NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.2732 8.3149 120.1332 55.2279 33.6239 175.9361 5 P 4.2432 0.0000 0.0000 61.8301 33.1798 176.0793 6 I 3.6123 8.6095 121.0170 64.1999 38.2715 177.7758 7 A 3.8203 7.8727 121.3565 54.9090 18.2549 179.3437 8 E 3.7848 8.0305 116.7800 59.4997 29.6142 178.9714 9 Q 3.9081 8.2028 118.2937 59.2711 28.7774 179.2663 10 I 3.5224 7.8096 120.4764 64.2296 37.0857 178.4256 11 G 3.4919 7.8732 106.5842 48.2495 0.0000 175.7014 12 S 4.4134 8.1030 119.7960 60.5183 62.8560 177.2065 13 S 4.1153 8.0266 117.8449 61.3130 62.5634 176.3395 14 F 4.0038 8.4896 124.0375 61.4149 39.1524 177.3598 15 I 3.6853 7.7793 112.5042 63.6427 37.3679 177.9449 16 Q 3.9989 8.2409 121.5899 59.2396 28.8881 177.4306 17 H 3.9867 8.4719 119.6224 59.5453 29.8088 176.0481 18 Y 3.5339 7.6732 121.2774 61.2252 38.4608 178.1491 19 Y 4.1344 7.8919 117.1223 60.6510 37.9059 178.3497 20 Q 3.9745 8.0927 120.8524 59.2374 29.3835 178.3709 21 L 3.8647 7.8130 120.0001 57.5049 41.3769 179.0823 22 F 3.8369 7.8922 119.8648 61.5999 39.3874 176.6748 23 D 4.8599 8.1296 118.1318 57.0317 40.6621 176.7300 24 N 4.8614 8.2818 114.9834 51.9173 40.1486 174.6213 25 D 4.7126 7.7970 126.7850 52.7441 41.6422 176.0478 26 R 4.2699 8.1541 120.5765 55.9806 29.7607 177.4978 27 T 4.3507 7.7169 105.9670 62.1649 69.1546 174.6990 28 Q 4.5661 7.4743 118.6060 55.8806 30.3236 177.5101 29 L 4.0698 7.7674 119.2593 57.3974 42.3156 179.2060 30 G 3.8797 8.4532 107.3692 48.7048 0.0000 175.2357 31 A 4.1219 7.6036 120.5573 54.2834 18.5661 178.1894 32 I 4.1604 7.8088 108.4672 61.6579 38.3941 175.0406 33 Y 5.2346 7.7135 119.3089 56.3601 40.2223 175.4382 34 I 4.4950 8.1450 116.7849 59.5003 40.1789 175.8112 35 D 4.4285 8.5963 118.0408 56.5552 40.8904 177.6894 36 A 4.6959 7.8707 119.8352 51.8572 19.5385 177.0562 37 S 4.7580 7.8795 113.8672 59.1946 64.3810 172.9520 38 C 5.2231 9.1560 122.9374 57.5317 34.7015 172.2770 39 L 5.3846 9.2315 128.0815 53.6196 45.0988 175.0246 40 T 5.2013 9.2365 122.9183 61.8685 71.2717 173.0134 41 W 4.9410 9.5043 135.0000 55.4996 32.2265 176.0140 42 E 4.0361 9.6203 130.1176 57.5933 26.9213 176.4177 43 G 3.9854 8.4171 104.8812 45.5165 0.0000 173.1979 44 Q 4.5036 7.9681 121.1795 54.2600 30.6787 173.7277 45 Q 5.0574 8.2820 123.9639 54.5128 30.4249 174.8275 46 F 4.7051 9.3932 123.3076 55.6719 42.0545 174.1271 47 Q 4.7530 9.1113 122.9470 55.2495 30.8397 176.7492 48 G 4.2253 9.6542 109.6580 45.6543 0.0000 173.7814 49 K 3.7458 8.8000 120.8431 59.5659 31.9919 178.6068 50 A 3.9492 8.1166 119.8535 55.4356 18.3372 179.3214 51 A 3.9698 7.9571 118.4312 55.2238 18.5314 179.7645 52 I 3.3903 7.5555 117.8774 64.5016 37.1985 178.8833 53 V 3.4700 7.9692 119.4065 65.8188 31.2255 177.4795 54 E 3.7770 8.2006 119.2015 59.2710 29.2141 178.8217 55 K 3.4908 7.3192 118.0537 59.2417 32.5055 178.5144 56 L 3.6239 7.6219 119.4647 57.1140 41.2870 179.2418 57 S 4.0864 7.7428 113.4671 60.3101 63.2469 175.8414 58 S 4.2086 7.2476 116.5052 58.3188 63.5729 174.5977 59 L 3.7941 6.3550 122.2347 54.5827 41.9254 176.4283 60 P 4.4921 0.0000 0.0000 60.3367 29.8998 174.6783 61 F 5.2043 6.8834 117.4481 58.1158 40.6912 174.5525 62 Q 4.5483 9.4664 119.4452 56.4740 30.7164 176.4437 63 K 4.9016 9.1486 116.3959 54.6168 35.7195 175.5657 64 I 4.8669 8.1431 122.2462 59.5720 41.9078 173.1535 65 Q 4.9806 8.7869 128.8108 54.7534 32.3394 173.4541 66 H 5.5740 9.8749 123.0404 54.0249 32.2366 173.5361 67 S 4.6798 9.2201 115.1090 56.7128 66.5328 172.9208 68 I 4.2822 8.2578 123.7132 60.7915 37.2132 175.7502 69 T 4.1827 8.7864 125.2029 66.1943 69.7957 174.9580 70 A 4.6937 7.4524 120.1895 50.8174 22.7597 175.5014 71 Q 4.9227 8.5280 118.3929 54.8073 32.0961 173.2578 72 D 5.0012 9.4353 124.5302 52.5812 43.4643 175.0783 73 H 5.4702 8.6871 119.5649 54.2198 32.2253 173.1178 74 Q 4.7538 8.8568 119.9569 53.6452 33.3715 172.7793 75 P 5.0022 0.0000 0.0000 63.0207 32.8384 175.2552 76 T 4.6199 8.7309 111.6496 59.3749 71.4821 173.6813 77 P 4.3242 0.0000 0.0000 65.4951 31.4924 177.1307 78 D 4.6923 8.0649 116.3036 54.5255 40.6130 176.5929 79 S 3.9715 8.0731 112.9162 59.6793 60.7522 170.5041 80 C 5.0105 8.2429 119.2360 58.7915 30.7824 172.4294 81 I 5.0496 8.6887 119.9678 59.7348 40.4281 174.9395 82 I 4.9021 8.6861 127.0694 59.6881 39.7431 174.6376 83 S 5.2497 9.3534 123.7010 56.9687 65.7387 172.6703 84 M 5.0829 9.4327 125.4929 53.6534 34.7799 174.3823 85 V 5.0424 9.1260 126.4165 60.9963 34.8072 174.3895 86 V 4.4457 8.6817 126.8222 60.0571 34.0141 174.6179 87 G 3.7545 7.5397 110.9326 45.6968 0.0000 171.5028 88 Q 5.3669 8.6886 119.3966 54.6660 33.8691 174.0135 89 L 5.2030 9.3218 121.6293 54.1630 44.9662 175.2036 90 K 4.7112 8.7023 120.3907 54.8625 35.3701 174.5409 91 A 4.6590 8.5930 129.7642 51.5332 21.0830 177.0969 92 D 4.2917 9.1910 122.5660 55.7047 41.5189 175.2960 93 E 4.7615 9.0937 122.9382 56.9789 30.2850 175.4619 94 D 4.7232 8.2210 119.0838 52.6825 41.8124 174.7689 95 P 4.3506 0.0000 0.0000 62.6688 31.8490 176.5293 96 I 4.0075 8.2932 122.0573 62.6700 37.7331 175.0703 97 M 4.8787 9.2054 124.8485 53.3420 36.0927 175.6729 98 G 4.2206 8.5914 109.1835 46.3975 0.0000 172.0583 99 F 5.2008 8.2931 113.6972 55.8375 41.7223 172.7325 100 H 5.2477 9.1650 117.7297 54.1569 32.0503 172.8428 101 Q 4.9623 8.9652 122.9509 54.9231 33.0461 172.8391 102 M 5.1717 8.8771 125.5518 53.7534 35.7726 173.9888 103 F 5.4014 9.2737 123.4910 55.5787 43.7622 173.4111 104 L 5.1523 9.1218 124.6604 53.4142 44.5238 174.9401 105 L 5.2480 9.3359 126.6727 53.0295 44.5923 175.5176 106 K 4.8547 9.0555 123.1589 54.6503 36.0058 174.7706 107 N 4.3378 7.9145 125.8973 52.5775 39.1156 174.0557 108 I 4.2970 8.0289 127.7424 60.3344 39.8639 176.0101 109 N 4.3886 9.4289 123.5060 54.6414 35.8017 173.7588 110 D 4.4418 8.5304 110.9477 54.9193 38.6767 173.8687 111 A 4.7184 7.4913 118.5056 50.2008 23.1726 176.5103 112 W 4.8240 8.9598 121.4678 56.3865 29.6372 176.2687 113 V 4.5924 8.8347 118.7732 59.5034 34.8735 174.6368 114 C 4.7475 9.2733 125.0481 58.9807 31.5480 173.3193 115 T 4.4362 9.0194 117.7161 63.4858 70.4888 174.5905 116 N 5.5380 8.1858 119.1829 51.2591 42.5089 173.0936 117 D 5.2958 9.5650 123.7024 52.7024 44.8488 173.9751 118 M 5.3327 8.7745 124.9094 53.5067 35.4891 174.3633 119 F 5.1677 9.4879 125.4747 56.4944 43.2090 174.0208 120 R 4.5987 7.5785 122.6861 54.3175 34.4235 174.9298 121 L 4.3650 9.5133 124.7583 54.2721 42.5590 176.7013 122 A 4.1227 8.7560 124.2117 51.6343 18.9616 177.9009 123 L 3.5609 8.3627 117.9882 58.7545 40.5837 176.0824 124 H 4.2679 8.2363 121.4930 55.5301 26.9710 174.9269 125 N 4.6561 8.5391 121.3608 54.3106 39.1669 175.3689 126 F 4.1358 8.0987 115.8920 58.5600 42.2705 173.5398 127 G 3.8394 8.1729 115.7269 45.6965 0.0000 173.0351 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 4 K 8.31 4.27 0.00 1.75 1.80 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.47 7.81 5 P 0.00 4.24 0.00 2.22 1.98 0.00 3.59 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 6 I 8.61 3.61 1.87 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.92 0.00 0.00 7 A 7.87 3.82 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 8 E 8.03 3.78 0.00 2.14 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 0.00 2.45 2.41 0.00 9 Q 8.20 3.91 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.73 0.00 10 I 7.81 3.52 1.25 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.53 -0.48 0.00 0.00 11 G 7.87 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.10 4.41 0.00 3.81 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 13 S 8.03 4.12 0.00 3.96 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 14 F 8.49 4.00 0.00 3.02 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 15 I 7.78 3.69 2.19 0.00 0.00 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 1.65 0.79 1.14 0.00 0.00 16 Q 8.24 4.00 0.00 2.19 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 17 H 8.47 3.99 0.00 3.19 3.31 0.00 5.86 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 18 Y 7.67 3.53 0.00 1.88 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 0.00 0.00 0.00 0.00 19 Y 7.89 4.13 0.00 3.14 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.09 3.97 0.00 2.20 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 21 L 7.81 3.86 0.00 1.56 1.49 0.64 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 22 F 7.89 3.84 0.00 2.68 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 23 D 8.13 4.86 0.00 2.90 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 24 N 8.28 4.86 0.00 2.78 2.70 0.00 0.00 6.76 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 D 7.80 4.71 0.00 2.76 2.48 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 26 R 8.15 4.27 0.00 1.46 2.01 0.00 2.21 0.00 0.00 2.69 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.27 0.00 27 T 7.72 4.35 4.18 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 1.12 0.00 0.00 28 Q 7.47 4.57 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.84 0.00 0.00 0.00 0.00 0.00 2.56 2.46 0.00 29 L 7.77 4.07 0.00 1.80 1.83 0.43 0.53 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 30 G 8.45 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.60 4.12 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 32 I 7.81 4.16 2.12 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.34 0.97 0.00 0.00 33 Y 7.71 5.23 0.00 3.21 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 34 I 8.14 4.49 1.92 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 1.40 0.88 0.95 0.00 0.00 35 D 8.60 4.43 0.00 2.83 2.77 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 36 A 7.87 4.70 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 37 S 7.88 4.76 0.00 3.91 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 38 C 9.16 5.22 0.00 3.00 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 39 L 9.23 5.38 0.00 1.78 1.57 1.36 0.55 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 40 T 9.24 5.20 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 1.29 0.00 0.00 41 W 9.50 4.94 0.00 3.69 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 42 E 9.62 4.04 0.00 2.41 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 0.00 2.34 2.57 0.00 43 G 8.42 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 44 Q 7.97 4.50 0.00 2.16 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.75 0.00 0.00 0.00 0.00 0.00 1.69 2.03 0.00 45 Q 8.28 5.06 0.00 1.86 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.47 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 46 F 9.39 4.71 0.00 2.99 2.92 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 47 Q 9.11 4.75 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.56 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 48 G 9.65 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 49 K 8.80 3.75 0.00 2.02 1.87 0.00 2.20 0.00 0.00 1.89 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.64 7.81 50 A 8.12 3.95 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 51 A 7.96 3.97 1.46 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 52 I 7.56 3.39 1.76 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.91 0.17 0.00 0.00 53 V 7.97 3.47 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 0.93 0.00 0.00 0.98 0.00 0.00 54 E 8.20 3.78 0.00 1.99 1.94 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 2.21 2.42 0.00 55 K 7.32 3.49 0.00 0.79 1.20 0.00 1.12 0.00 0.00 0.99 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.52 7.81 56 L 7.62 3.62 0.00 1.42 1.20 1.01 0.36 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 57 S 7.74 4.09 0.00 3.86 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 58 S 7.25 4.21 0.00 3.85 4.01 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 59 L 6.35 3.79 0.00 1.04 1.41 0.68 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.49 0.00 2.20 2.06 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.98 0.00 61 F 6.88 5.20 0.00 3.16 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 62 Q 9.47 4.55 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.63 0.00 63 K 9.15 4.90 0.00 1.61 1.68 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.52 7.81 64 I 8.14 4.87 0.84 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.11 1.18 0.00 0.00 65 Q 8.79 4.98 0.00 2.14 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.48 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 66 H 9.87 5.57 0.00 2.83 3.05 0.00 5.85 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 9.22 4.68 0.00 3.76 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 68 I 8.26 4.28 1.85 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 1.30 0.34 0.93 0.00 0.00 69 T 8.79 4.18 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 1.13 0.00 0.00 70 A 7.45 4.69 1.14 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 71 Q 8.53 4.92 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 72 D 9.44 5.00 0.00 2.50 2.55 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 73 H 8.69 5.47 0.00 2.97 3.18 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.86 4.75 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.96 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 75 P 0.00 5.00 0.00 2.10 2.07 0.00 3.74 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 76 T 8.73 4.62 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 1.30 0.00 0.00 77 P 0.00 4.32 0.00 2.08 2.16 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 78 D 8.06 4.69 0.00 2.69 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 79 S 8.07 3.97 0.00 4.08 4.05 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 80 C 8.24 5.01 0.00 2.93 3.02 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 0.00 0.00 0.00 81 I 8.69 5.05 1.69 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.84 0.82 0.00 0.00 82 I 8.69 4.90 1.90 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 1.26 0.99 0.94 0.00 0.00 83 S 9.35 5.25 0.00 4.09 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 M 9.43 5.08 0.00 2.00 1.88 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 2.56 2.42 0.00 85 V 9.13 5.04 2.36 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 0.98 0.00 0.00 1.28 0.00 0.00 86 V 8.68 4.45 1.94 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 0.56 0.00 0.00 0.66 0.00 0.00 87 G 7.54 3.75 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 0.00 0.00 0.00 88 Q 8.69 5.37 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 89 L 9.32 5.20 0.00 1.45 1.44 0.91 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.70 4.71 0.00 1.80 1.62 0.00 1.61 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.53 7.81 91 A 8.59 4.66 1.12 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 0.00 0.00 92 D 9.19 4.29 0.00 2.78 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 0.00 0.00 0.00 93 E 9.09 4.76 0.00 1.93 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 2.21 2.24 0.00 94 D 8.22 4.72 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.35 0.00 2.08 2.03 0.00 3.75 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 2.08 2.15 0.00 96 I 8.29 4.01 1.88 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 1.34 0.47 0.95 0.00 0.00 97 M 9.21 4.88 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.63 0.00 98 G 8.59 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 0.00 0.00 0.00 0.00 99 F 8.29 5.20 0.00 2.76 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 0.00 100 H 9.16 5.25 0.00 2.91 3.10 0.00 5.79 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 8.97 4.96 0.00 2.47 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 1.43 2.39 0.00 102 M 8.88 5.17 0.00 1.96 1.77 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.77 0.00 103 F 9.27 5.40 0.00 2.94 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 0.00 104 L 9.12 5.15 0.00 1.78 1.56 1.05 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 105 L 9.34 5.25 0.00 1.71 1.66 0.56 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 106 K 9.06 4.85 0.00 1.78 1.57 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.21 1.28 7.81 107 N 7.91 4.34 0.00 1.44 1.91 0.00 0.00 6.88 7.94 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 0.00 108 I 8.03 4.30 1.81 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.10 0.87 0.00 0.00 109 N 9.43 4.39 0.00 2.82 2.85 0.00 0.00 7.20 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.53 4.44 0.00 2.80 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 0.00 111 A 7.49 4.72 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 0.00 112 W 8.96 4.82 0.00 3.19 3.10 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 0.00 113 V 8.83 4.59 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 0.75 0.00 0.00 0.98 0.00 0.00 114 C 9.27 4.75 0.00 2.79 2.85 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 0.00 115 T 9.02 4.44 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 1.25 0.00 0.00 116 N 8.19 5.54 0.00 2.68 2.78 0.00 0.00 6.52 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 0.00 117 D 9.56 5.30 0.00 3.04 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 0.00 118 M 8.77 5.33 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 119 F 9.49 5.17 0.00 2.80 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 0.00 120 R 7.58 4.60 0.00 1.46 1.51 0.00 3.25 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.63 0.00 121 L 9.51 4.37 0.00 1.49 1.57 1.14 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.76 4.12 1.13 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 0.00 123 L 8.36 3.56 0.00 1.76 1.78 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 124 H 8.24 4.27 0.00 3.28 3.63 0.00 5.69 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.54 4.66 0.00 2.81 2.94 0.00 0.00 6.96 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 0.00 126 F 8.10 4.14 0.00 2.95 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.17 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