NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.5305 8.3193 117.0972 58.7222 62.9596 173.4212 2 T 4.4816 8.0813 112.9655 60.3579 72.0032 172.6649 3 K 4.1593 7.9556 121.8939 56.3758 33.9327 177.8765 4 T 4.3077 8.1015 115.4940 61.1754 69.5356 175.2585 5 N 4.2963 8.5144 119.7968 56.5433 38.5320 177.8049 6 S 4.1373 8.0089 115.9748 61.6800 63.0816 176.4892 7 E 4.0267 8.0703 120.7921 59.2037 29.2414 179.2811 8 I 3.7633 7.6202 120.0872 64.2287 37.1257 178.3816 9 L 4.0323 8.2888 119.9265 57.2159 41.3218 179.4244 10 E 3.9859 7.9712 118.6126 59.3550 29.5275 179.0721 11 Q 3.9615 7.8884 117.6355 58.8984 28.6426 178.8311 12 L 3.8965 7.8907 120.1105 57.3844 41.5199 179.4848 13 K 3.8784 7.7753 119.5386 59.8084 32.0670 179.0860 14 Q 3.9455 8.0326 116.4088 58.4273 28.6288 178.0565 15 A 4.2002 7.8302 120.8568 53.0958 19.2040 177.8826 16 S 4.4615 7.4980 110.2140 58.0080 64.6183 174.1482 17 D 4.5988 7.9928 122.2970 55.9214 40.8110 177.2470 18 G 3.9504 8.8828 111.0461 45.4763 0.0000 173.1098 19 L 4.4012 7.7095 121.6907 54.0014 43.0260 175.4693 20 L 5.0756 8.3509 124.3587 52.8718 44.9547 175.6786 21 F 4.6049 9.2588 127.2218 58.0343 40.5483 173.8491 22 M 4.8605 7.6938 126.1617 53.9994 33.2269 175.2237 23 S 4.2175 8.7259 122.6005 57.9430 66.2380 176.4193 24 E 4.0950 8.8975 117.4345 58.1276 29.6483 175.7244 25 S 4.8779 8.0147 112.9840 56.2692 65.3686 171.3112 26 E 5.2881 8.1736 116.1831 55.2614 32.1377 174.3872 27 Y 4.8357 8.7713 119.2380 55.7681 42.9512 173.3439 28 P 5.0090 0.0000 0.0000 62.3250 33.1440 175.1508 29 F 5.2237 8.7195 118.3900 56.2052 41.8000 175.5176 30 E 4.8230 9.2683 120.4725 54.6271 32.6421 175.4683 31 V 4.5212 8.6476 125.1352 62.5941 32.7093 174.8129 32 F 5.1191 8.7102 121.6443 55.7106 42.1929 173.5249 33 L 4.3186 8.3465 119.7431 54.2047 44.1003 174.4445 34 W 4.8118 8.7077 128.5777 55.8507 29.4092 176.6870 35 E 3.8651 9.2901 125.3543 57.9205 29.5019 177.7044 36 G 4.0254 8.7744 112.4131 46.0825 0.0000 171.4259 37 S 4.6820 7.7632 113.2030 56.0764 65.8799 174.9114 38 A 4.0681 8.6965 127.4824 51.7321 18.5466 175.0585 39 P 4.3702 0.0000 0.0000 65.5192 31.4745 175.5747 40 P 4.4046 0.0000 0.0000 61.7751 29.0595 173.9807 41 V 3.6335 8.2442 120.8587 63.4483 31.6348 175.2099 42 T 4.6745 8.1361 117.8423 59.7121 70.9090 175.3498 43 H 4.0818 8.6960 120.0107 58.8237 27.9978 177.6111 44 E 3.7827 7.2391 121.2007 59.1000 29.1808 179.2602 45 I 3.4433 7.8459 120.3716 64.0905 37.3059 178.4083 46 V 2.9533 7.3474 118.4965 65.9893 31.2100 177.9052 47 L 3.9109 7.7224 120.8919 58.2648 41.1500 180.2959 48 Q 3.8045 7.3836 119.7147 60.3327 28.2367 180.5547 49 Q 3.8050 7.7840 118.7263 57.2677 28.5200 177.5992 50 T 4.2473 7.1251 108.9563 60.2028 70.9072 174.0148 51 G 3.5918 8.2445 108.9680 47.0574 0.0000 172.8550 52 H 4.8663 7.8742 113.6743 53.4971 32.2997 174.6823 53 G 3.9282 8.5817 113.3138 45.2622 0.0000 175.8436 54 Q 3.8117 8.5210 122.2679 57.8746 28.6441 177.3023 55 D 4.7589 7.8098 117.3486 53.3235 39.6846 175.8512 56 A 4.8041 7.6793 120.6930 50.1802 22.6028 174.6711 57 P 4.3588 0.0000 0.0000 63.4522 32.4679 175.0643 58 F 5.3075 8.7019 124.9301 56.4617 42.6489 173.6932 59 K 4.1749 7.9508 125.9420 54.9894 35.9647 174.3151 60 V 4.3522 7.8937 126.7439 61.0715 33.7308 174.9248 61 V 4.6343 8.0875 119.8218 59.2709 36.4691 174.8181 62 D 4.6755 8.5246 122.3028 52.7824 40.6438 176.9482 63 I 3.7225 8.6434 121.4839 64.8460 37.5530 177.8401 64 D 4.5184 8.0998 117.8114 57.6451 40.8648 178.4841 65 S 4.3036 7.9429 114.4969 61.3739 62.5578 176.5830 66 F 4.1410 7.8944 122.0164 61.1479 39.4655 176.4077 67 F 4.7692 8.0265 115.4850 57.5322 38.6354 177.4273 68 S 4.1021 7.6462 115.2758 61.8302 61.9677 176.6447 69 R 3.8615 7.8456 118.4285 59.1000 30.0632 178.1699 70 A 3.7561 7.9217 120.5827 54.2451 18.4359 178.3826 71 T 4.5758 7.8451 103.3336 61.6096 69.3849 174.1401 72 T 4.4208 7.4745 120.4182 61.1573 69.1478 172.9065 73 P 4.4570 0.0000 0.0000 62.7226 32.2923 175.5693 74 Q 4.3154 6.6082 117.5479 53.3487 32.2749 176.2075 75 D 4.3197 8.5510 119.5304 56.0059 39.2686 177.4775 76 W 4.6515 7.2354 113.1772 56.6765 28.8325 176.2506 77 Y 4.2284 7.0973 117.9350 58.3111 38.1808 175.4544 78 E 5.0047 8.6913 123.0943 54.9000 32.7920 175.7475 79 D 4.3425 8.9598 118.2938 58.5074 40.4323 178.0906 80 E 3.8654 8.1463 118.8969 59.6605 29.6202 178.7203 81 E 3.6130 7.8636 117.8069 59.1792 29.4220 178.9574 82 N 4.3116 8.3914 116.8120 56.0596 38.5567 177.3168 83 A 3.9617 8.1164 122.3686 55.2164 18.6244 179.9124 84 V 3.5903 7.4562 116.2867 65.9188 31.5137 178.4973 85 V 3.9509 8.0869 119.3284 65.4019 31.4346 177.8127 86 A 3.9977 8.1003 120.5101 55.3116 18.2592 179.8405 87 K 3.9046 8.1092 116.8296 59.4133 31.9469 179.6102 88 F 4.0199 8.0436 117.8351 60.2975 39.0223 177.9353 89 Q 4.0386 8.3963 117.9421 58.5995 28.3893 178.7457 90 K 3.8672 8.0853 120.7862 59.2675 32.2803 178.5691 91 L 3.7234 7.6921 120.6135 58.0854 41.9440 178.5579 92 L 3.6774 7.9797 120.5418 58.0020 41.8837 178.5336 93 E 3.8460 7.9616 118.8142 59.4760 29.5321 178.8881 94 V 3.5296 7.8521 118.2257 66.0100 31.2871 178.1823 95 I 3.6937 7.5330 119.4682 64.4147 36.8790 178.6384 96 K 4.0233 7.9431 117.4636 59.1336 31.8472 179.3394 97 S 4.2911 8.0703 115.2885 60.8812 62.9199 175.3456 98 N 4.6571 7.7494 117.3881 52.8401 39.6715 175.3082 99 L 4.6877 7.6262 120.2334 52.8860 43.4552 175.7641 100 K 4.2699 8.8473 124.9145 56.6234 33.7272 175.7196 101 N 4.3224 8.7189 120.5269 53.8961 35.7401 172.1464 102 P 4.7701 0.0000 0.0000 62.7785 32.7395 177.2067 103 Q 4.6325 9.3023 121.5794 54.2793 33.9778 173.8352 104 V 4.7142 8.0587 120.4360 61.3110 34.3606 173.8528 105 Y 4.8941 9.1578 125.3994 56.2639 40.8731 174.6803 106 R 4.7600 8.9157 124.4130 54.6129 32.3339 175.1600 107 L 4.8635 9.2250 124.9999 54.2719 44.5663 177.5031 108 G 4.0869 9.4328 109.7629 44.5683 0.0000 172.0766 109 E 4.5752 7.7448 115.9970 55.6594 33.0260 174.0063 110 V 3.9419 8.0975 123.4264 62.8115 31.1161 171.1649 111 E 4.9041 7.7917 128.6157 54.8655 30.1439 174.3715 112 L 4.9362 9.0509 125.1667 53.0103 44.7879 175.2499 113 D 5.0327 8.7085 122.3322 52.8955 42.9323 175.5675 114 V 4.7200 8.4977 123.6216 61.1681 34.5684 173.7577 115 Y 5.1059 9.0122 124.8131 56.3074 41.5542 174.7773 116 V 4.6278 9.5387 125.4277 61.8419 32.6158 174.0388 117 I 4.9090 9.0492 130.1015 59.6526 39.4635 175.5135 118 G 4.6188 9.0811 113.2683 44.8107 0.0000 170.1974 119 E 5.2907 8.7489 120.5436 54.3847 31.9933 175.6868 120 T 4.5150 9.1623 117.5389 60.0486 70.0158 173.9420 121 P 4.3347 0.0000 0.0000 64.7400 31.2126 176.6532 122 A 4.2624 7.9012 120.8730 52.2684 19.1208 177.7190 123 G 3.9032 8.6557 104.5139 45.5032 0.0000 173.0502 124 N 5.1574 7.8980 115.6296 51.0866 42.5692 173.3635 125 L 5.0644 8.5390 120.3468 53.6179 43.7806 175.9974 126 A 4.1406 8.7303 124.4726 50.1920 23.5452 175.2735 127 G 3.7031 5.8210 103.0515 45.6033 0.0000 171.3794 128 I 5.3939 7.4827 112.8531 59.2654 41.5027 174.6598 129 S 5.1491 9.2488 116.4256 57.7447 66.9771 173.1373 130 T 4.8000 8.3130 114.3767 61.4632 70.6735 171.9532 131 K 4.9478 8.3541 118.9237 54.6569 35.9465 176.1920 132 V 4.6941 8.8323 121.9535 61.2028 35.4783 174.2545 133 V 4.9997 8.5623 125.8559 61.2460 34.4734 173.8965 134 E 5.0392 9.5719 127.6737 54.9336 33.0153 176.2257 135 T 4.1841 9.7174 114.8642 61.6374 68.8814 174.0202 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 1 S 8.32 4.53 0.00 3.65 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 2 T 8.08 4.48 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 3 K 7.96 4.16 0.00 1.74 1.86 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.71 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.40 7.81 4 T 8.10 4.31 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 1.34 0.00 0.00 5 N 8.51 4.30 0.00 2.79 2.83 0.00 0.00 6.82 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 6 S 8.01 4.14 0.00 3.85 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 7 E 8.07 4.03 0.00 2.15 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 2.38 2.38 0.00 8 I 7.62 3.76 1.95 0.00 0.00 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 1.47 0.75 0.82 0.00 0.00 9 L 8.29 4.03 0.00 1.63 1.68 0.90 0.70 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 10 E 7.97 3.99 0.00 2.15 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 2.31 2.47 0.00 11 Q 7.89 3.96 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 12 L 7.89 3.90 0.00 1.61 1.59 0.75 0.48 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 13 K 7.78 3.88 0.00 1.85 1.96 0.00 1.64 0.00 0.00 1.78 0.00 0.00 3.14 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.61 1.49 7.81 14 Q 8.03 3.95 0.00 2.02 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.63 0.00 15 A 7.83 4.20 1.26 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 0.00 0.00 16 S 7.50 4.46 0.00 3.95 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 17 D 7.99 4.60 0.00 2.67 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 18 G 8.88 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 0.00 0.00 0.00 19 L 7.71 4.40 0.00 1.51 1.83 0.51 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 20 L 8.35 5.08 0.00 1.59 1.57 0.96 0.86 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 21 F 9.26 4.60 0.00 2.93 2.91 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 22 M 7.69 4.86 0.00 1.80 1.81 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 23 S 8.73 4.22 0.00 4.15 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 24 E 8.90 4.09 0.00 2.18 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 2.36 2.26 0.00 25 S 8.01 4.88 0.00 3.88 3.85 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 26 E 8.17 5.29 0.00 1.90 1.80 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 2.03 2.15 0.00 27 Y 8.77 4.84 0.00 2.96 2.79 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 28 P 0.00 5.01 0.00 2.02 2.08 0.00 3.82 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 2.09 2.15 0.00 29 F 8.72 5.22 0.00 3.02 2.98 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 30 E 9.27 4.82 0.00 2.03 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 2.31 2.32 0.00 31 V 8.65 4.52 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 0.70 0.00 0.00 0.93 0.00 0.00 32 F 8.71 5.12 0.00 3.12 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 33 L 8.35 4.32 0.00 1.55 1.58 0.93 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 34 W 8.71 4.81 0.00 3.47 2.98 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 35 E 9.29 3.87 0.00 2.02 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 2.41 2.33 0.00 36 G 8.77 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 37 S 7.76 4.68 0.00 4.16 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 38 A 8.70 4.07 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 39 P 0.00 4.37 0.00 2.08 2.47 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.34 0.00 40 P 0.00 4.40 0.00 2.06 2.06 0.00 3.67 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 2.04 2.09 0.00 41 V 8.24 3.63 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 0.91 0.00 0.00 1.11 0.00 0.00 42 T 8.14 4.67 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 1.21 0.00 0.00 43 H 8.70 4.08 0.00 1.86 3.07 0.00 5.65 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 44 E 7.24 3.78 0.00 1.94 1.86 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 2.17 2.18 0.00 45 I 7.85 3.44 1.89 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 1.29 0.56 0.70 0.00 0.00 46 V 7.35 2.95 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 0.73 0.00 0.00 0.31 0.00 0.00 47 L 7.72 3.91 0.00 1.58 1.80 0.80 0.77 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 48 Q 7.38 3.80 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.99 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 49 Q 7.78 3.80 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 1.76 1.27 0.00 50 T 7.13 4.25 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 0.34 0.00 0.00 51 G 8.24 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 52 H 7.87 4.87 0.00 3.03 3.22 0.00 5.89 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.58 3.93 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 0.00 0.00 0.00 54 Q 8.52 3.81 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.66 0.00 0.00 0.00 0.00 0.00 2.29 1.98 0.00 55 D 7.81 4.76 0.00 2.75 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 56 A 7.68 4.80 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 57 P 0.00 4.36 0.00 2.25 2.07 0.00 3.59 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 2.16 0.00 58 F 8.70 5.31 0.00 3.04 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 59 K 7.95 4.17 0.00 1.69 1.42 0.00 1.41 0.00 0.00 1.42 0.00 0.00 2.84 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.24 1.23 7.81 60 V 7.89 4.35 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 0.54 0.00 0.00 0.38 0.00 0.00 61 V 8.09 4.63 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 0.76 0.00 0.00 0.82 0.00 0.00 62 D 8.52 4.68 0.00 2.83 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 63 I 8.64 3.72 1.96 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.65 1.01 0.00 0.00 64 D 8.10 4.52 0.00 2.92 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 65 S 7.94 4.30 0.00 4.17 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 66 F 7.89 4.14 0.00 2.82 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 67 F 8.03 4.77 0.00 3.27 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 68 S 7.65 4.10 0.00 4.11 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 69 R 7.85 3.86 0.00 1.70 1.91 0.00 3.43 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 70 A 7.92 3.76 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 71 T 7.85 4.58 4.29 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 1.35 0.00 0.00 72 T 7.47 4.42 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 1.16 0.00 0.00 73 P 0.00 4.46 0.00 2.10 2.07 0.00 3.68 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 1.92 1.96 0.00 74 Q 6.61 4.32 0.00 0.93 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.90 0.00 0.00 0.00 0.00 0.00 2.01 1.77 0.00 75 D 8.55 4.32 0.00 2.78 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 76 W 7.24 4.65 0.00 3.72 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 77 Y 7.10 4.23 0.00 2.82 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 78 E 8.69 5.00 0.00 2.00 1.87 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 2.30 2.44 0.00 79 D 8.96 4.34 0.00 2.67 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 80 E 8.15 3.87 0.00 2.01 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 2.32 2.38 0.00 81 E 7.86 3.61 0.00 1.40 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 1.60 2.07 0.00 82 N 8.39 4.31 0.00 2.73 2.85 0.00 0.00 6.86 7.20 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 83 A 8.12 3.96 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 84 V 7.46 3.59 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 1.22 0.00 0.00 0.97 0.00 0.00 85 V 8.09 3.95 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 1.13 0.00 0.00 1.06 0.00 0.00 86 A 8.10 4.00 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 K 8.11 3.90 0.00 1.83 1.68 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.66 7.81 88 F 8.04 4.02 0.00 3.44 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 89 Q 8.40 4.04 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.69 0.00 90 K 8.09 3.87 0.00 1.86 1.89 0.00 1.56 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.39 7.81 91 L 7.69 3.72 0.00 1.60 1.54 0.64 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 92 L 7.98 3.68 0.00 1.63 1.74 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 93 E 7.96 3.85 0.00 2.17 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 0.00 2.27 2.29 0.00 94 V 7.85 3.53 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 0.99 0.00 0.00 0.88 0.00 0.00 95 I 7.53 3.69 2.03 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.61 0.93 0.00 0.00 96 K 7.94 4.02 0.00 1.72 1.88 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.65 7.81 97 S 8.07 4.29 0.00 3.81 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 98 N 7.75 4.66 0.00 2.59 2.81 0.00 0.00 7.00 7.75 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 99 L 7.63 4.69 0.00 1.71 1.55 0.84 0.78 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 0.00 100 K 8.85 4.27 0.00 1.75 1.76 0.00 1.78 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.40 7.81 101 N 8.72 4.32 0.00 2.86 2.81 0.00 0.00 7.05 8.02 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 0.00 102 P 0.00 4.77 0.00 1.98 2.02 0.00 3.65 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 103 Q 9.30 4.63 0.00 2.06 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 104 V 8.06 4.71 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 0.02 0.00 0.00 0.68 0.00 0.00 105 Y 9.16 4.89 0.00 3.03 2.97 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 0.00 106 R 8.92 4.76 0.00 1.63 1.82 0.00 3.13 0.00 0.00 3.11 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.41 0.00 107 L 9.23 4.86 0.00 1.60 1.54 0.76 1.41 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 0.00 108 G 9.43 4.09 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 0.00 0.00 0.00 109 E 7.74 4.58 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 2.22 2.30 0.00 110 V 8.10 3.94 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 1.43 0.00 0.00 0.95 0.00 0.00 111 E 7.79 4.90 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 2.27 2.34 0.00 112 L 9.05 4.94 0.00 1.58 1.65 1.07 1.02 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 0.00 113 D 8.71 5.03 0.00 2.75 2.46 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 0.00 114 V 8.50 4.72 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 0.20 0.00 0.00 0.85 0.00 0.00 115 Y 9.01 5.11 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 0.00 116 V 9.54 4.63 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 1.09 0.00 0.00 1.04 0.00 0.00 117 I 9.05 4.91 2.15 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.90 0.95 0.00 0.00 118 G 9.08 4.62 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 E 8.75 5.29 0.00 2.08 1.80 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 2.20 2.35 0.00 120 T 9.16 4.52 4.21 0.00 0.00 0.00 0.00 0.00 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 0.00 121 P 0.00 4.33 0.00 2.19 2.21 0.00 3.73 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 2.07 1.96 0.00 122 A 7.90 4.26 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 0.00 123 G 8.66 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 0.00 124 N 7.90 5.16 0.00 2.64 2.72 0.00 0.00 6.96 7.14 0.00 0.00 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 L 8.54 5.06 0.00 1.81 1.58 1.25 0.87 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 0.00 126 A 8.73 4.14 0.98 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 0.00 0.00 127 G 5.82 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 0.00 128 I 7.48 5.39 1.99 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.08 0.78 0.00 0.00 129 S 9.25 5.15 0.00 3.31 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 0.00 130 T 8.31 4.80 3.74 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 0.98 0.00 0.00 131 K 8.35 4.95 0.00 0.79 0.79 0.00 1.18 0.00 0.00 1.02 0.00 0.00 2.57 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.19 1.02 7.81 132 V 8.83 4.69 2.16 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 1.02 0.00 0.00 1.21 0.00 0.00 133 V 8.56 5.00 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 1.08 0.00 0.00 1.14 0.00 0.00 134 E 9.57 5.04 0.00 1.91 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 2.27 2.28 0.00 135 T 9.72 4.18 4.26 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 1.27 0.00 0.00