.1563 28.6598 179.1819 137 R 3.9211 7.9415 118.4389 59.2835 30.3976 179.0598 138 V 3.6198 8.0013 118.0438 66.1198 31.5100 177.8681 139 E 4.0080 8.7910 118.5294 59.3568 29.3190 179.1939 140 A 4.0341 8.0127 120.8857 55.0017 18.1431 179.7981 141 I 3.6414 7.3031 117.3113 64.8874 37.6097 178.1444 142 T 4.1691 7.7528 115.9410 66.8239 68.4102 176.0221 143 A 4.0137 8.0959 122.3408 55.6109 18.1247 179.7364 144 I 3.6860 7.4149 116.2139 64.6204 37.2146 178.2451 145 E 4.1355 7.9161 118.2864 58.2895 29.2875 177.0505 146 Q 4.2038 7.8516 120.8321 56.1230 28.7786 175.0493 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 8.30 4.44 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.24 0.00 2 K 8.02 4.27 0.00 1.88 1.85 0.00 1.62 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.44 7.81 3 K 9.53 5.18 0.00 1.83 1.93 0.00 1.27 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.40 7.81 4 I 8.84 5.17 1.99 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.30 1.07 0.00 0.00 5 A 8.94 4.94 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 9.43 5.14 0.00 3.06 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.65 4.32 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 0.00 8 C 8.54 5.23 0.00 2.90 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 9 D 8.07 4.82 0.00 2.97 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 10 H 8.75 4.17 0.00 3.40 3.62 0.00 5.52 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.61 3.90 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 1.01 0.00 0.00 0.75 0.00 0.00 12 G 8.50 3.54 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 13 F 8.32 4.16 0.00 3.13 3.25 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 14 I 7.44 3.57 1.85 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 1.75 0.69 0.96 0.00 0.00 15 L 7.79 4.43 0.00 1.92 1.82 1.10 0.64 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 16 K 7.72 3.67 0.00 1.68 1.13 0.00 1.93 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.09 1.06 7.81 17 H 7.47 4.12 0.00 3.09 3.22 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 E 7.93 3.99 0.00 1.93 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 2.35 2.30 0.00 19 I 7.93 3.75 1.91 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 1.68 1.22 1.11 0.00 0.00 20 V 7.90 3.37 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 0.90 0.00 0.00 0.31 0.00 0.00 21 A 7.95 3.94 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 22 H 8.25 4.10 0.00 3.35 3.51 0.00 5.79 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.14 4.00 0.00 1.93 1.74 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.92 3.71 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 1.05 0.00 0.00 0.95 0.00 0.00 25 E 8.26 3.96 0.00 1.95 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 0.00 2.29 2.35 0.00 26 R 7.75 4.25 0.00 1.94 1.94 0.00 3.37 0.00 0.00 3.16 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 27 G 8.25 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 28 V 7.55 4.50 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 0.70 0.00 0.00 0.99 0.00 0.00 29 E 9.03 4.27 0.00 2.06 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 30 V 8.43 4.64 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 0.87 0.00 0.00 0.94 0.00 0.00 31 I 9.09 4.40 1.94 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 1.17 0.89 0.98 0.00 0.00 32 D 8.86 5.05 0.00 2.80 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 33 K 9.54 4.49 0.00 1.74 1.90 0.00 1.83 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.53 7.81 34 G 8.59 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 0.00 0.00 0.00 0.00 0.00 0.00 35 T 6.89 3.69 3.38 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 0.92 0.00 0.00 36 W 8.38 4.82 0.00 3.41 3.09 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 0.00 37 S 6.76 3.86 0.00 3.80 3.72 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 38 S 8.18 4.43 0.00 4.08 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 39 E 7.74 3.97 0.00 1.94 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 40 R 8.38 3.31 0.00 1.70 1.79 0.00 3.27 0.00 0.00 3.13 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 41 T 7.94 4.63 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 1.35 0.00 0.00 42 D 8.53 4.94 0.00 2.69 2.42 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 43 Y 8.57 4.22 0.00 3.25 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.27 0.00 2.00 2.02 0.00 3.11 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.26 0.00 45 H 7.60 3.95 0.00 2.85 3.00 0.00 5.77 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 7.71 3.93 0.00 3.09 2.87 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 0.00 0.00 0.00 47 A 8.01 3.94 1.55 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 48 S 8.11 3.57 0.00 3.98 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 49 Q 7.67 3.85 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.38 0.00 50 V 7.64 3.47 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 0.99 0.00 0.00 0.88 0.00 0.00 51 A 8.02 3.80 0.65 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 0.00 0.00 0.00 0.00 0.00 0.00 52 L 7.95 3.79 0.00 1.69 1.65 0.90 1.00 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 53 A 7.71 4.20 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 54 V 7.89 3.54 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 1.03 0.00 0.00 1.00 0.00 0.00 55 A 8.18 4.14 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.27 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.02 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 0.00 0.00 0.00 58 E 7.85 3.98 0.00 2.15 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 0.00 2.46 2.23 0.00 59 V 7.01 4.57 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 0.82 0.00 0.00 0.97 0.00 0.00 60 D 8.91 4.54 0.00 2.73 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 61 G 7.74 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 0.00 0.00 0.00 0.00 62 G 9.28 4.70 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 63 I 8.69 4.91 1.98 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.92 0.85 0.00 0.00 64 L 8.38 5.40 0.00 1.24 1.22 0.81 0.74 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 65 I 7.85 4.82 1.66 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.11 1.58 0.82 0.00 0.00 66 C 8.01 5.06 0.00 3.04 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.94 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 T 7.88 4.43 4.19 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 1.16 0.00 0.00 69 G 8.07 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 0.00 0.00 0.00 70 V 7.67 3.57 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.88 0.00 0.00 71 G 7.66 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 0.00 0.00 0.00 72 I 7.21 3.92 1.74 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.76 0.00 0.00 73 S 7.95 4.18 0.00 4.07 4.06 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 74 I 8.15 3.67 2.05 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 1.46 0.81 0.94 0.00 0.00 75 A 7.92 4.08 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.00 4.29 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 77 N 8.16 4.47 0.00 3.01 2.92 0.00 0.00 7.10 7.38 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 78 K 7.71 4.04 0.00 1.70 1.68 0.00 1.65 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.71 1.57 7.81 79 F 7.87 4.34 0.00 3.34 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 80 A 8.47 4.25 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 81 G 9.08 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 0.00 0.00 0.00 82 I 7.19 4.40 2.19 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 1.38 0.92 0.95 0.00 0.00 83 R 9.45 4.58 0.00 1.69 1.83 0.00 3.15 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 84 A 8.64 5.31 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 85 V 8.70 4.36 2.12 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 0.95 0.00 0.00 0.93 0.00 0.00 86 V 8.44 5.16 2.01 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 1.00 0.00 0.00 0.94 0.00 0.00 87 C 8.38 4.77 0.00 2.97 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 88 S 8.55 4.74 0.00 3.94 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 89 E 7.69 4.75 0.00 2.20 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 90 P 0.00 4.44 0.00 2.41 2.52 0.00 3.48 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 91 Y 8.14 4.05 0.00 3.13 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 92 S 8.70 4.01 0.00 3.99 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 93 A 7.48 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Q 8.26 3.95 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 95 L 7.83 3.84 0.00 1.02 1.30 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 96 S 7.98 4.95 0.00 4.16 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 7.77 3.83 0.00 1.92 1.89 0.00 3.12 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 1.68 1.60 0.00 98 Q 7.96 4.45 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.60 0.00 0.00 0.00 0.00 0.00 2.53 2.37 0.00 99 N 8.53 4.56 0.00 2.70 2.79 0.00 0.00 6.94 8.00 0.00 0.00 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 N 7.95 4.73 0.00 2.90 2.79 0.00 0.00 6.89 8.08 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 0.00 101 D 7.99 4.57 0.00 1.58 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 0.00 0.00 0.00 102 T 7.80 4.17 4.57 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 1.36 0.00 0.00 103 N 9.04 5.16 0.00 2.93 3.07 0.00 0.00 6.17 7.83 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 0.00 104 V 7.92 4.96 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 0.97 0.00 0.00 0.94 0.00 0.00 105 L 8.14 4.72 0.00 0.27 0.13 0.76 0.91 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 0.00 106 A 9.03 5.38 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 0.00 107 F 7.44 5.05 0.00 3.01 3.21 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 0.00 108 G 8.61 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 S 9.22 4.42 0.00 3.88 4.03 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 0.00 110 R 8.21 4.36 0.00 1.84 1.99 0.00 3.28 0.00 0.00 3.15 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 111 V 7.84 4.12 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 0.83 0.00 0.00 0.92 0.00 0.00 112 V 7.58 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 0.74 0.00 0.00 0.90 0.00 0.00 113 G 8.19 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.24 3.93 0.00 1.74 1.64 0.88 0.86 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 0.00 115 E 8.01 3.94 0.00 1.98 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 2.36 2.27 0.00 116 L 7.80 3.82 0.00 1.69 1.73 0.88 0.99 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 0.00 117 A 7.84 3.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.91 3.64 0.00 1.83 1.56 0.00 1.57 0.00 0.00 1.40 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.13 1.49 7.81 119 M 7.92 3.99 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 120 I 7.82 3.67 1.67 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.74 0.84 0.00 0.00 121 V 7.83 3.74 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 1.32 0.00 0.00 0.99 0.00 0.00 122 D 8.45 4.41 0.00 2.90 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 0.00 123 A 8.04 4.06 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 W 8.44 4.27 0.00 3.53 3.47 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 0.00 125 L 8.34 3.95 0.00 1.71 1.73 1.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 126 G 8.14 3.67 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 0.00 127 A 6.95 4.41 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 0.00 128 Q 8.13 4.58 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.03 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 129 Y 8.36 5.02 0.00 3.11 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 0.00 130 E 9.13 4.14 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.21 0.00 131 G 6.16 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 0.00 0.00 0.00 132 G 8.28 3.67 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 0.00 133 R 8.63 3.95 0.00 1.87 2.02 0.00 2.99 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.37 0.00 134 H 7.99 4.46 0.00 3.43 3.75 0.00 5.62 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.96 4.30 0.00 2.26 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 136 Q 8.16 4.22 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 137 R 7.94 3.92 0.00 2.10 2.02 0.00 3.21 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 138 V 8.00 3.62 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 0.97 0.00 0.00 1.01 0.00 0.00 139 E 8.79 4.01 0.00 2.26 2.01 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 2.36 2.42 0.00 140 A 8.01 4.03 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.30 3.64 2.06 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 1.53 0.77 0.92 0.00 0.00 142 T 7.75 4.17 4.42 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 1.22 0.00 0.00 143 A 8.10 4.01 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 0.00 144 I 7.41 3.69 2.03 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 1.53 0.75 0.91 0.00 0.00 145 E 7.92 4.14 0.00 2.15 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 2.35 2.55 0.00 146 Q 7.85 4.20 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.26 0.00