NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9693 8.2085 109.7547 45.5475 0.0000 173.6922 0 A 3.8999 8.6413 119.8068 54.4805 18.2844 178.1088 1 M 4.0027 8.5575 118.1949 58.7738 32.7129 176.4038 2 A 4.4017 8.1174 121.6021 54.7103 18.6436 179.0779 3 L 3.6497 7.9917 118.5292 58.2002 42.1240 179.1344 4 K 3.9856 8.2623 119.5469 59.4803 32.0620 178.8456 5 R 3.9369 8.1711 119.0700 59.4303 29.9673 178.5899 6 I 3.3373 7.8615 119.8330 64.4959 36.9597 178.1408 7 H 4.1817 8.3145 117.1826 58.6327 28.5290 177.7101 8 K 3.9609 8.1497 121.4659 59.7437 32.0758 178.7802 9 E 4.1108 8.5585 118.9983 59.1406 29.4475 179.0836 10 L 4.1612 8.4278 120.7846 58.2945 41.7384 178.8169 11 N 4.3974 8.3187 116.5164 56.4256 38.5109 177.2181 12 D 4.4034 8.3599 120.4269 57.1523 40.6816 178.5458 13 L 4.0255 7.9766 120.0141 58.0471 42.1618 178.5992 14 A 4.1171 7.7251 119.6129 55.0369 18.3811 179.4009 15 R 4.2589 7.6037 114.9042 57.7394 31.5304 177.1066 16 D 4.7458 7.7114 117.1311 52.1043 42.2424 171.9532 17 P 4.4723 0.0000 0.0000 61.1821 32.5379 174.5488 18 P 4.3860 0.0000 0.0000 63.2415 32.9571 175.9091 19 A 3.5561 8.9927 124.3040 54.2937 16.5831 179.0857 20 Q 3.8775 8.7253 110.5357 57.5030 27.6387 172.8398 21 C 5.1985 7.9343 115.0714 58.3426 30.2199 173.0072 22 S 4.9214 8.3266 114.5681 56.9387 66.4271 172.5673 23 A 4.8565 7.5779 118.6047 51.0965 21.8037 175.8388 24 G 2.6438 8.1052 107.4276 44.9550 0.0000 170.7736 25 P 4.5867 0.0000 0.0000 62.3578 31.7585 178.2930 26 V 3.8500 8.1456 121.2909 65.9403 32.8511 176.2501 27 G 3.9791 6.9551 107.6166 45.8569 0.0000 173.7658 28 D 4.6012 9.0284 124.7250 53.6271 41.0048 175.5947 29 D 4.7193 7.7612 120.6390 53.2656 40.3489 176.6021 30 M 4.2841 8.7298 127.0863 57.5267 32.3255 177.5819 31 F 4.5097 8.9070 116.6209 57.6922 40.0964 174.2736 32 H 5.3939 8.5568 121.8919 54.3020 32.0521 172.5259 33 W 5.3369 9.4770 125.8175 55.0826 32.7831 174.5440 34 Q 5.1820 8.9182 122.4347 54.6725 31.3066 174.1509 35 A 5.3657 8.9353 125.0180 50.4850 23.4266 174.9812 36 T 4.8511 8.9196 108.6283 59.7066 72.5933 172.7458 37 A 5.0813 8.9455 124.8005 50.4037 22.2776 175.3579 38 M 4.7512 8.3787 121.5342 54.6309 33.0623 176.8853 39 G 4.1088 9.2248 111.1379 45.9569 0.0000 171.8962 40 P 4.5995 0.0000 0.0000 62.1550 32.1678 175.7653 41 N 4.6241 8.6159 119.2751 55.1596 38.9174 174.9176 42 D 4.5740 9.6483 120.9363 54.7322 39.3223 173.8512 43 S 4.8701 7.5836 114.0326 55.4874 65.4040 173.2361 44 P 4.2925 0.0000 0.0000 64.7300 31.2322 176.9975 45 Y 5.0745 7.5254 116.1868 57.1818 38.3981 175.1589 46 Q 4.4422 7.7552 122.0812 58.0574 29.3754 176.9444 47 G 4.0410 9.2466 113.2778 45.0750 0.0000 173.5554 48 G 3.9310 8.1651 107.1315 45.4170 0.0000 172.9595 49 V 4.8909 8.2760 121.5650 60.7246 34.0421 174.7756 50 F 5.0027 9.2524 126.5039 55.8080 41.8998 174.4815 51 F 4.9776 9.6874 123.0366 56.5773 40.9246 174.9617 52 L 5.1969 8.9789 121.0388 53.2851 46.5132 175.1760 53 T 5.1020 8.8609 115.1031 60.4934 70.7478 172.7773 54 I 5.0126 8.8392 127.6605 59.7931 41.5224 173.9261 55 H 5.1964 8.9083 123.4097 53.9797 31.7802 172.7467 56 F 4.5686 8.9681 123.4073 55.6670 39.9943 174.4904 57 P 4.6566 0.0000 0.0000 62.2117 32.2388 177.3938 58 T 4.0936 8.4974 109.3486 64.0420 69.0592 174.7209 59 D 4.9690 8.0750 121.0719 52.9718 39.9026 175.2601 60 Y 4.4639 8.0701 121.5139 58.3687 39.2734 174.5776 61 P 3.3839 0.0000 0.0000 62.4945 31.4733 176.5534 62 F 4.8457 8.1769 115.6435 57.7018 39.1612 175.5478 63 K 4.6885 7.6709 119.2870 53.4585 35.8600 174.1733 64 P 2.9700 0.0000 0.0000 60.8956 31.9615 174.4626 65 P 4.1747 0.0000 0.0000 62.6304 32.3414 175.5587 66 K 4.2565 8.6263 121.4816 55.6989 33.4404 176.1321 67 V 4.8302 8.2096 123.8428 61.0767 34.3995 174.2864 68 A 4.9643 8.7086 127.8199 50.2874 23.1535 175.3152 69 F 4.6516 9.6325 119.8486 57.8335 39.8444 176.3568 70 T 4.5949 9.2780 111.6576 62.2415 70.4677 174.6306 71 T 4.5458 8.2283 119.2140 62.5166 69.5694 175.2248 72 R 4.1610 8.5504 124.9863 56.5291 30.8054 175.9090 73 I 4.8285 8.1566 119.5990 60.0870 40.8785 173.6271 74 Y 4.0004 8.7195 128.0514 56.5926 38.3596 174.1054 75 H 4.8032 7.6672 125.3644 54.2614 33.0409 172.7369 76 P 4.0751 0.0000 0.0000 64.9072 31.4760 177.5150 77 N 4.7210 8.2876 113.6045 52.5902 39.0408 173.6460 78 I 5.4017 7.6298 118.6570 58.5726 40.5521 174.8853 79 N 4.8782 8.3580 123.3125 50.9562 39.6211 175.3612 80 S 4.2499 8.5090 111.5171 60.7035 63.1534 174.4404 81 N 4.5368 8.5563 117.7309 53.1286 38.7960 175.9857 82 G 4.3297 8.4173 106.9677 46.4272 0.0000 173.8500 83 S 4.5256 8.0123 115.9984 58.3345 63.4891 172.8558 84 I 4.8173 8.1605 124.5089 59.6879 39.2731 174.8094 85 C 4.4223 8.9711 129.1607 58.5636 31.8589 172.7867 86 L 4.5318 8.1616 128.9582 52.7610 44.5841 175.7821 87 D 4.4491 9.1815 127.5231 56.6523 39.0695 178.3991 88 I 3.8295 7.7484 112.2625 62.6559 37.8777 176.8820 89 L 4.5160 7.7384 119.4296 53.1215 42.3926 176.1462 90 R 4.7358 8.0160 116.7741 56.3276 30.0792 178.3070 91 S 4.2538 9.5906 123.7240 61.4551 63.4671 175.2658 92 Q 4.5734 8.1283 118.6883 55.0323 28.7940 175.4138 93 W 4.4007 7.8836 127.9843 57.7895 31.3550 175.3165 94 S 4.3141 6.5146 117.4581 55.3436 64.9267 172.8769 95 P 4.2743 0.0000 0.0000 64.0109 30.9434 177.0007 96 A 3.9529 7.4265 121.4093 53.5498 18.6062 177.7311 97 L 4.1587 6.8043 116.2705 54.1667 42.5761 176.3859 98 T 5.1748 7.8625 109.9224 59.4262 73.3414 174.9314 99 I 3.7708 9.3239 122.3090 64.3495 36.8825 178.8750 100 S 4.1389 8.1361 113.6958 61.4758 62.3262 176.1809 101 K 3.9644 8.2144 121.1573 59.3368 31.6235 179.5154 102 V 3.6479 8.2454 118.8680 66.1204 31.4939 178.1480 103 L 3.9819 8.2783 119.0059 57.6865 41.3442 179.4449 104 L 4.0294 8.1758 119.0836 58.0304 41.5081 179.8225 105 S 4.1593 8.3390 115.1352 61.6171 62.7266 176.8487 106 I 3.7180 8.1132 122.8796 64.2912 36.8309 177.9140 107 C 4.0542 8.5026 120.0132 62.7210 31.4447 175.5494 108 S 4.1336 8.4149 114.9812 61.4159 61.6659 175.9023 109 L 3.9834 7.9074 122.3071 58.0450 41.8729 178.5602 110 L 4.1226 7.8667 118.2487 58.0927 41.5948 179.0294 111 C 4.6674 7.9757 115.7971 61.7331 29.0204 173.7885 112 D 4.6620 7.9462 119.4708 51.7425 41.5795 172.6568 113 P 4.3421 0.0000 0.0000 62.3416 32.2101 176.5786 114 N 4.7539 9.0535 118.4933 50.8709 37.8249 173.9969 115 P 4.3023 0.0000 0.0000 64.4018 31.9400 177.8506 116 D 4.5281 7.9524 117.6814 55.7297 41.5365 176.0851 117 D 4.8380 7.6287 119.1714 51.9699 40.4289 174.6730 118 P 4.4037 0.0000 0.0000 62.0010 30.9219 177.0840 119 L 3.9644 8.3685 125.5624 56.8411 42.0324 177.4892 120 V 4.1865 7.5802 119.0738 59.8053 31.8559 173.6582 121 P 4.2308 0.0000 0.0000 65.5880 31.1396 177.9826 122 E 3.9411 8.0611 117.4682 59.2245 29.5604 178.7579 123 I 3.6219 7.6004 119.3004 64.1133 37.0308 177.9381 124 A 3.8662 7.9178 121.6906 55.0693 18.1907 179.6651 125 R 3.8216 8.1534 117.5251 59.6817 30.1954 178.9129 126 I 3.9178 8.0435 114.3096 63.3241 37.3676 177.2675 127 Y 3.7220 8.0629 121.1738 60.5439 38.5181 178.2376 128 K 4.0055 7.7500 118.3155 59.3342 32.1457 178.8717 129 T 4.3771 7.9544 108.9872 62.4117 70.5227 174.1127 130 D 4.9513 8.0575 120.9020 51.8886 42.7524 175.0198 131 R 3.7968 8.0551 123.5293 59.0988 30.5450 177.2290 132 E 3.9701 8.1179 117.9347 59.2407 29.4631 179.1318 133 K 3.9621 8.0958 119.8836 59.4115 32.2058 178.1580 134 Y 4.1821 8.2934 120.0513 61.0034 38.6369 178.0502 135 N 4.0619 8.6244 117.6167 56.0923 38.6197 177.3722 136 R 3.7850 7.9638 120.0475 59.6103 30.1233 178.7518 137 I 3.5482 7.6735 119.3479 64.0260 36.9556 178.2948 138 A 3.8705 7.7891 122.0989 54.9878 18.0808 179.8995 139 R 4.2303 7.9516 118.1829 58.9839 30.1584 179.0946 140 E 4.0096 8.1883 118.3318 59.3792 29.4991 179.5633 141 W 4.2624 8.8275 119.2406 59.7287 29.0824 178.8509 142 T 4.2148 8.2609 116.0955 66.8664 67.7375 176.5064 143 Q 4.0142 8.0167 118.5696 59.1001 28.8266 178.9709 144 K 3.8493 7.9283 118.2021 58.6506 32.0244 178.1155 145 Y 4.8144 7.8876 114.2811 57.6246 40.1259 176.3749 146 A 4.5250 8.1465 120.8663 51.8556 19.6299 176.4057 147 M 4.2131 7.9310 122.4895 56.0879 32.3375 175.9538 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 8.21 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 0.00 0.00 0.00 0 A 8.64 3.90 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.56 4.00 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.75 0.00 2 A 8.12 4.40 1.69 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 0.00 0.00 3 L 7.99 3.65 0.00 1.99 1.93 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 4 K 8.26 3.99 0.00 2.04 2.00 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.47 7.81 5 R 8.17 3.94 0.00 2.07 2.14 0.00 3.20 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.84 0.00 6 I 7.86 3.34 1.51 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.25 -0.04 0.45 0.00 0.00 7 H 8.31 4.18 0.00 3.31 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 8.15 3.96 0.00 2.01 2.01 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.62 1.51 7.81 9 E 8.56 4.11 0.00 2.11 2.12 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 2.42 2.55 0.00 10 L 8.43 4.16 0.00 2.03 1.90 0.37 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.32 4.40 0.00 2.96 2.86 0.00 0.00 7.05 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.36 4.40 0.00 2.75 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 7.98 4.03 0.00 1.92 1.93 1.11 0.98 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 14 A 7.73 4.12 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 15 R 7.60 4.26 0.00 1.95 2.01 0.00 3.27 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 16 D 7.71 4.75 0.00 2.61 2.64 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 17 P 0.00 4.47 0.00 2.09 1.98 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 18 P 0.00 4.39 0.00 2.25 2.28 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 19 A 8.99 3.56 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 20 Q 8.73 3.88 0.00 2.35 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 21 C 7.93 5.20 0.00 2.97 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 22 S 8.33 4.92 0.00 3.80 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 23 A 7.58 4.86 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 24 G 8.11 2.64 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 25 P 0.00 4.59 0.00 2.13 2.08 0.00 3.01 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.69 0.00 26 V 8.15 3.85 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 0.71 0.00 0.00 0.70 0.00 0.00 27 G 6.96 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 28 D 9.03 4.60 0.00 2.69 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 29 D 7.76 4.72 0.00 2.80 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 30 M 8.73 4.28 0.00 1.87 2.12 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 2.56 2.55 0.00 31 F 8.91 4.51 0.00 3.11 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 32 H 8.56 5.39 0.00 3.22 3.32 0.00 5.55 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.48 5.34 0.00 3.18 3.09 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 34 Q 8.92 5.18 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 35 A 8.94 5.37 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 36 T 8.92 4.85 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 0.21 0.00 0.00 37 A 8.95 5.08 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 38 M 8.38 4.75 0.00 2.12 2.07 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.53 0.00 39 G 9.22 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 0.00 0.00 0.00 40 P 0.00 4.60 0.00 2.31 2.07 0.00 3.85 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.19 0.00 41 N 8.62 4.62 0.00 2.74 2.80 0.00 0.00 7.06 8.06 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 42 D 9.65 4.57 0.00 2.83 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 43 S 7.58 4.87 0.00 4.13 4.08 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 44 P 0.00 4.29 0.00 1.74 2.19 0.00 3.53 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.93 0.00 45 Y 7.53 5.07 0.00 3.30 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 46 Q 7.76 4.44 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.51 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 47 G 9.25 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.17 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 49 V 8.28 4.89 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 0.67 0.00 0.00 0.93 0.00 0.00 50 F 9.25 5.00 0.00 3.15 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 51 F 9.69 4.98 0.00 3.06 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 52 L 8.98 5.20 0.00 1.40 1.34 0.66 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.86 5.10 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 1.31 0.00 0.00 54 I 8.84 5.01 1.75 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 1.00 0.53 -0.08 0.00 0.00 55 H 8.91 5.20 0.00 2.97 3.13 0.00 5.80 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.97 4.57 0.00 2.66 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.66 0.00 2.48 2.18 0.00 3.76 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.09 0.00 58 T 8.50 4.09 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 1.07 0.00 0.00 59 D 8.08 4.97 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Y 8.07 4.46 0.00 3.34 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 61 P 0.00 3.38 0.00 1.66 1.46 0.00 3.72 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 0.86 1.57 0.00 62 F 8.18 4.85 0.00 3.27 3.22 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 63 K 7.67 4.69 0.00 1.77 1.56 0.00 1.75 0.00 0.00 1.77 0.00 0.00 3.64 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.67 7.81 64 P 0.00 2.97 0.00 1.72 1.45 0.00 3.55 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.82 0.00 65 P 0.00 4.17 0.00 1.40 1.05 0.00 2.75 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 66 K 8.63 4.26 0.00 1.58 1.67 0.00 1.52 0.00 0.00 1.49 0.00 0.00 2.70 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.25 7.81 67 V 8.21 4.83 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 0.65 0.00 0.00 0.71 0.00 0.00 68 A 8.71 4.96 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 69 F 9.63 4.65 0.00 2.95 3.27 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 70 T 9.28 4.59 4.30 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 0.00 0.00 1.29 0.00 0.00 71 T 8.23 4.55 4.76 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 1.38 0.00 0.00 72 R 8.55 4.16 0.00 1.00 1.49 0.00 2.86 0.00 0.00 2.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.34 0.00 73 I 8.16 4.83 1.86 0.00 0.00 -0.61 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 0.56 0.39 0.00 0.00 74 Y 8.72 4.00 0.00 1.92 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.67 4.80 0.00 2.99 2.83 0.00 5.73 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.08 0.00 1.92 1.86 0.00 2.89 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.74 0.00 77 N 8.29 4.72 0.00 2.77 2.91 0.00 0.00 6.91 7.24 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 78 I 7.63 5.40 1.54 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.16 0.65 0.00 0.00 79 N 8.36 4.88 0.00 2.93 2.95 0.00 0.00 6.01 7.64 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 80 S 8.51 4.25 0.00 4.05 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 81 N 8.56 4.54 0.00 2.90 2.91 0.00 0.00 7.01 7.31 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 82 G 8.42 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 0.00 0.00 0.00 0.00 83 S 8.01 4.53 0.00 4.01 3.79 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 84 I 8.16 4.82 1.91 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 1.49 0.93 0.94 0.00 0.00 85 C 8.97 4.42 0.00 2.93 2.84 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 86 L 8.16 4.53 0.00 1.77 1.46 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 87 D 9.18 4.45 0.00 2.93 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 88 I 7.75 3.83 2.00 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 1.70 0.70 0.98 0.00 0.00 89 L 7.74 4.52 0.00 1.80 1.71 0.91 0.60 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 90 R 8.02 4.74 0.00 1.84 1.27 0.00 3.14 0.00 0.00 3.39 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 91 S 9.59 4.25 0.00 4.00 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 92 Q 8.13 4.57 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.59 0.00 93 W 7.88 4.40 0.00 3.57 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 6.51 4.31 0.00 3.58 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 95 P 0.00 4.27 0.00 1.60 1.22 0.00 3.24 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.93 0.00 96 A 7.43 3.95 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 0.00 0.00 0.00 0.00 0.00 97 L 6.80 4.16 0.00 0.27 1.29 0.61 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 98 T 7.86 5.17 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 1.26 0.00 0.00 99 I 9.32 3.77 1.95 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.79 0.99 0.00 0.00 100 S 8.14 4.14 0.00 3.96 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 0.00 101 K 8.21 3.96 0.00 1.98 1.84 0.00 1.66 0.00 0.00 1.51 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.45 7.81 102 V 8.25 3.65 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 1.13 0.00 0.00 1.27 0.00 0.00 103 L 8.28 3.98 0.00 1.87 1.71 0.99 0.76 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 0.00 104 L 8.18 4.03 0.00 1.88 1.74 0.94 0.78 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 0.00 105 S 8.34 4.16 0.00 4.05 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 0.00 106 I 8.11 3.72 2.00 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 1.44 0.75 1.01 0.00 0.00 107 C 8.50 4.05 0.00 3.05 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 8.41 4.13 0.00 3.92 3.99 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 0.00 109 L 7.91 3.98 0.00 1.76 1.84 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 110 L 7.87 4.12 0.00 1.82 1.59 0.60 0.23 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 0.00 111 C 7.98 4.67 0.00 3.21 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 D 7.95 4.66 0.00 2.64 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.34 0.00 0.86 1.44 0.00 3.48 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.74 0.00 114 N 9.05 4.75 0.00 2.60 2.68 0.00 0.00 7.17 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 P 0.00 4.30 0.00 2.19 2.12 0.00 3.71 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.19 0.00 116 D 7.95 4.53 0.00 2.67 2.74 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 0.00 117 D 7.63 4.84 0.00 2.72 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 P 0.00 4.40 0.00 2.14 2.06 0.00 3.75 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 119 L 8.37 3.96 0.00 1.76 1.73 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.58 4.19 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 0.92 0.00 0.00 0.94 0.00 0.00 121 P 0.00 4.23 0.00 2.18 2.08 0.00 3.63 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.13 0.00 122 E 8.06 3.94 0.00 2.10 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 2.44 2.52 0.00 123 I 7.60 3.62 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 0.89 0.24 0.39 0.00 0.00 124 A 7.92 3.87 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 0.00 125 R 8.15 3.82 0.00 1.88 2.11 0.00 3.11 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 126 I 8.04 3.92 1.99 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.42 1.04 0.00 0.00 127 Y 8.06 3.72 0.00 2.49 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 0.00 128 K 7.75 4.01 0.00 1.87 1.82 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.69 7.81 129 T 7.95 4.38 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 0.00 130 D 8.06 4.95 0.00 2.68 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 8.06 3.80 0.00 1.72 1.81 0.00 3.01 0.00 0.00 3.01 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.75 0.00 132 E 8.12 3.97 0.00 2.05 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 2.39 2.35 0.00 133 K 8.10 3.96 0.00 1.93 1.97 0.00 1.69 0.00 0.00 1.59 0.00 0.00 3.18 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.44 7.81 134 Y 8.29 4.18 0.00 3.15 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 0.00 135 N 8.62 4.06 0.00 2.91 2.80 0.00 0.00 6.71 7.46 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 0.00 136 R 7.96 3.78 0.00 1.92 2.00 0.00 3.07 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 137 I 7.67 3.55 0.93 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.48 -0.25 0.00 0.00 138 A 7.79 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.95 4.23 0.00 1.97 1.97 0.00 3.11 0.00 0.00 3.24 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.60 0.00 140 E 8.19 4.01 0.00 2.31 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 2.33 2.53 0.00 141 W 8.83 4.26 0.00 3.45 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 0.00 142 T 8.26 4.21 4.58 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 1.50 0.00 0.00 143 Q 8.02 4.01 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.98 0.00 0.00 0.00 0.00 0.00 2.58 2.55 0.00 144 K 7.93 3.85 0.00 0.79 0.83 0.00 1.38 0.00 0.00 1.52 0.00 0.00 2.33 0.00 0.00 2.21 0.00 0.00 0.00 0.00 1.19 1.46 7.81 145 Y 7.89 4.81 0.00 3.19 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 0.00 146 A 8.15 4.52 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 0.00 147 M 7.93 4.21 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.71 0.00