NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 5.0610 8.2787 120.0230 54.3767 43.8565 178.1806 23 A 3.8602 7.9141 123.4188 54.8083 18.1190 178.4171 24 D 4.3929 9.1039 118.3005 57.1463 41.3690 177.5463 25 S 4.1558 8.2214 115.2929 61.5793 62.9564 176.4137 26 K 3.8679 7.8960 120.3984 59.6328 31.7559 179.1759 27 A 4.0054 7.7635 120.5510 55.1694 18.3423 180.1299 28 V 3.6569 8.2076 118.0922 64.9175 31.4760 178.5524 29 L 4.3490 8.3789 119.8288 57.6963 41.4543 179.0500 30 N 4.2829 8.1816 117.0608 56.4271 38.7644 176.6456 31 Q 4.2464 8.5722 121.0921 59.3822 29.1471 178.4018 32 A 4.2127 8.7144 122.0952 55.1195 18.5147 179.4757 33 V 3.5498 8.2791 116.8733 66.2686 31.5552 178.0926 34 A 4.1268 8.4359 120.0455 55.5602 18.3378 179.4187 35 D 4.3718 8.5987 117.7271 57.5224 40.8261 179.0801 36 L 4.2096 8.7115 119.9005 57.7746 41.4377 179.7932 37 S 3.8679 7.8212 115.1502 61.5146 62.6352 176.9300 38 V 3.5999 7.8008 120.7595 65.8293 31.1878 177.8994 39 A 4.0044 8.5256 121.1067 55.2683 18.1126 178.8863 40 H 3.9668 8.4944 117.0211 59.6510 29.8275 177.4474 41 S 4.1057 7.7749 114.8178 61.3804 62.2413 176.1962 42 I 3.6847 7.9355 122.6101 64.3309 36.7702 178.3418 43 L 3.9578 8.2256 120.2736 58.0344 41.3805 179.1211 44 H 3.6824 8.1588 118.3922 58.9239 29.6701 177.0143 45 Q 4.2556 8.1373 121.5344 59.3258 28.7840 178.3879 46 V 3.6428 7.8434 119.1454 66.3557 31.3013 177.2708 47 H 4.1639 8.1919 116.7567 59.3186 29.7348 176.9295 48 W 4.7271 8.1982 119.2993 59.6056 29.0298 177.4724 49 Y 4.4431 8.7728 114.8936 57.1482 37.8022 175.2981 50 M 4.4607 7.6164 121.2601 55.9051 32.9307 175.6417 51 R 4.6309 8.9252 123.6406 55.0300 34.5619 173.8350 52 G 4.2349 8.9596 106.6580 42.7859 0.0000 173.1263 53 R 4.2587 8.2458 119.7224 57.4807 30.4691 177.4285 54 G 4.2750 9.5473 110.3986 45.5561 0.0000 175.0968 55 F 4.0779 8.7363 122.2545 62.0621 39.0169 176.9646 56 M 4.2412 8.2948 115.2990 58.2335 32.1827 177.3201 57 I 3.7363 7.5239 118.2432 63.2930 38.4804 177.5005 58 W 4.2081 8.3567 120.0314 59.2832 28.7139 178.0090 59 H 3.8732 8.2046 118.3669 58.8345 29.6024 175.3294 60 P 4.2414 0.0000 0.0000 65.3923 31.1797 178.0121 61 K 3.5066 7.5109 119.7728 59.6650 31.9844 178.3859 62 M 4.0458 7.9484 118.7429 58.5829 31.7566 178.4883 63 D 4.1740 7.6811 118.4122 57.3302 40.9928 178.6096 64 E 3.8982 7.9100 118.4683 59.6531 29.4646 178.9362 65 Y 4.4636 7.8677 116.6314 61.4250 37.9708 178.4421 66 M 4.0422 8.5543 120.0290 58.4235 32.0891 178.4432 67 E 3.9161 8.3320 119.5139 59.1444 29.8498 178.4939 68 E 3.6195 8.2033 119.3386 59.1650 29.6331 178.7102 69 I 3.7974 8.0990 120.2372 64.7417 37.1961 178.1376 70 D 4.4328 8.6472 120.0815 57.1949 40.5641 179.2207 71 G 3.4340 7.8494 106.2326 47.9065 0.0000 175.3949 72 Y 4.3105 7.3341 119.2729 60.6595 37.8772 178.4126 73 L 4.0981 8.2492 121.4760 58.3996 42.1525 178.6384 74 D 4.3405 8.2914 117.9865 57.1765 41.1608 177.8011 75 E 3.9021 8.2684 120.0448 59.3991 29.5564 178.7433 76 M 3.9219 8.3909 119.2867 58.1219 31.9225 178.6207 77 S 4.0682 8.0404 113.3380 61.6144 62.6606 176.1214 78 E 4.0009 8.4227 120.8613 58.6653 29.0998 179.2808 79 R 3.8248 7.9707 119.4559 59.0733 30.0492 178.0537 80 L 3.8922 8.0480 120.3135 58.3521 42.0055 178.8478 81 I 3.8360 7.9362 119.8209 65.0397 36.8432 178.5961 82 T 3.8917 7.6073 115.1261 66.2830 68.3477 175.9551 83 L 4.3456 7.8324 118.4151 54.9870 41.8281 177.6615 84 G 3.8642 8.3448 108.2146 45.1928 0.0000 173.8102 85 G 3.7939 7.9520 108.8138 43.8663 0.0000 173.7758 86 A 4.5151 7.9559 121.6867 49.0324 19.6036 174.2856 87 P 4.4339 0.0000 0.0000 63.0104 32.1418 176.8362 88 F 4.7022 8.3411 120.1733 58.9294 39.2654 176.7046 89 S 4.7835 8.7547 119.7270 56.4896 63.4436 174.7208 90 T 4.4767 6.7632 109.7105 59.9966 72.9409 173.5375 91 L 3.9515 8.1906 122.2963 57.6888 41.7219 179.6673 92 K 3.8601 7.8263 119.1791 59.5368 32.2980 178.4432 93 E 3.6945 7.7625 118.4562 59.2661 29.3221 179.4403 94 F 4.4397 7.5493 117.6330 60.7573 38.8455 177.6383 95 S 4.1174 8.2749 111.6360 61.6372 62.2975 175.8237 96 E 4.0790 8.1238 119.8302 58.6450 29.2872 178.1094 97 N 4.5602 7.5878 114.6005 53.2461 39.6402 175.7422 98 S 4.4564 7.5380 114.8167 58.4645 62.9279 173.8286 99 Q 4.3166 8.8809 124.6692 56.1031 29.2257 176.2948 100 L 3.9234 7.5720 119.1568 54.1082 42.2679 176.3846 101 K 4.5711 8.2518 121.8910 54.6204 34.2351 175.5106 102 E 4.7250 8.4730 121.2504 54.6181 32.1393 175.6756 103 V 4.5209 7.7773 113.8106 58.8872 35.4249 175.6457 104 L 4.0442 8.2212 121.1684 54.5021 42.0378 177.8731 105 G 2.4459 7.8697 110.6436 45.3474 0.0000 173.0805 106 D 4.2918 7.2774 120.8643 52.9417 43.3933 175.7491 107 Y 4.7161 8.5609 124.4568 60.2096 38.1145 176.6796 108 N 4.6838 8.5580 115.7456 53.6306 39.0924 175.6365 109 V 3.8319 7.3265 119.9749 62.6332 32.2377 176.4957 110 T 4.1981 8.8682 117.9836 61.3004 70.6833 175.5351 111 I 3.6773 8.3917 123.1938 65.0882 37.1250 178.5417 112 E 3.8425 8.0654 118.4666 59.2092 29.2119 179.1906 113 E 3.8968 8.1653 118.8147 59.3854 29.5364 179.1920 114 Q 3.9267 8.3530 118.4858 59.1213 28.7306 179.1653 115 L 3.6910 8.0086 119.8273 57.3721 41.5274 179.2526 116 A 3.8665 7.9971 120.8995 55.2720 18.2099 179.7681 117 R 3.7699 8.0780 116.6568 59.4271 30.1034 179.4747 118 V 3.1779 7.4982 117.8388 65.7860 31.4070 178.0507 119 V 3.4713 7.6378 118.0880 66.1766 31.2894 177.9251 120 E 3.9756 8.0330 118.1922 59.1390 29.2368 179.2187 121 V 3.6413 7.9149 118.5834 66.3651 31.5126 178.1849 122 F 4.4390 8.5916 117.7059 60.5638 38.6801 177.9054 123 R 3.9191 8.5459 118.2621 59.3400 29.8144 178.2340 124 Y 3.9203 8.1065 119.1966 60.7758 38.6829 178.2958 125 L 3.3542 8.1608 119.5394 57.5283 41.5888 179.2850 126 A 3.8265 8.0284 120.7433 55.1499 18.2835 179.6123 127 A 3.7653 7.7512 119.1482 55.0771 18.4175 179.6252 128 L 3.6418 7.5484 119.1889 58.1659 42.0218 179.2697 129 F 4.4426 8.0259 118.1769 60.3227 38.7810 177.4919 130 Q 3.9666 8.3020 119.5869 59.0556 28.7467 178.3351 131 K 3.9349 8.0743 120.7237 59.3533 32.1829 178.9557 132 G 2.2698 7.6521 105.9562 47.1378 0.0000 175.2404 133 F 4.0101 8.2791 123.6245 61.1570 39.4447 176.8942 134 D 4.3919 8.4767 118.6255 57.3599 40.6755 179.0705 135 V 3.5319 8.0009 119.1539 66.1275 31.7511 178.3151 136 S 4.4168 8.0850 115.3830 60.7865 62.9463 175.8075 137 D 4.0839 8.0883 121.9679 57.0127 40.6814 177.8915 138 E 3.9095 7.8705 118.6285 59.2994 30.0837 178.1310 139 E 4.2268 8.2981 116.8341 56.4881 29.2918 178.0980 140 G 3.6785 7.4741 106.6293 46.7621 0.0000 175.1216 141 D 4.6061 8.0350 122.2315 52.5818 39.1319 176.5460 142 S 4.1024 8.0059 119.8156 60.6106 63.4002 176.7029 143 V 3.5235 7.6260 121.5811 66.1825 31.4197 178.0159 144 T 3.6952 7.7943 115.5084 66.4440 68.2840 175.8741 145 N 4.5655 7.9988 120.4674 56.3194 38.8089 176.3127 146 D 4.3870 8.1289 118.9775 57.1813 41.4194 177.9899 147 I 3.5024 7.4995 120.4514 64.5169 37.0098 178.3970 148 F 3.9386 7.9336 118.3104 60.3364 38.6524 177.2845 149 N 4.3207 8.4023 116.7770 56.6931 38.7656 177.0285 150 V 3.5255 7.7425 119.3925 66.0724 31.7464 177.9056 151 A 3.4306 7.4238 121.3505 54.0368 17.8901 179.5907 152 K 4.0806 8.3512 118.4764 59.4448 32.4086 178.7044 153 A 3.9641 8.1428 121.3853 55.5511 18.2135 179.6534 154 S 4.0942 7.9349 110.9813 61.4000 62.4587 176.1692 155 I 3.4571 7.6836 122.2841 64.4742 36.7220 178.2695 156 E 4.0320 8.2868 119.3913 59.1132 29.3103 179.1026 157 K 4.2302 8.0203 119.2953 60.0583 32.2715 178.5090 158 H 4.4275 8.4888 116.6055 58.9301 28.5301 177.7459 159 I 3.8026 8.0967 121.7132 64.1512 36.9044 177.9246 160 W 4.4508 8.5056 129.2268 61.1108 30.4822 177.8821 161 M 3.2862 7.8250 118.1769 58.0991 31.3561 178.8310 162 L 4.0081 8.4555 119.4861 57.9664 41.7439 179.6294 163 Q 3.9999 8.4334 118.0088 58.7731 28.5728 178.6802 164 A 4.0017 8.3016 122.1654 55.1427 18.2156 179.0954 165 E 3.9761 8.0606 116.6462 59.5013 29.7858 178.3489 166 L 4.3438 7.6618 115.4754 54.3417 41.7117 177.1241 167 G 3.9429 8.1120 106.9470 46.5809 0.0000 173.7495 168 Q 4.6290 8.5204 116.7915 53.1002 32.4215 175.4827 169 A 4.3615 8.3542 122.5279 51.4628 19.2011 176.3061 170 P 4.4140 0.0000 0.0000 64.0906 31.6874 177.4934 171 K 3.8666 8.0663 114.9305 57.2856 29.4445 175.2254 172 L 4.1848 8.0075 122.4576 55.1874 41.5282 177.5191 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 22 L 8.28 5.06 0.00 1.76 1.75 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.91 3.86 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 24 D 9.10 4.39 0.00 2.94 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 8.22 4.16 0.00 4.01 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 7.90 3.87 0.00 1.98 1.86 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.73 7.81 27 A 7.76 4.01 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 28 V 8.21 3.66 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.74 0.00 0.00 29 L 8.38 4.35 0.00 1.96 1.81 0.94 0.22 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 8.18 4.28 0.00 2.86 2.60 0.00 0.00 6.80 7.07 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 31 Q 8.57 4.25 0.00 2.44 2.45 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 2.78 0.00 32 A 8.71 4.21 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 8.28 3.55 2.46 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 1.26 0.00 0.00 1.03 0.00 0.00 34 A 8.44 4.13 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.60 4.37 0.00 2.96 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 36 L 8.71 4.21 0.00 1.79 1.80 1.23 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.82 3.87 0.00 3.45 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 0.00 38 V 7.80 3.60 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 0.98 0.00 0.00 1.01 0.00 0.00 39 A 8.53 4.00 1.46 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 40 H 8.49 3.97 0.00 3.28 3.50 0.00 5.59 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.77 4.11 0.00 3.96 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 7.94 3.68 1.97 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 1.48 0.77 0.86 0.00 0.00 43 L 8.23 3.96 0.00 1.75 1.67 1.12 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.16 3.68 0.00 2.98 2.64 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 8.14 4.26 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 46 V 7.84 3.64 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 0.94 0.00 0.00 0.96 0.00 0.00 47 H 8.19 4.16 0.00 3.05 3.28 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 8.20 4.73 0.00 3.69 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 49 Y 8.77 4.44 0.00 3.16 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 50 M 7.62 4.46 0.00 2.28 2.37 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.95 0.00 51 R 8.93 4.63 0.00 2.03 1.79 0.00 3.31 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.81 0.00 52 G 8.96 4.23 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 0.00 53 R 8.25 4.26 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.55 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 0.00 0.00 0.00 0.00 55 F 8.74 4.08 0.00 3.37 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 56 M 8.29 4.24 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.20 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 7.52 3.74 1.65 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.39 0.57 0.00 0.00 58 W 8.36 4.21 0.00 3.47 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 8.20 3.87 0.00 1.64 2.55 0.00 5.95 0.00 0.00 0.00 0.00 6.94 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 4.24 0.00 2.16 2.21 0.00 3.60 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 61 K 7.51 3.51 0.00 1.47 1.86 0.00 1.04 0.00 0.00 1.11 0.00 0.00 2.62 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.11 0.50 7.81 62 M 7.95 4.05 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 3.03 0.00 63 D 7.68 4.17 0.00 2.82 2.60 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 64 E 7.91 3.90 0.00 1.90 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 2.31 2.24 0.00 65 Y 7.87 4.46 0.00 3.24 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 66 M 8.55 4.04 0.00 1.82 2.14 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.24 0.00 67 E 8.33 3.92 0.00 2.14 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 2.26 2.31 0.00 68 E 8.20 3.62 0.00 2.14 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 1.72 2.05 0.00 69 I 8.10 3.80 2.08 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 1.93 0.94 1.03 0.00 0.00 70 D 8.65 4.43 0.00 2.79 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 7.85 3.43 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 0.00 72 Y 7.33 4.31 0.00 3.24 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 8.25 4.10 0.00 1.85 1.86 0.90 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.29 4.34 0.00 2.88 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.27 3.90 0.00 2.15 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 2.21 2.30 0.00 76 M 8.39 3.92 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 1.98 0.00 77 S 8.04 4.07 0.00 3.99 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 78 E 8.42 4.00 0.00 2.08 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 2.33 2.44 0.00 79 R 7.97 3.82 0.00 1.95 2.00 0.00 3.11 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 8.05 3.89 0.00 1.83 1.87 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.94 3.84 2.01 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 7.61 3.89 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 83 L 7.83 4.35 0.00 1.75 1.69 0.94 1.23 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 84 G 8.34 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 85 G 7.95 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 86 A 7.96 4.52 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 87 P 0.00 4.43 0.00 2.26 2.08 0.00 3.79 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 2.02 2.00 0.00 88 F 8.34 4.70 0.00 3.40 3.03 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 89 S 8.75 4.78 0.00 4.01 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 90 T 6.76 4.48 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 91 L 8.19 3.95 0.00 1.69 1.80 1.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.83 3.86 0.00 1.76 1.71 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.49 7.81 93 E 7.76 3.69 0.00 1.94 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 2.28 2.27 0.00 94 F 7.55 4.44 0.00 3.24 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 95 S 8.27 4.12 0.00 4.00 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 8.12 4.08 0.00 1.97 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 2.30 2.38 0.00 97 N 7.59 4.56 0.00 2.35 2.70 0.00 0.00 6.95 7.03 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 98 S 7.54 4.46 0.00 4.06 3.74 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 8.88 4.32 0.00 1.87 2.11 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 2.42 2.71 0.00 100 L 7.57 3.92 0.00 1.49 1.43 0.89 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.25 4.57 0.00 1.65 1.65 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.31 1.36 7.81 102 E 8.47 4.72 0.00 1.90 1.81 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 2.18 2.26 0.00 103 V 7.78 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 8.22 4.04 0.00 1.53 1.48 0.90 0.86 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 0.00 105 G 7.87 2.45 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 0.00 106 D 7.28 4.29 0.00 2.56 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 0.00 0.00 0.00 0.00 107 Y 8.56 4.72 0.00 3.15 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 0.00 108 N 8.56 4.68 0.00 2.87 2.90 0.00 0.00 6.92 7.31 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 0.00 109 V 7.33 3.83 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 0.84 0.00 0.00 0.94 0.00 0.00 110 T 8.87 4.20 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 1.26 0.00 0.00 111 I 8.39 3.68 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 1.90 1.10 0.85 0.00 0.00 112 E 8.07 3.84 0.00 1.97 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 2.33 2.36 0.00 113 E 8.17 3.90 0.00 2.18 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 2.30 2.32 0.00 114 Q 8.35 3.93 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.60 0.00 115 L 8.01 3.69 0.00 1.49 1.29 -0.29 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.00 3.87 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 0.00 117 R 8.08 3.77 0.00 1.98 1.90 0.00 3.07 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.77 0.00 118 V 7.50 3.18 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 -0.04 0.00 0.00 0.81 0.00 0.00 119 V 7.64 3.47 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 1.02 0.00 0.00 0.86 0.00 0.00 120 E 8.03 3.98 0.00 2.11 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 2.44 2.43 0.00 121 V 7.91 3.64 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 1.24 0.00 0.00 0.94 0.00 0.00 122 F 8.59 4.44 0.00 3.17 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 0.00 123 R 8.55 3.92 0.00 2.02 1.99 0.00 3.23 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 1.68 1.93 0.00 124 Y 8.11 3.92 0.00 3.12 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 0.00 125 L 8.16 3.35 0.00 1.58 0.81 1.02 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.03 3.83 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 0.00 127 A 7.75 3.77 1.16 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 0.00 128 L 7.55 3.64 0.00 1.15 1.37 1.04 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.03 4.44 0.00 3.15 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 0.00 130 Q 8.30 3.97 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 131 K 8.07 3.93 0.00 1.87 1.72 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.52 7.81 132 G 7.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.28 4.01 0.00 3.25 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 8.48 4.39 0.00 2.86 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 0.00 135 V 8.00 3.53 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 1.06 0.00 0.00 0.93 0.00 0.00 136 S 8.09 4.42 0.00 4.27 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 0.00 137 D 8.09 4.08 0.00 2.30 2.67 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 0.00 0.00 0.00 138 E 7.87 3.91 0.00 1.99 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 0.00 2.30 2.33 0.00 139 E 8.30 4.23 0.00 2.05 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 2.31 2.43 0.00 140 G 7.47 3.68 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 0.00 141 D 8.04 4.61 0.00 2.75 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 8.01 4.10 0.00 4.05 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 V 7.63 3.52 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 7.79 3.70 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 145 N 8.00 4.57 0.00 2.71 2.92 0.00 0.00 6.41 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 0.00 146 D 8.13 4.39 0.00 2.96 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 7.50 3.50 1.59 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 1.38 0.92 0.47 0.00 0.00 148 F 7.93 3.94 0.00 3.35 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 0.00 149 N 8.40 4.32 0.00 3.26 2.90 0.00 0.00 6.86 7.84 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 0.00 150 V 7.74 3.53 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.98 0.00 0.00 151 A 7.42 3.43 -0.28 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 0.00 152 K 8.35 4.08 0.00 2.06 1.97 0.00 1.64 0.00 0.00 1.56 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.50 7.81 153 A 8.14 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 7.93 4.09 0.00 3.95 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 0.00 155 I 7.68 3.46 1.86 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.75 0.71 0.00 0.00 156 E 8.29 4.03 0.00 2.06 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 0.00 2.34 2.56 0.00 157 K 8.02 4.23 0.00 2.08 2.03 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.73 1.98 7.81 158 H 8.49 4.43 0.00 3.42 3.46 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.10 3.80 2.16 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.06 1.00 0.00 0.00 160 W 8.51 4.45 0.00 3.39 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 0.00 161 M 7.83 3.29 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.20 0.00 162 L 8.46 4.01 0.00 1.63 1.59 0.83 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.43 4.00 0.00 2.36 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.51 2.75 0.00 164 A 8.30 4.00 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 0.00 165 E 8.06 3.98 0.00 2.22 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 0.00 2.36 2.46 0.00 166 L 7.66 4.34 0.00 1.78 1.64 0.80 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.11 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 0.00 0.00 0.00 168 Q 8.52 4.63 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.44 0.00 169 A 8.35 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 0.00 170 P 0.00 4.41 0.00 2.13 2.30 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 2.09 2.42 0.00 171 K 8.07 3.87 0.00 1.92 1.90 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.11 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.60 7.81 172 L 8.01 4.18 0.00 1.63 1.58 0.94 0.95 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