NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 K 4.2326 8.3101 120.1342 56.4803 32.8537 172.8780 14 A 4.3983 7.8420 118.8368 51.7545 21.6154 174.1119 15 K 4.6446 7.4838 114.2539 53.4009 36.9306 175.6200 16 T 4.0695 8.3433 114.3708 61.6137 69.4506 175.9210 17 R 3.9960 8.7324 123.4260 59.2681 29.9840 179.5257 18 S 4.1884 8.0037 115.0309 61.6395 62.9548 176.5866 19 S 4.1354 7.9547 116.5205 61.4817 62.5860 176.3521 20 R 3.9040 7.6804 120.1830 58.3651 29.8853 177.5795 21 A 4.6415 7.2819 114.3441 50.5967 20.0011 176.2260 22 G 3.7870 8.7144 105.5114 46.7803 0.0000 173.8520 23 L 4.9740 7.9970 119.0243 52.5406 44.1808 177.4019 24 Q 4.2127 9.2247 122.3436 58.8524 29.1138 177.2533 25 F 4.4310 8.5154 115.5823 56.9636 39.5214 174.8136 26 P 4.5835 0.0000 0.0000 61.3344 29.7180 176.7897 27 V 3.6698 8.3100 126.1106 67.0043 31.5561 177.0759 28 G 3.9049 8.2110 104.4629 48.1145 0.0000 174.8868 29 R 3.8631 8.0019 120.8611 59.0777 30.1606 178.1899 30 V 3.5935 8.1017 118.1919 66.4680 31.2133 177.2110 31 H 4.0332 8.4610 117.8117 59.5225 29.6090 177.1234 32 R 3.9633 7.8143 119.9786 59.5010 29.8359 178.3842 33 L 4.0954 8.3995 119.1838 57.8228 41.3892 179.6185 34 L 4.1876 8.0512 119.1141 57.6823 41.4609 179.5972 35 R 3.9337 7.7761 118.1776 59.2096 29.9645 179.0892 36 K 4.1685 7.8328 115.3436 58.6080 32.9588 177.9433 37 G 3.5932 7.9052 107.6643 45.6198 0.0000 173.1266 38 N 4.0567 7.4447 116.2930 54.4804 35.9725 173.1596 39 Y 4.4533 7.4511 112.2568 59.1414 40.1297 176.4924 40 A 4.4607 7.7008 118.4155 51.0236 21.9069 175.3880 41 E 4.0685 9.0467 121.0768 59.0202 29.5964 177.5305 42 R 4.6669 7.7391 115.3180 54.0776 32.7743 175.4771 43 V 4.2999 8.1238 120.4377 60.5730 33.7698 175.7722 44 G 3.7549 8.5396 116.0326 45.3660 0.0000 173.8671 45 A 4.2168 8.6761 124.0431 53.7550 18.9038 178.6538 46 G 3.9169 7.9632 103.4944 46.0281 0.0000 175.4692 47 A 3.9760 7.8609 122.4321 55.1721 18.1270 177.8788 48 P 4.2664 0.0000 0.0000 65.8503 31.3478 178.3272 49 V 3.9217 7.9271 117.5321 66.1226 31.4452 176.7811 50 Y 3.8889 8.0045 118.6983 60.7966 38.5341 178.2157 51 L 3.9852 8.1063 120.4972 58.1679 42.3014 178.3003 52 A 4.1036 8.9554 121.7258 55.4941 18.2780 179.1291 53 A 3.8222 7.9460 118.7882 55.6441 18.3815 180.1063 54 V 3.6655 7.6709 116.2504 66.0279 31.5558 178.3106 55 L 4.0081 8.2269 119.0095 57.6583 41.4322 178.5857 56 E 2.6810 8.0361 119.5173 59.2156 29.3477 177.9459 57 Y 4.2376 8.2499 119.4824 61.1118 38.6668 178.6306 58 L 3.7629 7.9021 119.4008 57.8464 41.6942 179.6559 59 T 3.8563 8.2786 115.9766 66.4235 68.3205 176.3982 60 A 3.8723 8.5208 123.7239 55.1891 18.3600 179.1608 61 E 3.6504 7.9808 118.0298 59.4762 29.5282 179.2280 62 I 3.6982 7.3675 119.7280 64.1507 36.4467 178.1114 63 L 3.9700 7.7748 119.8478 57.9072 41.5117 178.9630 64 E 4.1270 8.2673 119.1330 59.7083 29.3712 179.1276 65 L 4.0050 8.0954 118.4189 57.3353 41.5971 179.0569 66 A 4.2576 8.6510 121.1635 54.1151 18.7085 179.4917 67 G 3.6818 9.2881 103.9273 48.3223 0.0000 175.2329 68 N 4.4522 8.2049 118.6011 55.9713 37.0243 177.2780 69 A 4.1066 7.6910 121.9798 55.2102 18.3682 179.5462 70 A 3.9937 8.0877 119.2391 55.0517 18.3260 179.2070 71 R 3.7946 7.7636 117.1482 59.9261 29.9435 178.0651 72 D 4.6157 7.9603 118.1294 56.0675 40.9734 176.6036 73 N 4.9492 6.8740 114.3174 52.7698 39.8780 175.4959 74 K 3.9751 8.8241 116.0662 56.6095 30.6574 176.0762 75 K 4.6350 8.2222 118.7926 54.9816 34.0270 176.3709 76 T 4.3405 8.3408 110.4324 61.4513 69.5667 174.3110 77 R 4.5093 7.5882 122.5618 54.3315 32.2285 174.6271 78 I 4.0406 8.5010 126.9722 61.2317 37.8001 175.7819 79 I 4.3528 8.0153 119.1096 58.5598 40.3086 174.7384 80 P 4.2853 0.0000 0.0000 65.8944 31.1703 178.7880 81 R 3.9134 8.0200 116.8019 59.6408 29.7337 178.0482 82 H 4.2255 7.5896 114.8174 58.8410 28.6906 177.2879 83 L 3.9396 7.7448 120.4982 58.0382 41.5055 179.1960 84 Q 3.9572 8.1581 118.5626 59.4057 28.8607 178.4307 85 L 3.9231 7.7951 118.9008 57.8609 41.4344 179.1500 86 A 3.9807 8.4728 120.8652 55.4044 18.0011 179.9118 87 V 3.6081 7.8560 115.2875 66.2256 31.9428 178.1749 88 R 4.1432 8.3995 114.8517 57.5003 29.8978 177.7152 89 N 4.7688 7.6430 116.0935 54.0156 39.6868 175.0000 90 D 4.3311 7.2957 120.2232 54.2319 41.7781 176.2675 91 E 3.9355 9.0061 127.7729 59.6454 29.5062 178.5002 92 E 4.0880 8.2987 117.9227 58.8477 29.4930 179.3167 93 L 4.0436 7.9715 118.8225 57.5509 41.8091 178.1679 94 N 4.1863 8.0093 115.8583 56.8870 38.9410 176.3194 95 K 4.0340 7.8955 120.0482 59.5759 32.1778 178.2377 96 L 3.9768 7.3738 119.3383 57.2599 42.2565 177.5082 97 L 4.7904 7.9857 118.5156 54.2708 42.3212 178.3543 98 G 3.7813 8.2859 108.8300 47.4085 0.0000 175.3328 99 R 4.4584 7.8491 116.8912 55.7602 31.1868 175.8089 100 V 4.1880 7.3642 118.3677 61.6006 32.7373 175.0417 101 T 4.5361 8.2522 122.4319 61.7075 70.3945 173.7575 102 I 4.0641 8.2931 127.6429 59.9331 38.0636 175.7820 103 A 4.0378 8.5518 128.6944 53.6314 18.7501 176.7397 104 Q 3.4467 8.6619 119.9833 57.2055 26.4246 174.6832 105 G 3.9238 8.3128 103.7887 44.2779 0.0000 176.3021 106 G 3.6782 7.8490 108.0539 46.5011 0.0000 171.7888 107 V 4.5023 7.9958 112.4163 59.1338 35.2968 174.5677 108 L 4.3424 8.1915 120.8785 53.0811 42.2647 175.4313 109 P 4.3011 0.0000 0.0000 62.9884 31.5192 175.3877 110 N 4.8049 8.3632 120.2694 52.3870 41.8825 173.2250 111 I 4.5690 8.1084 125.6230 59.1104 40.4168 175.3453 112 Q 4.1167 8.5976 124.6444 55.9142 28.9997 177.4286 113 S 4.2812 8.6503 117.0562 59.9976 63.3124 175.0036 114 V 3.9912 7.6692 119.6507 62.2334 31.5477 176.2616 115 L 4.4971 8.0450 120.0131 54.7685 42.1521 176.2437 116 L 4.5750 7.6692 118.4959 53.0157 43.5004 174.2452 117 P 3.8030 0.0000 0.0000 61.9374 30.3196 175.5791 118 K 3.5475 9.4878 121.3773 57.8054 30.7075 176.1545 119 K 3.7357 8.0215 127.4097 57.0708 31.5244 175.9634 120 T 4.2673 8.3277 112.5933 62.8721 67.1715 174.5137 121 E 4.2776 8.3629 124.3775 56.1906 29.8971 176.2991 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 13 K 8.31 4.23 0.00 1.76 1.86 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.45 7.81 14 A 7.84 4.40 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 7.48 4.64 0.00 1.71 1.69 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.32 7.81 16 T 8.34 4.07 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 17 R 8.73 4.00 0.00 1.88 2.05 0.00 3.13 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 18 S 8.00 4.19 0.00 3.89 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 19 S 7.95 4.14 0.00 4.06 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 20 R 7.68 3.90 0.00 2.03 2.07 0.00 3.13 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 21 A 7.28 4.64 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 22 G 8.71 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 23 L 8.00 4.97 0.00 1.70 1.78 0.97 0.77 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 24 Q 9.22 4.21 0.00 2.21 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.99 0.00 0.00 0.00 0.00 0.00 2.51 2.38 0.00 25 F 8.52 4.43 0.00 2.90 3.01 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 26 P 0.00 4.58 0.00 2.26 2.20 0.00 3.68 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.92 0.00 27 V 8.31 3.67 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 1.11 0.00 0.00 0.98 0.00 0.00 28 G 8.21 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 29 R 8.00 3.86 0.00 1.89 2.13 0.00 3.17 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 30 V 8.10 3.59 2.25 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 0.97 0.00 0.00 1.05 0.00 0.00 31 H 8.46 4.03 0.00 3.25 3.50 0.00 5.64 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 32 R 7.81 3.96 0.00 1.93 2.13 0.00 3.17 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 33 L 8.40 4.10 0.00 1.89 1.77 0.94 0.54 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 34 L 8.05 4.19 0.00 1.90 1.73 0.88 0.75 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 35 R 7.78 3.93 0.00 1.96 1.99 0.00 3.18 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 36 K 7.83 4.17 0.00 1.86 1.95 0.00 1.61 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.60 1.41 7.81 37 G 7.91 3.59 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 0.00 0.00 0.00 38 N 7.44 4.06 0.00 2.61 2.71 0.00 0.00 6.84 8.74 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 39 Y 7.45 4.45 0.00 3.03 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 40 A 7.70 4.46 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 41 E 9.05 4.07 0.00 1.94 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 2.31 2.37 0.00 42 R 7.74 4.67 0.00 1.81 1.80 0.00 3.20 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 43 V 8.12 4.30 1.97 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 0.74 0.00 0.00 0.92 0.00 0.00 44 G 8.54 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 45 A 8.68 4.22 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 46 G 7.96 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 A 7.86 3.98 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 48 P 0.00 4.27 0.00 2.35 2.44 0.00 3.79 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 2.16 2.19 0.00 49 V 7.93 3.92 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 1.03 0.00 0.00 0.97 0.00 0.00 50 Y 8.00 3.89 0.00 3.21 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 51 L 8.11 3.99 0.00 1.86 1.89 0.95 0.99 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 52 A 8.96 4.10 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 53 A 7.95 3.82 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 54 V 7.67 3.67 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 1.12 0.00 0.00 1.17 0.00 0.00 55 L 8.23 4.01 0.00 2.06 1.99 1.05 0.91 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 56 E 8.04 2.68 0.00 1.50 1.83 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 2.06 1.75 0.00 57 Y 8.25 4.24 0.00 2.99 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 58 L 7.90 3.76 0.00 1.88 1.68 1.06 0.88 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 59 T 8.28 3.86 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 1.37 0.00 0.00 60 A 8.52 3.87 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.98 3.65 0.00 1.39 1.70 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 2.16 2.28 0.00 62 I 7.37 3.70 1.84 0.00 0.00 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 1.47 0.91 0.90 0.00 0.00 63 L 7.77 3.97 0.00 1.75 1.72 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.27 4.13 0.00 1.98 2.18 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 2.28 2.35 0.00 65 L 8.10 4.00 0.00 1.85 1.68 0.97 0.80 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 66 A 8.65 4.26 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 67 G 9.29 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 68 N 8.20 4.45 0.00 2.91 2.86 0.00 0.00 6.93 8.30 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 69 A 7.69 4.11 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 70 A 8.09 3.99 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 71 R 7.76 3.79 0.00 1.91 2.14 0.00 3.10 0.00 0.00 3.16 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 72 D 7.96 4.62 0.00 2.68 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 N 6.87 4.95 0.00 2.64 2.78 0.00 0.00 7.02 7.49 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 74 K 8.82 3.98 0.00 1.88 1.98 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.54 7.81 75 K 8.22 4.63 0.00 1.69 1.73 0.00 1.80 0.00 0.00 1.81 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.59 7.81 76 T 8.34 4.34 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 77 R 7.59 4.51 0.00 1.75 1.84 0.00 3.24 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.61 0.00 78 I 8.50 4.04 1.90 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 1.48 0.66 0.98 0.00 0.00 79 I 8.02 4.35 1.81 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.67 0.89 0.00 0.00 80 P 0.00 4.29 0.00 2.35 2.22 0.00 3.57 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 81 R 8.02 3.91 0.00 1.88 1.86 0.00 3.28 0.00 0.00 3.38 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 82 H 7.59 4.23 0.00 3.31 3.31 0.00 5.71 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 83 L 7.74 3.94 0.00 1.85 1.74 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 8.16 3.96 0.00 2.15 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.88 0.00 0.00 0.00 0.00 0.00 2.74 2.54 0.00 85 L 7.80 3.92 0.00 1.96 1.72 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.47 3.98 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 87 V 7.86 3.61 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.93 0.00 0.00 88 R 8.40 4.14 0.00 1.77 1.97 0.00 3.50 0.00 0.00 3.23 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.81 0.00 89 N 7.64 4.77 0.00 2.75 2.86 0.00 0.00 6.87 8.98 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 90 D 7.30 4.33 0.00 2.86 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 91 E 9.01 3.94 0.00 2.08 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 2.38 2.41 0.00 92 E 8.30 4.09 0.00 2.24 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 2.34 2.36 0.00 93 L 7.97 4.04 0.00 1.69 1.70 0.89 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 94 N 8.01 4.19 0.00 2.91 3.10 0.00 0.00 7.24 6.20 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 95 K 7.90 4.03 0.00 2.06 1.79 0.00 1.72 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.45 7.81 96 L 7.37 3.98 0.00 1.65 1.90 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 97 L 7.99 4.79 0.00 1.73 1.61 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.29 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 99 R 7.85 4.46 0.00 1.79 1.95 0.00 3.37 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.53 0.00 100 V 7.36 4.19 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 0.78 0.00 0.00 0.94 0.00 0.00 101 T 8.25 4.54 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 102 I 8.29 4.06 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.49 0.91 0.00 0.00 103 A 8.55 4.04 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.66 3.45 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 105 G 8.31 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 7.85 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 0.00 107 V 8.00 4.50 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.93 0.00 0.00 108 L 8.19 4.34 0.00 1.63 1.60 1.00 1.04 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 0.00 109 P 0.00 4.30 0.00 2.17 2.08 0.00 3.80 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 110 N 8.36 4.80 0.00 2.66 2.68 0.00 0.00 7.00 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 0.00 111 I 8.11 4.57 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.79 0.91 0.00 0.00 112 Q 8.60 4.12 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.96 0.00 0.00 0.00 0.00 0.00 2.45 2.29 0.00 113 S 8.65 4.28 0.00 4.15 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 0.00 114 V 7.67 3.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.93 0.00 0.00 115 L 8.04 4.50 0.00 1.77 1.73 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.67 4.58 0.00 1.62 1.58 0.92 1.06 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 0.00 117 P 0.00 3.80 0.00 2.06 1.94 0.00 3.83 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 2.02 2.13 0.00 118 K 9.49 3.55 0.00 1.97 1.89 0.00 1.70 0.00 0.00 1.63 0.00 0.00 3.23 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.40 7.81 119 K 8.02 3.74 0.00 1.91 1.88 0.00 1.77 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.44 7.81 120 T 8.33 4.27 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 121 E 8.36 4.28 0.00 1.92 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 2.28 2.42 0.00