NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3413 0.0000 0.0000 61.8321 32.6107 175.8814 3 K 3.8451 8.7273 121.0199 55.9574 32.5152 175.0641 4 K 4.0108 9.4334 127.5336 56.9578 33.8330 175.1271 5 V 4.9252 8.3991 126.1020 61.1533 33.5154 174.4010 6 L 4.8556 8.9153 127.3015 53.1271 45.5259 175.4228 7 T 4.8026 8.1086 116.9951 62.2700 71.7056 173.7782 8 G 4.0470 8.4190 110.9859 45.9246 0.0000 171.6646 9 V 4.8836 8.0166 118.8785 60.8511 34.9447 175.6932 10 V 4.1859 8.6038 126.8084 62.5515 32.1758 176.3809 11 V 4.2123 8.4855 120.6173 60.7432 32.7863 175.7175 12 S 4.4114 7.4420 113.5879 57.6115 65.5403 174.7067 13 D 5.0595 8.5760 124.7738 53.9709 41.7210 176.7800 14 K 4.2930 7.7269 113.6377 57.9348 31.7369 175.9893 15 M 4.8094 7.5026 118.3399 53.2179 35.2348 174.8046 16 Q 4.2954 8.4587 118.6073 56.1120 29.7363 176.5424 17 K 4.9149 8.7166 121.0086 56.2043 29.9840 174.4267 18 T 5.2555 7.4227 113.0874 62.4974 72.8521 173.9168 19 V 4.6841 8.9587 118.6142 59.8752 36.1681 174.9415 20 T 4.8083 8.7256 120.6870 62.4793 69.8635 173.8580 21 V 4.5173 9.1579 128.4026 61.2006 33.7474 174.4037 22 L 4.6201 9.1376 131.2070 53.8015 43.1422 174.8279 23 V 4.5300 8.9032 128.2153 61.5759 32.9637 174.3479 24 E 4.8283 8.7477 128.8219 55.0456 31.3833 174.8037 25 R 4.7297 9.0491 125.3735 54.9044 33.9840 174.1982 26 Q 4.7121 8.6921 124.7223 54.3974 29.7830 173.3242 27 F 5.0931 8.1142 120.2525 54.0105 41.7164 172.4910 28 P 5.2169 0.0000 0.0000 61.2598 32.9817 175.1070 29 H 4.4362 9.6007 124.8184 55.7899 30.1399 174.3311 30 P 4.3111 0.0000 0.0000 64.9426 31.1710 176.6145 31 L 4.5153 7.9799 118.2004 55.3200 43.9407 176.0533 32 Y 4.8245 7.9952 113.1351 57.1633 38.6536 175.9879 33 G 4.3468 7.9766 114.3960 46.3216 0.0000 174.2480 34 K 4.0162 7.5834 120.3530 54.8971 33.5950 174.9557 35 V 4.4010 8.3435 127.1789 62.3364 32.1432 175.0159 36 I 4.5399 8.7853 121.6981 58.8702 40.5785 175.3380 37 K 4.2844 8.5156 124.2693 56.4479 33.5008 176.2212 38 R 4.4749 8.1319 117.4165 55.9118 34.2429 173.7390 39 S 5.2814 8.6093 120.4551 56.9123 66.5436 172.6505 40 K 4.4213 8.5685 117.7176 55.5954 35.6857 174.1373 41 K 5.0630 8.4939 125.8150 55.1801 34.2654 175.3224 42 Y 4.6391 9.2891 121.4790 56.1230 41.6684 174.5804 43 L 4.7986 8.8026 123.8841 54.0323 42.6586 175.8603 44 A 5.1020 9.1538 126.4826 50.0058 22.1444 174.9183 45 H 4.6147 9.5557 122.4334 56.5137 31.1944 173.8694 46 D 5.0073 9.1914 125.8492 51.1811 41.2594 173.6654 47 P 4.2060 0.0000 0.0000 64.5233 31.7226 177.0473 48 E 4.5838 7.9416 116.2008 58.0546 30.2628 175.6349 49 E 3.9962 8.3306 114.2574 57.2505 27.2547 177.1127 50 K 3.8775 8.3001 123.1907 58.6056 32.6986 176.0602 51 Y 4.5594 8.0849 116.2764 56.1573 39.5247 175.1160 52 K 4.6306 9.1667 123.4860 53.8076 34.8583 175.5692 53 L 4.0961 8.3454 122.5569 56.7880 42.2355 176.1182 54 G 4.1803 8.6139 114.7746 46.0606 0.0000 174.0753 55 D 4.6158 8.1223 118.7722 54.3401 42.5487 175.7871 56 V 4.7268 8.5490 120.5309 61.4044 33.9822 175.0090 57 V 4.8744 8.4107 120.0123 59.5029 36.1449 174.3504 58 E 4.8418 8.7821 121.2840 55.5918 31.3986 175.7693 59 I 4.8556 9.3527 123.9088 59.4426 41.1841 174.3108 60 I 5.0612 8.7789 125.4703 58.7335 41.1433 174.1753 61 E 3.2066 9.1716 130.8925 56.8998 29.8435 175.9781 62 S 4.7394 8.0030 121.6090 56.1906 67.5289 173.7171 63 R 3.9495 8.4406 120.9726 55.3844 30.3921 174.1337 64 P 4.2806 0.0000 0.0000 63.3948 31.8472 176.0393 65 I 4.4353 7.7804 119.8840 61.1704 39.3662 175.3369 66 S 4.5097 7.4686 111.9533 57.0657 64.7616 175.4177 67 K 3.9082 8.7494 122.4177 57.9043 32.4169 176.6446 68 R 3.6660 8.4539 117.6195 55.0491 27.7945 175.1041 69 K 5.3586 6.6923 129.6393 57.4506 33.7441 174.2574 70 R 4.8554 7.5446 128.0894 54.7664 31.4577 174.6406 71 F 5.3568 8.2544 115.2416 56.1989 44.0126 174.2641 72 R 4.9986 8.7778 120.2284 54.0759 33.9864 175.2870 73 V 3.8014 8.0241 123.0087 62.9927 31.1684 175.6325 74 L 4.2414 8.7185 131.7347 57.3778 42.4155 176.6615 75 R 4.5677 7.4209 112.2674 55.8588 32.6396 171.9905 76 L 4.5187 8.5973 121.3240 54.0223 42.6109 175.7833 77 V 4.0422 9.1236 129.3123 64.3392 31.3978 175.1799 78 E 4.7790 7.7616 116.7548 54.6305 33.2158 174.1496 79 S 4.9046 8.8849 116.6466 57.4055 64.1483 170.2652 80 G 3.8651 8.5958 119.5369 43.9812 0.0000 173.4589 81 R 4.9579 7.9337 130.4775 56.3126 28.2899 174.5343 82 M 4.2343 7.7720 127.4937 58.3146 32.3567 177.0965 83 D 4.4566 8.2283 119.5497 56.7700 39.1355 179.1940 84 L 3.9638 7.6391 118.5593 57.5944 41.6944 179.3356 85 V 3.6366 7.7558 117.6324 66.2737 31.2606 177.3067 86 E 4.2844 9.8279 118.2692 59.1269 29.3285 178.8975 87 K 3.8525 8.1888 119.3386 60.0507 32.2749 177.9094 88 Y 3.9572 8.1183 119.2227 60.8370 38.8034 177.5880 89 L 3.7804 9.0603 121.0121 58.1206 41.7632 179.9682 90 I 3.6298 8.0416 119.6990 64.3739 36.8979 178.2420 91 R 3.9017 7.5039 118.2153 59.5468 29.9764 178.1653 92 R 3.0457 7.4680 118.3622 58.9268 30.0127 178.2512 93 Q 3.9353 7.9036 119.4687 59.0844 29.1643 177.7668 94 N 4.5376 8.7525 117.4577 55.7913 38.3206 176.5051 95 Y 4.3532 7.7792 117.0443 60.0873 37.9044 177.5906 96 Q 4.2069 7.9307 119.2492 60.0558 29.6201 177.5908 97 S 4.9815 8.0316 114.1221 58.7091 64.1025 170.7012 98 L 3.4764 8.3800 125.5517 56.1068 39.5482 174.9273 99 S 4.8587 8.4208 126.3905 58.7464 62.8310 179.1001 100 K 4.5831 9.0523 111.7186 56.3373 34.0723 176.2763 101 R 4.6297 7.5465 117.6119 56.0242 35.4762 174.8336 102 G 3.7592 8.9130 113.3580 46.1241 0.0000 176.8501 103 G 3.9237 8.0852 110.9895 45.1634 0.0000 171.8143 104 K 4.3483 8.0607 123.0790 54.2233 34.0827 176.9584 105 A 4.1830 8.6369 128.2806 52.5062 18.3158 176.7610 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 2 P 0.00 4.34 0.00 2.19 2.12 0.00 3.75 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 1.88 1.99 0.00 3 K 8.73 3.85 0.00 1.73 1.80 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.47 7.81 4 K 9.43 4.01 0.00 1.94 1.78 0.00 1.45 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.54 7.81 5 V 8.40 4.93 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 0.90 0.00 0.00 1.00 0.00 0.00 6 L 8.92 4.86 0.00 1.03 1.16 0.16 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 7 T 8.11 4.80 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 1.22 0.00 0.00 8 G 8.42 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 0.00 0.00 0.00 9 V 8.02 4.88 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 0.90 0.00 0.00 10 V 8.60 4.19 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 0.90 0.00 0.00 0.94 0.00 0.00 11 V 8.49 4.21 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.35 0.00 0.00 12 S 7.44 4.41 0.00 3.85 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 13 D 8.58 5.06 0.00 2.72 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 7.73 4.29 0.00 1.85 1.85 0.00 1.60 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.50 1.47 7.81 15 M 7.50 4.81 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.48 0.00 16 Q 8.46 4.30 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.34 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 17 K 8.72 4.91 0.00 1.99 1.85 0.00 1.99 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.58 1.42 7.81 18 T 7.42 5.26 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 19 V 8.96 4.68 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 0.81 0.00 0.00 0.97 0.00 0.00 20 T 8.73 4.81 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 21 V 9.16 4.52 2.02 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 0.82 0.00 0.00 0.83 0.00 0.00 22 L 9.14 4.62 0.00 1.50 1.39 0.94 0.85 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 23 V 8.90 4.53 2.23 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 0.83 0.00 0.00 0.76 0.00 0.00 24 E 8.75 4.83 0.00 2.02 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 2.24 2.31 0.00 25 R 9.05 4.73 0.00 1.97 2.03 0.00 3.18 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.66 0.00 26 Q 8.69 4.71 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.56 0.00 0.00 0.00 0.00 0.00 2.17 2.28 0.00 27 F 8.11 5.09 0.00 3.24 3.21 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 28 P 0.00 5.22 0.00 2.17 2.15 0.00 4.03 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 29 H 9.60 4.44 0.00 3.33 3.30 0.00 5.60 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.31 0.00 2.14 2.12 0.00 3.39 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.81 0.00 31 L 7.98 4.52 0.00 1.39 1.18 0.94 0.72 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 32 Y 8.00 4.82 0.00 2.76 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 33 G 7.98 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 0.00 0.00 0.00 0.00 34 K 7.58 4.02 0.00 1.89 1.75 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.50 7.81 35 V 8.34 4.40 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 0.84 0.00 0.00 0.93 0.00 0.00 36 I 8.79 4.54 1.68 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 0.70 -0.34 0.93 0.00 0.00 37 K 8.52 4.28 0.00 1.62 1.76 0.00 1.84 0.00 0.00 1.68 0.00 0.00 2.74 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.38 7.81 38 R 8.13 4.47 0.00 1.99 1.93 0.00 3.36 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 39 S 8.61 5.28 0.00 3.92 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 40 K 8.57 4.42 0.00 1.83 1.70 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.47 1.07 7.81 41 K 8.49 5.06 0.00 1.59 1.63 0.00 1.70 0.00 0.00 1.81 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.26 1.44 7.81 42 Y 9.29 4.64 0.00 2.65 2.64 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 43 L 8.80 4.80 0.00 1.60 1.67 1.01 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 44 A 9.15 5.10 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 45 H 9.56 4.61 0.00 3.26 3.26 0.00 5.72 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 D 9.19 5.01 0.00 2.79 2.53 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 47 P 0.00 4.21 0.00 2.08 2.13 0.00 3.69 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 2.06 1.90 0.00 48 E 7.94 4.58 0.00 1.86 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 2.18 2.27 0.00 49 E 8.33 4.00 0.00 2.02 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 0.00 2.26 2.23 0.00 50 K 8.30 3.88 0.00 1.50 1.65 0.00 1.54 0.00 0.00 1.28 0.00 0.00 2.93 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.30 1.05 7.81 51 Y 8.08 4.56 0.00 3.02 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 52 K 9.17 4.63 0.00 1.90 1.70 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.38 7.81 53 L 8.35 4.10 0.00 1.59 1.61 0.99 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 54 G 8.61 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 55 D 8.12 4.62 0.00 2.73 2.69 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 56 V 8.55 4.73 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 0.98 0.00 0.00 0.92 0.00 0.00 57 V 8.41 4.87 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 0.45 0.00 0.00 0.72 0.00 0.00 58 E 8.78 4.84 0.00 1.86 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 2.24 2.25 0.00 59 I 9.35 4.86 1.61 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.68 0.40 0.00 0.00 60 I 8.78 5.06 1.90 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 1.13 1.77 0.93 0.00 0.00 61 E 9.17 3.21 0.00 2.00 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 0.00 2.08 1.89 0.00 62 S 8.00 4.74 0.00 3.64 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 63 R 8.44 3.95 0.00 1.73 1.78 0.00 3.24 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 64 P 0.00 4.28 0.00 2.05 1.99 0.00 3.63 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 65 I 7.78 4.44 1.95 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 1.27 0.74 0.76 0.00 0.00 66 S 7.47 4.51 0.00 3.92 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.75 3.91 0.00 1.74 1.77 0.00 1.93 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.44 7.81 68 R 8.45 3.67 0.00 2.06 1.98 0.00 3.21 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 69 K 6.69 5.36 0.00 1.89 1.78 0.00 1.71 0.00 0.00 1.86 0.00 0.00 3.21 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.45 7.81 70 R 7.54 4.86 0.00 1.71 1.61 0.00 3.23 0.00 0.00 3.38 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 71 F 8.25 5.36 0.00 2.94 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 72 R 8.78 5.00 0.00 1.78 1.83 0.00 3.18 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 73 V 8.02 3.80 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 -0.51 0.00 0.00 0.71 0.00 0.00 74 L 8.72 4.24 0.00 1.67 1.65 0.97 0.96 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 75 R 7.42 4.57 0.00 1.92 2.03 0.00 3.02 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.56 0.00 76 L 8.60 4.52 0.00 1.99 1.72 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 77 V 9.12 4.04 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 0.81 0.00 0.00 0.91 0.00 0.00 78 E 7.76 4.78 0.00 2.02 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 2.24 2.28 0.00 79 S 8.88 4.90 0.00 3.86 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 80 G 8.60 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 81 R 7.93 4.96 0.00 2.34 2.22 0.00 3.34 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.37 0.00 82 M 7.77 4.23 0.00 2.06 2.16 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 83 D 8.23 4.46 0.00 2.86 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 84 L 7.64 3.96 0.00 1.75 1.74 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.76 3.64 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 1.10 0.00 0.00 0.98 0.00 0.00 86 E 9.83 4.28 0.00 2.23 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 2.43 2.48 0.00 87 K 8.19 3.85 0.00 1.95 2.06 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.51 7.81 88 Y 8.12 3.96 0.00 3.09 3.19 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 89 L 9.06 3.78 0.00 1.74 1.71 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.04 3.63 1.96 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.82 0.89 0.00 0.00 91 R 7.50 3.90 0.00 1.89 1.79 0.00 3.13 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 92 R 7.47 3.05 0.00 1.31 1.64 0.00 2.63 0.00 0.00 2.91 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.13 0.00 93 Q 7.90 3.94 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.54 2.36 0.00 94 N 8.75 4.54 0.00 2.96 2.95 0.00 0.00 6.96 7.38 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 95 Y 7.78 4.35 0.00 2.98 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 96 Q 7.93 4.21 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.63 0.00 97 S 8.03 4.98 0.00 4.00 3.90 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 98 L 8.38 3.48 0.00 1.69 1.64 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 99 S 8.42 4.86 0.00 3.98 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 0.00 100 K 9.05 4.58 0.00 1.82 1.84 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.45 7.81 101 R 7.55 4.63 0.00 1.77 1.87 0.00 3.37 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 102 G 8.91 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.09 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 0.00 0.00 0.00 104 K 8.06 4.35 0.00 1.68 1.83 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.34 7.81 105 A 8.64 4.18 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