NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.6461 8.4293 116.1976 55.1596 30.3386 173.2448 2 C 4.1440 7.6419 114.0647 56.8353 30.1092 172.0942 3 D 4.5524 8.3308 118.4687 55.1781 40.1522 175.5215 4 L 4.0710 8.0341 120.5220 57.0086 42.2739 175.7189 5 P 4.5466 0.0000 0.0000 62.3147 32.2936 175.3911 6 C 4.2661 8.4351 113.5083 57.8473 30.6495 174.9751 7 G 3.8975 8.2369 107.4883 45.4258 0.0000 172.8394 8 V 4.3211 7.2204 118.9629 61.0144 32.8456 174.3611 9 Y 4.7295 8.0862 123.4840 56.7199 42.1335 174.4792 10 D 3.6651 7.8741 117.5117 51.7694 43.6305 174.7122 11 P 4.0841 0.0000 0.0000 64.4504 31.1521 178.0493 12 A 3.9931 8.4735 120.7191 55.0554 17.6664 179.6550 13 Q 3.7731 8.0107 116.5068 59.0637 28.7694 178.8764 14 A 4.0443 7.7447 121.2475 54.9925 18.4348 179.3905 15 R 3.8374 8.0983 117.2943 59.7482 30.3174 178.7402 16 I 3.8597 8.0276 119.8323 64.6045 37.0840 178.3530 17 E 4.0155 7.9927 118.4342 59.3062 29.2912 179.2810 18 A 4.0731 8.1935 120.9051 55.0633 18.3439 179.5605 19 E 3.9733 8.5096 117.7236 59.6220 29.4053 179.7257 20 S 4.1188 7.9404 114.9539 61.3646 62.8765 176.6788 21 V 3.5706 7.7750 121.0107 66.0841 31.2355 178.0399 22 K 4.1326 8.1456 118.9454 59.4606 32.0305 178.5408 23 A 4.2849 8.1548 122.5291 54.7374 18.2032 179.7276 24 I 3.7704 8.1612 118.6652 64.6066 37.0322 178.6752 25 Q 4.0216 8.1850 118.9672 59.0413 26.9407 178.7260 26 E 4.0242 8.4631 119.7134 59.3767 29.4732 179.6035 27 K 4.3208 8.1826 118.6233 59.6975 31.9210 179.3491 28 M 4.4395 8.3120 117.9989 58.0249 31.9040 178.2723 29 A 4.1559 7.7783 120.0178 53.9868 18.5834 177.8412 30 A 4.3466 7.3948 117.5408 52.2503 20.8533 175.8735 31 N 4.5791 8.1224 114.7504 52.3411 38.7248 173.7053 32 D 4.8253 8.4465 124.5270 53.0844 40.1144 176.6119 33 D 4.4452 8.4087 120.7494 54.2638 42.5608 176.1260 34 L 3.9375 8.6912 128.6530 59.0513 42.1653 179.0745 35 H 4.1674 8.2982 115.2961 58.6205 28.6538 177.5192 36 F 4.1461 8.7671 122.7151 61.3634 39.2602 177.1975 37 Q 3.8856 8.5506 118.0627 58.8581 28.3946 178.9912 38 I 3.6253 7.8060 120.7101 64.4651 37.1304 178.6532 39 R 3.7980 7.9136 118.5380 59.2116 29.8066 178.9813 40 A 3.7079 7.9488 120.7142 55.2967 18.2409 179.8983 41 T 3.7221 7.8296 114.1597 66.6510 68.4917 177.0718 42 V 3.5435 7.8264 120.2434 66.2499 31.5266 178.2154 43 I 4.0174 7.9526 121.1357 63.5556 36.8521 178.3129 44 K 3.9015 8.2986 120.9279 59.3299 31.9721 178.4169 45 E 3.8948 8.1870 119.6230 59.3907 29.4803 178.8994 46 Q 3.9618 7.8536 117.6077 59.1866 28.8417 179.0739 47 R 4.0553 8.2340 118.9077 59.0340 30.0601 178.9847 48 A 4.0329 8.2794 120.9572 54.9829 18.3074 179.3002 49 E 3.8846 8.2161 117.9985 59.3982 29.6493 179.0798 50 L 3.9376 7.9466 118.7462 57.6011 41.6453 179.3063 51 A 4.0498 8.1294 120.7356 55.1723 18.2690 179.8224 52 K 3.9152 8.2103 117.0304 59.7818 32.0412 179.0239 53 H 4.1598 8.3936 118.5191 59.6884 29.9184 177.0046 54 H 4.1911 8.3161 118.0552 58.9496 28.5050 177.8660 55 L 4.1059 8.0619 120.8159 57.8044 41.4537 179.1677 56 D 4.5406 8.5401 119.3630 57.4483 40.7035 179.0482 57 V 3.7532 8.1088 118.8517 65.9807 31.4601 178.0743 58 L 3.9307 7.9843 118.4768 57.5135 41.2494 179.3604 59 W 4.6205 8.4852 127.4586 60.6618 30.8261 177.7723 60 S 4.0430 8.8609 113.2148 60.2613 62.9077 175.0694 61 D 4.7410 8.2799 120.7995 55.9416 41.9404 177.3817 62 Y 3.4878 7.5621 118.2096 60.2023 39.0214 175.7141 63 F 3.9947 7.9921 118.3250 57.2885 39.5421 175.3750 64 K 4.5161 8.1784 124.1167 53.8656 34.7723 175.3241 65 P 4.4637 0.0000 0.0000 65.9300 30.9990 177.1845 66 P 4.2975 0.0000 0.0000 65.7315 31.1197 178.4126 67 H 4.3043 8.0400 115.1970 58.9989 28.4023 177.8989 68 F 4.3147 7.7532 117.6426 60.1570 38.8115 177.1815 69 E 4.2227 7.8609 117.5583 59.3813 29.4376 179.0005 70 S 4.3391 8.2865 114.4625 60.1553 64.0755 174.2918 71 Y 4.5054 8.1992 121.9510 54.7428 37.1012 174.1892 72 P 4.3355 0.0000 0.0000 65.0578 31.6514 177.7688 73 E 4.5571 8.1064 116.6029 56.1031 30.2711 177.2294 74 L 3.9117 8.3312 122.9083 58.5205 42.0599 178.4714 75 H 4.4076 8.4328 115.6143 59.5177 28.6491 177.6633 76 T 3.8217 7.9707 116.7750 66.3890 68.3204 176.2093 77 L 3.8092 8.0484 122.3521 58.2622 42.1377 179.2981 78 V 3.5472 7.9276 118.2085 65.9013 31.4504 177.4467 79 N 4.0283 8.1175 116.8793 56.6893 38.7155 176.7798 80 E 3.7708 8.3483 120.1500 58.8563 29.5105 179.2127 81 A 3.7976 7.4851 120.9405 55.2957 18.4910 180.2021 82 V 3.6070 7.7950 110.9549 64.3411 31.5603 179.0532 83 K 3.9828 8.0472 118.2447 59.1885 31.8170 179.2526 84 A 4.0972 8.1161 121.3791 55.0735 18.2712 179.7134 85 L 4.0149 7.8111 117.2915 57.9843 41.5469 179.8289 86 S 4.1260 8.0897 115.0636 61.5157 62.5119 176.6029 87 A 3.9939 7.9199 122.4533 55.0024 18.4869 179.2560 88 A 4.1766 7.9347 120.8217 54.5834 18.1828 179.9487 89 K 3.9225 7.9369 116.2228 59.3335 32.2311 178.4594 90 A 4.4282 7.4475 117.8897 51.4383 18.9539 176.6686 91 S 4.6889 7.2868 111.7331 56.9921 65.6113 173.8000 92 T 4.3808 8.3189 112.8017 61.2396 69.6223 173.7623 93 D 4.5247 8.2794 124.2956 53.2417 41.3503 175.0212 94 P 4.6909 0.0000 0.0000 64.7785 31.2369 178.3051 95 A 3.9935 8.6862 120.5150 55.1619 17.6589 179.7525 96 T 3.9845 8.2604 108.8334 64.8787 68.9420 177.2518 97 G 3.6355 8.1288 108.2082 47.5458 0.0000 175.3175 98 Q 3.9809 8.3955 122.2489 58.7134 29.1849 178.0925 99 K 3.7572 8.2582 120.5898 59.3814 32.1774 178.6544 100 A 4.1837 7.9677 120.6260 55.2346 18.3239 179.6240 101 L 4.0016 7.8944 117.5325 57.9414 41.5143 179.5115 102 D 4.3256 8.3452 119.1733 57.5973 40.7655 178.4585 103 Y 4.3189 7.7779 116.8331 61.2261 37.8432 178.5903 104 I 3.8016 8.1648 120.5970 64.3368 37.2018 178.3351 105 A 4.1320 8.2850 121.7231 55.2259 18.2233 179.7669 106 Q 4.0292 7.9602 116.5227 59.2175 28.7494 178.9678 107 I 3.8257 8.0276 120.9379 64.2935 37.1094 177.9428 108 D 4.3735 8.6592 119.4954 57.1682 41.0793 178.2848 109 K 4.1424 8.1950 120.0717 59.7148 32.2950 178.9107 110 I 3.6150 7.7003 119.6474 64.0816 36.9198 177.9329 111 F 3.9700 8.6369 121.9686 61.4277 39.1507 177.4418 112 W 4.1813 8.2506 118.1198 59.5602 28.2726 178.5118 113 E 4.1158 8.2705 119.1873 59.6054 28.7093 179.3997 114 T 4.0610 7.8005 108.7999 64.4727 68.9176 176.6429 115 K 4.0459 7.5248 120.9261 58.6328 32.1969 178.4797 116 K 4.3976 8.0111 115.5059 56.1728 32.4316 176.6896 117 A 4.2029 7.5250 126.9677 52.5625 18.2881 177.4188 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 H 8.43 4.65 0.00 3.27 3.32 0.00 5.48 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 2 C 7.64 4.14 0.00 3.10 2.91 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 3 D 8.33 4.55 0.00 2.87 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 4 L 8.03 4.07 0.00 1.59 1.73 0.91 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 5 P 0.00 4.55 0.00 2.27 2.08 0.00 3.81 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 1.99 1.97 0.00 6 C 8.44 4.27 0.00 3.00 2.97 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 7 G 8.24 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 8 V 7.22 4.32 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 0.89 0.00 0.00 0.91 0.00 0.00 9 Y 8.09 4.73 0.00 2.86 2.40 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 10 D 7.87 3.67 0.00 2.58 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.08 0.00 2.24 1.86 0.00 2.97 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.04 0.00 12 A 8.47 3.99 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.01 3.77 0.00 1.81 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 14 A 7.74 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 8.10 3.84 0.00 1.89 2.09 0.00 3.12 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 16 I 8.03 3.86 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 1.52 1.16 0.91 0.00 0.00 17 E 7.99 4.02 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 18 A 8.19 4.07 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 0.00 0.00 19 E 8.51 3.97 0.00 2.19 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 2.34 2.58 0.00 20 S 7.94 4.12 0.00 4.10 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 21 V 7.78 3.57 2.29 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 1.00 0.00 0.00 0.99 0.00 0.00 22 K 8.15 4.13 0.00 1.89 1.80 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.60 7.81 23 A 8.15 4.28 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 I 8.16 3.77 2.03 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 1.55 0.81 0.92 0.00 0.00 25 Q 8.19 4.02 0.00 2.30 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.62 0.00 26 E 8.46 4.02 0.00 2.20 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 2.34 2.63 0.00 27 K 8.18 4.32 0.00 2.22 2.06 0.00 1.82 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.50 1.75 7.81 28 M 8.31 4.44 0.00 2.06 2.33 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.58 0.00 29 A 7.78 4.16 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.39 4.35 1.24 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 0.00 0.00 31 N 8.12 4.58 0.00 2.21 2.23 0.00 0.00 7.14 8.09 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 32 D 8.45 4.83 0.00 2.82 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 33 D 8.41 4.45 0.00 2.86 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 34 L 8.69 3.94 0.00 1.78 1.63 0.89 1.01 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 35 H 8.30 4.17 0.00 3.48 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 F 8.77 4.15 0.00 3.20 3.28 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 37 Q 8.55 3.89 0.00 2.28 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.59 0.00 0.00 0.00 0.00 0.00 2.69 2.61 0.00 38 I 7.81 3.63 1.98 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 1.47 0.73 0.88 0.00 0.00 39 R 7.91 3.80 0.00 1.80 1.88 0.00 3.15 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.85 0.00 40 A 7.95 3.71 0.74 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 0.00 0.00 41 T 7.83 3.72 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 42 V 7.83 3.54 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 1.00 0.00 0.00 0.97 0.00 0.00 43 I 7.95 4.02 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.88 0.89 0.00 0.00 44 K 8.30 3.90 0.00 1.84 1.96 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 45 E 8.19 3.89 0.00 2.29 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 0.00 2.29 2.38 0.00 46 Q 7.85 3.96 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.64 0.00 47 R 8.23 4.06 0.00 1.82 2.11 0.00 3.29 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.79 0.00 48 A 8.28 4.03 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 49 E 8.22 3.88 0.00 2.19 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 0.00 2.29 2.38 0.00 50 L 7.95 3.94 0.00 1.95 1.70 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.13 4.05 1.42 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 52 K 8.21 3.92 0.00 1.99 1.87 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.64 7.81 53 H 8.39 4.16 0.00 3.21 3.42 0.00 5.79 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 54 H 8.32 4.19 0.00 3.36 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.06 4.11 0.00 1.87 1.76 0.94 1.16 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 56 D 8.54 4.54 0.00 2.91 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 57 V 8.11 3.75 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 1.35 0.00 0.00 0.88 0.00 0.00 58 L 7.98 3.93 0.00 2.09 1.72 0.75 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.49 4.62 0.00 3.44 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 60 S 8.86 4.04 0.00 4.05 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 61 D 8.28 4.74 0.00 2.99 2.97 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 62 Y 7.56 3.49 0.00 1.43 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 F 7.99 3.99 0.00 2.91 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.18 4.52 0.00 1.44 1.57 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.25 1.16 7.81 65 P 0.00 4.46 0.00 2.15 2.17 0.00 3.56 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 66 P 0.00 4.30 0.00 2.01 2.05 0.00 3.38 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 67 H 8.04 4.30 0.00 2.97 3.07 0.00 5.64 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 68 F 7.75 4.31 0.00 3.18 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 7.86 4.22 0.00 2.18 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 2.64 2.52 0.00 70 S 8.29 4.34 0.00 3.97 3.61 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 71 Y 8.20 4.51 0.00 3.00 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 72 P 0.00 4.34 0.00 2.21 2.23 0.00 3.77 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 73 E 8.11 4.56 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.26 0.00 74 L 8.33 3.91 0.00 1.81 1.82 0.50 -0.36 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 75 H 8.43 4.41 0.00 3.27 3.36 0.00 5.68 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 76 T 7.97 3.82 4.41 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 1.19 0.00 0.00 77 L 8.05 3.81 0.00 1.84 1.84 1.04 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 78 V 7.93 3.55 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.15 0.00 0.00 79 N 8.12 4.03 0.00 2.71 2.76 0.00 0.00 7.23 7.23 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 80 E 8.35 3.77 0.00 1.49 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 2.19 2.31 0.00 81 A 7.49 3.80 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 82 V 7.80 3.61 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 0.74 0.00 0.00 0.82 0.00 0.00 83 K 8.05 3.98 0.00 1.92 1.81 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.46 7.81 84 A 8.12 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.81 4.01 0.00 1.92 1.73 0.96 0.75 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 86 S 8.09 4.13 0.00 4.04 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 87 A 7.92 3.99 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 4.18 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 89 K 7.94 3.92 0.00 1.98 2.01 0.00 1.69 0.00 0.00 1.94 0.00 0.00 3.21 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.63 7.81 90 A 7.45 4.43 1.26 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 91 S 7.29 4.69 0.00 3.82 3.78 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 92 T 8.32 4.38 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 1.21 0.00 0.00 93 D 8.28 4.52 0.00 2.70 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.69 0.00 2.20 2.11 0.00 3.94 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 95 A 8.69 3.99 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 8.26 3.98 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 1.22 0.00 0.00 97 G 8.13 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.40 3.98 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 99 K 8.26 3.76 0.00 1.93 1.98 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.24 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.29 7.81 100 A 7.97 4.18 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.89 4.00 0.00 1.91 1.74 0.98 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.35 4.33 0.00 2.59 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 0.00 103 Y 7.78 4.32 0.00 3.23 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.16 3.80 2.07 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 1.50 0.84 0.93 0.00 0.00 105 A 8.29 4.13 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 7.96 4.03 0.00 2.38 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.65 0.00 107 I 8.03 3.83 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.91 1.07 0.00 0.00 108 D 8.66 4.37 0.00 2.84 2.97 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 0.00 109 K 8.19 4.14 0.00 2.00 2.02 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.60 7.81 110 I 7.70 3.62 1.88 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.84 -0.04 0.00 0.00 111 F 8.64 3.97 0.00 2.97 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 0.00 112 W 8.25 4.18 0.00 3.56 3.26 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 0.00 113 E 8.27 4.12 0.00 2.30 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 0.00 2.45 2.78 0.00 114 T 7.80 4.06 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 1.24 0.00 0.00 115 K 7.52 4.05 0.00 1.79 1.87 0.00 1.54 0.00 0.00 1.18 0.00 0.00 2.91 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.30 0.21 7.81 116 K 8.01 4.40 0.00 1.81 1.90 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.56 1.84 7.81 117 A 7.53 4.20 1.35 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