NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9908 8.3549 109.7394 45.9244 0.0000 174.2491 5 S 4.4069 8.7046 114.5786 59.7031 63.9665 174.6379 6 R 3.7778 8.3025 120.7615 59.4106 30.9635 177.4625 7 R 3.6514 7.9504 116.7301 58.9126 29.8767 176.2915 8 Y 4.5106 7.8629 112.5003 57.4620 38.2245 174.8933 9 D 4.6061 7.8287 120.7438 53.5294 41.0342 176.4737 10 S 4.1246 8.6922 123.9442 59.7747 63.5349 174.0478 11 R 3.7602 8.5064 118.9907 57.0829 26.4971 177.0784 12 T 4.1977 7.7590 105.9152 63.2271 70.0469 175.2772 13 T 4.6247 7.3792 110.4191 60.5860 68.4101 172.6820 14 I 4.5991 7.1357 113.4935 59.5006 41.4707 175.4301 15 F 4.6926 8.4664 119.8098 56.7351 40.0138 176.1252 16 S 4.5147 8.4868 118.4999 55.9613 63.9365 173.5667 17 P 4.4723 0.0000 0.0000 64.9639 31.0404 177.2825 18 E 4.2777 8.1246 116.0892 55.8393 29.6203 176.2626 19 G 3.6492 8.3526 107.3120 46.4218 0.0000 173.9381 20 R 4.5736 7.8964 117.7161 54.2337 32.5977 175.8087 21 L 4.6006 7.6759 119.9286 53.5804 41.5769 177.4026 22 Y 3.5781 7.2560 119.5828 60.8570 38.1297 178.1427 23 Q 4.0016 8.0527 118.1734 59.2856 29.0045 179.4982 24 V 3.5917 7.6158 118.4568 65.8705 31.6464 177.6761 25 E 3.9436 8.0975 118.4076 59.8851 29.3909 179.0924 26 Y 4.4494 8.2717 116.6903 60.9636 37.7940 178.4561 27 A 4.0658 8.7420 122.1908 55.2274 18.5211 179.6519 28 L 3.9168 8.1163 117.4958 57.9422 41.4649 179.2650 29 E 3.9487 8.0916 118.2707 59.2971 29.7650 178.7015 30 S 4.3035 8.1918 113.1273 61.5776 62.5658 176.2514 31 I 3.7787 7.9756 122.8412 64.0892 36.5792 178.0538 32 S 4.2881 8.0288 113.5132 60.2267 62.8775 174.3570 33 H 4.7399 7.7895 118.2122 55.4863 29.4311 174.5890 34 A 4.3109 7.8272 123.3174 50.8285 19.1777 177.6842 35 G 4.0368 8.5311 108.3993 45.4390 0.0000 173.5453 36 T 4.1649 8.4935 119.1648 63.3279 69.8019 173.0917 37 A 5.1543 8.5609 126.6712 50.1862 21.7891 175.3321 38 I 4.5957 9.5370 123.7498 59.2923 41.2070 174.8794 39 G 4.4230 8.7477 112.3186 44.5074 0.0000 171.8251 40 I 4.6665 8.8818 126.3677 59.6050 40.6494 174.1400 41 M 4.7627 8.7847 126.8598 54.1143 33.3466 175.1590 42 A 4.5775 8.4707 132.1727 51.2998 21.2336 176.0049 43 S 4.4699 8.6210 108.8747 59.8354 63.8341 174.6156 44 D 4.8625 8.9127 118.7336 50.9317 39.5387 175.7616 45 G 4.0856 6.8453 109.1033 46.2789 0.0000 171.3187 46 I 5.0800 7.6894 118.8795 59.3208 41.0780 175.5454 47 V 4.4802 8.9939 124.1726 61.0935 34.5840 174.1326 48 L 5.2804 8.6783 126.6473 52.9125 44.3370 175.6947 49 A 4.8109 9.2957 125.0275 50.1671 22.4061 174.6240 50 A 5.0267 8.5688 122.6221 50.1174 22.8025 174.7420 51 E 4.4603 8.9117 121.8888 54.2233 31.4889 175.5987 52 R 4.0735 8.6008 126.7760 56.0967 30.2940 176.2742 53 K 3.9688 8.5646 125.1272 56.6416 32.9364 173.3788 54 V 3.1638 8.6134 130.9431 62.8777 31.6535 171.3036 55 T 4.7077 8.1003 114.9267 60.6138 72.2630 171.9470 56 S 4.6226 8.0090 114.4806 57.0820 65.6337 174.7298 57 T 4.0012 8.4828 119.3868 66.6565 68.2027 176.3583 58 L 4.0633 7.5605 119.8212 56.6822 41.9058 177.0750 59 L 3.7673 7.2663 119.5395 55.0598 41.9775 176.1200 60 E 4.0345 8.6990 127.5182 56.2880 29.6029 175.7922 61 Q 4.2070 8.6040 128.5248 58.3437 29.7298 177.5016 62 D 4.3952 8.1484 116.7527 56.9133 40.9516 176.9801 63 T 4.4121 7.8097 112.8502 63.0780 68.9499 173.7525 63A S 4.7183 7.6218 116.8955 57.2494 63.6211 174.8506 64 T 4.4280 8.0275 123.4679 62.6354 69.7979 172.9298 65 E 4.6737 8.2940 121.2202 55.9499 31.1941 177.3593 66 K 4.6798 7.6157 116.2392 55.8517 36.1073 175.4596 67 L 5.1534 7.7037 119.2650 53.0988 43.5897 175.6250 68 Y 4.7261 8.7139 121.8331 55.8001 41.4919 175.1310 69 K 4.5095 8.7904 125.0149 55.8708 33.0029 176.1558 70 L 4.3197 8.6642 126.8122 56.4632 42.3949 175.6538 71 N 4.9687 7.4905 113.5490 52.3647 41.9207 173.1098 72 D 4.5545 8.6600 117.5088 56.2200 41.2665 177.3003 73 K 4.7287 8.0510 116.2701 55.8459 34.4533 175.4267 74 I 5.2559 7.6816 120.8935 59.5831 41.2761 174.1180 75 A 5.1939 9.2391 127.0188 50.4818 23.2336 175.0952 76 V 4.9405 8.7868 111.1634 59.5017 36.4444 174.5507 77 A 5.2527 8.9484 125.0024 50.3433 21.3190 175.7529 78 V 4.4544 8.9621 122.8332 61.3684 33.7329 175.5591 79 A 4.3012 9.0526 127.8288 53.2855 21.3716 173.4765 80 G 3.7376 8.6932 113.1276 45.1325 0.0000 173.6169 81 L 4.1061 8.7467 126.9619 54.8142 41.4409 177.6614 82 T 3.8587 8.8499 121.6963 66.7693 68.2679 176.0596 83 A 3.9982 8.0449 121.7901 55.3807 18.4377 179.2665 84 D 4.4175 8.0950 116.4854 57.3873 40.9332 178.4137 85 A 3.9874 8.0664 121.3430 55.4966 18.3080 179.3626 86 E 3.6090 8.2842 117.0165 59.5716 29.4639 179.6132 87 I 3.6956 7.4713 119.6361 64.4845 37.2747 178.4030 88 L 3.7618 7.5818 118.8475 57.8621 41.4439 179.3837 89 I 3.4829 8.3170 120.2901 64.5879 37.0236 177.9516 90 N 4.2755 8.2909 117.8531 56.8947 38.8519 177.0728 91 T 3.9252 7.7920 110.4803 64.4028 68.6582 176.4618 92 A 3.9368 7.8969 123.8508 55.2835 18.5492 179.5648 93 R 4.0103 8.0675 116.6589 59.6447 30.0311 179.4402 94 I 3.7242 7.7859 119.3733 64.6347 37.1492 177.7668 95 H 4.1874 8.3930 118.8783 59.3223 29.5911 176.9635 96 A 3.9372 8.1401 122.3657 55.4766 18.1941 179.7272 97 Q 4.0415 8.0146 115.9937 59.0364 28.6493 178.7202 98 N 4.3528 8.5889 117.9914 56.3284 38.5080 176.6935 99 Y 4.0173 8.1529 120.9060 60.7346 38.9109 177.8947 100 L 4.3180 8.0885 122.5462 57.6194 41.9533 178.8885 101 K 3.9662 8.2477 118.8674 59.7398 32.1821 178.7004 102 T 3.7667 7.8483 115.4011 65.9307 68.4365 175.6152 103 Y 4.5248 7.6828 116.1323 56.6714 39.4218 175.8419 104 N 4.5029 8.6183 116.0561 53.9735 36.5612 173.8092 105 E 4.7979 7.9334 115.9235 54.3696 33.6003 174.9426 106 D 4.5980 8.7964 122.9230 54.2359 41.5107 176.2575 107 I 2.7231 8.1816 123.4158 59.7747 38.5026 174.5182 108 P 4.1361 0.0000 0.0000 62.3463 32.8065 176.9874 109 V 3.4744 8.4434 122.5827 66.4289 31.4022 178.1639 110 E 3.7514 7.9562 118.0370 59.2302 29.3593 178.3898 111 I 3.5879 7.5866 119.3648 64.4218 37.2504 177.9574 112 L 3.8359 7.4290 121.0857 57.9897 41.9208 179.1708 113 V 3.0461 7.3524 118.2401 65.7829 31.3082 177.9868 114 R 3.8420 8.4464 118.8045 59.1782 29.8592 178.5732 115 R 3.8252 7.7203 118.6452 59.4105 30.2682 178.1544 116 L 3.9512 7.7249 119.7239 58.4135 41.9265 179.1872 117 S 4.2328 8.2415 115.0384 61.6370 62.7429 176.3047 118 D 4.3932 8.2959 121.7991 57.3636 40.3033 178.8951 119 I 3.8195 7.7113 119.3785 64.3636 37.0141 178.2383 120 K 4.2671 7.9321 118.7618 59.6999 31.9603 179.0103 121 Q 4.1891 8.5812 120.1741 59.1183 28.7678 178.7276 122 G 3.6631 8.1563 106.6894 48.0971 0.0000 174.9334 123 Y 4.0049 7.8369 115.1644 59.4247 37.8428 177.5836 124 T 4.3217 7.7673 116.4499 63.9944 69.4517 174.9622 125 Q 4.4400 7.9454 119.9124 56.1038 30.8396 174.2781 126 H 4.6600 7.6653 110.5589 55.3860 30.6441 173.5920 127 G 3.7896 8.7514 108.6310 44.1662 0.0000 174.6463 128 G 4.5056 7.8080 105.8715 46.2961 0.0000 173.1551 129 L 4.6927 7.0221 118.0493 52.1844 43.9436 176.6709 130 R 4.1896 8.1118 116.4602 55.2465 30.2400 174.6382 131 P 4.5032 0.0000 0.0000 61.9146 32.2974 175.8236 132 F 4.3456 8.5142 118.6720 57.1812 39.9533 177.6462 133 G 4.0413 9.0036 116.6294 45.3516 0.0000 172.7683 134 V 4.8901 7.2727 117.5919 61.3596 35.9118 175.1974 135 S 4.6553 8.4649 121.4649 56.7115 66.4565 173.0960 136 F 5.3733 8.7892 121.8533 55.7121 42.1058 174.9788 137 I 4.5690 8.3382 121.6367 59.9806 40.0617 173.9977 138 Y 5.0607 9.0362 124.9279 56.3568 39.6692 175.0940 139 A 4.7309 9.2547 126.4440 50.3426 21.5469 175.3206 140 G 5.0888 8.5350 108.1226 45.8671 0.0000 170.6641 141 Y 5.0108 8.3273 119.9161 56.0762 41.7087 173.6869 142 D 4.4810 7.3435 123.9306 51.6672 42.4618 174.5899 143 D 4.5081 8.3846 117.5573 53.6410 39.2105 176.3584 144 R 4.0871 8.2110 126.3210 56.9539 30.1583 175.1834 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 4 G 8.35 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 0.00 0.00 0.00 5 S 8.70 4.41 0.00 4.04 4.02 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 6 R 8.30 3.78 0.00 1.83 1.93 0.00 3.16 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 7 R 7.95 3.65 0.00 1.48 1.04 0.00 2.43 0.00 0.00 2.94 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.35 0.00 8 Y 7.86 4.51 0.00 2.95 2.95 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 9 D 7.83 4.61 0.00 2.71 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 10 S 8.69 4.12 0.00 3.92 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 11 R 8.51 3.76 0.00 2.06 2.02 0.00 3.13 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 12 T 7.76 4.20 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 1.23 0.00 0.00 13 T 7.38 4.62 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 1.20 0.00 0.00 14 I 7.14 4.60 1.95 0.00 0.00 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 1.69 0.97 0.94 0.00 0.00 15 F 8.47 4.69 0.00 3.06 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 16 S 8.49 4.51 0.00 3.77 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 17 P 0.00 4.47 0.00 2.09 2.18 0.00 3.75 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 18 E 8.12 4.28 0.00 1.89 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 0.00 2.26 2.35 0.00 19 G 8.35 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 20 R 7.90 4.57 0.00 1.65 1.88 0.00 3.05 0.00 0.00 3.12 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 21 L 7.68 4.60 0.00 1.55 1.45 0.79 0.17 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 22 Y 7.26 3.58 0.00 2.82 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 23 Q 8.05 4.00 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 24 V 7.62 3.59 2.16 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 1.06 0.00 0.00 0.90 0.00 0.00 25 E 8.10 3.94 0.00 1.90 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 2.33 2.35 0.00 26 Y 8.27 4.45 0.00 2.95 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 27 A 8.74 4.07 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 28 L 8.12 3.92 0.00 1.97 1.75 0.93 0.70 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 29 E 8.09 3.95 0.00 2.06 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 2.37 2.44 0.00 30 S 8.19 4.30 0.00 3.98 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 31 I 7.98 3.78 1.98 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 1.54 0.80 0.94 0.00 0.00 32 S 8.03 4.29 0.00 3.95 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 33 H 7.79 4.74 0.00 3.28 3.34 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.83 4.31 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 35 G 8.53 4.04 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 0.00 0.00 0.00 36 T 8.49 4.16 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 37 A 8.56 5.15 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 38 I 9.54 4.60 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.81 0.92 0.00 0.00 39 G 8.75 4.42 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 0.00 40 I 8.88 4.67 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.67 0.92 0.00 0.00 41 M 8.78 4.76 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 42 A 8.47 4.58 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 43 S 8.62 4.47 0.00 4.00 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 44 D 8.91 4.86 0.00 2.75 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 45 G 6.85 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.69 5.08 1.90 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 1.27 0.76 0.97 0.00 0.00 47 V 8.99 4.48 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 1.07 0.00 0.00 0.93 0.00 0.00 48 L 8.68 5.28 0.00 1.53 1.54 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 49 A 9.30 4.81 1.18 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 50 A 8.57 5.03 1.17 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 0.00 0.00 51 E 8.91 4.46 0.00 2.04 1.82 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 2.22 2.26 0.00 52 R 8.60 4.07 0.00 1.83 1.95 0.00 3.24 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.60 0.00 53 K 8.56 3.97 0.00 1.79 1.71 0.00 2.07 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.61 3.16 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.10 4.71 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 56 S 8.01 4.62 0.00 3.82 3.69 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 0.00 0.00 0.00 0.00 57 T 8.48 4.00 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 58 L 7.56 4.06 0.00 1.57 1.73 0.92 1.38 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 59 L 7.27 3.77 0.00 1.66 1.79 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.70 4.03 0.00 1.95 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 2.29 2.35 0.00 61 Q 8.60 4.21 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.30 6.67 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 62 D 8.15 4.40 0.00 2.68 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 63 T 7.81 4.41 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 63A S 7.62 4.72 0.00 4.05 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 64 T 8.03 4.43 4.10 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 0.00 0.00 0.00 0.70 0.00 0.00 65 E 8.29 4.67 0.00 2.09 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 2.16 2.29 0.00 66 K 7.62 4.68 0.00 1.64 1.82 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.44 7.81 67 L 7.70 5.15 0.00 1.35 1.49 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 68 Y 8.71 4.73 0.00 2.86 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 69 K 8.79 4.51 0.00 1.73 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.54 7.81 70 L 8.66 4.32 0.00 1.81 1.68 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.49 4.97 0.00 2.61 2.67 0.00 0.00 7.00 8.47 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 72 D 8.66 4.55 0.00 2.73 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 K 8.05 4.73 0.00 1.72 2.01 0.00 1.74 0.00 0.00 2.08 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.48 7.81 74 I 7.68 5.26 1.88 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.72 0.96 0.00 0.00 75 A 9.24 5.19 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 76 V 8.79 4.94 1.82 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 0.22 0.00 0.00 0.84 0.00 0.00 77 A 8.95 5.25 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 78 V 8.96 4.45 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 0.66 0.00 0.00 1.28 0.00 0.00 79 A 9.05 4.30 1.17 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 0.00 0.00 80 G 8.69 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 81 L 8.75 4.11 0.00 1.65 1.65 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.85 3.86 4.28 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 1.32 0.00 0.00 83 A 8.04 4.00 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 84 D 8.10 4.42 0.00 2.95 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 85 A 8.07 3.99 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 86 E 8.28 3.61 0.00 2.09 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 0.00 2.07 2.54 0.00 87 I 7.47 3.70 2.14 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 1.81 1.60 1.03 0.00 0.00 88 L 7.58 3.76 0.00 1.91 1.63 0.58 -0.02 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 89 I 8.32 3.48 1.83 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.54 0.77 0.00 0.00 90 N 8.29 4.28 0.00 2.80 2.93 0.00 0.00 7.01 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 91 T 7.79 3.93 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 1.24 0.00 0.00 92 A 7.90 3.94 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 93 R 8.07 4.01 0.00 1.99 2.02 0.00 3.13 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.88 0.00 94 I 7.79 3.72 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.71 0.94 0.00 0.00 95 H 8.39 4.19 0.00 3.33 3.50 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.14 3.94 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 97 Q 8.01 4.04 0.00 2.26 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 98 N 8.59 4.35 0.00 2.99 2.92 0.00 0.00 6.60 8.23 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 99 Y 8.15 4.02 0.00 3.26 3.18 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 0.00 100 L 8.09 4.32 0.00 1.93 1.90 1.07 0.51 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 0.00 101 K 8.25 3.97 0.00 1.88 1.92 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.45 7.81 102 T 7.85 3.77 3.67 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 0.00 0.00 0.00 0.09 0.00 0.00 103 Y 7.68 4.52 0.00 2.57 2.77 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 0.00 0.00 0.00 0.00 104 N 8.62 4.50 0.00 2.88 2.99 0.00 0.00 6.74 7.25 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 0.00 105 E 7.93 4.80 0.00 2.11 1.90 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 2.34 2.38 0.00 106 D 8.80 4.60 0.00 2.69 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 0.00 107 I 8.18 2.72 1.60 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.36 0.75 0.00 0.00 108 P 0.00 4.14 0.00 1.97 1.80 0.00 2.81 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.00 0.00 109 V 8.44 3.47 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 0.91 0.00 0.00 0.87 0.00 0.00 110 E 7.96 3.75 0.00 1.96 1.82 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 2.27 2.29 0.00 111 I 7.59 3.59 1.74 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 1.45 0.35 0.81 0.00 0.00 112 L 7.43 3.84 0.00 1.47 1.67 0.85 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.35 3.05 1.85 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 0.47 0.00 0.00 -0.23 0.00 0.00 114 R 8.45 3.84 0.00 1.80 1.86 0.00 3.14 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 115 R 7.72 3.83 0.00 1.96 2.11 0.00 3.16 0.00 0.00 2.88 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 116 L 7.72 3.95 0.00 1.96 1.71 0.74 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.24 4.23 0.00 4.07 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 0.00 118 D 8.30 4.39 0.00 2.98 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 0.00 119 I 7.71 3.82 2.05 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 1.59 0.65 0.98 0.00 0.00 120 K 7.93 4.27 0.00 2.11 1.95 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.45 1.54 7.81 121 Q 8.58 4.19 0.00 2.22 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 122 G 8.16 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 0.00 0.00 0.00 123 Y 7.84 4.00 0.00 3.19 3.04 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 0.00 124 T 7.77 4.32 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 1.14 0.00 0.00 125 Q 7.95 4.44 0.00 1.90 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.64 0.00 0.00 0.00 0.00 0.00 2.26 2.20 0.00 126 H 7.67 4.66 0.00 3.18 3.21 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.75 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 0.00 128 G 7.81 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 0.00 0.00 0.00 0.00 129 L 7.02 4.69 0.00 1.57 1.65 0.94 0.84 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 0.00 130 R 8.11 4.19 0.00 1.91 1.92 0.00 3.00 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.52 0.00 131 P 0.00 4.50 0.00 2.09 2.10 0.00 3.67 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 2.12 0.00 132 F 8.51 4.35 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 0.00 133 G 9.00 4.04 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 0.00 0.00 0.00 134 V 7.27 4.89 1.80 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 -0.22 0.00 0.00 0.82 0.00 0.00 135 S 8.46 4.66 0.00 3.69 3.63 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 0.00 136 F 8.79 5.37 0.00 2.57 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 0.00 0.00 0.00 137 I 8.34 4.57 1.89 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 1.27 0.88 0.96 0.00 0.00 138 Y 9.04 5.06 0.00 2.74 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 0.00 139 A 9.25 4.73 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 0.00 140 G 8.53 5.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.33 5.01 0.00 2.98 2.79 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 0.00 142 D 7.34 4.48 0.00 2.56 2.38 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 0.00 143 D 8.38 4.51 0.00 2.80 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 0.00 144 R 8.21 4.09 0.00 1.64 1.82 0.00 3.23 0.00 0.00 3.18 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.46 0.00