NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.4369 8.1776 115.2923 57.8573 63.4103 174.4524 4 Q 3.8326 8.8894 126.3105 56.7454 28.2700 175.8261 5 I 4.2859 7.6682 109.9654 60.1869 39.1249 176.7433 6 R 4.4335 7.9704 121.7758 56.2695 30.2385 175.7556 7 Q 4.2839 8.7946 121.4225 56.5369 31.6824 173.1935 8 N 4.2164 9.0156 123.4738 54.6684 37.4659 173.0893 9 Y 4.7113 7.2539 118.7514 55.1232 38.8177 175.8216 10 S 4.2757 8.0642 123.0138 58.1397 65.4225 175.1011 11 T 3.7702 8.2291 114.1162 64.8062 68.6321 176.6572 12 D 4.2454 7.8357 121.6324 57.0493 40.8254 178.6240 13 V 3.4360 7.0809 118.4192 66.0105 31.5836 177.3882 14 E 3.7347 7.4826 118.7747 59.5219 29.1587 178.8469 15 A 3.9482 7.8991 120.2060 54.9700 18.5414 179.4863 16 A 3.9992 7.9687 119.0971 54.6944 18.3164 180.1675 17 V 3.4900 8.0445 117.6794 66.4062 31.2491 178.0596 18 N 4.4313 7.9204 115.5022 55.8161 38.3451 177.4356 19 S 4.1223 7.7099 114.8712 61.1624 62.6255 175.8406 20 L 4.0588 8.0218 123.0971 57.9675 41.9344 178.8708 21 V 3.7249 8.2804 118.8538 66.2553 31.4269 177.6191 22 N 4.3639 7.9468 115.7943 56.4912 38.7825 176.6609 23 L 4.0509 7.9403 121.5173 57.9965 42.0266 178.4559 24 Y 3.9893 8.2109 116.9908 60.6847 37.9573 177.8057 25 L 4.0057 7.9844 119.5996 57.3053 41.5405 179.4054 26 Q 3.9508 8.0573 119.6981 59.1635 29.0552 177.9243 27 A 3.7881 7.9455 121.8453 55.1180 18.4055 179.4143 28 S 4.2703 8.5912 111.9701 61.9362 62.4651 175.8882 29 Y 4.4568 8.2385 122.1675 60.9539 38.5450 177.8041 30 T 3.8111 8.1393 116.8191 67.0730 68.5345 176.2487 31 Y 4.2383 7.8724 118.4636 60.8502 37.9080 178.2724 32 L 4.1660 8.0200 121.5349 58.1800 42.1871 179.0874 33 S 4.2927 7.9757 112.7814 61.3365 62.3818 175.9247 34 L 3.6009 7.8887 121.8636 57.5857 40.9592 179.8536 35 G 3.7364 8.4518 105.0977 48.0499 0.0000 175.6897 36 F 4.3086 8.3230 119.7694 58.7711 38.8969 177.2345 37 Y 4.2346 8.2992 120.3265 60.8961 38.8085 177.2713 38 F 4.0502 8.0930 116.9095 59.1753 38.8272 176.5477 39 D 4.4374 7.5102 116.8366 55.0806 41.7198 176.5688 40 R 4.1018 7.3542 119.4463 56.2503 30.5388 177.4104 41 D 4.4133 8.7385 121.2303 55.5090 39.4664 176.6454 42 D 4.6410 7.9355 117.6607 53.5440 40.4552 176.5505 43 V 3.8333 7.5686 117.4788 64.6509 33.0739 175.7902 44 A 3.8087 8.3036 117.7886 53.2265 15.8223 176.1619 45 L 4.7107 8.5544 120.2763 50.9281 43.4594 176.7343 46 E 3.9784 8.5685 123.5020 58.9720 29.7125 178.1184 47 G 3.4857 7.9228 105.3202 47.8162 0.0000 175.6794 48 V 3.0430 7.3711 120.9983 64.9582 31.5210 177.6377 49 S 4.0984 8.0131 113.0431 61.9401 62.2472 175.7561 50 H 4.0245 8.3700 120.8871 58.9804 29.6387 176.6301 51 F 3.7811 8.0214 122.4519 61.5839 39.0986 177.3056 52 F 4.0851 7.6408 117.0202 60.4827 38.7421 177.9756 53 R 4.0836 8.0675 117.6468 58.9465 29.7134 179.1136 54 E 3.7907 7.7968 118.6200 59.3248 29.4536 179.0009 55 L 3.6673 7.1442 118.4683 57.7681 41.4716 179.3915 56 A 4.1738 8.3173 120.9517 55.2837 18.2476 179.1266 57 E 4.0533 7.7182 116.7396 58.8563 29.8717 178.6137 58 E 3.9518 8.0708 118.9872 59.2392 29.5010 179.4048 59 K 4.4230 8.4593 118.7893 59.3560 31.8513 179.3040 60 R 3.2465 7.8112 118.7365 59.4178 29.8221 178.4440 61 E 4.1219 8.3550 118.2635 58.7125 29.3232 179.5239 62 G 3.5742 7.8061 106.2059 47.9744 0.0000 175.4004 63 Y 4.2412 7.8461 120.3797 59.3715 38.2322 177.6928 64 E 4.1234 7.6350 120.2230 58.8794 29.3934 179.1170 65 R 4.0453 7.8577 119.2443 59.2781 30.2421 178.4052 66 L 4.1757 7.9996 118.6220 57.9423 41.4526 179.5590 67 L 4.0985 8.3910 119.0947 57.4034 41.5438 179.5442 68 K 3.9928 7.9374 119.4538 59.7268 32.3415 178.6955 69 M 3.9182 8.3532 118.6569 58.2880 32.0115 177.7033 70 Q 3.8666 8.0295 120.0040 59.4011 29.0452 178.0381 71 N 4.3175 7.6894 116.5975 56.5306 38.6682 177.2253 72 Q 4.0625 7.6130 118.1902 58.9190 29.1676 178.5948 73 R 3.7218 7.4757 118.8712 58.6020 29.7059 177.5070 74 G 3.7185 7.4600 105.2432 45.1719 0.0000 174.3295 75 G 4.5816 7.8203 108.2371 45.2138 0.0000 172.7258 76 R 4.5268 8.9602 118.7130 53.7084 32.3573 176.2742 77 A 4.7119 8.3438 125.4296 51.4475 18.9884 176.6907 78 L 4.4705 8.0696 121.2929 52.8498 44.1570 176.3738 79 F 4.6394 8.4420 122.5069 56.6309 40.0999 174.9845 80 Q 4.7477 8.2262 121.1789 53.7195 32.5686 174.7886 81 D 4.4411 8.4494 118.3650 54.5532 41.3212 176.3600 82 I 4.2227 7.9276 123.5020 59.4860 37.8797 176.0363 83 K 4.1535 8.5638 126.2244 55.6610 32.4905 177.3705 84 K 4.4440 8.6466 122.8485 56.2605 32.7435 174.8697 85 P 4.4287 0.0000 0.0000 62.7096 31.7528 177.4421 86 A 3.8147 8.5068 122.3391 54.1858 18.4921 177.0278 87 E 4.2650 6.8406 113.4100 55.0202 33.5568 174.6286 88 D 4.6807 7.7804 116.9092 53.9481 42.7483 176.4210 89 E 3.8697 6.9735 118.5270 54.9590 32.9225 174.5934 90 W 4.5249 6.9067 123.2858 55.8381 30.4678 177.6006 91 G 3.7986 7.2492 111.1039 47.2664 0.0000 177.8391 92 K 4.6715 9.2074 126.2231 54.7057 34.8759 176.8526 93 T 4.3126 8.6130 116.8908 66.8406 68.3752 175.0897 94 P 4.3485 0.0000 0.0000 65.5918 31.2975 178.5082 95 D 4.3974 8.2216 117.0979 57.4255 40.9646 178.3382 96 A 4.1748 8.4784 121.3790 55.5500 18.3618 179.4051 97 M 4.2580 8.5319 116.7611 58.7721 32.3375 178.6499 98 K 4.0409 8.1580 118.1262 59.2304 32.1147 179.2657 99 A 4.0455 8.1872 121.1146 55.1476 18.4944 179.6003 100 A 3.9856 8.0804 119.3857 55.2302 18.5909 179.4318 101 M 4.0439 8.7982 117.1028 58.8567 32.3152 178.4497 102 A 3.9996 8.0844 120.8022 55.1645 18.7708 179.3018 103 L 3.8882 8.1139 118.8455 58.1426 41.9543 179.2361 104 E 4.0266 8.1513 118.2163 59.3241 29.6325 179.0436 105 K 4.1022 7.9370 118.0237 59.2711 31.9618 179.3967 106 K 3.9256 8.1999 119.8661 59.5862 32.1797 178.9209 107 L 3.9106 7.6977 118.8137 57.7048 41.4928 179.1054 108 N 4.3315 8.7912 117.3376 56.7865 38.9426 176.6974 109 Q 4.0345 8.3063 120.7853 59.1935 29.1359 178.1606 110 A 4.0484 8.1941 121.9388 54.9239 18.3775 179.7303 111 L 3.9219 8.1228 117.6659 58.0697 41.8255 179.4932 112 L 4.0739 8.4390 119.2591 58.0852 41.5231 179.5334 113 D 4.3640 8.1810 118.6992 57.3369 40.9736 178.5861 114 L 4.0421 7.9756 120.4172 57.8458 41.9998 178.3879 115 H 4.3659 8.3002 118.4613 59.0568 29.9844 177.0032 116 A 4.0099 8.1713 122.6898 54.8432 18.1588 179.4184 117 L 4.0196 8.2067 119.3427 58.2888 42.1833 179.4850 118 G 3.6725 8.0922 105.3033 47.4842 0.0000 176.0541 119 S 4.0604 7.9601 117.3284 61.4837 62.6680 176.5281 120 A 4.0204 7.5470 121.4542 55.2047 18.2842 179.2000 121 R 4.1201 7.8594 113.0634 55.5700 31.2493 176.7148 122 T 3.4275 7.2387 108.3008 63.1503 68.2088 173.9224 123 D 4.8450 8.3059 121.4975 51.9812 41.6321 174.0376 124 P 4.3067 0.0000 0.0000 65.6944 31.4909 177.5383 125 H 4.0711 8.3964 117.7158 59.2294 29.5318 176.7221 126 L 4.1313 8.0164 121.2587 58.0005 41.9924 178.4531 127 C 4.3906 7.9907 116.4740 62.8995 28.1755 175.5375 128 D 4.3109 8.5780 119.8833 57.5024 40.8258 177.8161 129 F 4.3430 8.3805 121.0775 61.4437 39.1252 176.9277 130 L 4.4893 8.0523 118.4065 57.3808 41.4803 178.9917 131 E 4.0256 7.9912 117.9255 59.3100 29.4062 179.2799 132 T 3.9667 8.2416 115.4475 66.4327 68.8982 176.0939 133 H 4.3988 7.4607 113.8056 55.4437 29.6455 175.0931 134 F 4.7215 7.6103 117.3913 58.7170 41.6392 176.5652 135 L 3.9949 8.5365 120.8592 58.2610 41.5145 179.3639 136 D 4.3081 8.0163 116.7490 57.4645 41.3579 177.5833 137 E 3.9531 8.2788 118.6109 59.6866 29.3242 179.2652 138 E 3.9956 8.2128 118.0897 59.6181 29.6782 179.4373 139 V 3.6079 7.5624 118.2913 66.1094 31.3531 178.2876 140 K 4.0114 8.0549 117.9536 59.3136 32.0677 179.1089 141 L 3.9916 8.0637 120.5976 58.1089 41.8729 179.2217 142 I 3.8167 8.1827 120.2887 64.1034 37.1239 178.0788 143 K 3.8980 8.1213 120.5333 59.3211 31.9293 178.5393 144 K 3.8532 8.3510 120.0265 60.0414 32.1726 178.7035 145 M 4.2875 8.1689 118.7645 58.3090 31.9534 179.0560 146 G 3.6336 8.5686 106.4268 47.9285 0.0000 175.5643 147 D 4.3770 8.2698 121.3358 57.2509 40.7441 178.5558 148 H 4.1425 8.1943 116.7900 58.9384 28.7045 177.8282 149 L 4.0477 8.1016 120.7335 58.2212 41.3183 179.7754 150 T 3.8806 7.8964 115.3409 66.5616 68.3690 176.4146 151 N 4.4209 8.0127 118.4400 55.8747 38.5008 177.4607 152 L 3.9751 8.0961 120.0223 58.2168 41.8323 178.8290 153 H 4.2618 8.2573 116.9604 59.0508 29.8169 176.9029 154 R 4.0631 7.5178 120.1325 59.1556 30.0157 176.7276 155 L 4.3385 7.7085 121.8701 54.9296 41.9297 176.4703 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 3 S 8.18 4.44 0.00 4.06 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 4 Q 8.89 3.83 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 5 I 7.67 4.29 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 1.27 0.64 0.89 0.00 0.00 6 R 7.97 4.43 0.00 1.87 1.94 0.00 3.25 0.00 0.00 3.06 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.71 0.00 7 Q 8.79 4.28 0.00 2.06 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.12 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 8 N 9.02 4.22 0.00 2.86 2.86 0.00 0.00 7.02 7.54 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 9 Y 7.25 4.71 0.00 2.97 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 10 S 8.06 4.28 0.00 3.99 3.91 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 11 T 8.23 3.77 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 1.14 0.00 0.00 12 D 7.84 4.25 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 13 V 7.08 3.44 1.93 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 1.09 0.00 0.00 0.89 0.00 0.00 14 E 7.48 3.73 0.00 1.51 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 2.24 2.59 0.00 15 A 7.90 3.95 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 16 A 7.97 4.00 1.37 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 17 V 8.04 3.49 2.29 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 1.03 0.00 0.00 1.02 0.00 0.00 18 N 7.92 4.43 0.00 2.82 2.91 0.00 0.00 6.78 8.64 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 19 S 7.71 4.12 0.00 3.84 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 20 L 8.02 4.06 0.00 1.97 1.80 1.02 0.62 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 21 V 8.28 3.72 2.28 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 0.97 0.00 0.00 1.01 0.00 0.00 22 N 7.95 4.36 0.00 2.96 2.94 0.00 0.00 6.89 6.54 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 23 L 7.94 4.05 0.00 1.98 1.88 0.90 0.81 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 24 Y 8.21 3.99 0.00 3.57 3.43 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 25 L 7.98 4.01 0.00 1.82 1.59 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 26 Q 8.06 3.95 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 27 A 7.95 3.79 1.32 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 0.00 0.00 0.00 28 S 8.59 4.27 0.00 4.26 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 0.00 29 Y 8.24 4.46 0.00 3.26 3.11 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 30 T 8.14 3.81 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 0.95 0.00 0.00 31 Y 7.87 4.24 0.00 3.05 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 32 L 8.02 4.17 0.00 2.13 2.01 1.23 0.97 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 33 S 7.98 4.29 0.00 3.90 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 0.00 34 L 7.89 3.60 0.00 1.56 1.15 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.45 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 36 F 8.32 4.31 0.00 3.35 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 0.00 37 Y 8.30 4.23 0.00 3.40 3.27 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 38 F 8.09 4.05 0.00 3.24 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 39 D 7.51 4.44 0.00 2.63 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 40 R 7.35 4.10 0.00 1.93 1.97 0.00 3.36 0.00 0.00 3.52 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 41 D 8.74 4.41 0.00 2.79 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 42 D 7.94 4.64 0.00 2.79 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 43 V 7.57 3.83 1.77 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 0.38 0.00 0.00 0.25 0.00 0.00 44 A 8.30 3.81 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 45 L 8.55 4.71 0.00 1.83 1.53 1.14 0.66 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 46 E 8.57 3.98 0.00 2.01 1.92 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 2.34 2.36 0.00 47 G 7.92 3.49 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 0.00 48 V 7.37 3.04 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 -0.09 0.00 0.00 0.58 0.00 0.00 49 S 8.01 4.10 0.00 4.00 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 50 H 8.37 4.02 0.00 3.25 3.37 0.00 5.66 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 8.02 3.78 0.00 2.97 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 52 F 7.64 4.09 0.00 3.16 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 53 R 8.07 4.08 0.00 1.88 1.89 0.00 2.69 0.00 0.00 2.99 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.81 0.00 54 E 7.80 3.79 0.00 1.86 1.71 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 2.12 2.18 0.00 55 L 7.14 3.67 0.00 1.11 0.61 0.40 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.32 4.17 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 57 E 7.72 4.05 0.00 2.19 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 2.26 2.36 0.00 58 E 8.07 3.95 0.00 2.21 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 2.25 2.42 0.00 59 K 8.46 4.42 0.00 2.03 2.24 0.00 1.81 0.00 0.00 1.91 0.00 0.00 3.04 0.00 0.00 3.45 0.00 0.00 0.00 0.00 1.93 1.88 7.81 60 R 7.81 3.25 0.00 2.04 2.05 0.00 3.10 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.67 0.00 61 E 8.36 4.12 0.00 2.12 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 2.24 2.34 0.00 62 G 7.81 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.24 0.00 3.26 3.34 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 64 E 7.64 4.12 0.00 2.07 2.04 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 2.39 2.10 0.00 65 R 7.86 4.05 0.00 1.96 2.28 0.00 2.43 0.00 0.00 2.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 66 L 8.00 4.18 0.00 1.92 1.73 0.62 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.39 4.10 0.00 2.03 1.84 1.35 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 68 K 7.94 3.99 0.00 2.16 2.03 0.00 1.55 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.51 7.81 69 M 8.35 3.92 0.00 1.68 1.24 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.12 0.00 70 Q 8.03 3.87 0.00 2.34 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.54 0.00 0.00 0.00 0.00 0.00 2.32 2.60 0.00 71 N 7.69 4.32 0.00 2.81 2.86 0.00 0.00 7.21 7.56 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 72 Q 7.61 4.06 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.00 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 73 R 7.48 3.72 0.00 0.75 0.66 0.00 2.86 0.00 0.00 2.83 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.96 0.00 74 G 7.46 3.72 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 0.00 0.00 0.00 75 G 7.82 4.58 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 0.00 0.00 0.00 76 R 8.96 4.53 0.00 1.72 1.81 0.00 3.33 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 77 A 8.34 4.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.07 4.47 0.00 1.47 1.50 0.88 0.83 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 79 F 8.44 4.64 0.00 3.04 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 80 Q 8.23 4.75 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 81 D 8.45 4.44 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 82 I 7.93 4.22 1.64 0.00 0.00 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 1.33 0.42 0.89 0.00 0.00 83 K 8.56 4.15 0.00 2.05 1.79 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.44 7.81 84 K 8.65 4.44 0.00 1.95 2.00 0.00 1.62 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.50 7.81 85 P 0.00 4.43 0.00 2.41 2.30 0.00 3.48 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 1.82 1.92 0.00 86 A 8.51 3.81 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 87 E 6.84 4.26 0.00 1.16 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 1.70 1.65 0.00 88 D 7.78 4.68 0.00 2.42 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 89 E 6.97 3.87 0.00 1.61 1.55 0.00 0.00 0.00 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 2.18 0.00 90 W 6.91 4.52 0.00 3.01 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 91 G 7.25 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 0.00 0.00 0.00 92 K 9.21 4.67 0.00 2.07 1.86 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.54 7.81 93 T 8.61 4.31 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 1.12 0.00 0.00 94 P 0.00 4.35 0.00 2.23 2.17 0.00 3.66 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 95 D 8.22 4.40 0.00 3.18 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 96 A 8.48 4.17 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 0.00 0.00 0.00 0.00 0.00 97 M 8.53 4.26 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.63 0.00 98 K 8.16 4.04 0.00 2.16 1.91 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.51 1.52 7.81 99 A 8.19 4.05 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.08 3.99 1.63 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 0.00 0.00 101 M 8.80 4.04 0.00 2.29 2.17 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.66 0.00 102 A 8.08 4.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.11 3.89 0.00 1.75 1.76 0.81 0.25 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 0.00 104 E 8.15 4.03 0.00 2.31 2.17 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 2.73 2.62 0.00 105 K 7.94 4.10 0.00 2.00 1.90 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.73 7.81 106 K 8.20 3.93 0.00 1.83 1.98 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 107 L 7.70 3.91 0.00 1.88 1.62 0.50 -0.01 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 0.00 108 N 8.79 4.33 0.00 2.92 2.99 0.00 0.00 6.84 7.00 0.00 0.00 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 Q 8.31 4.03 0.00 2.42 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 110 A 8.19 4.05 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 0.00 111 L 8.12 3.92 0.00 1.98 1.79 1.10 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 112 L 8.44 4.07 0.00 1.85 1.77 0.95 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.18 4.36 0.00 2.93 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 0.00 114 L 7.98 4.04 0.00 1.90 1.84 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 115 H 8.30 4.37 0.00 3.41 3.47 0.00 5.66 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 0.00 116 A 8.17 4.01 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 0.00 117 L 8.21 4.02 0.00 1.85 1.86 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.09 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 0.00 0.00 0.00 119 S 7.96 4.06 0.00 4.01 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 0.00 120 A 7.55 4.02 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 0.00 121 R 7.86 4.12 0.00 1.81 1.96 0.00 3.44 0.00 0.00 3.25 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.74 0.00 122 T 7.24 3.43 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 1.27 0.00 0.00 123 D 8.31 4.84 0.00 2.74 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 0.00 124 P 0.00 4.31 0.00 2.35 2.33 0.00 3.84 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 125 H 8.40 4.07 0.00 3.23 3.53 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 8.02 4.13 0.00 2.01 1.89 0.93 1.04 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 0.00 127 C 7.99 4.39 0.00 3.29 3.28 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 0.00 128 D 8.58 4.31 0.00 2.81 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 0.00 129 F 8.38 4.34 0.00 3.19 3.28 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 0.00 130 L 8.05 4.49 0.00 1.98 1.80 1.08 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 131 E 7.99 4.03 0.00 2.11 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 2.28 2.56 0.00 132 T 8.24 3.97 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 0.83 0.00 0.00 133 H 7.46 4.40 0.00 2.03 2.50 0.00 5.60 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 F 7.61 4.72 0.00 3.17 3.07 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 0.00 135 L 8.54 3.99 0.00 1.68 1.77 0.87 0.87 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 0.00 136 D 8.02 4.31 0.00 2.72 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 0.00 137 E 8.28 3.95 0.00 2.18 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 2.32 0.00 138 E 8.21 4.00 0.00 2.28 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 2.63 2.59 0.00 139 V 7.56 3.61 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 1.05 0.00 0.00 0.99 0.00 0.00 140 K 8.05 4.01 0.00 2.04 1.84 0.00 1.71 0.00 0.00 1.56 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.55 7.81 141 L 8.06 3.99 0.00 1.96 1.92 0.95 0.87 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 0.00 142 I 8.18 3.82 2.06 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 1.47 0.69 0.95 0.00 0.00 143 K 8.12 3.90 0.00 2.00 2.02 0.00 1.53 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.63 7.81 144 K 8.35 3.85 0.00 2.06 2.06 0.00 1.91 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.50 7.81 145 M 8.17 4.29 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.77 0.00 146 G 8.57 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 0.00 0.00 0.00 147 D 8.27 4.38 0.00 2.80 2.65 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 0.00 148 H 8.19 4.14 0.00 3.29 3.18 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 L 8.10 4.05 0.00 1.87 1.75 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 150 T 7.90 3.88 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 1.20 0.00 0.00 151 N 8.01 4.42 0.00 2.80 2.84 0.00 0.00 6.96 7.16 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 0.00 152 L 8.10 3.98 0.00 1.75 1.76 0.90 0.91 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 0.00 153 H 8.26 4.26 0.00 3.23 3.38 0.00 5.76 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 0.00 154 R 7.52 4.06 0.00 1.94 2.10 0.00 3.45 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 155 L 7.71 4.34 0.00 1.69 1.55 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00