NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.8012 8.4449 117.8329 56.2527 29.9979 172.9366 1D H 4.5456 8.6812 118.0527 55.9588 29.5799 173.2943 1E H 5.0862 7.5950 115.3675 53.5855 33.5197 171.9951 1F H 4.6287 8.9002 117.0601 55.9595 28.9511 174.3102 1G F 4.8330 8.3642 119.3920 57.8345 39.8255 174.1008 2 N 4.6308 8.4963 117.4317 52.3562 39.0089 174.5563 3 L 4.7489 8.0398 123.4860 52.0791 43.8264 174.7507 4 P 4.4706 0.0000 0.0000 61.6140 32.2078 174.2091 5 P 4.3910 0.0000 0.0000 62.1234 32.4846 174.2431 6 G 3.6785 9.2041 103.3928 44.9969 0.0000 171.0564 7 N 4.1533 7.8310 114.3860 52.8064 39.3053 173.7884 8 Y 4.8700 7.8983 114.8738 58.0438 38.4639 177.0218 9 K 4.1317 8.6870 122.4070 58.6198 32.2606 177.3271 10 K 4.7289 7.6085 115.5091 53.2914 35.2504 173.8295 11 P 4.7061 0.0000 0.0000 63.1475 32.3298 175.1174 12 K 4.9290 9.5295 119.7023 55.0285 37.4109 174.8480 13 L 5.0692 9.1325 121.0498 53.2344 44.4863 176.2203 14 L 5.0483 8.6485 123.1246 53.5192 43.5065 174.3546 15 Y 4.8939 9.3065 126.9163 56.6045 40.5824 173.5350 16 C 4.1180 8.2726 127.7210 56.7911 32.6337 174.7495 17 S 3.9408 8.3054 122.6591 60.7485 63.0436 174.9745 18 N 4.2143 8.0337 118.7249 56.1350 38.3337 175.4181 19 G 3.9136 7.5077 101.3683 44.1361 0.0000 171.7657 20 G 3.3447 7.7606 106.7177 44.8056 0.0000 173.1570 21 H 4.9274 7.1326 114.1606 53.6540 33.3697 174.3732 22 F 5.3521 9.1163 120.1164 55.9902 40.5593 175.3038 23 L 4.4695 9.0777 126.1465 55.3664 43.2912 175.6227 24 R 4.9300 9.4113 126.1095 54.6279 33.6718 173.9342 25 I 4.8055 8.2218 126.7545 59.3914 38.6190 175.7022 26 L 4.0802 8.7837 128.0158 53.4498 42.2776 176.8426 27 P 4.1439 0.0000 0.0000 65.8609 31.2833 177.1023 28 D 4.5817 8.0097 114.6702 53.3505 39.5863 177.1514 29 G 4.1343 8.5380 109.7456 45.4923 0.0000 174.1400 30 T 4.3561 8.1570 117.0624 63.2490 69.1531 173.6986 31 V 4.8454 7.8894 123.5143 61.3037 34.7898 174.6326 32 D 4.5779 8.4680 124.6612 53.1141 42.8558 174.2118 33 G 4.5706 8.5961 104.6163 45.4987 0.0000 172.2639 34 T 4.9928 8.7901 114.3258 60.6955 71.1328 174.5509 35 R 4.2716 8.7967 123.9771 56.3369 30.9830 176.3199 36 D 4.6446 8.2327 119.6190 53.1264 40.2602 176.6956 37 R 3.6962 8.6592 127.9321 58.3053 30.2825 177.1960 38 S 4.3785 8.3628 110.9876 58.7101 63.6572 174.0628 39 D 4.3649 7.7530 121.9470 55.0262 41.2115 176.0015 40 Q 4.3483 8.4471 122.9932 56.4300 29.4035 175.9370 41 H 4.8751 9.4210 116.2297 55.4629 29.0532 175.3746 42 I 4.5579 7.4460 110.8301 59.9325 38.2204 175.2143 43 Q 4.2648 7.8151 122.0757 55.6425 29.8003 174.6668 44 L 4.9962 8.9779 124.5498 52.8135 45.5404 175.2469 45 Q 4.7199 9.3119 125.3666 54.5525 30.6702 174.4581 46 L 5.5126 8.8319 126.3380 53.1261 43.8880 176.0496 47 S 4.5513 8.0519 114.1177 56.8773 66.5492 172.8875 48 A 4.7975 8.3635 123.0357 51.2666 20.3347 177.5878 49 E 4.3435 8.5377 119.2047 56.3836 29.6300 179.6822 50 E 4.3269 7.3787 118.3951 54.9320 30.5672 175.1812 51 N 4.4821 8.5762 118.8382 55.6067 39.2881 175.0968 52 G 3.9959 9.2716 113.4810 45.1446 0.0000 172.0682 53 E 5.1847 8.2036 119.6239 54.9719 32.1677 175.5429 54 V 4.8703 8.8109 115.1821 60.2145 37.0642 173.5278 55 Y 5.1783 8.6903 119.6475 56.4559 41.2290 175.1374 56 I 4.6357 8.6176 122.6922 59.5164 40.3534 174.1901 57 K 4.7484 8.5904 128.6302 53.9979 35.4399 175.1138 58 S 4.5661 8.8281 123.0748 58.6842 62.6265 174.9535 59 T 3.8619 8.5399 118.4253 64.4325 68.7917 175.8886 60 E 4.0838 8.3428 122.6473 58.1792 29.9277 176.9581 61 T 4.3464 8.1510 106.6514 60.7214 70.4520 175.3861 62 G 3.8384 8.2364 109.9337 44.9928 0.0000 173.6820 63 Q 4.4140 7.6228 118.7768 56.1246 30.2876 174.6349 64 Y 4.7032 8.9704 120.3921 56.1096 40.2978 175.0989 65 L 4.4011 9.2038 126.4290 55.3472 43.4632 175.5632 66 A 5.0235 8.7642 126.0530 50.7747 23.2721 174.3583 67 M 5.3741 8.5227 119.6540 53.7486 34.5526 175.7318 68 D 5.2466 9.5058 126.7498 52.7041 40.8855 176.9377 69 T 3.9989 8.5922 112.9690 64.7515 67.2375 174.0103 70 D 4.8317 8.5180 119.0450 53.9863 41.2853 177.0121 71 G 3.3690 8.6375 107.6641 45.2436 0.0000 173.1276 72 L 4.7601 8.2896 120.6227 53.3829 43.2558 176.3037 73 L 5.0407 8.5622 123.6037 55.1303 42.7305 175.6017 74 Y 5.0054 9.0803 119.9792 55.9794 42.1064 173.4662 75 G 4.2835 8.8061 108.1496 45.0774 0.0000 173.1626 76 S 5.1457 8.9683 120.5749 56.7119 64.2069 175.2890 77 Q 4.3686 9.0438 125.3743 58.1636 28.9770 176.3658 78 T 4.7541 7.5445 105.9709 58.5692 71.8607 171.4994 79 P 3.8013 0.0000 0.0000 62.3035 32.1356 175.2176 80 N 5.0058 8.1221 118.0860 51.1956 40.4168 174.5052 81 E 3.9748 8.6938 116.0478 59.3593 29.7098 178.7054 82 E 4.0050 8.7506 117.4783 57.6069 29.8082 177.4896 83 C 4.8545 7.7666 115.0241 59.1976 29.1039 173.3702 84 L 4.3177 6.9823 121.1837 53.6234 42.7686 175.8531 85 F 5.2518 8.8596 121.3169 55.6081 43.5409 174.3061 86 L 4.8323 9.1280 122.5660 53.5785 42.7614 175.4612 87 E 4.4970 8.8609 126.8980 55.3816 30.1749 175.7866 88 R 4.8021 8.5080 125.2607 54.0473 34.7810 174.5982 89 L 4.7438 8.7256 123.7654 55.1486 43.1039 175.7652 90 E 4.7185 9.1943 124.8300 55.2178 33.6891 174.7730 91 E 3.9986 10.0250 123.8464 57.7962 27.8546 174.5009 92 N 4.3271 8.5013 110.4378 54.1140 36.6035 174.0471 93 H 4.8438 8.5476 116.7790 57.6417 37.4353 173.4846 94 Y 4.6392 7.8898 116.1205 57.4695 40.0947 173.5319 95 N 5.5796 9.5815 118.1358 51.9251 41.3160 174.5954 96 T 5.2463 8.8473 112.8672 60.1636 72.9000 172.7446 97 Y 5.0440 8.6042 118.9760 56.6599 41.6475 174.1403 98 I 4.5310 8.4620 126.0188 59.2169 39.5315 175.5127 99 S 4.0802 8.9791 122.5546 58.4602 62.4007 173.9488 100 K 3.9639 8.6676 129.3850 59.3744 32.3228 178.6444 101 K 3.7509 7.9526 118.2836 59.2466 32.2214 176.9758 102 H 4.8541 8.1523 114.1418 54.3681 29.3157 176.6631 103 A 3.9464 7.6744 126.0499 55.1812 18.3923 180.8129 104 E 3.7149 7.9449 113.1474 58.4715 29.8194 178.1701 105 K 4.2248 7.6413 117.3228 55.3958 32.7248 175.8110 106 N 3.9958 7.5898 115.6140 54.0343 36.4876 174.5862 107 W 5.0698 7.7110 117.4672 55.7095 31.1749 177.3533 108 F 5.4325 9.2659 123.6065 55.4745 41.4937 175.3147 109 V 4.0506 8.9550 121.1062 62.8613 32.5232 175.1602 110 G 4.4486 8.5274 112.4325 45.3566 0.0000 171.5830 111 L 5.2745 8.4291 121.3770 52.5259 45.3491 177.0345 112 K 4.2626 9.0456 122.7737 55.3116 33.0399 178.3431 113 K 3.8377 8.4800 119.8280 59.4497 31.9480 177.8590 114 N 4.5795 8.0871 113.7621 52.6047 37.6778 175.8579 115 G 3.5119 8.2676 108.0834 45.5175 0.0000 173.5327 116 S 4.8664 8.1281 114.8000 56.8252 64.6548 173.5636 117 C 4.7611 8.2801 119.6668 59.8617 28.7350 173.4021 118 K 4.3708 8.6031 121.5924 55.7133 33.1172 176.6591 119 R 4.0686 8.4999 123.3788 55.7476 31.4107 177.1031 120 G 3.1904 8.7148 115.3793 48.3171 0.0000 174.1259 121 P 4.2473 0.0000 0.0000 64.1935 31.4336 177.4659 122 R 4.3608 7.8285 116.0311 56.1568 30.3556 176.1455 123 T 5.1706 7.6246 108.1954 59.7959 70.8560 173.2268 124 H 4.7703 7.8189 115.3386 54.8850 30.6634 172.9686 125 Y 3.8825 8.6715 118.3511 59.8076 38.0985 177.1084 126 G 4.0384 8.9916 111.4381 45.4519 0.0000 173.9670 127 Q 4.2065 7.3256 118.4605 55.2275 29.8810 177.0646 128 K 3.8319 8.2565 118.5942 58.6321 32.8593 179.4617 129 A 3.9732 8.0364 121.2092 54.0152 18.3178 178.5094 130 I 4.4026 7.1486 105.8400 60.5838 38.0254 175.3321 131 L 4.3587 7.2910 123.1552 54.0783 42.6488 175.8563 132 F 5.1426 9.4481 122.4578 55.4883 43.3855 173.9042 133 L 5.3025 9.2749 123.0681 52.7200 44.9629 173.5500 134 P 5.1687 0.0000 0.0000 62.5683 32.4710 175.4405 135 L 4.9782 9.1293 123.7678 51.9354 45.3625 174.4517 136 P 4.6110 0.0000 0.0000 62.6372 32.3452 177.0383 137 V 3.7527 8.1593 114.2597 61.7707 31.6359 176.3401 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 1C H 8.44 4.80 0.00 3.13 3.45 0.00 5.67 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.68 4.55 0.00 3.20 3.21 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.59 5.09 0.00 3.15 3.31 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.90 4.63 0.00 3.32 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.36 4.83 0.00 2.93 3.08 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 0.00 0.00 0.00 0.00 2 N 8.50 4.63 0.00 2.95 2.78 0.00 0.00 6.89 6.74 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 3 L 8.04 4.75 0.00 1.47 1.41 0.67 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.47 0.00 2.21 2.07 0.00 3.68 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 1.96 1.91 0.00 5 P 0.00 4.39 0.00 2.17 2.08 0.00 3.70 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 6 G 9.20 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 7 N 7.83 4.15 0.00 2.61 2.64 0.00 0.00 5.76 7.55 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 8 Y 7.90 4.87 0.00 3.04 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 9 K 8.69 4.13 0.00 1.81 1.90 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.59 7.81 10 K 7.61 4.73 0.00 1.71 1.69 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.39 7.81 11 P 0.00 4.71 0.00 2.05 2.04 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 12 K 9.53 4.93 0.00 1.64 1.75 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.62 7.81 13 L 9.13 5.07 0.00 1.62 1.62 0.45 0.58 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 14 L 8.65 5.05 0.00 1.54 1.55 0.33 0.87 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 15 Y 9.31 4.89 0.00 3.33 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 16 C 8.27 4.12 0.00 2.35 2.47 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 17 S 8.31 3.94 0.00 3.75 3.87 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 0.00 0.00 0.00 0.00 18 N 8.03 4.21 0.00 2.57 2.65 0.00 0.00 6.71 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 19 G 7.51 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 0.00 0.00 0.00 20 G 7.76 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 21 H 7.13 4.93 0.00 3.00 3.22 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 9.12 5.35 0.00 3.12 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 23 L 9.08 4.47 0.00 1.80 1.51 0.89 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.41 4.93 0.00 1.91 2.05 0.00 3.27 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.81 0.00 25 I 8.22 4.81 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 0.89 0.00 0.00 26 L 8.78 4.08 0.00 1.78 1.52 0.92 1.20 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 27 P 0.00 4.14 0.00 1.99 2.12 0.00 3.52 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 28 D 8.01 4.58 0.00 2.77 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 29 G 8.54 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 0.00 0.00 0.00 30 T 8.16 4.36 4.28 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 1.22 0.00 0.00 31 V 7.89 4.85 2.10 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 0.89 0.00 0.00 0.94 0.00 0.00 32 D 8.47 4.58 0.00 2.87 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 33 G 8.60 4.57 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 34 T 8.79 4.99 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 1.38 0.00 0.00 35 R 8.80 4.27 0.00 1.86 1.96 0.00 3.20 0.00 0.00 3.07 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.46 0.00 36 D 8.23 4.64 0.00 2.84 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 37 R 8.66 3.70 0.00 1.91 1.91 0.00 3.24 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.41 0.00 38 S 8.36 4.38 0.00 3.98 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 39 D 7.75 4.36 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 40 Q 8.45 4.35 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.08 0.00 0.00 0.00 0.00 0.00 2.28 2.21 0.00 41 H 9.42 4.88 0.00 3.33 3.45 0.00 5.78 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.45 4.56 1.87 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.91 1.06 0.00 0.00 43 Q 7.82 4.26 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.00 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 44 L 8.98 5.00 0.00 1.57 1.43 0.80 0.74 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 45 Q 9.31 4.72 0.00 2.09 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 46 L 8.83 5.51 0.00 1.74 1.43 0.90 1.11 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 47 S 8.05 4.55 0.00 3.88 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 48 A 8.36 4.80 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 49 E 8.54 4.34 0.00 1.69 1.23 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 2.11 2.25 0.00 50 E 7.38 4.33 0.00 2.20 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 0.00 2.41 2.39 0.00 51 N 8.58 4.48 0.00 2.82 3.01 0.00 0.00 7.11 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 52 G 9.27 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 0.00 0.00 0.00 53 E 8.20 5.18 0.00 1.94 1.72 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 2.23 2.30 0.00 54 V 8.81 4.87 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 0.64 0.00 0.00 1.22 0.00 0.00 55 Y 8.69 5.18 0.00 3.01 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 56 I 8.62 4.64 1.73 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.71 0.67 0.00 0.00 57 K 8.59 4.75 0.00 1.33 1.45 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.64 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.94 0.67 7.81 58 S 8.83 4.57 0.00 3.86 3.64 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 59 T 8.54 3.86 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 1.21 0.00 0.00 60 E 8.34 4.08 0.00 1.98 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 2.16 2.36 0.00 61 T 8.15 4.35 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 1.24 0.00 0.00 62 G 8.24 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 63 Q 7.62 4.41 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 64 Y 8.97 4.70 0.00 2.90 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 65 L 9.20 4.40 0.00 1.61 1.52 0.81 0.13 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 66 A 8.76 5.02 0.53 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 67 M 8.52 5.37 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.72 0.00 68 D 9.51 5.25 0.00 2.95 2.87 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 0.00 0.00 0.00 0.00 69 T 8.59 4.00 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 1.27 0.00 0.00 70 D 8.52 4.83 0.00 2.70 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 71 G 8.64 3.37 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 0.00 72 L 8.29 4.76 0.00 1.87 1.64 0.91 0.81 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 73 L 8.56 5.04 0.00 1.57 1.61 0.90 0.95 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 74 Y 9.08 5.01 0.00 2.97 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 75 G 8.81 4.28 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 0.00 76 S 8.97 5.15 0.00 3.88 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 77 Q 9.04 4.37 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 78 T 7.54 4.75 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 1.23 0.00 0.00 79 P 0.00 3.80 0.00 1.47 0.49 0.00 3.51 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.45 0.00 80 N 8.12 5.01 0.00 2.91 2.93 0.00 0.00 6.28 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 81 E 8.69 3.97 0.00 2.02 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 2.37 2.32 0.00 82 E 8.75 4.01 0.00 2.26 2.30 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 2.38 2.35 0.00 83 C 7.77 4.85 0.00 3.26 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 84 L 6.98 4.32 0.00 1.40 1.29 0.75 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.86 5.25 0.00 3.04 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 86 L 9.13 4.83 0.00 1.51 1.60 0.89 0.83 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 87 E 8.86 4.50 0.00 2.14 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 2.16 1.86 0.00 88 R 8.51 4.80 0.00 1.78 1.79 0.00 3.02 0.00 0.00 2.85 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.61 0.00 89 L 8.73 4.74 0.00 1.73 1.68 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 90 E 9.19 4.72 0.00 2.20 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 2.28 2.41 0.00 91 E 10.03 4.00 0.00 2.35 2.15 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 2.32 2.33 0.00 92 N 8.50 4.33 0.00 2.85 2.89 0.00 0.00 6.87 8.16 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 93 H 8.55 4.84 0.00 2.88 3.02 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.89 4.64 0.00 3.04 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 95 N 9.58 5.58 0.00 2.98 2.53 0.00 0.00 6.96 7.09 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 96 T 8.85 5.25 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 1.37 0.00 0.00 97 Y 8.60 5.04 0.00 2.76 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 98 I 8.46 4.53 1.65 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.36 0.55 0.00 0.00 99 S 8.98 4.08 0.00 4.06 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 0.00 100 K 8.67 3.96 0.00 1.69 1.66 0.00 1.71 0.00 0.00 1.44 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.31 7.81 101 K 7.95 3.75 0.00 1.75 1.63 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.92 1.26 7.81 102 H 8.15 4.85 0.00 3.05 2.21 0.00 5.69 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 0.00 103 A 7.67 3.95 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 0.00 104 E 7.94 3.71 0.00 1.81 1.77 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 2.16 2.12 0.00 105 K 7.64 4.22 0.00 0.94 1.49 0.00 1.60 0.00 0.00 1.47 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.00 7.81 106 N 7.59 4.00 0.00 3.06 3.12 0.00 0.00 6.87 7.81 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 0.00 107 W 7.71 5.07 0.00 3.29 3.08 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 0.00 0.00 0.00 0.00 108 F 9.27 5.43 0.00 2.82 3.03 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 0.00 109 V 8.95 4.05 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 0.61 0.00 0.00 0.45 0.00 0.00 110 G 8.53 4.45 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 0.00 111 L 8.43 5.27 0.00 1.48 1.44 1.04 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 112 K 9.05 4.26 0.00 1.92 1.67 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.35 7.81 113 K 8.48 3.84 0.00 1.70 1.85 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.43 7.81 114 N 8.09 4.58 0.00 2.79 2.89 0.00 0.00 6.13 7.00 0.00 0.00 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 G 8.27 3.51 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 0.00 116 S 8.13 4.87 0.00 3.97 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 0.00 117 C 8.28 4.76 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 0.00 118 K 8.60 4.37 0.00 1.61 1.68 0.00 1.61 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.33 7.81 119 R 8.50 4.07 0.00 1.79 1.62 0.00 3.21 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.55 0.00 120 G 8.71 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 0.00 0.00 0.00 121 P 0.00 4.25 0.00 1.91 2.18 0.00 2.98 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.76 0.00 122 R 7.83 4.36 0.00 1.80 1.92 0.00 3.28 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 123 T 7.62 5.17 4.28 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 1.23 0.00 0.00 124 H 7.82 4.77 0.00 3.37 3.49 0.00 5.47 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 0.00 125 Y 8.67 3.88 0.00 3.13 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 0.00 126 G 8.99 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 0.00 0.00 0.00 127 Q 7.33 4.21 0.00 1.85 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.73 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 128 K 8.26 3.83 0.00 1.75 1.64 0.00 1.53 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.27 7.81 129 A 8.04 3.97 1.20 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 0.00 0.00 130 I 7.15 4.40 1.65 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 0.52 0.00 0.00 131 L 7.29 4.36 0.00 1.04 0.73 0.31 0.67 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 0.00 132 F 9.45 5.14 0.00 3.37 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 0.00 133 L 9.27 5.30 0.00 2.04 1.75 0.71 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.17 0.00 2.21 2.19 0.00 3.84 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 135 L 9.13 4.98 0.00 1.64 1.61 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.61 0.00 1.92 1.98 0.00 3.67 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 2.02 2.12 0.00 137 V 8.16 3.75 2.02 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 0.68 0.00 0.00 0.90 0.00 0.00