NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7237 8.3549 109.7301 45.2321 0.0000 170.3077 2 L 3.7406 7.9637 128.6753 52.1379 40.8781 173.7362 3 S 4.4249 9.3270 121.9019 57.5520 66.2530 174.7479 4 A 3.9217 8.4425 123.3065 55.2337 18.0680 179.7692 5 A 3.9559 7.8992 118.8756 55.3775 18.5291 179.7784 6 Q 3.9138 7.9521 116.1697 59.0877 28.7977 178.9656 7 R 3.8128 8.2254 119.4882 59.2519 30.1329 178.9481 8 Q 3.9520 8.0975 119.4292 58.9845 29.0785 178.3341 9 V 3.6081 7.8358 119.3513 66.1406 31.6246 178.5360 10 V 3.2780 7.6695 111.9753 64.0473 30.9632 178.4614 11 A 4.1150 7.7820 120.1832 55.0580 18.6424 179.5038 12 S 4.3536 8.1683 112.9562 61.7067 63.3305 176.7651 13 T 4.1915 8.3454 113.1787 63.8072 68.6374 176.4157 14 W 4.5239 8.7854 131.8076 60.4139 30.5047 177.5863 15 K 3.7181 7.8397 118.6757 59.6976 31.3674 178.4986 16 D 4.2901 7.8988 117.4625 57.1714 40.9787 178.3552 17 I 3.6497 7.6255 119.5530 64.1388 37.3190 178.0127 18 A 3.5028 7.6976 122.0957 53.5793 18.2663 178.2425 19 G 3.4779 7.6331 106.7083 47.3164 0.0000 174.4996 20 S 4.6290 8.6812 118.9052 57.9339 63.6284 174.1739 21 D 4.7987 7.6594 119.1907 52.4464 39.6552 175.2732 22 N 4.0677 9.1221 115.5825 55.2160 37.4133 174.7937 23 G 3.8646 8.3615 102.0577 46.0814 0.0000 175.9479 24 A 4.1351 8.1650 123.9218 55.0264 18.2861 180.6742 25 G 3.5721 8.7661 104.6037 47.9360 0.0000 176.0923 26 V 3.7240 7.8189 120.3039 65.6651 31.6000 178.2480 27 G 3.7354 8.2417 105.6188 47.5512 0.0000 175.6646 28 K 3.9574 8.1933 122.0878 59.2938 32.2739 178.4935 29 E 3.8959 8.2250 119.5657 59.3605 29.5412 178.0395 30 C 3.8960 8.2501 118.7532 62.8760 31.6213 175.7932 31 F 4.1269 8.2975 118.9712 60.3638 38.4506 178.1696 32 T 3.8879 8.2169 115.8336 66.6553 68.3839 176.9545 33 K 4.0044 8.2322 120.5171 59.1898 32.0116 179.2204 34 F 4.3313 8.3333 120.9807 61.5554 39.1680 177.2875 35 L 3.9350 7.9248 116.6881 57.3785 41.4492 179.2924 36 S 4.2977 7.9733 114.5905 61.0839 62.7911 175.8658 37 A 4.2685 7.6504 122.6066 53.2230 19.4610 176.9886 38 H 4.6109 7.6879 114.3281 53.6624 29.7523 173.6244 39 H 4.2399 8.2633 121.9881 58.3279 29.0305 177.7545 40 D 4.4389 7.9704 117.8546 56.0622 39.7132 177.8030 41 M 4.0691 8.0865 119.2944 56.9724 31.9215 178.0732 42 A 4.1530 7.8909 121.1528 55.3280 18.0398 179.4982 43 A 4.0230 8.0127 118.5187 55.1089 18.4564 179.9000 44 V 3.5653 7.6072 117.1956 65.8694 31.7541 177.9980 45 F 3.8866 8.1076 116.8744 58.1636 39.0267 176.3998 46 G 3.8221 7.5969 106.9585 45.8033 0.0000 173.2360 47 F 5.3461 7.5752 117.5489 55.6535 40.5485 176.6457 48 S 4.2899 9.3007 118.1278 59.2804 63.3952 174.4339 49 G 3.8593 7.4891 106.8511 45.6211 0.0000 172.3488 50 A 3.9864 8.4201 121.4770 54.6108 18.4112 178.6780 51 S 4.4955 7.7843 108.1538 57.8922 63.8161 173.8149 52 D 4.2893 7.6152 122.1284 54.0358 41.0377 175.2650 53 P 4.2555 0.0000 0.0000 65.8538 31.1453 178.9124 54 G 3.3972 8.4205 104.5250 47.1384 0.0000 176.0297 55 V 3.0403 6.9758 120.3295 65.8764 31.6313 178.0069 56 A 3.9258 7.6837 119.9975 54.9382 18.3422 179.0064 57 D 4.1622 7.6393 115.8819 57.4127 41.3076 178.2325 58 L 3.9824 8.1080 121.3059 58.0317 42.1415 178.9935 59 G 3.7280 8.2119 105.7801 47.8323 0.0000 175.5053 60 A 4.0699 7.9776 122.8938 54.9831 18.5423 179.9493 61 K 4.0120 7.9714 116.6696 59.4193 32.0492 179.9157 62 V 3.7255 8.1097 118.7626 66.1786 31.6133 178.2435 63 L 4.2789 8.1578 118.2505 57.5477 41.3022 179.3468 64 A 4.2101 8.2384 121.2383 55.1455 18.2254 179.4600 65 Q 3.9794 8.1583 117.7453 59.2443 29.0994 178.3818 66 I 3.7456 7.9727 121.2889 64.1452 37.2164 178.5542 67 G 3.0940 7.7455 106.5770 47.4122 0.0000 176.0193 68 V 3.4650 7.2516 119.3476 65.7255 31.7466 177.6250 69 A 4.1814 8.0635 120.7753 55.2036 17.9495 179.7866 70 V 3.3558 7.9326 117.3850 65.9618 31.3513 178.2842 71 S 4.2428 7.7172 112.0782 60.4589 63.1984 175.0074 72 H 4.8757 7.4728 118.9717 55.4196 28.6863 175.9603 73 L 3.9370 7.5512 124.6906 57.7686 41.9981 178.4545 74 G 3.6305 8.0035 105.8825 46.9488 0.0000 173.3596 75 D 4.6712 8.0265 119.1906 51.5182 42.3902 175.2306 76 E 3.9800 8.5680 127.5245 59.0616 29.9990 178.4069 77 G 3.6760 8.0526 105.2336 47.4797 0.0000 175.5095 78 K 3.8955 7.9642 121.9385 59.6099 32.3376 178.6139 79 M 4.3019 7.7846 119.7564 58.3562 32.0681 178.6255 80 V 3.6452 8.2754 112.6851 64.0036 31.7867 178.4966 81 A 3.9633 7.8822 120.5879 55.0910 18.1494 179.5383 82 E 3.9937 8.3101 116.1843 59.7560 29.7907 179.2370 83 M 4.2051 8.2122 119.5637 57.7928 31.8722 178.8229 84 K 4.0751 8.3824 119.1325 59.3312 32.0591 179.1284 85 A 3.9587 7.8692 120.6132 55.1114 18.0615 179.7949 86 V 3.7102 7.5475 115.4703 66.1401 31.8799 178.2058 87 G 3.6688 8.0905 105.4769 47.7405 0.0000 175.7832 88 V 3.7029 8.0912 121.0395 65.9413 31.4909 178.4128 89 R 3.7309 7.7664 117.6483 59.1176 29.7110 178.2674 90 H 3.9135 7.8169 114.7460 57.2808 28.4011 177.5141 91 K 4.0467 7.6006 120.5952 58.5098 31.8682 177.7188 92 G 3.9687 7.2538 104.8083 45.3012 0.0000 172.7555 93 Y 4.9571 7.3892 117.4862 56.9417 40.6262 178.5983 94 G 3.6608 8.2005 111.3675 46.9144 0.0000 175.3463 95 N 4.6786 8.9532 121.6433 52.1880 37.9562 175.2662 96 K 4.7623 8.3828 119.3719 57.8234 32.6425 176.5823 97 H 4.9807 8.2201 112.8023 55.3197 29.7159 174.7472 98 I 4.1217 7.9526 120.1707 61.1790 38.0043 176.1662 99 K 4.5039 8.0425 123.8773 54.0427 34.6865 177.0699 100 A 4.2231 8.4611 123.2261 55.5816 17.9187 180.1138 101 E 4.0731 8.0061 116.3841 59.5539 29.6461 178.7971 102 Y 4.6095 7.8285 116.7851 60.7341 37.9923 178.0413 103 F 4.3075 8.3959 118.8593 60.0542 38.5038 177.4084 104 E 4.1411 8.0525 119.8215 58.8387 29.1453 177.1101 105 P 4.3762 0.0000 0.0000 65.6570 31.2900 178.0502 106 L 3.0328 7.3671 119.6612 57.3627 41.8637 179.0320 107 G 2.6502 7.7607 105.2277 47.3538 0.0000 175.4460 108 A 3.9480 7.4353 122.0834 55.0642 18.3717 179.9721 109 S 4.0464 7.5763 113.0303 61.2311 62.8044 176.6849 110 L 3.7369 7.5958 123.1656 58.1053 41.8542 179.0493 111 L 3.8188 7.7166 118.8990 57.6280 41.4795 179.5502 112 S 4.0134 7.8436 112.5089 61.3297 62.5032 176.1105 113 A 4.1581 7.9254 123.5008 55.2868 18.0318 179.5307 114 M 3.8632 8.0696 117.3522 58.5720 31.9952 178.6574 115 E 3.8920 8.2034 119.4105 59.4210 29.5406 178.2693 116 H 4.1333 8.1161 117.7039 58.9826 29.9178 177.0311 117 R 3.9928 7.7246 119.7156 58.7149 30.2696 177.5869 118 I 4.2069 7.8815 110.6265 59.0107 38.5003 176.7307 119 G 3.7844 8.8931 111.7697 46.9146 0.0000 177.7579 120 G 3.7662 8.8364 114.2181 46.8812 0.0000 174.0144 121 K 4.0438 7.7219 120.8455 58.8976 32.7218 177.1800 122 M 4.3437 7.5548 120.8505 54.2280 30.5973 174.9257 123 N 4.7754 7.6386 120.7778 51.5699 41.4459 175.2776 124 A 4.0117 8.5461 120.4717 55.5294 18.2784 179.6192 125 A 3.9585 8.0213 118.5588 55.2820 18.4779 179.5952 126 A 4.0918 8.0202 118.8660 55.2662 18.4787 179.8914 127 K 4.0768 8.3620 117.1718 59.6278 32.1364 179.1703 128 D 4.3365 8.2462 118.1136 57.2039 41.0804 178.1699 129 A 3.9837 8.2913 121.4812 55.0289 18.3840 179.7296 130 W 4.1290 8.7564 117.6740 59.6945 29.0196 178.7294 131 A 4.2065 8.6311 121.0330 55.0051 17.9301 179.5620 132 A 3.9262 8.2384 119.1353 55.2692 18.4514 179.7704 133 A 3.8692 8.2915 119.6274 55.4422 18.3631 179.2127 134 Y 4.0348 8.9373 118.2191 60.7701 38.8612 178.0117 135 A 3.8938 8.3942 121.9128 55.3445 18.4639 179.4472 136 D 4.2036 7.9562 116.8829 57.4042 40.9631 179.1360 137 I 3.6244 7.7804 120.6139 64.3939 37.1839 178.7413 138 S 3.8948 7.8369 115.5039 61.0856 62.7425 176.5918 139 G 3.4586 7.8197 109.1429 47.5131 0.0000 175.5601 140 A 3.9222 7.8900 123.2008 54.4966 18.3024 179.4657 141 L 3.9408 7.5965 118.7443 58.4391 42.1105 179.1239 142 I 3.4035 7.6571 119.9991 64.5338 36.7340 178.5112 143 S 4.1308 7.8522 114.9333 61.5271 62.7981 176.7372 144 G 3.6636 7.9694 108.3943 47.6655 0.0000 175.5232 145 L 4.0758 7.8914 121.9904 57.5210 42.1873 178.1378 146 Q 4.3805 7.9209 115.3698 55.8636 29.0202 176.4534 147 S 4.3969 7.5443 121.4489 58.7378 63.3793 173.7110 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 G 8.35 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 0.00 0.00 0.00 2 L 7.96 3.74 0.00 1.86 1.72 0.80 0.59 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 3 S 9.33 4.42 0.00 4.02 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 4 A 8.44 3.92 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 5 A 7.90 3.96 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 6 Q 7.95 3.91 0.00 2.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 7 R 8.23 3.81 0.00 1.94 1.92 0.00 3.07 0.00 0.00 3.05 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 8 Q 8.10 3.95 0.00 2.28 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 9 V 7.84 3.61 2.16 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 1.02 0.00 0.00 1.01 0.00 0.00 10 V 7.67 3.28 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.67 0.00 0.00 11 A 7.78 4.11 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 12 S 8.17 4.35 0.00 4.16 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 0.00 13 T 8.35 4.19 4.51 0.00 0.00 0.00 0.00 0.00 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 14 W 8.79 4.52 0.00 3.91 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 15 K 7.84 3.72 0.00 2.02 1.94 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.48 7.81 16 D 7.90 4.29 0.00 2.81 2.66 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 17 I 7.63 3.65 1.62 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.54 0.71 0.00 0.00 18 A 7.70 3.50 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.63 3.48 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 0.00 20 S 8.68 4.63 0.00 3.94 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 21 D 7.66 4.80 0.00 2.82 2.84 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 22 N 9.12 4.07 0.00 2.87 2.95 0.00 0.00 7.16 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 23 G 8.36 3.86 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 0.00 0.00 0.00 24 A 8.16 4.14 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 25 G 8.77 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 26 V 7.82 3.72 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 1.07 0.00 0.00 0.86 0.00 0.00 27 G 8.24 3.74 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 0.00 0.00 0.00 28 K 8.19 3.96 0.00 1.87 1.98 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.43 7.81 29 E 8.23 3.90 0.00 2.17 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 2.27 2.29 0.00 30 C 8.25 3.90 0.00 2.94 3.04 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 31 F 8.30 4.13 0.00 3.15 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 32 T 8.22 3.89 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 1.19 0.00 0.00 33 K 8.23 4.00 0.00 1.80 1.86 0.00 1.63 0.00 0.00 1.51 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.59 7.81 34 F 8.33 4.33 0.00 3.02 3.13 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 35 L 7.92 3.93 0.00 1.72 1.70 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 36 S 7.97 4.30 0.00 3.97 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 37 A 7.65 4.27 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 H 7.69 4.61 0.00 2.72 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 H 8.26 4.24 0.00 3.16 3.28 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 7.97 4.44 0.00 2.75 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 41 M 8.09 4.07 0.00 2.09 2.03 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.41 0.00 42 A 7.89 4.15 1.49 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 43 A 8.01 4.02 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 44 V 7.61 3.57 1.95 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 0.77 0.00 0.00 0.73 0.00 0.00 45 F 8.11 3.89 0.00 2.69 1.63 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 46 G 7.60 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 F 7.58 5.35 0.00 3.04 2.83 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 0.00 0.00 0.00 0.00 48 S 9.30 4.29 0.00 3.99 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 49 G 7.49 3.86 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 0.00 0.00 0.00 50 A 8.42 3.99 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 51 S 7.78 4.50 0.00 3.93 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 52 D 7.62 4.29 0.00 2.65 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.26 0.00 2.11 2.03 0.00 3.56 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 54 G 8.42 3.40 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 0.00 55 V 6.98 3.04 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 1.05 0.00 0.00 0.45 0.00 0.00 56 A 7.68 3.93 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 57 D 7.64 4.16 0.00 2.75 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 58 L 8.11 3.98 0.00 1.89 1.64 0.88 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.21 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.98 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 61 K 7.97 4.01 0.00 1.99 1.91 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.57 7.81 62 V 8.11 3.73 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 1.03 0.00 0.00 63 L 8.16 4.28 0.00 2.05 1.98 1.18 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.24 4.21 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 65 Q 8.16 3.98 0.00 2.37 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 66 I 7.97 3.75 2.01 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.64 0.83 0.00 0.00 67 G 7.75 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 0.00 0.00 0.00 68 V 7.25 3.46 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 0.84 0.00 0.00 1.02 0.00 0.00 69 A 8.06 4.18 1.30 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 70 V 7.93 3.36 1.65 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 0.94 0.00 0.00 0.64 0.00 0.00 71 S 7.72 4.24 0.00 4.09 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 72 H 7.47 4.88 0.00 3.11 3.26 0.00 5.64 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.55 3.94 0.00 1.69 1.63 0.81 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 74 G 8.00 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 0.00 0.00 0.00 75 D 8.03 4.67 0.00 2.66 2.50 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 76 E 8.57 3.98 0.00 2.04 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 2.34 2.34 0.00 77 G 8.05 3.68 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 0.00 0.00 0.00 78 K 7.96 3.90 0.00 2.00 1.95 0.00 1.54 0.00 0.00 1.35 0.00 0.00 2.47 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.35 7.81 79 M 7.78 4.30 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 80 V 8.28 3.65 2.03 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 0.77 0.00 0.00 0.99 0.00 0.00 81 A 7.88 3.96 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 82 E 8.31 3.99 0.00 2.24 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 2.52 2.36 0.00 83 M 8.21 4.21 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.82 0.00 84 K 8.38 4.08 0.00 1.92 1.82 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.60 7.81 85 A 7.87 3.96 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 86 V 7.55 3.71 2.28 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 0.99 0.00 0.00 1.04 0.00 0.00 87 G 8.09 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 88 V 8.09 3.70 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 0.97 0.00 0.00 0.98 0.00 0.00 89 R 7.77 3.73 0.00 1.90 1.61 0.00 3.25 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.86 0.00 90 H 7.82 3.91 0.00 3.40 3.42 0.00 5.82 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.60 4.05 0.00 1.65 1.81 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 92 G 7.25 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 93 Y 7.39 4.96 0.00 2.82 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 94 G 8.20 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 0.00 0.00 0.00 95 N 8.95 4.68 0.00 3.00 3.11 0.00 0.00 7.38 6.93 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 96 K 8.38 4.76 0.00 1.68 1.93 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.46 7.81 97 H 8.22 4.98 0.00 3.31 3.29 0.00 5.85 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 7.95 4.12 1.97 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 1.39 0.50 1.05 0.00 0.00 99 K 8.04 4.50 0.00 0.79 1.47 0.00 1.35 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.29 1.45 7.81 100 A 8.46 4.22 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 0.00 101 E 8.01 4.07 0.00 1.99 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 0.00 2.39 2.44 0.00 102 Y 7.83 4.61 0.00 2.90 2.83 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 0.00 0.00 0.00 0.00 103 F 8.40 4.31 0.00 3.25 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 0.00 104 E 8.05 4.14 0.00 2.23 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 2.40 2.43 0.00 105 P 0.00 4.38 0.00 2.55 2.41 0.00 4.08 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.19 0.00 106 L 7.37 3.03 0.00 1.56 1.63 0.97 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 107 G 7.76 2.65 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 0.00 108 A 7.44 3.95 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 0.00 109 S 7.58 4.05 0.00 3.74 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 0.00 110 L 7.60 3.74 0.00 1.43 1.44 0.86 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 111 L 7.72 3.82 0.00 1.80 1.65 0.94 0.57 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 0.00 112 S 7.84 4.01 0.00 3.92 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 0.00 113 A 7.93 4.16 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 0.00 114 M 8.07 3.86 0.00 1.78 2.05 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.26 0.00 115 E 8.20 3.89 0.00 2.08 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 0.00 2.30 2.43 0.00 116 H 8.12 4.13 0.00 3.26 3.46 0.00 5.82 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 0.00 117 R 7.72 3.99 0.00 1.82 1.97 0.00 3.28 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 118 I 7.88 4.21 1.85 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 1.62 0.75 0.82 0.00 0.00 119 G 8.89 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 120 G 8.84 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 0.00 121 K 7.72 4.04 0.00 1.85 1.87 0.00 1.69 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.45 7.81 122 M 7.55 4.34 0.00 2.13 1.97 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.48 0.00 123 N 7.64 4.78 0.00 3.02 3.13 0.00 0.00 5.98 7.03 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 0.00 124 A 8.55 4.01 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 0.00 125 A 8.02 3.96 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 0.00 126 A 8.02 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 127 K 8.36 4.08 0.00 2.03 1.93 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.50 1.67 7.81 128 D 8.25 4.34 0.00 2.86 2.84 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 0.00 129 A 8.29 3.98 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 0.00 130 W 8.76 4.13 0.00 3.60 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 0.00 131 A 8.63 4.21 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 0.00 132 A 8.24 3.93 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 0.00 133 A 8.29 3.87 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 0.00 134 Y 8.94 4.03 0.00 3.29 3.13 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 0.00 135 A 8.39 3.89 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 0.00 136 D 7.96 4.20 0.00 2.90 2.65 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 0.00 137 I 7.78 3.62 1.84 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 1.52 0.98 0.89 0.00 0.00 138 S 7.84 3.89 0.00 3.55 3.33 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 0.00 139 G 7.82 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 A 7.89 3.92 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 0.00 141 L 7.60 3.94 0.00 1.75 1.53 0.98 0.91 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 0.00 142 I 7.66 3.40 1.74 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 -0.36 0.76 0.00 0.00 143 S 7.85 4.13 0.00 3.95 3.86 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 0.00 144 G 7.97 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 0.00 0.00 0.00 145 L 7.89 4.08 0.00 1.70 1.93 0.94 1.03 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 0.00 146 Q 7.92 4.38 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 147 S 7.54 4.40 0.00 3.94 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