NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8709 8.3544 109.7357 45.4436 0.0000 173.3429 2 S 4.1679 8.3311 119.0829 56.5865 64.3658 171.5045 3 S 4.4775 8.4228 120.2012 57.7231 66.3804 174.7736 4 G 4.2698 8.2861 117.1173 43.3063 0.0000 172.5741 5 S 4.5679 7.4065 108.5474 57.6196 65.8643 175.2192 6 S 4.6427 8.1828 118.8024 57.4127 66.8451 173.1280 7 G 3.9701 8.5622 107.3530 46.4116 0.0000 173.7865 8 H 4.5298 7.8554 110.7429 55.0568 32.7819 174.8927 9 F 4.4186 8.7722 128.1678 55.3815 38.2914 170.9730 10 P 4.3682 0.0000 0.0000 62.4319 30.8754 177.3083 11 A 4.6652 8.4092 130.1688 51.6160 19.5790 175.9934 12 R 4.5013 8.0178 121.7594 55.9026 30.7974 175.4370 13 V 4.5227 7.9398 123.8622 60.0686 34.3822 174.1554 14 K 4.3425 8.4814 121.7209 55.2167 33.2549 176.1947 15 V 4.1827 8.1332 123.1816 61.2059 32.4602 175.2857 16 E 4.2708 8.5691 127.2793 54.9870 30.2484 174.7543 17 P 4.3134 0.0000 0.0000 63.0515 31.8816 175.8699 18 A 4.6652 8.5930 124.9420 51.5395 19.1554 176.5256 19 V 4.5443 7.2270 116.0273 61.6123 34.3176 174.6844 20 D 4.3810 8.6168 121.2446 56.6955 41.2957 178.7487 21 T 3.4045 7.3413 107.0556 62.8580 67.7457 172.6880 22 S 4.6745 8.0457 114.5509 59.3971 64.7584 174.4069 23 R 4.6488 7.7196 119.9005 55.8255 30.6973 175.2926 24 I 4.2405 7.8027 118.7294 60.8273 38.3402 175.6717 25 K 4.7658 8.6626 125.0447 54.6273 35.2188 175.3865 26 V 4.9017 8.6677 118.1572 59.3575 34.0185 175.0045 27 F 4.9867 9.0209 120.5584 54.5317 41.0851 174.4907 28 G 4.7781 8.7740 108.1993 42.8368 0.0000 172.1991 29 P 4.3051 0.0000 0.0000 65.6207 31.0981 178.9243 30 G 4.2642 8.1869 104.1159 47.6293 0.0000 174.1880 31 I 4.0127 7.6042 118.1585 61.3727 39.4174 176.8799 32 E 4.1924 7.9448 119.0357 59.0256 30.2635 178.2701 33 G 4.1782 8.3199 106.5365 46.2641 0.0000 174.2569 34 K 4.2187 7.3425 117.9050 56.6775 33.6526 177.8922 35 D 3.4067 7.2599 118.5922 54.0938 41.5172 177.0252 36 V 3.8534 6.9851 116.4302 62.6984 31.4697 175.7088 37 F 4.5741 6.7380 116.8905 57.0055 39.3542 174.8066 38 R 4.1275 8.6746 122.4949 58.2179 30.2044 176.0378 39 E 3.8617 9.3554 123.2573 57.7267 27.6691 174.2594 40 A 4.7097 7.5759 119.5394 50.5388 21.8433 176.9951 41 T 4.3679 8.2835 118.1725 62.9366 67.9882 173.9509 42 T 4.6776 7.7658 121.6647 60.0921 70.4842 172.3186 43 D 5.6865 8.5819 124.9564 52.2253 42.9142 173.6385 44 F 5.0591 7.9545 114.1195 55.3530 42.1705 173.4487 45 T 4.9054 8.5934 114.5495 61.6377 71.8877 173.6520 46 V 4.5072 8.9556 127.0028 61.3367 33.0154 173.7571 47 D 5.1694 8.8398 129.4310 53.3531 42.5172 175.2984 48 S 4.6865 8.3266 121.8576 57.3481 66.1227 173.5718 49 R 4.2790 8.8842 124.1112 57.6928 31.1231 175.9673 50 P 4.5932 0.0000 0.0000 63.7257 31.4788 176.6627 51 L 4.4656 7.4132 119.0557 56.3780 43.4858 176.5557 52 T 4.6262 7.3699 108.7932 61.4378 69.8843 172.5341 53 Q 4.6315 8.7149 123.2817 55.9076 31.5151 176.1623 54 V 4.5075 7.1891 111.3699 60.7602 32.8664 174.0985 55 G 4.3653 7.6231 108.8464 45.3557 0.0000 173.6847 56 G 4.3626 8.3796 107.9994 44.5928 0.0000 171.7880 57 D 5.0712 8.5226 116.5209 53.8636 39.1600 175.5412 58 H 4.7518 8.1002 112.3046 56.6935 30.5319 174.0426 59 I 4.2270 7.2729 117.7527 59.6177 39.3712 175.2396 60 K 4.4432 7.9863 122.9881 55.6032 35.3979 173.8868 61 A 4.9850 8.5914 127.6034 49.5253 22.9372 175.0413 62 H 4.4828 8.3636 118.3703 55.0869 32.3740 172.4209 63 I 4.1366 8.1949 127.0611 60.7208 38.9532 175.1526 64 A 4.8562 8.1691 125.6994 49.9462 21.3217 175.5296 65 N 4.8074 9.0551 120.1970 53.2446 39.7127 175.0020 66 P 4.5066 0.0000 0.0000 64.4405 31.7126 177.0749 67 S 4.5331 9.3015 114.4472 59.1408 64.1904 173.6484 68 G 3.3792 7.4289 112.6004 45.5994 0.0000 173.4721 69 A 4.4727 7.7996 122.6441 52.0464 20.1619 176.3508 70 S 4.9486 8.3693 113.1035 56.5432 67.0788 174.2994 71 T 4.4000 8.1298 120.4050 61.7950 69.8771 174.0766 72 E 3.8235 9.1405 127.6882 57.0036 30.1455 175.4294 73 C 4.8941 8.2291 123.1425 58.3481 30.6376 173.5634 74 F 4.6509 9.1093 121.3101 55.6812 40.9597 174.3937 75 V 4.1837 8.2864 117.2737 61.1286 32.7242 176.2515 76 T 4.5236 8.9980 121.4779 61.7183 72.0910 172.5318 77 D 4.7412 8.6890 127.3888 53.5214 42.4609 176.1502 78 N 4.4319 8.4489 122.3933 52.5750 38.3582 174.7336 79 A 4.1500 7.5512 119.0983 52.1062 16.8495 178.1566 80 D 4.6990 9.2105 118.3140 54.8217 43.5225 176.1215 81 G 4.1752 7.1510 117.0677 45.7446 0.0000 171.9205 82 T 4.9263 7.1204 110.5703 60.0537 72.3249 172.7440 83 Y 4.7331 8.6198 119.3663 56.2188 41.6827 174.9576 84 Q 5.1052 9.0418 124.0064 53.4902 31.8329 173.8819 85 V 4.6227 7.2898 127.1233 61.1403 33.5815 173.8269 86 E 5.2650 9.2653 129.4064 54.6273 32.3104 174.0675 87 Y 5.3246 8.6704 123.3333 56.1747 42.0995 174.0615 88 T 5.1715 8.9188 117.9197 60.0829 70.6721 171.7333 89 P 4.2307 0.0000 0.0000 61.5501 32.4884 176.5531 90 F 5.0207 7.2944 120.0739 56.2033 38.3905 175.2712 91 E 4.6430 7.7029 119.9478 55.7850 33.0917 175.4412 92 K 4.3217 8.7228 124.2409 56.5046 32.5794 175.8607 93 G 4.0075 7.9305 113.5954 46.1383 0.0000 168.9037 94 L 5.2109 8.5273 122.3979 53.9952 42.4524 176.0086 95 H 5.1461 8.4617 123.1904 54.4594 32.2366 174.2314 96 V 4.7171 8.4317 120.7547 60.7512 32.9855 174.5686 97 V 4.2152 8.2703 129.1119 61.8905 32.9989 174.2026 98 E 4.9228 8.6991 128.2225 54.8178 31.4679 175.0986 99 V 4.7135 8.3155 125.3943 61.5366 33.9883 174.9700 100 T 4.8455 8.1867 115.9757 60.4480 70.9997 172.8593 101 Y 4.1156 9.4788 129.4972 56.5522 38.9826 174.8052 102 D 4.1252 8.4671 128.3422 55.7506 39.9028 173.1536 103 D 4.5140 8.5007 111.6148 54.9103 38.5297 174.3842 104 V 4.3862 7.4686 118.2031 60.3923 34.2559 173.0044 105 P 5.0942 0.0000 0.0000 62.1518 32.2984 175.6721 106 I 4.4958 7.9017 113.0876 58.8474 39.3205 174.6168 107 P 4.4404 0.0000 0.0000 64.0726 31.1104 176.4521 108 N 4.4851 7.8081 115.6988 53.7635 39.9120 174.8725 109 S 4.2439 7.1301 113.4879 55.6880 64.9423 172.4549 110 P 4.5235 0.0000 0.0000 63.1287 32.1666 175.3617 111 F 4.7716 9.0908 119.6306 55.9896 42.1972 175.3780 112 K 4.7589 8.6227 118.2350 55.0989 35.0222 176.6910 113 V 4.0972 8.3604 126.8296 61.1705 32.6097 174.9702 114 A 4.2674 8.4190 131.2878 50.6600 18.4949 176.7678 115 V 3.8864 8.1172 121.7619 63.9101 32.4087 175.4877 116 T 4.6753 8.4435 119.5864 59.6594 70.2790 173.2299 117 E 4.0321 8.9833 126.4879 56.9222 30.4581 175.6118 118 G 2.9183 8.8062 112.9796 44.9151 0.0000 173.0770 119 C 4.7740 8.4321 113.6713 56.3478 33.9950 173.6579 120 Q 4.6934 8.2164 116.8784 53.5803 30.2041 174.4510 121 P 4.5251 0.0000 0.0000 63.6435 31.4903 176.2044 122 S 3.9074 7.4615 115.0612 58.8554 62.8591 174.2823 123 S 4.4511 8.6240 120.3908 57.9756 64.1256 170.5959 124 G 3.9815 8.5269 120.7408 45.3419 0.0000 172.8504 125 P 4.3388 0.0000 0.0000 62.5522 32.7006 176.8719 126 S 4.7759 8.3313 119.0800 56.7765 65.0121 174.3177 127 S 4.2403 8.7147 118.7607 60.6717 62.6251 174.3293 128 G 3.7341 7.7114 111.9024 45.6822 0.0000 171.9603 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 G 8.35 3.87 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 0.00 0.00 0.00 2 S 8.33 4.17 0.00 3.86 3.71 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 3 S 8.42 4.48 0.00 3.80 3.66 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 0.00 0.00 0.00 0.00 4 G 8.29 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 0.00 0.00 0.00 0.00 5 S 7.41 4.57 0.00 3.93 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 6 S 8.18 4.64 0.00 3.82 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 7 G 8.56 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 8 H 7.86 4.53 0.00 3.12 3.16 0.00 5.67 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 8.77 4.42 0.00 3.01 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 10 P 0.00 4.37 0.00 2.15 2.05 0.00 3.53 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 1.82 1.88 0.00 11 A 8.41 4.67 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 12 R 8.02 4.50 0.00 1.76 1.86 0.00 3.28 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 13 V 7.94 4.52 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 0.74 0.00 0.00 0.93 0.00 0.00 14 K 8.48 4.34 0.00 1.76 1.77 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.41 7.81 15 V 8.13 4.18 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 0.82 0.00 0.00 0.94 0.00 0.00 16 E 8.57 4.27 0.00 1.98 1.86 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 2.31 2.35 0.00 17 P 0.00 4.31 0.00 2.18 2.07 0.00 3.75 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 18 A 8.59 4.67 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 19 V 7.23 4.54 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 0.76 0.00 0.00 0.83 0.00 0.00 20 D 8.62 4.38 0.00 2.63 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.34 3.40 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 0.85 0.00 0.00 22 S 8.05 4.67 0.00 3.96 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 23 R 7.72 4.65 0.00 1.78 1.95 0.00 3.19 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 24 I 7.80 4.24 1.92 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 1.34 0.43 1.02 0.00 0.00 25 K 8.66 4.77 0.00 1.86 1.90 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.46 7.81 26 V 8.67 4.90 1.84 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 0.76 0.00 0.00 0.62 0.00 0.00 27 F 9.02 4.99 0.00 3.08 3.13 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 28 G 8.77 4.78 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 0.00 0.00 0.00 29 P 0.00 4.31 0.00 2.14 2.24 0.00 3.88 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 2.00 1.98 0.00 30 G 8.19 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 31 I 7.60 4.01 1.18 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.07 0.82 0.00 0.00 32 E 7.94 4.19 0.00 2.01 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 2.38 2.49 0.00 33 G 8.32 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 0.00 0.00 0.00 0.00 34 K 7.34 4.22 0.00 1.65 1.74 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.37 7.81 35 D 7.26 3.41 0.00 2.42 2.43 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 36 V 6.99 3.85 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 0.81 0.00 0.00 37 F 6.74 4.57 0.00 3.16 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 38 R 8.67 4.13 0.00 1.86 1.94 0.00 3.54 0.00 0.00 3.30 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 39 E 9.36 3.86 0.00 2.17 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 2.34 2.34 0.00 40 A 7.58 4.71 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 41 T 8.28 4.37 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 1.14 0.00 0.00 42 T 7.77 4.68 4.13 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 0.51 0.00 0.00 43 D 8.58 5.69 0.00 2.53 2.37 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 44 F 7.95 5.06 0.00 2.93 3.17 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 0.00 45 T 8.59 4.91 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 1.14 0.00 0.00 46 V 8.96 4.51 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 1.13 0.00 0.00 1.22 0.00 0.00 47 D 8.84 5.17 0.00 3.12 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 48 S 8.33 4.69 0.00 3.95 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 49 R 8.88 4.28 0.00 1.85 1.88 0.00 3.31 0.00 0.00 3.41 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.56 0.00 50 P 0.00 4.59 0.00 2.14 2.14 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.97 0.00 51 L 7.41 4.47 0.00 1.62 1.02 0.39 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.37 4.63 4.54 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 1.35 0.00 0.00 53 Q 8.71 4.63 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 7.34 0.00 0.00 0.00 0.00 0.00 2.25 2.41 0.00 54 V 7.19 4.51 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 1.04 0.00 0.00 0.94 0.00 0.00 55 G 7.62 4.37 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 0.00 56 G 8.38 4.36 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 0.00 57 D 8.52 5.07 0.00 2.71 2.72 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 58 H 8.10 4.75 0.00 2.69 2.84 0.00 5.57 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 59 I 7.27 4.23 1.52 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 -0.36 0.73 0.00 0.00 60 K 7.99 4.44 0.00 1.75 1.53 0.00 1.48 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.35 1.45 7.81 61 A 8.59 4.98 1.29 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 62 H 8.36 4.48 0.00 3.20 3.11 0.00 5.86 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 8.19 4.14 1.79 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.50 0.61 0.00 0.00 64 A 8.17 4.86 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 65 N 9.06 4.81 0.00 2.80 2.75 0.00 0.00 6.64 7.46 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 66 P 0.00 4.51 0.00 2.21 2.33 0.00 3.80 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.05 0.00 67 S 9.30 4.53 0.00 4.03 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 68 G 7.43 3.38 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 0.00 69 A 7.80 4.47 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 S 8.37 4.95 0.00 3.71 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 71 T 8.13 4.40 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 1.36 0.00 0.00 72 E 9.14 3.82 0.00 2.00 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 1.51 2.09 0.00 73 C 8.23 4.89 0.00 2.82 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 74 F 9.11 4.65 0.00 3.10 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 75 V 8.29 4.18 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 0.74 0.00 0.00 0.92 0.00 0.00 76 T 9.00 4.52 4.35 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 1.21 0.00 0.00 77 D 8.69 4.74 0.00 3.07 2.58 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 78 N 8.45 4.43 0.00 2.68 2.78 0.00 0.00 7.35 7.02 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 79 A 7.55 4.15 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 80 D 9.21 4.70 0.00 2.66 2.58 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 81 G 7.15 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 0.00 0.00 0.00 0.00 82 T 7.12 4.93 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 1.31 0.00 0.00 83 Y 8.62 4.73 0.00 2.97 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 84 Q 9.04 5.11 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.15 2.03 0.00 85 V 7.29 4.62 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.77 0.00 0.00 86 E 9.27 5.26 0.00 1.91 1.70 0.00 0.00 0.00 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 2.08 0.00 87 Y 8.67 5.32 0.00 3.28 3.13 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 88 T 8.92 5.17 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 1.27 0.00 0.00 89 P 0.00 4.23 0.00 2.17 2.34 0.00 4.03 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 90 F 7.29 5.02 0.00 3.15 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 91 E 7.70 4.64 0.00 1.87 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 2.35 2.60 0.00 92 K 8.72 4.32 0.00 1.82 1.94 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.50 7.81 93 G 7.93 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 0.00 0.00 0.00 94 L 8.53 5.21 0.00 1.63 1.59 0.95 1.09 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 95 H 8.46 5.15 0.00 3.04 3.11 0.00 5.64 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 96 V 8.43 4.72 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 1.34 0.00 0.00 0.93 0.00 0.00 97 V 8.27 4.22 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 0.96 0.00 0.00 0.78 0.00 0.00 98 E 8.70 4.92 0.00 1.90 1.84 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 2.21 2.21 0.00 99 V 8.32 4.71 2.21 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 1.06 0.00 0.00 1.05 0.00 0.00 100 T 8.19 4.85 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 0.00 101 Y 9.48 4.12 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 0.00 102 D 8.47 4.13 0.00 3.08 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 0.00 103 D 8.50 4.51 0.00 2.90 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 0.00 104 V 7.47 4.39 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 1.11 0.00 0.00 1.03 0.00 0.00 105 P 0.00 5.09 0.00 2.19 2.03 0.00 3.42 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 106 I 7.90 4.50 1.89 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.70 1.01 0.00 0.00 107 P 0.00 4.44 0.00 2.17 2.17 0.00 3.75 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 1.98 2.08 0.00 108 N 7.81 4.49 0.00 2.74 2.93 0.00 0.00 6.96 7.61 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 0.00 109 S 7.13 4.24 0.00 3.66 3.66 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 0.00 0.00 0.00 0.00 110 P 0.00 4.52 0.00 2.02 2.00 0.00 3.62 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 1.90 1.94 0.00 111 F 9.09 4.77 0.00 2.86 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 0.00 112 K 8.62 4.76 0.00 1.61 1.72 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.33 1.41 7.81 113 V 8.36 4.10 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 0.98 0.00 0.00 1.01 0.00 0.00 114 A 8.42 4.27 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 0.00 115 V 8.12 3.89 2.24 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 0.87 0.00 0.00 1.05 0.00 0.00 116 T 8.44 4.68 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 1.51 0.00 0.00 117 E 8.98 4.03 0.00 1.98 1.88 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 2.34 2.34 0.00 118 G 8.81 2.92 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 0.00 119 C 8.43 4.77 0.00 2.99 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 0.00 120 Q 8.22 4.69 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 7.06 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 121 P 0.00 4.53 0.00 2.21 2.22 0.00 3.84 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 2.01 2.18 0.00 122 S 7.46 3.91 0.00 3.84 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 0.00 123 S 8.62 4.45 0.00 3.83 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 0.00 124 G 8.53 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 0.00 125 P 0.00 4.34 0.00 2.19 2.08 0.00 3.74 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 1.98 0.00 126 S 8.33 4.78 0.00 3.86 3.81 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 0.00 127 S 8.71 4.24 0.00 3.83 3.87 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 0.00 128 G 7.71 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