NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3468 8.3149 120.1412 55.6966 33.5361 175.3297 7 L 4.1310 8.3852 121.5851 53.4142 42.1547 175.1732 8 H 5.0412 9.3459 118.5148 53.5766 32.5527 172.6478 9 K 4.6064 8.4044 120.3050 56.0495 33.2945 175.9386 10 E 4.9005 8.8001 121.6339 53.8947 33.6981 173.7736 11 P 5.0136 0.0000 0.0000 62.9262 32.3438 175.2730 12 A 4.8699 8.2183 123.2109 51.3589 23.1561 175.6194 13 T 4.6214 8.6880 114.9631 61.3938 72.3384 173.8955 14 L 4.1988 8.6962 128.3797 55.8389 42.4303 175.7805 15 I 4.3002 8.4732 126.8916 62.2377 38.4860 175.9772 16 K 4.4868 7.5510 120.1108 55.4141 35.5785 173.7740 17 A 4.5834 8.7191 130.7569 51.9111 19.5980 176.7391 18 I 4.2147 8.3177 123.5561 62.8621 38.2787 175.0940 19 D 4.5203 8.0698 117.9878 52.9840 41.9672 175.5594 20 G 3.8454 9.2932 106.3397 48.2525 0.0000 173.6734 21 D 4.9626 8.3682 116.3436 52.7234 41.6672 175.2705 22 T 5.2011 8.1461 115.6508 62.1296 71.9266 173.0080 23 I 4.9320 8.8737 119.2340 59.0573 41.8659 174.2122 24 K 5.3581 9.2028 124.0629 55.1942 33.6937 175.7413 25 I 5.1364 8.8945 118.1342 59.1863 41.9243 174.2002 26 M 4.8213 9.2606 124.2808 55.1968 33.1610 174.2242 27 Y 4.8617 9.4585 128.3910 56.1613 41.7912 175.8543 28 K 3.5177 8.9629 127.6219 57.3698 29.6171 175.3532 29 G 4.0287 8.1726 106.3566 44.9940 0.0000 172.7603 30 Q 4.9107 7.9550 119.0716 53.1771 31.9928 173.2038 31 P 4.9921 0.0000 0.0000 63.1585 32.2719 175.3423 32 M 5.0411 9.4213 122.7215 54.0267 37.3857 173.9226 33 T 4.9370 8.4627 116.8475 62.7208 70.6390 173.9303 34 F 5.0933 9.9732 125.5478 55.5932 42.1191 174.1861 35 R 4.9959 8.7101 122.8077 54.2695 32.4939 174.9416 36 L 4.5679 8.7030 127.2837 54.3987 42.3135 177.2989 37 L 3.8486 8.3683 125.0207 56.1092 42.1868 178.1159 38 L 3.7568 8.8183 120.5389 55.1176 39.3132 174.0299 39 V 4.9537 7.2764 110.0828 59.5641 35.8117 174.9506 40 D 4.9317 8.8617 123.1139 52.8814 43.5503 175.5325 41 T 4.6764 8.5178 114.0649 59.4411 71.1436 173.1624 42 P 4.6099 0.0000 0.0000 62.7778 32.1405 175.8223 43 E 4.4893 9.9898 121.6055 55.7881 30.6695 177.4051 44 T 4.0625 8.4904 112.0387 62.5892 70.3937 174.8015 45 K 4.3275 7.7539 122.4123 54.6190 31.1039 174.3844 46 H 4.8311 8.1415 122.0699 52.9211 32.0564 171.0422 47 P 4.2727 0.0000 0.0000 65.5474 31.9202 178.4937 48 K 3.9443 7.8928 121.8441 56.9878 32.0933 178.5305 49 K 4.0555 8.2049 123.6034 57.0672 34.2862 176.8626 50 G 4.0581 7.9036 111.0932 44.4646 0.0000 174.4348 51 V 3.6803 8.5038 125.2934 63.7977 32.0755 176.6001 52 E 4.3437 9.8213 128.9238 55.4009 31.2612 175.9913 53 K 4.1043 8.2621 122.7354 57.8860 32.5648 176.7894 54 Y 4.2995 8.0311 123.1279 59.3317 36.0460 170.9217 55 G 3.8811 7.7321 106.8560 47.8388 0.0000 173.8112 56 P 4.3017 0.0000 0.0000 64.9116 31.5039 178.7534 57 E 3.9959 8.1441 116.6143 59.4930 29.6773 179.0961 58 A 4.0556 8.9239 121.7091 54.8563 18.4545 179.4919 59 S 4.3007 8.2074 112.3106 60.7581 63.4045 176.5431 60 A 4.0688 7.9471 124.6687 54.6818 18.1105 179.0346 61 F 3.9062 8.2588 119.2866 61.9581 39.4016 177.4496 62 T 3.9503 8.1079 114.8308 66.4763 68.2257 176.3594 63 K 3.8555 7.8805 120.8894 59.6127 32.2351 178.9146 64 K 3.8840 8.5651 118.8045 59.6002 31.7554 178.9440 65 M 3.8495 7.9088 117.5464 58.7534 32.2671 177.9932 66 L 4.1388 8.0928 119.1058 57.7569 41.6257 179.2798 67 E 4.0101 8.3075 117.8621 58.8362 29.4987 178.2316 68 N 4.5588 7.9636 114.2490 53.1057 39.2940 175.4199 69 A 4.4655 6.9201 123.8146 51.6969 19.2585 177.8959 70 K 4.1878 9.2404 120.9006 58.6468 32.6654 178.2926 71 K 4.5920 8.5369 118.2122 54.6481 36.3558 175.2276 72 L 5.1214 8.6036 126.9745 53.6229 44.2000 174.8241 73 E 5.0546 9.2910 124.4848 54.7389 34.3769 174.7420 74 V 4.6921 9.1002 115.5883 59.5025 35.1465 174.5657 75 E 4.8935 9.1031 125.5443 54.2850 31.8476 175.0499 76 F 4.6588 8.7925 125.9550 57.7334 39.9818 175.8370 77 D 4.9622 8.5682 121.3136 53.7598 43.2225 176.1118 78 K 4.5208 8.8696 118.9444 56.6617 33.1780 177.8198 79 G 4.1678 8.6644 111.9831 44.7770 0.0000 174.0872 80 Q 4.0377 8.6427 122.7601 56.4495 29.3868 176.4582 81 R 4.5048 8.4494 119.8425 56.3703 30.9157 175.9831 82 T 4.9923 7.3157 107.3774 59.7204 71.8750 173.2298 83 D 4.7366 8.4975 123.7382 51.5370 41.4135 177.1780 84 K 3.8640 8.3770 117.3178 59.1640 32.3792 176.9898 85 Y 4.2630 8.1756 116.0301 57.7206 38.1920 176.0721 86 G 3.8829 8.4387 108.4986 45.5734 0.0000 173.5141 87 R 4.4034 8.5287 119.6130 54.5123 31.6577 176.5609 88 G 2.9346 8.0302 110.8149 46.3639 0.0000 172.3285 89 L 5.2541 8.4078 122.2509 53.0783 43.8503 175.6267 90 A 4.4436 8.2950 123.5309 51.2118 23.6391 173.9483 91 Y 4.9213 8.8872 117.4298 57.1368 39.7275 175.2653 92 I 4.8886 8.6744 124.6103 59.6733 40.2741 174.1322 93 Y 5.1218 9.0827 123.6121 56.0525 41.3155 174.5175 94 A 4.8564 9.0849 125.9030 50.1104 21.2484 176.3771 95 D 4.3151 10.2701 125.4353 56.0584 39.0768 175.5405 96 G 3.9385 8.4056 104.6959 45.2676 0.0000 173.1530 97 K 4.4616 8.0692 122.3251 54.5111 33.7157 174.8555 98 M 3.9155 8.5624 125.7378 55.2100 32.9037 176.4763 99 V 3.6263 8.5273 127.8670 66.4833 31.2304 177.6835 100 N 4.3340 7.9479 115.4558 56.2906 38.4534 176.8809 101 E 3.8762 8.0450 120.0156 58.8986 29.9763 178.1499 102 A 4.0267 7.9102 120.9004 55.4252 18.4597 179.4757 103 L 3.4497 7.8915 117.1711 57.9439 41.6886 180.1286 104 V 3.7114 7.3309 117.5117 65.9688 31.2723 178.0465 105 R 3.9391 8.3751 117.7643 59.1796 29.9529 177.5396 106 Q 4.3362 7.6727 114.8873 55.0103 29.0724 175.9760 107 G 3.8644 8.0137 108.5660 46.8169 0.0000 174.8196 108 L 4.4538 7.6276 116.3492 53.7761 42.4139 176.2556 109 A 4.6892 7.4883 118.8703 50.8355 22.1196 176.2495 110 K 4.7814 8.4395 119.8225 54.4370 35.0568 176.2505 111 V 4.1054 8.7730 123.8122 62.8545 31.8874 175.9183 112 A 4.0012 8.8298 130.4923 51.5501 19.5117 176.3384 113 Y 4.1950 7.6966 116.9445 58.0091 38.4392 175.9478 114 V 3.9952 8.0502 124.1430 61.4797 33.0686 174.8273 115 Y 4.6822 8.0849 123.9617 55.7119 38.7990 175.2249 116 K 4.3224 8.6516 124.6726 56.3405 32.6675 175.3938 117 P 4.7965 0.0000 0.0000 62.8901 31.7336 176.6567 118 N 4.8306 8.2007 119.3308 52.1349 36.9482 175.2926 119 N 5.0585 7.9349 114.9952 53.5152 38.6924 177.6832 120 T 3.9082 8.8382 119.1282 67.1247 68.7378 174.8740 121 H 4.9361 7.9942 117.1614 55.4878 29.4004 176.1759 122 E 3.9960 8.2628 123.3875 59.5627 29.3007 178.7741 123 Q 3.9463 7.9964 117.4669 59.1622 28.9222 177.6295 124 H 4.1439 8.2754 118.7246 59.5511 29.8748 176.9601 125 L 3.8932 7.9122 120.4948 57.9417 41.4569 179.8390 126 R 3.9581 8.1675 118.0773 58.8424 29.7803 179.0478 127 K 3.8587 8.5382 118.7804 59.9253 32.1703 179.5441 128 S 4.0986 8.1980 115.1283 61.4552 62.5996 176.4645 129 E 3.9858 8.3321 122.0323 59.0355 29.3587 178.6981 130 A 3.7283 7.7733 120.5956 54.7869 18.3167 179.4588 131 Q 3.7489 7.7809 117.9618 59.4208 29.2025 178.2701 132 A 4.0811 7.9490 121.7093 54.9992 18.3294 179.7413 133 K 3.3237 7.8012 117.3864 59.3457 31.8868 179.5743 134 K 4.0293 8.0845 118.0936 59.8214 32.3665 177.8399 135 E 4.2635 8.3638 117.1789 54.8725 30.5561 176.4315 136 K 4.0685 8.1564 118.5888 57.2815 30.5034 174.9838 137 L 4.3596 8.2957 119.1235 55.3556 44.8492 178.9349 138 N 3.5464 9.4733 118.0140 54.0429 38.4408 176.2094 139 I 2.9742 4.0000 123.9082 64.7183 37.7679 176.7549 140 W 4.9113 7.8023 117.0923 56.5870 29.2114 176.5706 141 S 4.4645 8.3362 119.8013 58.6020 62.5318 173.9663 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 6 K 8.31 4.35 0.00 1.79 1.85 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.43 7.81 7 L 8.39 4.13 0.00 1.80 1.74 0.98 0.90 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 8 H 9.35 5.04 0.00 3.21 3.26 0.00 5.71 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 9 K 8.40 4.61 0.00 1.67 1.67 0.00 1.41 0.00 0.00 1.31 0.00 0.00 2.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 1.31 7.81 10 E 8.80 4.90 0.00 2.09 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 2.35 2.21 0.00 11 P 0.00 5.01 0.00 1.94 1.98 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 12 A 8.22 4.87 1.17 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 0.00 0.00 13 T 8.69 4.62 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 14 L 8.70 4.20 0.00 1.62 1.56 0.91 1.03 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 15 I 8.47 4.30 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.82 0.93 0.00 0.00 16 K 7.55 4.49 0.00 1.80 1.61 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.43 7.81 17 A 8.72 4.58 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.32 4.21 2.01 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.65 0.91 0.00 0.00 19 D 8.07 4.52 0.00 2.76 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 20 G 9.29 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 0.00 0.00 0.00 21 D 8.37 4.96 0.00 2.71 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 22 T 8.15 5.20 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 1.26 0.00 0.00 23 I 8.87 4.93 1.89 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 1.29 0.97 0.93 0.00 0.00 24 K 9.20 5.36 0.00 1.86 1.81 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.43 7.81 25 I 8.89 5.14 1.89 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 0.97 1.30 0.82 0.00 0.00 26 M 9.26 4.82 0.00 2.14 2.03 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.54 0.00 27 Y 9.46 4.86 0.00 3.08 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 28 K 8.96 3.52 0.00 1.49 1.59 0.00 1.69 0.00 0.00 1.58 0.00 0.00 3.04 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.90 0.21 7.81 29 G 8.17 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 30 Q 7.96 4.91 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.96 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 31 P 0.00 4.99 0.00 2.13 2.11 0.00 3.76 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 32 M 9.42 5.04 0.00 1.98 2.26 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.65 0.00 33 T 8.46 4.94 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 34 F 9.97 5.09 0.00 2.80 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 35 R 8.71 5.00 0.00 1.87 1.73 0.00 3.32 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 36 L 8.70 4.57 0.00 1.55 1.60 0.98 1.28 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 37 L 8.37 3.85 0.00 1.17 1.22 0.35 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.82 3.76 0.00 2.00 1.87 1.10 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.28 4.95 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 0.79 0.00 0.00 0.91 0.00 0.00 40 D 8.86 4.93 0.00 2.52 2.48 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 41 T 8.52 4.68 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 1.16 0.00 0.00 42 P 0.00 4.61 0.00 2.18 2.07 0.00 3.63 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.05 0.00 43 E 9.99 4.49 0.00 2.06 1.88 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 2.28 2.45 0.00 44 T 8.49 4.06 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 45 K 7.75 4.33 0.00 1.74 1.80 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.40 7.81 46 H 8.14 4.83 0.00 3.06 3.30 0.00 5.74 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.27 0.00 2.22 2.00 0.00 3.35 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.87 0.00 48 K 7.89 3.94 0.00 1.83 1.72 0.00 1.95 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.50 7.81 49 K 8.20 4.06 0.00 1.44 1.42 0.00 1.58 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.42 7.81 50 G 7.90 4.06 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 0.00 0.00 0.00 51 V 8.50 3.68 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 0.77 0.00 0.00 0.91 0.00 0.00 52 E 9.82 4.34 0.00 1.82 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 53 K 8.26 4.10 0.00 1.63 1.62 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.68 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.72 0.77 7.81 54 Y 8.03 4.30 0.00 3.20 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 55 G 7.73 3.88 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 0.00 0.00 0.00 56 P 0.00 4.30 0.00 2.15 2.11 0.00 3.56 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 57 E 8.14 4.00 0.00 2.36 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 0.00 2.52 2.50 0.00 58 A 8.92 4.06 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 59 S 8.21 4.30 0.00 4.11 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 0.00 60 A 7.95 4.07 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 61 F 8.26 3.91 0.00 3.24 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 8.11 3.95 4.31 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 1.25 0.00 0.00 63 K 7.88 3.86 0.00 1.91 2.06 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.49 7.81 64 K 8.57 3.88 0.00 1.67 1.73 0.00 1.80 0.00 0.00 1.51 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.48 7.81 65 M 7.91 3.85 0.00 1.84 1.76 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.53 0.00 66 L 8.09 4.14 0.00 1.71 1.67 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.31 4.01 0.00 1.92 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 2.33 2.60 0.00 68 N 7.96 4.56 0.00 2.73 2.82 0.00 0.00 6.98 7.06 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 69 A 6.92 4.47 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 70 K 9.24 4.19 0.00 1.85 1.87 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.54 7.81 71 K 8.54 4.59 0.00 1.80 1.65 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.37 7.81 72 L 8.60 5.12 0.00 1.70 1.64 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 73 E 9.29 5.05 0.00 1.94 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 2.21 2.26 0.00 74 V 9.10 4.69 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 0.21 0.00 0.00 0.78 0.00 0.00 75 E 9.10 4.89 0.00 2.31 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.39 0.00 76 F 8.79 4.66 0.00 3.08 2.95 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 77 D 8.57 4.96 0.00 2.75 2.94 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 78 K 8.87 4.52 0.00 1.78 1.87 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.44 7.81 79 G 8.66 4.17 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 0.00 0.00 0.00 80 Q 8.64 4.04 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 81 R 8.45 4.50 0.00 1.53 1.29 0.00 2.24 0.00 0.00 2.25 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.38 0.00 82 T 7.32 4.99 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 1.11 0.00 0.00 83 D 8.50 4.74 0.00 2.94 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 84 K 8.38 3.86 0.00 1.62 1.80 0.00 1.26 0.00 0.00 1.52 0.00 0.00 3.00 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.98 0.42 7.81 85 Y 8.18 4.26 0.00 3.11 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 86 G 8.44 3.88 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 0.00 0.00 0.00 87 R 8.53 4.40 0.00 1.98 1.77 0.00 3.12 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 88 G 8.03 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 0.00 0.00 0.00 89 L 8.41 5.25 0.00 1.54 1.57 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.30 4.44 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.89 4.92 0.00 3.00 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 92 I 8.67 4.89 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.02 0.84 0.00 0.00 93 Y 9.08 5.12 0.00 2.89 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 94 A 9.08 4.86 1.21 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 0.00 0.00 0.00 95 D 10.27 4.32 0.00 2.74 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 96 G 8.41 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 97 K 8.07 4.46 0.00 1.92 1.71 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.38 7.81 98 M 8.56 3.92 0.00 1.94 1.68 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.33 0.00 99 V 8.53 3.63 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 1.03 0.00 0.00 0.96 0.00 0.00 100 N 7.95 4.33 0.00 2.90 2.90 0.00 0.00 6.78 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 0.00 101 E 8.05 3.88 0.00 1.90 1.88 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 2.23 2.00 0.00 102 A 7.91 4.03 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.89 3.45 0.00 1.83 1.60 0.98 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.33 3.71 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.94 0.00 0.00 105 R 8.38 3.94 0.00 2.00 2.08 0.00 3.34 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.67 4.34 0.00 1.69 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.43 0.00 0.00 0.00 0.00 0.00 2.45 2.30 0.00 107 G 8.01 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 108 L 7.63 4.45 0.00 1.29 1.46 0.40 0.40 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 0.00 109 A 7.49 4.69 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.44 4.78 0.00 1.65 1.72 0.00 1.52 0.00 0.00 1.57 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.75 1.12 7.81 111 V 8.77 4.11 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 0.74 0.00 0.00 0.94 0.00 0.00 112 A 8.83 4.00 1.17 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 0.00 0.00 113 Y 7.70 4.19 0.00 2.87 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 0.00 114 V 8.05 4.00 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 0.83 0.00 0.00 0.96 0.00 0.00 115 Y 8.08 4.68 0.00 3.09 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 0.00 116 K 8.65 4.32 0.00 1.78 1.80 0.00 1.65 0.00 0.00 1.79 0.00 0.00 3.13 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.77 7.81 117 P 0.00 4.80 0.00 2.21 2.17 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 118 N 8.20 4.83 0.00 2.95 2.88 0.00 0.00 6.67 8.86 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 0.00 119 N 7.93 5.06 0.00 2.87 3.01 0.00 0.00 6.11 7.22 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 0.00 120 T 8.84 3.91 4.39 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 1.11 0.00 0.00 121 H 7.99 4.94 0.00 2.89 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.26 4.00 0.00 2.24 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 2.33 2.39 0.00 123 Q 8.00 3.95 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.63 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 124 H 8.28 4.14 0.00 3.21 3.45 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.91 3.89 0.00 1.99 1.70 1.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.17 3.96 0.00 2.09 1.96 0.00 3.14 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 127 K 8.54 3.86 0.00 2.04 1.88 0.00 1.54 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.48 1.54 7.81 128 S 8.20 4.10 0.00 3.91 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 0.00 129 E 8.33 3.99 0.00 2.06 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 2.22 2.57 0.00 130 A 7.77 3.73 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 0.00 131 Q 7.78 3.75 0.00 2.10 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 132 A 7.95 4.08 1.57 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 0.00 133 K 7.80 3.32 0.00 1.59 1.35 0.00 0.73 0.00 0.00 0.61 0.00 0.00 2.45 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.30 0.89 7.81 134 K 8.08 4.03 0.00 1.77 2.05 0.00 1.45 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.59 7.81 135 E 8.36 4.26 0.00 1.93 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 0.00 2.30 2.53 0.00 136 K 8.16 4.07 0.00 1.80 2.02 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.40 7.81 137 L 8.30 4.36 0.00 1.75 1.63 0.92 0.66 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 0.00 138 N 9.47 3.55 0.00 2.45 1.42 0.00 0.00 7.08 7.32 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 0.00 139 I 4.00 2.97 0.91 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.14 -1.02 0.00 0.00 140 W 7.80 4.91 0.00 3.39 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 0.00 141 S 8.34 4.46 0.00 3.98 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