NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 W 4.4394 8.2744 130.5364 56.9093 32.2363 174.7936 5 V 3.8017 7.8158 116.0537 59.1781 31.9501 173.3933 6 P 4.4707 0.0000 0.0000 61.8387 32.7072 173.7261 7 P 4.5037 0.0000 0.0000 62.2595 32.1418 175.1743 8 E 4.0229 8.5084 119.8425 55.4367 30.1006 175.5403 9 V 4.1212 8.0567 125.9867 61.3186 32.3514 174.7423 10 F 4.4097 8.7374 126.8082 56.0188 39.6187 176.1925 11 D 4.5645 8.5491 125.9156 53.3711 40.8377 176.0817 12 L 3.9842 8.5062 127.3982 57.8689 41.7182 179.3492 13 V 3.7232 7.9228 116.9749 66.2871 31.5165 177.7949 14 A 4.0611 8.2481 119.7296 55.0347 18.1557 179.3785 15 E 3.9789 8.4641 117.4013 59.7761 29.6150 179.2693 16 D 4.3783 8.3128 118.9537 57.1769 40.8445 179.0242 17 K 4.2072 8.5263 119.0051 59.4689 32.1677 178.9474 18 A 4.0496 8.1674 121.0755 55.5095 18.4164 179.7132 19 R 3.8852 8.2444 116.9556 59.8789 29.6510 178.1258 20 C 4.5029 8.5011 116.3511 60.0556 40.1355 176.0397 21 M 4.1378 8.4995 120.4931 58.7641 31.4358 179.0291 22 S 4.1987 7.8627 113.6745 61.5365 63.0041 176.1602 23 E 4.0901 8.0765 121.0297 58.4933 29.4340 177.5002 24 H 4.9820 7.5973 111.8696 54.3894 29.8395 174.0460 25 G 3.8944 8.1526 108.1128 46.8925 0.0000 173.9842 26 T 4.4054 7.8813 116.2016 62.7144 69.4864 175.5913 27 T 4.4852 8.9808 116.5047 60.1737 72.0648 175.9547 28 Q 3.8327 8.4417 122.0948 59.2210 29.0831 177.9389 29 A 3.9750 8.0751 121.3829 55.7148 18.3002 179.4417 30 Q 3.9377 7.8012 115.8316 59.3360 28.8040 179.3699 31 I 3.8342 7.5231 120.5729 64.1593 37.0201 178.2671 32 D 4.4066 8.2771 120.3107 57.2652 40.6036 178.3888 33 D 4.4473 8.3030 119.5765 57.4554 40.8607 179.0529 34 V 3.8145 7.8415 118.6347 66.1274 31.3700 177.6821 35 D 4.7806 8.3643 117.6575 55.9470 40.5760 177.1584 36 K 4.5258 7.5687 116.4918 56.3712 32.7757 177.2635 37 G 2.8257 8.1014 107.4464 45.4708 0.0000 173.8768 38 N 4.4900 7.6461 117.7994 52.2360 38.4842 174.4539 39 L 4.8936 8.1480 123.2826 53.0519 44.1165 176.5665 40 V 4.5515 8.0790 113.8967 60.1118 36.1469 175.2748 41 N 3.8720 7.9509 122.2975 52.5510 37.6209 175.5206 42 E 4.5601 7.4060 119.3589 53.8823 32.6269 174.5922 43 P 4.7054 0.0000 0.0000 65.2040 30.8858 178.5688 44 S 4.2498 8.1569 112.2542 61.1193 62.9285 175.8037 45 I 4.1818 7.6727 121.1129 62.9775 38.5022 177.5180 46 T 4.1409 8.5532 111.1916 64.9323 68.6718 176.1893 47 C 4.4434 8.7072 119.7828 59.6273 39.3352 175.3172 48 Y 4.1269 7.5713 118.2925 60.9895 38.3817 178.0538 49 M 3.8466 8.0861 119.3096 58.3961 32.1973 178.0828 50 Y 4.0264 8.1320 119.7014 60.7017 38.9780 177.2796 51 C 3.9778 8.4903 119.7336 59.5512 42.0388 175.2126 52 L 3.8108 7.7203 122.1511 58.2485 41.5716 179.0030 53 L 4.0237 7.6852 118.8578 57.6296 41.4977 179.1301 54 E 3.7869 7.7899 119.2383 58.9849 29.2782 178.6264 55 A 4.0016 7.8252 120.0820 54.5439 18.4253 178.5622 56 F 4.3412 7.5615 112.4543 56.6644 39.1950 176.2269 57 S 3.8393 7.7398 112.9198 59.4841 60.9425 173.1975 58 L 4.2007 7.9041 123.1074 56.8055 41.6530 177.2957 59 V 5.4901 7.5866 109.1001 58.4338 35.7644 174.4071 60 D 4.8940 8.2083 121.2228 51.8315 41.5983 176.6555 61 D 5.0896 8.5890 116.2182 54.5836 39.0174 176.1961 62 E 4.6420 9.2049 118.2883 54.5810 30.3584 175.9252 63 A 4.3967 8.3232 119.9566 53.1447 16.9701 177.8123 64 N 4.5749 7.7824 116.7185 54.4715 39.3061 175.1661 65 V 4.1892 8.1920 122.6798 62.3149 32.5469 175.2265 66 D 4.6418 8.7398 127.1971 52.9910 40.5707 176.6165 67 E 3.9497 8.6957 127.6153 59.5014 29.5467 178.9380 68 D 4.3923 8.0987 118.4203 57.4505 40.7164 178.7896 69 I 3.7506 7.5928 119.3244 64.2870 37.4398 177.9486 70 M 4.0951 8.2908 119.3652 58.7257 32.1717 178.2858 71 L 4.0388 8.4035 119.6727 57.7123 41.5276 179.7226 72 G 3.7032 7.9391 104.6388 47.3702 0.0000 175.3696 73 L 4.0775 7.5780 120.2812 55.8892 41.9191 177.0906 74 L 4.5154 6.8112 117.9862 51.7749 43.7889 174.5383 75 P 4.4892 0.0000 0.0000 62.3550 31.9170 177.0058 76 D 4.3999 8.6437 118.5934 57.6965 40.3230 179.0098 77 Q 4.1958 8.0404 116.7490 57.5368 29.1359 177.0227 78 L 4.5617 7.7165 118.5303 54.2831 42.4474 177.9718 79 Q 3.9460 7.5847 118.3950 59.3335 28.7297 179.0060 80 E 3.9931 8.0743 118.6494 59.3207 29.5417 179.3905 81 R 3.8825 7.9738 117.4047 59.1905 30.2334 178.6877 82 A 3.9206 8.0971 120.5478 55.3688 18.4166 179.4613 83 Q 4.0229 8.4857 118.3738 59.3461 28.7196 178.5474 84 S 4.1145 8.0383 114.3909 61.0866 62.4452 176.2827 85 V 3.6691 7.9968 121.1614 66.3569 31.4484 178.0381 86 M 4.2281 8.7540 118.7360 57.9908 31.5130 178.6023 87 G 3.7501 7.9384 104.6415 46.5131 0.0000 175.2453 88 K 4.3205 7.4691 118.1051 57.4621 32.6513 176.6156 89 C 4.8959 8.1942 113.7262 56.3236 41.7553 173.5772 90 L 4.9464 7.4513 118.9943 51.7097 44.1696 174.6183 91 P 4.4947 0.0000 0.0000 62.3895 32.0668 176.2259 92 T 4.1988 8.1440 109.8253 62.0368 69.3329 173.6584 93 S 4.5477 7.3798 113.9648 56.6492 65.2726 175.0332 94 G 4.0506 7.9917 110.0873 45.7317 0.0000 172.0495 95 S 4.2635 8.3923 113.5511 60.7825 63.4773 173.8283 96 D 4.6382 7.6090 118.9200 50.7220 42.8931 175.2481 97 N 4.0013 8.6204 116.1199 57.0075 38.2048 178.2083 98 C 4.3853 8.0254 117.0022 59.9967 40.4244 175.4787 99 N 4.3397 8.4970 118.6980 56.3071 38.5484 177.1014 100 K 4.2398 8.1559 121.5808 59.0479 32.0748 179.2354 101 I 3.9449 7.6779 119.6703 63.9668 37.0144 177.7931 102 Y 4.1071 8.0628 120.6468 60.9854 38.6462 177.9912 103 N 4.2240 8.5969 117.5889 56.0581 38.4945 177.2884 104 L 3.9192 8.1264 121.6465 58.0297 42.2267 178.8780 105 A 4.1409 8.2184 120.9618 55.0700 18.4471 179.4994 106 K 3.6984 8.0735 118.5872 59.7281 32.3089 178.2111 107 C 4.2768 8.3591 118.9489 59.5741 37.6820 175.7662 108 V 3.6110 8.1565 120.1688 65.9346 31.2221 177.8002 109 Q 4.1713 8.3263 119.6541 59.2858 28.7282 178.0256 110 E 4.1158 7.9422 116.8373 59.1159 29.9253 178.7889 111 S 4.3717 7.9337 114.9905 60.2060 63.9389 174.5327 112 A 4.7521 7.9316 123.4600 49.9064 18.6924 174.6695 113 P 5.0274 0.0000 0.0000 63.4827 32.2377 178.3155 114 D 4.5770 8.0121 117.7395 54.5300 40.1282 176.6887 115 V 4.4067 7.3569 111.2624 58.9895 34.8439 174.8446 116 W 5.0015 8.2394 131.3916 55.7239 32.8476 174.3018 117 F 4.4804 7.9681 124.9402 55.9522 39.4013 175.6859 118 V 4.3361 7.9798 118.2895 59.4049 34.7984 175.8387 119 I 3.9085 8.0659 121.3311 61.6237 37.0779 175.9930 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 W 8.27 4.44 0.00 3.55 3.19 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 5 V 7.82 3.80 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.98 0.00 0.00 6 P 0.00 4.47 0.00 2.24 2.08 0.00 3.87 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 7 P 0.00 4.50 0.00 2.25 2.15 0.00 3.79 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 8 E 8.51 4.02 0.00 1.88 1.89 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 1.47 1.94 0.00 9 V 8.06 4.12 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 0.89 0.00 0.00 0.93 0.00 0.00 10 F 8.74 4.41 0.00 3.06 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 11 D 8.55 4.56 0.00 2.74 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 12 L 8.51 3.98 0.00 1.74 1.67 0.88 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 13 V 7.92 3.72 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 1.25 0.00 0.00 1.11 0.00 0.00 14 A 8.25 4.06 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 15 E 8.46 3.98 0.00 2.22 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 2.68 2.63 0.00 16 D 8.31 4.38 0.00 2.93 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 17 K 8.53 4.21 0.00 1.92 2.05 0.00 1.80 0.00 0.00 1.80 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.72 1.77 7.81 18 A 8.17 4.05 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 19 R 8.24 3.89 0.00 1.92 2.08 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 20 C 8.50 4.50 0.00 3.42 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 21 M 8.50 4.14 0.00 2.04 2.30 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.31 0.00 22 S 7.86 4.20 0.00 3.89 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 23 E 8.08 4.09 0.00 2.10 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 2.06 2.29 0.00 24 H 7.60 4.98 0.00 3.31 3.35 0.00 5.81 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.15 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.88 4.41 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 1.07 0.00 0.00 27 T 8.98 4.49 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 1.20 0.00 0.00 28 Q 8.44 3.83 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 29 A 8.08 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 30 Q 7.80 3.94 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 31 I 7.52 3.83 1.85 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.26 0.95 0.00 0.00 32 D 8.28 4.41 0.00 2.87 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 33 D 8.30 4.45 0.00 2.88 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 34 V 7.84 3.81 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 1.33 0.00 0.00 1.12 0.00 0.00 35 D 8.36 4.78 0.00 3.00 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 36 K 7.57 4.53 0.00 1.86 1.86 0.00 1.60 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.30 7.81 37 G 8.10 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 0.00 0.00 0.00 38 N 7.65 4.49 0.00 2.81 2.75 0.00 0.00 6.80 7.89 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 39 L 8.15 4.89 0.00 1.61 1.69 0.71 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 40 V 8.08 4.55 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 0.69 0.00 0.00 0.94 0.00 0.00 41 N 7.95 3.87 0.00 1.44 2.20 0.00 0.00 6.86 7.65 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 42 E 7.41 4.56 0.00 1.99 1.81 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 2.24 2.28 0.00 43 P 0.00 4.71 0.00 2.16 2.14 0.00 3.85 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 2.02 0.00 44 S 8.16 4.25 0.00 4.07 4.16 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 45 I 7.67 4.18 1.91 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.40 1.07 0.00 0.00 46 T 8.55 4.14 4.56 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 1.43 0.00 0.00 47 C 8.71 4.44 0.00 2.87 2.89 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 48 Y 7.57 4.13 0.00 3.21 3.28 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 49 M 8.09 3.85 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.10 2.75 0.00 50 Y 8.13 4.03 0.00 3.12 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 51 C 8.49 3.98 0.00 3.26 3.20 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 52 L 7.72 3.81 0.00 1.22 1.44 1.04 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.69 4.02 0.00 1.73 1.61 0.91 0.74 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 54 E 7.79 3.79 0.00 1.39 1.73 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 2.18 2.28 0.00 55 A 7.83 4.00 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 56 F 7.56 4.34 0.00 3.13 3.07 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 0.00 57 S 7.74 3.84 0.00 4.04 3.94 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 58 L 7.90 4.20 0.00 1.82 1.67 0.76 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.59 5.49 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 0.55 0.00 0.00 0.78 0.00 0.00 60 D 8.21 4.89 0.00 2.92 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 61 D 8.59 5.09 0.00 2.88 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 62 E 9.20 4.64 0.00 2.12 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 2.22 2.32 0.00 63 A 8.32 4.40 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 64 N 7.78 4.57 0.00 2.94 2.77 0.00 0.00 6.69 7.56 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 65 V 8.19 4.19 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 0.94 0.00 0.00 66 D 8.74 4.64 0.00 2.71 2.56 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 67 E 8.70 3.95 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 68 D 8.10 4.39 0.00 2.67 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 69 I 7.59 3.75 1.86 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 0.46 0.96 0.00 0.00 70 M 8.29 4.10 0.00 2.02 2.01 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 2.50 2.48 0.00 71 L 8.40 4.04 0.00 1.70 1.87 0.95 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 72 G 7.94 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.58 4.08 0.00 1.74 1.59 0.74 0.85 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 74 L 6.81 4.52 0.00 1.48 1.34 0.61 0.41 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 75 P 0.00 4.49 0.00 2.20 2.16 0.00 3.55 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 2.03 1.98 0.00 76 D 8.64 4.40 0.00 2.69 2.76 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 77 Q 8.04 4.20 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 78 L 7.72 4.56 0.00 1.59 1.55 0.94 1.10 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 79 Q 7.58 3.95 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.54 0.00 80 E 8.07 3.99 0.00 2.00 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 2.39 2.39 0.00 81 R 7.97 3.88 0.00 2.01 2.00 0.00 3.17 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 82 A 8.10 3.92 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 83 Q 8.49 4.02 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 84 S 8.04 4.11 0.00 3.95 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.00 3.67 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 0.99 0.00 0.00 1.01 0.00 0.00 86 M 8.75 4.23 0.00 2.03 2.24 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.53 0.00 87 G 7.94 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 K 7.47 4.32 0.00 1.94 1.88 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.47 7.81 89 C 8.19 4.90 0.00 3.00 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 90 L 7.45 4.95 0.00 1.76 1.54 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 91 P 0.00 4.49 0.00 2.18 2.06 0.00 3.77 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 1.99 1.95 0.00 92 T 8.14 4.20 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 1.26 0.00 0.00 93 S 7.38 4.55 0.00 3.99 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 94 G 7.99 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 0.00 0.00 0.00 95 S 8.39 4.26 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 7.61 4.64 0.00 2.84 2.74 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 97 N 8.62 4.00 0.00 2.20 1.57 0.00 0.00 6.83 7.66 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 98 C 8.03 4.39 0.00 3.10 3.15 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 0.00 0.00 0.00 0.00 99 N 8.50 4.34 0.00 2.86 2.93 0.00 0.00 7.21 7.50 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 0.00 100 K 8.16 4.24 0.00 2.05 1.88 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.47 7.81 101 I 7.68 3.94 2.01 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.15 1.00 0.00 0.00 102 Y 8.06 4.11 0.00 3.14 3.18 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 0.00 103 N 8.60 4.22 0.00 2.99 2.87 0.00 0.00 6.75 7.56 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 0.00 104 L 8.13 3.92 0.00 1.85 1.83 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 105 A 8.22 4.14 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.07 3.70 0.00 1.20 1.47 0.00 1.50 0.00 0.00 1.47 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.30 7.81 107 C 8.36 4.28 0.00 3.10 3.26 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 0.00 108 V 8.16 3.61 2.41 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 1.05 0.00 0.00 1.01 0.00 0.00 109 Q 8.33 4.17 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.60 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 110 E 7.94 4.12 0.00 2.20 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 2.57 2.35 0.00 111 S 7.93 4.37 0.00 4.13 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 7.93 4.75 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 0.00 113 P 0.00 5.03 0.00 2.19 2.20 0.00 3.40 0.00 0.00 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 114 D 8.01 4.58 0.00 2.81 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 0.00 115 V 7.36 4.41 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 0.65 0.00 0.00 1.02 0.00 0.00 116 W 8.24 5.00 0.00 3.18 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 0.00 117 F 7.97 4.48 0.00 2.76 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 0.00 118 V 7.98 4.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.94 0.00 0.00 119 I 8.07 3.91 1.68 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.24 0.60 0.00 0.00