NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4461 8.3044 120.3359 55.2161 33.4380 174.1297 3 V 4.0307 8.1785 122.2600 60.0770 32.7955 173.5887 4 W 4.2989 9.0026 135.0000 56.8041 31.7335 175.0769 5 T 3.9896 7.8084 121.4626 61.4938 67.3083 172.1899 6 P 4.5433 0.0000 0.0000 63.2055 32.2192 175.6421 7 V 4.0107 7.6056 120.1151 62.6048 32.8009 175.0928 8 N 4.1753 8.7589 126.0831 55.0855 37.0186 172.8326 9 N 5.0242 7.5972 108.4820 53.1164 40.2894 174.0521 10 K 4.2075 8.2497 114.9729 56.2580 32.8710 176.2957 11 M 4.9152 8.1170 120.1764 53.7880 35.5448 175.0559 12 F 4.7401 7.6292 116.0977 57.3428 41.0674 176.9290 13 E 3.5515 8.2703 121.5664 57.2236 27.5059 175.3851 14 T 3.9163 8.2884 122.7000 66.2848 69.0517 174.2021 15 F 4.4828 9.0674 123.6872 57.6803 36.2844 176.6612 16 S 4.3781 8.2642 116.1701 60.8192 62.9572 174.6159 17 Y 4.3799 8.2921 116.6259 57.9227 38.1474 175.0949 18 L 4.6584 7.5656 120.0376 52.1307 43.5700 174.4920 19 P 4.3475 0.0000 0.0000 62.1122 31.7343 174.8806 20 P 4.1747 0.0000 0.0000 63.0247 31.6632 176.2093 21 L 3.9606 8.4420 122.9644 54.4846 41.8121 177.7135 22 T 4.1016 8.2830 114.8428 61.5741 70.6412 174.7077 23 D 4.3888 8.5042 120.3534 57.4821 40.7477 178.8898 24 E 3.9791 8.0919 118.6761 59.5397 29.5748 179.2674 25 Q 3.9182 7.6971 116.6771 58.7952 28.7260 178.8293 26 I 3.7465 7.8989 120.6383 64.4384 37.1527 178.2310 27 A 4.0592 8.4497 121.7546 55.2124 18.1581 179.5289 28 A 3.9664 8.2248 119.2315 55.4605 18.4596 179.9096 29 Q 4.1688 8.1545 116.5707 59.1099 28.8149 179.1134 30 V 3.7574 8.1815 119.3613 66.2155 31.5327 177.8284 31 D 4.4364 8.5040 118.8242 57.5129 40.5487 178.1506 32 Y 4.2194 8.3234 120.1286 60.6008 38.7869 177.9220 33 I 3.8259 8.0572 120.8331 64.6865 37.4480 178.5840 34 V 3.5460 7.9127 118.5541 65.9159 31.1388 177.8571 35 A 3.9454 8.1724 120.0076 54.5814 18.2821 178.3557 36 N 4.1340 7.1577 111.7792 52.1769 38.6948 175.8123 37 G 3.7196 7.2109 108.0579 45.9182 0.0000 173.9795 38 W 4.9767 7.5239 119.1481 55.9411 30.8319 176.1674 39 I 4.4140 8.6983 122.5027 59.2426 38.0159 174.0828 40 P 4.8123 0.0000 0.0000 62.9877 32.7422 175.2361 41 C 5.0130 9.0212 121.9771 58.3203 35.5797 172.4656 42 L 5.3189 8.7465 123.9967 53.2782 44.3572 175.1879 43 E 5.6397 9.1437 120.8318 55.0177 34.1943 174.5380 44 F 5.5779 9.2088 116.0123 56.0083 42.0508 172.9411 45 A 4.5374 8.3581 120.5338 50.1079 22.6547 176.2190 46 E 4.3553 8.6558 118.5567 55.7279 30.7829 177.7766 47 A 4.3790 8.8402 122.6051 55.8050 18.4970 179.7917 48 D 4.5728 8.2224 113.5895 56.4076 41.0617 177.1862 49 K 4.6541 8.0836 116.9310 56.0398 32.5391 176.5802 50 A 3.9790 7.8756 123.1832 52.7118 19.5079 177.7050 51 Y 4.6670 7.8731 113.2403 55.5369 39.9720 175.9217 52 V 3.8513 8.3898 123.4975 62.6719 31.6329 175.3378 53 S 4.7030 8.9333 116.2555 57.8121 66.2574 173.8548 54 N 5.2997 8.5787 113.6153 52.2901 39.9951 176.4709 55 E 4.0137 8.2743 119.6667 59.5290 29.6425 178.9360 56 S 4.0937 8.9046 115.6722 60.4125 62.9033 175.7536 57 A 2.5800 7.4908 123.3420 53.2478 17.7376 179.0093 58 I 3.5789 7.0317 116.6662 63.5811 38.0720 177.1010 59 R 4.2637 7.4965 116.2994 55.7086 30.4883 176.1531 60 F 5.1374 7.1348 118.0243 55.7070 41.6821 177.3932 61 G 4.0814 8.2733 117.7987 46.3943 0.0000 175.7823 62 S 4.6809 8.4528 114.4169 58.7295 62.3665 174.4431 63 V 4.4503 7.3071 107.2662 61.1711 33.0143 177.7099 64 S 4.5121 8.2459 115.2915 59.7550 63.5675 173.4655 65 C 4.0232 8.1423 119.0324 61.5767 27.9498 173.2092 66 L 3.5456 8.3980 123.9210 55.6667 39.0327 173.3410 67 Y 4.3741 7.7273 119.2365 55.9136 39.9959 174.4323 68 Y 4.7713 7.2077 123.4031 56.1432 42.2830 174.8171 69 D 4.4984 8.9013 123.1897 55.4450 41.7054 176.8443 70 N 4.7231 8.9291 117.1248 54.3300 35.8523 176.1080 71 R 3.9574 8.0260 118.8431 59.3629 30.3622 177.2397 72 Y 4.3761 7.6699 114.5942 58.0034 38.3255 175.2970 73 W 5.0927 8.6559 124.1757 55.3905 32.6206 174.6635 74 T 4.3293 8.1899 117.0770 62.7845 69.5277 174.5862 75 M 4.5388 8.5060 126.1015 55.2409 33.2290 175.2305 76 W 4.7555 9.5135 135.0000 56.1891 31.2308 176.7889 77 K 3.3703 8.5047 128.8050 57.6947 30.5488 177.4355 78 L 4.9276 8.2105 125.8125 52.6197 45.0259 173.9834 79 P 4.3060 0.0000 0.0000 63.6539 32.2972 177.5128 80 M 4.3002 8.5667 123.4615 53.6735 30.5418 176.1660 81 F 4.5092 7.3029 117.6802 59.1602 39.9446 176.6430 82 G 4.0100 9.1488 113.8169 45.3314 0.0000 172.9147 83 C 4.3101 7.9716 120.8432 59.6486 31.7150 173.2033 84 R 4.5975 8.6010 125.4293 55.6957 31.2705 174.4555 85 D 4.8323 7.9170 118.3000 51.2854 42.8274 174.4133 86 P 4.3412 0.0000 0.0000 66.4370 31.0489 178.2468 87 M 4.0891 8.4235 118.2890 58.0887 31.7613 178.7311 88 Q 4.0048 8.1570 118.0716 58.8262 28.8943 178.8528 89 V 3.6059 7.7532 118.7489 66.0710 31.7532 177.9113 90 L 4.0318 8.1650 118.8318 57.9079 41.3688 179.6908 91 R 3.9685 8.3295 118.2555 59.3924 29.9484 179.0148 92 E 4.0911 8.3377 118.4120 59.1767 29.4290 179.2996 93 I 3.5048 7.7730 120.0565 64.3128 37.1007 178.5003 94 V 3.4728 7.6369 118.4853 65.9245 31.3609 177.8685 95 A 3.9288 8.1028 120.6115 55.2129 18.2675 179.1570 96 C 2.0000 7.6210 117.6629 62.0594 30.9959 175.9909 97 T 3.7656 7.5807 111.5346 64.3907 68.0144 176.6049 98 K 3.8944 7.9743 121.2362 59.7478 32.7267 178.8419 99 A 4.0245 7.6883 121.1400 53.2940 19.9096 177.6462 100 F 4.6889 7.8525 115.5634 55.0768 39.1383 173.9261 101 P 4.4364 0.0000 0.0000 64.2490 31.9100 177.8689 102 D 4.5975 8.0358 116.6102 54.0211 41.2973 175.7591 103 A 4.7136 7.5178 121.4697 50.7236 20.7134 177.1088 104 Y 4.1521 8.5518 118.0229 57.9361 39.3398 175.3396 105 V 5.1577 8.7634 123.3011 61.1174 35.2510 174.2404 106 R 4.9995 9.4610 123.9810 54.2495 32.9670 173.9225 107 L 4.7626 8.1041 123.9190 54.0700 43.5823 175.7591 108 V 4.7943 8.7444 118.6219 59.4856 36.2587 174.1583 109 A 4.8775 8.0911 121.3572 50.5392 22.8398 175.1911 110 F 5.2376 8.8887 119.2877 55.7233 42.5898 174.0852 111 D 5.3636 8.8483 122.6459 52.7500 42.5697 176.4841 112 N 4.8052 9.1769 122.5246 53.7382 38.4241 176.0011 113 Q 4.2696 8.7216 118.8019 58.5558 29.2859 177.5358 114 K 4.0090 8.4059 115.3359 57.2308 32.8829 176.5670 115 Q 3.4948 8.0191 118.4044 55.8086 26.9297 172.5311 116 V 4.4819 7.7840 117.1661 60.0568 34.9851 173.9989 117 Q 4.3161 8.7792 123.2935 56.6163 29.2386 175.6080 118 I 4.2739 8.1193 124.5191 60.8722 39.5999 174.3625 119 M 4.5635 6.6593 117.0239 54.9443 34.2429 173.7361 120 G 4.3540 8.3148 106.7521 46.2674 0.0000 172.2479 121 F 5.0217 7.6021 116.5920 55.2617 41.7573 172.9547 122 L 4.6475 8.8446 122.6966 55.5711 42.0502 176.7959 123 V 4.5525 9.0333 118.3652 61.3463 33.9457 175.6858 124 Q 4.4612 7.8782 121.8604 54.3823 32.4220 173.0103 125 R 4.4986 8.3704 126.4437 53.1559 32.7312 173.6246 126 P 4.2275 0.0000 0.0000 63.0839 31.1469 176.0073 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 2 M 8.30 4.45 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.57 0.00 3 V 8.18 4.03 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 0.81 0.00 0.00 0.97 0.00 0.00 4 W 9.00 4.30 0.00 3.43 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 5 T 7.81 3.99 4.10 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 1.03 0.00 0.00 6 P 0.00 4.54 0.00 2.24 2.19 0.00 3.79 0.00 0.00 3.75 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 7 V 7.61 4.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.91 0.00 0.00 8 N 8.76 4.18 0.00 2.81 2.76 0.00 0.00 6.86 7.79 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 9 N 7.60 5.02 0.00 2.72 2.65 0.00 0.00 7.31 6.68 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 10 K 8.25 4.21 0.00 1.91 1.76 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.65 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.46 1.47 7.81 11 M 8.12 4.92 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 12 F 7.63 4.74 0.00 3.15 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 13 E 8.27 3.55 0.00 2.13 1.73 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 2.22 2.15 0.00 14 T 8.29 3.92 4.15 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 0.00 0.00 0.00 0.17 0.00 0.00 15 F 9.07 4.48 0.00 3.27 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.26 4.38 0.00 4.05 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 17 Y 8.29 4.38 0.00 3.02 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 18 L 7.57 4.66 0.00 1.80 1.59 0.85 0.84 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 19 P 0.00 4.35 0.00 2.01 2.00 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 20 P 0.00 4.17 0.00 2.03 2.03 0.00 3.68 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 21 L 8.44 3.96 0.00 1.62 1.53 0.55 0.45 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 22 T 8.28 4.10 4.41 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 1.19 0.00 0.00 23 D 8.50 4.39 0.00 2.71 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 24 E 8.09 3.98 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 2.39 2.45 0.00 25 Q 7.70 3.92 0.00 2.18 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 26 I 7.90 3.75 2.08 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 1.66 1.08 1.12 0.00 0.00 27 A 8.45 4.06 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 28 A 8.22 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 8.15 4.17 0.00 2.59 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.44 1.99 0.00 30 V 8.18 3.76 2.33 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 1.09 0.00 0.00 1.08 0.00 0.00 31 D 8.50 4.44 0.00 2.98 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 32 Y 8.32 4.22 0.00 3.08 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 33 I 8.06 3.83 2.15 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 1.63 0.82 1.06 0.00 0.00 34 V 7.91 3.55 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 1.01 0.00 0.00 0.98 0.00 0.00 35 A 8.17 3.95 1.30 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 0.00 0.00 0.00 36 N 7.16 4.13 0.00 1.44 1.42 0.00 0.00 7.07 8.98 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 37 G 7.21 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 38 W 7.52 4.98 0.00 3.34 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 39 I 8.70 4.41 2.10 0.00 0.00 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 1.45 0.99 0.72 0.00 0.00 40 P 0.00 4.81 0.00 2.08 1.98 0.00 3.78 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 41 C 9.02 5.01 0.00 3.05 2.67 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 0.00 0.00 0.00 0.00 42 L 8.75 5.32 0.00 1.85 1.60 0.88 0.83 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 43 E 9.14 5.64 0.00 2.05 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 2.37 2.33 0.00 44 F 9.21 5.58 0.00 3.06 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 45 A 8.36 4.54 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 8.66 4.36 0.00 2.21 2.14 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 0.00 2.33 2.32 0.00 47 A 8.84 4.38 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 48 D 8.22 4.57 0.00 2.72 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 49 K 8.08 4.65 0.00 1.57 1.71 0.00 1.73 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.46 7.81 50 A 7.88 3.98 0.55 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 0.00 0.00 51 Y 7.87 4.67 0.00 2.90 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 8.39 3.85 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 0.66 0.00 0.00 0.77 0.00 0.00 53 S 8.93 4.70 0.00 4.09 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 54 N 8.58 5.30 0.00 2.77 2.85 0.00 0.00 6.57 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 55 E 8.27 4.01 0.00 2.14 2.22 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 2.38 2.36 0.00 56 S 8.90 4.09 0.00 4.01 3.80 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 57 A 7.49 2.58 1.11 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 58 I 7.03 3.58 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.81 0.89 0.00 0.00 59 R 7.50 4.26 0.00 1.89 1.99 0.00 3.19 0.00 0.00 3.21 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 60 F 7.13 5.14 0.00 2.97 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 61 G 8.27 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 0.00 0.00 0.00 62 S 8.45 4.68 0.00 3.86 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 63 V 7.31 4.45 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 0.67 0.00 0.00 0.52 0.00 0.00 64 S 8.25 4.51 0.00 4.12 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 0.00 65 C 8.14 4.02 0.00 2.96 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 66 L 8.40 3.55 0.00 1.76 1.74 0.95 1.02 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 67 Y 7.73 4.37 0.00 2.91 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 68 Y 7.21 4.77 0.00 2.82 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 69 D 8.90 4.50 0.00 2.89 2.67 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 0.00 0.00 0.00 0.00 70 N 8.93 4.72 0.00 3.08 3.25 0.00 0.00 7.00 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 71 R 8.03 3.96 0.00 1.52 1.71 0.00 3.10 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 72 Y 7.67 4.38 0.00 3.05 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 73 W 8.66 5.09 0.00 3.08 3.15 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 0.00 0.00 0.00 0.00 74 T 8.19 4.33 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 0.94 0.00 0.00 75 M 8.51 4.54 0.00 2.08 2.03 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 2.71 2.80 0.00 76 W 9.51 4.76 0.00 3.65 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 77 K 8.50 3.37 0.00 1.67 0.92 0.00 1.72 0.00 0.00 1.56 0.00 0.00 2.72 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.87 0.21 7.81 78 L 8.21 4.93 0.00 1.61 1.60 1.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 4.31 0.00 0.76 1.89 0.00 3.66 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.17 0.00 80 M 8.57 4.30 0.00 2.05 2.01 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 2.69 2.53 0.00 81 F 7.30 4.51 0.00 3.10 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 82 G 9.15 4.01 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 0.00 0.00 0.00 83 C 7.97 4.31 0.00 3.00 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 84 R 8.60 4.60 0.00 1.80 1.86 0.00 3.20 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.76 0.00 85 D 7.92 4.83 0.00 2.64 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 86 P 0.00 4.34 0.00 2.33 2.41 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 87 M 8.42 4.09 0.00 2.12 2.28 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.59 0.00 88 Q 8.16 4.00 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 89 V 7.75 3.61 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 1.10 0.00 0.00 0.97 0.00 0.00 90 L 8.17 4.03 0.00 1.87 1.72 0.95 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.33 3.97 0.00 2.03 2.02 0.00 3.15 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 92 E 8.34 4.09 0.00 2.23 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 0.00 2.63 2.64 0.00 93 I 7.77 3.50 1.99 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.86 0.85 0.00 0.00 94 V 7.64 3.47 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 1.06 0.00 0.00 0.93 0.00 0.00 95 A 8.10 3.93 1.51 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 96 C 7.62 2.00 0.00 1.23 2.33 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 97 T 7.58 3.77 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 1.14 0.00 0.00 98 K 7.97 3.89 0.00 1.83 1.91 0.00 1.44 0.00 0.00 1.68 0.00 0.00 3.34 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.39 1.64 7.81 99 A 7.69 4.02 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 0.00 100 F 7.85 4.69 0.00 2.91 2.82 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 0.00 101 P 0.00 4.44 0.00 2.12 2.11 0.00 3.27 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 102 D 8.04 4.60 0.00 2.71 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.52 4.71 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 Y 8.55 4.15 0.00 2.37 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 0.00 105 V 8.76 5.16 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 0.92 0.00 0.00 0.87 0.00 0.00 106 R 9.46 5.00 0.00 1.82 1.91 0.00 2.32 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.36 0.00 107 L 8.10 4.76 0.00 1.53 0.80 0.87 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 108 V 8.74 4.79 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.46 0.00 0.00 109 A 8.09 4.88 1.19 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 0.00 0.00 110 F 8.89 5.24 0.00 3.00 2.88 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 0.00 111 D 8.85 5.36 0.00 2.37 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 N 9.18 4.81 0.00 2.93 3.04 0.00 0.00 6.27 7.39 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 0.00 113 Q 8.72 4.27 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.06 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 114 K 8.41 4.01 0.00 1.75 1.87 0.00 1.90 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.47 7.81 115 Q 8.02 3.49 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 116 V 7.78 4.48 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 0.50 0.00 0.00 0.92 0.00 0.00 117 Q 8.78 4.32 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.18 1.97 0.00 118 I 8.12 4.27 1.28 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.16 0.63 -0.53 0.00 0.00 119 M 6.66 4.56 0.00 2.20 2.28 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.71 0.00 120 G 8.31 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 0.00 0.00 0.00 0.00 121 F 7.60 5.02 0.00 3.23 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 0.00 122 L 8.84 4.65 0.00 1.74 1.73 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.03 4.55 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 0.68 0.00 0.00 0.90 0.00 0.00 124 Q 7.88 4.46 0.00 2.00 1.81 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 2.31 2.24 0.00 125 R 8.37 4.50 0.00 1.76 1.66 0.00 3.35 0.00 0.00 3.33 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.61 0.00 126 P 0.00 4.23 0.00 2.07 1.97 0.00 2.20 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.33 0.00