NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 L 4.2174 8.1844 122.4889 54.5644 41.5325 175.7227 7 S 4.4064 8.4694 121.3878 55.0147 62.9542 172.3563 8 P 4.2485 0.0000 0.0000 64.2090 33.1328 174.7284 9 L 4.9934 6.8923 123.7623 53.1677 44.1327 175.4403 10 S 4.8527 8.9867 119.8386 57.2002 67.5597 172.1296 11 T 4.9043 8.0749 113.4166 61.5290 71.6349 171.4698 12 H 4.8594 8.4476 120.8581 55.2186 33.5053 171.9428 13 V 4.6537 8.5680 126.3997 61.0135 33.7839 173.9439 14 L 4.7702 8.5667 129.4362 53.1900 45.2023 174.8918 15 N 5.2145 9.0887 126.3584 53.0531 38.5297 175.0802 16 I 4.1503 8.8665 119.1152 62.0636 37.7554 177.1779 17 A 4.3276 8.5925 126.2416 54.2681 18.6107 178.1538 18 Q 4.5627 8.2368 111.4853 54.7131 30.6906 175.7001 19 G 3.9817 8.3888 105.7613 46.7751 0.0000 173.7745 20 V 4.6341 7.4052 110.6759 58.0257 35.7541 173.7391 21 P 4.5176 0.0000 0.0000 63.2095 32.1145 177.2471 22 G 3.7393 9.1251 110.9994 44.6591 0.0000 172.7910 23 A 4.6380 8.4444 128.0736 51.2404 20.2449 176.0328 24 N 4.1637 8.3436 114.6406 54.4867 37.1455 174.1172 25 M 4.6301 8.0612 116.8821 54.4761 34.5456 174.9917 26 T 4.6683 8.3670 121.6742 63.3783 70.4512 173.6782 27 I 4.7877 8.7153 125.7659 59.4627 41.6714 174.2894 28 V 4.5924 8.5002 126.4977 60.8963 34.3409 173.7261 29 L 5.0176 8.8819 130.4697 54.1152 43.8935 174.8648 30 H 5.5937 9.4902 122.3617 54.1789 33.3637 172.3008 31 R 4.8628 9.2211 119.8649 54.4456 33.4391 173.8674 32 L 3.8465 8.3322 128.5156 54.1554 43.2487 175.8263 33 D 4.5034 8.7846 127.1553 53.0739 41.1761 174.9607 34 P 4.3162 0.0000 0.0000 64.2028 31.9819 177.4740 35 V 3.8241 7.9369 118.8748 64.1989 32.0786 175.6057 36 S 4.7010 7.7975 112.6888 57.0133 65.3667 173.2089 37 S 4.7036 8.3387 112.8422 57.1555 63.4678 174.2938 38 A 4.3356 7.5602 121.4674 51.3202 20.2524 177.6375 39 W 4.9749 8.6181 120.4757 55.5909 30.7602 175.4617 40 N 5.0131 9.7217 123.6752 51.5423 40.4005 174.3301 41 I 4.2112 8.4397 124.8356 61.5879 37.3100 175.4149 42 L 4.5430 8.9687 127.5715 56.6092 43.3247 177.5645 43 T 4.6651 7.5633 113.8761 62.4499 73.1735 172.8803 44 T 4.8913 8.5927 122.4770 61.8991 70.9843 173.6588 45 G 4.2566 9.0385 112.7733 45.1085 0.0000 170.8177 46 I 5.2632 7.9996 119.0376 59.4845 41.1156 175.9728 47 T 4.3712 8.8476 117.3258 61.8245 70.3559 174.5239 48 N 4.9187 8.6395 121.3375 51.7567 39.4902 175.3868 49 D 4.3881 8.5248 116.8047 57.4566 40.8499 177.1592 50 D 4.5519 8.3050 116.8172 53.9269 41.0697 176.5445 51 G 3.8318 8.2024 107.6400 46.4314 0.0000 173.8832 52 R 4.9664 8.0566 118.2485 54.5312 32.0954 175.2994 53 C 5.0632 8.0740 119.3812 56.7510 31.7573 171.8122 54 P 4.4563 0.0000 0.0000 62.2868 32.0704 176.2559 55 G 3.9788 8.5813 104.4420 46.3989 0.0000 175.2744 56 L 4.0634 8.0566 121.0101 57.3737 42.0798 177.6645 57 I 4.4094 7.5111 115.9367 58.8661 41.1590 173.5953 58 T 4.3809 8.2086 116.0522 60.6428 71.5630 175.1613 59 K 4.0494 8.6461 123.0790 60.3043 31.8883 178.8698 60 E 4.0850 8.1594 116.6648 58.9851 29.5715 177.8418 61 N 4.8059 8.0140 114.7007 53.6080 40.3467 175.6083 62 F 4.8493 7.7724 122.6601 57.7401 37.7206 174.2046 63 I 4.2908 7.8947 117.9654 57.8615 39.9623 176.2730 64 A 4.1177 8.3757 122.7527 51.7635 19.1129 177.6361 65 G 3.7343 7.3958 105.7930 46.5038 0.0000 170.6055 66 V 4.8213 7.3342 119.2739 61.3056 33.7112 174.5796 67 Y 5.1976 8.4853 124.8740 56.0667 41.7148 174.5843 68 K 4.9106 8.9000 121.8251 55.0005 36.1498 174.6239 69 M 5.0137 9.1749 126.3614 53.6047 34.6295 174.6084 70 R 4.8456 8.9159 124.7005 54.8093 32.4390 174.6081 71 F 4.9480 9.5629 125.4755 55.7137 41.5003 176.0234 72 E 4.9638 8.9241 126.3283 55.3713 26.1322 177.3998 73 T 4.1438 7.9545 114.1333 64.8244 69.5142 176.9932 74 G 3.7524 8.2878 108.7587 47.3870 0.0000 175.8987 75 K 4.0706 8.1259 120.4229 59.2303 32.0423 178.6394 76 Y 3.9838 8.1625 119.8430 60.6155 38.7348 178.3308 77 W 3.9186 8.5497 120.0700 59.6265 29.2291 178.0609 78 D 4.5648 8.7770 119.3005 56.8196 40.4152 178.1924 79 A 4.0369 7.7719 120.2353 54.7549 18.3918 178.6131 80 L 4.2939 7.0633 113.6118 54.5201 41.7848 177.4818 81 G 3.9527 8.1526 106.9886 45.9261 0.0000 173.3663 82 E 4.7802 8.3858 117.8830 54.2506 33.4169 175.5157 83 T 4.3259 8.1561 110.9276 61.0085 68.9975 173.5333 84 C 4.3816 7.9373 120.8708 57.0262 34.5827 174.7375 85 F 4.2897 8.2625 128.1315 60.1888 39.0957 174.6551 86 Y 4.5468 6.7776 117.1470 55.1129 39.1566 173.8065 87 P 4.6119 0.0000 0.0000 65.8823 32.4083 175.4760 88 Y 5.2646 7.0798 115.1895 56.6844 40.9350 174.0402 89 V 4.3379 8.8534 119.7457 61.0419 34.6681 173.9267 90 E 5.2563 8.9498 126.1031 54.6685 32.4462 175.0696 91 I 4.6211 8.9471 125.3741 59.5440 39.8117 174.6301 92 V 4.9445 8.6791 127.0312 61.0517 33.6285 174.4818 93 F 5.2261 8.6804 121.6119 55.7793 41.8734 173.1589 94 T 5.1147 8.7659 116.2183 62.0186 70.8322 173.7781 95 I 4.3058 8.7545 127.1604 60.0707 38.8896 175.7148 96 T 4.0798 8.8518 116.0158 62.5300 70.2312 173.7714 97 N 4.7504 7.8115 122.9213 51.8972 39.3027 174.6748 98 T 4.1059 8.4808 119.9974 62.4052 67.9959 174.8894 99 S 4.5844 8.0407 113.7428 59.3923 63.7785 173.9656 100 Q 4.4575 7.4440 120.1653 55.1185 30.2999 174.4592 101 H 4.8828 8.2446 119.4677 55.7610 31.9681 173.3630 102 Y 4.6154 8.5382 121.3261 56.3847 41.6209 173.7288 103 H 5.0998 9.3421 124.8385 54.5626 32.1791 173.1407 104 V 4.5476 8.7300 127.0279 60.3403 31.7062 172.9100 105 P 4.8793 0.0000 0.0000 60.1729 34.0650 174.6432 106 L 4.5814 8.5233 121.4886 53.1159 44.9278 174.8451 107 L 5.1740 8.7122 126.8238 52.9655 43.8686 175.4961 108 L 5.4439 9.1657 124.4750 54.2504 44.3900 176.2577 109 S 5.8144 8.5318 115.2345 56.8668 65.7665 173.8650 110 R 2.9767 8.0541 117.1174 58.7590 29.7685 177.9771 111 F 4.8469 7.8570 113.9805 56.4209 40.8896 174.1707 112 S 4.9128 8.1615 114.1394 58.0379 65.2472 172.3874 113 Y 5.4307 7.6073 117.9892 56.4370 40.4948 173.3591 114 S 4.7953 9.2220 114.5753 57.4661 67.1171 172.4108 115 T 5.0831 8.2629 113.7465 61.3456 70.3250 172.5187 116 T 4.6775 8.1450 113.9047 59.9149 71.9076 172.9072 117 R 4.2794 8.5610 123.3979 55.6908 31.0855 175.6286 118 G 4.2866 9.2671 113.5062 44.4697 0.0000 173.2822 119 S 4.8675 8.1569 114.2720 57.4067 63.5424 174.6643 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 6 L 8.18 4.22 0.00 1.61 1.69 0.90 0.59 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 7 S 8.47 4.41 0.00 3.93 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 P 0.00 4.25 0.00 1.18 2.15 0.00 3.71 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 1.13 1.72 0.00 9 L 6.89 4.99 0.00 1.35 1.32 0.85 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.99 4.85 0.00 3.93 3.98 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 11 T 8.07 4.90 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 1.23 0.00 0.00 12 H 8.45 4.86 0.00 3.31 3.16 0.00 5.69 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.57 4.65 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 0.53 0.00 0.00 0.97 0.00 0.00 14 L 8.57 4.77 0.00 1.81 1.47 1.01 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.09 5.21 0.00 2.83 2.91 0.00 0.00 6.53 7.45 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 16 I 8.87 4.15 1.94 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 1.44 0.82 0.97 0.00 0.00 17 A 8.59 4.33 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 18 Q 8.24 4.56 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 19 G 8.39 3.98 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 0.00 20 V 7.41 4.63 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 0.96 0.00 0.00 21 P 0.00 4.52 0.00 2.05 2.10 0.00 3.68 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 2.17 2.15 0.00 22 G 9.13 3.74 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 0.00 23 A 8.44 4.64 1.25 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 0.00 0.00 24 N 8.34 4.16 0.00 2.89 2.92 0.00 0.00 6.81 7.77 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 25 M 8.06 4.63 0.00 1.97 1.61 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 26 T 8.37 4.67 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 1.16 0.00 0.00 27 I 8.72 4.79 1.67 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.89 0.35 0.00 0.00 28 V 8.50 4.59 1.94 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 0.56 0.00 0.00 0.82 0.00 0.00 29 L 8.88 5.02 0.00 1.74 1.49 1.18 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 30 H 9.49 5.59 0.00 3.00 3.45 0.00 5.80 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 9.22 4.86 0.00 1.62 1.61 0.00 2.94 0.00 0.00 2.87 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.57 0.00 32 L 8.33 3.85 0.00 0.27 1.04 -0.41 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.78 4.50 0.00 2.60 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 0.00 0.00 0.00 0.00 34 P 0.00 4.32 0.00 2.11 2.01 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.83 0.00 35 V 7.94 3.82 2.12 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 0.76 0.00 0.00 0.87 0.00 0.00 36 S 7.80 4.70 0.00 3.94 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 37 S 8.34 4.70 0.00 3.73 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 A 7.56 4.34 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 39 W 8.62 4.97 0.00 3.12 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 40 N 9.72 5.01 0.00 2.55 2.73 0.00 0.00 6.64 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 41 I 8.44 4.21 1.85 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 1.20 0.49 0.83 0.00 0.00 42 L 8.97 4.54 0.00 1.54 1.77 1.15 0.76 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 43 T 7.56 4.67 4.21 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 1.18 0.00 0.00 44 T 8.59 4.89 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 1.16 0.00 0.00 45 G 9.04 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 0.00 0.00 0.00 0.00 46 I 8.00 5.26 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.64 0.91 0.00 0.00 47 T 8.85 4.37 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 1.24 0.00 0.00 48 N 8.64 4.92 0.00 2.97 3.02 0.00 0.00 7.06 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 8.52 4.39 0.00 2.69 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 50 D 8.30 4.55 0.00 2.85 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 51 G 8.20 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.06 4.97 0.00 1.91 1.86 0.00 3.09 0.00 0.00 3.14 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 53 C 8.07 5.06 0.00 2.83 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 54 P 0.00 4.46 0.00 2.19 2.03 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.07 0.00 55 G 8.58 3.98 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 0.00 56 L 8.06 4.06 0.00 1.73 1.71 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.51 4.41 1.90 0.00 0.00 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 1.47 1.19 0.70 0.00 0.00 58 T 8.21 4.38 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 59 K 8.65 4.05 0.00 1.92 1.91 0.00 1.74 0.00 0.00 1.90 0.00 0.00 3.08 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.56 1.69 7.81 60 E 8.16 4.09 0.00 2.00 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 2.34 2.46 0.00 61 N 8.01 4.81 0.00 2.79 2.92 0.00 0.00 7.18 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 7.77 4.85 0.00 3.06 3.15 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 0.00 0.00 0.00 63 I 7.89 4.29 1.85 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 1.28 0.78 0.93 0.00 0.00 64 A 8.38 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 7.40 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 V 7.33 4.82 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 1.18 0.00 0.00 0.87 0.00 0.00 67 Y 8.49 5.20 0.00 1.64 2.34 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 68 K 8.90 4.91 0.00 0.79 0.85 0.00 1.07 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 0.91 1.00 7.81 69 M 9.17 5.01 0.00 1.47 2.08 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.39 0.00 70 R 8.92 4.85 0.00 1.64 1.65 0.00 2.85 0.00 0.00 2.90 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.37 0.00 71 F 9.56 4.95 0.00 2.75 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 72 E 8.92 4.96 0.00 2.01 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 2.30 2.45 0.00 73 T 7.95 4.14 4.51 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 1.21 0.00 0.00 74 G 8.29 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 75 K 8.13 4.07 0.00 2.03 1.92 0.00 1.71 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.56 7.81 76 Y 8.16 3.98 0.00 2.98 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 77 W 8.55 3.92 0.00 3.49 3.35 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 78 D 8.78 4.56 0.00 2.90 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 79 A 7.77 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 80 L 7.06 4.29 0.00 1.73 1.67 -0.05 0.74 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 81 G 8.15 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 0.00 0.00 0.00 82 E 8.39 4.78 0.00 2.26 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 2.26 2.32 0.00 83 T 8.16 4.33 4.21 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 1.22 0.00 0.00 84 C 7.94 4.38 0.00 3.01 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 85 F 8.26 4.29 0.00 2.24 2.03 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 86 Y 6.78 4.55 0.00 2.98 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 87 P 0.00 4.61 0.00 2.15 2.30 0.00 3.53 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.84 0.00 88 Y 7.08 5.26 0.00 3.07 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 89 V 8.85 4.34 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 0.17 0.00 0.00 -0.06 0.00 0.00 90 E 8.95 5.26 0.00 1.95 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.46 0.00 91 I 8.95 4.62 2.18 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.04 1.09 0.00 0.00 92 V 8.68 4.94 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.91 0.00 0.00 93 F 8.68 5.23 0.00 3.15 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 8.77 5.11 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 1.24 0.00 0.00 95 I 8.75 4.31 1.85 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.51 0.28 0.00 0.00 96 T 8.85 4.08 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 97 N 7.81 4.75 0.00 2.79 2.90 0.00 0.00 6.84 7.10 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 98 T 8.48 4.11 4.19 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 1.25 0.00 0.00 99 S 8.04 4.58 0.00 4.06 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 0.00 100 Q 7.44 4.46 0.00 1.67 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 101 H 8.24 4.88 0.00 3.17 3.08 0.00 5.61 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 0.00 102 Y 8.54 4.62 0.00 2.79 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 0.00 103 H 9.34 5.10 0.00 3.16 3.05 0.00 5.52 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.73 4.55 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 0.65 0.00 0.00 0.30 0.00 0.00 105 P 0.00 4.88 0.00 2.14 1.97 0.00 3.48 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.82 0.00 106 L 8.52 4.58 0.00 0.47 0.85 0.50 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.71 5.17 0.00 1.69 1.59 0.93 0.19 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 0.00 108 L 9.17 5.44 0.00 1.94 1.70 1.05 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.53 5.81 0.00 4.08 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 R 8.05 2.98 0.00 1.40 0.91 0.00 2.85 0.00 0.00 2.70 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 111 F 7.86 4.85 0.00 2.96 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 S 8.16 4.91 0.00 4.03 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Y 7.61 5.43 0.00 2.92 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 S 9.22 4.80 0.00 3.83 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 0.00 115 T 8.26 5.08 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 1.27 0.00 0.00 116 T 8.14 4.68 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 0.00 117 R 8.56 4.28 0.00 1.89 1.92 0.00 3.37 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 118 G 9.27 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 S 8.16 4.87 0.00 3.65 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