NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4099 8.3344 115.4136 57.8205 64.4187 172.0226 3 S 3.7956 8.2237 113.7333 55.8096 63.0306 172.8736 4 Q 4.1639 8.5018 125.0659 58.5273 29.8200 176.6840 5 I 3.9491 7.2778 110.5868 61.8726 38.3683 176.1980 6 R 4.2512 7.7823 119.8273 56.1956 29.9154 175.2438 7 Q 4.3240 8.6084 125.2473 56.0051 31.5906 173.3863 8 N 4.2098 8.9727 124.2685 54.9394 37.3561 173.2584 9 Y 4.8265 7.2583 115.4823 54.8326 39.6155 175.5989 10 S 4.2692 8.0726 123.0806 58.0866 65.2930 174.9948 11 T 3.7745 8.3846 114.4263 65.0135 68.3398 176.4667 12 D 4.2139 7.8340 121.2221 57.1589 40.9395 178.4708 13 V 3.3908 6.9096 119.0622 65.8723 31.4418 177.3118 14 E 3.8254 7.6603 118.6665 59.5222 29.4443 178.7948 15 A 3.9560 8.0769 120.2988 55.0877 18.4008 179.4799 16 A 3.9452 8.4942 119.6990 55.1613 18.3280 180.1169 17 V 3.5703 8.2307 117.3466 66.1727 31.5079 177.9938 18 N 4.2246 8.1447 116.3464 56.4068 38.3427 177.3588 19 S 4.1198 8.0714 114.5072 61.1765 62.4600 175.9515 20 L 4.0893 8.0681 123.1998 57.8833 41.6907 179.1339 21 V 3.7374 8.1185 118.6884 66.0406 31.4993 177.4443 22 N 4.3125 7.9919 116.9408 56.6412 38.6686 176.5342 23 L 3.9910 7.9922 121.7130 58.5107 42.1418 178.6539 24 Y 3.9598 8.5196 116.8053 60.8990 37.7896 178.2899 25 L 3.7416 8.3315 120.5559 57.5466 41.6361 179.3535 26 Q 3.9959 8.2713 119.2960 59.2847 29.0593 177.9007 27 A 3.9504 8.2390 122.0461 55.3196 18.3244 179.4728 28 S 4.2839 8.5733 111.6822 61.7882 62.5256 175.8634 29 Y 4.4417 8.1188 122.1373 61.1311 38.5218 177.7449 30 T 3.8325 8.4021 117.1038 67.2054 68.6265 176.1690 31 Y 4.0856 8.0713 118.3300 60.7120 37.9144 178.4103 32 L 4.1377 8.0908 121.5600 58.3209 42.2814 179.0429 33 S 4.3679 8.4033 113.0622 61.4497 62.3753 175.9403 34 L 3.4959 8.0251 122.0861 57.5459 40.9789 179.8359 35 G 3.7235 8.4570 104.7503 48.0114 0.0000 175.6183 36 F 4.4161 8.2599 119.6807 59.5319 39.0415 177.3276 37 Y 4.2040 8.3420 119.9201 60.8238 38.8717 177.6267 38 F 4.2267 8.2901 115.0233 58.5991 38.8605 176.2032 39 D 4.6223 7.8865 117.5806 54.4583 41.8578 176.5798 40 R 4.0561 7.2801 118.8118 56.5241 30.5961 177.4651 41 D 4.1016 8.6511 120.7786 55.8422 39.5525 176.8002 42 D 4.5882 7.9170 117.1871 53.6316 40.3307 176.4821 43 V 3.7973 7.5289 117.8063 64.4398 33.4935 175.7900 44 A 3.8463 8.1518 120.4435 53.7432 16.5101 178.4531 45 L 4.7532 7.7127 122.2736 51.6314 42.6561 177.3731 46 E 4.0633 8.7103 123.3734 59.2521 29.7474 178.0482 47 G 3.6566 8.1162 104.9239 48.1342 0.0000 175.6533 48 V 3.4830 7.6696 120.4484 65.0883 31.5247 177.8940 49 S 4.1332 8.0749 113.1711 61.7344 62.3300 175.4745 50 H 4.0063 8.6859 121.2804 59.1800 29.3874 176.8302 51 F 4.1179 8.1077 122.2067 61.5460 39.3882 177.2548 52 F 3.9211 8.0868 117.0392 60.1470 38.7473 178.0671 53 R 3.9399 8.0190 118.1488 58.9829 29.7139 178.8283 54 E 3.8022 7.8491 118.5067 59.4188 29.4846 179.4676 55 L 3.5913 7.1253 118.5242 57.2071 41.5022 179.4730 56 A 4.1513 7.5719 120.7856 55.1070 18.3300 179.3064 57 E 3.9211 8.0152 117.4406 59.3948 29.6080 178.9070 58 E 3.9539 8.2335 118.8786 59.2493 29.4972 179.3976 59 K 4.4817 8.3640 118.4772 58.9837 32.0670 179.5270 60 R 3.4154 7.8251 119.1368 59.3895 30.0663 178.4764 61 E 3.9500 8.1523 118.3554 58.8460 29.1612 179.6927 62 G 3.3433 7.6394 106.0865 47.9332 0.0000 175.3613 63 Y 4.3281 7.5463 119.9681 59.0170 38.2140 177.6266 64 E 4.0392 7.5526 120.7960 59.2205 29.5459 179.0282 65 R 4.0028 8.0164 118.9613 59.2846 30.0670 178.6184 66 L 4.3339 8.0063 119.0975 57.8334 41.7830 179.4179 67 L 4.0775 8.3585 119.1806 57.4079 41.6436 179.4609 68 K 3.9135 8.2607 119.7632 59.8683 32.2790 178.6692 69 M 3.8122 8.0904 118.3876 58.1150 32.0699 177.7415 70 Q 3.8601 8.2126 120.4201 59.5247 29.3638 178.4809 71 N 4.3557 8.0077 116.9050 56.2604 38.3142 177.5459 72 Q 3.9453 7.5684 118.3897 58.6109 29.1479 178.2643 73 R 3.9231 7.5944 117.6259 56.4508 29.9820 177.9452 74 G 3.8838 7.5779 106.8734 44.8767 0.0000 174.0040 75 G 4.3256 7.2547 107.6454 44.2216 0.0000 173.4833 76 R 4.4733 8.8703 119.3979 53.8548 31.8137 176.2888 77 A 4.3619 8.3774 125.6447 50.9430 19.0331 176.3934 78 L 4.5616 8.1688 122.7909 52.8363 44.2948 176.1251 79 F 4.8718 8.5881 122.0187 56.0467 40.8537 174.6552 80 Q 4.7793 8.2647 120.8814 53.6391 32.4823 174.9367 81 D 4.4208 8.5179 118.4713 54.6997 41.2462 176.6564 82 I 4.2963 8.0274 123.6867 59.3707 37.4340 175.9886 83 K 4.1453 8.6943 126.0874 55.7719 32.4590 177.5881 84 K 3.9010 8.5142 122.4438 55.8781 32.9738 174.8678 85 P 4.3641 0.0000 0.0000 62.3824 31.7866 177.7230 86 A 3.7650 8.6615 123.2952 54.5675 18.4297 176.9400 87 E 4.3492 6.7046 113.0844 54.7401 33.2699 174.7667 88 D 4.7320 7.8751 116.3101 54.0165 43.0657 176.4496 89 E 4.3656 7.1709 117.6068 54.6398 33.0569 174.8437 90 W 4.3975 6.2734 122.2957 55.7563 30.3188 177.7986 91 G 3.7597 7.0722 107.6634 47.4078 0.0000 175.9309 92 K 4.6169 8.9950 125.8156 54.6651 35.1324 176.9909 93 T 4.2403 8.7064 116.4297 67.1634 68.1831 174.9396 94 P 4.3841 0.0000 0.0000 65.5874 31.3400 178.5361 95 D 4.4232 8.2268 117.3224 57.2136 40.8523 178.3862 96 A 4.0657 8.2266 121.2532 55.4787 18.3872 179.3769 97 M 4.2939 8.4411 116.7786 58.8350 32.3085 178.6427 98 K 4.0584 8.1178 118.5880 59.3341 32.2297 179.2188 99 A 4.0652 8.1721 120.8624 54.9580 18.2280 179.5811 100 A 3.8492 8.3009 119.4044 55.6865 18.6461 179.6162 101 M 4.0339 8.5992 116.8092 58.6382 32.2675 178.3165 102 A 4.0392 8.1635 121.2792 54.7716 18.5397 179.3507 103 L 3.8345 7.8106 118.8730 58.3751 42.2286 179.0542 104 E 4.0040 8.4115 118.6256 59.5274 29.4395 179.6110 105 K 4.2037 8.2081 118.4046 59.0815 32.0148 179.4426 106 K 3.9332 7.9317 120.0507 59.3345 32.1541 178.8676 107 L 3.9077 7.9566 119.2095 57.9700 41.5321 178.8224 108 N 4.3737 8.6749 117.2275 56.9261 38.6552 176.6321 109 Q 3.9121 8.1680 120.5144 59.1721 29.2220 177.8921 110 A 4.1328 8.0723 121.8202 55.1434 18.2753 179.7057 111 L 3.9249 8.4776 117.8463 58.0905 41.8168 179.7569 112 L 4.0705 8.2298 119.0197 57.8178 41.4804 179.4034 113 D 4.3953 8.3951 119.4723 57.0737 40.6675 178.5134 114 L 3.9703 7.9147 121.0660 58.3335 42.1326 178.4474 115 H 4.0594 8.7043 118.4786 59.0469 29.8868 177.0860 116 A 4.0132 8.1737 122.6230 55.1811 18.2996 179.3452 117 L 4.0189 8.1135 118.9921 58.1741 42.0710 179.3802 118 G 3.6198 8.3468 105.8656 48.0198 0.0000 175.8456 119 S 4.1486 8.2178 117.5022 61.2412 62.5772 176.7344 120 A 4.0467 7.7452 122.3159 54.7637 18.2393 178.9558 121 R 4.1948 7.9331 113.8726 55.2232 31.3365 176.5128 122 T 3.4446 7.2080 108.6655 63.0339 68.1190 174.4397 123 D 4.8396 7.9710 121.0318 52.3344 40.1205 172.9656 124 P 4.3129 0.0000 0.0000 65.6632 31.3965 178.0581 125 H 4.2102 8.2033 117.5578 58.9361 29.8973 176.6875 126 L 4.0026 8.2122 122.1825 58.4217 41.9336 178.5900 127 C 3.7795 7.8267 116.1270 63.0371 28.0397 175.7788 128 D 4.3778 8.1402 119.4110 57.0909 40.8846 177.8278 129 F 4.3196 8.4630 121.4478 61.6180 39.3945 177.2532 130 L 4.1776 8.0973 118.4398 57.6623 41.1757 179.2383 131 E 4.0331 8.1876 117.8452 59.7633 29.4952 179.4254 132 T 3.9316 7.9800 114.5787 66.8498 68.7711 176.2050 133 H 4.3484 7.6269 115.0620 56.5346 29.4916 176.1087 134 F 4.6494 7.7621 117.1676 59.0029 40.4958 177.1293 135 L 3.9857 8.4588 118.5936 58.6162 41.6879 179.5298 136 D 4.3980 8.0668 116.7568 57.2533 41.3392 178.0589 137 E 3.9943 8.1026 118.9881 59.1352 29.4782 178.9674 138 E 3.9925 8.2132 118.5422 59.4656 29.6486 179.3010 139 V 3.6081 7.5750 117.9283 66.1767 31.5173 178.2534 140 K 4.0044 8.0396 117.9571 59.2702 31.8106 179.2080 141 L 3.9971 7.8894 120.3522 57.9952 41.9922 179.0182 142 I 3.7095 8.4019 120.1209 64.4172 37.1510 178.2752 143 K 3.9556 8.1614 120.3781 59.3343 32.0574 178.6507 144 K 3.8813 8.0291 119.9120 59.8321 32.1721 178.7945 145 M 4.2907 8.4464 119.2991 58.2885 31.9628 178.9443 146 G 3.6748 8.5942 106.4133 47.8227 0.0000 175.4694 147 D 4.3312 8.1583 121.1009 57.4494 40.8587 178.5177 148 H 4.1358 7.7698 116.0952 58.8631 28.6369 177.7462 149 L 4.0029 7.9616 120.5755 58.3233 41.4981 179.7030 150 T 3.8570 7.8052 115.2686 66.8518 68.3939 176.4128 151 N 4.4192 8.1122 118.2859 56.1193 38.3808 177.6088 152 L 4.0400 8.2903 120.1365 57.8964 41.7706 178.6792 153 H 4.2664 8.4023 117.7891 59.3080 29.9312 177.0619 154 R 4.0525 7.8835 119.3431 59.0463 29.9187 176.6980 155 L 4.3387 7.5384 122.1157 54.8728 41.9168 176.4017 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 2 S 8.33 4.41 0.00 4.01 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 3 S 8.22 3.80 0.00 4.02 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 4 Q 8.50 4.16 0.00 2.19 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 5 I 7.28 3.95 1.82 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.56 0.88 0.00 0.00 6 R 7.78 4.25 0.00 1.79 1.95 0.00 3.15 0.00 0.00 3.86 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 7 Q 8.61 4.32 0.00 2.07 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.19 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 8 N 8.97 4.21 0.00 2.88 2.89 0.00 0.00 6.95 7.54 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 9 Y 7.26 4.83 0.00 2.88 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 10 S 8.07 4.27 0.00 3.99 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 11 T 8.38 3.77 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 1.19 0.00 0.00 12 D 7.83 4.21 0.00 2.66 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 13 V 6.91 3.39 1.67 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 0.80 0.00 0.00 0.79 0.00 0.00 14 E 7.66 3.83 0.00 1.91 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 0.00 2.32 2.68 0.00 15 A 8.08 3.96 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 16 A 8.49 3.95 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 17 V 8.23 3.57 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 1.15 0.00 0.00 1.09 0.00 0.00 18 N 8.14 4.22 0.00 2.92 2.77 0.00 0.00 6.68 7.85 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 19 S 8.07 4.12 0.00 4.08 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 20 L 8.07 4.09 0.00 1.98 1.84 1.04 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 21 V 8.12 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 1.20 0.00 0.00 1.01 0.00 0.00 22 N 7.99 4.31 0.00 2.78 3.05 0.00 0.00 6.90 6.56 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 23 L 7.99 3.99 0.00 2.00 1.92 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 8.52 3.96 0.00 3.54 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 25 L 8.33 3.74 0.00 1.86 1.57 0.96 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.27 4.00 0.00 2.34 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.60 0.00 27 A 8.24 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 28 S 8.57 4.28 0.00 4.36 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 0.00 29 Y 8.12 4.44 0.00 3.24 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 8.40 3.83 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 0.76 0.00 0.00 31 Y 8.07 4.09 0.00 3.07 3.16 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 0.00 0.00 0.00 32 L 8.09 4.14 0.00 2.18 2.20 1.36 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.40 4.37 0.00 4.03 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.03 3.50 0.00 1.38 0.89 -0.08 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.46 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 36 F 8.26 4.42 0.00 3.39 3.24 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 37 Y 8.34 4.20 0.00 3.47 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 0.00 38 F 8.29 4.23 0.00 3.25 3.32 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 39 D 7.89 4.62 0.00 2.77 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 40 R 7.28 4.06 0.00 1.80 1.88 0.00 3.16 0.00 0.00 2.91 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 41 D 8.65 4.10 0.00 2.78 2.81 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 42 D 7.92 4.59 0.00 2.76 2.78 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 43 V 7.53 3.80 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 0.45 0.00 0.00 0.24 0.00 0.00 44 A 8.15 3.85 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 45 L 7.71 4.75 0.00 2.06 1.70 1.19 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.71 4.06 0.00 2.06 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 2.41 2.43 0.00 47 G 8.12 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 48 V 7.67 3.48 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 0.41 0.00 0.00 0.80 0.00 0.00 49 S 8.07 4.13 0.00 4.07 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 50 H 8.69 4.01 0.00 3.27 3.42 0.00 5.65 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 8.11 4.12 0.00 3.06 2.88 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 52 F 8.09 3.92 0.00 3.20 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 53 R 8.02 3.94 0.00 1.89 1.85 0.00 2.78 0.00 0.00 3.01 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.76 0.00 54 E 7.85 3.80 0.00 1.88 1.75 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 2.18 2.40 0.00 55 L 7.13 3.59 0.00 0.57 0.44 -0.14 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.57 4.15 1.51 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 0.00 0.00 0.00 57 E 8.02 3.92 0.00 2.22 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 0.00 2.26 2.35 0.00 58 E 8.23 3.95 0.00 2.09 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 2.23 2.40 0.00 59 K 8.36 4.48 0.00 2.18 2.25 0.00 1.68 0.00 0.00 1.94 0.00 0.00 2.96 0.00 0.00 3.39 0.00 0.00 0.00 0.00 1.89 1.91 7.81 60 R 7.83 3.42 0.00 2.14 2.01 0.00 3.13 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.78 0.00 61 E 8.15 3.95 0.00 2.12 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 2.23 2.42 0.00 62 G 7.64 3.34 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 0.00 63 Y 7.55 4.33 0.00 3.35 3.36 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 64 E 7.55 4.04 0.00 2.00 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 0.00 2.25 2.08 0.00 65 R 8.02 4.00 0.00 2.05 2.17 0.00 2.50 0.00 0.00 2.59 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.64 0.00 66 L 8.01 4.33 0.00 1.93 1.78 0.68 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.36 4.08 0.00 2.01 1.84 1.35 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.26 3.91 0.00 2.17 1.95 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.49 7.81 69 M 8.09 3.81 0.00 1.80 1.14 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.99 0.00 70 Q 8.21 3.86 0.00 2.34 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.59 0.00 71 N 8.01 4.36 0.00 2.86 2.81 0.00 0.00 7.12 6.87 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 72 Q 7.57 3.95 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 73 R 7.59 3.92 0.00 0.67 0.66 0.00 3.00 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.10 0.00 74 G 7.58 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 75 G 7.25 4.33 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 0.00 76 R 8.87 4.47 0.00 1.76 1.84 0.00 3.33 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 77 A 8.38 4.36 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 78 L 8.17 4.56 0.00 1.48 1.50 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 79 F 8.59 4.87 0.00 3.05 2.94 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 80 Q 8.26 4.78 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 81 D 8.52 4.42 0.00 2.69 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 82 I 8.03 4.30 1.86 0.00 0.00 0.71 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 0.51 1.02 0.00 0.00 83 K 8.69 4.15 0.00 2.02 1.78 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.09 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.46 7.81 84 K 8.51 3.90 0.00 1.67 1.84 0.00 1.51 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.39 1.40 7.81 85 P 0.00 4.36 0.00 2.44 2.32 0.00 3.21 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.74 0.00 86 A 8.66 3.77 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 87 E 6.70 4.35 0.00 1.16 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 1.51 1.47 0.00 88 D 7.88 4.73 0.00 2.45 2.57 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 89 E 7.17 4.37 0.00 1.73 1.82 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 2.36 2.29 0.00 90 W 6.27 4.40 0.00 2.60 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 G 7.07 3.76 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 0.00 0.00 0.00 92 K 8.99 4.62 0.00 2.04 1.87 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.53 7.81 93 T 8.71 4.24 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 1.23 0.00 0.00 94 P 0.00 4.38 0.00 2.22 2.17 0.00 3.70 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 95 D 8.23 4.42 0.00 3.15 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 96 A 8.23 4.07 1.58 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 97 M 8.44 4.29 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.65 0.00 98 K 8.12 4.06 0.00 2.02 1.90 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.66 7.81 99 A 8.17 4.07 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 0.00 100 A 8.30 3.85 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 0.00 0.00 0.00 0.00 0.00 101 M 8.60 4.03 0.00 2.14 2.16 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 2.65 2.60 0.00 102 A 8.16 4.04 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 0.00 103 L 7.81 3.83 0.00 1.78 1.85 0.82 0.48 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 0.00 104 E 8.41 4.00 0.00 2.21 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 105 K 8.21 4.20 0.00 1.97 1.88 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.69 7.81 106 K 7.93 3.93 0.00 1.95 2.01 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.48 7.81 107 L 7.96 3.91 0.00 1.88 1.61 0.75 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.67 4.37 0.00 2.91 3.00 0.00 0.00 6.95 7.47 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 0.00 109 Q 8.17 3.91 0.00 2.39 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 110 A 8.07 4.13 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 0.00 111 L 8.48 3.92 0.00 1.91 1.77 1.15 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.23 4.07 0.00 1.86 1.73 0.93 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.40 4.40 0.00 2.90 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 0.00 114 L 7.91 3.97 0.00 1.88 1.86 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 115 H 8.70 4.06 0.00 3.35 3.40 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.17 4.01 1.45 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 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.11 4.02 0.00 1.77 1.84 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.35 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.22 4.15 0.00 4.07 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 0.00 120 A 7.75 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 0.00 121 R 7.93 4.19 0.00 1.78 1.94 0.00 3.44 0.00 0.00 3.25 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.71 0.00 122 T 7.21 3.44 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 1.27 0.00 0.00 123 D 7.97 4.84 0.00 2.72 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.31 0.00 2.34 2.34 0.00 3.84 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 2.12 2.06 0.00 125 H 8.20 4.21 0.00 3.25 3.37 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.21 4.00 0.00 1.99 1.94 1.05 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 127 C 7.83 3.78 0.00 3.14 2.88 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 0.00 128 D 8.14 4.38 0.00 2.86 2.73 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 0.00 129 F 8.46 4.32 0.00 3.05 3.32 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 0.00 130 L 8.10 4.18 0.00 1.83 1.74 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.19 4.03 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.72 0.00 132 T 7.98 3.93 4.07 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 0.00 0.00 0.97 0.00 0.00 133 H 7.63 4.35 0.00 2.29 2.61 0.00 5.62 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 0.00 134 F 7.76 4.65 0.00 3.13 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.46 3.99 0.00 1.68 1.78 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 136 D 8.07 4.40 0.00 2.73 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.10 3.99 0.00 2.18 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 0.00 2.34 2.26 0.00 138 E 8.21 3.99 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.59 0.00 139 V 7.57 3.61 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 1.04 0.00 0.00 0.95 0.00 0.00 140 K 8.04 4.00 0.00 1.87 1.83 0.00 1.70 0.00 0.00 1.56 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.66 7.81 141 L 7.89 4.00 0.00 1.90 1.89 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 142 I 8.40 3.71 2.10 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 1.45 0.61 0.94 0.00 0.00 143 K 8.16 3.96 0.00 1.94 2.01 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.48 7.81 144 K 8.03 3.88 0.00 2.08 2.01 0.00 1.73 0.00 0.00 1.80 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.46 7.81 145 M 8.45 4.29 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.76 0.00 146 G 8.59 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 0.00 147 D 8.16 4.33 0.00 2.80 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 H 7.77 4.14 0.00 3.31 3.19 0.00 5.63 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 0.00 149 L 7.96 4.00 0.00 1.88 1.75 0.97 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 150 T 7.81 3.86 4.38 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 1.20 0.00 0.00 151 N 8.11 4.42 0.00 2.90 2.85 0.00 0.00 7.02 6.76 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 0.00 152 L 8.29 4.04 0.00 1.72 1.76 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.40 4.27 0.00 3.25 3.50 0.00 5.76 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 R 7.88 4.05 0.00 1.95 2.12 0.00 3.31 0.00 0.00 3.22 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 155 L 7.54 4.34 0.00 1.68 1.56 0.92 0.93 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