NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.6840 8.1633 120.6145 55.4533 34.2477 173.7822 2 I 4.5419 8.5302 125.6723 58.7301 40.7292 173.0338 3 A 4.7201 8.8958 128.2176 50.0411 22.1659 174.6419 4 L 4.8426 8.6111 126.2791 54.4159 43.2752 175.2552 5 I 5.0307 8.8033 121.2163 59.3468 40.5189 174.6452 6 Q 5.0178 8.7747 122.7943 54.0610 32.5550 174.4829 7 R 4.4955 8.7960 124.9052 56.2432 31.2160 175.6583 8 V 5.6950 9.2743 119.2974 59.0361 35.4539 176.2691 9 T 4.4965 8.4632 111.3964 62.9335 70.1911 174.7125 10 R 4.8685 7.9930 115.5886 56.6020 32.4246 173.4759 11 A 5.1050 8.5001 120.4132 51.4530 23.2018 175.3229 12 S 5.1404 9.4185 115.5441 56.8968 66.7586 173.1138 13 V 5.0584 8.9574 125.9305 60.0745 33.9942 174.5338 14 T 5.7406 8.7939 113.6822 58.8102 72.5500 173.1249 15 V 4.4838 8.1004 122.6268 61.0379 34.1112 175.2239 16 E 3.9262 9.8708 130.1517 57.4474 26.9370 176.1834 17 G 3.9749 8.3447 106.3414 45.4185 0.0000 173.5670 18 E 4.0082 7.9895 121.9378 55.4057 29.9116 175.7225 19 V 4.2931 8.3349 126.9973 62.7625 31.0101 175.4292 20 T 4.2452 8.8020 119.2859 63.6544 69.6208 174.8087 21 G 4.1593 7.6300 106.2039 46.3151 0.0000 172.0282 22 E 5.3916 9.2241 122.8921 54.9242 33.2748 174.0722 23 I 4.7602 9.1305 119.3824 58.4010 41.8999 176.0666 24 G 4.2065 8.5183 113.2511 44.8475 0.0000 175.5416 25 A 4.4790 8.7257 128.1182 51.3263 19.8119 177.0061 26 G 4.2950 7.2953 109.2722 45.8921 0.0000 172.4664 27 L 5.3616 8.8624 124.4424 52.7505 45.8497 174.9781 28 L 4.8760 8.8708 125.4221 53.6251 44.0495 175.0843 29 V 4.5808 9.1403 127.4093 61.2642 33.5519 174.2168 30 L 4.8878 8.7054 129.4901 53.5855 43.3116 175.4771 31 L 4.8121 8.9474 127.0278 53.0638 44.5288 175.0427 32 G 4.3770 8.8922 113.9135 44.3649 0.0000 171.8773 33 V 4.6440 8.5446 125.7117 61.9948 32.7934 175.1749 34 E 4.7067 10.0467 128.1114 54.2582 31.6343 176.7739 35 K 3.8155 8.4705 122.8682 59.9957 32.1304 177.4093 36 D 4.8057 7.9528 115.2231 54.3621 40.7619 176.2270 37 D 4.6525 7.8569 119.8070 54.5081 41.6182 174.9141 38 D 4.5650 7.9382 118.7690 51.5324 42.1865 175.8805 39 E 3.5612 8.5387 117.6750 59.5016 29.1135 179.5132 40 Q 4.0443 8.0160 117.6075 59.0084 28.8121 178.8428 41 K 4.0374 8.9475 119.7044 59.2300 32.0644 179.2621 42 A 4.1884 8.1254 121.1754 55.4240 18.3519 179.2847 43 N 4.3076 8.5416 115.5583 56.7849 39.0044 177.3559 44 R 4.2112 8.1918 121.0041 58.6497 30.0732 178.7846 45 L 4.0366 8.3523 120.4219 58.1601 42.0110 178.4800 46 C 4.0275 8.3870 118.7416 62.5778 31.3957 175.4474 47 E 3.9440 8.3899 120.1976 59.4370 29.1387 179.6281 48 R 4.0870 8.0109 118.1255 59.1456 29.9236 179.2084 49 V 3.6160 7.9003 117.0960 66.2036 31.7387 177.9641 50 L 4.3185 8.2305 116.8145 56.4407 41.5569 178.4761 51 G 4.1388 7.5503 103.1995 43.2802 0.0000 172.9624 52 Y 4.0877 7.6797 123.6051 57.8247 39.1890 175.9220 53 R 4.7933 7.8511 128.5233 54.9878 28.5561 175.8426 54 I 4.4429 7.7947 108.9538 60.0590 38.9869 176.0352 55 F 4.5994 8.4817 120.8227 56.0082 40.3413 175.6325 56 S 4.8142 8.5943 121.3046 58.6115 63.6730 174.4127 57 D 4.7703 8.7266 124.3068 52.2359 41.5907 176.5723 58 A 4.0479 8.5792 120.5069 55.3559 18.3887 178.4034 59 E 4.2483 8.5113 113.4554 56.5621 29.9198 177.2435 60 G 3.9513 8.2899 107.5465 45.1904 0.0000 173.4445 61 K 4.4499 7.8257 118.5275 54.4867 33.8612 175.9499 62 M 4.6446 8.4214 121.8121 55.9040 31.1713 176.2124 63 N 5.0001 8.5565 117.8929 52.6391 42.5120 174.6135 64 L 4.9997 8.1398 119.3553 52.5646 44.7751 176.0742 65 N 5.9808 9.2033 122.2609 51.1257 40.1584 176.6588 66 V 2.5128 8.3044 119.9780 64.8445 31.0800 178.3960 67 Q 3.8814 7.9797 118.0719 58.7949 28.4883 178.3063 68 Q 3.9992 8.5922 118.3908 58.3955 28.8125 177.6808 69 A 4.2625 7.5713 119.3545 51.3889 18.7628 177.3601 70 G 3.6889 7.6390 105.3861 46.4174 0.0000 174.3601 71 G 3.9471 7.8207 107.7559 44.8741 0.0000 173.1656 72 S 5.0766 8.6619 115.3144 56.5022 67.0387 173.6537 73 V 4.8343 8.6282 119.6283 61.2724 34.7510 173.6790 74 L 5.1641 9.0783 130.1543 53.4363 44.4191 174.8138 75 V 4.8926 8.8867 127.3326 61.3979 33.7215 174.6245 76 V 4.9722 8.9897 127.6777 60.7666 35.1175 174.6693 77 S 4.4265 8.4625 122.6065 58.7413 64.2979 173.2548 78 Q 4.5308 9.3131 125.1638 54.4376 30.4505 174.9204 79 F 4.4017 8.5990 121.3636 58.7744 38.7709 177.9905 80 T 4.3430 6.9925 111.4692 63.9166 69.0038 176.5382 81 L 4.0587 7.5358 122.1125 57.4211 41.6331 177.6015 82 A 4.5285 7.6041 117.9161 51.8959 18.8261 177.2398 83 A 4.1410 7.7236 119.6323 52.3641 19.1209 177.4536 84 D 4.6111 9.0140 121.1168 53.5475 41.0608 176.7788 85 T 4.5358 8.2010 115.6266 61.3403 69.3920 174.7209 86 E 4.0449 8.1375 126.0111 60.1949 29.5638 178.3714 87 R 4.5492 7.5136 113.1786 55.4485 33.3910 177.1362 88 G 4.0738 8.7833 103.9020 46.3278 0.0000 173.2558 89 M 4.3491 8.2131 116.3957 54.9448 32.1985 176.4711 90 R 4.5615 7.5409 118.3874 53.2390 32.6616 173.7028 91 P 4.2661 0.0000 0.0000 62.6077 32.0465 175.4970 92 S 4.4436 8.3439 114.8640 56.7995 64.1884 174.9367 93 F 4.9717 8.5584 130.6493 56.9557 37.6632 175.9253 94 S 4.8043 7.9267 112.1023 58.6308 63.8768 176.0639 95 K 4.5149 8.1595 120.1384 54.6921 33.3968 179.3390 96 G 4.1204 7.9836 106.8102 45.3092 0.0000 172.8453 97 A 4.5332 8.1035 122.8538 50.3427 20.5535 177.6780 98 S 4.3457 8.2348 114.0992 57.7949 64.9667 173.3109 99 P 4.3359 0.0000 0.0000 66.0873 31.0961 178.5619 100 D 4.3354 8.0621 117.1060 56.7210 39.2578 178.7851 101 R 3.9090 7.6631 118.9750 58.5133 29.9856 178.7848 102 A 4.0424 8.4300 121.1274 55.1880 18.3772 179.3322 103 E 2.5400 8.0232 117.4477 58.8523 29.6146 178.7899 104 A 3.9399 7.7891 120.7786 55.3241 18.4844 179.6770 105 L 4.0867 8.3575 117.8803 57.7893 41.7267 179.0628 106 Y 4.1521 8.3067 119.8274 60.8622 38.7618 177.6641 107 D 3.9094 8.3617 119.0996 57.1906 41.2573 177.5121 108 Y 3.9136 8.1109 120.2388 60.4957 38.8198 177.7181 109 F 3.9701 8.4160 121.6052 61.2752 39.4095 177.2076 110 V 3.5087 7.6093 117.6677 66.1783 31.4398 177.9340 111 E 3.8133 8.1149 118.2613 59.2813 29.2662 179.5900 112 R 3.6968 7.6622 118.2926 58.9771 29.6158 178.8340 113 C 3.8577 7.5798 116.6025 62.8250 27.8964 176.2020 114 R 4.1078 7.7241 118.3736 59.4926 29.6788 178.8346 115 Q 4.0546 7.6132 116.4345 58.7226 28.7303 178.3932 116 Q 4.3534 7.6931 117.6691 56.7259 29.3176 175.6785 117 E 4.4300 8.6577 123.2300 54.2607 29.8588 175.3748 118 M 4.1137 8.6498 127.0954 57.8159 32.7233 176.9121 119 N 5.0137 8.6529 117.2821 51.5388 38.0097 172.9116 120 T 5.1422 7.8019 115.5789 61.7176 71.5847 174.1495 121 Q 4.9288 9.3119 124.4191 54.4416 33.4160 174.0103 122 T 5.7030 7.6820 109.3381 60.0710 72.8511 172.3805 123 G 4.5356 8.0406 109.8996 45.5465 0.0000 173.1907 124 R 4.6817 8.3649 121.4448 53.9376 32.4220 175.3378 125 F 3.8463 9.3725 126.4853 59.0685 39.5008 174.8802 126 A 3.2357 7.6426 128.1669 52.2150 16.2778 177.1525 127 A 4.2527 7.4842 119.0331 51.1696 19.7494 177.7206 128 D 4.5237 8.3659 119.6279 53.9410 40.3735 175.2359 129 M 4.9291 8.2480 125.6608 53.5590 34.9186 175.6179 130 Q 4.4782 8.8812 121.6330 54.3706 31.1434 174.9555 131 V 4.6220 8.3958 125.3417 61.3917 32.6878 174.6151 132 S 4.8187 8.9549 124.6716 57.2558 63.8650 172.8353 133 L 4.8955 8.1365 125.1098 55.0409 43.5904 174.5210 134 V 4.2661 8.4753 119.0787 61.0380 34.0970 173.9044 135 N 4.9091 8.7831 127.9736 53.0424 39.5319 174.0376 136 D 4.2339 9.6269 128.3497 56.2405 40.8267 174.6709 137 G 3.9623 8.7160 121.4550 45.0603 0.0000 170.4848 138 P 4.4907 0.0000 0.0000 61.3559 32.9534 175.7886 139 V 4.3285 9.1360 118.8851 61.5192 34.4703 174.4424 140 T 5.2349 8.0507 123.5727 62.1377 72.2894 173.2916 141 F 5.0090 9.3650 124.3216 55.4097 43.5435 173.7287 142 W 4.9319 9.1311 132.3642 56.1041 31.7119 174.9891 143 L 4.8748 8.6091 127.9755 53.1368 44.0859 175.5304 144 Q 4.9041 8.4294 122.1407 54.7784 32.4675 174.2762 145 V 4.1313 8.3334 123.9619 63.1198 31.5384 175.0484 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 M 8.16 4.68 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.44 0.00 2 I 8.53 4.54 1.46 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 0.88 0.60 -0.66 0.00 0.00 3 A 8.90 4.72 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 4 L 8.61 4.84 0.00 1.51 1.48 0.94 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.80 5.03 1.96 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 1.52 0.75 0.92 0.00 0.00 6 Q 8.77 5.02 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.05 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 7 R 8.80 4.50 0.00 1.73 1.70 0.00 2.44 0.00 0.00 2.81 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.80 0.00 8 V 9.27 5.69 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 0.59 0.00 0.00 1.03 0.00 0.00 9 T 8.46 4.50 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 1.24 0.00 0.00 10 R 7.99 4.87 0.00 1.87 2.03 0.00 3.18 0.00 0.00 3.32 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.42 0.00 11 A 8.50 5.11 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 12 S 9.42 5.14 0.00 3.89 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 13 V 8.96 5.06 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 0.91 0.00 0.00 0.94 0.00 0.00 14 T 8.79 5.74 4.15 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 1.22 0.00 0.00 15 V 8.10 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 1.01 0.00 0.00 0.94 0.00 0.00 16 E 9.87 3.93 0.00 2.12 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 2.22 2.28 0.00 17 G 8.34 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 18 E 7.99 4.01 0.00 2.07 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 2.31 2.30 0.00 19 V 8.33 4.29 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 0.96 0.00 0.00 0.94 0.00 0.00 20 T 8.80 4.25 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 1.29 0.00 0.00 21 G 7.63 4.16 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 0.00 22 E 9.22 5.39 0.00 1.97 1.79 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 2.25 2.44 0.00 23 I 9.13 4.76 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 1.20 0.62 0.94 0.00 0.00 24 G 8.52 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 0.00 0.00 0.00 0.00 25 A 8.73 4.48 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.30 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 27 L 8.86 5.36 0.00 1.70 1.65 1.12 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.87 4.88 0.00 1.80 1.56 0.99 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 29 V 9.14 4.58 2.19 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 0.92 0.00 0.00 1.05 0.00 0.00 30 L 8.71 4.89 0.00 1.68 1.50 0.89 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 31 L 8.95 4.81 0.00 1.56 1.54 -0.12 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.89 4.38 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 33 V 8.54 4.64 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 0.92 0.00 0.00 1.10 0.00 0.00 34 E 10.05 4.71 0.00 2.18 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 2.31 2.25 0.00 35 K 8.47 3.82 0.00 2.01 1.90 0.00 1.82 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.47 7.81 36 D 7.95 4.81 0.00 2.73 2.67 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 0.00 37 D 7.86 4.65 0.00 2.81 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.94 4.56 0.00 2.75 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 39 E 8.54 3.56 0.00 1.75 1.41 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 1.47 1.95 0.00 40 Q 8.02 4.04 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 41 K 8.95 4.04 0.00 1.92 1.90 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.64 7.81 42 A 8.13 4.19 1.69 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 0.00 0.00 43 N 8.54 4.31 0.00 3.02 2.90 0.00 0.00 7.28 7.18 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 44 R 8.19 4.21 0.00 2.10 2.00 0.00 3.22 0.00 0.00 3.22 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 45 L 8.35 4.04 0.00 1.89 2.04 0.88 0.90 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 46 C 8.39 4.03 0.00 2.50 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 47 E 8.39 3.94 0.00 2.23 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 2.31 2.62 0.00 48 R 8.01 4.09 0.00 2.02 1.96 0.00 3.16 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.93 0.00 49 V 7.90 3.62 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 0.96 0.00 0.00 1.07 0.00 0.00 50 L 8.23 4.32 0.00 1.64 1.70 0.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 51 G 7.55 4.14 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 0.00 0.00 0.00 52 Y 7.68 4.09 0.00 3.20 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 53 R 7.85 4.79 0.00 1.64 1.71 0.00 3.15 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 54 I 7.79 4.44 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.33 0.49 0.00 0.00 55 F 8.48 4.60 0.00 3.36 3.05 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 56 S 8.59 4.81 0.00 3.91 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 57 D 8.73 4.77 0.00 2.90 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 58 A 8.58 4.05 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 59 E 8.51 4.25 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 60 G 8.29 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 61 K 7.83 4.45 0.00 2.00 1.73 0.00 1.67 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.45 7.81 62 M 8.42 4.64 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.74 0.00 63 N 8.56 5.00 0.00 2.77 2.77 0.00 0.00 6.96 7.85 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 64 L 8.14 5.00 0.00 1.79 1.53 0.93 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 65 N 9.20 5.98 0.00 3.20 3.10 0.00 0.00 6.61 7.63 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 66 V 8.30 2.51 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 1.01 0.00 0.00 0.80 0.00 0.00 67 Q 7.98 3.88 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.94 0.00 0.00 0.00 0.00 0.00 2.63 2.40 0.00 68 Q 8.59 4.00 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.95 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 69 A 7.57 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.64 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 0.00 0.00 0.00 71 G 7.82 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 72 S 8.66 5.08 0.00 3.78 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 73 V 8.63 4.83 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 1.07 0.00 0.00 0.97 0.00 0.00 74 L 9.08 5.16 0.00 1.82 1.55 1.02 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 75 V 8.89 4.89 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 1.08 0.00 0.00 1.15 0.00 0.00 76 V 8.99 4.97 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 1.00 0.00 0.00 0.98 0.00 0.00 77 S 8.46 4.43 0.00 3.61 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 9.31 4.53 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 79 F 8.60 4.40 0.00 3.25 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 80 T 6.99 4.34 4.22 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 0.64 0.00 0.00 81 L 7.54 4.06 0.00 1.51 1.56 0.71 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 82 A 7.60 4.53 1.41 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 0.00 0.00 83 A 7.72 4.14 1.05 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 0.00 0.00 84 D 9.01 4.61 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.20 4.54 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 1.15 0.00 0.00 86 E 8.14 4.04 0.00 1.94 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 0.00 2.31 2.43 0.00 87 R 7.51 4.55 0.00 1.77 1.62 0.00 3.26 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.19 0.00 88 G 8.78 4.07 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 0.00 0.00 0.00 89 M 8.21 4.35 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 90 R 7.54 4.56 0.00 1.74 1.83 0.00 3.22 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 91 P 0.00 4.27 0.00 1.47 1.88 0.00 3.74 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 92 S 8.34 4.44 0.00 3.77 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 93 F 8.56 4.97 0.00 3.11 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 94 S 7.93 4.80 0.00 3.97 3.94 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 95 K 8.16 4.51 0.00 1.66 1.78 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 0.96 7.81 96 G 7.98 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.10 4.53 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 98 S 8.23 4.35 0.00 4.11 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 99 P 0.00 4.34 0.00 2.20 2.22 0.00 3.61 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 2.11 2.15 0.00 100 D 8.06 4.34 0.00 2.85 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 0.00 101 R 7.66 3.91 0.00 2.15 2.01 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 102 A 8.43 4.04 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.02 2.54 0.00 1.16 1.72 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 2.02 1.61 0.00 104 A 7.79 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 8.36 4.09 0.00 1.80 1.79 0.94 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 8.31 4.15 0.00 3.17 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 0.00 107 D 8.36 3.91 0.00 2.82 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 0.00 108 Y 8.11 3.91 0.00 3.26 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 0.00 109 F 8.42 3.97 0.00 3.24 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 0.00 110 V 7.61 3.51 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.58 0.00 0.00 111 E 8.11 3.81 0.00 1.72 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 0.00 2.55 2.40 0.00 112 R 7.66 3.70 0.00 1.52 1.79 0.00 2.80 0.00 0.00 2.52 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.49 0.00 113 C 7.58 3.86 0.00 2.97 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 0.00 114 R 7.72 4.11 0.00 1.84 1.93 0.00 3.26 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 115 Q 7.61 4.05 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 116 Q 7.69 4.35 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.78 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 117 E 8.66 4.43 0.00 1.63 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 2.19 2.30 0.00 118 M 8.65 4.11 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.49 0.00 119 N 8.65 5.01 0.00 2.73 2.71 0.00 0.00 6.64 6.85 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 0.00 120 T 7.80 5.14 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 1.20 0.00 0.00 121 Q 9.31 4.93 0.00 1.92 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.57 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 122 T 7.68 5.70 4.44 0.00 0.00 0.00 0.00 0.00 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 0.00 123 G 8.04 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 0.00 0.00 0.00 0.00 124 R 8.36 4.68 0.00 1.84 1.77 0.00 3.23 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 125 F 9.37 3.85 0.00 3.04 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 0.00 126 A 7.64 3.24 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.48 4.25 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 0.00 128 D 8.37 4.52 0.00 2.62 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 M 8.25 4.93 0.00 1.90 1.91 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 130 Q 8.88 4.48 0.00 1.94 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 131 V 8.40 4.62 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 0.77 0.00 0.00 0.92 0.00 0.00 132 S 8.95 4.82 0.00 3.93 3.70 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 0.00 133 L 8.14 4.90 0.00 1.77 1.60 0.93 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.48 4.27 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 0.94 0.00 0.00 135 N 8.78 4.91 0.00 2.77 2.71 0.00 0.00 7.15 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 0.00 136 D 9.63 4.23 0.00 2.71 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 0.00 137 G 8.72 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 0.00 0.00 0.00 138 P 0.00 4.49 0.00 2.15 2.04 0.00 3.68 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.92 0.00 139 V 9.14 4.33 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 1.08 0.00 0.00 0.90 0.00 0.00 140 T 8.05 5.23 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 1.26 0.00 0.00 141 F 9.37 5.01 0.00 3.01 2.89 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 0.00 142 W 9.13 4.93 0.00 3.49 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 0.00 143 L 8.61 4.87 0.00 1.49 1.34 0.48 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 144 Q 8.43 4.90 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.58 0.00 145 V 8.33 4.13 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 0.83 0.00 0.00 0.99 0.00 0.00