NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4673 8.3044 118.1944 55.1721 32.5715 174.3157 1 V 4.2825 7.9015 118.7581 60.8019 34.6278 173.3449 2 L 4.4489 8.2519 126.9299 53.7041 43.9042 176.7506 3 S 4.5730 8.8605 117.5884 57.5850 65.4553 175.0977 4 E 4.3012 8.8304 122.4027 59.4420 29.3390 178.9946 5 G 3.6394 8.1077 105.3810 47.8846 0.0000 175.4092 6 E 3.9493 7.9716 121.0611 58.8976 29.4087 179.4583 7 W 4.3653 8.1271 119.0531 59.8732 29.0627 178.5708 8 Q 4.1598 8.5947 118.3251 59.0237 28.0110 178.8781 9 L 4.0795 7.9054 119.5915 57.6493 41.6366 179.7885 10 V 3.7346 7.9367 118.2362 66.2293 31.5997 178.2329 11 L 4.2992 8.6284 118.9697 57.6294 40.9144 179.0593 12 H 4.2357 8.5707 119.0203 59.3027 30.0201 177.7380 13 V 3.3927 7.8177 121.0146 64.3399 31.3753 178.1451 14 W 3.9751 8.4974 128.9524 60.0871 30.2709 177.7972 15 A 4.0092 7.9405 120.2617 54.8871 18.0158 179.4894 16 K 3.9434 7.3149 116.9500 59.4326 32.0840 179.6602 17 V 2.8517 7.0015 118.0595 65.6995 31.0784 177.6155 18 E 3.8715 7.4908 115.9044 58.0413 29.2807 178.5084 19 A 4.2002 7.5018 120.6819 53.8241 20.1287 177.6921 20 D 4.6644 7.9169 116.4791 52.1172 42.8607 175.4775 21 V 3.4452 7.9489 123.2814 65.5610 32.0608 176.6407 22 A 4.0811 8.0492 120.0842 55.2137 18.2832 179.6776 23 G 3.9082 8.2536 105.4058 47.8857 0.0000 175.6999 24 H 4.1823 8.3439 119.0529 58.2254 28.6381 178.0846 25 G 3.7347 8.4474 108.0281 47.9520 0.0000 175.7351 26 Q 3.9822 8.0869 120.6247 58.7838 28.7986 178.5132 27 D 4.3178 7.9258 119.7396 57.5061 40.7893 179.1372 28 I 3.5707 7.7911 120.0733 64.4789 37.0306 178.6346 29 F 3.4152 7.9763 118.4928 60.0342 38.5698 178.0133 30 I 3.7341 7.8919 119.8834 64.1134 36.7917 178.3441 31 R 3.7702 7.8905 119.5773 59.2122 29.8608 178.1571 32 L 3.8470 7.7214 120.0976 58.4323 41.8942 179.0895 33 F 4.6241 8.0272 117.7655 60.5406 38.5587 177.9282 34 K 4.0500 8.1465 117.6257 59.4459 31.9961 179.3092 35 S 4.2542 8.1727 114.9032 60.3065 64.2872 174.5085 36 H 4.7571 8.2746 118.2734 51.8606 29.1330 171.8084 37 P 4.4975 0.0000 0.0000 64.7231 31.1342 177.6533 38 E 4.1437 8.2316 115.9852 59.3684 29.5281 179.1001 39 T 3.9152 8.2768 111.2884 64.4279 68.8380 176.3542 40 L 3.8366 8.0036 123.3618 57.9356 41.8001 178.5750 41 E 4.1836 7.8731 117.0229 58.6045 29.4285 178.7186 42 K 4.4423 8.1733 117.4676 57.0084 32.6357 177.3331 43 F 4.5696 8.1906 118.9890 55.6224 39.3399 175.9526 44 D 4.3534 8.4855 124.5462 57.0089 40.9704 178.6129 45 R 3.9280 7.6302 116.6886 57.7174 30.4196 176.8706 46 F 5.0745 7.5047 113.9492 56.6041 40.8117 176.5776 47 K 4.0344 8.3562 120.4905 58.9838 32.2869 177.5529 48 H 4.4623 8.1419 114.3379 57.1066 29.2099 175.6746 49 L 3.9862 7.5021 120.9779 55.2862 41.6822 176.8888 50 K 4.2799 9.5825 123.8120 57.5461 33.3150 177.1947 51 T 4.7340 7.4423 107.3596 58.9961 73.1067 174.3041 52 E 3.9403 8.6405 121.0227 59.1916 29.7317 178.6606 53 A 3.9692 7.9176 120.5172 55.2777 18.3228 179.3288 54 E 3.9601 7.9356 115.8627 59.6223 29.8702 179.2377 55 M 4.1713 8.0635 118.7938 58.4512 31.8565 178.9851 56 K 3.9781 8.1568 117.3310 59.1576 32.2982 178.6385 57 A 4.3763 7.6792 118.4911 52.1533 18.9469 177.2727 58 S 4.1989 7.4584 113.3738 57.6807 62.8491 174.4183 59 E 3.9833 8.9119 129.2449 59.4783 29.5087 178.2454 60 D 4.4823 8.1295 118.5877 57.2552 40.8941 178.3376 61 L 3.2414 7.9179 120.9743 57.6180 42.0980 178.9439 62 K 3.8653 7.8168 119.1746 59.5039 32.1806 179.0123 63 K 4.0344 8.1602 118.7960 59.5873 31.8862 178.8709 64 H 4.3073 8.5169 118.8290 59.1990 29.7574 177.5206 65 G 3.6994 8.1753 107.7457 47.8615 0.0000 175.8239 66 V 3.6429 7.7652 120.3103 66.0153 31.6215 178.2811 67 T 3.9216 7.9134 115.5202 66.5524 68.2517 176.8496 68 V 3.6639 7.9903 120.1015 66.2271 31.6483 178.2107 69 L 4.2473 8.2956 118.7316 58.0037 41.3807 179.7520 70 T 4.0129 8.2166 115.8143 66.5524 68.3151 176.6391 71 A 4.0240 8.0394 122.6234 55.0319 18.3359 179.4917 72 L 3.7468 8.2739 119.1925 58.0292 42.0968 179.3665 73 G 3.2829 8.5740 105.9555 47.6579 0.0000 175.4653 74 A 3.9842 7.7748 122.1924 54.8670 18.6382 179.6123 75 I 3.7800 7.4365 117.9643 64.5534 37.2433 178.6200 76 L 3.9833 7.7508 119.9337 57.7256 41.1879 179.6237 77 K 3.9925 7.8153 116.8352 58.3926 32.2998 178.7565 78 K 3.9525 7.8474 118.4050 56.0717 32.5646 176.6187 79 K 2.0000 8.2720 118.1759 56.4209 29.8263 175.2944 80 G 4.0279 8.0013 105.9417 45.8342 0.0000 174.1152 81 H 4.5456 7.3780 118.9192 55.0832 27.4584 174.8113 82 H 5.5241 7.2445 111.1386 54.5762 29.6187 176.3932 83 E 3.9453 8.6352 122.3900 60.2359 28.9546 178.7488 84 A 4.0320 7.9088 118.4377 55.3065 17.5876 179.0148 85 E 4.0985 8.1637 116.6228 59.4908 29.5454 179.4052 86 L 4.2907 8.2363 119.1391 57.3333 41.6260 179.1331 87 K 3.8955 7.8564 119.0975 59.3951 32.0894 177.4329 88 P 4.3425 0.0000 0.0000 65.6571 31.3217 178.2053 89 L 4.0351 7.5483 117.4557 57.9788 42.0579 178.7826 90 A 4.1773 8.4982 121.2584 55.1505 18.2376 179.4329 91 Q 3.8857 8.2381 118.3592 59.3885 29.1546 178.6214 92 S 4.0063 8.1520 115.3567 61.8272 63.0391 176.0457 93 H 4.2939 8.5765 119.2372 57.5985 28.2639 177.4046 94 A 2.8607 7.5853 121.9211 54.2159 18.9437 179.0037 95 T 3.9249 7.6048 112.7358 65.2453 69.0569 176.3100 96 K 4.0532 7.4703 119.9623 58.9448 32.7805 177.2999 97 H 4.2983 8.0289 114.6665 56.1500 29.4295 175.4928 98 K 3.2164 7.4779 117.3460 56.9213 28.4931 174.6109 99 I 4.3243 8.2677 118.6675 58.7162 38.6697 174.9315 100 P 4.4908 0.0000 0.0000 62.1302 32.1894 177.6642 101 I 3.6970 8.2473 122.3754 64.5243 36.9865 178.6866 102 K 3.6769 7.9689 119.9792 59.8200 31.9558 178.2513 103 Y 4.2325 8.0898 116.7380 60.8039 37.8945 178.1660 104 L 4.2430 7.8719 119.7160 57.5389 41.7943 179.1029 105 E 4.0334 7.9613 118.6669 59.3106 29.3730 179.2193 106 F 4.5354 7.7828 117.6732 60.8144 38.9591 177.5985 107 I 3.8134 8.0450 118.0218 63.8116 37.7311 178.1342 108 S 4.1696 8.0213 116.1799 61.4204 62.6033 176.1138 109 E 3.9967 8.4398 121.9008 59.2433 29.4257 178.7363 110 A 3.9803 7.9838 120.8653 55.1383 18.3935 179.7184 111 I 3.6475 7.9660 118.3975 64.6036 37.1764 178.7384 112 I 3.8164 7.8668 120.6878 64.5605 36.9285 177.9508 113 H 4.1247 8.4475 119.1582 59.3452 29.6466 177.5492 114 V 3.5220 7.8384 119.9806 65.9667 31.2793 178.0174 115 L 3.7721 7.8464 118.8105 57.7840 41.0293 178.9497 116 H 4.3825 7.9330 117.5019 59.3939 29.8895 177.3223 117 S 4.1672 7.7582 115.9654 61.6429 62.8080 176.4858 118 R 4.0290 7.9823 119.6349 57.7819 31.0944 176.5932 119 H 5.0366 8.3615 115.6227 53.7451 29.5712 173.0035 120 P 4.3244 0.0000 0.0000 65.9425 31.5312 179.2460 121 G 3.6262 8.1521 106.5017 47.5053 0.0000 173.6905 122 N 5.0347 8.1341 115.2205 52.9181 39.5831 174.8320 123 F 4.9317 7.8303 119.0247 56.3670 39.5391 174.2008 124 G 3.9159 7.6132 109.2022 43.7169 0.0000 171.7319 125 A 3.8866 8.4562 120.7468 55.5363 18.2565 179.6813 126 D 4.1968 7.9773 116.3860 57.4752 40.9335 178.7949 127 A 3.9396 7.7476 120.7704 55.0861 18.3551 179.3288 128 Q 3.1272 7.8272 118.4488 58.8290 29.0372 178.6143 129 G 3.5002 8.0916 106.7147 47.5888 0.0000 175.6069 130 A 3.8629 7.9107 123.1428 55.0634 18.3831 179.4301 131 M 3.9903 8.1590 116.8377 58.7557 32.2723 177.9223 132 N 4.3096 8.5230 117.6709 56.5686 39.1376 176.7444 133 K 3.8382 8.1182 120.8114 59.4195 32.2512 178.6791 134 A 3.8252 8.0002 121.1249 55.0793 18.1725 179.6258 135 L 4.1532 8.1900 117.5508 57.7394 41.6210 179.5197 136 E 3.9778 8.5745 119.2235 59.0735 29.2990 179.0231 137 L 3.9449 8.0784 120.4753 58.0259 42.2057 178.6476 138 F 4.1682 8.2611 120.5529 61.6732 39.3151 177.3728 139 R 3.4750 8.2950 117.7665 58.7465 29.7523 179.0873 140 K 3.8319 8.2748 119.8834 59.7034 32.3596 178.7723 141 D 4.3581 8.2096 119.2576 57.2126 40.5879 178.8904 142 I 3.4475 7.5207 120.3323 64.0022 37.0007 178.2338 143 A 3.6833 7.8232 121.5064 55.0018 18.2509 179.5361 144 A 3.9495 7.8883 119.2668 55.2601 18.4003 180.0827 145 K 4.0078 8.0034 116.8371 59.5977 32.0257 178.9412 146 Y 4.4602 8.3788 117.5118 61.3632 37.8614 179.0800 147 K 3.9699 8.1123 118.8806 59.7480 31.9964 179.3023 148 E 4.0467 7.8918 116.8103 59.1528 29.4535 178.7307 149 L 4.3496 7.9661 116.9496 55.2414 41.9694 177.7774 150 G 3.9096 8.0499 107.4496 45.1525 0.0000 172.2386 151 Y 4.6376 8.2083 121.4325 55.4670 40.3002 176.2691 152 Q 3.8048 8.8228 128.7643 59.2046 29.9516 175.6184 153 G 3.9379 5.7103 110.1235 46.2945 0.0000 173.4145 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 0 M 8.30 4.47 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 1 V 7.90 4.28 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 0.91 0.00 0.00 0.95 0.00 0.00 2 L 8.25 4.45 0.00 0.86 0.81 0.60 -0.21 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 3 S 8.86 4.57 0.00 4.03 3.98 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 0.00 0.00 0.00 4 E 8.83 4.30 0.00 2.19 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 2.43 2.52 0.00 5 G 8.11 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 0.00 0.00 0.00 6 E 7.97 3.95 0.00 1.82 1.74 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 2.22 2.26 0.00 7 W 8.13 4.37 0.00 3.60 3.17 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 0.00 0.00 0.00 0.00 8 Q 8.59 4.16 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.76 2.61 0.00 9 L 7.91 4.08 0.00 1.88 1.75 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.94 3.73 2.45 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 1.18 0.00 0.00 0.94 0.00 0.00 11 L 8.63 4.30 0.00 1.83 1.82 0.95 0.91 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 12 H 8.57 4.24 0.00 3.42 3.56 0.00 5.78 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.82 3.39 2.43 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 1.04 0.00 0.00 0.87 0.00 0.00 14 W 8.50 3.98 0.00 3.66 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 15 A 7.94 4.01 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 16 K 7.31 3.94 0.00 1.40 1.65 0.00 1.63 0.00 0.00 1.47 0.00 0.00 2.70 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.45 7.81 17 V 7.00 2.85 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 0.00 0.00 0.01 0.00 0.00 0.45 0.00 0.00 18 E 7.49 3.87 0.00 2.00 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 0.00 2.17 2.13 0.00 19 A 7.50 4.20 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 20 D 7.92 4.66 0.00 2.70 2.52 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 21 V 7.95 3.45 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 1.07 0.00 0.00 0.84 0.00 0.00 22 A 8.05 4.08 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.25 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 24 H 8.34 4.18 0.00 3.25 3.25 0.00 5.83 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 25 G 8.45 3.73 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 0.00 0.00 0.00 26 Q 8.09 3.98 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.60 0.00 27 D 7.93 4.32 0.00 2.77 2.65 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 0.00 0.00 0.00 0.00 28 I 7.79 3.57 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.58 0.50 0.00 0.00 29 F 7.98 3.42 0.00 2.98 2.52 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 30 I 7.89 3.73 1.90 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 1.43 0.67 0.91 0.00 0.00 31 R 7.89 3.77 0.00 1.95 2.03 0.00 3.02 0.00 0.00 2.92 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 32 L 7.72 3.85 0.00 1.57 1.32 0.98 0.91 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 33 F 8.03 4.62 0.00 3.08 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 K 8.15 4.05 0.00 1.75 1.84 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.69 1.62 7.81 35 S 8.17 4.25 0.00 3.68 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 36 H 8.27 4.76 0.00 2.97 2.73 0.00 5.65 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 37 P 0.00 4.50 0.00 2.16 2.13 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 2.10 2.17 0.00 38 E 8.23 4.14 0.00 2.31 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 2.26 2.49 0.00 39 T 8.28 3.92 4.53 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 0.91 0.00 0.00 40 L 8.00 3.84 0.00 1.48 1.81 -0.07 0.75 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 41 E 7.87 4.18 0.00 2.27 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 0.00 2.39 2.41 0.00 42 K 8.17 4.44 0.00 1.96 1.69 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.15 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.78 1.97 7.81 43 F 8.19 4.57 0.00 3.21 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 44 D 8.49 4.35 0.00 2.60 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 45 R 7.63 3.93 0.00 0.67 1.27 0.00 3.01 0.00 0.00 2.93 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.40 0.00 46 F 7.50 5.07 0.00 2.87 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 47 K 8.36 4.03 0.00 1.87 2.23 0.00 1.62 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.62 1.42 7.81 48 H 8.14 4.46 0.00 3.30 3.46 0.00 5.54 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.50 3.99 0.00 1.57 1.59 0.84 0.63 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 50 K 9.58 4.28 0.00 1.76 1.84 0.00 1.64 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.52 7.81 51 T 7.44 4.73 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 1.20 0.00 0.00 52 E 8.64 3.94 0.00 2.06 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 2.37 2.38 0.00 53 A 7.92 3.97 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 E 7.94 3.96 0.00 2.09 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 2.34 0.00 55 M 8.06 4.17 0.00 2.09 2.28 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.60 0.00 56 K 8.16 3.98 0.00 1.84 1.86 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.65 7.81 57 A 7.68 4.38 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 58 S 7.46 4.20 0.00 3.89 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 59 E 8.91 3.98 0.00 2.13 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 2.39 2.48 0.00 60 D 8.13 4.48 0.00 2.99 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 61 L 7.92 3.24 0.00 1.16 1.56 -0.06 0.62 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 62 K 7.82 3.87 0.00 1.83 1.93 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.46 7.81 63 K 8.16 4.03 0.00 2.05 1.89 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.66 7.81 64 H 8.52 4.31 0.00 3.50 3.39 0.00 5.79 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 65 G 8.18 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 66 V 7.77 3.64 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 1.05 0.00 0.00 0.98 0.00 0.00 67 T 7.91 3.92 4.44 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 1.29 0.00 0.00 68 V 7.99 3.66 2.45 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 1.32 0.00 0.00 1.09 0.00 0.00 69 L 8.30 4.25 0.00 1.83 1.90 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.22 4.01 4.46 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 1.27 0.00 0.00 71 A 8.04 4.02 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 3.75 0.00 1.63 1.77 0.28 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.57 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 0.00 0.00 0.00 74 A 7.77 3.98 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 75 I 7.44 3.78 1.83 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 1.53 0.60 0.89 0.00 0.00 76 L 7.75 3.98 0.00 1.34 1.55 -0.13 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.82 3.99 0.00 1.78 1.80 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.46 1.53 7.81 78 K 7.85 3.95 0.00 1.84 1.82 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.66 1.77 7.81 79 K 8.27 2.00 0.00 1.24 0.74 0.00 1.46 0.00 0.00 1.42 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.37 0.93 7.81 80 G 8.00 4.03 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 0.00 0.00 0.00 81 H 7.38 4.55 0.00 3.16 3.24 0.00 5.81 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.24 5.52 0.00 3.30 3.47 0.00 5.67 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.64 3.95 0.00 2.12 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 0.00 2.40 2.49 0.00 84 A 7.91 4.03 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 85 E 8.16 4.10 0.00 2.25 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 2.40 2.47 0.00 86 L 8.24 4.29 0.00 2.06 1.73 1.01 0.71 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 87 K 7.86 3.90 0.00 1.92 1.90 0.00 1.69 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.72 7.81 88 P 0.00 4.34 0.00 2.30 2.34 0.00 3.87 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 2.23 2.05 0.00 89 L 7.55 4.04 0.00 1.84 1.93 0.99 1.39 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 90 A 8.50 4.18 1.48 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 0.00 0.00 91 Q 8.24 3.89 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 92 S 8.15 4.01 0.00 4.03 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 93 H 8.58 4.29 0.00 3.60 3.62 0.00 5.80 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 94 A 7.59 2.86 0.82 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 0.00 0.00 0.00 0.00 0.00 95 T 7.60 3.92 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 1.12 0.00 0.00 96 K 7.47 4.05 0.00 1.54 1.63 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.24 1.35 7.81 97 H 8.03 4.30 0.00 3.02 3.15 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.48 3.22 0.00 1.76 1.74 0.00 1.44 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.24 1.29 7.81 99 I 8.27 4.32 2.12 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 1.50 0.99 1.16 0.00 0.00 100 P 0.00 4.49 0.00 1.77 1.80 0.00 2.77 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 1.51 1.98 0.00 101 I 8.25 3.70 1.83 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.36 0.82 0.00 0.00 102 K 7.97 3.68 0.00 1.70 1.71 0.00 1.74 0.00 0.00 1.96 0.00 0.00 3.18 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.78 1.21 7.81 103 Y 8.09 4.23 0.00 3.26 3.13 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 0.00 104 L 7.87 4.24 0.00 1.84 1.78 0.70 1.17 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 0.00 105 E 7.96 4.03 0.00 2.08 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 0.00 2.31 2.40 0.00 106 F 7.78 4.54 0.00 3.23 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 0.00 107 I 8.05 3.81 1.94 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.09 1.05 0.00 0.00 108 S 8.02 4.17 0.00 4.21 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 0.00 109 E 8.44 4.00 0.00 2.16 2.28 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 2.36 2.39 0.00 110 A 7.98 3.98 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 0.00 111 I 7.97 3.65 2.06 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 1.53 0.77 1.00 0.00 0.00 112 I 7.87 3.82 2.12 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.83 1.14 0.00 0.00 113 H 8.45 4.12 0.00 3.34 3.48 0.00 5.78 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 0.00 114 V 7.84 3.52 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 0.98 0.00 0.00 0.93 0.00 0.00 115 L 7.85 3.77 0.00 0.50 0.54 0.77 0.71 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 0.00 116 H 7.93 4.38 0.00 3.45 3.59 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.76 4.17 0.00 3.91 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 0.00 118 R 7.98 4.03 0.00 1.60 1.51 0.00 2.80 0.00 0.00 3.01 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.47 0.00 119 H 8.36 5.04 0.00 3.17 3.20 0.00 5.63 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 0.00 120 P 0.00 4.32 0.00 2.20 2.26 0.00 3.74 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.95 0.00 121 G 8.15 3.63 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 0.00 0.00 0.00 122 N 8.13 5.03 0.00 2.79 2.93 0.00 0.00 6.67 7.57 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 0.00 123 F 7.83 4.93 0.00 2.96 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 0.00 124 G 7.61 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 0.00 125 A 8.46 3.89 1.27 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 0.00 0.00 0.00 126 D 7.98 4.20 0.00 2.65 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 0.00 127 A 7.75 3.94 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 0.00 128 Q 7.83 3.13 0.00 1.32 1.90 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 2.24 2.25 0.00 129 G 8.09 3.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.91 3.86 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 0.00 131 M 8.16 3.99 0.00 2.49 2.38 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.89 0.00 132 N 8.52 4.31 0.00 2.90 2.92 0.00 0.00 6.87 6.36 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 0.00 133 K 8.12 3.84 0.00 1.91 1.77 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.26 1.36 7.81 134 A 8.00 3.83 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 0.00 135 L 8.19 4.15 0.00 1.88 1.81 0.98 0.71 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 0.00 136 E 8.57 3.98 0.00 2.13 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 2.34 2.57 0.00 137 L 8.08 3.94 0.00 1.87 1.96 1.02 0.94 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 0.00 138 F 8.26 4.17 0.00 3.13 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 0.00 139 R 8.30 3.48 0.00 1.95 1.84 0.00 3.16 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.97 0.00 140 K 8.27 3.83 0.00 1.80 2.01 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.44 7.81 141 D 8.21 4.36 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 0.00 142 I 7.52 3.45 1.36 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.21 0.10 0.00 0.00 143 A 7.82 3.68 1.27 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 0.00 0.00 0.00 144 A 7.89 3.95 1.38 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 0.00 0.00 145 K 8.00 4.01 0.00 2.00 1.93 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.74 1.62 7.81 146 Y 8.38 4.46 0.00 3.13 3.25 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 0.00 147 K 8.11 3.97 0.00 2.03 1.88 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.73 7.81 148 E 7.89 4.05 0.00 2.16 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 2.36 2.50 0.00 149 L 7.97 4.35 0.00 1.82 1.72 1.00 0.87 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 0.00 150 G 8.05 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 0.00 151 Y 8.21 4.64 0.00 2.74 2.52 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 0.00 152 Q 8.82 3.80 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.48 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 153 G 5.71 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 0.00 0.00 0.00