NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.8471 8.1933 116.7409 58.6564 64.5821 173.4251 2 Y 4.5711 9.2979 122.8279 57.0397 38.5216 173.9047 3 S 4.6134 8.6017 115.6859 56.9654 63.8551 173.7456 4 I 4.2486 7.9816 130.3354 59.3070 35.1350 175.7782 5 T 3.8204 7.6618 118.8157 66.1653 69.0827 174.4962 6 T 4.7217 7.3172 117.4730 60.7902 71.2612 173.1231 7 P 4.4842 0.0000 0.0000 66.2837 31.6455 178.6541 8 S 4.3635 7.9244 115.1018 58.6227 62.2382 174.2990 9 Q 4.7370 8.0598 122.2694 57.4529 31.4041 176.6873 10 F 3.3846 8.0507 118.5811 61.3009 38.9495 177.1116 11 V 3.6916 8.0308 116.6351 65.9269 31.1751 177.4462 12 F 5.0118 8.8634 119.4023 59.3701 38.9328 176.0880 13 L 5.0387 7.5303 116.3585 54.8884 41.9056 176.6992 14 S 4.7417 8.1266 114.5723 58.7532 64.7222 173.9392 15 S 5.1028 8.5305 116.5759 58.7528 61.6112 174.3210 16 A 4.8655 7.5243 119.9422 51.2826 21.7142 177.1845 17 W 5.3633 7.9408 116.3292 55.9291 30.8700 175.3861 18 A 4.8452 9.0507 125.2163 50.0530 22.2449 174.0329 19 D 5.0016 8.2124 118.8799 52.0507 43.3375 174.9659 20 P 4.3816 0.0000 0.0000 66.3793 31.0502 178.4268 21 I 3.5905 7.5034 113.1380 63.1398 36.9735 177.1246 22 E 3.7926 8.5128 121.9985 58.6049 29.2960 179.0859 23 L 3.8382 7.5469 119.6900 58.0575 42.1363 178.6706 24 I 3.8107 7.4435 119.2162 64.6096 37.0226 177.9363 25 N 4.2811 8.3547 117.2789 56.3376 38.3453 177.1686 26 L 3.9405 7.5278 120.4929 58.6406 42.2220 178.3214 27 C 4.3164 8.7326 117.3877 63.5715 27.8805 176.2850 28 T 3.9646 8.1644 117.2266 66.8072 68.4493 176.2231 29 N 4.4818 8.5200 118.5814 56.0433 38.3215 176.8972 30 A 4.0736 8.4419 122.2152 55.5183 18.6431 179.5399 31 L 4.4741 7.7813 114.5941 56.0166 42.8396 178.4395 32 G 4.1092 7.4462 108.6780 42.9164 0.0000 172.9220 33 N 4.4510 7.7196 119.9965 53.4643 42.6589 173.3449 34 Q 4.1997 7.5380 120.4552 55.8460 31.3528 175.4285 35 F 4.6621 8.8113 123.9996 57.9067 38.9025 176.0377 36 Q 4.5289 7.9376 116.6966 55.4589 29.6547 175.3242 37 T 4.3519 7.3524 110.2283 59.5780 68.9480 174.5712 38 Q 3.8484 8.7927 129.0967 59.2312 28.5470 177.6892 39 Q 3.9515 7.4362 118.8915 57.6666 29.9029 177.4323 40 A 3.8212 8.8468 122.3683 54.8169 18.7298 179.5005 41 R 3.8506 7.6459 110.3424 57.9948 30.0553 177.8692 42 T 4.1157 9.1850 116.3856 65.1779 68.5334 176.6095 43 V 3.5536 7.5821 119.1932 66.4944 31.5645 178.5578 44 V 4.2009 7.2121 118.0087 65.4781 31.2829 177.2797 45 Q 4.1946 7.8399 119.2072 59.8291 28.6910 179.0025 46 R 4.2487 7.9707 117.1019 58.1878 30.3058 178.2613 47 Q 4.3395 8.1917 118.1543 57.7763 28.9053 177.6617 48 F 4.2506 8.8550 122.3052 61.6583 39.3489 176.5205 49 S 4.2134 8.9604 114.0870 60.4850 62.0785 175.3890 50 E 4.2348 8.4878 121.3809 58.8277 29.2966 179.3936 51 V 4.1018 7.4581 115.4289 61.8295 30.9642 176.0102 52 W 4.8395 8.5253 120.8312 55.3697 30.8276 174.7205 53 K 4.9247 9.2872 124.4634 53.2860 34.8940 174.8573 54 P 4.7184 0.0000 0.0000 63.1318 31.2124 174.1835 55 S 4.4524 9.3503 116.7696 58.8369 65.5663 172.7315 56 P 4.2271 0.0000 0.0000 61.9547 29.9779 175.6897 57 Q 4.5304 7.4910 126.0919 54.4582 31.3025 175.2961 58 V 2.5087 7.3388 116.8387 66.5995 31.6096 178.5139 59 T 4.0876 7.7832 116.4620 65.5363 68.5581 173.5469 60 V 4.3569 6.5951 120.0579 61.1780 34.2252 173.6852 61 R 4.1246 7.3604 118.4942 54.5144 32.2943 173.9518 62 F 3.5312 8.0713 124.4849 57.0869 39.5067 173.2999 63 P 4.1218 0.0000 0.0000 62.8240 31.2251 175.7081 64 D 4.4934 8.0698 121.1934 56.5641 39.9651 177.3833 65 S 4.5403 7.7478 114.8594 57.6147 62.7126 173.4517 66 D 4.6001 7.5993 118.9265 53.3075 44.5828 173.7144 67 F 5.5565 7.6496 115.3093 56.2572 40.8565 174.0917 68 K 5.0079 9.0574 114.3331 56.1086 37.2032 175.2769 69 V 4.2891 8.8759 125.2528 62.6096 33.4904 174.0629 70 Y 4.5930 8.7692 128.1658 56.0304 40.8622 175.1601 71 R 3.7728 8.4474 127.5288 60.0334 30.3445 176.3354 72 Y 5.2775 6.4928 117.5021 55.8297 36.3574 173.0262 73 N 4.8469 7.7575 119.0760 51.3826 40.4988 175.0610 74 A 3.5272 8.6513 129.8316 54.9191 18.8110 178.0720 75 V 4.0983 7.6530 114.1104 65.1820 32.7170 177.7928 76 L 4.1907 8.3725 119.2391 59.0089 41.4249 178.2891 77 D 4.7359 9.5652 116.3172 57.8787 40.7905 176.5471 78 P 4.2993 0.0000 0.0000 65.8291 31.7019 178.5857 79 L 3.9847 8.0046 119.0697 57.6959 41.4639 179.1671 80 V 3.9255 7.6124 117.9095 66.6199 31.3714 177.9896 81 T 3.6885 7.9851 114.1970 66.9792 68.1779 176.2197 82 A 3.8414 7.2009 120.0879 55.1970 18.0417 179.3749 83 L 3.7051 7.2211 115.8794 57.5452 41.8801 179.3338 84 L 3.8703 7.9119 118.2890 56.7138 41.5064 178.0609 85 G 4.5560 7.9508 107.0627 44.8087 0.0000 173.1307 86 A 4.3911 6.9972 122.8562 52.1644 20.2654 179.2388 87 F 4.7017 7.6562 113.2122 59.6811 39.9127 176.6921 88 D 4.6048 8.4001 121.1018 57.0842 40.6651 176.3271 89 T 4.9705 7.4487 105.0705 60.8734 71.8189 172.5324 90 R 4.7649 8.1702 116.0018 56.9155 35.0051 174.2706 91 N 4.3482 8.0499 119.1591 51.3729 45.7800 174.0784 92 R 3.7166 7.9111 123.2452 56.2313 27.5298 175.0884 93 I 4.2672 7.2151 120.1048 61.5869 40.0453 174.8140 94 I 4.1649 7.6449 128.6301 60.2609 35.7784 177.9640 95 E 4.2664 7.5401 120.5731 55.1424 28.6964 177.2500 96 V 3.8253 7.4765 125.7929 62.7970 31.6840 174.8382 97 E 4.4175 9.2004 126.3164 54.2050 31.2798 176.3914 98 N 4.1547 8.8755 118.8041 56.8555 38.4872 175.5682 99 Q 4.0267 7.8701 114.1509 56.8624 29.5508 176.7900 100 A 4.3494 7.0832 119.1324 51.1831 23.5680 174.0640 101 N 5.1827 8.5803 113.1401 51.1406 41.1197 173.0750 102 P 4.3196 0.0000 0.0000 66.1964 31.9788 177.6506 103 T 4.1676 8.0277 113.3864 64.1553 68.5421 177.1576 104 T 3.4096 6.5291 114.1772 65.2882 69.0698 173.9955 105 A 5.0794 7.5473 124.6640 52.1315 19.3586 177.6687 106 E 4.0374 7.2743 119.2976 59.3520 29.8572 177.7090 107 T 4.4371 7.4112 115.2525 61.7217 69.0083 174.7134 108 L 3.9949 7.3683 122.8097 56.3161 42.9964 179.5368 109 D 5.0024 7.3857 123.5317 53.1611 43.2127 175.5251 110 A 4.6547 8.2076 122.5422 51.1398 21.9524 176.6689 111 T 4.2603 8.4632 115.6134 63.8923 67.8867 176.8621 112 R 3.9184 8.0993 119.4725 58.9114 29.7212 177.4533 113 R 4.4074 7.7782 116.3534 57.7617 31.2881 177.7393 114 V 3.5541 7.4974 117.6279 66.1189 31.3399 177.4224 115 D 4.3333 8.1741 117.8526 57.8198 40.7752 178.9579 116 D 4.3221 7.7680 118.6335 57.1518 40.5899 178.2411 117 A 3.9912 8.2843 120.7487 55.8943 18.5230 179.3824 118 T 3.9049 8.0792 113.2266 66.9138 68.4428 176.7716 119 V 3.4697 7.6735 119.4067 66.2172 31.6597 178.2054 120 A 3.9585 7.9780 120.3497 55.3269 18.2687 178.6659 121 I 3.5606 8.6762 117.5596 63.6935 37.0216 177.7456 122 R 3.6610 7.8928 122.9102 59.9145 29.9788 178.1328 123 S 4.1582 7.6679 112.5953 60.9848 62.1623 175.5716 124 A 4.1994 8.5816 122.5914 54.3117 18.1811 178.6487 125 I 3.7686 7.7305 119.1024 63.8692 36.7195 177.5005 126 N 4.2737 8.2304 116.5175 57.1544 39.2801 176.8866 127 N 4.3721 7.8189 117.2810 56.8152 38.5553 176.6647 128 L 3.9837 7.7127 121.6716 58.0791 42.1662 179.0628 129 I 3.7839 7.9853 119.6748 64.3473 36.9452 177.9450 130 V 3.6007 8.5756 118.5043 66.4821 31.5157 177.6424 131 E 4.0870 8.0108 117.6114 59.1945 29.4403 178.9473 132 L 3.9804 8.9101 119.9543 58.2509 41.5740 179.7713 133 I 3.7103 7.9064 118.7837 64.7161 37.1629 178.4316 134 R 4.0964 7.8584 117.6235 57.0838 29.8687 177.4087 135 G 3.7921 7.8416 105.6966 46.0089 0.0000 173.6167 136 T 3.5716 8.6267 115.3433 65.3885 69.3205 176.7233 137 G 3.6531 7.2963 115.4664 44.8444 0.0000 176.0260 138 S 4.7548 7.5399 114.2918 57.6940 64.3910 176.1111 139 Y 4.5549 10.3190 125.8634 58.1464 40.5836 173.9527 140 N 5.2111 8.6453 116.0497 52.1433 42.3909 176.2079 141 R 3.4554 8.9838 120.4540 59.9190 29.0299 178.8451 142 S 4.1308 7.9664 115.0781 60.8428 62.9804 175.3771 143 S 4.3633 8.8146 117.6397 59.5951 62.1401 175.1803 144 F 3.8662 7.4702 124.2859 60.7160 38.6175 177.4608 145 E 3.5943 8.1812 117.7324 58.3727 29.1179 178.1069 146 S 4.5945 7.8942 113.0253 58.5140 63.5141 174.3510 147 S 4.6137 7.2940 117.4009 60.3602 64.2883 176.4369 148 S 2.8182 7.2490 115.0084 60.7766 62.7512 174.8752 149 G 3.7620 6.9844 107.8827 44.0486 0.0000 173.7498 150 L 4.1088 7.3415 121.1942 55.0720 41.7221 176.1897 151 V 4.4397 8.0884 121.8669 60.7319 34.6939 173.5415 152 W 5.3469 8.7479 135.0000 55.9877 32.6494 175.1255 153 T 4.3950 7.6137 113.0695 59.9954 70.9596 174.1171 154 S 3.8685 8.2737 120.8065 58.3330 63.1141 173.9178 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 S 8.19 4.85 0.00 3.77 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 2 Y 9.30 4.57 0.00 3.04 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 3 S 8.60 4.61 0.00 3.89 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 4 I 7.98 4.25 1.98 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.87 1.07 0.00 0.00 5 T 7.66 3.82 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 6 T 7.32 4.72 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 1.24 0.00 0.00 7 P 0.00 4.48 0.00 2.26 2.36 0.00 3.73 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 2.11 2.02 0.00 8 S 7.92 4.36 0.00 3.94 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 9 Q 8.06 4.74 0.00 2.42 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 10 F 8.05 3.38 0.00 3.30 3.08 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 0.00 0.00 0.00 0.00 11 V 8.03 3.69 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 0.61 0.00 0.00 0.79 0.00 0.00 12 F 8.86 5.01 0.00 3.24 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 13 L 7.53 5.04 0.00 1.37 1.02 0.35 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.13 4.74 0.00 4.15 4.01 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 15 S 8.53 5.10 0.00 3.99 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 16 A 7.52 4.87 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 17 W 7.94 5.36 0.00 3.68 3.23 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 18 A 9.05 4.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.21 5.00 0.00 2.70 2.41 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 20 P 0.00 4.38 0.00 2.24 2.65 0.00 3.43 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.44 0.00 21 I 7.50 3.59 1.81 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 1.36 1.12 0.88 0.00 0.00 22 E 8.51 3.79 0.00 2.27 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 2.27 2.32 0.00 23 L 7.55 3.84 0.00 1.84 1.52 0.40 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.44 3.81 2.11 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 1.54 0.44 0.92 0.00 0.00 25 N 8.35 4.28 0.00 2.77 2.87 0.00 0.00 6.75 7.16 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 26 L 7.53 3.94 0.00 1.85 1.91 0.95 1.03 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 27 C 8.73 4.32 0.00 3.18 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 28 T 8.16 3.96 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 29 N 8.52 4.48 0.00 2.90 2.89 0.00 0.00 6.79 8.79 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 30 A 8.44 4.07 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.78 4.47 0.00 1.86 1.83 0.97 1.12 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 32 G 7.45 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 33 N 7.72 4.45 0.00 2.80 2.24 0.00 0.00 6.91 7.69 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 34 Q 7.54 4.20 0.00 1.97 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.12 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 35 F 8.81 4.66 0.00 3.18 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 36 Q 7.94 4.53 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 37 T 7.35 4.35 4.17 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 0.00 0.00 1.11 0.00 0.00 38 Q 8.79 3.85 0.00 2.02 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.14 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 39 Q 7.44 3.95 0.00 2.13 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.42 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 40 A 8.85 3.82 1.02 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 41 R 7.65 3.85 0.00 1.87 2.06 0.00 3.19 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00 42 T 9.19 4.12 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 1.19 0.00 0.00 43 V 7.58 3.55 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 1.00 0.00 0.00 0.90 0.00 0.00 44 V 7.21 4.20 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 1.26 0.00 0.00 0.96 0.00 0.00 45 Q 7.84 4.19 0.00 2.35 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.61 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 46 R 7.97 4.25 0.00 1.91 1.99 0.00 3.18 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.74 0.00 47 Q 8.19 4.34 0.00 2.18 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 48 F 8.85 4.25 0.00 3.25 3.34 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 49 S 8.96 4.21 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 50 E 8.49 4.23 0.00 2.36 2.08 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 0.00 2.39 2.40 0.00 51 V 7.46 4.10 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 0.89 0.00 0.00 0.91 0.00 0.00 52 W 8.53 4.84 0.00 3.61 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 53 K 9.29 4.92 0.00 1.60 1.74 0.00 1.74 0.00 0.00 1.79 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.58 7.81 54 P 0.00 4.72 0.00 2.19 2.23 0.00 3.41 0.00 0.00 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.91 0.00 55 S 9.35 4.45 0.00 3.67 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 56 P 0.00 4.23 0.00 2.08 1.51 0.00 4.09 0.00 0.00 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 1.14 0.00 57 Q 7.49 4.53 0.00 1.89 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.09 0.00 0.00 0.00 0.00 0.00 2.44 2.30 0.00 58 V 7.34 2.51 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 1.23 0.00 0.00 0.76 0.00 0.00 59 T 7.78 4.09 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 1.27 0.00 0.00 60 V 6.60 4.36 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 0.61 0.00 0.00 0.86 0.00 0.00 61 R 7.36 4.12 0.00 0.67 0.80 0.00 3.37 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.16 0.00 62 F 8.07 3.53 0.00 1.84 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 63 P 0.00 4.12 0.00 1.62 1.72 0.00 2.38 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.73 0.00 64 D 8.07 4.49 0.00 2.78 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 65 S 7.75 4.54 0.00 3.84 3.89 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 0.00 0.00 0.00 66 D 7.60 4.60 0.00 2.40 2.31 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 67 F 7.65 5.56 0.00 3.36 3.07 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 68 K 9.06 5.01 0.00 1.88 2.20 0.00 0.61 0.00 0.00 1.27 0.00 0.00 2.13 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.19 1.00 7.81 69 V 8.88 4.29 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 0.89 0.00 0.00 1.04 0.00 0.00 70 Y 8.77 4.59 0.00 3.67 3.27 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 71 R 8.45 3.77 0.00 2.42 1.11 0.00 2.61 0.00 0.00 2.41 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.55 0.00 72 Y 6.49 5.28 0.00 2.64 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 N 7.76 4.85 0.00 3.16 2.67 0.00 0.00 6.89 8.15 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 74 A 8.65 3.53 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 75 V 7.65 4.10 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 0.94 0.00 0.00 0.95 0.00 0.00 76 L 8.37 4.19 0.00 1.78 1.77 1.01 0.98 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 77 D 9.57 4.74 0.00 2.69 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 78 P 0.00 4.30 0.00 2.30 2.31 0.00 3.93 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 79 L 8.00 3.98 0.00 1.86 1.81 0.99 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.61 3.93 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 1.25 0.00 0.00 1.28 0.00 0.00 81 T 7.99 3.69 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 1.13 0.00 0.00 82 A 7.20 3.84 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 83 L 7.22 3.71 0.00 1.82 1.45 1.41 0.52 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 84 L 7.91 3.87 0.00 1.45 1.47 0.63 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 85 G 7.95 4.56 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 0.00 0.00 0.00 86 A 7.00 4.39 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 F 7.66 4.70 0.00 2.99 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 88 D 8.40 4.60 0.00 2.78 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 89 T 7.45 4.97 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 90 R 8.17 4.76 0.00 1.91 2.04 0.00 3.10 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 91 N 8.05 4.35 0.00 2.68 2.90 0.00 0.00 6.91 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 92 R 7.91 3.72 0.00 2.08 2.05 0.00 3.08 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 93 I 7.22 4.27 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 1.41 0.57 0.97 0.00 0.00 94 I 7.64 4.16 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 1.47 0.65 0.91 0.00 0.00 95 E 7.54 4.27 0.00 2.07 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 2.26 2.29 0.00 96 V 7.48 3.83 2.08 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 0.79 0.00 0.00 0.98 0.00 0.00 97 E 9.20 4.42 0.00 2.22 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 2.25 2.37 0.00 98 N 8.88 4.15 0.00 2.71 2.87 0.00 0.00 6.94 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 99 Q 7.87 4.03 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.57 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 100 A 7.08 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 0.00 101 N 8.58 5.18 0.00 2.74 2.64 0.00 0.00 6.86 7.69 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 0.00 102 P 0.00 4.32 0.00 2.26 2.20 0.00 3.75 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 2.07 1.99 0.00 103 T 8.03 4.17 4.24 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 1.21 0.00 0.00 104 T 6.53 3.41 4.24 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 1.21 0.00 0.00 105 A 7.55 5.08 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 0.00 106 E 7.27 4.04 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 2.44 2.42 0.00 107 T 7.41 4.44 4.24 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 1.21 0.00 0.00 108 L 7.37 3.99 0.00 1.61 1.67 0.92 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 109 D 7.39 5.00 0.00 2.74 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 0.00 110 A 8.21 4.65 1.19 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 0.00 0.00 111 T 8.46 4.26 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 0.00 112 R 8.10 3.92 0.00 1.84 1.97 0.00 3.26 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 113 R 7.78 4.41 0.00 1.88 1.93 0.00 3.19 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 114 V 7.50 3.55 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 1.06 0.00 0.00 1.01 0.00 0.00 115 D 8.17 4.33 0.00 2.77 2.75 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 0.00 116 D 7.77 4.32 0.00 2.77 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 0.00 117 A 8.28 3.99 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 0.00 118 T 8.08 3.90 4.49 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 1.17 0.00 0.00 119 V 7.67 3.47 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 0.98 0.00 0.00 0.96 0.00 0.00 120 A 7.98 3.96 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 0.00 121 I 8.68 3.56 1.75 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.32 0.97 0.00 0.00 122 R 7.89 3.66 0.00 1.55 1.90 0.00 3.12 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 123 S 7.67 4.16 0.00 4.18 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 0.00 124 A 8.58 4.20 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 0.00 125 I 7.73 3.77 2.08 0.00 0.00 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 1.58 0.89 1.00 0.00 0.00 126 N 8.23 4.27 0.00 2.89 2.83 0.00 0.00 7.36 6.59 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 0.00 127 N 7.82 4.37 0.00 2.79 2.90 0.00 0.00 6.70 6.40 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 0.00 128 L 7.71 3.98 0.00 2.10 1.96 1.15 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 129 I 7.99 3.78 1.97 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 1.44 0.57 0.93 0.00 0.00 130 V 8.58 3.60 2.32 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 0.84 0.00 0.00 0.97 0.00 0.00 131 E 8.01 4.09 0.00 2.39 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 2.40 2.52 0.00 132 L 8.91 3.98 0.00 1.60 1.76 0.91 0.82 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 0.00 133 I 7.91 3.71 2.04 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 1.54 0.53 0.92 0.00 0.00 134 R 7.86 4.10 0.00 1.98 1.99 0.00 3.20 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 135 G 7.84 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 0.00 0.00 0.00 136 T 8.63 3.57 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 0.00 137 G 7.30 3.65 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 0.00 0.00 0.00 138 S 7.54 4.75 0.00 3.84 4.08 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 0.00 0.00 0.00 0.00 139 Y 10.32 4.55 0.00 2.78 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 0.00 140 N 8.65 5.21 0.00 2.76 2.57 0.00 0.00 6.63 7.65 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 0.00 141 R 8.98 3.46 0.00 2.22 2.51 0.00 3.07 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 142 S 7.97 4.13 0.00 3.82 3.96 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 0.00 143 S 8.81 4.36 0.00 3.78 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 F 7.47 3.87 0.00 2.30 1.87 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 0.00 145 E 8.18 3.59 0.00 2.16 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 2.43 2.40 0.00 146 S 7.89 4.59 0.00 3.94 3.86 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 0.00 147 S 7.29 4.61 0.00 3.57 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 0.00 148 S 7.25 2.82 0.00 3.14 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 0.00 149 G 6.98 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 0.00 0.00 0.00 150 L 7.34 4.11 0.00 1.41 1.68 0.53 0.56 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 0.00 151 V 8.09 4.44 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 0.97 0.00 0.00 0.91 0.00 0.00 152 W 8.75 5.35 0.00 3.14 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 0.00 153 T 7.61 4.40 4.11 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 0.00 0.00 1.16 0.00 0.00 154 S 8.27 3.87 0.00 3.63 3.58 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