NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9195 8.3549 109.7369 45.5510 0.0000 172.4111 2 L 4.3271 8.0469 118.7331 51.0827 44.1199 175.1586 3 S 4.5678 9.7233 117.0772 57.8155 65.8709 174.7217 4 D 4.7608 8.7893 122.0530 57.3019 40.4497 179.2766 5 G 3.7016 8.0232 106.0648 47.3187 0.0000 175.7776 6 E 3.8729 8.3332 121.0449 59.1441 29.4537 179.0532 7 W 4.6931 7.9228 118.9746 60.2322 29.0970 178.3335 8 Q 4.0686 7.9502 118.3206 59.3372 28.4388 178.2753 9 L 4.0428 7.8808 119.9958 57.9285 41.5847 179.5368 10 V 3.7585 8.2326 118.3552 66.1883 31.4524 177.9765 11 L 4.1751 9.0733 119.1210 57.9987 41.2931 179.4695 12 N 4.4066 8.2753 115.6620 56.3634 38.9320 177.3585 13 V 3.7345 7.7616 119.7121 65.7375 31.6960 177.7044 14 W 4.2192 8.6703 128.3692 60.4186 30.3387 178.1857 15 G 3.5713 7.8432 105.8589 47.6541 0.0000 175.5375 16 K 3.7129 7.4461 119.7109 59.2874 32.3398 179.0851 17 V 2.8356 7.0189 117.5067 65.7519 31.0385 177.7590 18 E 3.8859 7.5276 116.9173 59.0816 29.3345 178.7113 19 A 4.1899 7.5543 118.8232 53.5543 20.0247 177.4657 20 D 4.6622 7.6921 116.7524 52.3701 42.5781 176.0625 21 V 3.5671 7.6719 122.9266 66.0343 32.2287 176.7820 22 A 4.1597 7.9995 120.2131 54.7741 18.3054 179.7481 23 G 3.5038 7.9706 104.4888 48.2112 0.0000 175.8304 24 H 4.1718 8.2327 118.8185 58.3410 28.5951 178.2035 25 G 3.5209 8.0436 107.6158 47.6941 0.0000 175.2993 26 Q 3.8574 8.3782 122.8134 59.1484 29.0746 178.5415 27 E 3.8532 7.8788 118.8017 59.2355 29.3847 179.6961 28 V 3.4947 7.8424 118.5130 65.9375 31.6362 178.0917 29 L 3.4100 7.8208 118.8017 57.5363 41.2658 179.5697 30 I 3.6045 7.5860 119.6843 64.5648 37.1019 178.7934 31 R 3.6262 7.8613 118.7813 58.8381 29.7690 178.8706 32 L 3.9370 8.1849 120.5337 58.3305 41.5811 179.2070 33 F 4.5183 8.1533 118.0581 60.5770 38.6192 177.9688 34 K 4.1437 8.7820 118.3901 59.3179 31.9098 179.2666 35 G 3.7318 8.0102 104.9307 46.2684 0.0000 173.8312 36 H 4.7014 8.1518 117.5886 51.9601 29.8884 171.8000 37 P 4.4780 0.0000 0.0000 64.6500 31.4521 177.5770 38 E 4.0976 8.2861 116.2200 59.5333 29.3614 179.1143 39 T 3.6093 8.1422 111.0334 64.5552 68.5993 176.0927 40 L 3.7754 7.9890 122.8398 57.9320 41.7439 178.6692 41 E 4.1404 7.9131 117.5203 59.1960 29.4190 178.9082 42 K 4.3141 8.0498 118.1776 57.1889 32.5668 176.2718 43 F 4.6247 8.3359 119.0391 55.5895 40.0238 175.9686 44 D 4.3334 8.7451 126.7706 57.2792 40.7841 179.0859 45 K 3.8587 7.8684 117.9516 58.6510 32.2734 176.7601 46 F 5.0862 7.9554 114.3127 56.6633 41.0370 176.3505 47 K 4.0848 7.7324 120.0732 59.4141 32.3459 177.5789 48 H 4.2972 8.0822 115.1259 56.4333 29.1505 175.2114 49 L 4.3737 8.0389 121.5384 54.6141 41.8670 176.9168 50 K 4.5017 9.2487 122.2938 55.6154 32.8880 176.3636 51 S 4.5405 7.6895 112.5047 56.2731 66.1352 175.9015 52 E 3.7905 8.5630 123.5184 59.9344 29.1150 179.0263 53 D 4.3945 8.0549 117.9269 57.6372 40.8515 178.6391 54 E 4.0012 7.9068 118.6115 59.3723 29.2038 179.0980 55 M 3.9766 8.5817 119.0944 58.6358 32.1989 178.6897 56 K 3.9916 8.5766 117.4919 59.2702 32.2450 178.7265 57 A 4.3789 7.6336 119.4112 52.7497 18.9360 177.3932 58 S 4.1586 7.4837 113.6930 58.2696 62.7344 174.6402 59 E 4.1075 8.8481 127.6214 59.4600 29.6668 178.5889 60 D 4.5292 8.1715 119.4321 56.9378 40.9683 178.2895 61 L 3.5412 7.6826 119.8054 57.7862 42.0326 178.9114 62 K 3.9391 7.8825 119.2675 59.3608 32.1232 178.9552 63 K 4.0239 8.2483 118.8830 59.8111 31.9190 178.8382 64 H 4.4190 8.5919 118.7010 58.9583 29.7531 177.6043 65 G 3.5643 8.1540 107.7971 47.8137 0.0000 175.2393 66 N 4.3567 8.2064 120.0169 56.4682 38.9973 176.9299 67 T 3.8923 8.0407 117.1492 67.4131 68.5928 176.1550 68 T 3.8973 8.1100 117.5941 66.9434 68.4835 176.6446 69 L 4.2419 8.7716 121.1685 58.0074 41.8053 179.9868 70 T 3.9346 8.4568 116.2460 66.6693 68.2466 175.9987 71 A 3.9547 8.0590 122.5437 55.2415 18.3432 179.1219 72 L 3.7068 7.9900 117.9560 58.3030 42.0628 179.6459 73 G 3.3306 8.6127 105.8919 47.5477 0.0000 175.6518 74 G 3.6533 7.6893 106.9255 47.8203 0.0000 175.5580 75 I 3.8608 7.3361 122.1853 63.9551 37.2655 178.5276 76 L 3.9017 7.8926 120.2470 57.7528 41.1684 179.8127 77 K 3.9416 7.8711 117.4058 58.8142 32.0911 178.6376 78 K 4.0010 7.7842 117.2073 55.9979 32.8764 177.3358 79 K 2.0000 7.8456 117.6293 56.4843 29.1614 174.3656 80 G 3.9806 7.7773 109.0917 45.7255 0.0000 172.7875 81 H 4.5777 7.9978 119.8712 55.1217 27.5097 174.7726 82 H 5.1009 7.2750 111.6271 55.1068 29.7496 176.2573 83 E 3.9012 8.5084 123.4824 60.0327 29.5211 178.6158 84 A 4.0122 7.9455 120.2502 55.3076 18.7112 178.1697 85 E 4.0794 8.2418 113.9507 59.1699 29.8532 178.4280 86 L 4.3356 7.7945 119.3395 57.1481 43.0277 178.7152 87 T 3.9022 8.2913 116.3017 66.0180 68.1397 174.5329 88 P 4.3055 0.0000 0.0000 65.8700 31.0672 178.2482 89 L 4.0872 7.9078 119.2887 57.8423 42.0048 178.5583 90 A 4.1576 8.2939 120.9858 55.2734 18.4558 179.6627 91 Q 4.1376 8.7679 117.0714 59.2217 28.8541 179.2439 92 S 4.0566 9.0892 116.4349 61.6353 63.0549 175.9725 93 H 4.4233 8.6831 119.3871 58.1519 28.6745 176.9763 94 A 2.6089 8.9553 124.5015 54.2437 17.9225 179.2954 95 T 3.8881 7.5584 107.2523 62.7061 69.7060 175.9184 96 K 4.0872 7.5333 120.9572 58.1593 33.0844 176.8014 97 H 4.3624 8.1027 114.7004 55.8818 29.6637 175.0895 98 K 3.2163 7.3050 115.2139 56.8380 28.0473 177.1880 99 I 4.3435 7.9194 119.5884 59.0823 37.7398 175.0126 100 P 4.4344 0.0000 0.0000 62.6277 31.9863 178.0673 101 V 3.6308 8.5534 120.7145 65.9217 31.5353 178.5407 102 K 3.7401 7.8957 118.1305 60.0960 32.1248 178.5703 103 Y 4.1440 7.8287 117.8888 60.7604 37.6341 178.1109 104 L 4.1801 7.9566 120.0688 57.6235 41.6630 179.2807 105 E 4.0660 7.8291 118.3924 59.0180 29.4762 179.0867 106 F 4.5851 7.5457 117.7754 60.7857 39.2328 177.4194 107 I 3.9875 8.2306 117.3872 63.2756 37.7949 177.9592 108 S 4.2601 7.8786 116.6302 61.7871 62.6932 175.9593 109 E 4.0747 8.9185 122.2632 58.8935 29.3906 178.4735 110 A 4.2864 8.1558 122.4135 54.5729 18.3227 179.7077 111 I 3.6456 7.6838 117.5760 64.7655 37.2870 178.8342 112 I 3.7619 7.7902 120.5394 64.5107 36.4151 178.5799 113 Q 4.0838 8.6079 119.4199 58.7592 28.3859 179.1093 114 V 3.5373 7.8521 119.4338 65.8999 31.5951 178.0517 115 L 3.6958 7.9055 118.9973 57.6975 41.0602 179.3973 116 Q 4.1406 7.7224 118.4259 59.4639 29.1512 178.1569 117 S 4.2538 8.2832 115.4729 60.9350 62.9650 175.9921 118 K 4.2178 8.4698 119.5942 56.9162 33.2260 176.5577 119 H 4.9574 8.6187 116.7029 53.4901 29.8160 172.1257 120 P 4.3260 0.0000 0.0000 66.5181 31.6080 179.8503 121 G 3.9008 7.4368 104.1430 48.8968 0.0000 174.2001 122 D 4.5851 8.0635 119.6767 54.3784 41.9753 177.6096 123 F 5.1297 8.4496 122.8706 57.5403 37.0842 174.5107 124 G 3.8534 7.5903 107.7444 43.6350 0.0000 171.4436 125 A 3.8953 8.4780 120.8531 55.5729 18.0653 179.5464 126 D 4.1932 7.9839 116.0024 57.5299 41.0197 178.8704 127 A 3.8678 7.7921 120.5835 55.1471 18.3810 179.1360 128 Q 3.2154 7.8256 116.9557 59.2151 28.6797 179.8445 129 G 3.5071 8.4374 106.4532 47.3531 0.0000 175.5155 130 A 3.8372 8.6640 123.7931 55.4266 18.4490 179.3943 131 M 4.0561 8.5767 116.9473 59.0089 32.3212 178.6172 132 S 4.3611 8.3912 115.2674 61.1065 62.8864 176.7989 133 K 3.9018 7.7942 121.3792 59.3018 31.7663 179.2137 134 A 3.8734 7.8047 121.0083 55.1875 18.3511 179.7798 135 L 4.0656 8.4173 117.9890 57.7189 41.5814 179.3478 136 E 3.9883 8.5404 120.0332 58.9597 29.5456 178.6194 137 L 3.9279 8.4147 120.9084 58.0623 42.3533 178.3931 138 F 4.1041 8.2535 120.6416 61.7344 39.2353 177.3954 139 R 3.5786 8.1661 117.2588 59.2563 29.7067 178.8837 140 N 4.2714 8.2557 116.4235 56.3184 38.0509 177.0589 141 D 4.4368 8.5565 120.1211 56.6849 40.8179 178.7636 142 M 3.7257 7.3781 119.3351 57.9698 31.8438 178.2358 143 A 3.7788 7.8853 122.0124 54.5016 18.5333 179.5070 144 A 3.9662 7.6769 118.9667 55.0260 18.2806 179.9083 145 K 3.9166 7.6560 117.4166 60.5633 32.3676 177.8968 146 Y 4.4506 8.9827 116.7430 61.8574 37.2928 178.4875 147 K 3.8320 9.0898 120.3293 60.0706 32.1861 179.1171 148 E 4.0086 8.0643 117.6777 59.4457 29.6139 179.0576 149 L 4.2432 8.6136 117.3412 55.4051 41.6634 177.6686 150 G 3.7727 7.5738 106.2448 46.3784 0.0000 173.6674 151 F 4.7491 7.9860 123.2286 56.3643 41.1563 175.9417 152 Q 3.7715 5.7683 119.0133 57.9599 28.4370 177.0555 153 G 3.7238 7.9417 112.1724 45.6860 0.0000 172.1890 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 G 8.35 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 2 L 8.05 4.33 0.00 0.70 0.93 0.53 -0.66 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 3 S 9.72 4.57 0.00 3.99 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 4 D 8.79 4.76 0.00 2.77 2.86 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 5 G 8.02 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 6 E 8.33 3.87 0.00 1.71 1.78 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 2.24 2.26 0.00 7 W 7.92 4.69 0.00 3.44 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 8 Q 7.95 4.07 0.00 2.37 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 9 L 7.88 4.04 0.00 1.97 1.74 0.90 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 10 V 8.23 3.76 2.58 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 1.26 0.00 0.00 0.91 0.00 0.00 11 L 9.07 4.18 0.00 1.80 1.81 0.91 0.83 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 12 N 8.28 4.41 0.00 2.77 2.94 0.00 0.00 7.00 7.21 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 13 V 7.76 3.73 2.50 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 1.18 0.00 0.00 1.15 0.00 0.00 14 W 8.67 4.22 0.00 3.62 3.29 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 15 G 7.84 3.57 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 16 K 7.45 3.71 0.00 1.67 1.45 0.00 1.66 0.00 0.00 1.54 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.46 7.81 17 V 7.02 2.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 -0.23 0.00 0.00 18 E 7.53 3.89 0.00 2.06 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 19 A 7.55 4.19 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 20 D 7.69 4.66 0.00 2.73 2.58 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 21 V 7.67 3.57 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 1.02 0.00 0.00 0.97 0.00 0.00 22 A 8.00 4.16 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 23 G 7.97 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 24 H 8.23 4.17 0.00 3.12 3.21 0.00 5.82 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 8.04 3.52 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 0.00 0.00 0.00 26 Q 8.38 3.86 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.74 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 27 E 7.88 3.85 0.00 2.17 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 2.24 2.33 0.00 28 V 7.84 3.49 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 1.00 0.00 0.00 0.98 0.00 0.00 29 L 7.82 3.41 0.00 1.45 0.78 0.90 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.59 3.60 1.84 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.87 0.86 0.00 0.00 31 R 7.86 3.63 0.00 1.91 1.94 0.00 3.08 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.81 0.00 32 L 8.18 3.94 0.00 1.66 1.43 1.11 1.08 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 33 F 8.15 4.52 0.00 2.96 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 34 K 8.78 4.14 0.00 1.72 1.85 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.71 7.81 35 G 8.01 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 36 H 8.15 4.70 0.00 3.10 2.80 0.00 5.64 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 37 P 0.00 4.48 0.00 2.15 2.11 0.00 3.83 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 2.09 1.99 0.00 38 E 8.29 4.10 0.00 2.30 2.32 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 2.39 2.69 0.00 39 T 8.14 3.61 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 40 L 7.99 3.78 0.00 1.50 1.81 -0.12 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.91 4.14 0.00 2.24 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 2.38 2.52 0.00 42 K 8.05 4.31 0.00 2.01 1.56 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.43 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.56 1.41 7.81 43 F 8.34 4.62 0.00 3.12 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 44 D 8.75 4.33 0.00 2.65 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 K 7.87 3.86 0.00 1.42 1.04 0.00 1.60 0.00 0.00 1.52 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.82 1.23 7.81 46 F 7.96 5.09 0.00 2.82 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 47 K 7.73 4.08 0.00 1.94 1.93 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.61 1.56 7.81 48 H 8.08 4.30 0.00 3.23 3.43 0.00 5.70 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 49 L 8.04 4.37 0.00 1.61 1.57 1.02 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.25 4.50 0.00 1.66 1.77 0.00 1.72 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.47 7.81 51 S 7.69 4.54 0.00 3.97 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 52 E 8.56 3.79 0.00 2.03 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 2.37 2.42 0.00 53 D 8.05 4.39 0.00 2.79 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 54 E 7.91 4.00 0.00 2.05 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 2.34 0.00 55 M 8.58 3.98 0.00 1.89 2.28 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 2.72 2.59 0.00 56 K 8.58 3.99 0.00 1.92 1.85 0.00 1.67 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.48 7.81 57 A 7.63 4.38 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 58 S 7.48 4.16 0.00 3.95 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 59 E 8.85 4.11 0.00 2.26 2.21 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 2.40 2.44 0.00 60 D 8.17 4.53 0.00 2.99 3.04 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 61 L 7.68 3.54 0.00 1.02 1.57 0.59 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.88 3.94 0.00 1.83 1.92 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 63 K 8.25 4.02 0.00 2.19 1.94 0.00 1.81 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.52 1.54 7.81 64 H 8.59 4.42 0.00 3.75 3.57 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 8.15 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 N 8.21 4.36 0.00 2.80 3.00 0.00 0.00 7.28 6.99 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 67 T 8.04 3.89 4.40 0.00 0.00 0.00 0.00 0.00 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 68 T 8.11 3.90 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 1.29 0.00 0.00 69 L 8.77 4.24 0.00 1.74 1.99 0.87 0.87 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 70 T 8.46 3.93 4.43 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 0.00 0.00 0.00 1.25 0.00 0.00 71 A 8.06 3.95 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 3.71 0.00 1.58 1.55 0.05 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.61 3.33 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 0.00 74 G 7.69 3.65 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 0.00 0.00 0.00 75 I 7.34 3.86 1.86 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.07 0.86 0.00 0.00 76 L 7.89 3.90 0.00 1.19 1.41 -0.29 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.87 3.94 0.00 1.81 1.79 0.00 1.79 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.45 1.46 7.81 78 K 7.78 4.00 0.00 1.62 1.92 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.63 1.74 7.81 79 K 7.85 2.00 0.00 0.93 0.74 0.00 1.42 0.00 0.00 1.23 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.53 0.98 7.81 80 G 7.78 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 0.00 0.00 0.00 81 H 8.00 4.58 0.00 3.15 3.23 0.00 5.79 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 7.28 5.10 0.00 3.26 3.41 0.00 5.49 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 83 E 8.51 3.90 0.00 2.08 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 2.39 2.40 0.00 84 A 7.95 4.01 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 85 E 8.24 4.08 0.00 2.10 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 0.00 2.31 2.38 0.00 86 L 7.79 4.34 0.00 1.74 1.83 0.79 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.29 3.90 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 1.23 0.00 0.00 88 P 0.00 4.31 0.00 2.29 2.34 0.00 3.73 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 2.22 2.05 0.00 89 L 7.91 4.09 0.00 1.85 1.97 1.03 1.19 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 8.29 4.16 1.45 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 91 Q 8.77 4.14 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 92 S 9.09 4.06 0.00 3.80 4.11 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 0.00 0.00 0.00 93 H 8.68 4.42 0.00 3.50 3.54 0.00 5.82 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 8.96 2.61 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.56 3.89 4.11 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 0.00 0.00 1.08 0.00 0.00 96 K 7.53 4.09 0.00 1.59 1.71 0.00 1.55 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.11 1.33 7.81 97 H 8.10 4.36 0.00 2.98 3.14 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.30 3.22 0.00 1.81 1.89 0.00 1.40 0.00 0.00 2.24 0.00 0.00 3.01 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.26 1.23 7.81 99 I 7.92 4.34 2.16 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.98 1.22 0.00 0.00 100 P 0.00 4.43 0.00 1.64 1.73 0.00 3.67 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.50 0.00 101 V 8.55 3.63 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 0.90 0.00 0.00 0.98 0.00 0.00 102 K 7.90 3.74 0.00 1.61 1.91 0.00 1.64 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.29 7.81 103 Y 7.83 4.14 0.00 3.19 3.11 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 0.00 0.00 0.00 104 L 7.96 4.18 0.00 1.92 1.77 0.62 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.83 4.07 0.00 1.93 2.00 0.00 0.00 0.00 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 0.00 106 F 7.55 4.59 0.00 3.28 2.99 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 0.00 0.00 0.00 107 I 8.23 3.99 2.03 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.39 1.07 0.00 0.00 108 S 7.88 4.26 0.00 4.10 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 0.00 109 E 8.92 4.07 0.00 2.09 2.31 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 2.42 2.41 0.00 110 A 8.16 4.29 1.45 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 0.00 111 I 7.68 3.65 2.11 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.84 1.02 0.00 0.00 112 I 7.79 3.76 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.92 1.16 0.00 0.00 113 Q 8.61 4.08 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.72 0.00 114 V 7.85 3.54 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 0.95 0.00 0.00 0.98 0.00 0.00 115 L 7.91 3.70 0.00 0.91 0.28 0.68 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.72 4.14 0.00 2.38 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.47 2.51 0.00 117 S 8.28 4.25 0.00 3.79 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 0.00 118 K 8.47 4.22 0.00 1.37 1.47 0.00 1.68 0.00 0.00 1.45 0.00 0.00 2.53 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.25 1.42 7.81 119 H 8.62 4.96 0.00 3.06 3.38 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 0.00 120 P 0.00 4.33 0.00 2.20 2.16 0.00 3.64 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 2.13 2.28 0.00 121 G 7.44 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 0.00 122 D 8.06 4.59 0.00 2.79 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 0.00 123 F 8.45 5.13 0.00 3.01 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 0.00 124 G 7.59 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 0.00 125 A 8.48 3.90 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 4.19 0.00 2.65 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 0.00 127 A 7.79 3.87 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 3.22 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 1.48 1.73 0.00 129 G 8.44 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 0.00 130 A 8.66 3.84 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.58 4.06 0.00 2.47 2.34 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.92 0.00 132 S 8.39 4.36 0.00 3.90 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 0.00 133 K 7.79 3.90 0.00 1.80 1.66 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.38 1.53 7.81 134 A 7.80 3.87 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 0.00 135 L 8.42 4.07 0.00 1.72 1.80 1.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.54 3.99 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 137 L 8.41 3.93 0.00 1.79 1.94 1.09 1.02 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 0.00 138 F 8.25 4.10 0.00 3.10 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 0.00 139 R 8.17 3.58 0.00 1.98 1.85 0.00 3.23 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.05 0.00 140 N 8.26 4.27 0.00 2.74 2.83 0.00 0.00 7.06 8.07 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 0.00 141 D 8.56 4.44 0.00 2.61 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 0.00 142 M 7.38 3.73 0.00 1.31 1.39 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 143 A 7.89 3.78 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 0.00 144 A 7.68 3.97 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 0.00 145 K 7.66 3.92 0.00 2.11 1.91 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.51 7.81 146 Y 8.98 4.45 0.00 3.19 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 0.00 147 K 9.09 3.83 0.00 1.95 2.00 0.00 1.51 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.56 7.81 148 E 8.06 4.01 0.00 2.21 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 2.36 2.37 0.00 149 L 8.61 4.24 0.00 1.89 1.75 0.96 0.73 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 0.00 150 G 7.57 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 0.00 0.00 0.00 151 F 7.99 4.75 0.00 2.89 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 5.77 3.77 0.00 0.93 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.62 0.00 0.00 0.00 0.00 0.00 2.07 1.94 0.00 153 G 7.94 3.72 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 0.00 0.00 0.00