NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9320 8.3549 109.7402 45.3813 0.0000 177.0464 2 L 4.2856 8.7341 120.1508 50.9251 43.6401 174.7145 3 S 4.5352 9.5350 118.0481 57.6963 66.2720 174.9170 4 D 4.6469 8.6733 121.4204 57.5711 40.5869 179.2130 5 G 3.7042 8.1253 105.6104 47.9652 0.0000 175.3414 6 E 3.9186 8.3005 121.1835 58.8608 29.4583 179.4801 7 W 4.4061 8.1370 118.9234 59.9771 29.0651 178.5232 8 Q 4.1681 8.4239 117.9586 59.0547 28.1552 178.9349 9 L 4.0402 7.9904 119.9118 57.6713 41.6045 179.7716 10 V 3.7004 7.9792 118.0914 66.2817 31.6377 178.2614 11 L 4.2320 8.6942 118.9289 57.5300 41.1667 179.3314 12 N 4.4203 8.3309 116.5464 56.3071 38.7880 177.4283 13 V 3.7907 7.9811 120.6321 64.6570 31.4922 178.2392 14 W 4.0500 8.7361 129.2006 59.8273 30.3435 177.9593 15 G 3.8420 8.3500 105.9858 47.8694 0.0000 175.7583 16 K 3.8606 7.7529 119.9008 58.9868 32.1716 179.3779 17 V 2.8005 6.8627 118.0509 65.7187 31.1614 177.8232 18 E 3.8172 7.8916 116.8598 58.8947 29.3233 178.4618 19 A 4.2184 7.3462 118.8799 52.7120 20.1823 176.9678 20 D 4.5319 7.8149 113.6399 52.3028 43.7047 176.2359 21 V 3.4918 7.5660 123.9419 66.1372 32.1476 176.7846 22 A 4.0606 7.9802 120.1371 55.0051 18.3561 179.7209 23 G 3.4692 8.2175 104.1189 48.2243 0.0000 175.6711 24 H 4.1127 8.2569 118.9576 58.3486 28.6624 178.0615 25 G 3.6020 8.2863 107.7535 47.8025 0.0000 175.3873 26 Q 3.8378 8.0688 122.4237 58.9005 29.0285 178.1023 27 E 3.8670 7.9821 120.0721 59.0591 29.5684 178.9118 28 V 3.5025 7.8249 118.4138 65.9461 31.5703 178.1052 29 L 3.4971 7.7158 118.7005 57.5481 41.3602 179.5443 30 I 3.6794 7.5238 119.7456 64.3095 37.0305 178.6482 31 R 3.8436 8.1055 119.1842 59.0962 29.8517 178.6718 32 L 3.8903 8.0229 120.3057 58.4168 41.9535 179.0032 33 F 4.5334 7.9713 117.9052 60.7115 38.5922 177.8812 34 K 4.1603 8.1898 117.4141 59.0620 32.0371 179.2693 35 G 3.7879 8.0521 105.1105 46.2308 0.0000 173.7331 36 H 4.7004 8.1899 117.8051 51.9394 29.8647 171.7522 37 P 4.5977 0.0000 0.0000 64.6776 31.3263 177.4806 38 E 4.2727 8.2897 116.2022 59.6465 29.3482 179.1802 39 T 3.8231 8.2342 110.8332 64.2932 68.7572 176.1700 40 L 3.6139 8.0752 123.5285 57.9856 41.7155 178.6561 41 E 4.0874 7.8735 117.9427 59.0361 29.4445 178.7266 42 K 4.4498 8.2326 116.6142 56.7058 32.8440 177.5735 43 F 4.4380 8.1090 119.3748 55.3793 39.5730 175.6312 44 D 4.3375 8.3012 124.4720 57.2784 40.6459 178.6666 45 K 3.9208 7.9101 116.9223 58.7539 32.3339 177.4684 46 F 5.1071 7.9502 115.7568 57.1973 39.2838 177.0663 47 K 4.2275 8.0111 119.9803 58.1078 31.7700 177.1975 48 H 4.6227 7.9991 113.3616 55.2973 29.2919 174.9966 49 L 4.2449 7.5463 121.5235 54.7234 40.8672 176.4919 50 K 4.4612 9.0821 123.3600 55.8560 32.7171 176.7725 51 S 4.5594 7.2598 113.2356 56.2548 66.5500 175.2036 52 E 3.9133 8.5927 122.8080 59.6183 29.1940 178.5855 53 D 4.3961 8.0447 118.3941 57.4242 40.7761 178.4701 54 E 3.9648 8.1063 118.8439 59.7226 29.2283 179.3869 55 M 3.9739 7.7972 117.7120 58.2529 32.0845 178.7487 56 K 4.0432 8.4808 117.8978 58.8551 32.2631 178.5411 57 A 4.4082 7.4265 119.4067 52.0647 19.0663 177.3003 58 S 4.1560 7.3579 113.8056 58.0919 62.9421 174.6728 59 E 4.0119 8.9746 128.2565 59.6805 29.3188 178.9650 60 D 4.5203 8.1575 118.5078 57.2068 40.9542 178.4456 61 L 3.3981 8.0646 121.0289 57.8739 42.0587 179.0125 62 K 3.9225 7.7518 119.7336 59.2819 32.0389 178.9193 63 K 3.9925 8.2362 118.8954 59.8032 31.9327 178.8184 64 H 4.3507 8.6672 118.6554 59.2419 29.8256 177.5430 65 G 3.5578 8.3352 107.6675 47.5998 0.0000 175.2839 66 N 4.3094 8.1484 119.2760 56.9033 39.0679 177.0671 67 T 3.8706 8.0962 117.3231 66.6463 68.5537 175.8873 68 N 4.2700 8.3013 118.9315 57.0150 38.9859 177.0248 69 L 4.2369 8.2166 120.2040 57.7462 41.7877 179.5886 70 T 3.9284 8.2927 116.0800 66.7521 68.5216 176.4217 71 A 4.0237 8.0298 122.5349 54.8751 18.3498 179.3991 72 L 3.7202 8.1038 119.0771 58.1854 42.1469 179.3613 73 G 3.5933 8.4809 106.0323 47.8120 0.0000 175.8451 74 G 3.6177 7.8052 106.8757 47.4324 0.0000 175.6996 75 I 3.8321 7.5402 121.8451 64.2547 37.0917 178.5617 76 L 3.9521 7.9375 120.1867 57.6740 41.1699 179.7131 77 K 3.8285 7.6877 117.2427 58.8260 32.0113 178.5941 78 K 3.9886 7.5323 116.2107 55.1627 32.7878 178.7485 79 K 2.0000 8.9431 120.2068 56.0814 31.7964 175.8162 80 G 4.0949 8.8393 115.2626 47.1205 0.0000 173.7716 81 H 4.5003 7.1461 117.2901 54.9546 27.1368 174.8846 82 H 5.0521 7.4731 112.3899 55.0017 29.6659 176.3932 83 E 4.0845 8.4187 123.1572 59.9988 29.0086 178.5640 84 A 4.0399 7.8691 119.6592 54.9672 17.2855 178.9658 85 E 4.1033 8.0668 116.7329 59.2442 29.6989 179.0196 86 L 4.1278 8.5481 120.7745 58.4096 42.1866 178.5878 87 T 3.8804 8.0254 115.9133 66.6139 68.5379 174.4053 88 P 4.2932 0.0000 0.0000 65.9048 31.0604 178.1609 89 L 3.9997 7.5326 118.3337 58.0646 42.0305 178.8175 90 A 4.1588 8.2780 120.8371 55.1001 18.2175 179.7083 91 Q 3.9270 8.2820 117.0299 59.2509 28.8303 179.1456 92 S 4.0622 8.0618 115.1368 61.7112 63.0134 176.1751 93 H 4.2801 8.6856 119.6270 58.0572 28.1916 177.7548 94 A 2.5800 7.6817 122.2899 54.6492 18.2897 179.3455 95 T 3.8856 7.0907 112.3949 65.8787 69.0272 176.6557 96 K 3.9367 7.4443 119.7513 59.6281 32.5360 177.7363 97 H 4.2670 7.9542 114.5010 56.1585 29.4280 175.5033 98 K 3.4667 7.4801 116.9171 57.1804 28.7558 176.4264 99 I 4.3228 7.7482 119.2786 59.0216 37.9528 175.1055 100 P 4.6393 0.0000 0.0000 62.0829 32.1963 177.6268 101 V 3.6792 8.3661 118.6364 65.9729 31.3409 178.0767 102 K 3.8021 8.0058 118.1732 60.3244 32.0059 178.5758 103 Y 4.2840 7.9450 117.7456 60.8579 37.8317 177.9245 104 L 4.1584 8.1304 119.4919 57.9132 41.7181 179.3682 105 E 4.0166 8.3191 118.7144 59.3849 29.4505 179.3017 106 F 4.6601 7.8679 117.8830 60.8007 38.8755 177.6343 107 I 3.8233 8.3118 118.4587 63.9855 37.7951 177.9392 108 S 4.2032 8.3930 116.2288 61.8668 62.7488 176.5727 109 E 4.0595 8.4297 120.8170 59.3948 29.1249 179.3591 110 A 4.3767 7.9919 122.0045 54.6016 18.4628 179.5279 111 I 3.6588 8.0655 118.6207 64.7891 37.2599 178.5756 112 I 3.8291 7.9143 120.2724 64.6990 36.8648 178.5682 113 Q 4.0532 8.7236 119.1046 58.9440 28.4744 179.0769 114 V 3.5330 8.1625 119.6744 65.7863 31.4905 177.9847 115 L 3.7518 7.7624 118.7439 57.7469 41.1378 179.3535 116 Q 4.2278 7.8560 117.9804 59.3339 29.1504 177.9191 117 S 4.2048 8.1218 113.1585 61.3687 62.5638 175.8216 118 K 4.0860 8.1097 119.9803 58.0785 33.3181 177.0327 119 H 5.0038 8.4766 116.3809 53.4298 29.8503 172.5351 120 P 4.3853 0.0000 0.0000 66.0445 31.5086 179.3087 121 G 3.6930 8.2367 106.4610 47.7376 0.0000 173.5723 122 D 4.8303 8.0417 116.7457 53.9254 41.6411 176.3267 123 F 5.1561 8.2691 120.8081 56.9429 39.4734 174.7074 124 G 3.8421 7.6318 108.9591 44.0470 0.0000 171.9056 125 A 3.8805 8.4011 120.6965 55.4603 18.3170 179.7557 126 D 4.1975 7.9491 116.5140 57.4058 40.9351 178.6617 127 A 4.0274 7.8609 120.7911 55.1132 18.3743 179.3819 128 Q 3.3095 7.9458 116.9908 58.8362 28.7591 179.3922 129 G 3.5501 7.8587 106.2466 47.8961 0.0000 175.5724 130 A 3.8917 7.9960 123.6242 54.8787 18.3844 179.4503 131 M 4.0383 8.4712 117.1336 58.7301 32.3449 178.6073 132 S 4.1891 8.3115 115.5517 61.5715 62.9320 176.8317 133 K 3.9138 8.0567 120.9021 59.3811 31.7862 179.2584 134 A 3.8230 8.0038 121.0908 55.0769 18.1437 179.7425 135 L 4.0832 8.1017 117.5716 57.7856 41.6956 179.1930 136 E 3.9426 8.3618 119.3946 59.0487 29.5763 178.6369 137 L 3.9343 8.2249 120.5923 58.0785 42.2452 178.3638 138 F 4.0950 8.3263 120.5952 61.6719 39.1472 177.3895 139 R 3.5319 8.3065 117.4945 59.2014 29.8760 178.8364 140 N 4.2341 8.4134 116.6223 56.5319 38.5569 177.2962 141 D 4.3396 8.1164 120.1170 57.2611 40.8550 178.8380 142 M 3.6307 7.6568 119.2351 57.9566 31.8088 178.4911 143 A 3.7646 7.7950 120.8614 55.1095 18.6549 179.5832 144 A 3.9150 7.9717 119.2430 55.0838 18.4439 179.8164 145 K 3.9198 7.9625 118.1709 59.7444 32.2739 178.2642 146 Y 4.4775 8.4367 117.5317 61.3625 37.8936 178.4854 147 K 3.8208 8.3381 120.1307 59.9437 32.0371 177.9887 148 E 3.9622 7.8228 117.1726 59.5615 29.5681 178.5222 149 L 4.2810 7.7837 117.2772 55.7404 41.7671 178.0066 150 G 3.8932 8.0691 106.6728 45.3550 0.0000 172.4799 151 F 4.5198 7.8784 121.6755 56.2534 40.1451 175.4031 152 Q 3.9146 7.8978 129.5999 54.7787 28.2044 175.6090 153 G 3.6064 8.1566 113.5048 45.6852 0.0000 172.0514 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 3.93 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 2 L 8.73 4.29 0.00 0.65 0.80 0.57 -0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.53 4.54 0.00 4.03 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 4 D 8.67 4.65 0.00 2.77 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 5 G 8.13 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 8.30 3.92 0.00 2.03 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 2.27 0.00 7 W 8.14 4.41 0.00 3.57 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 8 Q 8.42 4.17 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.61 0.00 9 L 7.99 4.04 0.00 1.91 1.76 0.93 0.85 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 7.98 3.70 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.88 0.00 0.00 11 L 8.69 4.23 0.00 1.79 1.80 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.33 4.42 0.00 2.93 2.93 0.00 0.00 7.03 7.45 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 13 V 7.98 3.79 2.28 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 1.05 0.00 0.00 0.90 0.00 0.00 14 W 8.74 4.05 0.00 3.60 3.20 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 15 G 8.35 3.84 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 0.00 0.00 0.00 16 K 7.75 3.86 0.00 1.41 1.37 0.00 1.65 0.00 0.00 1.52 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.32 7.81 17 V 6.86 2.80 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 0.26 0.00 0.00 -0.37 0.00 0.00 18 E 7.89 3.82 0.00 2.02 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 2.43 2.51 0.00 19 A 7.35 4.22 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 20 D 7.81 4.53 0.00 2.67 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.57 3.49 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 1.08 0.00 0.00 0.93 0.00 0.00 22 A 7.98 4.06 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.22 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.26 4.11 0.00 3.25 3.22 0.00 5.83 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 8.29 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 26 Q 8.07 3.84 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 27 E 7.98 3.87 0.00 2.01 1.93 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 2.22 2.23 0.00 28 V 7.82 3.50 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 29 L 7.72 3.50 0.00 1.47 1.06 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 30 I 7.52 3.68 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 0.62 0.87 0.00 0.00 31 R 8.11 3.84 0.00 1.97 1.93 0.00 3.25 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 32 L 8.02 3.89 0.00 1.64 1.47 0.98 0.89 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 F 7.97 4.53 0.00 2.99 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 34 K 8.19 4.16 0.00 1.76 1.85 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.73 1.59 7.81 35 G 8.05 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 0.00 0.00 0.00 36 H 8.19 4.70 0.00 2.93 2.65 0.00 5.64 0.00 0.00 0.00 0.00 6.84 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 4.60 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 4.27 0.00 2.31 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 2.36 2.60 0.00 39 T 8.23 3.82 4.38 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 0.65 0.00 0.00 40 L 8.08 3.61 0.00 1.52 1.73 -0.11 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.87 4.09 0.00 2.19 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 2.39 2.40 0.00 42 K 8.23 4.45 0.00 1.66 1.70 0.00 1.91 0.00 0.00 1.77 0.00 0.00 3.21 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.73 1.93 7.81 43 F 8.11 4.44 0.00 3.19 2.61 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 44 D 8.30 4.34 0.00 2.63 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 7.91 3.92 0.00 1.20 1.36 0.00 1.52 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.39 7.81 46 F 7.95 5.11 0.00 2.90 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 47 K 8.01 4.23 0.00 1.94 1.88 0.00 1.86 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.52 7.81 48 H 8.00 4.62 0.00 3.29 3.43 0.00 5.52 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 7.55 4.24 0.00 1.51 1.55 0.67 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.08 4.46 0.00 1.67 1.79 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.43 7.81 51 S 7.26 4.56 0.00 3.97 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 52 E 8.59 3.91 0.00 2.04 1.97 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 2.35 2.38 0.00 53 D 8.04 4.40 0.00 2.71 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 8.11 3.96 0.00 2.20 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 2.32 2.34 0.00 55 M 7.80 3.97 0.00 1.94 2.19 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.48 0.00 56 K 8.48 4.04 0.00 1.77 1.84 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.62 7.81 57 A 7.43 4.41 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 58 S 7.36 4.16 0.00 3.85 3.76 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 59 E 8.97 4.01 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 60 D 8.16 4.52 0.00 2.99 3.14 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 0.00 0.00 0.00 61 L 8.06 3.40 0.00 1.10 1.53 0.63 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.75 3.92 0.00 1.78 1.91 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.45 7.81 63 K 8.24 3.99 0.00 2.08 1.92 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.60 7.81 64 H 8.67 4.35 0.00 3.58 3.76 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 8.34 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 8.15 4.31 0.00 2.88 3.03 0.00 0.00 7.15 7.11 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 67 T 8.10 3.87 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 1.28 0.00 0.00 68 N 8.30 4.27 0.00 2.76 2.98 0.00 0.00 7.27 7.26 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 69 L 8.22 4.24 0.00 1.80 1.90 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.29 3.93 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 1.25 0.00 0.00 71 A 8.03 4.02 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 72 L 8.10 3.72 0.00 1.60 1.62 0.10 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.48 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 7.81 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.54 3.83 1.86 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.06 0.89 0.00 0.00 76 L 7.94 3.95 0.00 1.15 1.54 -0.35 0.96 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 77 K 7.69 3.83 0.00 1.73 1.81 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.47 1.55 7.81 78 K 7.53 3.99 0.00 1.81 1.93 0.00 1.80 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.58 1.85 7.81 79 K 8.94 2.00 0.00 1.19 0.74 0.00 1.40 0.00 0.00 1.48 0.00 0.00 2.64 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.94 7.81 80 G 8.84 4.09 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 0.00 0.00 0.00 81 H 7.15 4.50 0.00 3.13 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.47 5.05 0.00 3.21 3.40 0.00 5.49 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.42 4.08 0.00 2.04 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 2.40 2.34 0.00 84 A 7.87 4.04 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 85 E 8.07 4.10 0.00 2.21 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 2.38 2.42 0.00 86 L 8.55 4.13 0.00 1.73 1.67 0.70 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.03 3.88 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 1.26 0.00 0.00 88 P 0.00 4.29 0.00 2.29 2.34 0.00 3.83 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 2.10 2.05 0.00 89 L 7.53 4.00 0.00 1.83 1.90 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.28 4.16 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 91 Q 8.28 3.93 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 92 S 8.06 4.06 0.00 4.02 4.13 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 93 H 8.69 4.28 0.00 3.55 3.58 0.00 5.81 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 7.68 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.09 3.89 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 96 K 7.44 3.94 0.00 1.54 1.53 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.24 1.34 7.81 97 H 7.95 4.27 0.00 2.99 3.14 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.48 3.47 0.00 1.88 1.92 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.32 1.49 7.81 99 I 7.75 4.32 2.10 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 1.40 0.97 1.20 0.00 0.00 100 P 0.00 4.64 0.00 2.01 2.00 0.00 3.28 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.50 0.00 101 V 8.37 3.68 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 1.10 0.00 0.00 0.99 0.00 0.00 102 K 8.01 3.80 0.00 1.69 1.93 0.00 1.45 0.00 0.00 1.57 0.00 0.00 3.19 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.30 1.53 7.81 103 Y 7.94 4.28 0.00 3.30 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 0.00 104 L 8.13 4.16 0.00 1.89 1.83 0.77 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.32 4.02 0.00 1.98 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 2.32 2.45 0.00 106 F 7.87 4.66 0.00 3.21 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 0.00 107 I 8.31 3.82 2.02 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 1.13 0.00 0.00 108 S 8.39 4.20 0.00 4.17 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.43 4.06 0.00 2.31 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 2.43 2.44 0.00 110 A 7.99 4.38 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 0.00 111 I 8.07 3.66 2.12 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.05 1.09 0.00 0.00 112 I 7.91 3.83 2.12 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 1.76 0.90 1.19 0.00 0.00 113 Q 8.72 4.05 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 114 V 8.16 3.53 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 0.97 0.00 0.00 0.89 0.00 0.00 115 L 7.76 3.75 0.00 1.04 0.53 0.76 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.86 4.23 0.00 2.45 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.96 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 117 S 8.12 4.20 0.00 3.88 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 0.00 118 K 8.11 4.09 0.00 1.41 1.41 0.00 1.67 0.00 0.00 1.35 0.00 0.00 2.57 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.28 1.40 7.81 119 H 8.48 5.00 0.00 3.14 3.17 0.00 5.64 0.00 0.00 0.00 0.00 6.76 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 4.39 0.00 2.25 2.38 0.00 3.78 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 121 G 8.24 3.69 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 0.00 122 D 8.04 4.83 0.00 2.76 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 0.00 123 F 8.27 5.16 0.00 2.93 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 0.00 124 G 7.63 3.84 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 0.00 0.00 0.00 125 A 8.40 3.88 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 7.95 4.20 0.00 2.67 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 7.86 4.03 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 0.00 128 Q 7.95 3.31 0.00 2.02 1.87 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 1.24 1.56 0.00 129 G 7.86 3.55 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 0.00 130 A 8.00 3.89 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 0.00 131 M 8.47 4.04 0.00 2.46 2.37 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.89 0.00 132 S 8.31 4.19 0.00 4.05 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 0.00 133 K 8.06 3.91 0.00 1.78 1.69 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.54 7.81 134 A 8.00 3.82 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 0.00 135 L 8.10 4.08 0.00 1.78 1.81 1.00 0.48 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 8.36 3.94 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.32 0.00 137 L 8.22 3.93 0.00 1.90 1.94 0.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.33 4.10 0.00 3.16 3.28 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 0.00 139 R 8.31 3.53 0.00 1.97 1.87 0.00 3.21 0.00 0.00 3.40 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.05 0.00 140 N 8.41 4.23 0.00 2.91 2.83 0.00 0.00 7.08 7.62 0.00 0.00 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 8.12 4.34 0.00 2.62 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 0.00 142 M 7.66 3.63 0.00 1.22 1.61 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 1.53 1.81 0.00 143 A 7.80 3.76 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 0.00 144 A 7.97 3.91 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 0.00 145 K 7.96 3.92 0.00 2.05 1.93 0.00 1.57 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.57 7.81 146 Y 8.44 4.48 0.00 3.21 3.23 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 0.00 147 K 8.34 3.82 0.00 1.86 2.07 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.49 7.81 148 E 7.82 3.96 0.00 2.20 2.29 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 2.35 2.39 0.00 149 L 7.78 4.28 0.00 1.96 1.74 1.04 1.04 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 0.00 150 G 8.07 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 0.00 0.00 0.00 151 F 7.88 4.52 0.00 2.78 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 0.00 152 Q 7.90 3.91 0.00 1.85 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.18 2.13 0.00 153 G 8.16 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