NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3002 8.2644 123.5809 52.2228 19.8583 176.2316 3 R 3.9978 8.6562 123.4805 57.6206 30.2001 174.9817 4 R 4.1746 7.9288 117.2764 57.7842 31.9961 176.0776 5 R 4.0443 7.5920 116.9234 56.5636 31.1870 177.6041 6 R 3.6934 8.8141 119.3977 56.7414 29.5799 177.4488 7 A 3.6234 7.5318 112.7793 53.4635 15.3707 176.6752 8 E 4.3289 8.0904 122.2318 55.2111 30.9385 176.9715 9 V 3.3349 8.0992 120.1025 63.5552 31.8548 175.4391 10 R 4.2958 8.3188 126.8583 54.5429 30.2242 175.6354 11 Q 4.2348 8.4561 126.5654 55.9098 29.8739 173.9079 12 L 4.7448 8.0280 119.2675 52.8193 45.2742 176.0218 13 Q 4.4310 8.2199 120.4639 54.3588 29.0783 172.5808 14 P 4.2971 0.0000 0.0000 60.6066 33.0233 175.7693 15 D 4.5902 8.7679 120.9958 54.7211 41.7182 177.5945 16 L 3.9705 8.6242 124.6981 58.0317 41.6356 178.4791 17 V 3.8059 7.3202 119.2486 64.5882 31.7420 176.7683 18 Y 4.1388 9.0061 122.6464 59.1198 38.9215 177.0024 19 G 4.5888 8.0116 106.5825 44.8923 0.0000 171.9074 20 D 4.5846 7.5818 116.3858 52.3851 44.9694 175.9599 21 V 3.6281 8.6751 120.7342 64.6924 31.3993 178.1479 22 L 3.9507 8.1148 118.9392 59.2972 42.1558 178.5080 23 V 3.3703 8.4542 115.7563 66.7245 30.7253 177.3465 24 T 3.7327 8.0078 107.5761 65.3638 68.3688 175.8292 25 A 3.9905 7.8001 122.5089 54.6983 18.7320 179.0918 26 F 4.1692 8.4012 118.6950 61.6106 39.5560 177.0261 27 I 3.3782 7.4634 118.8477 64.6252 36.3148 177.7916 28 N 4.2295 9.1040 117.6060 56.3565 38.2410 177.5452 29 K 3.8321 7.5274 117.9993 58.9113 31.9441 179.1021 30 I 3.9673 7.0376 119.5951 63.7345 37.8844 174.2298 31 M 3.8310 7.3294 124.3626 55.2402 31.3493 173.9289 32 R 4.1113 8.5028 124.4739 56.2184 30.8134 176.4821 33 D 4.4201 9.1134 124.1248 55.0070 37.7330 175.2503 34 G 3.9143 8.2516 105.2914 45.8184 0.0000 175.6828 35 K 4.2775 7.2761 119.9990 55.2695 30.4978 177.3728 36 K 4.1136 8.1435 124.6907 58.8645 32.8948 178.6629 37 N 4.2337 8.2804 115.4600 55.6145 38.4573 175.1592 38 L 4.5316 7.2871 115.6395 55.0052 44.8849 177.9511 39 A 4.2838 8.6366 120.5707 53.1795 17.7243 179.5174 40 A 4.3779 9.4160 128.5352 55.5223 18.8392 179.6311 41 R 4.2268 8.2683 117.0142 60.1745 30.0016 178.5471 42 I 4.0272 8.3368 120.8776 63.7346 37.0470 177.9437 43 F 4.3730 8.4536 121.1351 61.9364 38.9770 176.6578 44 Y 3.5770 9.4487 116.9362 60.6560 37.6456 177.4879 45 D 3.8552 8.8624 120.1213 56.9605 40.7997 178.8147 46 A 4.0858 8.3703 121.6243 55.0733 18.7044 178.9542 47 C 3.6378 7.4653 113.9017 62.9895 28.4926 176.1431 48 K 4.0788 8.7925 121.8808 59.4406 31.6725 178.2648 49 I 4.3191 7.4495 118.1254 62.0551 38.2632 176.5116 50 I 4.3839 7.5709 118.7959 61.3590 37.8999 176.4989 51 Q 5.1646 7.7555 119.0697 57.0896 29.8771 177.5179 52 E 4.1913 8.1238 114.3082 57.8984 29.6737 177.3513 53 K 4.5218 7.4016 115.5300 55.6296 34.1660 175.5819 54 T 4.1129 7.0963 110.8609 61.4906 70.6239 173.5893 55 G 3.8421 8.7728 114.6936 46.6581 0.0000 174.0288 56 Q 4.2363 8.1984 120.1034 55.3021 29.5239 175.0467 57 E 4.6657 8.4225 118.9340 53.7572 31.3024 175.8851 58 P 4.4292 0.0000 0.0000 63.1751 30.7786 176.8651 59 L 4.4361 8.9509 124.2776 57.1399 42.4641 177.0990 60 K 4.5621 7.9205 116.6998 55.8344 33.3816 177.2825 61 V 3.6366 7.6991 118.7869 65.6158 31.7749 176.9646 62 F 4.6343 8.0993 118.2122 58.0213 39.2068 175.1052 63 K 4.0986 7.6304 120.2363 57.5270 34.2188 177.0061 64 Q 3.9546 8.2484 120.1595 58.6735 29.1660 177.5456 65 A 3.8905 7.4961 120.3737 54.3376 17.6541 178.2903 66 V 3.5567 7.1339 116.9446 64.9250 31.7990 176.7696 67 E 4.0818 8.0871 121.1867 58.0511 29.7537 177.4054 68 N 4.7592 7.8403 115.3557 53.5560 39.1942 175.3400 69 V 4.3743 9.0348 117.9896 62.4072 32.3672 175.2424 70 K 4.4031 8.1206 119.0275 53.2953 31.5497 174.5946 71 P 4.4418 0.0000 0.0000 62.6307 31.3155 176.2539 72 R 4.0551 9.1487 124.2789 59.0394 30.2491 175.3836 73 M 5.0368 7.7105 115.2302 53.4788 36.0374 173.7160 74 E 4.7291 8.6816 122.0045 54.7359 33.5311 175.4085 75 V 5.0774 8.2268 117.5583 59.5002 31.0031 174.3750 76 R 4.3290 8.2936 123.0841 55.2113 31.0029 176.2100 77 S 4.4657 8.7538 118.8721 59.3879 63.4758 172.5896 78 R 4.1431 8.2595 119.5966 55.2009 33.8287 173.7946 79 R 4.3986 7.8230 121.5034 54.7060 32.3673 175.1190 80 V 3.6487 9.3552 124.1027 62.6959 32.7391 174.0249 81 G 3.0645 9.1164 107.2363 44.7252 0.0000 174.7667 82 G 3.8444 8.5759 114.4264 45.6648 0.0000 172.8133 83 A 4.4670 7.7837 122.7487 50.1243 21.4530 174.1764 84 N 5.0739 8.6011 120.2991 51.7639 40.6350 173.8226 85 Y 4.7557 8.1261 121.5202 55.6384 40.4552 176.5037 86 Q 4.6587 7.9211 124.3630 54.7529 27.6840 176.5955 87 V 3.8411 7.7504 119.3808 63.4304 32.8764 173.7288 88 P 5.6039 0.0000 0.0000 61.2339 33.8553 173.4919 89 M 4.2001 8.3315 117.7545 54.8568 34.8797 173.8544 90 E 4.0812 8.9366 118.0567 57.3968 30.0085 177.1087 91 V 4.4254 7.8423 123.3694 60.8491 33.7858 175.3722 92 S 4.3236 8.5759 122.2466 57.5569 63.3295 172.6744 93 P 4.2158 0.0000 0.0000 66.4257 30.6756 178.4423 94 R 3.8469 8.0769 117.4544 59.4081 29.9924 178.1846 95 R 3.7850 8.2295 117.3747 60.3687 29.8848 178.6336 96 Q 3.5522 8.5626 115.3526 58.6024 28.7960 179.3304 97 Q 4.1459 8.6324 119.8366 60.2938 29.1333 179.4614 98 S 3.9382 8.3191 114.3851 62.2021 62.9889 176.7294 99 L 3.3713 8.6054 120.8287 58.7375 41.5413 179.0930 100 A 4.0318 9.4624 118.1687 55.5998 18.1818 179.8945 101 L 4.0718 8.6778 115.4341 57.7319 42.2919 179.3578 102 R 3.8907 8.4611 119.3902 59.1145 29.6602 178.0436 103 W 4.4686 9.6445 116.6715 60.9957 28.8243 179.3708 104 L 3.6837 8.9307 115.8160 57.6068 41.4673 179.3640 105 V 3.5590 8.8928 116.2855 67.3799 31.5271 178.2169 106 Q 3.9889 8.7204 116.1400 59.1849 28.8891 179.0372 107 A 4.0547 10.6000 119.8417 55.4394 18.6272 179.2476 108 A 4.4485 9.1569 120.6069 55.1184 18.3995 179.4935 109 N 4.3623 8.5558 113.8256 56.5300 38.6978 177.2027 110 Q 4.1799 7.9173 118.9320 57.8207 29.0563 176.4373 111 R 3.9671 7.6381 118.5633 55.9486 30.6315 174.1944 112 P 4.7394 0.0000 0.0000 62.4784 31.9381 175.6631 113 E 4.0578 8.0222 118.8831 57.3364 29.7900 176.6379 114 R 4.3898 8.4661 120.4675 56.1819 30.3794 177.3802 115 R 4.3330 7.7761 118.4392 54.4594 31.8020 176.2705 116 A 3.7183 7.9579 123.3921 54.2067 18.9924 178.2462 117 A 3.9529 8.1245 118.0975 55.9543 18.2473 179.1718 118 V 3.3751 7.6550 113.8845 67.4466 31.6744 178.1331 119 R 3.3643 8.2417 113.2389 59.7083 30.0448 179.0113 120 I 3.5747 8.1468 117.9164 64.2487 37.4980 177.6027 121 A 4.0265 8.0774 121.3194 56.4774 18.0615 178.7911 122 H 4.2815 8.7349 114.6760 58.7465 28.5789 177.1653 123 E 4.0440 8.2725 119.9665 59.7571 29.5377 179.4053 124 L 4.0141 8.6908 118.9489 58.0489 41.8408 178.9343 125 M 3.9893 8.7518 119.0132 59.4924 31.9433 177.2108 126 D 4.2913 9.2951 119.1078 57.3939 41.0337 178.5076 127 A 3.9855 8.8028 120.6632 55.5826 18.3827 179.1997 128 A 4.1060 7.7670 117.5935 55.6374 18.4409 179.3197 129 E 4.0536 7.8099 115.6014 60.2036 30.1504 176.6470 130 G 3.6248 9.3863 113.0309 45.5325 0.0000 175.6323 131 K 4.3906 7.8134 120.3148 56.6690 32.2309 176.5981 132 G 4.1401 8.6612 109.3544 44.4370 0.0000 176.0507 133 G 3.6192 8.6934 111.6128 48.1994 0.0000 175.0423 134 A 3.8685 8.1548 122.3147 55.0689 18.0818 179.5064 135 V 3.3793 7.5319 114.9439 66.8034 31.1250 177.4897 136 K 3.7536 7.8066 116.4343 59.6833 31.6782 178.5195 137 K 3.6620 7.7859 118.2389 59.7831 32.1827 178.9655 138 K 3.3124 7.1248 119.5805 59.4586 31.9625 178.7780 139 E 3.9189 8.8020 118.8966 59.2216 29.5470 178.4532 140 D 4.4095 8.9669 118.9343 57.5861 41.2436 178.6606 141 V 3.5963 7.9575 118.5325 66.1518 31.6211 177.8401 142 E 4.4350 8.2072 117.6978 58.7553 29.0405 178.5899 143 R 4.3612 7.9230 116.7178 57.2254 30.8233 176.7761 144 M 4.2565 8.5188 118.7057 56.0119 32.9348 176.3650 145 A 4.4699 7.2178 119.8432 52.5847 19.7875 177.0482 146 E 4.1067 9.0689 124.0665 57.7411 28.3169 176.8277 147 A 3.9681 8.1313 119.0289 55.4296 18.3609 178.5933 148 N 5.0022 8.0440 111.4050 53.3255 38.7861 177.0211 149 R 3.9802 8.2267 117.2720 57.8956 29.8987 177.4390 150 A 3.9882 7.9752 120.9720 55.8504 18.8171 179.1611 151 Y 3.9654 7.3922 108.5156 58.5642 37.9627 177.3104 152 A 4.2112 8.4512 125.9273 55.8238 18.4398 180.4553 153 H 4.3402 8.3667 105.8234 57.2365 28.1221 174.9710 154 Y 4.9572 8.6116 116.6910 58.1219 37.9533 175.7153 155 R 4.1645 8.2471 119.9688 56.6004 30.2512 176.6757 156 W 4.5701 9.3977 119.4842 56.5390 28.4694 176.1540 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 A 8.26 4.30 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 3 R 8.66 4.00 0.00 1.86 1.95 0.00 3.23 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 4 R 7.93 4.17 0.00 1.83 1.80 0.00 3.26 0.00 0.00 3.22 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 5 R 7.59 4.04 0.00 1.91 1.84 0.00 3.16 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 6 R 8.81 3.69 0.00 1.75 1.90 0.00 3.28 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 7 A 7.53 3.62 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 8 E 8.09 4.33 0.00 1.96 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 2.27 2.28 0.00 9 V 8.10 3.33 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 0.74 0.00 0.00 0.92 0.00 0.00 10 R 8.32 4.30 0.00 1.79 1.82 0.00 3.28 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 1.53 1.59 0.00 11 Q 8.46 4.23 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 12 L 8.03 4.74 0.00 1.63 1.54 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.22 4.43 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 14 P 0.00 4.30 0.00 2.13 2.01 0.00 3.78 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.16 0.00 15 D 8.77 4.59 0.00 2.94 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 16 L 8.62 3.97 0.00 1.76 1.75 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.32 3.81 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.09 0.00 0.00 18 Y 9.01 4.14 0.00 3.17 3.14 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 19 G 8.01 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.58 4.58 0.00 2.73 2.57 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 21 V 8.68 3.63 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 0.78 0.00 0.00 0.96 0.00 0.00 22 L 8.11 3.95 0.00 1.62 2.05 0.99 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.45 3.37 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 0.76 0.00 0.00 1.04 0.00 0.00 24 T 8.01 3.73 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 1.29 0.00 0.00 25 A 7.80 3.99 1.44 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 0.00 0.00 26 F 8.40 4.17 0.00 3.33 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 27 I 7.46 3.38 1.85 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.38 0.93 0.00 0.00 28 N 9.10 4.23 0.00 2.71 2.80 0.00 0.00 7.03 7.31 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 29 K 7.53 3.83 0.00 1.45 1.72 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.65 1.62 7.81 30 I 7.04 3.97 1.85 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.70 0.83 0.00 0.00 31 M 7.33 3.83 0.00 2.04 1.96 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 2.70 2.57 0.00 32 R 8.50 4.11 0.00 1.85 1.77 0.00 3.19 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 33 D 9.11 4.42 0.00 2.88 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 34 G 8.25 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 0.00 0.00 0.00 35 K 7.28 4.28 0.00 2.07 1.77 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.36 7.81 36 K 8.14 4.11 0.00 1.77 1.79 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.45 7.81 37 N 8.28 4.23 0.00 2.74 2.88 0.00 0.00 6.73 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 38 L 7.29 4.53 0.00 1.63 1.66 0.93 1.05 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 39 A 8.64 4.28 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 40 A 9.42 4.38 1.58 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 41 R 8.27 4.23 0.00 2.08 2.14 0.00 3.19 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.75 0.00 42 I 8.34 4.03 2.06 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.38 1.00 0.00 0.00 43 F 8.45 4.37 0.00 3.16 3.38 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 44 Y 9.45 3.58 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.86 3.86 0.00 2.82 2.76 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 46 A 8.37 4.09 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 47 C 7.47 3.64 0.00 2.78 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 48 K 8.79 4.08 0.00 1.95 1.82 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 49 I 7.45 4.32 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 1.70 0.94 0.93 0.00 0.00 50 I 7.57 4.38 1.95 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 1.51 0.81 0.92 0.00 0.00 51 Q 7.76 5.16 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.94 0.00 0.00 0.00 0.00 0.00 2.50 2.26 0.00 52 E 8.12 4.19 0.00 1.96 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 0.00 2.32 2.28 0.00 53 K 7.40 4.52 0.00 1.83 1.78 0.00 1.81 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.33 1.44 7.81 54 T 7.10 4.11 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 1.26 0.00 0.00 55 G 8.77 3.84 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 0.00 0.00 0.00 56 Q 8.20 4.24 0.00 2.03 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 57 E 8.42 4.67 0.00 2.20 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 2.28 2.33 0.00 58 P 0.00 4.43 0.00 2.02 2.11 0.00 3.78 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 59 L 8.95 4.44 0.00 1.64 2.03 1.23 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.92 4.56 0.00 1.84 1.68 0.00 1.65 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.43 7.81 61 V 7.70 3.64 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 0.92 0.00 0.00 1.00 0.00 0.00 62 F 8.10 4.63 0.00 2.89 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 63 K 7.63 4.10 0.00 1.74 1.75 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.38 7.81 64 Q 8.25 3.95 0.00 2.19 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.48 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 65 A 7.50 3.89 1.43 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 0.00 0.00 66 V 7.13 3.56 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 0.83 0.00 0.00 0.51 0.00 0.00 67 E 8.09 4.08 0.00 1.94 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 2.29 2.37 0.00 68 N 7.84 4.76 0.00 2.81 2.92 0.00 0.00 6.68 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 69 V 9.03 4.37 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 0.86 0.00 0.00 1.04 0.00 0.00 70 K 8.12 4.40 0.00 1.80 1.92 0.00 1.81 0.00 0.00 2.03 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.42 7.81 71 P 0.00 4.44 0.00 2.42 2.30 0.00 4.03 0.00 0.00 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.81 0.00 72 R 9.15 4.06 0.00 2.05 2.12 0.00 3.19 0.00 0.00 3.35 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 73 M 7.71 5.04 0.00 1.98 1.92 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 2.52 2.63 0.00 74 E 8.68 4.73 0.00 2.14 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 2.35 0.00 75 V 8.23 5.08 2.35 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 1.21 0.00 0.00 0.98 0.00 0.00 76 R 8.29 4.33 0.00 1.90 2.13 0.00 3.25 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 77 S 8.75 4.47 0.00 3.89 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 78 R 8.26 4.14 0.00 1.55 1.73 0.00 2.23 0.00 0.00 2.37 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.28 0.00 79 R 7.82 4.40 0.00 1.44 1.60 0.00 3.27 0.00 0.00 2.98 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.40 0.00 80 V 9.36 3.65 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 0.55 0.00 0.00 0.45 0.00 0.00 81 G 9.12 3.06 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 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.58 3.84 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 0.00 0.00 0.00 83 A 7.78 4.47 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 84 N 8.60 5.07 0.00 2.53 2.66 0.00 0.00 6.99 7.46 0.00 0.00 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 Y 8.13 4.76 0.00 2.87 2.52 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 86 Q 7.92 4.66 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 87 V 7.75 3.84 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 1.26 0.00 0.00 1.22 0.00 0.00 88 P 0.00 5.60 0.00 2.15 2.06 0.00 4.04 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 89 M 8.33 4.20 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 90 E 8.94 4.08 0.00 1.88 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 2.34 2.36 0.00 91 V 7.84 4.43 2.27 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 0.75 0.00 0.00 0.98 0.00 0.00 92 S 8.58 4.32 0.00 3.92 3.68 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 93 P 0.00 4.22 0.00 2.29 2.31 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.07 0.00 94 R 8.08 3.85 0.00 1.84 2.03 0.00 3.11 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 95 R 8.23 3.78 0.00 1.83 2.01 0.00 3.17 0.00 0.00 3.32 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 96 Q 8.56 3.55 0.00 2.31 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.44 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 97 Q 8.63 4.15 0.00 2.12 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.64 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 98 S 8.32 3.94 0.00 3.95 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 99 L 8.61 3.37 0.00 1.53 0.37 0.77 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 100 A 9.46 4.03 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 0.00 101 L 8.68 4.07 0.00 1.92 1.86 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.46 3.89 0.00 1.72 1.81 0.00 2.81 0.00 0.00 3.03 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 103 W 9.64 4.47 0.00 3.65 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 0.00 104 L 8.93 3.68 0.00 2.29 1.88 1.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.89 3.56 2.25 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 0.90 0.00 0.00 0.65 0.00 0.00 106 Q 8.72 3.99 0.00 2.47 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.47 0.00 0.00 0.00 0.00 0.00 2.41 2.42 0.00 107 A 10.60 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 108 A 9.16 4.45 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 0.00 109 N 8.56 4.36 0.00 2.86 2.96 0.00 0.00 7.20 8.35 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 0.00 110 Q 7.92 4.18 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.77 0.00 0.00 0.00 0.00 0.00 2.43 2.68 0.00 111 R 7.64 3.97 0.00 1.85 2.16 0.00 3.25 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 112 P 0.00 4.74 0.00 2.17 2.15 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 113 E 8.02 4.06 0.00 1.96 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 2.31 2.26 0.00 114 R 8.47 4.39 0.00 1.80 1.95 0.00 3.20 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 115 R 7.78 4.33 0.00 1.81 1.82 0.00 3.16 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 116 A 7.96 3.72 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 0.00 117 A 8.12 3.95 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 0.00 118 V 7.65 3.38 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 0.79 0.00 0.00 0.95 0.00 0.00 119 R 8.24 3.36 0.00 2.06 1.87 0.00 3.23 0.00 0.00 3.57 8.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.86 0.00 120 I 8.15 3.57 1.99 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 1.78 1.23 1.27 0.00 0.00 121 A 8.08 4.03 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.73 4.28 0.00 3.34 3.30 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.27 4.04 0.00 2.15 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 0.00 2.73 2.58 0.00 124 L 8.69 4.01 0.00 1.97 1.73 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 125 M 8.75 3.99 0.00 2.08 2.08 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 2.59 2.59 0.00 126 D 9.30 4.29 0.00 2.79 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 0.00 127 A 8.80 3.99 1.43 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 0.00 0.00 128 A 7.77 4.11 1.43 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 0.00 0.00 129 E 7.81 4.05 0.00 2.01 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 0.00 2.31 2.31 0.00 130 G 9.39 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 0.00 131 K 7.81 4.39 0.00 1.87 1.91 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.43 7.81 132 G 8.66 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 0.00 133 G 8.69 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 0.00 134 A 8.15 3.87 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.53 3.38 2.13 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 1.08 0.00 0.00 1.04 0.00 0.00 136 K 7.81 3.75 0.00 1.80 1.67 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.57 1.60 7.81 137 K 7.79 3.66 0.00 0.88 1.36 0.00 1.62 0.00 0.00 1.51 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.39 1.33 7.81 138 K 7.12 3.31 0.00 1.43 1.81 0.00 1.74 0.00 0.00 1.58 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.42 7.81 139 E 8.80 3.92 0.00 1.87 1.95 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 2.29 2.45 0.00 140 D 8.97 4.41 0.00 2.82 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 0.00 141 V 7.96 3.60 2.13 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 1.10 0.00 0.00 1.09 0.00 0.00 142 E 8.21 4.44 0.00 2.22 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 2.36 2.51 0.00 143 R 7.92 4.36 0.00 1.93 1.97 0.00 3.14 0.00 0.00 3.21 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.89 0.00 144 M 8.52 4.26 0.00 2.02 2.21 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.93 0.00 145 A 7.22 4.47 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 0.00 146 E 9.07 4.11 0.00 2.19 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 0.00 2.30 2.24 0.00 147 A 8.13 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.04 5.00 0.00 2.92 3.04 0.00 0.00 6.74 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.23 3.98 0.00 1.82 1.91 0.00 3.53 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 1.64 1.61 0.00 150 A 7.98 3.99 0.79 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 0.00 151 Y 7.39 3.97 0.00 2.90 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.45 4.21 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 0.00 153 H 8.37 4.34 0.00 3.27 3.36 0.00 5.50 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.61 4.96 0.00 3.27 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 0.00 155 R 8.25 4.16 0.00 1.92 2.03 0.00 3.26 0.00 0.00 3.34 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.96 0.00 156 W 9.40 4.57 0.00 3.55 2.97 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