NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 A 4.3356 8.1233 123.5822 52.0982 21.2020 178.0870 24 D 4.4731 8.6191 115.7908 54.9646 41.2943 177.5423 25 S 4.1621 8.9440 117.6255 61.4824 63.3032 176.1043 26 K 3.9094 8.1529 120.4044 59.5300 31.8137 178.9048 27 A 4.0372 7.5600 119.5679 55.2568 18.2844 180.1359 28 V 3.6834 8.1244 117.8493 64.8254 31.6794 178.3467 29 L 4.1761 8.3302 119.8631 57.9422 41.6624 179.1769 30 N 4.3721 8.3584 116.7179 56.5573 38.7153 176.7222 31 Q 4.2734 8.3557 121.0744 59.2245 29.1350 178.1310 32 A 4.2173 8.5943 122.0744 55.0930 18.4581 179.7162 33 V 3.5913 7.9475 116.3723 66.0810 31.5917 178.2575 34 A 4.1425 8.3012 120.0733 55.4103 18.3439 179.4185 35 D 4.3847 8.5702 117.7878 57.5295 40.9370 179.0591 36 L 4.1689 8.6785 119.9251 57.8706 41.4717 179.7074 37 S 3.9105 7.8419 115.1413 61.4573 62.5931 176.9866 38 V 3.5914 7.8529 120.7498 65.8441 31.2398 177.8620 39 A 4.0306 8.4818 121.0614 55.3648 18.1336 179.1220 40 H 3.9953 8.3722 116.6663 59.4640 30.0017 177.2728 41 S 4.1243 7.8574 114.9512 61.5749 62.0722 176.2711 42 I 3.6716 7.8686 122.2127 64.3980 36.8448 178.2315 43 L 3.9065 7.9995 119.8970 58.1825 41.3646 179.1348 44 H 3.5868 8.0841 117.9673 58.9958 29.5923 176.9968 45 Q 4.2338 7.9552 121.3288 59.2708 28.8638 178.5569 46 V 3.6277 8.0463 119.4225 66.2475 31.3891 177.1505 47 H 4.0909 8.2632 117.1135 59.4469 29.6523 176.8176 48 W 4.7184 8.2825 119.3111 59.5657 28.8353 177.4664 49 Y 4.4388 8.6583 114.9626 57.2094 37.9308 175.3941 50 M 4.4184 7.5429 120.2495 56.1420 32.9263 175.6703 51 R 4.5844 8.6474 123.0329 55.4209 34.5926 173.8007 52 G 4.1970 9.0781 107.2145 42.9492 0.0000 173.2443 53 R 4.2306 8.3375 119.4500 57.6824 30.3880 177.5264 54 G 4.2648 9.5152 110.3798 45.3063 0.0000 174.9167 55 F 4.1106 8.6782 122.3015 62.0655 39.0339 176.9280 56 M 4.3278 8.2313 115.3006 58.1026 32.2351 177.1770 57 I 3.7595 7.5684 118.2205 62.9219 38.4840 177.2688 58 W 4.2567 8.2511 119.7677 59.0566 28.8604 177.9258 59 H 3.8798 8.1456 118.3876 58.8571 29.5858 175.3042 60 P 4.2238 0.0000 0.0000 65.4209 31.1415 177.9570 61 K 3.4785 7.5589 119.4926 59.7443 31.9763 178.4683 62 M 4.0858 7.9540 118.6476 58.5505 31.7982 178.5132 63 D 4.2068 7.7190 118.7688 57.1369 40.8307 178.6493 64 E 3.9069 7.7183 118.7809 59.3780 29.5626 178.5937 65 Y 4.4942 7.7239 116.7739 61.6914 38.0307 178.8299 66 M 4.1279 8.2029 119.4773 58.1028 31.9673 178.4110 67 E 3.8459 8.0937 119.5591 59.2649 29.9228 178.5522 68 E 3.6717 8.3161 119.3433 59.2296 29.7200 178.7351 69 I 3.7691 8.2954 120.1117 64.6641 37.1884 178.1980 70 D 4.4890 8.7773 120.0644 57.0061 40.5267 179.1071 71 G 3.4628 7.7848 106.4137 47.9522 0.0000 175.3002 72 Y 4.2736 7.1605 119.1696 60.5692 37.9142 178.1453 73 L 4.0003 8.0322 121.2799 58.6476 42.2132 178.7503 74 D 4.3130 8.2608 117.5617 57.2304 41.2060 177.7079 75 E 3.9151 8.1707 119.9265 59.5843 29.6493 178.7450 76 M 3.9891 8.4917 119.4088 58.0774 32.0143 178.8967 77 S 4.1729 8.1414 114.6132 61.5094 63.1407 176.4101 78 E 3.9302 8.1714 121.7669 58.6148 29.1376 179.1984 79 R 3.8107 7.9905 119.2095 59.2304 30.0621 178.2670 80 L 3.9297 7.8840 120.1135 58.1682 41.9901 178.9410 81 I 3.8312 8.3244 120.1401 64.8496 36.8449 178.4977 82 T 3.8669 7.9407 115.5120 66.5356 68.3835 175.9639 83 L 4.3078 8.0697 118.2198 55.2118 41.6446 177.6529 84 G 3.8174 8.3370 107.8970 45.5548 0.0000 173.7988 85 G 3.8654 7.9235 109.1689 43.5479 0.0000 174.0657 86 A 4.4834 7.9042 121.0791 49.0947 19.4946 174.0053 87 P 4.4639 0.0000 0.0000 62.7158 32.1821 177.0147 88 F 4.7182 8.3852 121.1095 58.9882 39.2978 176.3482 89 S 4.8351 9.0053 117.6659 57.5700 64.2189 174.3036 90 T 4.4836 6.9705 110.2271 59.4760 72.7667 174.0037 91 L 4.0219 8.3438 122.7776 57.9770 41.6846 179.7707 92 K 3.8356 7.8412 118.8334 59.6448 32.1898 178.4860 93 E 3.7031 7.8057 118.6689 59.1809 29.2106 179.4140 94 F 4.3815 7.5642 117.6840 60.7055 38.8437 177.6367 95 S 4.0883 8.1692 111.4987 61.5372 62.3077 175.6965 96 E 4.0482 7.8901 119.8982 59.3544 29.2768 178.5703 97 N 4.4751 7.7288 114.8364 54.0741 39.3146 176.0695 98 S 4.5915 7.6050 114.6906 58.4766 62.9316 173.9099 99 Q 4.2365 9.0002 124.8814 56.4518 29.1109 176.3462 100 L 4.0317 7.4225 118.7326 53.8893 42.4510 176.3639 101 K 4.6321 8.1832 120.9435 54.6225 34.7439 175.4301 102 E 4.7401 8.4128 119.6420 54.6801 32.4028 175.8215 103 V 4.5184 7.7926 113.6210 58.8172 35.4669 175.5911 104 L 3.9632 8.2995 121.3239 54.5050 41.9389 177.8826 105 G 2.3472 8.1490 111.8324 45.3726 0.0000 172.3999 106 D 4.4570 7.5829 121.7407 52.2560 43.4854 175.6977 107 Y 4.8155 8.6344 124.2165 60.3510 38.1335 177.1423 108 N 4.5880 8.4963 116.2643 54.7491 39.0413 175.9081 109 V 3.7741 7.2008 117.9602 63.2654 32.1227 176.4149 110 T 4.2477 8.7568 117.3324 61.1523 70.8322 175.6990 111 I 3.6629 8.3328 123.1639 65.0220 37.1569 178.2418 112 E 3.8211 8.1925 118.4261 59.7085 29.1842 179.3470 113 E 3.9466 8.1001 118.3669 59.3152 29.4232 179.4348 114 Q 3.9077 8.2363 118.2593 58.9661 28.7900 178.8077 115 L 3.6341 7.8571 119.7804 57.5773 41.4992 179.4030 116 A 3.9070 8.2081 121.0863 55.1086 18.2694 179.7873 117 R 3.9085 8.0788 116.7246 59.3737 30.1757 179.3599 118 V 3.1533 7.6649 117.9080 65.7896 31.4528 177.8359 119 V 3.4328 7.7197 118.2829 66.2070 31.2672 177.4355 120 E 3.9173 8.1342 118.0576 59.7051 29.2984 179.6065 121 V 3.6558 7.6562 117.7635 66.1864 31.5242 178.1265 122 F 4.3859 8.3180 117.3168 60.7170 38.7746 177.6800 123 R 3.9456 8.5391 118.1879 59.5541 29.8442 178.4109 124 Y 3.9304 8.1633 118.9403 60.7247 38.8499 178.1477 125 L 3.3693 8.2039 119.8262 57.4789 41.5613 179.3015 126 A 3.8786 8.1655 120.8542 55.0731 18.2729 179.6140 127 A 3.7654 7.7204 119.2584 55.0627 18.4507 179.6241 128 L 3.6361 7.5124 119.2749 58.1637 41.9684 179.2963 129 F 4.4558 8.2999 118.2034 60.2800 38.7791 177.2576 130 Q 3.9845 8.3903 122.0247 59.9896 28.8322 179.5207 131 K 4.0219 8.0552 124.5640 59.5478 31.7245 180.9808 132 G 2.3810 7.5972 106.7158 47.0914 0.0000 175.4241 133 F 3.9950 8.0867 123.3514 61.0646 39.3700 176.7914 134 D 4.4477 8.3534 118.3958 57.4608 40.6795 179.0532 135 V 3.5570 7.7021 118.7063 66.1054 31.4427 178.2280 136 S 4.2682 7.8711 115.1926 60.7420 62.7987 175.7451 137 D 4.0905 8.1063 121.9294 57.2442 40.7569 178.0355 138 E 3.9447 8.2021 118.4633 59.0998 29.6958 177.9832 139 E 4.2566 8.1025 116.9738 56.4275 29.7454 177.2744 140 G 3.7681 7.6523 106.7548 46.8379 0.0000 174.6928 141 D 4.6208 7.9067 121.7890 52.7950 39.6728 176.1816 142 S 4.1235 8.0668 120.5087 60.3329 63.6992 176.5835 143 V 3.4765 7.6471 121.6676 66.3347 31.4839 177.8925 144 T 3.7468 7.9389 115.1087 66.5155 68.2324 175.8700 145 N 4.3805 8.1253 120.2921 56.1253 38.7566 176.4105 146 D 4.3232 8.0212 119.1217 57.2427 41.4059 177.8661 147 I 3.5255 7.4341 120.0630 64.7001 37.1376 178.3198 148 F 4.0366 7.7746 117.9793 60.3579 38.6939 177.2483 149 N 4.3655 8.5438 116.7491 56.7273 38.7953 176.9808 150 V 3.5344 8.0294 119.5760 66.0412 31.6359 177.7868 151 A 3.4423 7.4434 121.5450 54.1159 17.8424 179.5047 152 K 4.0376 8.0113 117.8874 59.5346 32.3064 178.6023 153 A 3.9813 7.9188 121.1023 55.5604 18.2702 179.6608 154 S 4.0671 7.9339 110.9652 61.5384 62.3853 176.3851 155 I 3.5891 7.9017 122.6326 64.3259 36.7642 178.2913 156 E 4.0149 8.5463 119.8088 59.1446 29.3877 179.2072 157 K 4.2095 8.1345 119.7234 59.9951 32.2457 178.4176 158 H 4.4127 8.3903 116.4353 59.0809 28.6155 177.5690 159 I 3.8144 8.2208 121.7723 64.3057 36.9143 177.9236 160 W 4.4659 8.4961 128.9963 61.0872 30.4208 177.9633 161 M 3.2971 7.7427 117.7108 57.9775 31.3352 178.6826 162 L 3.9937 8.1144 119.1492 58.0918 41.8650 179.4610 163 Q 3.9656 8.2727 117.6775 59.0375 28.5824 179.0980 164 A 4.1226 8.2720 121.8257 55.2656 18.2254 179.1697 165 E 3.9710 8.3170 116.9131 59.2718 29.7241 178.1122 166 L 4.4397 7.7654 116.3161 54.2325 41.7377 177.1384 167 G 3.9256 8.1737 106.8714 46.2330 0.0000 173.6459 168 Q 4.6431 8.2909 116.8019 53.1584 32.3723 175.4179 169 A 4.3840 8.3293 122.3528 51.4136 19.2097 176.3529 170 P 4.3787 0.0000 0.0000 63.9509 31.9903 177.3373 171 K 3.8369 8.0994 115.1374 57.3219 29.3507 175.0728 172 L 4.1848 7.8185 121.5410 55.2124 41.4962 177.7940 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 23 A 8.12 4.34 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 24 D 8.62 4.47 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 25 S 8.94 4.16 0.00 3.93 3.97 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 0.00 0.00 0.00 26 K 8.15 3.91 0.00 2.00 1.85 0.00 1.65 0.00 0.00 1.94 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.52 7.81 27 A 7.56 4.04 1.36 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 0.00 0.00 0.00 28 V 8.12 3.68 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 0.89 0.00 0.00 0.83 0.00 0.00 29 L 8.33 4.18 0.00 1.95 1.81 0.92 0.21 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 30 N 8.36 4.37 0.00 2.85 2.65 0.00 0.00 6.89 6.02 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 31 Q 8.36 4.27 0.00 2.47 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.74 0.00 32 A 8.59 4.22 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 0.00 0.00 0.00 0.00 0.00 33 V 7.95 3.59 2.50 0.00 0.00 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 0.00 0.00 1.10 0.00 0.00 34 A 8.30 4.14 1.53 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 0.00 0.00 35 D 8.57 4.38 0.00 2.89 2.98 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 36 L 8.68 4.17 0.00 1.78 1.80 1.19 1.41 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 37 S 7.84 3.91 0.00 3.31 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 38 V 7.85 3.59 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 0.98 0.00 0.00 1.02 0.00 0.00 39 A 8.48 4.03 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 40 H 8.37 4.00 0.00 3.34 3.43 0.00 5.80 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 41 S 7.86 4.12 0.00 3.94 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 42 I 7.87 3.67 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.69 0.86 0.00 0.00 43 L 8.00 3.91 0.00 1.74 1.67 1.10 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.08 3.59 0.00 3.09 2.51 0.00 5.59 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 45 Q 7.96 4.23 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 46 V 8.05 3.63 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 0.95 0.00 0.00 0.98 0.00 0.00 47 H 8.26 4.09 0.00 3.03 3.32 0.00 6.00 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 48 W 8.28 4.72 0.00 3.65 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 49 Y 8.66 4.44 0.00 3.19 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 50 M 7.54 4.42 0.00 2.34 2.40 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.89 0.00 51 R 8.65 4.58 0.00 2.06 1.82 0.00 3.50 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.69 0.00 52 G 9.08 4.20 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 0.00 53 R 8.34 4.23 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 54 G 9.52 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 0.00 0.00 0.00 0.00 55 F 8.68 4.11 0.00 3.39 3.16 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 56 M 8.23 4.33 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 57 I 7.57 3.76 1.67 0.00 0.00 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 1.25 0.54 0.28 0.00 0.00 58 W 8.25 4.26 0.00 3.50 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 59 H 8.15 3.88 0.00 1.75 2.49 0.00 5.95 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.22 0.00 2.16 2.21 0.00 3.49 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 61 K 7.56 3.48 0.00 1.47 1.87 0.00 0.88 0.00 0.00 1.19 0.00 0.00 2.57 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.15 0.56 7.81 62 M 7.95 4.09 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 3.07 0.00 63 D 7.72 4.21 0.00 2.78 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 64 E 7.72 3.91 0.00 1.89 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 0.00 2.30 2.24 0.00 65 Y 7.72 4.49 0.00 3.23 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 M 8.20 4.13 0.00 1.87 1.94 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.24 0.00 67 E 8.09 3.85 0.00 2.25 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 2.26 2.32 0.00 68 E 8.32 3.67 0.00 2.05 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 1.90 2.00 0.00 69 I 8.30 3.77 2.04 0.00 0.00 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 1.86 1.10 1.02 0.00 0.00 70 D 8.78 4.49 0.00 2.83 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 71 G 7.78 3.46 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 0.00 72 Y 7.16 4.27 0.00 3.20 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 73 L 8.03 4.00 0.00 1.95 1.93 0.90 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.26 4.31 0.00 2.75 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 75 E 8.17 3.92 0.00 2.13 2.19 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 2.20 2.29 0.00 76 M 8.49 3.99 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.03 0.00 77 S 8.14 4.17 0.00 4.10 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 0.00 78 E 8.17 3.93 0.00 2.17 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 2.32 2.31 0.00 79 R 7.99 3.81 0.00 1.93 1.97 0.00 3.10 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 80 L 7.88 3.93 0.00 1.86 1.74 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.32 3.83 1.86 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 1.52 0.71 0.90 0.00 0.00 82 T 7.94 3.87 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 83 L 8.07 4.31 0.00 1.56 1.69 0.96 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 84 G 8.34 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 0.00 0.00 0.00 85 G 7.92 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 0.00 0.00 0.00 86 A 7.90 4.48 1.18 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 87 P 0.00 4.46 0.00 2.12 2.03 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.25 0.00 88 F 8.39 4.72 0.00 3.39 2.98 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 89 S 9.01 4.84 0.00 3.99 3.94 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 90 T 6.97 4.48 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 91 L 8.34 4.02 0.00 1.71 1.83 1.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.84 3.84 0.00 1.76 1.72 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 93 E 7.81 3.70 0.00 1.91 1.56 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 2.34 2.28 0.00 94 F 7.56 4.38 0.00 3.24 2.98 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 95 S 8.17 4.09 0.00 4.03 3.88 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 96 E 7.89 4.05 0.00 1.90 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 2.30 2.60 0.00 97 N 7.73 4.48 0.00 2.28 2.69 0.00 0.00 7.02 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 98 S 7.61 4.59 0.00 3.93 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 99 Q 9.00 4.24 0.00 1.75 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.62 0.00 0.00 0.00 0.00 0.00 2.61 2.72 0.00 100 L 7.42 4.03 0.00 1.50 1.42 0.91 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.18 4.63 0.00 1.65 1.65 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.31 7.81 102 E 8.41 4.74 0.00 1.89 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 2.17 2.26 0.00 103 V 7.79 4.52 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.30 3.96 0.00 1.54 1.49 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.15 2.35 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 0.00 106 D 7.58 4.46 0.00 2.54 2.36 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 0.00 107 Y 8.63 4.82 0.00 3.13 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 8.50 4.59 0.00 2.89 2.91 0.00 0.00 6.90 7.04 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 0.00 109 V 7.20 3.77 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 0.76 0.00 0.00 0.90 0.00 0.00 110 T 8.76 4.25 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 0.00 111 I 8.33 3.66 1.88 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.96 0.90 0.00 0.00 112 E 8.19 3.82 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 113 E 8.10 3.95 0.00 2.17 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 2.32 0.00 114 Q 8.24 3.91 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 115 L 7.86 3.63 0.00 1.49 1.26 -0.35 -0.08 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 0.00 116 A 8.21 3.91 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 0.00 117 R 8.08 3.91 0.00 1.95 1.90 0.00 3.08 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 118 V 7.66 3.15 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 -0.02 0.00 0.00 0.79 0.00 0.00 119 V 7.72 3.43 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 0.99 0.00 0.00 0.91 0.00 0.00 120 E 8.13 3.92 0.00 2.22 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 2.31 2.44 0.00 121 V 7.66 3.66 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 1.25 0.00 0.00 0.91 0.00 0.00 122 F 8.32 4.39 0.00 3.25 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 0.00 123 R 8.54 3.95 0.00 2.03 2.02 0.00 3.15 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 124 Y 8.16 3.93 0.00 3.11 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.20 3.37 0.00 1.57 0.78 1.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.17 3.88 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 0.00 127 A 7.72 3.77 1.18 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 0.00 128 L 7.51 3.64 0.00 1.02 1.26 0.89 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.30 4.46 0.00 3.10 3.02 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 0.00 130 Q 8.39 3.98 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 131 K 8.06 4.02 0.00 1.82 1.81 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.33 7.81 132 G 7.60 2.38 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 0.00 133 F 8.09 3.99 0.00 3.21 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 0.00 134 D 8.35 4.45 0.00 2.86 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 0.00 135 V 7.70 3.56 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 1.05 0.00 0.00 0.94 0.00 0.00 136 S 7.87 4.27 0.00 4.31 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 0.00 137 D 8.11 4.09 0.00 2.49 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 0.00 138 E 8.20 3.94 0.00 2.04 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 2.32 2.39 0.00 139 E 8.10 4.26 0.00 1.98 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 2.32 2.60 0.00 140 G 7.65 3.77 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 0.00 0.00 0.00 141 D 7.91 4.62 0.00 2.77 2.55 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 0.00 142 S 8.07 4.12 0.00 4.03 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 0.00 143 V 7.65 3.48 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.94 3.75 4.42 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 1.28 0.00 0.00 145 N 8.13 4.38 0.00 2.65 2.87 0.00 0.00 6.46 7.86 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 0.00 146 D 8.02 4.32 0.00 2.99 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 0.00 147 I 7.43 3.53 1.61 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 1.39 0.89 0.50 0.00 0.00 148 F 7.77 4.04 0.00 3.30 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 0.00 149 N 8.54 4.37 0.00 3.27 3.00 0.00 0.00 6.86 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 0.00 150 V 8.03 3.53 2.03 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 0.99 0.00 0.00 0.93 0.00 0.00 151 A 7.44 3.44 -0.26 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 0.00 152 K 8.01 4.04 0.00 2.12 2.00 0.00 1.63 0.00 0.00 1.57 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.52 7.81 153 A 7.92 3.98 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 0.00 0.00 154 S 7.93 4.07 0.00 3.98 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 0.00 155 I 7.90 3.59 1.89 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.90 0.72 0.00 0.00 156 E 8.55 4.01 0.00 2.08 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 2.35 2.48 0.00 157 K 8.13 4.21 0.00 2.06 2.02 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.24 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.72 1.94 7.81 158 H 8.39 4.41 0.00 3.44 3.50 0.00 5.69 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 0.00 159 I 8.22 3.81 2.16 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.98 1.00 0.00 0.00 160 W 8.50 4.47 0.00 3.42 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 0.00 161 M 7.74 3.30 0.00 1.93 2.02 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.14 0.00 162 L 8.11 3.99 0.00 1.69 1.60 0.80 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.27 3.97 0.00 2.39 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.75 0.00 164 A 8.27 4.12 1.34 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 0.00 0.00 0.00 165 E 8.32 3.97 0.00 2.19 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 0.00 2.32 2.43 0.00 166 L 7.77 4.44 0.00 1.73 1.63 0.80 0.71 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 0.00 167 G 8.17 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 0.00 168 Q 8.29 4.64 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 169 A 8.33 4.38 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 0.00 170 P 0.00 4.38 0.00 2.14 2.31 0.00 3.90 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.45 0.00 171 K 8.10 3.84 0.00 1.91 1.87 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.56 7.81 172 L 7.82 4.18 0.00 1.63 1.59 0.98 0.96 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