NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4176 8.3044 118.1930 54.8784 32.8077 175.4304 2 S 4.0404 8.0483 113.6569 58.5679 63.2773 171.8318 3 N 4.4276 8.8226 124.7159 53.4319 39.8641 173.5392 4 E 4.6959 8.2594 122.0048 53.7079 32.4567 175.2103 5 D 4.3830 8.5518 123.0007 55.1878 41.2670 177.0675 6 L 4.0052 8.2054 122.5570 55.5585 42.3260 176.8793 7 F 5.2333 7.4814 116.2150 55.7082 41.3815 175.3366 8 I 4.1344 8.8293 126.8279 63.5550 37.7694 175.4905 9 C 4.6814 7.3917 114.3306 57.7150 32.3293 172.6918 10 I 4.2604 8.3042 120.3024 61.0945 36.7221 175.9662 11 D 4.6896 9.4609 128.9168 57.2881 42.0985 175.5296 12 H 5.2668 7.8656 110.9276 54.8878 31.8713 172.3452 13 V 4.7746 8.6518 119.7673 61.2565 33.1332 174.2159 14 A 4.8993 9.2443 130.8294 51.0264 20.7540 175.1108 15 Y 5.0348 9.0553 123.8548 55.7287 41.6758 174.3597 16 A 4.6467 8.2089 130.0803 50.7471 20.1043 175.4697 17 C 4.8597 8.2487 116.8960 56.1381 32.6915 173.9613 18 P 4.1687 0.0000 0.0000 64.7987 31.3178 176.4960 19 D 4.6171 7.7737 115.9412 51.2913 43.3074 175.5243 20 A 3.9199 8.4095 129.2393 55.3471 18.5565 178.3057 21 D 4.3574 8.1623 116.8463 57.8120 40.8893 178.4374 22 E 3.9045 10.2976 119.2850 59.4329 29.6367 178.4975 23 A 4.2690 8.5657 120.8433 55.6108 18.5425 179.5712 24 S 4.1304 8.9772 112.3519 61.3883 62.4376 176.5374 25 K 4.0384 8.4840 121.7474 59.4813 31.7923 178.5261 26 Y 4.2160 8.2715 119.7328 61.2536 38.2213 177.8261 27 Y 3.8689 8.4780 117.4431 60.9317 37.9899 178.9279 28 Q 4.5318 8.0144 119.6613 58.7572 28.9412 177.5238 29 E 4.0282 8.5988 118.6799 60.5621 28.2968 179.3316 30 T 3.8315 8.2629 116.3067 66.4494 68.3694 176.7741 31 F 4.6445 6.7792 123.8001 58.4392 39.4700 175.7650 32 G 4.2270 7.4831 103.8259 46.3713 0.0000 173.3966 33 W 4.7804 9.5915 119.7666 55.8501 31.0685 175.8178 34 H 4.7285 9.1358 121.4895 55.4105 29.7418 173.9903 35 E 4.6671 8.8770 124.1772 55.7505 29.8257 175.6417 36 L 4.7026 8.7516 126.3846 55.3321 43.8929 176.1264 37 H 4.5866 7.5836 115.3149 55.3344 33.0418 172.5183 38 R 4.9715 8.3112 124.0641 54.5965 33.1120 173.7386 39 E 4.7326 9.2809 125.8891 54.5235 33.8371 173.4055 40 E 4.9801 8.7067 125.0827 54.4565 32.8284 174.0316 41 N 4.8879 9.2711 126.5150 51.1312 40.6187 172.9696 42 P 4.2366 0.0000 0.0000 65.9222 31.6728 177.5657 43 E 4.0374 8.3506 117.4165 59.3020 29.2728 178.4269 44 Q 4.1899 8.2109 114.0720 55.5481 29.7077 175.6344 45 G 3.8169 8.1091 106.5261 46.5985 0.0000 173.2625 46 V 4.8475 7.4360 117.0174 60.6347 35.8424 174.2949 47 V 4.8963 8.4478 125.1070 59.9400 34.1285 174.2713 48 E 5.0551 9.4411 123.4365 54.6128 33.7400 174.8948 49 I 4.9707 8.5441 122.8230 59.9579 41.6430 174.1988 50 M 4.8599 9.0974 127.4358 54.6241 33.3295 174.9494 51 M 5.3981 9.2912 124.4556 53.5568 35.0223 175.2455 52 A 4.9345 9.0162 124.2017 49.3161 22.5266 175.3036 53 P 2.9700 0.0000 0.0000 63.5541 31.8016 175.7822 54 A 4.5185 7.0373 119.9044 49.6770 22.3398 175.8851 55 A 3.8851 8.3312 121.8397 54.6540 18.6190 178.3591 56 K 4.5667 7.5547 113.3307 54.5550 34.1367 176.1820 57 L 4.3229 8.2402 122.6936 54.3093 42.8568 176.5498 58 T 4.4838 8.0574 111.7001 60.1579 70.8443 175.5133 59 E 3.6934 8.3216 124.4275 59.7112 29.8278 178.4267 60 H 4.8050 7.8840 112.4922 55.5578 29.1547 174.2277 61 M 4.2232 8.1103 121.0054 55.5133 32.4372 175.9372 62 T 4.5843 8.3908 122.9589 63.4660 69.9547 174.0083 63 Q 4.9621 8.7514 122.9830 54.3507 32.8489 174.3243 64 V 4.8013 9.3817 120.6746 61.4434 33.9278 174.1168 65 Q 4.8975 9.2734 130.2608 54.4258 30.5306 174.4184 66 V 4.2883 8.8334 128.8992 62.9024 32.5965 174.8217 67 M 5.1157 8.8451 127.5398 53.9374 35.2821 174.8819 68 A 5.1800 8.1719 120.1824 51.0722 23.2491 174.3166 69 P 4.7491 0.0000 0.0000 63.1219 31.8496 176.2975 70 L 4.6131 8.2225 121.1815 55.5971 42.9304 175.5445 71 N 4.7583 7.6695 113.9289 52.5717 39.5675 173.6584 72 D 4.7383 8.5983 116.6358 54.6876 40.8280 177.0283 73 E 4.5425 8.9707 118.6899 55.9526 30.8130 176.6077 74 S 4.3694 7.8253 115.1458 57.8127 64.1545 175.2454 75 T 3.9052 8.6031 113.6883 65.2849 68.2669 176.7628 76 V 3.6351 7.7759 120.2050 65.4333 31.5763 177.8082 77 A 4.0306 8.0445 120.7715 54.9709 18.1819 179.5032 78 K 3.8557 7.9249 116.6412 59.4780 32.1871 178.8810 79 W 4.2522 8.1636 128.3079 60.8709 30.4920 177.6127 80 L 4.2171 8.5083 118.3176 58.0796 41.0170 179.6524 81 A 3.9227 8.1161 120.3280 55.1157 18.1738 179.4334 82 K 3.7088 8.2809 117.4350 59.4033 32.4356 177.3278 83 H 4.3826 8.2467 115.8911 55.4181 30.9745 174.6402 84 N 4.2322 8.6736 114.5710 55.4031 36.1059 174.3910 85 G 3.9714 8.4487 101.0830 46.1590 0.0000 171.8508 86 R 4.3489 7.6591 118.2850 54.3803 30.5616 176.4581 87 A 4.5901 8.8572 125.1197 51.9306 19.6266 176.3037 88 G 4.4175 8.7553 107.0412 45.7701 0.0000 172.3792 89 L 4.4572 8.8642 119.7058 56.4867 41.4963 176.5305 90 H 4.3630 10.0313 124.2706 57.7357 31.0070 173.9591 91 H 4.7692 7.5145 110.9769 55.2822 31.9345 171.3590 92 M 5.2175 8.4010 116.5350 53.6441 35.1709 173.9688 93 A 5.0609 9.0797 126.9176 49.8830 22.3141 174.7595 94 W 5.2369 9.2409 122.9294 54.8179 31.7542 175.5408 95 R 4.7704 9.0924 125.9080 56.4089 30.4768 175.5739 96 V 4.8101 9.0457 118.2312 59.7224 35.6772 176.2852 97 D 4.2588 8.8063 122.0783 56.5718 41.5990 176.2988 98 D 4.6557 7.6577 117.5715 51.5860 43.1332 174.9429 99 I 3.6995 8.9342 128.3511 63.9393 38.0363 177.3288 100 D 4.3283 8.1529 119.1321 57.2641 40.6859 178.4706 101 A 3.9431 8.7764 121.5513 55.2691 18.3802 179.7999 102 V 3.4498 7.9303 116.8922 66.1951 31.5147 178.4695 103 S 4.1043 8.4440 114.9462 61.3979 62.7191 176.3295 104 A 3.9980 8.1033 123.4515 55.5548 17.6647 179.6841 105 T 4.0655 7.9631 115.5539 66.3265 68.5967 176.6819 106 L 4.0610 8.1299 120.8584 58.0883 41.6167 179.9474 107 R 4.1560 8.1676 117.8480 59.3168 29.4949 178.9688 108 E 4.0449 8.1741 117.9047 58.8823 29.1353 178.4878 109 R 4.5368 7.3632 115.4488 55.8148 30.2827 177.1486 110 G 3.9195 8.0345 106.9964 45.2050 0.0000 173.9920 111 V 3.9567 7.6176 119.2812 62.4954 32.5495 175.2773 112 Q 4.6345 8.9658 126.2197 54.2652 30.7863 174.5292 113 L 5.0140 8.1518 123.2059 52.7315 43.8481 176.3095 114 L 4.0858 8.6889 125.5818 57.8609 42.3378 176.9156 115 Y 5.0797 7.8795 114.6629 56.0671 40.2256 175.8692 116 D 4.5464 8.9137 123.0600 56.4459 41.3396 176.4314 117 E 4.7965 7.8143 117.2906 53.0599 32.6993 173.2138 118 P 4.6725 0.0000 0.0000 63.2074 32.2401 175.9925 119 K 4.4268 9.3431 122.7089 54.7666 35.1040 175.0149 120 L 4.6136 8.3344 124.0188 54.5872 42.3706 176.2731 121 G 4.2836 9.2847 119.1222 44.3153 0.0000 172.3526 122 T 3.9458 8.3061 109.5884 62.5860 69.4961 175.5551 123 G 3.7455 9.2006 111.4841 45.8956 0.0000 174.2213 124 G 3.9319 7.7276 106.6927 44.8194 0.0000 173.8247 125 N 4.7409 7.8374 117.0223 53.2838 40.1720 174.0290 126 R 5.2307 8.6730 120.5881 54.6950 32.6382 175.5844 127 I 5.3498 8.8019 116.2127 58.6100 41.9712 173.0428 128 N 5.1087 7.7771 118.9860 53.3828 42.3375 172.4906 129 F 5.1355 8.3624 118.6933 55.8676 43.6255 174.5055 130 M 4.7415 9.1472 121.9029 54.9428 32.3748 174.7811 131 H 3.9655 8.8960 120.4600 53.4785 29.2956 174.5035 132 P 4.7328 0.0000 0.0000 66.1054 31.0332 178.8503 133 K 4.0608 8.0054 115.1726 58.9121 32.0090 178.8952 134 S 4.5266 9.2386 115.3270 60.8754 63.3408 176.3045 135 G 3.9029 7.8343 106.8462 43.7741 0.0000 171.9265 136 K 3.6564 8.6278 123.1405 56.6656 28.8799 176.5543 137 G 4.1154 8.5183 109.9226 44.8844 0.0000 171.5707 138 V 4.4002 7.2812 118.3514 59.4282 34.1839 174.2669 139 L 4.5710 8.3388 124.2287 54.4513 43.3580 174.9465 140 I 4.4214 7.8281 127.6930 59.4356 39.6800 174.3999 141 E 4.4797 8.8909 127.5487 54.3779 32.4118 174.2200 142 L 5.1835 8.2855 125.3894 53.4000 44.5200 175.6278 143 T 5.1035 9.0971 119.7341 61.8090 72.7256 172.5011 144 Q 5.2761 8.7738 127.2032 53.3797 31.6784 174.2960 145 Y 4.7389 8.9317 124.6226 57.1022 38.9453 173.8736 146 P 4.3992 0.0000 0.0000 63.0471 32.0042 176.4930 147 K 4.1307 8.4447 123.1770 56.8232 33.0252 175.5729 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 2.13 2.22 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 2 S 8.05 4.04 0.00 3.92 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 3 N 8.82 4.43 0.00 2.74 2.72 0.00 0.00 6.74 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 4 E 8.26 4.70 0.00 1.83 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.31 0.00 5 D 8.55 4.38 0.00 2.66 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.21 4.01 0.00 0.45 0.92 0.79 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 7 F 7.48 5.23 0.00 2.89 2.81 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 0.00 0.00 0.00 8 I 8.83 4.13 1.85 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.47 0.88 0.00 0.00 9 C 7.39 4.68 0.00 2.94 3.05 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 10 I 8.30 4.26 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 1.07 0.33 1.14 0.00 0.00 11 D 9.46 4.69 0.00 2.90 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 12 H 7.87 5.27 0.00 3.37 3.44 0.00 5.47 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.65 4.77 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.03 0.00 0.00 14 A 9.24 4.90 1.01 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 0.00 0.00 15 Y 9.06 5.03 0.00 2.95 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 16 A 8.21 4.65 0.62 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 0.00 0.00 17 C 8.25 4.86 0.00 2.86 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 0.00 0.00 0.00 18 P 0.00 4.17 0.00 2.07 2.16 0.00 3.63 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 19 D 7.77 4.62 0.00 2.62 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 20 A 8.41 3.92 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 21 D 8.16 4.36 0.00 2.86 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 22 E 10.30 3.90 0.00 2.11 2.18 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 2.33 2.33 0.00 23 A 8.57 4.27 1.59 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 24 S 8.98 4.13 0.00 3.90 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 25 K 8.48 4.04 0.00 2.04 1.90 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.75 1.57 7.81 26 Y 8.27 4.22 0.00 2.95 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 27 Y 8.48 3.87 0.00 3.14 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 8.01 4.53 0.00 2.16 2.19 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 2.72 2.73 0.00 29 E 8.60 4.03 0.00 1.90 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 2.57 2.53 0.00 30 T 8.26 3.83 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 0.94 0.00 0.00 31 F 6.78 4.64 0.00 2.96 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 32 G 7.48 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 33 W 9.59 4.78 0.00 3.71 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 9.14 4.73 0.00 3.25 3.27 0.00 5.80 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.88 4.67 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 2.30 2.37 0.00 36 L 8.75 4.70 0.00 1.55 1.71 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 37 H 7.58 4.59 0.00 3.19 3.08 0.00 5.80 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 38 R 8.31 4.97 0.00 1.75 1.65 0.00 3.22 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.55 0.00 39 E 9.28 4.73 0.00 1.99 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 40 E 8.71 4.98 0.00 1.93 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.25 0.00 41 N 9.27 4.89 0.00 2.80 2.64 0.00 0.00 6.52 7.38 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 42 P 0.00 4.24 0.00 2.21 2.16 0.00 3.86 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 43 E 8.35 4.04 0.00 2.13 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 2.38 2.32 0.00 44 Q 8.21 4.19 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 45 G 8.11 3.82 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 0.00 0.00 0.00 46 V 7.44 4.85 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 1.05 0.00 0.00 0.95 0.00 0.00 47 V 8.45 4.90 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 0.77 0.00 0.00 0.94 0.00 0.00 48 E 9.44 5.06 0.00 1.82 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 0.00 2.16 2.21 0.00 49 I 8.54 4.97 1.84 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 1.20 0.65 1.01 0.00 0.00 50 M 9.10 4.86 0.00 2.19 2.06 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.69 0.00 51 M 9.29 5.40 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.54 0.00 52 A 9.02 4.93 1.14 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 0.00 0.00 53 P 0.00 2.97 0.00 1.71 1.00 0.00 3.24 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 54 A 7.04 4.52 1.13 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 0.00 0.00 55 A 8.33 3.89 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 56 K 7.55 4.57 0.00 1.70 1.70 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.35 7.81 57 L 8.24 4.32 0.00 1.64 1.59 0.98 0.85 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 58 T 8.06 4.48 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 1.18 0.00 0.00 59 E 8.32 3.69 0.00 1.87 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.23 0.00 60 H 7.88 4.80 0.00 3.11 3.26 0.00 5.94 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 M 8.11 4.22 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 62 T 8.39 4.58 4.33 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 1.40 0.00 0.00 63 Q 8.75 4.96 0.00 2.13 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 64 V 9.38 4.80 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 0.84 0.00 0.00 0.95 0.00 0.00 65 Q 9.27 4.90 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 66 V 8.83 4.29 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 0.79 0.00 0.00 0.79 0.00 0.00 67 M 8.85 5.12 0.00 1.73 1.62 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 68 A 8.17 5.18 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.75 0.00 2.29 2.17 0.00 3.85 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 1.98 2.01 0.00 70 L 8.22 4.61 0.00 1.62 1.74 0.90 1.14 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 71 N 7.67 4.76 0.00 2.76 2.78 0.00 0.00 6.04 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 72 D 8.60 4.74 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 73 E 8.97 4.54 0.00 2.00 1.97 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 2.25 2.26 0.00 74 S 7.83 4.37 0.00 4.08 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 75 T 8.60 3.91 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 1.22 0.00 0.00 76 V 7.78 3.64 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 0.93 0.00 0.00 0.82 0.00 0.00 77 A 8.04 4.03 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 78 K 7.92 3.86 0.00 2.11 1.92 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.65 7.81 79 W 8.16 4.25 0.00 3.55 3.41 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 80 L 8.51 4.22 0.00 2.08 1.83 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.12 3.92 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.28 3.71 0.00 1.61 1.78 0.00 1.73 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.23 1.37 7.81 83 H 8.25 4.38 0.00 2.31 2.89 0.00 6.01 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.67 4.23 0.00 2.74 2.78 0.00 0.00 6.89 8.46 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 85 G 8.45 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 0.00 0.00 0.00 86 R 7.66 4.35 0.00 2.13 1.97 0.00 3.21 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 87 A 8.86 4.59 1.49 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 0.00 0.00 88 G 8.76 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 L 8.86 4.46 0.00 1.67 1.76 0.98 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 90 H 10.03 4.36 0.00 2.41 3.08 0.00 5.79 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 H 7.51 4.77 0.00 3.47 3.36 0.00 5.45 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 92 M 8.40 5.22 0.00 2.12 1.97 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 2.69 2.83 0.00 93 A 9.08 5.06 0.98 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 94 W 9.24 5.24 0.00 3.00 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 95 R 9.09 4.77 0.00 1.89 1.77 0.00 2.70 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.45 0.00 96 V 9.05 4.81 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 1.06 0.00 0.00 1.06 0.00 0.00 97 D 8.81 4.26 0.00 2.59 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 98 D 7.66 4.66 0.00 2.67 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 0.00 0.00 0.00 0.00 99 I 8.93 3.70 1.91 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 1.56 1.49 1.00 0.00 0.00 100 D 8.15 4.33 0.00 2.88 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 0.00 101 A 8.78 3.94 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 0.00 102 V 7.93 3.45 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 0.99 0.00 0.00 0.84 0.00 0.00 103 S 8.44 4.10 0.00 4.08 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 0.00 104 A 8.10 4.00 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 0.00 105 T 7.96 4.07 4.34 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 1.20 0.00 0.00 106 L 8.13 4.06 0.00 1.92 1.78 1.10 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 107 R 8.17 4.16 0.00 2.04 1.99 0.00 3.14 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 108 E 8.17 4.04 0.00 2.10 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 0.00 2.33 2.64 0.00 109 R 7.36 4.54 0.00 1.97 1.98 0.00 3.21 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 110 G 8.03 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 0.00 111 V 7.62 3.96 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 0.78 0.00 0.00 1.00 0.00 0.00 112 Q 8.97 4.63 0.00 1.93 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.53 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 113 L 8.15 5.01 0.00 1.47 1.72 0.95 1.07 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 0.00 114 L 8.69 4.09 0.00 1.43 0.96 0.34 0.74 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 0.00 115 Y 7.88 5.08 0.00 3.14 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 0.00 116 D 8.91 4.55 0.00 2.71 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 0.00 117 E 7.81 4.80 0.00 1.88 1.78 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 2.18 2.36 0.00 118 P 0.00 4.67 0.00 2.00 2.02 0.00 3.74 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 2.18 2.17 0.00 119 K 9.34 4.43 0.00 1.56 1.65 0.00 1.13 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.14 7.81 120 L 8.33 4.61 0.00 1.61 1.55 0.91 0.97 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 0.00 121 G 9.28 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 0.00 122 T 8.31 3.95 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 1.28 0.00 0.00 123 G 9.20 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 0.00 0.00 0.00 124 G 7.73 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 0.00 0.00 0.00 125 N 7.84 4.74 0.00 2.65 2.84 0.00 0.00 6.88 9.01 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 0.00 126 R 8.67 5.23 0.00 1.80 1.85 0.00 3.08 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 127 I 8.80 5.35 1.83 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 2.23 0.93 0.00 0.00 128 N 7.78 5.11 0.00 2.83 2.67 0.00 0.00 6.62 7.71 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 0.00 129 F 8.36 5.14 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 0.00 130 M 9.15 4.74 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 131 H 8.90 3.97 0.00 3.17 3.15 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 P 0.00 4.73 0.00 2.13 2.13 0.00 3.53 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 133 K 8.01 4.06 0.00 1.74 1.89 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.47 7.81 134 S 9.24 4.53 0.00 4.01 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 7.83 3.90 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 0.00 0.00 0.00 136 K 8.63 3.66 0.00 2.04 1.91 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.39 7.81 137 G 8.52 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 0.00 138 V 7.28 4.40 2.10 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 0.78 0.00 0.00 0.93 0.00 0.00 139 L 8.34 4.57 0.00 1.78 1.59 0.85 0.77 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 0.00 140 I 7.83 4.42 1.37 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.17 -0.63 0.00 0.00 141 E 8.89 4.48 0.00 1.66 1.56 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 1.74 1.47 0.00 142 L 8.29 5.18 0.00 1.58 1.62 0.98 1.11 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 0.00 143 T 9.10 5.10 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 1.39 0.00 0.00 144 Q 8.77 5.28 0.00 2.17 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 145 Y 8.93 4.74 0.00 2.80 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 0.00 146 P 0.00 4.40 0.00 2.06 2.22 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.14 0.00 147 K 8.44 4.13 0.00 1.75 1.71 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.68 7.81