NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 N 4.6891 8.4093 118.2162 51.6219 39.8388 174.1333 8 S 4.4959 7.4945 115.5355 54.5733 65.2814 171.9134 9 P 4.3446 0.0000 0.0000 62.3870 32.6441 177.5844 10 V 3.9032 8.0279 121.0767 62.2087 32.1074 175.6485 11 R 4.5177 8.5180 126.9561 55.6852 31.2905 175.5289 12 F 5.5357 8.4519 117.5963 55.0604 41.7655 174.0483 13 V 4.3607 9.2120 119.0937 61.0427 34.7445 174.5278 14 K 4.6166 8.6712 127.1077 55.5576 31.8957 176.5571 15 E 4.3233 9.5210 127.2178 58.8427 30.0459 177.1187 16 T 4.7680 7.7313 107.9620 59.3894 72.1222 173.8819 17 N 4.5497 8.6463 117.6097 54.5885 37.3531 176.1263 18 R 3.9962 7.6894 117.5200 57.9435 30.6105 177.0415 19 A 4.4178 7.3617 119.9799 51.3759 18.9246 176.7680 20 K 4.5901 8.2720 119.7673 54.0348 35.0670 176.6813 21 S 4.0111 8.8054 119.1531 58.3992 63.2497 172.5365 22 P 5.2025 0.0000 0.0000 62.5437 31.6809 175.8190 23 T 4.8214 8.6993 113.9102 59.9226 72.2383 172.8100 24 R 4.4738 8.3052 122.7719 55.0743 30.7035 176.9426 25 Q 4.1149 8.7180 123.2083 58.6027 29.3945 176.2928 26 S 4.6366 7.3998 110.3252 56.0693 65.6076 173.1936 27 P 4.2973 0.0000 0.0000 64.8321 31.1218 177.2002 28 G 3.9312 7.3939 106.5610 45.0430 0.0000 173.2896 29 A 4.2042 7.6397 122.8727 51.0655 19.3007 178.4953 30 A 4.0755 8.7190 125.4913 54.3671 18.7129 177.4030 31 G 4.3539 7.7008 99.9426 44.6695 0.0000 171.6847 32 Y 4.8251 8.9247 117.6142 55.7258 40.4387 175.6831 33 D 4.5157 9.3298 125.0444 54.9912 42.1028 175.4736 34 L 4.8655 8.5291 123.2935 53.1240 44.0671 175.1123 35 Y 5.2804 8.3233 119.9026 55.8800 41.8264 174.9448 36 S 4.5129 9.2682 118.3745 58.7193 63.3217 174.2572 37 A 4.4450 9.0660 127.8513 52.5754 19.5074 175.6555 38 Y 4.7178 7.8101 111.8812 56.5308 42.8869 173.9180 39 D 5.1034 8.4056 119.8238 53.3617 42.3974 176.1118 40 Y 4.9826 9.4224 120.2712 56.5454 42.8878 174.2891 41 T 4.8834 8.7099 117.4281 61.9072 71.7513 173.4595 42 I 4.4937 8.9176 127.8573 58.8327 39.3850 173.8276 43 P 4.7518 0.0000 0.0000 61.3955 32.7426 174.6051 44 P 4.2002 0.0000 0.0000 64.1570 31.7048 177.1413 45 G 3.9225 8.9424 109.9183 45.7492 0.0000 172.7199 46 E 4.9839 7.8321 118.6996 54.1379 33.5104 174.9630 47 R 5.1942 8.4514 116.5574 54.6490 33.0270 174.5996 48 Q 4.4257 8.8362 120.6901 54.2172 32.8045 173.5288 49 L 4.4659 8.6411 128.6327 55.2155 42.8254 175.7373 50 I 3.8285 8.8243 129.1504 59.5950 38.9854 175.4436 51 K 4.7395 9.1100 127.7935 56.5509 32.6968 177.9287 52 T 4.3533 8.6958 114.3153 60.3691 70.8464 175.8165 53 D 4.6587 8.3288 120.0858 55.0274 39.3769 172.1917 54 I 5.2168 7.7522 120.4896 59.6151 39.6288 174.9493 55 S 5.3847 8.9355 121.1305 56.8736 66.1963 172.8313 56 M 5.3598 8.4409 117.5014 53.9474 34.4680 174.7830 57 S 4.5858 8.8145 116.5104 57.3565 63.3833 174.1058 58 M 4.4003 8.5892 125.0213 54.2245 32.5634 174.9713 59 P 4.5194 0.0000 0.0000 62.2151 32.3956 176.4114 60 K 4.4602 8.2790 118.2701 56.9478 33.0562 176.8347 61 F 3.7912 8.2185 118.7191 58.2369 36.9927 174.6553 62 C 5.4017 7.8384 114.3432 58.8299 32.5467 173.8347 63 Y 4.9726 8.9237 118.6498 55.2427 41.8323 174.4385 64 G 3.8499 8.8393 108.4379 45.1265 0.0000 172.7465 65 R 4.7863 8.5580 128.0433 55.1484 31.4212 175.5234 66 I 4.3036 8.6972 128.7952 61.3323 37.2580 175.3475 67 A 4.9135 8.9808 130.0411 49.1198 21.9652 173.9347 68 P 4.6844 0.0000 0.0000 62.3851 32.8766 176.5299 69 R 4.1449 8.3587 120.1307 55.8952 31.2856 177.7496 70 S 4.1313 8.8206 116.0383 61.6153 62.0144 176.7603 71 G 3.6915 8.0728 107.8545 48.0172 0.0000 175.4095 72 L 4.0202 7.8255 120.8779 57.4816 41.7629 179.4998 73 S 4.4747 7.8134 116.0930 61.1200 62.5370 176.8044 74 L 4.0744 7.7726 120.5486 57.2123 41.4352 178.9113 75 K 4.2655 7.3953 115.9917 56.7750 32.5306 177.7034 76 G 3.9355 7.7721 107.7187 44.8277 0.0000 172.7258 77 I 4.4942 8.2381 122.2008 60.2647 38.2729 174.9765 78 D 5.0556 8.7663 126.6610 52.4987 44.6584 175.0139 79 I 4.8094 8.1978 119.9864 59.7192 39.1892 176.0464 80 G 3.9604 8.9308 114.4783 43.9908 0.0000 177.1545 81 G 3.7150 9.9470 110.4625 46.1143 0.0000 175.1156 82 G 3.9155 9.0073 113.6869 44.5972 0.0000 172.3043 83 V 4.5449 7.5201 119.8580 61.6608 32.2709 175.5670 84 I 4.2229 8.7170 131.2514 59.6226 38.1256 175.5337 85 D 4.8365 8.5255 127.4429 53.9557 41.6433 177.4529 86 E 4.0046 9.2577 122.3366 59.2725 29.7476 177.9250 87 D 4.8395 7.9835 115.1424 53.0740 39.8472 175.2390 88 Y 4.3504 7.9115 122.3576 57.9989 38.9425 175.3125 89 R 4.2836 8.1020 124.4763 55.7421 31.3148 175.9449 90 G 3.6218 5.3974 107.5118 43.5832 0.0000 172.5121 91 N 4.6325 8.5075 118.2290 53.8013 39.4710 174.9230 92 I 4.2001 9.3281 128.5301 61.2506 38.1675 175.2976 93 G 4.3396 8.7896 114.1038 44.3154 0.0000 172.3886 94 V 4.4022 8.7250 122.0438 60.8177 34.4186 174.6842 95 I 4.4655 8.3428 129.2844 60.4667 37.9962 174.4630 96 L 4.7498 8.6356 128.5402 53.5367 43.4969 175.9619 97 I 4.5406 8.5821 125.3917 59.6713 39.5205 174.6349 98 N 4.7926 9.2468 127.7145 52.6720 38.6250 174.0970 99 N 4.9765 8.7172 121.3306 52.7202 39.5916 175.5672 100 G 3.9179 7.9782 109.2501 44.7898 0.0000 174.2165 101 K 4.2220 8.4023 117.1426 57.3878 32.5691 176.5065 102 C 5.0431 7.5777 114.5909 57.3938 31.8379 173.8308 103 T 4.2061 8.5273 116.9749 63.9919 68.9302 173.7558 104 F 4.8547 9.5343 128.8700 56.6711 41.3687 173.9165 105 N 5.0789 8.1634 123.7724 52.0219 40.1574 174.5595 106 V 4.2469 8.9101 123.5917 61.2716 34.0501 174.2200 107 N 5.3914 8.8153 125.0566 51.5151 41.2864 174.9400 108 T 4.1285 8.4503 118.4967 65.6790 68.8611 174.9258 109 G 4.0109 9.3185 115.6394 45.0555 0.0000 173.5443 110 D 4.7272 8.0336 120.8108 54.3367 42.0135 175.7493 111 R 4.6544 8.7251 120.1187 55.7954 29.9329 175.9935 112 I 4.5314 8.3375 116.3571 61.1491 40.0908 174.6204 113 A 4.5602 7.2358 122.8611 51.4169 22.7837 174.5135 114 Q 4.8048 8.8266 116.5985 54.4528 32.1373 174.3497 115 L 4.7444 9.1362 125.2606 54.0634 43.7916 174.9306 116 I 4.5890 8.2966 127.6350 59.8236 39.5946 174.7843 117 Y 4.6316 8.6588 125.4438 57.2974 37.5887 173.8690 118 Q 4.3610 8.6195 124.1338 54.4267 30.5062 175.4507 119 R 4.7379 8.5479 124.0032 56.0890 30.8858 175.7880 120 I 4.6352 8.2108 116.0062 59.5348 41.2581 173.8875 121 Y 4.9797 8.3494 119.0994 56.6915 40.5668 175.9599 122 Y 5.0843 8.3208 119.4032 55.9431 37.9582 173.6938 123 P 4.5605 0.0000 0.0000 61.8694 32.9893 176.5670 124 E 4.2176 8.4748 120.1560 55.7541 30.3162 175.6498 125 L 4.5893 8.3291 125.4460 53.1078 43.2347 175.4632 126 E 4.5304 8.5351 123.5587 54.0462 31.8744 174.4900 127 E 4.1971 8.8190 127.3867 55.6187 29.9952 175.7120 128 V 4.4906 8.0889 118.6499 59.6201 34.7633 175.5564 129 Q 4.2683 8.4597 118.9291 57.8889 29.1825 176.4563 130 S 4.6280 7.6219 109.4675 56.7869 65.5645 173.4218 131 L 4.3055 8.3895 123.7184 54.9253 41.6369 176.5805 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 7 N 8.41 4.69 0.00 2.85 2.91 0.00 0.00 6.02 6.76 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 8 S 7.49 4.50 0.00 4.07 3.89 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 9 P 0.00 4.34 0.00 2.07 2.04 0.00 3.66 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 2.03 2.07 0.00 10 V 8.03 3.90 1.89 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 0.90 0.00 0.00 0.64 0.00 0.00 11 R 8.52 4.52 0.00 1.82 1.80 0.00 3.11 0.00 0.00 3.37 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 12 F 8.45 5.54 0.00 3.17 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 13 V 9.21 4.36 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 0.97 0.00 0.00 0.90 0.00 0.00 14 K 8.67 4.62 0.00 1.72 2.02 0.00 1.86 0.00 0.00 1.94 0.00 0.00 3.09 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.60 1.64 7.81 15 E 9.52 4.32 0.00 1.92 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 2.53 2.47 0.00 16 T 7.73 4.77 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 1.38 0.00 0.00 17 N 8.65 4.55 0.00 2.82 2.99 0.00 0.00 6.02 7.66 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 18 R 7.69 4.00 0.00 1.60 1.82 0.00 3.15 0.00 0.00 2.84 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.49 0.00 19 A 7.36 4.42 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 20 K 8.27 4.59 0.00 1.54 1.24 0.00 1.49 0.00 0.00 1.15 0.00 0.00 2.13 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.09 1.25 7.81 21 S 8.81 4.01 0.00 3.94 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 22 P 0.00 5.20 0.00 1.86 1.99 0.00 2.64 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 1.67 1.79 0.00 23 T 8.70 4.82 4.30 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 1.31 0.00 0.00 24 R 8.31 4.47 0.00 1.37 1.63 0.00 2.22 0.00 0.00 2.77 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.50 0.00 25 Q 8.72 4.11 0.00 1.99 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 26 S 7.40 4.64 0.00 3.92 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 27 P 0.00 4.30 0.00 2.18 2.21 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 28 G 7.39 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 0.00 0.00 0.00 29 A 7.64 4.20 1.22 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 0.00 0.00 30 A 8.72 4.08 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 31 G 7.70 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 32 Y 8.92 4.83 0.00 2.82 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 33 D 9.33 4.52 0.00 2.34 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 0.00 0.00 0.00 34 L 8.53 4.87 0.00 1.46 1.50 0.86 0.63 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 35 Y 8.32 5.28 0.00 2.93 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 36 S 9.27 4.51 0.00 4.04 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 37 A 9.07 4.45 1.11 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 0.00 0.00 38 Y 7.81 4.72 0.00 2.62 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 39 D 8.41 5.10 0.00 2.47 2.54 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 40 Y 9.42 4.98 0.00 2.88 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 41 T 8.71 4.88 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 1.25 0.00 0.00 42 I 8.92 4.49 2.06 0.00 0.00 1.00 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 0.83 0.96 0.00 0.00 43 P 0.00 4.75 0.00 2.10 1.99 0.00 3.64 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 2.14 2.15 0.00 44 P 0.00 4.20 0.00 2.05 2.19 0.00 3.77 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 2.07 2.18 0.00 45 G 8.94 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 46 E 7.83 4.98 0.00 1.96 1.83 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 2.40 2.37 0.00 47 R 8.45 5.19 0.00 1.82 1.83 0.00 2.97 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 48 Q 8.84 4.43 0.00 2.11 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.02 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 49 L 8.64 4.47 0.00 1.65 1.57 0.90 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.82 3.83 1.78 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.62 0.90 0.00 0.00 51 K 9.11 4.74 0.00 2.21 1.99 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.58 1.58 7.81 52 T 8.70 4.35 4.32 0.00 0.00 0.00 0.00 0.00 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 53 D 8.33 4.66 0.00 3.04 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 54 I 7.75 5.22 1.94 0.00 0.00 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 1.55 0.98 0.97 0.00 0.00 55 S 8.94 5.38 0.00 4.00 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 56 M 8.44 5.36 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 57 S 8.81 4.59 0.00 3.90 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 58 M 8.59 4.40 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.95 2.74 0.00 59 P 0.00 4.52 0.00 2.16 1.95 0.00 3.94 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 2.01 1.64 0.00 60 K 8.28 4.46 0.00 1.86 1.62 0.00 2.00 0.00 0.00 0.85 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.56 1.41 7.81 61 F 8.22 3.79 0.00 3.18 2.96 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 62 C 7.84 5.40 0.00 3.12 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 63 Y 8.92 4.97 0.00 3.18 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 64 G 8.84 3.85 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 0.00 0.00 0.00 65 R 8.56 4.79 0.00 1.39 1.65 0.00 3.24 0.00 0.00 3.20 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 66 I 8.70 4.30 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.59 0.86 0.00 0.00 67 A 8.98 4.91 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 68 P 0.00 4.68 0.00 2.04 2.00 0.00 3.73 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 69 R 8.36 4.14 0.00 1.83 1.85 0.00 3.23 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 70 S 8.82 4.13 0.00 3.86 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 71 G 8.07 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 72 L 7.83 4.02 0.00 1.63 1.57 0.97 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 73 S 7.81 4.47 0.00 4.04 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 74 L 7.77 4.07 0.00 1.78 1.72 0.91 0.97 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 75 K 7.40 4.27 0.00 1.90 1.84 0.00 1.76 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.49 1.62 7.81 76 G 7.77 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 0.00 0.00 0.00 77 I 8.24 4.49 1.63 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 -0.11 0.52 0.00 0.00 78 D 8.77 5.06 0.00 2.51 2.50 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 79 I 8.20 4.81 1.83 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 1.22 0.89 0.94 0.00 0.00 80 G 8.93 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 81 G 9.95 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 0.00 0.00 0.00 82 G 9.01 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 83 V 7.52 4.54 2.01 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 0.61 0.00 0.00 0.85 0.00 0.00 84 I 8.72 4.22 1.96 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.95 1.04 0.00 0.00 85 D 8.53 4.84 0.00 2.69 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 86 E 9.26 4.00 0.00 2.37 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 2.41 2.55 0.00 87 D 7.98 4.84 0.00 2.83 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 88 Y 7.91 4.35 0.00 2.93 3.10 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 0.00 89 R 8.10 4.28 0.00 1.65 1.77 0.00 3.37 0.00 0.00 3.18 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.47 0.00 90 G 5.40 3.62 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 0.00 0.00 0.00 91 N 8.51 4.63 0.00 2.83 2.87 0.00 0.00 6.91 7.94 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 92 I 9.33 4.20 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 1.40 1.39 0.94 0.00 0.00 93 G 8.79 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 0.00 0.00 0.00 0.00 94 V 8.73 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 0.93 0.00 0.00 0.91 0.00 0.00 95 I 8.34 4.47 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.42 0.87 0.00 0.00 96 L 8.64 4.75 0.00 1.56 1.52 1.03 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.58 4.54 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.71 0.92 0.00 0.00 98 N 9.25 4.79 0.00 2.75 2.97 0.00 0.00 6.67 6.26 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 99 N 8.72 4.98 0.00 2.79 2.77 0.00 0.00 6.93 7.14 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 0.00 100 G 7.98 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 0.00 101 K 8.40 4.22 0.00 1.77 1.88 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.40 7.81 102 C 7.58 5.04 0.00 2.86 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 0.00 103 T 8.53 4.21 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 1.29 0.00 0.00 104 F 9.53 4.85 0.00 3.05 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 0.00 105 N 8.16 5.08 0.00 2.43 2.60 0.00 0.00 6.90 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 0.00 106 V 8.91 4.25 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 1.15 0.00 0.00 1.08 0.00 0.00 107 N 8.82 5.39 0.00 3.02 2.69 0.00 0.00 6.56 6.69 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 0.00 108 T 8.45 4.13 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 1.10 0.00 0.00 109 G 9.32 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 0.00 110 D 8.03 4.73 0.00 2.93 2.68 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 0.00 111 R 8.73 4.65 0.00 1.55 1.62 0.00 2.89 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 112 I 8.34 4.53 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 1.36 0.70 1.04 0.00 0.00 113 A 7.24 4.56 1.16 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 0.00 114 Q 8.83 4.80 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.20 0.00 115 L 9.14 4.74 0.00 1.60 1.41 0.72 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 116 I 8.30 4.59 1.72 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 1.19 0.57 0.86 0.00 0.00 117 Y 8.66 4.63 0.00 2.85 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 0.00 118 Q 8.62 4.36 0.00 1.37 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.02 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 119 R 8.55 4.74 0.00 1.61 1.75 0.00 3.13 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 120 I 8.21 4.64 1.81 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.17 1.13 0.00 0.00 121 Y 8.35 4.98 0.00 2.97 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 0.00 122 Y 8.32 5.08 0.00 3.16 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 0.00 123 P 0.00 4.56 0.00 2.19 2.01 0.00 3.92 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.00 0.00 124 E 8.47 4.22 0.00 1.95 1.89 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 2.30 2.40 0.00 125 L 8.33 4.59 0.00 1.68 1.59 0.94 0.86 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 0.00 126 E 8.54 4.53 0.00 1.87 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 2.17 2.25 0.00 127 E 8.82 4.20 0.00 1.97 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 0.00 2.27 2.33 0.00 128 V 8.09 4.49 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 0.80 0.00 0.00 0.95 0.00 0.00 129 Q 8.46 4.27 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 130 S 7.62 4.63 0.00 3.77 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 0.00 131 L 8.39 4.31 0.00 1.66 1.54 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00