NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.7385 8.2227 120.4717 54.3849 42.8654 173.5108 5 F 5.0296 8.6002 128.4550 55.9999 42.8323 171.9548 6 Y 5.0866 7.2465 123.5768 56.6746 43.2311 172.6005 7 L 4.5048 7.3500 125.7578 53.9270 46.3508 173.7363 8 R 4.9604 8.8013 125.7319 54.8500 33.8569 172.9442 9 Y 5.2582 8.2141 126.2392 56.2145 42.4084 173.4121 10 Y 4.8809 7.7217 123.7156 56.4357 43.1488 173.9354 11 V 4.2834 6.4792 122.7890 60.7544 35.4094 173.3555 12 G 4.3978 7.9387 109.9758 47.5900 0.0000 170.9767 13 H 4.9568 8.1277 114.3181 55.4171 32.4683 173.5888 14 K 5.0966 8.9133 117.1914 54.8962 34.6092 175.5618 15 G 4.0496 8.7078 116.4994 44.3208 0.0000 172.0619 16 K 3.9898 8.6262 118.8912 58.5168 32.7020 177.1511 17 F 5.0172 8.0274 118.7491 57.3330 40.2872 176.1307 18 G 3.9845 8.2971 109.0419 45.3318 0.0000 173.8099 19 H 5.0521 8.5579 119.1490 55.1184 28.9007 173.8562 20 E 4.6775 9.0333 125.7163 55.0451 30.6169 175.3560 21 F 5.2587 8.2053 118.7161 55.3413 42.2727 173.2261 22 L 5.1363 8.8747 121.1982 53.4299 44.8659 174.6899 23 E 5.0570 9.5795 127.8447 54.3887 33.1700 174.3051 24 F 5.6249 8.4511 119.9066 55.4088 42.1926 173.0223 25 E 5.0899 9.6827 120.4073 54.7707 33.9714 174.2725 26 F 4.9119 9.3632 124.0088 55.8583 41.7999 175.0299 27 R 4.9080 8.7078 123.4415 54.5353 30.9651 175.5817 28 P 4.9810 0.0000 0.0000 65.4048 31.3266 176.8403 29 D 4.4900 8.5458 119.6094 58.5366 39.5923 177.8670 30 G 3.8518 7.2241 105.7792 46.4693 0.0000 174.0502 31 K 4.1185 7.4637 123.0054 54.7475 34.8465 176.0145 32 L 4.9544 9.5298 129.7236 52.4940 43.2554 174.2952 33 R 4.6764 8.1669 124.7607 55.7230 31.5560 174.8770 34 Y 5.4103 9.2550 124.7339 56.1357 42.8843 173.9205 35 A 4.5861 8.2353 124.0607 50.6859 23.5413 174.6922 36 N 5.0535 8.3589 120.4921 51.5628 42.1969 172.6970 37 N 4.9962 8.4258 124.2013 51.8297 42.3789 172.8084 38 S 4.6799 8.0144 116.4447 57.7868 65.2683 175.0441 39 N 5.3534 8.7414 121.2654 52.1896 39.1484 174.1193 40 Y 3.6722 8.0406 120.8278 58.9863 39.0752 176.7853 41 K 3.6524 9.0514 128.3394 57.8005 29.6507 175.0255 42 N 4.2517 8.3352 108.8727 54.1136 36.3428 174.5786 43 D 4.5354 7.6711 118.2274 54.5768 41.8500 174.9562 44 V 4.6066 7.6969 114.4215 58.9520 35.0448 175.3568 45 M 4.1001 8.5598 121.5804 56.0309 33.0286 175.1916 46 I 4.6212 8.7965 125.8402 59.5861 40.3047 174.8335 47 R 5.1139 8.5235 124.0392 54.4315 34.0809 174.8533 48 K 4.5639 9.0216 120.8822 54.7399 36.3150 175.2120 49 E 5.7874 9.0506 122.3164 53.9978 32.5007 174.8271 50 A 4.8366 8.3617 121.6813 51.6568 22.8603 174.3670 51 Y 4.7501 8.8908 116.9368 56.4740 39.9532 175.9683 52 V 4.5787 9.1346 117.9813 59.6943 34.6471 175.3977 53 H 4.6794 8.6921 122.0276 55.3679 30.7115 176.4011 54 K 4.0252 8.3662 123.3508 59.9030 32.0280 179.2915 55 S 4.0199 7.7782 115.3689 61.2428 62.8571 176.6264 56 V 3.4841 7.8434 121.7680 66.0113 31.3561 177.7766 57 M 3.8263 7.9762 117.9537 58.5687 31.7151 178.3243 58 E 3.7512 8.3380 119.4517 59.0267 29.7345 178.4083 59 E 3.8577 7.8934 119.2277 58.6489 29.6465 178.5516 60 L 3.7362 7.4468 120.7507 57.7880 42.0564 178.7216 61 K 3.4074 7.3941 119.5288 59.1503 31.8335 178.7940 62 R 3.8018 7.4318 119.2942 59.3958 29.7612 178.5781 63 I 3.6753 7.5859 119.6789 64.1765 36.7808 178.6239 64 I 3.8007 7.6147 119.9271 64.4484 37.3721 177.6124 65 D 4.5993 8.2349 119.9100 57.9221 40.5445 179.0699 66 D 4.4694 8.1577 117.6773 56.9591 40.8827 178.6412 67 S 4.2325 8.0206 114.5727 58.9445 62.9032 174.0441 68 E 4.0320 8.2066 121.2518 57.2570 27.6602 176.6835 69 I 3.9449 7.3459 117.3343 64.1524 38.4373 177.2099 70 T 4.2547 8.1060 108.1436 63.0793 68.5240 174.5625 71 K 4.3396 7.6965 119.9974 57.0386 32.9462 176.4317 72 E 4.6128 8.3503 119.7067 55.6411 31.2421 174.3997 73 D 4.6677 8.0349 117.1748 53.3685 44.0361 175.0324 74 D 3.3700 8.2254 123.2249 52.7892 40.0096 177.6811 75 A 3.7985 6.9592 123.2626 55.3493 18.2112 178.6953 76 L 4.5398 7.5071 111.2404 54.4837 42.4321 176.6123 77 W 4.7543 8.0467 119.7079 55.3783 29.8152 174.3870 78 P 4.5402 0.0000 0.0000 62.5479 31.7916 174.3417 79 P 4.5911 0.0000 0.0000 61.4466 32.4772 174.3098 80 P 4.3904 0.0000 0.0000 63.5743 32.2241 175.4237 81 D 4.6869 8.1583 118.1407 52.5074 41.9878 175.4474 82 R 3.9449 8.7942 117.0151 59.8822 30.0304 178.5767 83 V 3.5757 7.3078 116.1539 64.6252 31.7922 175.3721 84 G 4.3516 6.7178 104.9873 43.1714 0.0000 171.5694 85 R 5.1310 8.5275 119.8863 54.5152 33.8089 174.3259 86 Q 5.1518 10.0991 122.4527 54.2180 32.7284 174.0989 87 E 5.3434 9.2738 123.2902 54.4369 33.1128 174.6516 88 L 5.2984 9.3262 126.3517 53.3853 45.1297 174.4631 89 E 5.1948 9.3018 127.7500 54.4866 32.7647 174.7318 90 I 4.6998 9.0624 127.0664 59.8804 41.7905 174.3726 91 V 4.4209 8.6130 128.3805 60.2176 32.1181 175.1726 92 I 4.6681 8.1203 131.4991 58.3661 38.6269 174.4436 93 G 4.0313 8.8218 118.6063 45.3653 0.0000 173.4083 94 D 4.5201 9.2785 118.3272 55.6872 40.5700 178.9238 95 E 4.1454 8.0762 119.2854 57.2304 29.8995 175.6630 96 H 5.2556 8.3523 121.6250 54.5936 30.6309 172.1200 97 I 4.3632 8.8165 117.8576 59.4673 40.3574 174.7787 98 S 5.0313 7.5629 115.8218 57.3384 65.4297 173.3859 99 F 5.1938 9.5833 124.5000 56.1004 42.9552 174.1073 100 T 5.3346 9.0198 118.6013 62.3587 71.6058 173.1583 101 T 5.0661 9.2542 119.8550 60.5335 71.9080 172.8981 102 S 5.2136 8.4036 119.1396 57.3330 64.2996 173.4618 103 K 4.5921 8.5857 119.3765 56.6512 33.0026 177.0005 104 I 4.5395 8.1787 121.2431 59.5849 39.9704 176.1417 105 G 3.7170 8.9794 115.4903 48.0792 0.0000 173.2582 106 S 4.5289 7.5801 112.6068 55.5270 65.2662 175.5353 107 L 3.5722 8.1059 120.6447 56.9519 41.0987 179.9056 108 I 3.6771 7.2312 119.3958 64.4815 36.9477 177.7927 109 D 4.2814 7.5764 118.0521 57.3488 40.8997 178.7482 110 V 3.5090 7.4155 118.1316 66.0656 31.3166 177.5375 111 N 4.4691 7.5149 114.5551 55.4873 38.5926 176.8302 112 Q 4.1932 8.0216 118.3227 56.3679 29.2002 176.4802 113 S 4.4360 6.8216 114.3165 57.5773 63.8648 174.7504 114 K 4.2027 8.4789 120.2125 58.4202 32.3961 177.3453 115 D 4.8113 7.6348 118.4927 50.7208 41.4974 173.7371 116 P 4.2887 0.0000 0.0000 66.1789 31.4625 178.6543 117 E 4.0612 8.4180 118.5743 60.8411 29.2953 181.0963 118 G 4.0267 8.6840 107.6804 46.7080 0.0000 176.0876 119 L 2.9949 7.7563 121.1757 56.8112 41.3838 179.5201 120 R 3.8342 8.0550 119.1657 59.5089 30.0446 178.6596 121 V 3.7034 7.4106 117.6878 65.9934 31.4430 177.6853 122 F 4.0179 7.9846 120.5104 61.3211 39.0622 176.1135 123 Y 4.0155 8.3751 119.5559 61.3651 38.2937 178.1249 124 Y 4.1277 8.1834 116.8220 60.1893 38.0611 177.8647 125 L 3.9060 7.7173 121.3701 58.0124 42.3185 178.9279 126 V 3.1108 7.6835 118.5628 65.8643 31.2755 177.7963 127 Q 3.7776 7.3189 117.4252 59.2833 28.5711 178.8873 128 D 4.3015 7.5717 119.3948 57.0995 40.6642 179.0629 129 L 3.8081 7.8439 119.5000 57.6661 41.6640 179.1649 130 K 2.9644 7.4073 118.2673 59.6390 32.0353 178.4799 131 C 3.9357 7.8766 118.4086 62.4380 31.2780 175.5330 132 L 3.8288 7.5378 121.2067 58.1363 41.6952 178.9048 133 V 3.4472 7.6354 118.5004 66.1094 31.2416 177.9772 134 F 4.4463 8.4203 118.1019 60.7700 38.3774 177.7692 135 S 4.1551 8.0228 114.3139 61.7318 62.6913 176.6455 136 L 4.1018 8.1724 122.1222 57.7682 41.6738 179.5763 137 I 4.2066 8.3386 113.3439 63.6747 37.5289 178.4162 138 G 3.6776 8.4513 108.3966 47.3859 0.0000 175.3116 139 L 4.3858 7.5651 119.3436 56.3290 42.2108 177.7201 140 H 4.4878 7.9904 115.6650 56.9525 30.0041 175.3565 141 F 4.5752 7.6389 114.3297 59.1446 42.6052 175.3723 142 K 4.1220 7.7136 120.5401 55.9294 32.2892 176.3394 143 I 3.8811 8.2575 127.8600 60.4837 37.6548 175.7205 144 K 3.9878 8.6017 126.8857 56.0336 32.3567 174.9440 145 P 4.4258 0.0000 0.0000 64.8585 31.7183 176.4426 146 I 4.1895 7.4458 122.5131 61.4147 38.0445 174.8906 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 4 D 8.22 4.74 0.00 2.83 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 5 F 8.60 5.03 0.00 3.25 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 6 Y 7.25 5.09 0.00 3.03 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 7.35 4.50 0.00 1.52 1.21 1.01 0.74 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 8 R 8.80 4.96 0.00 1.68 1.58 0.00 3.25 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.62 0.00 9 Y 8.21 5.26 0.00 2.56 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 10 Y 7.72 4.88 0.00 2.83 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 11 V 6.48 4.28 1.85 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 0.56 0.00 0.00 0.91 0.00 0.00 12 G 7.94 4.40 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 0.00 13 H 8.13 4.96 0.00 3.29 3.56 0.00 5.41 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.91 5.10 0.00 1.75 1.79 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.67 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.36 1.45 7.81 15 G 8.71 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 8.63 3.99 0.00 1.46 1.71 0.00 1.30 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.03 0.21 7.81 17 F 8.03 5.02 0.00 3.47 3.21 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 18 G 8.30 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 H 8.56 5.05 0.00 3.20 3.41 0.00 5.74 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 9.03 4.68 0.00 1.67 1.77 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 2.33 2.36 0.00 21 F 8.21 5.26 0.00 2.94 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 22 L 8.87 5.14 0.00 1.73 1.58 1.33 1.10 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 23 E 9.58 5.06 0.00 2.27 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 2.22 2.45 0.00 24 F 8.45 5.62 0.00 3.12 3.32 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 25 E 9.68 5.09 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.37 0.00 26 F 9.36 4.91 0.00 2.99 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 27 R 8.71 4.91 0.00 1.89 2.04 0.00 3.24 0.00 0.00 3.36 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.89 0.00 28 P 0.00 4.98 0.00 2.26 2.49 0.00 3.44 0.00 0.00 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.95 0.00 29 D 8.55 4.49 0.00 3.00 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 30 G 7.22 3.85 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 0.00 31 K 7.46 4.12 0.00 1.12 1.41 0.00 1.39 0.00 0.00 1.46 0.00 0.00 3.05 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.06 0.25 7.81 32 L 9.53 4.95 0.00 1.64 1.45 0.86 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.17 4.68 0.00 1.83 1.88 0.00 3.25 0.00 0.00 3.29 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.63 0.00 34 Y 9.26 5.41 0.00 2.98 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 35 A 8.24 4.59 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 36 N 8.36 5.05 0.00 2.58 2.50 0.00 0.00 6.35 6.67 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 37 N 8.43 5.00 0.00 1.92 1.42 0.00 0.00 6.30 7.08 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 38 S 8.01 4.68 0.00 3.78 3.60 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 39 N 8.74 5.35 0.00 2.97 2.84 0.00 0.00 6.87 6.87 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 40 Y 8.04 3.67 0.00 2.77 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 41 K 9.05 3.65 0.00 1.76 1.70 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.97 0.30 7.81 42 N 8.34 4.25 0.00 2.88 2.93 0.00 0.00 7.14 8.06 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 43 D 7.67 4.54 0.00 3.02 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 44 V 7.70 4.61 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 0.75 0.00 0.00 0.92 0.00 0.00 45 M 8.56 4.10 0.00 1.98 1.92 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.62 0.00 46 I 8.80 4.62 1.93 0.00 0.00 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 1.21 0.89 0.98 0.00 0.00 47 R 8.52 5.11 0.00 1.65 1.79 0.00 3.17 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.62 0.00 48 K 9.02 4.56 0.00 1.54 0.76 0.00 1.06 0.00 0.00 0.61 0.00 0.00 2.53 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.59 1.25 7.81 49 E 9.05 5.79 0.00 1.94 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 2.25 2.19 0.00 50 A 8.36 4.84 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 51 Y 8.89 4.75 0.00 2.83 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.13 4.58 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 0.77 0.00 0.00 1.17 0.00 0.00 53 H 8.69 4.68 0.00 3.18 3.18 0.00 5.70 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.37 4.03 0.00 2.07 2.02 0.00 1.68 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.49 1.07 7.81 55 S 7.78 4.02 0.00 4.06 4.15 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 V 7.84 3.48 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 1.02 0.00 0.00 0.95 0.00 0.00 57 M 7.98 3.83 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.62 0.00 58 E 8.34 3.75 0.00 2.18 1.85 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 2.24 2.27 0.00 59 E 7.89 3.86 0.00 2.08 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 2.23 2.25 0.00 60 L 7.45 3.74 0.00 1.59 1.36 0.76 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 61 K 7.39 3.41 0.00 0.96 1.58 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.30 7.81 62 R 7.43 3.80 0.00 1.96 1.97 0.00 3.11 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 63 I 7.59 3.68 1.93 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 1.46 0.61 0.87 0.00 0.00 64 I 7.61 3.80 2.11 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.07 1.07 0.00 0.00 65 D 8.23 4.60 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 66 D 8.16 4.47 0.00 2.69 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 67 S 8.02 4.23 0.00 4.08 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 68 E 8.21 4.03 0.00 2.23 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 2.28 2.26 0.00 69 I 7.35 3.94 1.99 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 1.55 1.72 1.12 0.00 0.00 70 T 8.11 4.25 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 71 K 7.70 4.34 0.00 2.03 1.97 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.49 7.81 72 E 8.35 4.61 0.00 2.36 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 0.00 2.61 2.58 0.00 73 D 8.03 4.67 0.00 2.66 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 74 D 8.23 3.37 0.00 2.51 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 0.00 0.00 0.00 75 A 6.96 3.80 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 76 L 7.51 4.54 0.00 1.79 1.80 0.97 0.93 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 77 W 8.05 4.75 0.00 3.21 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.54 0.00 2.11 2.00 0.00 3.64 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 2.09 2.10 0.00 79 P 0.00 4.59 0.00 2.10 2.07 0.00 3.83 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 80 P 0.00 4.39 0.00 2.09 2.11 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.16 0.00 81 D 8.16 4.69 0.00 2.78 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 82 R 8.79 3.94 0.00 1.83 2.07 0.00 3.38 0.00 0.00 3.16 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 83 V 7.31 3.58 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 0.75 0.00 0.00 0.94 0.00 0.00 84 G 6.72 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 85 R 8.53 5.13 0.00 1.99 1.96 0.00 3.13 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 86 Q 10.10 5.15 0.00 2.36 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.52 0.00 0.00 0.00 0.00 0.00 2.55 2.43 0.00 87 E 9.27 5.34 0.00 1.95 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 2.24 2.32 0.00 88 L 9.33 5.30 0.00 2.30 2.15 1.07 0.77 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 89 E 9.30 5.19 0.00 2.10 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 90 I 9.06 4.70 1.92 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.70 0.90 0.00 0.00 91 V 8.61 4.42 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 1.12 0.00 0.00 0.73 0.00 0.00 92 I 8.12 4.67 2.07 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.28 1.00 0.00 0.00 93 G 8.82 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 9.28 4.52 0.00 2.71 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 95 E 8.08 4.15 0.00 2.06 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 2.43 2.34 0.00 96 H 8.35 5.26 0.00 3.06 3.09 0.00 5.73 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.82 4.36 1.66 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.13 0.91 0.00 0.00 98 S 7.56 5.03 0.00 3.79 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 99 F 9.58 5.19 0.00 3.18 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 0.00 100 T 9.02 5.33 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 1.26 0.00 0.00 101 T 9.25 5.07 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 102 S 8.40 5.21 0.00 4.05 4.15 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 0.00 103 K 8.59 4.59 0.00 1.72 1.87 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.51 1.53 7.81 104 I 8.18 4.54 2.09 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.71 0.83 0.00 0.00 105 G 8.98 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 S 7.58 4.53 0.00 3.91 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 0.00 107 L 8.11 3.57 0.00 1.60 1.64 1.05 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.23 3.68 1.82 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.53 0.87 0.00 0.00 109 D 7.58 4.28 0.00 2.69 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 0.00 110 V 7.42 3.51 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 0.92 0.00 0.00 0.43 0.00 0.00 111 N 7.51 4.47 0.00 2.71 2.82 0.00 0.00 7.12 7.61 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 0.00 112 Q 8.02 4.19 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.95 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 113 S 6.82 4.44 0.00 3.92 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 0.00 114 K 8.48 4.20 0.00 2.01 1.96 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.40 7.81 115 D 7.63 4.81 0.00 2.66 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.29 0.00 2.28 2.37 0.00 3.80 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.02 0.00 117 E 8.42 4.06 0.00 1.99 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 2.33 1.98 0.00 118 G 8.68 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 0.00 119 L 7.76 2.99 0.00 1.46 1.32 0.55 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 120 R 8.05 3.83 0.00 1.99 2.16 0.00 3.20 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 121 V 7.41 3.70 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 1.08 0.00 0.00 1.05 0.00 0.00 122 F 7.98 4.02 0.00 2.82 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 0.00 123 Y 8.38 4.02 0.00 3.01 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 Y 8.18 4.13 0.00 3.20 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 0.00 125 L 7.72 3.91 0.00 1.79 1.79 0.90 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 126 V 7.68 3.11 1.58 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 0.33 0.00 0.00 -0.06 0.00 0.00 127 Q 7.32 3.78 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.57 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 128 D 7.57 4.30 0.00 2.75 2.65 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 0.00 129 L 7.84 3.81 0.00 1.63 1.80 0.95 0.68 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 0.00 130 K 7.41 2.96 0.00 1.73 1.25 0.00 1.52 0.00 0.00 1.61 0.00 0.00 3.15 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.22 1.27 7.81 131 C 7.88 3.94 0.00 3.07 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 0.00 132 L 7.54 3.83 0.00 1.68 1.69 0.86 1.08 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 0.00 133 V 7.64 3.45 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.04 0.00 0.00 134 F 8.42 4.45 0.00 3.03 2.87 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 0.00 135 S 8.02 4.16 0.00 4.16 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 0.00 136 L 8.17 4.10 0.00 1.84 1.74 1.08 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 137 I 8.34 4.21 1.57 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.66 0.69 0.00 0.00 138 G 8.45 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 0.00 139 L 7.57 4.39 0.00 1.64 1.74 0.99 0.97 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 0.00 140 H 7.99 4.49 0.00 3.19 3.16 0.00 5.89 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 F 7.64 4.58 0.00 3.27 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 0.00 142 K 7.71 4.12 0.00 1.80 1.97 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.41 7.81 143 I 8.26 3.88 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.52 0.91 0.00 0.00 144 K 8.60 3.99 0.00 1.71 1.73 0.00 1.77 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 1.42 1.46 7.81 145 P 0.00 4.43 0.00 2.07 2.09 0.00 3.66 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 146 I 7.45 4.19 1.86 0.00 0.00 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 1.27 0.59 0.91 0.00 0.00