NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3671 8.1227 123.5929 51.8809 20.0813 177.7057 3 N 4.2495 8.6727 120.5381 56.0141 38.9816 175.6831 4 I 3.6929 8.2029 123.0784 64.3215 37.6344 177.5412 5 A 4.1753 7.8870 121.1836 54.8677 18.2792 179.8310 6 V 3.5025 7.6416 116.3825 66.2449 31.7189 178.0036 7 Q 3.8609 8.1037 117.9991 59.1146 28.6056 179.2180 8 R 3.9038 8.0262 119.2235 59.7240 30.0891 178.5900 9 I 3.7941 7.9207 119.4312 64.1949 37.0379 178.5022 10 K 3.4544 7.7967 119.3554 59.3772 31.8576 179.2432 11 R 3.9002 7.9971 118.7948 59.6200 29.6234 178.3752 12 E 4.1274 8.4752 118.1854 58.7554 29.4443 179.0039 13 F 4.1202 8.7163 121.5191 61.4361 39.5598 177.4202 14 K 4.0831 8.3283 118.0956 59.2343 31.5509 178.9506 15 E 3.9239 8.0908 119.1089 59.1952 29.7694 178.8475 16 V 3.6475 7.7350 118.0927 66.0412 31.4167 177.6563 17 L 3.8249 7.3820 117.3347 57.8647 41.6512 179.1115 18 K 4.3336 7.7577 114.6761 55.7071 32.8851 177.3376 19 S 4.4180 7.4688 115.4855 57.5057 64.1774 174.9863 20 E 4.2798 8.6682 123.5559 59.0645 29.3541 178.9507 21 E 4.1118 8.1509 118.1202 59.7212 29.4875 179.2733 22 T 4.4543 7.9836 116.7572 66.2738 68.7146 176.9182 23 S 4.1645 8.1485 115.7727 60.8500 62.7578 175.6425 24 K 4.2868 8.1766 120.0540 55.6058 32.4005 176.0678 25 N 4.2993 8.1674 116.1259 54.6262 36.6878 175.4911 26 Q 4.5095 8.8746 118.9717 57.5752 30.7368 176.6299 27 I 5.3395 7.4932 110.5919 59.2879 41.6983 174.3241 28 K 4.9229 8.6486 121.2397 56.1584 36.3060 174.7088 29 V 4.9510 7.9212 119.4342 60.2901 34.2476 174.1479 30 D 5.3340 9.6146 123.9008 52.4989 44.3171 174.8372 31 L 4.3541 8.5409 122.6887 54.7327 42.7097 175.4705 32 V 4.2465 8.0932 125.2570 64.0524 33.3120 175.3269 33 D 4.8627 7.5416 119.3491 50.8536 41.3718 176.4888 34 E 3.7150 8.7137 122.3157 59.2871 29.5009 177.3545 35 N 4.6661 8.0619 112.8831 52.6694 39.0202 174.9579 36 F 3.6368 7.5315 115.8961 58.6239 37.1345 175.9151 37 T 4.3623 8.3133 111.7807 62.4374 70.2057 173.8754 38 E 5.1120 9.1605 124.1399 54.5617 33.3030 174.0765 39 L 5.1604 9.1018 125.5684 52.8821 46.7253 175.2356 40 R 4.8677 9.0223 120.2605 54.7888 32.8430 174.6846 41 G 4.3514 8.9740 114.1002 45.1216 0.0000 171.8795 42 E 5.4391 8.9364 121.5461 54.2717 33.3861 174.0273 43 I 5.2103 8.7548 119.8648 58.9152 40.6392 174.9098 44 A 4.7718 9.0550 127.3539 51.4790 19.3710 177.6024 45 G 3.9950 9.4232 109.0871 45.8005 0.0000 172.2950 46 P 4.6426 0.0000 0.0000 61.5647 31.6642 174.6799 47 P 4.4501 0.0000 0.0000 63.6701 32.0570 175.4474 48 D 4.4178 8.7801 116.8934 55.7089 38.9331 173.4542 49 T 4.7578 7.1870 103.2551 59.1947 72.1318 172.8232 50 P 4.3056 0.0000 0.0000 64.4286 31.5029 177.8962 51 Y 4.7253 7.0727 116.1330 59.0019 38.4129 175.3002 52 E 4.3797 7.6514 120.9874 57.9267 29.8310 177.0271 53 G 4.0339 9.3228 113.9348 44.9887 0.0000 173.0669 54 G 4.1067 8.2981 107.1732 45.0079 0.0000 173.0412 55 R 5.1806 8.5393 119.7098 54.2824 33.4804 174.7550 56 Y 4.6278 8.8977 121.3037 56.2772 40.6263 175.1207 57 Q 4.8494 9.1086 124.5192 55.4184 30.7671 175.2646 58 L 4.8937 8.5306 121.9920 52.7412 45.5762 175.3555 59 E 4.3540 9.0800 126.2513 55.9439 31.0053 175.2826 60 I 4.8847 8.7561 127.5288 59.4366 40.5856 174.5258 61 K 4.8761 8.8927 126.3904 54.5520 35.5230 175.4849 62 I 4.3162 8.5599 126.8660 58.8512 37.7380 174.2106 63 P 4.4733 0.0000 0.0000 62.1360 31.9726 177.3928 64 E 4.0288 8.7441 118.8158 59.4722 29.5877 178.2481 65 T 4.5090 7.8494 106.8942 61.4103 69.3750 173.8144 66 Y 4.7776 7.9651 123.1949 57.2273 39.0732 173.7778 67 P 3.6674 0.0000 0.0000 62.4212 31.5639 177.3627 68 F 4.5805 7.6804 119.4426 59.1085 39.6231 175.6087 69 N 5.0217 7.7166 117.4419 50.2213 40.9005 172.5046 70 P 2.9700 0.0000 0.0000 60.9052 32.0927 174.3081 71 P 4.1788 0.0000 0.0000 63.0039 32.2015 176.4436 72 K 4.2282 8.8368 123.3928 55.6894 32.8767 175.8232 73 V 4.7855 8.2172 125.2025 60.9756 33.9052 174.7973 74 R 4.8621 8.3843 126.2475 54.4005 34.0535 173.9769 75 F 4.5170 9.3083 125.3454 58.1238 39.3392 176.2676 76 I 3.8348 8.7198 125.7998 64.6782 37.6897 177.0385 77 T 4.2084 8.0201 118.6651 62.8845 68.7021 175.1872 78 K 4.2129 8.4916 126.6167 56.6789 32.7548 176.2903 79 I 4.8794 8.2980 120.8085 59.7674 40.7592 174.3349 80 W 4.1959 8.9207 135.0000 56.3336 29.9554 174.5402 81 H 4.9561 7.8176 124.6546 53.8133 32.5741 172.5189 82 P 4.0334 0.0000 0.0000 65.3789 31.1592 177.1596 83 N 4.8507 8.2429 114.2669 52.5636 38.8276 173.7765 84 I 4.8234 7.4097 118.9813 58.8924 40.6486 175.3662 85 S 4.0836 9.0850 120.5045 58.4409 62.5213 175.3605 86 S 4.4882 9.1045 123.4308 60.8741 63.3389 175.8933 87 V 3.9587 8.0117 120.3418 65.1919 31.5664 176.5524 88 T 4.3181 8.1526 106.9587 60.7784 69.9486 175.5833 89 G 4.2410 8.6496 109.9316 45.9438 0.0000 173.2012 90 A 4.4464 7.5930 122.2032 52.3368 19.6687 176.6982 91 I 4.8023 8.2837 120.8874 59.6290 39.7679 174.6061 92 C 4.5214 9.0211 128.5798 58.0985 32.6073 172.9889 93 L 4.2773 8.2563 125.1266 53.1030 44.8879 174.4671 94 D 4.4724 9.0487 127.0472 57.7543 40.7083 178.9095 95 I 4.1750 7.8181 111.9899 63.0582 37.5419 177.0328 96 L 4.4601 7.9242 119.3358 53.3104 42.3221 176.3364 97 K 4.5355 8.8364 118.8151 56.7809 31.7746 178.9355 98 D 4.5806 9.3542 118.0577 56.1119 41.0817 176.4810 99 Q 4.4792 7.9429 116.3784 54.9634 29.0774 175.3627 100 W 4.6779 8.1128 127.6028 57.0726 31.2395 175.1025 101 A 4.2375 7.0052 126.0262 49.6111 21.2257 176.9081 102 A 3.8068 8.5493 124.2182 54.1399 18.5044 178.2823 103 A 4.2036 7.3749 115.8690 52.7866 19.1797 177.4824 104 M 4.0928 7.2570 117.0292 55.1442 32.7131 176.5606 105 T 5.1501 7.9790 113.6967 58.9078 72.8630 175.4393 106 L 4.0189 8.8132 122.1495 58.2093 41.7082 179.8277 107 R 3.8756 8.0681 117.7122 59.9394 29.9726 178.1396 108 T 3.8868 7.8577 115.2910 66.8214 68.4896 176.5396 109 V 3.6683 7.9764 119.7625 66.1232 31.5947 178.0864 110 L 3.9934 8.0819 118.6721 57.8635 41.4002 179.5794 111 L 4.0644 8.0962 118.9267 57.5954 41.4974 179.5332 112 S 4.1073 8.1006 113.4172 61.2878 62.3689 176.1983 113 L 4.0665 8.1003 121.8167 57.6664 41.1115 179.2014 114 Q 3.9765 8.0343 118.3705 59.3086 28.9804 178.0370 115 A 4.1543 8.2800 121.8151 54.8210 18.3256 179.2753 116 L 3.9205 8.2452 119.5112 58.4921 41.9445 179.1800 117 L 3.9475 7.8292 117.2770 57.4418 41.6437 178.5141 118 A 4.7813 7.5366 116.9551 51.6545 19.7694 177.9742 119 A 4.4540 7.7383 120.2348 51.2353 20.3605 176.0810 120 A 4.3693 8.1399 123.6472 52.0097 19.7869 177.6742 121 E 4.4390 8.9008 122.1744 53.2232 29.4473 174.8289 122 P 4.0353 0.0000 0.0000 65.0697 31.7596 177.8474 123 D 4.5498 7.9155 115.9346 55.0255 41.2280 175.8420 124 D 4.7590 7.6268 117.8920 51.9320 40.9430 173.0487 125 P 4.5256 0.0000 0.0000 62.6354 32.7517 176.7396 126 Q 4.1976 8.7493 120.2972 56.9497 29.9830 175.5830 127 D 4.6029 7.4464 116.0424 51.1804 41.9466 175.1473 128 A 4.1407 8.2122 128.1127 54.4567 18.5673 179.0906 129 V 3.4784 7.6089 116.5444 66.1982 31.6939 178.0823 130 V 3.2679 7.3490 117.3634 65.9894 31.3823 177.9314 131 A 3.8246 8.3163 120.6295 55.0969 18.1290 179.4021 132 N 4.3218 8.4189 115.4497 56.2414 38.2070 177.5428 133 Q 3.9580 8.2995 121.0634 59.3193 29.0586 177.1118 134 Y 3.5713 7.8868 119.7054 60.8430 38.6623 178.3984 135 K 4.1516 7.7928 116.9930 59.2882 32.3480 178.8333 136 Q 4.4399 8.3866 116.5572 56.4312 30.7460 176.2291 137 N 5.0431 8.6064 118.4784 50.4364 40.1786 172.4513 138 P 4.1829 0.0000 0.0000 65.2747 31.8358 177.6591 139 E 3.9302 8.0672 117.5697 59.5705 29.7789 178.5838 140 M 4.0816 8.3801 118.8358 58.1466 31.8724 178.4318 141 F 4.5779 8.2557 122.2502 60.7123 39.6122 177.3636 142 K 3.7327 8.3320 118.0383 59.5845 31.9172 179.0773 143 Q 3.9838 7.9415 119.7160 59.4292 28.8108 178.7552 144 T 3.5481 7.5931 116.2514 66.3830 68.4707 176.5783 145 A 4.0510 7.5471 122.8266 55.4321 18.3430 179.9644 146 R 4.1253 8.2481 118.1015 58.7859 30.0539 179.0848 147 L 4.0379 7.9681 120.2540 57.8499 42.1104 178.9655 148 W 4.1561 8.9191 119.3194 59.7834 29.0079 178.3659 149 A 4.5056 8.3515 120.8486 55.1659 17.5619 179.3342 150 H 4.4587 7.9288 117.1508 58.9495 30.1383 177.4151 151 V 3.4358 7.9059 118.9700 65.6013 31.3754 176.6513 152 Y 4.6683 8.3608 114.2744 58.1111 39.2449 176.4327 153 A 4.3355 7.6477 120.5764 51.3661 19.4367 177.0218 154 G 3.8624 8.2578 103.8517 47.2573 0.0000 174.3086 155 A 4.5625 8.0048 128.0719 51.5772 18.4014 178.3327 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 2 A 8.12 4.37 1.39 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 3 N 8.67 4.25 0.00 2.94 2.84 0.00 0.00 7.22 6.90 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 4 I 8.20 3.69 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.79 0.94 0.00 0.00 5 A 7.89 4.18 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 0.00 0.00 0.00 0.00 0.00 6 V 7.64 3.50 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 0.97 0.00 0.00 1.05 0.00 0.00 7 Q 8.10 3.86 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.55 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 8 R 8.03 3.90 0.00 2.03 2.23 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.75 0.00 9 I 7.92 3.79 1.87 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 1.79 0.67 1.11 0.00 0.00 10 K 7.80 3.45 0.00 1.67 1.53 0.00 1.43 0.00 0.00 1.25 0.00 0.00 2.65 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.30 0.21 7.81 11 R 8.00 3.90 0.00 1.87 2.16 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 12 E 8.48 4.13 0.00 2.16 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 0.00 2.39 2.52 0.00 13 F 8.72 4.12 0.00 3.40 3.33 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 14 K 8.33 4.08 0.00 2.06 1.90 0.00 1.77 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.80 7.81 15 E 8.09 3.92 0.00 2.10 2.16 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 2.32 2.33 0.00 16 V 7.74 3.65 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 0.92 0.00 0.00 0.92 0.00 0.00 17 L 7.38 3.82 0.00 1.85 1.75 1.13 0.62 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 18 K 7.76 4.33 0.00 1.82 1.84 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.14 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.55 7.81 19 S 7.47 4.42 0.00 4.16 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 0.00 20 E 8.67 4.28 0.00 2.06 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 2.38 2.27 0.00 21 E 8.15 4.11 0.00 2.09 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 2.41 2.59 0.00 22 T 7.98 4.45 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 1.18 0.00 0.00 23 S 8.15 4.16 0.00 4.06 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 24 K 8.18 4.29 0.00 1.94 1.90 0.00 2.11 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.55 7.81 25 N 8.17 4.30 0.00 2.87 2.92 0.00 0.00 6.91 7.48 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 26 Q 8.87 4.51 0.00 2.12 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.70 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 27 I 7.49 5.34 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 1.39 0.70 0.92 0.00 0.00 28 K 8.65 4.92 0.00 1.77 1.87 0.00 1.25 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.31 1.35 7.81 29 V 7.92 4.95 1.94 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 0.98 0.00 0.00 30 D 9.61 5.33 0.00 2.67 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 31 L 8.54 4.35 0.00 1.14 1.34 -0.48 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.09 4.25 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 0.79 0.00 0.00 0.89 0.00 0.00 33 D 7.54 4.86 0.00 2.76 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 34 E 8.71 3.71 0.00 1.87 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 2.29 2.34 0.00 35 N 8.06 4.67 0.00 3.03 2.86 0.00 0.00 6.94 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 36 F 7.53 3.64 0.00 3.13 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.31 4.36 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 1.25 0.00 0.00 38 E 9.16 5.11 0.00 1.90 1.69 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 2.14 2.40 0.00 39 L 9.10 5.16 0.00 1.59 1.72 1.07 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 40 R 9.02 4.87 0.00 1.81 1.74 0.00 3.21 0.00 0.00 3.16 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 41 G 8.97 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 42 E 8.94 5.44 0.00 2.01 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 2.22 2.38 0.00 43 I 8.75 5.21 1.94 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 1.20 0.99 0.91 0.00 0.00 44 A 9.05 4.77 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 45 G 9.42 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 46 P 0.00 4.64 0.00 2.17 2.08 0.00 3.94 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.17 0.00 47 P 0.00 4.45 0.00 2.25 2.22 0.00 3.91 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 48 D 8.78 4.42 0.00 2.88 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 49 T 7.19 4.76 4.27 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 1.37 0.00 0.00 50 P 0.00 4.31 0.00 1.56 1.87 0.00 2.97 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.94 0.00 51 Y 7.07 4.73 0.00 3.14 3.19 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 52 E 7.65 4.38 0.00 2.21 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 2.39 2.34 0.00 53 G 9.32 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 54 G 8.30 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.54 5.18 0.00 1.57 1.79 0.00 3.13 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 56 Y 8.90 4.63 0.00 3.12 3.27 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 57 Q 9.11 4.85 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.34 0.00 58 L 8.53 4.89 0.00 1.39 1.26 0.68 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 59 E 9.08 4.35 0.00 2.02 1.89 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 2.26 2.26 0.00 60 I 8.76 4.88 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.59 0.83 0.00 0.00 61 K 8.89 4.88 0.00 1.59 1.60 0.00 1.61 0.00 0.00 1.61 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.32 7.81 62 I 8.56 4.32 1.72 0.00 0.00 0.49 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 0.51 0.53 0.00 0.00 63 P 0.00 4.47 0.00 2.22 2.15 0.00 3.55 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 2.07 2.04 0.00 64 E 8.74 4.03 0.00 2.01 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 0.00 2.35 2.33 0.00 65 T 7.85 4.51 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 1.28 0.00 0.00 66 Y 7.97 4.78 0.00 2.86 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 67 P 0.00 3.67 0.00 1.78 0.94 0.00 2.62 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.36 0.00 68 F 7.68 4.58 0.00 3.22 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 69 N 7.72 5.02 0.00 2.72 2.61 0.00 0.00 6.93 8.03 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 70 P 0.00 2.97 0.00 1.68 1.24 0.00 3.58 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.94 0.00 71 P 0.00 4.18 0.00 1.77 1.82 0.00 2.86 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.80 0.00 72 K 8.84 4.23 0.00 1.62 1.70 0.00 1.57 0.00 0.00 1.53 0.00 0.00 2.76 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.29 7.81 73 V 8.22 4.79 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 0.63 0.00 0.00 0.90 0.00 0.00 74 R 8.38 4.86 0.00 1.85 1.68 0.00 3.32 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 75 F 9.31 4.52 0.00 3.03 3.25 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 76 I 8.72 3.83 2.00 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 1.23 0.47 0.92 0.00 0.00 77 T 8.02 4.21 4.62 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 1.29 0.00 0.00 78 K 8.49 4.21 0.00 0.79 1.58 0.00 1.37 0.00 0.00 0.61 0.00 0.00 2.48 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.28 1.04 7.81 79 I 8.30 4.88 1.94 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.48 0.33 0.00 0.00 80 W 8.92 4.20 0.00 2.77 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 81 H 7.82 4.96 0.00 2.93 2.80 0.00 5.74 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 P 0.00 4.03 0.00 1.91 1.89 0.00 3.41 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.98 0.00 83 N 8.24 4.85 0.00 2.72 2.95 0.00 0.00 6.92 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 84 I 7.41 4.82 1.54 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.23 0.66 0.00 0.00 85 S 9.09 4.08 0.00 3.77 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 86 S 9.10 4.49 0.00 4.08 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 V 8.01 3.96 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 0.89 0.00 0.00 1.03 0.00 0.00 88 T 8.15 4.32 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 89 G 8.65 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 0.00 0.00 0.00 0.00 90 A 7.59 4.45 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.28 4.80 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.11 0.96 0.00 0.00 92 C 9.02 4.52 0.00 3.09 2.79 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 93 L 8.26 4.28 0.00 1.71 1.47 0.93 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 94 D 9.05 4.47 0.00 2.75 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 95 I 7.82 4.18 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 1.71 1.10 0.95 0.00 0.00 96 L 7.92 4.46 0.00 1.81 1.73 0.92 0.57 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 97 K 8.84 4.54 0.00 1.72 0.92 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.38 7.81 98 D 9.35 4.58 0.00 2.74 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 7.94 4.48 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 100 W 8.11 4.68 0.00 3.45 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 0.00 101 A 7.01 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 A 8.55 3.81 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 0.00 103 A 7.37 4.20 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 0.00 104 M 7.26 4.09 0.00 1.89 1.22 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 105 T 7.98 5.15 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 1.28 0.00 0.00 106 L 8.81 4.02 0.00 1.75 1.81 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.07 3.88 0.00 1.87 1.95 0.00 3.19 0.00 0.00 3.49 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.73 0.00 108 T 7.86 3.89 4.54 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 1.22 0.00 0.00 109 V 7.98 3.67 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 1.06 0.00 0.00 1.22 0.00 0.00 110 L 8.08 3.99 0.00 1.85 1.68 0.88 0.47 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 0.00 111 L 8.10 4.06 0.00 1.86 1.73 0.93 0.56 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 0.00 112 S 8.10 4.11 0.00 3.94 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 0.00 113 L 8.10 4.07 0.00 1.88 1.71 0.80 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 8.03 3.98 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.99 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 115 A 8.28 4.15 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 0.00 116 L 8.25 3.92 0.00 1.79 1.82 0.87 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 117 L 7.83 3.95 0.00 1.83 1.79 0.40 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.54 4.78 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 0.00 119 A 7.74 4.45 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 0.00 120 A 8.14 4.37 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.90 4.44 0.00 1.89 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 2.12 2.15 0.00 122 P 0.00 4.04 0.00 2.08 1.65 0.00 3.68 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.83 0.00 123 D 7.92 4.55 0.00 2.65 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 D 7.63 4.76 0.00 2.55 2.47 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 0.00 125 P 0.00 4.53 0.00 2.11 1.91 0.00 3.75 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 1.92 1.87 0.00 126 Q 8.75 4.20 0.00 1.89 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.01 0.00 0.00 0.00 0.00 0.00 2.49 2.26 0.00 127 D 7.45 4.60 0.00 2.66 2.21 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 0.00 128 A 8.21 4.14 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 0.00 129 V 7.61 3.48 2.17 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 1.10 0.00 0.00 0.96 0.00 0.00 130 V 7.35 3.27 1.69 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 0.26 0.00 0.00 -0.72 0.00 0.00 131 A 8.32 3.82 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 N 8.42 4.32 0.00 2.97 2.89 0.00 0.00 6.59 8.58 0.00 0.00 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 Q 8.30 3.96 0.00 2.43 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.67 0.00 0.00 0.00 0.00 0.00 2.59 2.53 0.00 134 Y 7.89 3.57 0.00 2.12 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 0.00 135 K 7.79 4.15 0.00 1.96 1.86 0.00 1.84 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.57 7.81 136 Q 8.39 4.44 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.16 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 137 N 8.61 5.04 0.00 2.65 2.69 0.00 0.00 7.02 8.34 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 0.00 138 P 0.00 4.18 0.00 2.12 1.88 0.00 3.62 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 2.05 2.03 0.00 139 E 8.07 3.93 0.00 2.07 1.94 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 2.37 2.45 0.00 140 M 8.38 4.08 0.00 2.13 2.28 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.71 0.00 141 F 8.26 4.58 0.00 3.32 3.26 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 0.00 142 K 8.33 3.73 0.00 1.95 1.78 0.00 1.90 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.72 7.81 143 Q 7.94 3.98 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.83 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 144 T 7.59 3.55 3.24 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 -0.15 0.00 0.00 145 A 7.55 4.05 1.05 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 0.00 146 R 8.25 4.13 0.00 1.98 1.96 0.00 3.09 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.48 0.00 147 L 7.97 4.04 0.00 1.85 1.92 0.88 1.14 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 0.00 148 W 8.92 4.16 0.00 3.57 3.64 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 0.00 149 A 8.35 4.51 1.68 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 0.00 0.00 150 H 7.93 4.46 0.00 3.14 3.49 0.00 5.80 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.91 3.44 1.54 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 0.01 0.00 0.00 0.77 0.00 0.00 152 Y 8.36 4.67 0.00 3.14 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 A 7.65 4.34 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 G 8.26 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 0.00 0.00 0.00 155 A 8.00 4.56 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