NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.8373 8.4293 116.2141 55.1934 30.3425 173.3519 2 C 4.0250 7.6832 114.2491 57.2831 30.2485 172.4272 3 D 4.6608 8.4059 118.8525 54.6830 40.1843 175.3783 4 L 4.0521 8.0266 120.3498 57.3113 42.1552 175.6838 5 P 4.6111 0.0000 0.0000 62.1278 32.5041 175.0863 6 C 4.3526 8.4361 112.3621 57.6472 30.7994 175.0749 7 G 3.9042 8.2657 107.5462 45.3780 0.0000 172.8043 8 V 4.2385 7.1112 119.0485 61.0292 32.5505 174.4856 9 Y 4.6756 8.0641 123.6746 56.6024 42.0364 174.6223 10 D 3.7163 7.9274 119.4465 51.7262 43.6353 174.4545 11 P 4.0624 0.0000 0.0000 64.2982 31.1747 178.0480 12 A 4.0032 8.3582 120.9165 55.0860 17.8373 179.6306 13 Q 3.7792 8.0593 116.4811 59.0159 28.6505 178.9642 14 A 4.0834 7.7405 121.2382 55.0194 18.5186 179.3830 15 R 3.8157 8.0292 117.2396 59.7889 30.2997 178.6863 16 I 3.7430 7.9085 119.5782 64.5663 37.1400 178.3430 17 E 4.0081 7.9627 117.8693 59.3229 29.4739 179.2407 18 A 4.0830 8.3475 120.9752 54.9450 18.3753 179.6094 19 E 3.9588 8.5565 117.9562 59.7391 29.5047 179.6531 20 S 4.1681 8.0125 114.8092 61.3001 62.8259 176.8007 21 V 3.5601 7.6170 120.8951 66.0192 31.3137 178.0833 22 K 4.1462 7.9767 118.6221 59.5223 32.0617 178.6264 23 A 4.0682 8.1289 121.0584 55.1882 18.2327 179.7268 24 I 3.7886 8.0317 118.5878 64.5027 37.0450 178.6039 25 Q 4.0395 8.1109 119.0217 58.9048 28.3808 178.6860 26 E 4.0054 8.2807 119.6192 59.4930 29.6313 179.6463 27 K 4.1378 8.1723 118.3215 59.5947 32.1109 179.3523 28 M 4.3952 8.2387 119.0459 58.0459 31.6374 178.0114 29 A 4.2089 7.8392 118.9439 53.5429 18.8887 178.3389 30 A 4.6051 7.6185 117.3316 51.5095 19.5476 176.5703 31 N 4.6658 7.5275 114.5873 51.9534 40.7274 173.4675 32 D 4.6948 8.6895 124.6479 53.3238 40.3647 176.7094 33 D 4.3913 8.5135 121.0984 54.6350 42.4415 176.1034 34 L 3.9287 8.7269 128.3687 59.0427 42.1021 179.0034 35 H 4.2069 8.2936 115.3138 58.7176 28.5975 177.4838 36 F 4.2112 9.1976 123.1353 61.2794 39.3026 177.3173 37 Q 3.9152 8.4618 117.9842 58.7796 28.4664 178.9135 38 I 3.6455 7.6977 120.8266 64.4911 37.1745 178.6720 39 R 3.8522 8.0046 118.6813 59.1484 29.7580 179.0318 40 A 3.7241 7.8546 120.8851 55.2243 18.2925 179.8781 41 T 3.7234 7.6589 114.0426 66.6188 68.6105 176.9334 42 V 3.5442 7.6749 120.0285 66.3503 31.5606 178.2348 43 I 3.8969 7.8539 119.4518 64.1403 36.8832 178.4295 44 K 3.9325 8.3663 121.0410 59.2987 32.0424 178.5227 45 E 3.9239 8.2669 119.7568 59.3800 29.5837 178.9049 46 Q 4.0110 7.9674 117.6472 58.9414 28.8135 178.8076 47 R 3.9519 8.2390 119.0512 59.0637 29.9971 178.9624 48 A 4.0191 8.1825 120.7814 54.9801 18.2665 179.2967 49 E 3.8519 8.1414 117.8126 59.4393 29.6324 179.1137 50 L 3.9166 7.9473 118.7892 57.5782 41.6635 179.3122 51 A 4.0392 8.1003 120.7806 55.0507 18.2454 179.7444 52 K 3.8592 8.2906 117.2499 59.8957 32.1525 178.8888 53 H 4.1038 8.4617 118.6508 59.7846 29.6197 176.9868 54 H 4.2649 8.4390 118.1846 58.8540 28.4860 177.8816 55 L 4.0710 8.0937 120.8907 57.8413 41.4826 179.1684 56 D 4.5311 8.4864 119.2887 57.4349 40.7416 179.0867 57 V 3.7461 7.9297 118.8411 65.8949 31.5114 178.1524 58 L 3.8875 7.8624 118.9509 57.4505 41.2385 179.2690 59 W 4.6598 8.3768 127.5753 60.5320 30.7967 177.6287 60 S 4.1077 8.4250 112.7422 60.2978 63.0693 175.2604 61 D 4.6623 8.4122 121.0959 56.0025 41.6527 177.3039 62 Y 3.4618 7.4059 118.6581 59.7993 39.1897 175.3608 63 F 4.0379 8.0041 119.0537 57.3966 39.6118 174.8215 64 K 4.7099 8.0596 122.4046 53.0341 36.4338 175.3960 65 P 4.3990 0.0000 0.0000 65.8723 31.0893 176.8086 66 P 4.2077 0.0000 0.0000 66.0102 31.1588 178.4179 67 H 4.3467 7.9980 114.8323 59.0206 28.4484 177.9900 68 F 4.4515 7.6689 117.5871 60.1733 38.7736 177.2947 69 E 4.1895 8.0399 117.9590 59.5873 29.5399 179.1835 70 S 4.2649 7.8646 113.3743 59.9524 64.0199 174.2067 71 Y 4.7195 7.8066 119.2790 54.6350 38.0935 173.8442 72 P 4.4504 0.0000 0.0000 64.9333 31.9662 177.3184 73 E 4.3599 8.1765 114.3406 56.8390 30.7004 177.7884 74 L 3.8897 8.2097 122.5384 58.8472 42.0397 178.1676 75 H 4.3881 8.4538 115.3771 59.6387 28.6203 177.7248 76 T 3.8518 7.9403 116.6693 66.3288 68.3248 176.3539 77 L 3.8988 8.2331 122.6232 58.1718 42.0633 179.3063 78 V 3.4881 7.9426 118.1996 66.0288 31.5117 177.3934 79 N 3.9915 7.8751 116.7716 56.7784 38.6785 176.6461 80 E 3.7517 8.2115 119.7676 58.6885 29.5115 179.2296 81 A 3.6616 7.3499 121.0688 55.2246 18.5079 180.1770 82 V 3.5642 7.8644 111.2619 64.3778 31.5232 179.0588 83 K 3.9475 7.9364 118.2077 59.2497 31.9027 179.2834 84 A 4.0830 7.9903 121.1960 54.9832 18.2496 179.7083 85 L 4.0177 7.7791 117.4592 57.9529 41.3655 179.7664 86 S 4.1231 8.0818 115.0823 61.4735 62.4951 176.5525 87 A 4.0224 7.8101 122.5221 54.7795 18.4326 179.2406 88 A 4.1000 7.9095 119.4806 55.0126 18.1644 179.9774 89 K 3.9542 7.7824 116.4007 59.2856 32.1399 178.3456 90 A 4.5378 7.3058 118.2203 51.1513 19.0061 176.5963 91 S 4.6371 7.2534 112.7544 58.1982 65.6539 173.9663 92 T 4.3630 8.3099 112.6968 61.2764 69.7722 173.7816 93 D 4.5266 8.3481 124.3311 53.1440 41.2437 174.8161 94 P 4.5839 0.0000 0.0000 64.8597 31.2131 178.2516 95 A 4.0000 8.3822 120.0326 55.2166 18.2955 179.7767 96 T 3.9683 8.3010 108.7527 64.9800 69.0629 177.1804 97 G 3.6440 8.1596 108.3110 47.4605 0.0000 175.2952 98 Q 4.0123 8.3452 122.1157 58.6783 29.1579 178.0454 99 K 3.8431 8.1612 120.6285 59.4022 32.1965 178.6192 100 A 4.1908 7.9576 120.4984 55.3281 18.3387 179.5815 101 L 3.9846 7.8733 117.0142 58.0448 41.7448 179.6171 102 D 4.3259 8.1775 118.9440 57.5518 40.7536 178.3955 103 Y 4.2159 7.8764 117.0163 61.1514 37.8622 178.6142 104 I 3.8413 8.2186 120.6977 64.0931 37.1432 178.3718 105 A 4.0878 7.9891 121.9461 55.2544 18.3480 179.7216 106 Q 4.0152 8.0835 116.2766 59.1541 28.7025 179.0915 107 I 3.7697 7.9478 120.9267 64.3531 37.1477 177.9258 108 D 4.3113 8.7000 119.3593 57.1323 40.8278 178.2246 109 K 4.1206 8.3231 120.1170 59.7473 32.2856 178.8979 110 I 3.5701 7.6854 119.6962 64.0513 36.7803 177.9705 111 F 4.1293 8.5851 121.9503 61.4220 39.1865 177.4046 112 W 4.3466 8.3491 117.7703 59.2953 28.7732 178.3856 113 E 4.1875 7.9893 119.3934 59.3294 28.8394 178.9590 114 T 4.3511 7.8867 108.5119 63.9997 68.9498 176.4828 115 K 4.1244 7.3449 121.1993 58.8880 32.3597 179.0325 116 K 4.1689 7.9909 117.5744 59.2685 32.2868 176.9997 117 A 4.2043 8.4036 125.3313 52.5876 18.2967 176.9888 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 4.84 0.00 3.32 3.38 0.00 5.48 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 C 7.68 4.03 0.00 3.11 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 8.41 4.66 0.00 2.87 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 4 L 8.03 4.05 0.00 1.60 1.74 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.61 0.00 2.30 2.12 0.00 3.81 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 2.00 1.99 0.00 6 C 8.44 4.35 0.00 3.00 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 7 G 8.27 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 7.11 4.24 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 0.84 0.00 0.00 0.90 0.00 0.00 9 Y 8.06 4.68 0.00 2.77 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 7.93 3.72 0.00 2.55 2.33 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 11 P 0.00 4.06 0.00 2.11 1.81 0.00 2.86 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 1.21 0.93 0.00 12 A 8.36 4.00 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 13 Q 8.06 3.78 0.00 1.80 1.58 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 2.20 2.29 0.00 14 A 7.74 4.08 1.36 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 0.00 0.00 15 R 8.03 3.82 0.00 1.90 2.07 0.00 3.13 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 1.76 1.69 0.00 16 I 7.91 3.74 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 1.03 0.91 0.00 0.00 17 E 7.96 4.01 0.00 2.21 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 2.59 2.55 0.00 18 A 8.35 4.08 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 19 E 8.56 3.96 0.00 2.17 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 2.47 0.00 20 S 8.01 4.17 0.00 4.07 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 7.62 3.56 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 1.00 0.00 0.00 0.97 0.00 0.00 22 K 7.98 4.15 0.00 1.91 1.80 0.00 1.79 0.00 0.00 1.66 0.00 0.00 3.21 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.63 7.81 23 A 8.13 4.07 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 24 I 8.03 3.79 2.05 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 1.52 0.82 0.85 0.00 0.00 25 Q 8.11 4.04 0.00 2.29 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.66 0.00 26 E 8.28 4.01 0.00 2.23 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 2.35 2.57 0.00 27 K 8.17 4.14 0.00 2.16 2.17 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.71 7.81 28 M 8.24 4.40 0.00 2.12 2.33 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.48 0.00 29 A 7.84 4.21 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.62 4.61 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 31 N 7.53 4.67 0.00 2.38 2.35 0.00 0.00 7.15 8.35 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 32 D 8.69 4.69 0.00 2.85 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 33 D 8.51 4.39 0.00 2.86 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 34 L 8.73 3.93 0.00 1.78 1.64 0.88 1.01 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 35 H 8.29 4.21 0.00 3.46 3.40 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 9.20 4.21 0.00 3.11 3.25 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 0.00 37 Q 8.46 3.92 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.69 2.59 0.00 38 I 7.70 3.65 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 1.48 1.06 0.88 0.00 0.00 39 R 8.00 3.85 0.00 1.68 1.88 0.00 3.16 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.85 0.00 40 A 7.85 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 T 7.66 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 1.18 0.00 0.00 42 V 7.67 3.54 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 1.00 0.00 0.00 0.96 0.00 0.00 43 I 7.85 3.90 1.86 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 1.38 0.53 0.89 0.00 0.00 44 K 8.37 3.93 0.00 1.80 1.98 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.43 7.81 45 E 8.27 3.92 0.00 2.30 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 0.00 2.29 2.38 0.00 46 Q 7.97 4.01 0.00 2.26 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.62 0.00 47 R 8.24 3.95 0.00 1.82 1.98 0.00 3.32 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.79 0.00 48 A 8.18 4.02 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 49 E 8.14 3.85 0.00 2.21 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 0.00 2.29 2.37 0.00 50 L 7.95 3.92 0.00 1.92 1.67 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.10 4.04 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 52 K 8.29 3.86 0.00 2.00 1.85 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.66 7.81 53 H 8.46 4.10 0.00 3.20 3.43 0.00 5.78 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 8.44 4.26 0.00 3.33 3.27 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 8.09 4.07 0.00 1.86 1.74 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.49 4.53 0.00 2.88 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.93 3.75 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 1.15 0.00 0.00 0.94 0.00 0.00 58 L 7.86 3.89 0.00 1.96 1.61 0.70 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.38 4.66 0.00 3.51 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 60 S 8.42 4.11 0.00 4.09 4.20 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 0.00 0.00 0.00 0.00 61 D 8.41 4.66 0.00 2.94 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 7.41 3.46 0.00 1.43 2.39 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 63 F 8.00 4.04 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 8.06 4.71 0.00 1.52 1.56 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.42 7.81 65 P 0.00 4.40 0.00 2.14 2.17 0.00 3.58 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.28 0.00 66 P 0.00 4.21 0.00 1.89 2.01 0.00 3.40 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.11 0.00 67 H 8.00 4.35 0.00 2.86 3.16 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 7.67 4.45 0.00 3.05 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.04 4.19 0.00 2.13 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 2.38 2.58 0.00 70 S 7.86 4.26 0.00 3.57 3.48 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 71 Y 7.81 4.72 0.00 3.03 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 72 P 0.00 4.45 0.00 2.08 2.17 0.00 3.70 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 73 E 8.18 4.36 0.00 2.17 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 74 L 8.21 3.89 0.00 1.88 1.88 0.45 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 75 H 8.45 4.39 0.00 3.26 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 7.94 3.85 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 1.21 0.00 0.00 77 L 8.23 3.90 0.00 1.86 1.91 1.15 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 78 V 7.94 3.49 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 0.96 0.00 0.00 1.14 0.00 0.00 79 N 7.88 3.99 0.00 2.66 2.77 0.00 0.00 7.29 7.75 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 80 E 8.21 3.75 0.00 1.52 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 2.18 2.41 0.00 81 A 7.35 3.66 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 82 V 7.86 3.56 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 0.77 0.00 0.00 0.85 0.00 0.00 83 K 7.94 3.95 0.00 1.89 1.78 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.41 7.81 84 A 7.99 4.08 1.51 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 0.00 0.00 0.00 85 L 7.78 4.02 0.00 1.90 1.72 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.08 4.12 0.00 4.05 3.88 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 87 A 7.81 4.02 1.36 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 0.00 0.00 88 A 7.91 4.10 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 89 K 7.78 3.95 0.00 1.96 2.01 0.00 1.68 0.00 0.00 1.94 0.00 0.00 3.21 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.61 7.81 90 A 7.31 4.54 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 91 S 7.25 4.64 0.00 3.78 3.76 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 92 T 8.31 4.36 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 1.21 0.00 0.00 93 D 8.35 4.53 0.00 2.77 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 4.58 0.00 2.20 2.12 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 2.05 0.00 95 A 8.38 4.00 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 96 T 8.30 3.97 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 97 G 8.16 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 8.35 4.01 0.00 2.27 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 99 K 8.16 3.84 0.00 1.98 2.00 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.32 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.60 1.40 7.81 100 A 7.96 4.19 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 0.00 101 L 7.87 3.98 0.00 1.93 1.75 0.93 0.89 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 0.00 102 D 8.18 4.33 0.00 2.68 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 7.88 4.22 0.00 3.24 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.22 3.84 2.06 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 1.49 0.72 0.92 0.00 0.00 105 A 7.99 4.09 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 0.00 106 Q 8.08 4.02 0.00 2.39 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.40 2.67 0.00 107 I 7.95 3.77 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.01 1.05 0.00 0.00 108 D 8.70 4.31 0.00 2.89 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.32 4.12 0.00 2.06 2.04 0.00 1.75 0.00 0.00 1.71 0.00 0.00 3.15 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.64 1.58 7.81 110 I 7.69 3.57 1.81 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.80 -0.13 0.00 0.00 111 F 8.59 4.13 0.00 3.07 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 0.00 112 W 8.35 4.35 0.00 3.55 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 0.00 113 E 7.99 4.19 0.00 2.28 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 2.45 2.58 0.00 114 T 7.89 4.35 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 1.40 0.00 0.00 115 K 7.34 4.12 0.00 1.98 1.97 0.00 1.52 0.00 0.00 0.82 0.00 0.00 2.85 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.64 0.37 7.81 116 K 7.99 4.17 0.00 1.83 1.91 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.84 7.81 117 A 8.40 4.20 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