NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1776 8.3001 120.3211 54.9434 33.5102 176.0586 2 A 2.8279 7.7793 122.5456 51.4388 18.2518 176.6611 3 K 3.5798 5.6600 122.2167 59.4607 33.8831 175.9153 4 V 4.7775 6.2138 117.5710 60.9748 34.0604 174.4829 5 Q 4.8367 9.3357 127.7027 54.3254 32.3929 174.0531 6 V 4.6715 8.7427 125.8459 62.8144 32.0345 175.0127 7 N 4.8730 10.3941 125.0203 55.0522 40.0781 174.6816 8 N 4.9573 7.9279 114.3853 52.6159 42.5153 173.3633 9 V 4.8790 8.4640 122.1385 61.0814 35.0055 174.7283 10 V 4.5080 7.9763 124.3147 61.0265 34.7214 174.4623 11 V 4.0761 8.5542 128.0809 62.6039 31.9553 175.0956 12 L 4.5395 8.2281 127.6188 52.5187 44.4285 175.2056 13 D 4.2401 8.3117 116.6195 55.7094 39.5989 172.9091 14 N 4.8554 7.7757 114.3108 50.7970 41.7309 171.7103 15 P 4.8268 0.0000 0.0000 62.7676 33.4137 174.3071 16 S 4.5611 9.0574 113.2363 56.5965 66.7794 172.0585 17 P 4.3800 0.0000 0.0000 62.7423 31.3715 177.3020 18 F 4.0006 9.2596 126.2666 61.5938 39.3902 175.9355 19 Y 3.9264 7.9983 116.4035 59.9375 38.1070 175.7894 20 N 4.3486 7.4689 117.0661 52.8605 39.1951 172.7645 21 P 4.5167 0.0000 0.0000 62.2742 32.7196 176.0373 22 F 3.8786 8.5788 120.8249 58.5397 40.4748 174.4352 23 Q 4.8402 7.9352 119.4662 54.2339 32.9181 173.8641 24 F 5.1943 8.7042 122.1536 55.4057 42.0710 175.1110 25 E 4.4912 9.0339 127.7449 54.8641 27.7662 175.0399 26 I 4.1716 7.6716 124.0985 61.4206 38.4496 176.0392 27 T 5.1746 9.2934 122.9252 61.8919 71.6981 173.0458 28 F 5.4080 9.2236 121.2760 55.1861 42.2204 173.3556 29 E 5.2398 9.9723 119.3838 54.7958 33.4478 173.8425 30 C 5.2635 9.2495 119.8911 57.0473 32.8846 174.7708 31 I 3.8497 8.3648 117.3349 63.6580 37.5846 176.3746 32 E 4.4929 7.8995 120.4109 53.7742 31.7115 175.8968 33 D 4.8859 8.1340 118.1734 55.2602 41.0791 174.9451 34 L 4.9503 8.1948 119.3639 54.7010 45.7744 175.6931 35 S 4.4566 8.6631 119.3775 57.1431 64.8277 172.1071 36 E 4.1861 8.8187 124.3082 56.9079 28.0630 175.4759 37 D 4.6003 8.2677 120.8796 54.0531 45.4662 175.3673 38 L 4.6235 7.9584 117.3112 54.5285 43.7347 176.7179 39 E 5.1853 7.8676 113.9974 56.2394 31.7506 174.0798 40 W 5.2258 9.1955 126.0732 54.6932 31.7114 175.1651 41 K 5.4205 9.4856 123.3929 53.6773 35.5925 175.2375 42 I 4.8133 8.5633 125.8183 60.3518 38.6542 174.5651 43 I 4.7317 8.6813 128.9095 59.8082 39.5894 174.6845 44 Y 4.7252 8.9655 128.4393 56.0960 39.5154 174.3439 45 V 4.1417 8.3641 130.1343 60.9153 30.1757 175.8085 46 G 3.8867 7.8090 110.8418 45.1509 0.0000 172.5306 47 S 5.3164 8.2089 111.3685 61.8818 63.9377 176.2953 48 A 3.5375 6.7844 123.4802 54.3617 20.2104 178.1821 49 E 4.3769 9.1183 114.0599 57.2914 30.9353 176.7329 50 S 4.5068 7.6494 112.5965 56.3006 64.9824 173.7381 51 E 4.9612 8.6956 126.9200 57.1960 29.7747 176.8062 52 E 4.0420 7.4980 117.3449 58.6940 30.1493 176.2950 53 Y 5.1687 7.3136 115.7430 55.8758 37.7615 174.2500 54 D 5.1594 8.0055 120.0619 52.2232 43.4913 175.6919 55 Q 4.9215 8.9237 119.8502 54.7171 31.6956 174.5285 56 V 4.4312 8.2574 114.4289 60.9049 32.0574 176.0394 57 L 4.3897 9.3820 126.6525 56.9222 42.6057 176.4777 58 D 4.7367 7.7776 115.2976 53.3663 44.6880 174.0188 59 S 5.1403 8.8376 117.8648 56.5651 65.1166 173.3355 60 V 4.2958 8.7051 125.9510 61.4961 34.7700 174.3601 61 L 5.1453 8.4790 128.6201 52.6900 40.8054 174.6772 62 V 3.6883 7.8620 122.7709 61.9172 32.8907 173.6416 63 G 4.3892 8.7542 112.7981 42.6120 0.0000 171.3557 64 P 4.7284 0.0000 0.0000 62.4845 32.8122 175.6928 65 V 4.6391 8.2357 120.6317 60.6256 35.1971 172.9352 66 P 5.6756 0.0000 0.0000 61.7717 32.3789 175.6702 67 A 4.4034 8.1502 122.0510 52.7849 19.0743 177.5338 68 G 3.7628 9.3977 104.7458 43.8890 0.0000 172.0256 69 R 4.8623 8.0796 120.4220 54.9064 32.3279 176.6085 70 H 4.7791 9.0043 122.2663 54.1860 33.0231 171.9043 71 M 5.2825 8.5803 122.3656 53.8707 34.8442 174.4142 72 F 4.9913 9.1085 118.9401 55.7763 41.7449 173.2526 73 V 3.9339 8.3681 120.7128 62.3454 32.7985 175.5557 74 F 4.9447 9.0365 130.1484 56.3417 40.0475 173.7964 75 Q 4.6621 8.8186 123.2936 55.7886 29.7594 175.6915 76 A 4.5134 8.7255 121.9969 51.0576 22.9421 175.8524 77 D 4.5225 9.1647 122.8900 54.7852 41.7651 176.5615 78 A 4.4653 8.3561 122.9600 50.2675 19.8489 175.8746 79 P 4.0563 0.0000 0.0000 62.4827 31.6673 175.8646 80 N 4.4262 8.3891 119.2919 52.7440 38.7903 173.6443 81 P 3.6562 0.0000 0.0000 65.3586 31.6325 178.8213 82 G 3.7502 8.0102 106.6119 49.0100 0.0000 174.5243 83 L 4.2667 7.5254 117.1958 54.2829 41.2567 176.6199 84 I 4.4903 7.5841 120.9803 58.6749 39.1050 173.9258 85 P 4.5048 0.0000 0.0000 61.5893 32.8337 175.3881 86 D 4.0144 8.7381 114.0947 57.3519 38.7402 177.9825 87 A 3.9277 6.3822 127.4878 54.2080 19.5080 178.5607 88 D 4.7343 8.0247 114.3576 54.0730 41.1558 177.2810 89 A 4.4989 7.9604 121.7115 52.3425 20.3475 178.0649 90 V 4.4423 6.4069 114.4638 58.2478 31.8319 175.3653 91 G 4.0457 7.2089 110.0153 46.1333 0.0000 168.9924 92 V 4.8132 8.6752 121.8142 62.9911 32.8850 176.9209 93 T 4.7656 9.7529 116.9084 60.4265 72.6312 172.0017 94 V 4.7763 7.9506 119.6297 61.4882 34.9089 175.3759 95 V 4.7744 9.0505 127.0802 61.2910 34.3982 174.2621 96 L 5.1711 8.9338 125.4198 52.9948 45.6622 175.3343 97 I 4.7949 8.2633 124.5856 59.8763 39.2060 175.0651 98 T 5.0506 9.6263 118.1470 60.0005 72.2946 172.6361 99 C 4.7782 8.2580 121.6843 57.7058 34.8199 172.7257 100 T 5.2086 8.5232 121.5118 62.0417 71.8416 172.5130 101 Y 4.5590 10.0495 125.7521 56.4818 41.0690 175.3810 102 R 3.2366 8.8247 122.8592 57.5911 27.4834 177.9165 103 G 3.9347 7.9960 107.2457 45.8545 0.0000 171.2610 104 Q 4.3586 7.4926 119.5437 53.8778 29.9202 174.6549 105 E 4.8526 8.7855 124.0821 55.7174 30.3284 175.9402 106 F 5.4869 8.6351 117.6389 55.3123 40.8817 173.9863 107 I 3.9337 7.0698 119.1793 60.4390 40.8400 172.4665 108 R 4.6371 8.7422 131.8606 54.6712 32.2207 175.0852 109 V 4.3396 8.4960 125.7793 61.0835 34.2711 174.5797 110 G 4.0421 9.1063 116.5510 45.5872 0.0000 171.7478 111 Y 4.7881 8.0599 119.1833 56.4398 42.3322 174.2728 112 Y 4.7131 8.6633 123.0474 58.0292 39.2846 175.2057 113 V 4.7334 9.5367 123.5867 61.1158 35.0789 173.5729 114 N 5.1853 9.2732 127.0699 52.2533 40.7192 173.2607 115 N 5.2744 9.4312 126.2201 52.0822 40.0134 174.0963 116 E 4.7733 9.0204 124.9154 54.0213 33.7398 174.1425 117 Y 4.7517 8.1073 120.1734 57.9300 38.2017 176.0346 118 T 4.1575 8.2184 118.3110 64.3437 67.7556 175.3623 119 E 4.2440 7.9871 120.1810 56.2815 30.2474 177.8736 120 T 3.8342 8.3880 111.7609 64.7290 68.9672 175.9606 121 E 4.2963 8.0795 121.3606 58.6355 30.1175 178.8462 122 L 4.1186 7.7733 118.4960 57.3726 41.9517 179.1010 123 R 4.1641 7.4008 117.6740 59.1272 30.3498 177.7267 124 E 4.1244 7.7741 117.8970 58.9480 29.9702 177.1707 125 N 4.9755 7.4621 112.6237 49.7701 36.8410 172.3731 126 P 4.2054 0.0000 0.0000 62.7686 32.2118 175.0849 127 P 4.2934 0.0000 0.0000 62.7528 31.7010 176.2312 128 V 3.6000 8.5976 120.9728 65.8062 31.3041 176.1116 129 K 4.2791 7.7760 120.5832 54.0503 32.3826 174.1597 130 P 4.1040 0.0000 0.0000 63.1787 32.0726 177.1397 131 D 4.7573 8.2265 125.8177 52.2034 39.9072 176.4691 132 F 3.7003 7.8671 122.2358 60.7291 39.7888 178.3537 133 S 4.5147 8.8077 115.3413 62.0070 62.3395 176.2725 134 K 4.1897 8.8214 118.7803 58.5624 31.9934 177.2248 135 L 4.6155 7.5415 118.7416 55.1954 42.9018 176.3543 136 Q 4.4812 8.6657 119.0450 55.8168 32.8840 173.2384 137 R 4.5265 9.7018 129.9917 55.2579 30.8960 174.6060 138 N 4.9110 8.9660 127.2352 52.2169 39.7084 173.8784 139 I 4.2263 8.6043 128.3231 60.7116 38.2563 177.6561 140 L 4.3790 8.4353 127.4174 52.8320 40.2294 176.9741 141 A 4.1067 8.4242 124.9766 55.9124 18.9179 179.9296 142 S 4.2243 7.8648 109.8881 61.3265 63.5198 174.7990 143 N 5.0566 7.9278 116.4093 51.2439 38.2940 171.4212 144 P 4.2454 0.0000 0.0000 62.5908 33.3847 177.5044 145 R 4.5752 7.9695 118.2536 54.4179 33.9186 174.6139 146 V 4.6113 8.3720 122.9416 61.3298 34.3161 174.5650 147 T 4.5467 8.6176 123.8382 61.6246 72.3090 173.1448 148 R 4.3718 8.3138 125.1733 54.5504 32.4959 173.7760 149 F 5.1163 7.9912 122.3215 54.8812 40.6607 174.6375 150 H 4.3413 9.3013 119.2033 56.7759 29.0166 173.9304 151 I 4.6493 8.2420 123.9036 59.4896 41.0429 174.2060 152 N 4.9819 7.8824 113.0089 50.2309 38.5082 174.5910 153 W 4.6554 7.6613 120.5633 57.0519 29.0517 176.2996 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 M 8.30 4.18 0.00 1.94 2.16 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.59 0.00 2 A 7.78 2.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 K 5.66 3.58 0.00 0.79 1.31 0.00 1.35 0.00 0.00 1.75 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.15 0.77 7.81 4 V 6.21 4.78 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 1.18 0.00 0.00 0.98 0.00 0.00 5 Q 9.34 4.84 0.00 2.15 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.71 0.00 0.00 0.00 0.00 0.00 2.51 2.36 0.00 6 V 8.74 4.67 2.24 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 1.13 0.00 0.00 1.33 0.00 0.00 7 N 10.39 4.87 0.00 2.88 2.90 0.00 0.00 6.76 7.88 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 8 N 7.93 4.96 0.00 2.86 2.65 0.00 0.00 6.62 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 9 V 8.46 4.88 2.27 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 1.08 0.00 0.00 1.03 0.00 0.00 10 V 7.98 4.51 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 0.89 0.00 0.00 0.96 0.00 0.00 11 V 8.55 4.08 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 0.63 0.00 0.00 0.52 0.00 0.00 12 L 8.23 4.54 0.00 1.54 1.45 0.87 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.31 4.24 0.00 2.64 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 7.78 4.86 0.00 2.67 2.55 0.00 0.00 7.29 7.69 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 15 P 0.00 4.83 0.00 2.09 2.04 0.00 3.83 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 1.96 1.95 0.00 16 S 9.06 4.56 0.00 3.94 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 17 P 0.00 4.38 0.00 2.12 2.13 0.00 3.59 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 2.13 2.16 0.00 18 F 9.26 4.00 0.00 2.96 3.21 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 19 Y 8.00 3.93 0.00 3.02 2.89 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 20 N 7.47 4.35 0.00 2.60 2.64 0.00 0.00 7.02 8.87 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 21 P 0.00 4.52 0.00 2.13 2.05 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 1.95 1.98 0.00 22 F 8.58 3.88 0.00 2.91 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 23 Q 7.94 4.84 0.00 1.73 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 24 F 8.70 5.19 0.00 2.80 2.80 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 25 E 9.03 4.49 0.00 1.98 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 2.21 2.24 0.00 26 I 7.67 4.17 1.32 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.18 0.82 0.00 0.00 27 T 9.29 5.17 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 1.21 0.00 0.00 28 F 9.22 5.41 0.00 3.64 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 29 E 9.97 5.24 0.00 1.99 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 2.21 2.24 0.00 30 C 9.25 5.26 0.00 2.99 3.10 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 31 I 8.36 3.85 1.80 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.46 0.84 0.00 0.00 32 E 7.90 4.49 0.00 2.16 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 2.24 2.31 0.00 33 D 8.13 4.89 0.00 2.75 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 34 L 8.19 4.95 0.00 1.90 1.62 1.12 1.41 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 35 S 8.66 4.46 0.00 3.93 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 36 E 8.82 4.19 0.00 1.99 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 2.29 2.48 0.00 37 D 8.27 4.60 0.00 2.71 2.24 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 38 L 7.96 4.62 0.00 1.77 1.54 1.02 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 39 E 7.87 5.19 0.00 1.98 1.80 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 2.10 2.23 0.00 40 W 9.20 5.23 0.00 3.22 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 41 K 9.49 5.42 0.00 1.68 1.73 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.60 1.33 7.81 42 I 8.56 4.81 1.55 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 -0.10 0.56 0.00 0.00 43 I 8.68 4.73 1.83 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.54 0.90 0.00 0.00 44 Y 8.97 4.73 0.00 2.88 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 45 V 8.36 4.14 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 0.84 0.00 0.00 0.84 0.00 0.00 46 G 7.81 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 47 S 8.21 5.32 0.00 4.17 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 A 6.78 3.54 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 49 E 9.12 4.38 0.00 1.87 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 2.29 2.24 0.00 50 S 7.65 4.51 0.00 3.68 3.48 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 0.00 0.00 0.00 0.00 51 E 8.70 4.96 0.00 1.96 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 0.00 2.26 2.24 0.00 52 E 7.50 4.04 0.00 1.87 1.48 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 0.00 2.21 2.25 0.00 53 Y 7.31 5.17 0.00 3.15 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 54 D 8.01 5.16 0.00 2.74 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 55 Q 8.92 4.92 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.04 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 56 V 8.26 4.43 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 0.74 0.00 0.00 0.97 0.00 0.00 57 L 9.38 4.39 0.00 1.39 1.84 0.68 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 58 D 7.78 4.74 0.00 2.93 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 8.84 5.14 0.00 3.95 3.75 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 60 V 8.71 4.30 1.88 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 0.72 0.00 0.00 0.46 0.00 0.00 61 L 8.48 5.15 0.00 1.53 1.60 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.86 3.69 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 0.96 0.00 0.00 0.67 0.00 0.00 63 G 8.75 4.39 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 0.00 64 P 0.00 4.73 0.00 2.11 2.07 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 65 V 8.24 4.64 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 1.03 0.00 0.00 0.96 0.00 0.00 66 P 0.00 5.68 0.00 2.16 2.08 0.00 3.44 0.00 0.00 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.86 0.00 67 A 8.15 4.40 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 68 G 9.40 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 0.00 0.00 0.00 69 R 8.08 4.86 0.00 1.72 1.67 0.00 3.16 0.00 0.00 3.19 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.69 0.00 70 H 9.00 4.78 0.00 1.58 2.76 0.00 5.61 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 71 M 8.58 5.28 0.00 1.98 1.87 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 2.45 2.43 0.00 72 F 9.11 4.99 0.00 3.09 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 73 V 8.37 3.93 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 0.78 0.00 0.00 0.94 0.00 0.00 74 F 9.04 4.94 0.00 2.66 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 75 Q 8.82 4.66 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.45 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 76 A 8.73 4.51 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 9.16 4.52 0.00 2.60 2.66 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 0.00 0.00 0.00 0.00 78 A 8.36 4.47 0.99 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 0.00 0.00 79 P 0.00 4.06 0.00 1.62 1.10 0.00 3.25 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 80 N 8.39 4.43 0.00 2.87 2.89 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 81 P 0.00 3.66 0.00 1.77 0.49 0.00 3.65 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.52 0.00 82 G 8.01 3.75 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 0.00 0.00 0.00 83 L 7.53 4.27 0.00 1.78 1.69 1.03 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.58 4.49 2.01 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 1.55 0.73 1.13 0.00 0.00 85 P 0.00 4.50 0.00 2.30 2.06 0.00 3.53 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 2.11 1.77 0.00 86 D 8.74 4.01 0.00 2.92 2.80 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 87 A 6.38 3.93 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 88 D 8.02 4.73 0.00 2.68 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 89 A 7.96 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 6.41 4.44 1.90 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 0.87 0.00 0.00 0.56 0.00 0.00 91 G 7.21 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 0.00 0.00 0.00 92 V 8.68 4.81 2.11 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 0.99 0.00 0.00 0.95 0.00 0.00 93 T 9.75 4.77 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 1.27 0.00 0.00 94 V 7.95 4.78 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 0.80 0.00 0.00 0.89 0.00 0.00 95 V 9.05 4.77 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 0.85 0.00 0.00 1.37 0.00 0.00 96 L 8.93 5.17 0.00 1.44 1.40 0.86 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.26 4.79 1.74 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.23 1.24 0.00 0.00 98 T 9.63 5.05 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 1.25 0.00 0.00 99 C 8.26 4.78 0.00 1.23 1.43 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 0.00 100 T 8.52 5.21 4.19 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 1.17 0.00 0.00 101 Y 10.05 4.56 0.00 2.55 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 0.00 0.00 0.00 102 R 8.82 3.24 0.00 1.52 1.60 0.00 3.09 0.00 0.00 2.93 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.50 0.00 103 G 8.00 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 0.00 104 Q 7.49 4.36 0.00 2.15 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.96 0.00 0.00 0.00 0.00 0.00 2.12 2.17 0.00 105 E 8.79 4.85 0.00 1.85 1.67 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 2.54 2.28 0.00 106 F 8.64 5.49 0.00 3.27 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 7.07 3.93 1.59 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.23 0.00 0.00 0.00 108 R 8.74 4.64 0.00 1.52 1.53 0.00 3.14 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.48 0.00 109 V 8.50 4.34 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 0.77 0.00 0.00 0.88 0.00 0.00 110 G 9.11 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 0.00 111 Y 8.06 4.79 0.00 3.07 2.92 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 0.00 112 Y 8.66 4.71 0.00 3.10 2.91 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 0.00 113 V 9.54 4.73 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 1.14 0.00 0.00 1.22 0.00 0.00 114 N 9.27 5.19 0.00 2.91 2.81 0.00 0.00 6.75 6.93 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 0.00 115 N 9.43 5.27 0.00 2.75 2.74 0.00 0.00 6.06 7.55 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 0.00 116 E 9.02 4.77 0.00 2.00 1.74 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 2.17 2.27 0.00 117 Y 8.11 4.75 0.00 2.90 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 0.00 118 T 8.22 4.16 4.29 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 1.26 0.00 0.00 119 E 7.99 4.24 0.00 2.04 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 2.41 2.32 0.00 120 T 8.39 3.83 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 1.21 0.00 0.00 121 E 8.08 4.30 0.00 1.97 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 2.37 2.24 0.00 122 L 7.77 4.12 0.00 1.51 1.07 0.77 0.19 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 0.00 123 R 7.40 4.16 0.00 1.87 2.01 0.00 3.46 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.93 0.00 124 E 7.77 4.12 0.00 2.35 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 2.35 2.25 0.00 125 N 7.46 4.98 0.00 2.67 2.78 0.00 0.00 7.10 7.88 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 0.00 126 P 0.00 4.21 0.00 2.18 2.44 0.00 4.10 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 127 P 0.00 4.29 0.00 2.14 2.00 0.00 3.62 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.77 0.00 128 V 8.60 3.60 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 0.78 0.00 0.00 0.93 0.00 0.00 129 K 7.78 4.28 0.00 1.74 1.72 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.41 1.54 7.81 130 P 0.00 4.10 0.00 1.43 1.46 0.00 3.71 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 1.93 1.95 0.00 131 D 8.23 4.76 0.00 2.77 2.59 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 0.00 132 F 7.87 3.70 0.00 2.96 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 0.00 0.00 0.00 133 S 8.81 4.51 0.00 4.11 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 0.00 134 K 8.82 4.19 0.00 1.92 1.91 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.60 1.47 7.81 135 L 7.54 4.62 0.00 1.74 1.62 0.24 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 136 Q 8.67 4.48 0.00 2.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 137 R 9.70 4.53 0.00 1.95 1.82 0.00 2.62 0.00 0.00 2.75 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 138 N 8.97 4.91 0.00 2.85 2.72 0.00 0.00 6.99 7.32 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 0.00 139 I 8.60 4.23 2.03 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.58 0.86 0.00 0.00 140 L 8.44 4.38 0.00 1.89 1.71 1.07 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 141 A 8.42 4.11 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 0.00 142 S 7.86 4.22 0.00 3.94 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 0.00 143 N 7.93 5.06 0.00 2.71 2.78 0.00 0.00 7.30 7.85 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 0.00 144 P 0.00 4.25 0.00 1.86 2.00 0.00 3.85 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.05 0.00 145 R 7.97 4.58 0.00 1.56 1.75 0.00 3.26 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.87 0.00 146 V 8.37 4.61 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 0.73 0.00 0.00 0.83 0.00 0.00 147 T 8.62 4.55 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 0.95 0.00 0.00 148 R 8.31 4.37 0.00 1.66 1.71 0.00 3.23 0.00 0.00 3.35 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 149 F 7.99 5.12 0.00 3.02 3.17 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 0.00 150 H 9.30 4.34 0.00 3.24 3.48 0.00 5.84 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 I 8.24 4.65 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 -0.00 0.00 0.00 152 N 7.88 4.98 0.00 2.63 2.71 0.00 0.00 6.75 7.68 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 0.00 153 W 7.66 4.66 0.00 3.16 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 0.00