NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.3342 8.1749 110.9398 60.9545 70.1667 172.9910 13 N 4.2377 8.4479 118.9340 52.7414 38.7921 173.8171 14 L 4.4458 9.1164 123.3701 54.9976 43.8332 175.5815 15 L 4.7542 8.0373 119.8084 53.2392 43.3272 176.6749 16 Y 4.3370 8.5731 123.6998 58.3251 39.9174 175.2109 17 T 3.8351 7.0438 117.0554 60.8776 70.2472 174.1723 18 R 3.8417 8.1517 126.7458 57.4236 30.1358 176.0796 19 N 4.3092 7.6224 118.0678 53.5397 39.1212 175.5045 20 D 4.6189 8.3845 130.7921 52.0488 38.6055 176.2748 21 V 4.1931 7.0582 118.1856 61.3218 33.6012 175.5559 22 S 4.0000 8.6919 121.2080 59.2483 63.5071 174.9950 23 D 4.4308 9.0552 126.8738 57.8757 40.6416 178.6700 24 S 4.0541 8.0861 113.1027 61.2306 62.3553 175.3085 25 E 3.9228 8.2581 121.1320 59.6215 29.3928 178.9499 26 K 3.8795 8.4491 118.5537 59.5354 32.0234 179.0052 27 K 3.7994 8.1594 117.7895 59.7336 32.1214 179.2269 28 A 3.9548 7.8856 120.2037 55.4903 18.3751 179.8815 29 T 3.7670 8.0699 114.3548 66.9077 68.7075 177.0266 30 V 3.6757 8.3794 120.4355 66.0883 31.3563 177.6851 31 E 3.9603 8.0164 118.7836 58.8754 29.0265 178.3150 32 L 3.9547 7.8640 120.4053 58.1314 42.0463 178.8931 33 L 3.9219 8.5128 119.1481 57.9691 41.6570 178.9291 34 N 4.1727 8.0463 116.0267 56.6271 38.4371 177.3669 35 R 3.8751 7.8389 119.3004 59.5633 30.1877 178.6861 36 Q 4.0649 7.6487 116.8137 58.9002 28.7212 178.4968 37 V 3.5168 7.9093 119.5905 66.2713 31.4430 177.9827 38 I 3.6652 7.7286 119.0512 64.5210 37.0133 177.8891 39 Q 3.9945 7.9244 119.8063 59.4757 28.7229 178.8702 40 F 3.8600 9.1718 118.6471 60.7091 39.1075 177.4660 41 I 3.7174 8.3048 119.8526 64.8579 36.8689 177.9544 42 D 4.3015 8.3023 118.4987 57.0643 41.0088 177.8655 43 L 3.7660 7.8891 121.2270 58.0319 41.9622 179.1691 44 S 4.0429 8.2828 114.4187 61.5458 62.9637 176.3725 45 L 3.9101 7.7764 122.8691 57.4064 41.3478 179.6970 46 I 3.4774 7.8832 119.7657 64.4748 37.0279 178.3591 47 T 3.8265 7.9688 116.9757 66.8934 68.2694 176.7737 48 K 3.3583 7.6853 119.8908 58.7953 31.8099 179.4813 49 Q 4.0774 7.3646 117.8976 58.8857 28.8117 178.6667 50 A 3.8716 7.5816 121.4118 55.4774 18.2488 178.6417 51 H 3.9654 7.7180 115.1694 59.6002 29.8335 176.8034 52 W 4.6339 7.9734 119.1343 59.8099 29.1475 177.5733 53 N 4.9583 8.1484 114.6277 52.6042 38.2020 174.5787 54 M 5.0189 7.0156 116.8164 54.3372 33.3386 175.5025 55 R 4.3022 9.4869 118.1838 55.6875 34.7505 173.8233 56 G 4.0566 8.8069 104.1569 43.8897 0.0000 172.9377 57 A 4.0080 8.4994 121.3464 53.7730 18.8112 176.8885 58 N 4.1453 8.9978 117.6853 54.4911 37.0478 175.6518 59 F 4.1671 7.3242 117.5396 60.3374 39.0332 176.2010 60 I 2.7989 7.7121 116.3627 64.2685 38.0579 177.5813 61 A 3.8311 7.8369 120.4701 55.2453 18.0918 179.6962 62 V 3.2742 7.3708 115.9245 66.3020 31.4499 177.3714 63 H 3.8416 8.0359 116.9261 59.5665 29.7471 176.5746 64 E 3.9157 8.3274 120.3105 59.3330 29.2012 178.5766 65 M 3.5463 7.7041 118.3771 58.7334 32.1090 178.0766 66 L 3.4566 7.7266 119.0027 57.8359 41.8110 179.1309 67 D 4.1769 7.5158 118.2110 57.3066 40.6156 178.9877 68 G 3.6093 7.3560 105.7293 47.9655 0.0000 175.5517 69 F 3.8973 7.1576 119.6415 60.1293 38.9813 177.2411 70 R 3.9030 7.8919 118.3074 59.9788 29.7107 178.4337 71 T 3.8481 7.8477 114.7273 66.6994 68.4415 176.4055 72 A 4.1014 7.8993 122.6180 55.1701 18.3841 179.4268 73 L 4.2532 8.8306 117.8182 58.4624 41.7206 180.0095 74 I 3.7844 8.0468 119.4997 64.2611 36.9493 178.0639 75 C 4.0609 8.0885 119.6088 62.8491 31.3715 175.1135 76 H 4.0777 8.3924 117.7932 59.0920 28.3089 177.0235 77 L 3.5686 8.2930 121.4916 58.7406 41.8755 178.9402 78 A 3.9534 8.4239 120.1863 55.4819 18.3898 179.5572 79 T 3.7922 7.9284 114.1654 67.1160 68.5387 176.6854 80 M 3.9122 8.2440 120.3942 58.2714 31.9980 178.4639 81 A 3.9590 8.0206 120.9779 55.4239 18.4640 179.4819 82 E 3.8830 8.6088 117.2560 59.5767 29.6351 179.6260 83 R 3.8197 8.0225 118.4993 59.2093 30.0531 178.3843 84 A 3.9505 7.9879 120.6139 55.3093 18.4182 179.8648 85 V 3.6804 7.7670 116.6938 66.1767 31.3224 178.2619 86 Q 4.0534 7.9940 117.3386 58.5196 28.5315 177.6579 87 L 4.4246 7.4972 117.4794 54.5540 42.0464 177.8565 88 G 3.9128 8.2215 108.5317 45.2090 0.0000 174.9010 89 G 4.1002 7.6849 108.7720 44.5649 0.0000 173.0795 90 V 4.1506 8.0348 119.3689 60.5184 33.2790 175.9438 91 A 4.1427 8.6786 131.0761 52.2376 18.6595 176.1896 92 L 4.6796 9.4750 124.3340 53.2758 42.7984 177.3358 93 G 4.2164 8.3643 112.9829 44.5720 0.0000 172.7323 94 T 4.2728 7.8903 110.3216 60.8810 71.2300 174.6036 95 T 3.8495 8.5197 116.7405 65.5594 67.2815 176.3002 96 Q 3.9761 8.0244 119.3531 59.0219 28.6486 178.7501 97 V 3.5873 7.1357 116.1803 66.0191 31.7696 177.7288 98 I 3.8469 7.8527 119.4266 64.4370 36.7868 177.7263 99 N 4.2872 8.2148 116.7972 55.9976 40.1800 176.3966 100 S 4.6111 7.4554 115.7284 55.1663 59.9932 172.9484 101 K 4.6634 7.3310 133.1660 58.0790 34.0948 174.7644 102 T 3.9303 8.0928 113.8527 61.8558 67.5635 171.5057 103 P 4.6809 0.0000 0.0000 62.4771 31.7326 174.8710 104 L 4.5527 7.7119 119.7900 52.6938 42.7692 176.3705 105 K 3.8025 8.8145 125.0080 56.5412 32.4839 175.8398 106 S 4.0555 8.6896 119.6253 58.8367 62.8936 172.8940 107 Y 4.2587 8.6080 127.9310 55.7490 39.4784 172.8262 108 P 4.3449 0.0000 0.0000 63.4341 31.6135 175.9067 109 L 4.7766 8.5437 121.0959 54.5302 41.8770 176.5270 110 D 4.8783 8.0073 116.9656 52.7996 40.7121 175.8962 111 I 4.3480 7.3639 113.1302 60.4077 39.4679 174.8782 112 H 5.3904 8.3079 113.8986 55.8956 33.4194 173.6695 113 N 4.7616 8.2201 118.6074 53.3471 39.5046 175.2864 114 V 3.7450 8.8240 125.5761 66.6845 31.5154 178.2492 115 Q 4.1343 8.0899 116.8226 58.4989 28.5823 178.1262 116 D 4.2984 8.1415 120.3870 57.6476 40.8870 178.0851 117 H 4.4537 8.2235 117.3856 58.2401 28.7055 177.0997 118 L 4.0693 8.0335 121.8482 58.3207 41.8425 179.2721 119 K 3.9650 8.0939 117.9696 59.4351 32.1567 178.8240 120 E 3.9196 8.5997 119.8907 59.3965 29.5591 178.8115 121 L 4.2288 8.9441 119.5533 57.9546 41.7586 179.1241 122 A 4.0727 8.3291 120.8680 55.5121 18.3265 179.4048 123 D 4.3134 8.1932 116.9606 57.7391 40.8709 179.1075 124 R 3.9921 8.0365 118.1324 59.7089 30.0254 178.8270 125 Y 3.7812 8.8908 116.5345 60.8744 37.8323 178.3563 126 A 3.8972 8.2443 121.7610 55.1515 18.3580 179.7189 127 I 3.5955 7.6597 117.8745 64.5643 37.1725 178.8491 128 V 3.4478 7.4635 118.5486 65.7990 31.4280 177.5746 129 A 3.9192 8.6346 121.5914 55.4326 18.1037 179.3850 130 N 4.2392 8.5536 114.8662 56.4210 38.6299 176.9588 131 D 4.3447 8.2801 119.8808 57.6245 41.0481 178.9363 132 V 3.7877 8.0669 119.5612 64.8370 31.0854 178.2280 133 R 3.9818 7.6961 118.1399 58.8367 30.2021 178.4978 134 K 4.0842 7.9405 118.1611 59.3941 32.2768 178.9196 135 A 4.0257 8.1448 121.0801 55.3281 17.7825 179.6768 136 I 3.6989 7.4457 117.0959 64.7295 37.1015 178.6310 137 G 3.6027 7.7405 103.3757 46.5298 0.0000 174.4241 138 E 4.3005 7.4101 120.2150 56.3218 29.9437 175.7064 139 A 4.3155 7.1040 122.0803 51.4503 19.0368 177.5024 140 K 4.0567 8.5642 123.1187 58.6064 32.8627 177.4335 141 D 4.4802 7.9817 118.7740 53.5539 41.8073 175.6212 142 D 4.3841 8.8092 127.6414 57.9789 40.8746 178.5820 143 D 4.3802 8.2557 118.1687 58.1243 40.8766 179.2527 144 T 3.8054 7.6255 115.0987 66.4708 68.2984 176.4400 145 A 3.9496 8.1099 122.8571 55.1296 18.3056 179.0619 146 D 4.2075 8.0760 116.3392 57.6370 41.3651 178.1979 147 I 3.6544 7.7927 120.2850 64.8009 37.1953 178.3922 148 L 3.9638 8.0446 119.3710 57.8376 41.3880 179.7621 149 T 3.7708 8.1075 115.7938 66.6402 68.3267 176.4878 150 A 4.0183 8.2471 122.6815 55.1518 18.3617 179.5924 151 A 3.3247 7.8934 119.2096 55.0476 18.3539 179.8530 152 S 3.9568 8.5107 112.0820 61.4334 62.1682 176.0077 153 R 3.7886 8.3091 121.8258 59.7893 29.5854 178.1949 154 D 3.9553 7.6170 118.3347 57.1871 40.7274 178.7208 155 L 3.6553 7.5642 119.3881 57.8240 41.6042 179.3973 156 D 4.3254 8.3072 119.1879 56.9643 40.5886 178.8060 157 K 4.1152 7.4127 119.0807 59.4435 32.2293 178.9433 158 F 3.8957 8.0204 118.3883 60.2541 38.7388 177.1542 159 L 3.8514 8.2065 120.2866 58.0445 41.7897 178.6738 160 W 4.4402 8.1769 127.9343 60.7249 30.3812 177.8600 161 F 3.9847 8.1288 116.2695 60.5674 38.6850 177.2862 162 I 3.8523 8.3197 119.6083 64.7129 37.0907 178.2294 163 E 4.0290 8.7634 119.4122 59.7015 29.1286 179.4371 164 S 4.3667 8.2255 113.3744 60.2811 62.9966 175.2001 165 N 4.6797 7.8039 117.8804 52.3179 38.9296 174.8749 166 I 4.1759 6.9377 122.5291 60.3434 37.9230 175.8335 167 E 4.1470 9.3326 124.7953 56.7292 29.1654 176.7637 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 12 T 8.17 4.33 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 13 N 8.45 4.24 0.00 2.83 2.81 0.00 0.00 6.87 6.97 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 14 L 9.12 4.45 0.00 1.55 1.64 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.04 4.75 0.00 1.55 1.60 0.94 0.90 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 16 Y 8.57 4.34 0.00 2.96 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 17 T 7.04 3.84 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 1.06 0.00 0.00 18 R 8.15 3.84 0.00 1.75 1.93 0.00 3.25 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.51 0.00 19 N 7.62 4.31 0.00 2.63 2.66 0.00 0.00 7.12 8.36 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 20 D 8.38 4.62 0.00 2.82 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 21 V 7.06 4.19 2.06 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 0.83 0.00 0.00 0.94 0.00 0.00 22 S 8.69 4.00 0.00 4.08 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 9.06 4.43 0.00 2.79 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 24 S 8.09 4.05 0.00 3.88 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 25 E 8.26 3.92 0.00 2.14 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 0.00 2.30 2.40 0.00 26 K 8.45 3.88 0.00 1.96 1.91 0.00 1.73 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.44 1.79 7.81 27 K 8.16 3.80 0.00 1.98 1.88 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.59 7.81 28 A 7.89 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 29 T 8.07 3.77 4.34 0.00 0.00 0.00 0.00 0.00 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 30 V 8.38 3.68 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.98 0.00 0.00 31 E 8.02 3.96 0.00 2.20 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 0.00 2.30 2.45 0.00 32 L 7.86 3.95 0.00 1.80 1.81 0.97 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.51 3.92 0.00 1.64 1.63 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.05 4.17 0.00 2.87 2.90 0.00 0.00 6.77 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 35 R 7.84 3.88 0.00 2.09 2.08 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 36 Q 7.65 4.06 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.49 0.00 0.00 0.00 0.00 0.00 2.55 2.45 0.00 37 V 7.91 3.52 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 1.05 0.00 0.00 0.91 0.00 0.00 38 I 7.73 3.67 2.05 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 1.42 0.84 0.93 0.00 0.00 39 Q 7.92 3.99 0.00 2.31 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.82 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 40 F 9.17 3.86 0.00 3.23 3.12 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 41 I 8.30 3.72 2.03 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 1.45 1.13 0.94 0.00 0.00 42 D 8.30 4.30 0.00 2.89 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 43 L 7.89 3.77 0.00 1.65 1.36 -0.22 0.24 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 44 S 8.28 4.04 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 45 L 7.78 3.91 0.00 1.87 1.76 0.94 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.88 3.48 1.96 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 1.50 1.05 0.61 0.00 0.00 47 T 7.97 3.83 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 1.23 0.00 0.00 48 K 7.69 3.36 0.00 1.32 0.74 0.00 0.61 0.00 0.00 0.76 0.00 0.00 2.77 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.00 1.18 7.81 49 Q 7.36 4.08 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.58 0.00 50 A 7.58 3.87 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 51 H 7.72 3.97 0.00 2.90 3.11 0.00 5.96 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 W 7.97 4.63 0.00 3.51 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 53 N 8.15 4.96 0.00 3.02 2.95 0.00 0.00 6.77 8.12 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 54 M 7.02 5.02 0.00 2.16 2.22 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 2.94 2.96 0.00 55 R 9.49 4.30 0.00 1.78 1.69 0.00 3.06 0.00 0.00 3.08 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.48 0.00 56 G 8.81 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 57 A 8.50 4.01 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 58 N 9.00 4.15 0.00 2.92 2.83 0.00 0.00 6.77 7.71 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 59 F 7.32 4.17 0.00 3.16 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 60 I 7.71 2.80 1.86 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.85 0.86 0.00 0.00 61 A 7.84 3.83 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.37 3.27 2.18 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 0.96 0.00 0.00 0.94 0.00 0.00 63 H 8.04 3.84 0.00 2.25 2.80 0.00 5.81 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.33 3.92 0.00 1.84 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 2.26 2.33 0.00 65 M 7.70 3.55 0.00 1.90 1.84 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.58 0.00 66 L 7.73 3.46 0.00 1.59 1.49 0.92 0.88 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 67 D 7.52 4.18 0.00 2.61 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 68 G 7.36 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 F 7.16 3.90 0.00 3.03 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 70 R 7.89 3.90 0.00 1.78 2.00 0.00 3.02 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 71 T 7.85 3.85 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 1.23 0.00 0.00 72 A 7.90 4.10 1.71 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 0.00 0.00 73 L 8.83 4.25 0.00 2.14 1.88 1.14 0.84 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 74 I 8.05 3.78 2.04 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 1.44 0.88 0.93 0.00 0.00 75 C 8.09 4.06 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 76 H 8.39 4.08 0.00 3.46 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.29 3.57 0.00 1.93 1.90 1.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.42 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 T 7.93 3.79 4.37 0.00 0.00 0.00 0.00 0.00 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 80 M 8.24 3.91 0.00 1.89 2.07 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.38 0.00 81 A 8.02 3.96 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.61 3.88 0.00 2.13 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 2.31 2.47 0.00 83 R 8.02 3.82 0.00 1.90 2.05 0.00 3.11 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 84 A 7.99 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.77 3.68 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.94 0.00 0.00 86 Q 7.99 4.05 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.06 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 87 L 7.50 4.42 0.00 1.77 1.66 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.22 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 0.00 0.00 0.00 89 G 7.68 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 0.00 0.00 0.00 0.00 90 V 8.03 4.15 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 0.85 0.00 0.00 0.93 0.00 0.00 91 A 8.68 4.14 1.24 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 0.00 0.00 92 L 9.48 4.68 0.00 1.66 1.61 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.36 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.89 4.27 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 1.22 0.00 0.00 95 T 8.52 3.85 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 96 Q 8.02 3.98 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 97 V 7.14 3.59 2.23 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 0.84 0.00 0.00 0.94 0.00 0.00 98 I 7.85 3.85 2.02 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 1.64 0.77 0.93 0.00 0.00 99 N 8.21 4.29 0.00 2.75 3.02 0.00 0.00 7.27 8.04 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 0.00 100 S 7.46 4.61 0.00 4.09 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 7.33 4.66 0.00 2.05 1.85 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.18 1.15 7.81 102 T 8.09 3.93 4.28 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 1.30 0.00 0.00 103 P 0.00 4.68 0.00 2.21 2.12 0.00 3.80 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 1.93 1.98 0.00 104 L 7.71 4.55 0.00 1.82 1.66 0.95 0.72 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 0.00 105 K 8.81 3.80 0.00 1.72 1.77 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.46 7.81 106 S 8.69 4.06 0.00 3.90 3.83 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 0.00 107 Y 8.61 4.26 0.00 3.05 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 0.00 108 P 0.00 4.34 0.00 2.07 1.88 0.00 2.68 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.55 0.00 109 L 8.54 4.78 0.00 1.69 1.77 0.98 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.01 4.88 0.00 2.74 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 0.00 111 I 7.36 4.35 1.74 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.17 0.79 0.00 0.00 112 H 8.31 5.39 0.00 3.18 3.34 0.00 5.90 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.22 4.76 0.00 2.83 3.02 0.00 0.00 6.84 7.71 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 0.00 114 V 8.82 3.75 2.23 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 1.07 0.00 0.00 1.15 0.00 0.00 115 Q 8.09 4.13 0.00 2.13 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 116 D 8.14 4.30 0.00 2.96 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 0.00 117 H 8.22 4.45 0.00 3.27 3.49 0.00 5.92 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.03 4.07 0.00 2.10 1.78 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.09 3.96 0.00 2.06 1.86 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.66 7.81 120 E 8.60 3.92 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.30 0.00 121 L 8.94 4.23 0.00 1.95 1.79 0.96 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.33 4.07 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.19 4.31 0.00 3.04 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 0.00 124 R 8.04 3.99 0.00 1.98 2.02 0.00 3.40 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 125 Y 8.89 3.78 0.00 3.08 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 0.00 126 A 8.24 3.90 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 I 7.66 3.60 2.03 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 1.41 0.84 0.90 0.00 0.00 128 V 7.46 3.45 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.71 0.00 0.00 129 A 8.63 3.92 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 0.00 130 N 8.55 4.24 0.00 2.81 2.87 0.00 0.00 6.74 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 0.00 131 D 8.28 4.34 0.00 2.81 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 0.00 132 V 8.07 3.79 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 0.87 0.00 0.00 1.02 0.00 0.00 133 R 7.70 3.98 0.00 1.94 2.14 0.00 3.23 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 134 K 7.94 4.08 0.00 1.88 1.82 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.74 1.59 7.81 135 A 8.14 4.03 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 0.00 136 I 7.45 3.70 1.95 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.11 0.89 0.00 0.00 137 G 7.74 3.60 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 0.00 0.00 0.00 138 E 7.41 4.30 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 139 A 7.10 4.32 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 0.00 140 K 8.56 4.06 0.00 1.93 1.92 0.00 1.89 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.41 7.81 141 D 7.98 4.48 0.00 2.72 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 0.00 142 D 8.81 4.38 0.00 2.70 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 0.00 143 D 8.26 4.38 0.00 2.69 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 0.00 144 T 7.63 3.81 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 1.17 0.00 0.00 145 A 8.11 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.08 4.21 0.00 2.80 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 0.00 147 I 7.79 3.65 2.00 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 1.49 0.78 0.84 0.00 0.00 148 L 8.04 3.96 0.00 1.83 1.68 0.92 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.11 3.77 4.36 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 1.18 0.00 0.00 150 A 8.25 4.02 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 0.00 151 A 7.89 3.32 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 0.00 152 S 8.51 3.96 0.00 3.83 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 R 8.31 3.79 0.00 1.99 1.96 0.00 3.10 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 154 D 7.62 3.96 0.00 2.58 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 0.00 0.00 0.00 155 L 7.56 3.66 0.00 1.71 1.61 0.91 0.56 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 0.00 156 D 8.31 4.33 0.00 2.61 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 0.00 157 K 7.41 4.12 0.00 1.80 1.77 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.73 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.15 1.45 7.81 158 F 8.02 3.90 0.00 2.96 1.85 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 0.00 159 L 8.21 3.85 0.00 1.90 1.93 0.99 1.08 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 0.00 160 W 8.18 4.44 0.00 3.44 3.54 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 0.00 161 F 8.13 3.98 0.00 3.15 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 0.00 162 I 8.32 3.85 1.92 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.63 0.88 0.00 0.00 163 E 8.76 4.03 0.00 2.28 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 0.00 2.38 2.53 0.00 164 S 8.23 4.37 0.00 3.71 3.82 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 0.00 165 N 7.80 4.68 0.00 2.77 2.79 0.00 0.00 6.99 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 6.94 4.18 2.05 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 1.31 0.66 0.98 0.00 0.00 167 E 9.33 4.15 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00