NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4250 8.3049 120.3500 54.8855 33.4070 175.3210 2 K 4.0292 8.4436 125.0267 55.2293 33.0806 173.3163 3 E 4.2537 9.3769 123.1321 56.4491 31.7963 175.2493 4 K 5.1861 8.5869 123.2681 54.6443 35.3945 175.2389 5 F 5.0040 9.5203 124.6958 56.4333 42.9620 173.5880 6 V 4.5781 7.7548 125.8239 60.9771 33.7574 173.7444 7 L 4.9057 8.7238 130.9542 53.4942 44.0723 174.8024 8 I 4.7874 8.6957 128.2205 59.8708 39.3534 174.8056 9 I 5.1056 9.0041 128.2930 59.7600 40.4435 174.8956 10 T 5.2272 8.5705 116.2100 60.4699 73.0812 172.4333 11 H 4.6177 9.9383 119.4359 56.3715 29.4232 176.8065 12 G 3.7962 9.1283 111.6509 47.0316 0.0000 174.3586 13 D 4.7980 8.5624 123.8880 54.5195 41.3381 177.8418 14 F 4.5462 8.3416 124.0659 61.6482 39.2615 177.5453 15 G 3.2156 8.1023 105.2421 47.3371 0.0000 175.4052 16 K 3.9277 8.0137 121.7909 59.3934 32.1726 179.0014 17 G 3.5925 8.2790 105.9778 47.4459 0.0000 175.4747 18 L 3.9403 8.1945 123.1262 57.8522 42.0749 178.9125 19 L 3.8280 7.9187 120.2961 58.0492 41.8257 178.5031 20 S 4.1691 7.9589 112.0978 61.5856 62.4253 176.2207 21 G 3.7250 8.4219 108.1676 47.7710 0.0000 175.3332 22 A 4.0221 8.2082 123.6766 55.0820 18.4118 179.5921 23 E 4.0579 8.4064 116.5653 58.9892 29.2363 179.4996 24 V 3.6203 7.2902 117.9973 65.6279 31.4974 177.6624 25 I 4.0894 7.4981 118.3055 63.1929 37.6619 176.6724 26 I 4.1477 7.7187 109.6576 59.9184 37.7849 176.3557 27 G 3.9892 7.9840 107.9101 44.7227 0.0000 173.6112 28 K 4.0631 8.4226 119.9255 56.6471 32.5510 175.8404 29 Q 4.5838 9.0803 127.6266 54.8407 30.6447 175.9019 30 E 4.5131 8.4468 117.1400 54.7893 31.8872 174.4293 31 N 4.9943 8.6981 110.3948 55.7026 36.3180 174.1532 32 V 4.4852 7.1891 115.2201 61.3451 34.8491 174.0863 33 H 5.1044 8.8175 125.9578 54.7085 33.6137 171.8268 34 T 5.0325 8.1875 114.1574 59.8740 71.5475 173.4794 35 V 4.3556 8.8404 123.3663 61.1840 34.7994 174.1992 36 G 4.4985 8.7326 114.2316 43.5410 0.0000 172.1084 37 L 4.9021 8.8015 123.7303 53.1488 43.2893 175.7218 38 N 5.2766 9.5896 121.5370 50.7562 42.1331 174.5341 39 L 3.9906 8.3790 120.3731 56.6885 42.0617 177.9659 40 G 4.0506 8.9078 111.4744 45.4353 0.0000 173.6894 41 D 4.3129 7.5553 119.3638 54.3018 41.4235 176.4968 42 N 4.5408 8.6155 121.3236 53.1105 39.3093 175.7932 43 I 3.7686 8.3309 130.3382 64.4114 37.2524 178.2180 44 E 3.9652 8.4654 119.7366 59.1687 29.2851 179.4016 45 V 3.5930 7.9351 117.9737 65.8755 31.6132 178.1299 46 V 3.5600 7.7968 118.0251 65.9626 31.3270 177.7053 47 R 3.8614 8.1795 118.6979 59.7093 29.8469 178.6062 48 K 4.0414 8.2884 120.4706 59.9546 32.1129 179.8621 49 E 3.9873 8.2718 118.7017 61.0499 29.6362 181.5390 50 V 3.7586 7.9510 119.5406 65.8638 31.5856 177.7178 51 E 3.7828 8.5367 121.7486 59.6216 29.2870 179.6363 52 K 3.9103 8.0472 123.6993 59.7755 31.8266 181.4952 53 I 3.7348 7.4847 121.2160 64.2060 36.9532 178.6189 54 I 3.6050 7.7764 122.8405 64.8070 36.9136 179.2021 55 K 3.9402 7.9753 126.9437 60.5601 31.3045 181.2529 56 E 4.1381 7.9963 118.6953 60.8915 29.8466 180.8985 57 K 4.1657 7.7987 119.0472 59.1292 32.1551 179.5474 58 L 4.1178 8.3179 122.0173 58.2640 41.2840 179.9213 59 Q 4.2320 7.9305 119.4063 58.9266 26.9892 180.7004 60 E 4.6656 7.9460 117.3079 55.7188 29.6344 175.4749 61 D 4.5815 7.6906 116.6743 55.2020 40.3279 173.4904 62 K 4.7226 7.2062 115.0474 54.7780 34.0464 176.1894 63 E 4.4749 9.2212 124.2500 55.6099 31.6590 174.9428 64 I 5.0759 8.3593 126.0089 59.6350 40.3476 174.2282 65 I 4.8691 8.9768 128.1724 59.5836 40.0451 174.4820 66 I 4.7669 9.0799 128.7271 59.7381 39.2703 174.7216 67 V 4.8373 8.9888 127.9112 61.3269 33.3344 174.9738 68 V 5.5784 8.9062 120.4063 58.5408 35.2989 176.4767 69 D 4.7517 8.9410 122.4959 56.0369 40.6804 176.4394 70 L 4.7287 7.7510 116.7160 52.2860 45.4879 175.7086 71 F 3.2519 8.6898 125.2017 59.7715 39.1233 175.7837 72 G 3.7325 5.7483 114.4958 46.7581 0.0000 172.3974 73 G 4.1220 8.7840 106.6984 44.5729 0.0000 175.0100 74 S 4.1265 8.8914 115.1425 61.1257 62.7725 175.2830 75 P 4.2337 0.0000 0.0000 65.5565 31.0459 178.3668 76 F 4.1443 8.2047 118.8454 61.4414 39.3763 176.7650 77 N 4.1069 8.6302 116.5035 56.1601 38.2410 177.4091 78 I 3.6198 8.2189 121.4057 64.2968 37.2533 178.1921 79 A 3.9175 7.9529 121.4621 55.2865 18.3140 179.6762 80 L 3.7559 7.6580 117.7120 57.8285 41.6653 179.9709 81 S 4.1658 8.0325 114.2030 61.5154 62.8434 176.5958 82 M 4.2525 7.8751 122.1905 58.5169 31.5211 178.3269 83 M 4.3875 7.9687 119.5886 58.9343 32.3590 178.8081 84 K 4.2063 7.8612 125.5502 59.7667 32.0534 182.1973 85 E 4.5691 7.6882 112.4209 55.5629 31.1454 176.8773 86 Y 4.8147 8.2967 116.1393 57.5589 41.7322 176.4558 87 D 4.7629 8.5563 121.1062 52.3214 38.4820 176.6857 88 V 4.8882 7.7332 116.8995 59.0668 36.2597 174.5951 89 K 4.7563 8.5472 120.9562 54.7812 35.0840 175.5643 90 V 4.9978 8.2911 121.7549 61.2369 34.7164 174.4595 91 I 4.8752 8.7493 126.5106 59.5574 41.5844 174.1573 92 T 5.1318 8.1165 117.9796 59.1429 71.8795 173.5505 93 G 4.0245 8.8176 106.4930 47.0283 0.0000 173.7256 94 I 3.7038 8.1095 119.1795 61.1034 38.4664 174.3354 95 N 5.2633 8.3707 123.0157 50.4776 40.8737 174.6302 96 M 4.0183 8.7509 116.3049 58.4235 32.2216 176.1670 97 P 4.2582 0.0000 0.0000 66.0547 31.2514 178.2614 98 M 3.9801 7.9372 117.8847 58.2453 31.9735 178.3290 99 L 3.9235 7.9314 120.4497 57.8865 42.2659 178.8668 100 V 3.5502 7.9003 118.3763 66.2428 31.4814 177.7359 101 E 4.0200 8.0803 120.1450 58.3744 29.4754 178.2878 102 L 3.9279 8.2402 120.8738 58.4294 41.9714 179.1623 103 L 4.1506 7.9124 117.6454 57.7480 41.4534 179.2440 104 T 4.1619 8.1107 110.2191 63.6407 68.7694 176.0215 105 S 4.8044 7.9334 114.9965 57.9675 63.1909 175.4181 106 I 3.6371 7.2512 123.3059 64.2557 37.6722 176.2795 107 N 4.8553 8.0705 113.7979 52.9951 38.8890 175.3470 108 V 3.8634 7.8220 119.4831 63.7862 32.2176 175.6200 109 Y 4.8396 7.5984 115.3882 55.0808 41.2406 175.5247 110 D 4.5980 8.5602 122.3150 53.8198 41.4010 177.6935 111 T 3.8912 8.5052 118.1150 67.2220 68.6411 177.0569 112 T 3.8592 7.8608 117.0712 66.6026 68.5941 176.1746 113 E 3.9152 8.1538 120.7319 59.0637 29.6849 178.3092 114 L 3.6636 8.0743 120.4017 58.2570 42.1821 179.0735 115 L 3.9615 8.1698 119.1113 57.6185 41.3710 179.0920 116 E 3.9192 8.0956 119.1151 59.2390 29.5199 178.6288 117 N 4.2433 8.1533 116.7540 56.3557 38.6390 177.4962 118 I 3.7374 7.9114 114.3794 63.5631 37.7381 178.1297 119 S 4.0521 8.1452 115.3489 61.1843 62.1228 176.0650 120 K 3.9087 7.7926 122.1637 59.5452 32.0384 178.7344 121 I 3.7705 7.9678 120.3163 64.3024 36.7985 178.5257 122 G 3.6609 8.2554 105.6256 47.9000 0.0000 175.5837 123 K 4.1553 7.9708 121.1676 59.2358 31.8914 179.3561 124 D 4.5443 8.3357 118.3781 56.8258 40.7844 178.2005 125 G 4.0257 7.7249 103.7933 44.4125 0.0000 173.3682 126 I 4.3315 7.1723 122.2103 59.6133 37.5276 175.3317 127 K 4.6004 8.2362 124.0271 54.4527 35.9186 175.9843 128 V 4.2099 8.3030 122.0694 61.2476 32.7110 175.0050 129 I 4.4571 8.4452 129.8619 59.9197 39.5436 175.7979 130 E 4.8162 8.5653 124.1296 55.3592 34.3404 173.1116 131 K 3.9995 8.6207 119.8641 60.5645 32.1812 179.0391 132 S 4.0786 7.9838 112.7970 61.4286 62.2696 176.1200 133 S 4.1876 8.0132 115.0867 61.1869 62.8173 176.2036 134 L 4.0904 7.6544 122.8204 57.7355 41.6071 179.2040 135 K 3.8944 7.8074 119.3821 59.7339 31.8718 178.0293 136 M 4.3448 7.7374 116.2980 56.6900 32.0042 177.6007 137 L 4.2663 7.8169 118.8700 56.0539 42.1243 176.5092 138 E 4.1453 7.8497 122.8509 56.5700 29.3780 176.5407 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 1 M 8.30 4.42 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 2 K 8.44 4.03 0.00 1.89 1.89 0.00 1.82 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.50 7.81 3 E 9.38 4.25 0.00 2.07 1.84 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 2.43 2.38 0.00 4 K 8.59 5.19 0.00 1.68 1.72 0.00 1.89 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.43 7.81 5 F 9.52 5.00 0.00 3.03 2.86 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 6 V 7.75 4.58 1.82 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 0.74 0.00 0.00 0.82 0.00 0.00 7 L 8.72 4.91 0.00 1.93 1.53 1.17 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.70 4.79 1.74 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.49 0.73 0.00 0.00 9 I 9.00 5.11 1.87 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 1.28 1.00 0.90 0.00 0.00 10 T 8.57 5.23 4.67 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 1.07 0.00 0.00 11 H 9.94 4.62 0.00 3.21 3.31 0.00 5.96 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 9.13 3.80 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 0.00 0.00 0.00 13 D 8.56 4.80 0.00 2.76 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 14 F 8.34 4.55 0.00 3.00 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 15 G 8.10 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 0.00 0.00 0.00 16 K 8.01 3.93 0.00 1.80 1.97 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.49 7.81 17 G 8.28 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 18 L 8.19 3.94 0.00 1.47 1.52 0.96 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.92 3.83 0.00 1.69 1.76 0.86 0.65 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 20 S 7.96 4.17 0.00 4.06 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 21 G 8.42 3.73 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 22 A 8.21 4.02 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 23 E 8.41 4.06 0.00 2.16 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 2.52 2.44 0.00 24 V 7.29 3.62 2.30 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 0.83 0.00 0.00 0.93 0.00 0.00 25 I 7.50 4.09 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.68 0.91 0.00 0.00 26 I 7.72 4.15 1.87 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 1.46 0.61 0.91 0.00 0.00 27 G 7.98 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 28 K 8.42 4.06 0.00 1.70 1.74 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.53 7.81 29 Q 9.08 4.58 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.53 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 30 E 8.45 4.51 0.00 1.88 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 2.25 1.88 0.00 31 N 8.70 4.99 0.00 2.91 3.17 0.00 0.00 6.18 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 7.19 4.49 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 0.62 0.00 0.00 0.88 0.00 0.00 33 H 8.82 5.10 0.00 3.47 3.22 0.00 5.78 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.19 5.03 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 1.11 0.00 0.00 35 V 8.84 4.36 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 0.94 0.00 0.00 0.95 0.00 0.00 36 G 8.73 4.50 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 0.00 37 L 8.80 4.90 0.00 1.60 1.60 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 38 N 9.59 5.28 0.00 2.69 2.72 0.00 0.00 6.56 6.60 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 39 L 8.38 3.99 0.00 1.64 1.63 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.91 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 41 D 7.56 4.31 0.00 2.82 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 42 N 8.62 4.54 0.00 2.76 2.73 0.00 0.00 7.18 7.93 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 43 I 8.33 3.77 1.88 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 1.65 0.78 0.91 0.00 0.00 44 E 8.47 3.97 0.00 2.13 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 2.33 2.46 0.00 45 V 7.94 3.59 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 1.03 0.00 0.00 0.93 0.00 0.00 46 V 7.80 3.56 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 1.01 0.00 0.00 0.97 0.00 0.00 47 R 8.18 3.86 0.00 2.06 2.06 0.00 3.14 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 48 K 8.29 4.04 0.00 2.10 1.83 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.46 1.32 7.81 49 E 8.27 3.99 0.00 1.99 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 2.24 2.19 0.00 50 V 7.95 3.76 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 0.89 0.00 0.00 0.97 0.00 0.00 51 E 8.54 3.78 0.00 2.08 2.05 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 2.26 2.16 0.00 52 K 8.05 3.91 0.00 1.82 1.80 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.37 1.35 7.81 53 I 7.48 3.73 1.98 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 1.42 0.59 0.83 0.00 0.00 54 I 7.78 3.61 1.60 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.76 0.54 0.00 0.00 55 K 7.98 3.94 0.00 1.76 1.82 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.33 7.81 56 E 8.00 4.14 0.00 2.05 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 2.26 2.23 0.00 57 K 7.80 4.17 0.00 1.66 1.64 0.00 1.07 0.00 0.00 1.26 0.00 0.00 2.38 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 0.21 7.81 58 L 8.32 4.12 0.00 1.82 1.75 1.07 1.17 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 59 Q 7.93 4.23 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.21 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 60 E 7.95 4.67 0.00 2.09 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.42 0.00 61 D 7.69 4.58 0.00 3.06 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 62 K 7.21 4.72 0.00 1.98 1.77 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.36 7.81 63 E 9.22 4.47 0.00 2.04 1.84 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 2.31 2.32 0.00 64 I 8.36 5.08 1.92 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 1.46 0.92 1.01 0.00 0.00 65 I 8.98 4.87 1.85 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 1.25 0.88 0.91 0.00 0.00 66 I 9.08 4.77 1.87 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 1.13 0.91 0.95 0.00 0.00 67 V 8.99 4.84 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 0.84 0.00 0.00 0.89 0.00 0.00 68 V 8.91 5.58 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 0.79 0.00 0.00 1.19 0.00 0.00 69 D 8.94 4.75 0.00 3.03 3.47 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 70 L 7.75 4.73 0.00 1.69 1.72 0.90 0.80 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 71 F 8.69 3.25 0.00 2.79 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 72 G 5.75 3.73 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 73 G 8.78 4.12 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 0.00 0.00 0.00 74 S 8.89 4.13 0.00 3.87 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 75 P 0.00 4.23 0.00 2.18 2.11 0.00 3.47 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 1.85 2.01 0.00 76 F 8.20 4.14 0.00 3.27 3.14 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 77 N 8.63 4.11 0.00 2.86 2.81 0.00 0.00 7.06 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 78 I 8.22 3.62 1.98 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 1.43 1.37 0.88 0.00 0.00 79 A 7.95 3.92 1.27 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 80 L 7.66 3.76 0.00 1.51 1.50 0.62 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.03 4.17 0.00 4.05 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 M 7.88 4.25 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.89 0.00 83 M 7.97 4.39 0.00 2.10 2.07 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 2.82 2.56 0.00 84 K 7.86 4.21 0.00 1.93 1.71 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.32 7.81 85 E 7.69 4.57 0.00 2.09 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 2.17 2.12 0.00 86 Y 8.30 4.81 0.00 2.98 2.86 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 87 D 8.56 4.76 0.00 2.69 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 7.73 4.89 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 0.92 0.00 0.00 0.96 0.00 0.00 89 K 8.55 4.76 0.00 1.73 1.70 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.37 7.81 90 V 8.29 5.00 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 0.84 0.00 0.00 0.91 0.00 0.00 91 I 8.75 4.88 1.90 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 1.33 1.36 0.93 0.00 0.00 92 T 8.12 5.13 4.36 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 1.50 0.00 0.00 93 G 8.82 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 94 I 8.11 3.70 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.74 0.95 0.00 0.00 95 N 8.37 5.26 0.00 2.94 2.95 0.00 0.00 5.90 7.66 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 96 M 8.75 4.02 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.67 0.00 97 P 0.00 4.26 0.00 2.30 2.30 0.00 3.68 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 98 M 7.94 3.98 0.00 2.08 2.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.82 0.00 99 L 7.93 3.92 0.00 1.74 1.63 0.85 0.78 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 0.00 100 V 7.90 3.55 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 0.94 0.00 0.00 0.96 0.00 0.00 101 E 8.08 4.02 0.00 2.14 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 2.27 2.19 0.00 102 L 8.24 3.93 0.00 1.82 1.84 0.91 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.91 4.15 0.00 1.64 1.69 0.87 0.83 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 0.00 104 T 8.11 4.16 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 1.24 0.00 0.00 105 S 7.93 4.80 0.00 4.40 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 0.00 106 I 7.25 3.64 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 1.30 0.71 0.96 0.00 0.00 107 N 8.07 4.86 0.00 2.74 2.81 0.00 0.00 6.78 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.82 3.86 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 0.11 0.00 0.00 0.88 0.00 0.00 109 Y 7.60 4.84 0.00 2.95 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 0.00 110 D 8.56 4.60 0.00 3.04 2.86 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 0.00 111 T 8.51 3.89 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 1.23 0.00 0.00 112 T 7.86 3.86 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 1.23 0.00 0.00 113 E 8.15 3.92 0.00 2.09 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 114 L 8.07 3.66 0.00 1.95 1.86 0.90 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.17 3.96 0.00 1.72 1.70 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.10 3.92 0.00 2.06 2.05 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 2.28 2.34 0.00 117 N 8.15 4.24 0.00 2.71 2.65 0.00 0.00 6.80 6.96 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 0.00 118 I 7.91 3.74 1.85 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 1.65 1.04 0.91 0.00 0.00 119 S 8.15 4.05 0.00 3.92 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 0.00 120 K 7.79 3.91 0.00 1.83 1.94 0.00 1.57 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.61 7.81 121 I 7.97 3.77 1.99 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 1.44 0.97 0.90 0.00 0.00 122 G 8.26 3.66 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 0.00 0.00 0.00 123 K 7.97 4.16 0.00 1.96 1.86 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.63 7.81 124 D 8.34 4.54 0.00 2.69 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 0.00 125 G 7.72 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 0.00 126 I 7.17 4.33 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.78 0.90 0.00 0.00 127 K 8.24 4.60 0.00 1.67 1.64 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.33 1.40 7.81 128 V 8.30 4.21 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 0.81 0.00 0.00 0.92 0.00 0.00 129 I 8.45 4.46 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.79 0.91 0.00 0.00 130 E 8.57 4.82 0.00 1.94 1.76 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 2.12 2.13 0.00 131 K 8.62 4.00 0.00 1.85 1.86 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.58 7.81 132 S 7.98 4.08 0.00 3.92 3.83 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 0.00 133 S 8.01 4.19 0.00 4.06 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 0.00 134 L 7.65 4.09 0.00 1.89 1.75 0.92 0.84 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 0.00 135 K 7.81 3.89 0.00 1.81 1.95 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 136 M 7.74 4.34 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.88 0.00 137 L 7.82 4.27 0.00 1.77 1.71 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 138 E 7.85 4.15 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 2.34 2.41 0.00