NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.8170 8.1648 122.2811 52.2459 19.9454 175.9175 2 T 4.6190 8.8162 118.7513 61.2128 72.6167 171.5933 3 K 5.2901 8.9388 124.3246 55.0203 37.3678 174.5333 4 A 5.2483 9.0732 123.4158 51.2242 23.5023 175.2119 5 V 5.0660 8.7675 116.9777 60.6688 35.3184 173.3490 6 A 5.0354 9.3722 124.4300 50.3117 22.3785 174.9487 7 V 4.5562 8.3908 122.5869 61.2919 33.5642 174.4603 8 L 4.6304 9.2169 130.0053 54.0658 42.9316 176.3437 9 K 4.9142 9.0637 122.3306 55.3641 37.1148 176.3532 10 G 4.5989 7.9761 108.4882 44.7984 0.0000 172.0171 11 D 4.4783 8.8498 118.0064 56.0022 41.5101 176.3893 12 G 4.3549 7.5805 108.4272 43.6550 0.0000 171.1739 13 P 4.4175 0.0000 0.0000 63.7243 32.0391 176.2884 14 V 4.1638 7.5725 120.7425 63.0555 31.9523 174.9470 15 Q 4.8276 8.8198 124.9962 55.4212 32.4417 173.4773 16 G 4.3207 8.4987 106.2670 46.0159 0.0000 172.1029 17 I 5.0519 8.1681 119.8888 59.3421 40.7202 174.9192 18 I 4.6720 8.8660 128.0506 59.4947 40.0483 174.4671 19 N 4.9342 8.5847 124.8182 51.5845 40.7755 174.1005 20 F 5.3624 9.0376 120.3265 55.8545 43.2018 173.9266 21 E 5.1622 9.6359 122.8716 55.0550 33.6847 173.6453 22 Q 4.8860 9.3828 127.7987 54.1343 30.5588 175.5422 23 K 4.0431 8.9044 127.1093 58.6587 32.7237 177.3525 24 E 4.7609 7.7951 116.5113 53.9955 33.3014 176.2807 25 S 4.1250 9.0558 117.9182 61.4779 62.7320 175.5688 26 N 4.7953 8.1562 115.8009 51.8205 37.3152 174.6100 27 G 4.0543 7.6922 109.2542 43.6500 0.0000 172.0441 28 P 4.6647 0.0000 0.0000 62.8292 32.4002 175.8627 29 V 4.6121 8.9974 121.4510 61.1731 33.7917 174.3720 30 K 4.7581 9.4810 130.3115 55.8458 33.7631 175.3508 31 V 4.8693 9.4206 127.9847 60.8397 34.1506 174.1648 32 W 5.4081 8.2769 123.8200 54.8752 31.6886 175.1112 33 G 3.9088 7.4724 107.4637 46.2007 0.0000 171.1099 34 S 5.1121 7.7890 115.1930 57.0536 66.7588 174.1784 35 I 5.1620 8.7992 125.3731 59.3781 41.0026 174.6814 36 K 4.8209 9.2268 125.4732 55.6857 36.1534 177.0379 37 G 3.7956 8.8940 106.7038 45.5891 0.0000 173.6600 38 L 4.3444 7.6090 120.0599 53.4989 42.6696 176.6517 39 T 4.2181 8.2040 111.7028 61.0941 69.5878 174.3080 40 E 4.1322 8.5315 121.7976 57.7286 30.6387 176.1156 41 G 3.9171 8.7894 105.8510 44.0201 0.0000 172.0158 42 L 4.8519 8.1351 118.9358 54.5149 43.0271 176.3992 43 H 5.0033 9.2747 119.9121 53.5980 32.8415 173.2949 44 G 4.0289 9.0134 110.9410 46.9780 0.0000 172.4708 45 F 5.4869 8.9185 125.0910 56.9777 42.2554 172.8521 46 H 5.1058 8.9134 122.8052 53.8693 33.6152 172.8761 47 V 4.4018 8.5755 121.8382 62.7641 32.6818 175.0137 48 H 5.2152 9.5456 125.6417 54.3227 30.8468 175.7590 49 E 3.7842 8.9676 122.4953 59.0306 29.6248 177.0879 50 F 5.0093 8.2676 118.4639 55.0042 41.6273 176.6262 51 G 4.1861 8.5604 111.4058 45.0074 0.0000 173.3716 52 D 4.7298 8.1489 119.8029 52.5448 42.0751 174.5895 53 N 5.1398 8.5475 124.7127 53.4887 39.3459 175.3671 54 T 3.9671 8.5602 109.7329 63.5270 68.8631 174.8074 55 A 4.6679 7.7893 124.6271 51.3018 20.0363 177.5666 56 G 3.7928 8.0820 110.6806 46.9965 0.0000 175.1171 57 A 3.9793 8.4764 119.1760 55.3744 18.0990 179.8642 58 T 3.8991 7.9560 113.7283 66.7174 68.5872 175.6090 59 S 4.5025 7.5927 112.8987 58.8704 63.5718 175.2861 60 A 4.5414 7.6590 126.2701 53.5567 18.4423 179.0285 61 G 3.8294 8.3918 106.0882 44.0727 0.0000 170.6404 62 P 4.6679 0.0000 0.0000 61.9392 33.9472 174.9818 63 H 4.4394 8.4168 116.4814 55.9828 29.3877 175.4215 64 F 4.1802 9.2210 125.8544 58.4092 40.3384 174.8929 65 N 5.0385 7.8019 125.7377 51.3989 38.8218 172.8701 66 P 4.0017 0.0000 0.0000 65.3848 31.9703 177.9925 67 L 4.2099 7.5383 115.8597 53.7995 41.9820 176.2724 68 S 3.5782 7.4086 113.4859 59.7043 60.7029 171.7895 69 R 4.4801 7.9905 117.9038 54.5911 32.0415 176.4430 70 K 4.4807 8.6836 118.2306 55.7371 33.8421 176.5143 71 H 4.0036 8.7255 122.9140 56.8254 30.4761 174.7587 72 G 4.1604 7.5311 110.0620 45.0985 0.0000 172.0400 73 G 4.1250 9.2364 109.3257 43.3939 0.0000 173.2762 74 P 4.3732 0.0000 0.0000 65.5273 31.1950 178.0217 75 K 4.1514 7.9183 116.7480 58.2883 32.3937 176.9623 76 D 4.5830 7.6643 119.1930 53.5776 41.4769 176.2370 77 E 3.8963 8.7718 124.2086 58.9898 29.7916 176.4929 78 E 4.2446 7.9834 121.7860 55.2768 28.5632 174.8229 79 R 4.7866 7.6255 120.0058 55.0440 32.6647 174.6930 80 H 4.5318 9.2689 116.3646 55.1819 29.4682 177.0571 81 V 3.5359 8.3843 122.4317 66.1977 31.4224 177.1882 82 G 3.9027 8.2705 106.4549 45.8879 0.0000 172.9603 83 D 4.8438 7.8986 120.8217 53.8547 39.4808 175.6621 84 L 4.7011 8.3272 122.5271 54.0393 43.3153 178.3337 85 G 4.0802 7.8610 110.3533 46.6534 0.0000 174.9597 86 N 5.6544 8.7290 120.4688 51.2862 41.6359 173.1613 87 V 4.2892 8.5824 115.4622 60.0787 34.8268 175.0179 88 T 4.9863 8.1751 118.5871 61.8309 71.4376 172.8886 89 A 4.6442 8.9456 129.7473 50.8177 20.6909 177.2698 90 D 4.7831 8.9117 122.7986 52.0553 40.9543 177.2136 91 K 4.2558 8.4315 116.7962 59.1216 32.3737 177.1737 92 D 4.5779 8.3167 117.6327 53.9368 41.1614 176.8647 93 G 4.0295 8.6316 108.4195 44.6370 0.0000 172.7065 94 V 4.7002 8.0867 120.0713 60.8458 33.6304 174.3724 95 A 5.1141 9.0363 130.4260 49.6805 20.7575 175.2532 96 D 4.8862 8.6260 123.1635 54.0379 41.9561 176.3567 97 V 4.0953 8.7142 125.0696 61.5047 33.4585 175.0369 98 S 4.7262 8.4144 122.7532 57.5949 64.3418 172.8682 99 I 4.7978 9.4195 128.3414 59.4094 41.4977 174.0852 100 E 5.1478 8.9093 126.1965 54.4614 32.1284 174.3847 101 D 5.0796 9.2438 126.0482 52.7115 44.4238 175.9504 102 S 4.6903 8.9788 118.4542 58.6154 64.3558 175.1856 103 V 3.9283 8.0417 120.7443 65.0454 31.8821 176.3800 104 I 4.0664 7.8192 111.6018 61.0623 38.2058 174.9913 105 S 4.6843 8.1874 114.4863 57.1032 65.2743 174.4467 106 L 4.3041 9.2326 125.1860 55.1418 41.8958 176.2803 107 S 4.6258 7.8747 112.5933 56.6760 66.1875 174.0613 108 G 4.0121 8.5082 106.0369 44.8833 0.0000 174.0675 109 D 4.4940 8.3838 117.2126 55.5444 39.4666 176.6978 110 H 5.2072 7.8656 116.4385 55.2944 29.4549 174.4497 111 A 4.3646 7.6649 121.8665 52.4743 18.8188 178.7616 112 I 3.7086 8.3154 113.4054 60.8003 38.3478 176.1265 113 I 3.6196 7.2951 123.0885 63.1926 37.4140 176.2301 114 G 3.8127 9.4421 113.8295 45.2425 0.0000 172.8805 115 R 4.9210 7.4193 119.2808 54.8278 33.6209 174.5481 116 T 4.9066 7.9856 115.2333 62.0594 71.4354 173.5860 117 L 4.7623 8.8538 129.0685 54.1022 43.8525 175.4126 118 V 5.0483 8.9064 126.1002 60.9610 35.2877 174.1805 119 V 5.1532 8.6157 126.3137 60.4846 33.7586 174.7558 120 H 5.2147 9.2296 121.6647 54.1022 30.7432 174.7088 121 E 4.3121 9.3115 122.0060 59.1116 29.9580 176.3534 122 K 4.7758 8.6196 116.7067 54.5526 36.6964 175.1900 123 A 4.4029 8.4368 122.1752 52.2873 18.7764 176.1687 124 D 4.9417 9.5933 122.9363 53.6873 41.1894 176.1327 125 D 4.5398 9.3631 125.8787 53.4678 39.5145 176.8685 126 L 3.4937 10.0008 119.8481 56.1152 39.5067 176.0323 127 G 3.9911 8.6453 104.9671 46.0163 0.0000 174.9267 128 K 4.4317 8.0266 118.0404 55.9749 32.2897 178.5213 129 G 3.6648 7.7288 109.1371 46.0388 0.0000 175.5171 130 G 3.8997 7.7091 104.5573 45.3737 0.0000 172.3235 131 N 5.1176 7.5196 115.2730 50.1854 40.5398 174.2861 132 E 4.0795 8.6752 117.1975 59.5262 29.8835 179.4706 133 E 3.9171 8.2384 118.7589 59.1481 29.5227 178.5770 134 S 4.1551 8.6173 113.8437 61.3958 62.4236 175.7059 135 T 4.1845 7.8389 111.0026 62.9686 68.4636 175.4620 136 K 4.2785 7.7357 119.4805 58.0023 33.7702 177.3838 137 T 4.2308 8.1650 107.8045 60.1926 69.8797 175.3136 138 G 4.1840 7.8098 110.1211 45.7296 0.0000 173.5497 139 N 4.2511 7.7378 114.0076 53.9492 36.7487 175.3630 140 A 4.4805 6.9993 119.9754 52.0781 19.5069 179.9189 141 G 3.7158 7.9919 103.5222 44.8515 0.0000 172.9968 142 S 4.4492 8.4090 115.2286 58.4815 64.9714 173.9520 143 R 4.5458 8.3054 119.3307 54.9739 29.9540 176.5836 144 L 4.3222 8.8105 125.7958 57.3678 43.0401 177.2228 145 A 4.9391 7.7679 117.4688 51.0699 22.8085 175.0486 146 A 5.0988 9.0431 120.4239 51.1904 23.4116 175.6574 147 G 4.5733 8.6104 104.8044 45.5954 0.0000 172.9178 148 V 4.2733 8.3210 123.8817 62.5057 32.7812 175.5934 149 I 4.0665 9.1816 129.6506 61.0552 37.7073 175.2912 150 G 4.3741 8.8542 115.1046 43.9111 0.0000 171.9049 151 I 4.2381 8.2849 121.7624 61.1827 37.5405 175.6389 152 A 4.7598 8.3218 128.5216 49.7801 21.8464 176.4653 153 Q 4.0693 8.4643 118.7436 56.4545 29.2210 175.9157 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 A 8.16 4.82 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 2 T 8.82 4.62 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 1.22 0.00 0.00 3 K 8.94 5.29 0.00 1.71 1.72 0.00 1.92 0.00 0.00 1.95 0.00 0.00 2.95 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.56 1.50 7.81 4 A 9.07 5.25 1.13 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 5 V 8.77 5.07 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 0.78 0.00 0.00 0.94 0.00 0.00 6 A 9.37 5.04 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.39 4.56 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 1.03 0.00 0.00 0.92 0.00 0.00 8 L 9.22 4.63 0.00 1.72 1.60 1.06 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.06 4.91 0.00 1.66 1.62 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.38 7.81 10 G 7.98 4.60 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 11 D 8.85 4.48 0.00 2.68 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 12 G 7.58 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 13 P 0.00 4.42 0.00 2.19 2.17 0.00 3.77 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 2.12 1.94 0.00 14 V 7.57 4.16 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 0.80 0.00 0.00 0.93 0.00 0.00 15 Q 8.82 4.83 0.00 2.23 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.42 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 16 G 8.50 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.17 5.05 1.82 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 1.20 1.09 0.83 0.00 0.00 18 I 8.87 4.67 1.86 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 1.28 1.27 0.54 0.00 0.00 19 N 8.58 4.93 0.00 1.44 1.46 0.00 0.00 6.36 8.47 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 20 F 9.04 5.36 0.00 2.87 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 21 E 9.64 5.16 0.00 2.51 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 22 Q 9.38 4.89 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.56 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 23 K 8.90 4.04 0.00 1.88 1.87 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.55 1.50 7.81 24 E 7.80 4.76 0.00 1.99 1.79 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 2.29 2.27 0.00 25 S 9.06 4.13 0.00 3.98 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.16 4.80 0.00 2.84 2.94 0.00 0.00 5.88 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.69 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 28 P 0.00 4.66 0.00 2.13 2.10 0.00 3.76 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 2.01 1.98 0.00 29 V 9.00 4.61 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 1.28 0.00 0.00 1.07 0.00 0.00 30 K 9.48 4.76 0.00 1.88 1.84 0.00 1.30 0.00 0.00 0.91 0.00 0.00 2.13 0.00 0.00 2.30 0.00 0.00 0.00 0.00 1.57 1.34 7.81 31 V 9.42 4.87 2.13 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 0.43 0.00 0.00 1.02 0.00 0.00 32 W 8.28 5.41 0.00 3.49 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 33 G 7.47 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 34 S 7.79 5.11 0.00 3.89 3.63 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 0.00 0.00 0.00 0.00 35 I 8.80 5.16 1.81 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 1.29 0.54 0.97 0.00 0.00 36 K 9.23 4.82 0.00 1.74 1.88 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.34 7.81 37 G 8.89 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 0.00 0.00 0.00 38 L 7.61 4.34 0.00 1.83 1.44 0.82 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.20 4.22 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 1.24 0.00 0.00 40 E 8.53 4.13 0.00 2.18 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 0.00 2.37 2.32 0.00 41 G 8.79 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 0.00 0.00 0.00 42 L 8.14 4.85 0.00 1.51 1.59 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 43 H 9.27 5.00 0.00 3.01 3.31 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.01 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.92 5.49 0.00 2.98 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 46 H 8.91 5.11 0.00 3.14 3.03 0.00 5.85 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.58 4.40 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 0.88 0.00 0.00 0.92 0.00 0.00 48 H 9.55 5.22 0.00 3.09 3.45 0.00 5.70 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.97 3.78 0.00 1.67 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.21 0.00 50 F 8.27 5.01 0.00 3.02 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 51 G 8.56 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 0.00 0.00 0.00 0.00 52 D 8.15 4.73 0.00 2.63 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 53 N 8.55 5.14 0.00 2.69 2.73 0.00 0.00 7.26 7.70 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 54 T 8.56 3.97 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 1.23 0.00 0.00 55 A 7.79 4.67 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 56 G 8.08 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 57 A 8.48 3.98 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 58 T 7.96 3.90 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 1.23 0.00 0.00 59 S 7.59 4.50 0.00 3.97 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 60 A 7.66 4.54 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.39 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 0.00 0.00 0.00 62 P 0.00 4.67 0.00 2.02 2.19 0.00 3.70 0.00 0.00 3.84 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 63 H 8.42 4.44 0.00 2.91 3.25 0.00 5.74 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.22 4.18 0.00 2.92 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 65 N 7.80 5.04 0.00 2.59 2.40 0.00 0.00 6.92 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 66 P 0.00 4.00 0.00 1.52 1.67 0.00 3.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.04 0.00 67 L 7.54 4.21 0.00 1.55 1.66 0.86 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.41 3.58 0.00 3.98 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 7.99 4.48 0.00 1.94 1.99 0.00 3.25 0.00 0.00 3.34 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 70 K 8.68 4.48 0.00 1.68 1.70 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.77 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.37 7.81 71 H 8.73 4.00 0.00 3.21 3.27 0.00 5.94 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 72 G 7.53 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 9.24 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.37 0.00 2.22 2.37 0.00 3.79 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 2.02 2.05 0.00 75 K 7.92 4.15 0.00 1.77 1.91 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.47 7.81 76 D 7.66 4.58 0.00 2.78 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 E 8.77 3.90 0.00 1.90 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 2.28 2.35 0.00 78 E 7.98 4.24 0.00 2.06 1.82 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 2.33 2.31 0.00 79 R 7.63 4.79 0.00 1.97 1.89 0.00 2.97 0.00 0.00 2.69 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.58 0.00 80 H 9.27 4.53 0.00 3.46 3.40 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.38 3.54 1.72 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 0.92 0.00 0.00 0.75 0.00 0.00 82 G 8.27 3.90 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 0.00 0.00 0.00 83 D 7.90 4.84 0.00 2.81 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 84 L 8.33 4.70 0.00 1.97 1.89 0.98 0.92 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 85 G 7.86 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 86 N 8.73 5.65 0.00 2.58 2.69 0.00 0.00 6.67 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 87 V 8.58 4.29 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 -0.23 0.00 0.00 0.75 0.00 0.00 88 T 8.18 4.99 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 1.20 0.00 0.00 89 A 8.95 4.64 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 D 8.91 4.78 0.00 2.89 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 91 K 8.43 4.26 0.00 1.88 2.00 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.43 7.81 92 D 8.32 4.58 0.00 2.81 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 93 G 8.63 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.09 4.70 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 1.01 0.00 0.00 0.97 0.00 0.00 95 A 9.04 5.11 1.13 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 96 D 8.63 4.89 0.00 2.56 2.63 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 0.00 0.00 0.00 0.00 97 V 8.71 4.10 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 0.73 0.00 0.00 0.59 0.00 0.00 98 S 8.41 4.73 0.00 3.89 3.71 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 99 I 9.42 4.80 1.96 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 1.15 0.82 1.01 0.00 0.00 100 E 8.91 5.15 0.00 1.96 1.82 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 2.20 2.46 0.00 101 D 9.24 5.08 0.00 2.87 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 0.00 102 S 8.98 4.69 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 0.00 103 V 8.04 3.93 2.25 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 0.86 0.00 0.00 0.95 0.00 0.00 104 I 7.82 4.07 1.96 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.82 1.06 0.00 0.00 105 S 8.19 4.68 0.00 3.86 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 0.00 106 L 9.23 4.30 0.00 1.72 1.66 1.00 0.65 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 0.00 107 S 7.87 4.63 0.00 3.95 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 0.00 108 G 8.51 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 0.00 109 D 8.38 4.49 0.00 2.76 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 0.00 110 H 7.87 5.21 0.00 3.22 3.46 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.66 4.36 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 0.00 112 I 8.32 3.71 1.61 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.29 0.90 0.00 0.00 113 I 7.30 3.62 1.78 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.74 0.83 0.00 0.00 114 G 9.44 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 0.00 0.00 0.00 115 R 7.42 4.92 0.00 1.58 1.82 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.22 0.00 116 T 7.99 4.91 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 1.22 0.00 0.00 117 L 8.85 4.76 0.00 1.76 1.53 0.39 0.63 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 0.00 118 V 8.91 5.05 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 0.76 0.00 0.00 0.76 0.00 0.00 119 V 8.62 5.15 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 0.80 0.00 0.00 1.06 0.00 0.00 120 H 9.23 5.21 0.00 3.22 3.59 0.00 5.67 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.31 4.31 0.00 2.00 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 2.37 2.32 0.00 122 K 8.62 4.78 0.00 1.78 1.88 0.00 1.38 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.52 7.81 123 A 8.44 4.40 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 0.00 124 D 9.59 4.94 0.00 2.71 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 0.00 125 D 9.36 4.54 0.00 2.91 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 0.00 126 L 10.00 3.49 0.00 1.87 1.79 0.93 1.26 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 0.00 127 G 8.65 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 K 8.03 4.43 0.00 1.82 1.82 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.65 1.51 7.81 129 G 7.73 3.66 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 0.00 0.00 0.00 130 G 7.71 3.90 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 0.00 0.00 0.00 131 N 7.52 5.12 0.00 2.77 2.79 0.00 0.00 6.17 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 0.00 132 E 8.68 4.08 0.00 2.05 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 2.40 2.30 0.00 133 E 8.24 3.92 0.00 2.07 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 0.00 2.41 2.44 0.00 134 S 8.62 4.16 0.00 4.07 4.02 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 0.00 0.00 0.00 135 T 7.84 4.18 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 1.25 0.00 0.00 136 K 7.74 4.28 0.00 1.81 1.81 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.34 1.62 7.81 137 T 8.16 4.23 4.14 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 1.19 0.00 0.00 138 G 7.81 4.18 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 0.00 0.00 0.00 139 N 7.74 4.25 0.00 2.93 2.90 0.00 0.00 6.85 7.20 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 0.00 140 A 7.00 4.48 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 0.00 141 G 7.99 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 0.00 142 S 8.41 4.45 0.00 3.97 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 0.00 143 R 8.31 4.55 0.00 1.67 1.84 0.00 3.18 0.00 0.00 3.12 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.64 0.00 144 L 8.81 4.32 0.00 1.73 1.70 0.99 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.77 4.94 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 0.00 146 A 9.04 5.10 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 0.00 147 G 8.61 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.32 4.27 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 0.81 0.00 0.00 0.98 0.00 0.00 149 I 9.18 4.07 1.77 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.30 0.34 0.00 0.00 150 G 8.85 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 0.00 0.00 0.00 0.00 151 I 8.28 4.24 1.85 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 1.25 0.54 0.91 0.00 0.00 152 A 8.32 4.76 1.23 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 0.00 0.00 153 Q 8.46 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00