NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 D 4.5978 8.3649 119.5566 52.2084 41.4862 174.4041 21 P 4.6897 0.0000 0.0000 62.9944 32.6920 173.9346 22 K 4.9360 9.9519 120.4829 55.4036 37.6781 175.4368 23 R 5.0716 9.1332 120.5913 54.5779 33.6700 175.3977 24 L 5.0460 8.6356 122.8814 53.5865 43.3815 174.7782 25 Y 4.6082 9.2108 127.3109 56.7540 40.3243 173.8054 26 C 4.2408 8.7179 128.4055 58.1703 32.3765 174.3144 27 K 3.8583 8.5372 128.0789 58.6261 32.2302 177.0940 28 N 4.4839 7.3911 120.1897 49.7008 37.2550 173.1303 29 G 3.9500 9.0052 109.7810 44.5597 0.0000 172.6244 30 G 2.9912 7.5585 106.9588 45.7819 0.0000 173.4002 31 F 4.2905 7.4841 116.9324 56.0408 41.6524 174.6284 32 F 5.2976 8.8041 119.6186 55.4940 41.1446 175.4546 33 L 4.5092 8.8322 126.3319 55.4888 43.2725 175.6054 34 R 4.6972 9.1145 125.6404 54.6519 33.3341 173.8533 35 I 4.6871 8.2459 127.6278 59.6597 38.2709 175.5434 36 H 4.2720 8.8922 125.0054 55.0333 29.1915 175.4909 37 P 4.2690 0.0000 0.0000 64.9974 31.3798 177.2544 38 D 4.5602 7.9096 115.6481 53.1397 39.9385 176.9164 39 G 4.0643 8.2788 109.1010 45.6718 0.0000 174.4663 40 R 4.4614 8.3056 119.3212 55.7958 30.8567 175.6391 41 V 4.9571 8.1835 118.9465 60.3225 34.6368 174.6415 42 D 4.6904 8.1132 123.6273 53.0753 42.0985 173.8062 43 G 4.7743 8.6396 105.2079 45.1889 0.0000 172.8091 44 V 4.9964 8.7952 118.5115 60.5846 34.4706 176.0083 45 R 3.9320 8.9608 121.8218 58.1530 30.7286 176.4839 46 E 4.0090 8.4397 122.1489 56.8610 29.5951 177.8481 47 K 3.7275 8.8639 130.1224 56.6048 32.1464 174.6662 48 S 4.5312 7.4599 111.6950 58.9753 62.7423 179.7888 49 D 4.4803 7.6682 118.7121 55.0825 41.4646 175.5467 50 P 4.3407 0.0000 0.0000 65.1856 32.2228 177.1163 51 H 4.4022 8.7399 115.5685 56.3774 28.5220 176.1056 52 I 4.4043 7.1087 110.9984 59.6885 38.2251 175.2904 53 K 4.4008 7.5233 124.3924 56.0810 32.9464 175.5176 54 L 5.1905 9.1157 127.5068 52.9051 45.9310 175.3865 55 Q 4.6792 8.9922 122.9903 54.6192 30.9963 174.6481 56 L 5.0392 8.7301 130.4028 54.3557 42.4039 176.6239 57 Q 4.7806 8.6605 124.6744 53.7300 30.7034 172.1551 58 A 4.7180 8.7432 127.5825 52.3621 19.3033 176.8655 59 E 4.4137 8.9842 121.0429 57.2887 31.9628 174.5616 60 E 4.8009 7.5772 115.0547 53.6075 33.6948 177.8687 61 R 4.2996 8.3381 114.9531 58.9762 29.8847 174.3660 62 G 4.1112 9.1298 110.4945 44.4939 0.0000 172.4128 63 V 4.9469 7.7634 120.3110 61.1230 34.1073 174.8482 64 V 5.2952 9.2975 120.7410 59.6678 36.2395 174.5362 65 S 5.3777 8.9251 117.2454 56.8254 66.1419 173.0238 66 I 4.6640 8.4063 122.5168 59.6869 39.4407 174.0969 67 K 4.6319 8.7519 129.2385 54.2399 34.7797 175.2003 68 G 3.9212 8.7115 115.4356 45.6948 0.0000 174.2825 69 V 3.6029 8.6156 126.8804 66.3417 31.8721 177.5669 70 S 4.1765 8.0682 113.6785 61.6337 62.8574 175.7760 71 A 3.9850 7.9745 121.2377 53.4065 18.1657 176.9190 72 N 4.1206 8.3619 112.6574 54.9243 37.8457 173.6205 73 R 4.8016 7.4842 112.7419 54.0999 35.0308 173.7917 74 Y 4.9883 8.7334 118.7237 55.8707 39.8845 175.3838 75 L 4.5067 9.1034 126.8448 55.5634 43.6135 175.6312 76 A 5.1111 9.2268 126.7399 50.6601 22.9404 174.2509 77 M 5.0502 8.6801 121.3308 54.0346 34.4425 175.9465 78 K 4.8729 8.7896 127.7209 54.8705 34.5496 177.9746 79 E 3.5025 8.8165 116.2338 57.7687 29.7254 174.5322 80 D 4.8370 8.1951 114.8956 53.6973 39.8620 177.2108 81 G 3.5856 8.6142 110.5778 45.1854 0.0000 174.3002 82 R 4.5394 7.7662 119.0679 56.4736 31.3980 175.5367 83 L 5.0885 7.0871 122.0283 52.8890 43.8480 175.8174 84 L 4.6130 8.4535 121.8977 54.8873 44.5237 173.5964 85 A 5.2562 8.6706 121.5366 50.2207 21.1611 176.2031 86 S 4.7448 9.1893 120.2402 57.3399 65.5314 176.2638 87 K 4.3536 8.7692 121.7365 56.1486 31.8929 177.4375 88 S 4.7638 7.8398 110.7134 56.7570 65.3502 173.2706 89 V 3.7409 7.9170 120.4839 61.3021 31.8709 174.4962 90 T 4.6746 7.8547 118.8583 59.7766 71.8995 174.7484 91 D 4.5971 8.8848 119.4882 56.8137 39.7094 175.0180 92 E 4.1545 7.9331 115.2022 57.8416 29.2416 177.3087 93 C 4.8568 7.2560 115.5266 58.5118 29.0661 173.4052 94 F 5.0545 7.3550 117.8092 55.6978 41.9159 174.4483 95 F 5.0530 8.8897 119.4284 55.5719 43.7697 174.0563 96 F 4.9122 9.3860 122.1522 57.5225 40.0397 173.9366 97 E 4.8119 9.4977 125.8233 54.6813 30.6933 174.9200 98 R 4.6417 8.5622 127.4457 54.3838 33.5894 174.2342 99 L 4.7449 8.4838 127.9616 53.6025 42.4155 175.9575 100 E 4.3391 9.1474 127.3005 55.6378 30.1432 178.6550 101 S 4.1601 8.6005 114.8415 60.7443 63.0129 174.6684 102 N 4.7115 8.1734 117.3302 52.5047 37.2437 175.1797 103 N 4.3188 8.3627 114.3168 54.3259 36.8979 173.5819 104 Y 4.5562 8.0865 116.4388 57.0302 40.5721 174.4665 105 N 5.5743 9.5547 118.8432 52.3299 41.5127 174.3230 106 T 5.2733 8.7431 110.3595 60.3284 73.0561 172.7304 107 Y 4.8677 8.8269 119.3046 56.5901 41.3136 173.9615 108 R 4.9646 8.8351 125.5789 54.0681 32.6570 175.3804 109 S 4.1339 9.1559 121.7666 58.8722 62.8734 175.0219 110 R 3.4811 8.1878 130.0808 59.7812 29.9570 178.7645 111 K 3.6723 7.7692 119.4489 57.0113 32.0005 180.2988 112 Y 4.3085 7.2989 123.7125 56.0904 36.6639 176.5175 113 T 4.5368 7.8957 113.3317 62.6915 69.3421 175.8839 114 S 4.5598 7.6044 116.8525 58.5287 63.8314 173.6768 115 W 5.3460 8.1160 121.4564 55.7252 31.0875 174.9379 116 Y 5.3964 8.7016 119.3906 55.9565 41.2007 175.7423 117 V 3.9897 9.1253 122.5652 63.4095 32.8953 174.7891 118 A 5.1135 8.5010 126.6011 51.2499 22.5397 174.7347 119 L 5.1304 8.1726 119.1997 52.8635 45.2996 177.3011 120 K 4.1977 8.8775 125.0908 56.4238 33.1726 178.2502 121 R 4.6128 8.3105 116.0541 56.9618 29.1054 174.7331 122 T 4.3281 7.6137 107.2074 62.3663 69.7332 175.5192 123 G 2.7307 7.6878 114.1449 45.4902 0.0000 174.4570 124 Q 4.4548 7.2486 118.5793 54.0199 29.1236 180.3498 125 Y 4.7957 8.1573 117.0756 57.2866 39.2611 174.6118 126 K 4.4329 8.5931 122.8240 54.5738 33.6791 175.9011 127 L 4.2130 8.7132 126.8334 55.3106 42.4564 178.9197 128 G 3.5536 8.9887 111.6027 48.0287 0.0000 175.8867 129 S 3.0239 7.0071 113.1724 59.6923 63.3911 174.8805 130 K 4.2955 7.7739 119.5890 56.3277 31.7960 176.3584 131 T 4.6879 6.8734 110.0172 59.1425 70.2639 174.0032 132 G 4.2566 7.9653 110.3469 44.5361 0.0000 170.7985 133 P 4.0412 0.0000 0.0000 64.1306 31.7054 176.8693 134 G 4.0246 8.8490 110.0213 45.4589 0.0000 173.8443 135 Q 4.2576 7.5946 120.6495 55.5907 29.7190 177.6625 136 K 4.0457 8.3576 121.4581 56.2195 32.2851 178.5896 137 A 4.0482 7.8282 119.9253 54.7061 18.5628 178.5049 138 I 4.6066 6.8550 105.9650 60.0253 38.4612 175.4310 139 L 4.7166 7.2794 123.0474 54.0840 42.9704 175.8331 140 F 5.4610 9.4640 121.5498 55.6646 43.9958 174.0258 141 L 5.1002 9.3940 122.5644 52.5617 44.3082 173.7083 142 P 5.0257 0.0000 0.0000 63.1897 31.8735 175.9798 143 M 4.9127 9.3935 123.9547 53.0058 36.2649 176.0434 144 S 4.2444 8.6271 114.4280 58.7386 62.6061 173.9568 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 20 D 8.36 4.60 0.00 2.71 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.69 0.00 2.01 2.05 0.00 3.85 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 2.00 2.04 0.00 22 K 9.95 4.94 0.00 1.64 1.77 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.43 7.81 23 R 9.13 5.07 0.00 1.88 1.95 0.00 2.92 0.00 0.00 2.42 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.49 0.00 24 L 8.64 5.05 0.00 1.59 1.68 0.26 0.88 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 25 Y 9.21 4.61 0.00 3.09 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 26 C 8.72 4.24 0.00 2.57 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 27 K 8.54 3.86 0.00 1.42 1.65 0.00 0.61 0.00 0.00 1.10 0.00 0.00 2.73 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.22 1.24 7.81 28 N 7.39 4.48 0.00 2.61 2.60 0.00 0.00 7.13 7.98 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 29 G 9.01 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 30 G 7.56 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 7.48 4.29 0.00 2.92 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 F 8.80 5.30 0.00 3.24 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 33 L 8.83 4.51 0.00 1.91 1.55 0.90 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 34 R 9.11 4.70 0.00 1.94 2.03 0.00 3.05 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.69 0.00 35 I 8.25 4.69 1.82 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.69 0.86 0.00 0.00 36 H 8.89 4.27 0.00 3.39 3.16 0.00 5.81 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.27 0.00 2.03 2.11 0.00 3.58 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 38 D 7.91 4.56 0.00 2.77 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 39 G 8.28 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 0.00 0.00 0.00 40 R 8.31 4.46 0.00 1.84 1.85 0.00 2.98 0.00 0.00 3.07 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.55 0.00 41 V 8.18 4.96 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 0.97 0.00 0.00 0.85 0.00 0.00 42 D 8.11 4.69 0.00 2.88 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 43 G 8.64 4.77 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 44 V 8.80 5.00 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 0.83 0.00 0.00 1.05 0.00 0.00 45 R 8.96 3.93 0.00 1.76 1.97 0.00 2.85 0.00 0.00 2.91 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.67 0.00 46 E 8.44 4.01 0.00 2.11 1.91 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 2.41 2.39 0.00 47 K 8.86 3.73 0.00 1.82 1.70 0.00 1.85 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.36 1.00 7.81 48 S 7.46 4.53 0.00 3.74 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 49 D 7.67 4.48 0.00 2.77 2.58 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 0.00 0.00 0.00 0.00 50 P 0.00 4.34 0.00 2.03 2.18 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.91 0.00 51 H 8.74 4.40 0.00 3.41 3.46 0.00 5.79 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 52 I 7.11 4.40 1.92 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.85 1.00 0.00 0.00 53 K 7.52 4.40 0.00 1.93 1.66 0.00 1.53 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.37 7.81 54 L 9.12 5.19 0.00 1.50 1.42 0.81 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.99 4.68 0.00 2.03 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 56 L 8.73 5.04 0.00 1.57 1.68 0.85 0.89 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 57 Q 8.66 4.78 0.00 1.77 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.00 0.00 0.00 0.00 0.00 0.00 2.22 2.17 0.00 58 A 8.74 4.72 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.98 4.41 0.00 1.97 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 2.17 2.09 0.00 60 E 7.58 4.80 0.00 1.84 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.82 0.00 61 R 8.34 4.30 0.00 1.82 1.76 0.00 3.29 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.20 0.00 62 G 9.13 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 63 V 7.76 4.95 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 0.98 0.00 0.00 64 V 9.30 5.30 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 0.96 0.00 0.00 1.21 0.00 0.00 65 S 8.93 5.38 0.00 3.89 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 66 I 8.41 4.66 1.72 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 1.05 0.59 0.68 0.00 0.00 67 K 8.75 4.63 0.00 1.55 1.45 0.00 0.81 0.00 0.00 1.40 0.00 0.00 2.69 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.96 0.51 7.81 68 G 8.71 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 69 V 8.62 3.60 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 0.75 0.00 0.00 0.88 0.00 0.00 70 S 8.07 4.18 0.00 3.91 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.97 3.99 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 72 N 8.36 4.12 0.00 2.78 2.87 0.00 0.00 6.99 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 73 R 7.48 4.80 0.00 1.68 1.72 0.00 3.13 0.00 0.00 3.55 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.77 0.00 74 Y 8.73 4.99 0.00 2.79 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 75 L 9.10 4.51 0.00 1.62 1.50 0.78 0.45 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 76 A 9.23 5.11 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 77 M 8.68 5.05 0.00 2.35 2.33 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 2.76 2.70 0.00 78 K 8.79 4.87 0.00 1.90 1.75 0.00 1.91 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.58 1.39 7.81 79 E 8.82 3.50 0.00 1.99 1.86 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 2.23 1.87 0.00 80 D 8.20 4.84 0.00 2.74 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 81 G 8.61 3.59 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 0.00 0.00 0.00 82 R 7.77 4.54 0.00 1.77 1.91 0.00 3.16 0.00 0.00 3.63 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.70 0.00 83 L 7.09 5.09 0.00 0.27 1.01 0.70 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.45 4.61 0.00 1.85 1.71 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.67 5.26 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 9.19 4.74 0.00 3.92 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 87 K 8.77 4.35 0.00 1.80 1.76 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 0.99 7.81 88 S 7.84 4.76 0.00 3.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 7.92 3.74 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 0.45 0.00 0.00 -0.41 0.00 0.00 90 T 7.85 4.67 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 1.18 0.00 0.00 91 D 8.88 4.60 0.00 2.72 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 92 E 7.93 4.15 0.00 2.12 2.26 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 2.50 2.33 0.00 93 C 7.26 4.86 0.00 2.21 2.56 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 94 F 7.35 5.05 0.00 2.66 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 95 F 8.89 5.05 0.00 3.21 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 96 F 9.39 4.91 0.00 2.99 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 97 E 9.50 4.81 0.00 2.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.08 0.00 98 R 8.56 4.64 0.00 1.96 1.76 0.00 3.15 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 99 L 8.48 4.74 0.00 1.70 1.62 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 100 E 9.15 4.34 0.00 2.40 1.91 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 2.50 2.44 0.00 101 S 8.60 4.16 0.00 3.99 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 0.00 102 N 8.17 4.71 0.00 3.00 3.02 0.00 0.00 6.13 8.04 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 0.00 103 N 8.36 4.32 0.00 2.85 2.90 0.00 0.00 6.84 8.22 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 0.00 104 Y 8.09 4.56 0.00 3.16 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 0.00 105 N 9.55 5.57 0.00 2.99 2.50 0.00 0.00 6.87 6.91 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 0.00 106 T 8.74 5.27 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 107 Y 8.83 4.87 0.00 2.88 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 0.00 108 R 8.84 4.96 0.00 1.75 1.96 0.00 3.22 0.00 0.00 2.72 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.09 0.00 109 S 9.16 4.13 0.00 4.20 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 0.00 110 R 8.19 3.48 0.00 1.18 1.56 0.00 3.06 0.00 0.00 2.79 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.90 0.00 111 K 7.77 3.67 0.00 1.82 1.70 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.36 1.03 7.81 112 Y 7.30 4.31 0.00 3.01 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 0.00 0.00 0.00 113 T 7.90 4.54 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 1.33 0.00 0.00 114 S 7.60 4.56 0.00 3.85 4.07 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 0.00 115 W 8.12 5.35 0.00 3.53 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Y 8.70 5.40 0.00 2.96 3.01 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 0.00 117 V 9.13 3.99 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 0.71 0.00 0.00 0.47 0.00 0.00 118 A 8.50 5.11 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 0.00 119 L 8.17 5.13 0.00 1.39 1.43 1.04 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 120 K 8.88 4.20 0.00 1.66 1.66 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.36 7.81 121 R 8.31 4.61 0.00 1.83 1.80 0.00 3.25 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.18 0.00 122 T 7.61 4.33 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 1.16 0.00 0.00 123 G 7.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Q 7.25 4.45 0.00 1.95 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.91 0.00 0.00 0.00 0.00 0.00 2.27 2.16 0.00 125 Y 8.16 4.80 0.00 3.00 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 0.00 126 K 8.59 4.43 0.00 1.78 1.80 0.00 1.81 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.36 7.81 127 L 8.71 4.21 0.00 1.54 1.45 0.82 0.92 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 0.00 128 G 8.99 3.55 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 0.00 0.00 0.00 129 S 7.01 3.02 0.00 3.73 3.01 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 0.00 130 K 7.77 4.30 0.00 1.82 1.82 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.34 1.25 7.81 131 T 6.87 4.69 4.45 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 1.45 0.00 0.00 132 G 7.97 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 0.00 133 P 0.00 4.04 0.00 2.06 2.02 0.00 3.75 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.28 0.00 134 G 8.85 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 0.00 0.00 0.00 135 Q 7.59 4.26 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.79 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 136 K 8.36 4.05 0.00 1.68 1.81 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.00 7.81 137 A 7.83 4.05 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 0.00 138 I 6.86 4.61 1.75 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.92 0.82 0.00 0.00 139 L 7.28 4.72 0.00 1.20 1.26 0.59 1.34 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 0.00 140 F 9.46 5.46 0.00 3.31 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 0.00 141 L 9.39 5.10 0.00 1.86 1.76 0.76 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 5.03 0.00 2.08 2.11 0.00 3.79 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 143 M 9.39 4.91 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.48 0.00 144 S 8.63 4.24 0.00 3.84 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00