NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.5108 8.3144 120.0851 56.2212 33.8227 174.2598 4 K 4.3897 8.5832 126.1031 54.1826 34.5425 173.3834 5 I 4.7622 8.2284 128.7623 60.8654 38.3795 174.6284 6 I 4.8187 9.1295 120.0977 59.3206 41.8147 174.6583 7 T 4.9620 8.8010 117.8437 62.0819 71.8633 173.2480 8 V 4.5760 8.7164 126.9850 60.9762 34.8130 174.3566 9 N 5.1120 8.9242 125.4526 52.4461 39.7212 174.1482 10 V 4.6615 8.8963 125.7320 61.1755 33.7767 175.5863 11 N 3.9402 10.0403 127.5895 54.4884 36.4554 175.5890 12 G 3.9561 8.5569 104.3978 45.0660 0.0000 173.4790 13 K 4.6952 7.7024 121.1134 54.0343 35.1472 175.1193 14 A 4.5719 8.6567 128.8180 52.2327 19.5299 177.1359 15 Q 4.3309 9.1690 120.2970 54.1521 32.2389 173.9940 16 E 4.9404 8.7976 126.0889 55.1106 30.4028 175.2829 17 K 4.8744 9.2333 125.6923 54.7095 37.4058 175.2129 18 A 5.1239 8.6488 123.5232 50.7007 20.3904 176.7377 19 V 4.5990 8.4831 115.5148 59.6362 36.0419 175.5284 20 E 4.5173 8.6623 122.8181 55.3331 30.2782 176.2525 21 P 4.2490 0.0000 0.0000 65.7065 31.4760 177.8414 22 R 4.0732 7.8405 112.1476 57.7104 30.0796 176.6308 23 T 3.9702 7.8256 117.6705 63.4694 68.8004 173.7891 24 L 4.5312 8.5102 127.1779 54.2536 43.5993 177.6562 25 L 4.0139 8.8699 125.0691 58.6171 41.9659 179.4719 26 I 3.6634 7.9913 118.3962 64.4981 37.8216 177.6306 27 H 4.3644 8.1402 116.5733 58.4178 28.6386 177.4179 28 F 4.1430 8.3579 122.7305 61.3029 39.3000 177.2064 29 L 3.8773 8.4071 118.9639 57.8139 41.5436 179.7505 30 R 4.0648 8.0215 117.8316 58.8956 29.9910 178.6243 31 E 4.0921 8.5178 117.3477 58.3212 29.9345 177.5729 32 E 3.9927 7.7486 118.6194 58.4060 29.8628 177.1398 33 L 4.1827 7.3113 114.7764 54.0247 42.3514 176.2417 34 N 4.7611 7.7461 113.7705 53.7590 35.8906 175.2669 35 L 4.3557 8.0460 120.5272 54.0859 40.0497 176.4675 36 T 4.3286 7.8631 108.4016 61.5918 69.4062 177.2038 37 G 3.4725 8.4993 112.7789 48.9011 0.0000 174.8838 38 A 3.9392 7.6667 121.4226 51.9784 18.9777 176.1405 39 H 4.9348 8.5659 118.0109 53.8607 32.6744 173.1384 40 I 4.5742 8.4380 119.4048 59.8908 39.0033 176.1927 41 G 4.2275 8.9889 114.3054 45.3497 0.0000 171.3486 42 C 4.6781 7.7002 112.8123 57.8246 32.0164 173.1726 43 E 4.6511 8.7716 114.9678 56.2577 29.6556 176.2479 44 T 4.4002 7.8302 107.6078 61.3934 69.2745 174.4393 45 S 3.9345 8.1574 115.8341 60.3257 60.1354 171.3716 46 H 4.6026 8.3813 118.3033 58.2764 29.4702 176.4583 47 C 4.1405 8.2650 114.0303 60.0537 29.4177 175.2899 48 G 3.9704 8.5758 105.7722 46.2381 0.0000 174.5260 49 A 4.1756 7.9504 122.2911 53.1614 18.6843 179.1824 50 C 4.5744 7.7511 109.8587 57.6806 30.5087 173.4508 51 T 4.2742 7.2827 118.2264 64.9129 68.4393 173.7756 52 V 4.5341 8.8732 118.5016 59.6141 36.9834 173.7601 53 D 5.2089 8.6039 121.7508 53.1145 42.7743 175.0389 54 I 4.7411 8.8699 127.2307 59.9274 40.1549 175.8650 55 D 4.3907 9.8680 129.4530 55.4669 38.7435 174.8696 56 G 4.0186 8.3690 103.8473 45.5344 0.0000 172.9408 57 R 4.8049 7.8544 117.8971 54.0902 34.7302 174.6662 58 S 4.8687 8.6610 117.8642 58.4579 63.6793 173.9690 59 V 4.4249 8.8372 124.3759 60.9573 35.4033 174.6942 60 K 4.6366 8.6775 126.9202 55.3975 32.2902 177.8378 61 S 4.2218 8.6551 121.6226 60.1923 62.9291 175.7751 62 C 4.4552 7.9086 114.7049 59.4471 30.0959 173.6702 63 T 4.7243 7.9343 117.9836 62.9677 69.2349 173.1718 64 H 4.8450 7.9309 118.7185 54.7266 33.3682 171.6146 65 L 4.8611 8.5470 125.4208 53.0075 43.2283 177.7291 66 A 3.8267 8.5042 126.2709 55.1814 18.2255 180.4322 67 V 3.5620 7.6507 114.8389 64.7086 31.4012 177.9868 68 Q 4.0986 7.6813 118.1149 57.9079 28.8171 176.2811 69 C 4.6218 8.1271 115.6759 58.6381 28.1456 172.4952 70 D 4.3927 7.4108 119.8111 55.9224 40.6240 176.5267 71 G 3.8987 9.4481 115.4166 45.6661 0.0000 172.9095 72 S 4.7512 8.0957 116.5329 57.4519 65.4139 172.8466 73 E 4.7980 9.8968 123.1547 54.8366 31.2248 174.5977 74 V 4.9693 9.0341 127.9172 60.9302 34.6807 173.9554 75 L 5.2831 8.9296 129.1799 53.4780 45.3725 175.2458 76 T 4.9320 9.3024 115.7136 59.3119 72.1696 175.2645 77 V 3.5405 8.2377 119.8252 64.6569 31.4438 178.2675 78 E 3.9313 7.6536 118.9119 58.4565 29.2897 177.7689 79 G 3.9398 7.6011 105.6835 45.2118 0.0000 174.8245 80 L 3.8276 7.7401 120.6204 57.4499 41.7730 177.9888 81 A 4.1111 7.7895 119.7515 52.2577 18.9872 176.3225 82 N 4.7033 9.0928 120.4050 52.2216 39.6694 174.3624 83 K 3.9205 9.8070 127.6119 57.2526 30.7241 175.6583 84 G 3.9926 8.5430 106.6423 44.8631 0.0000 174.6964 85 V 3.8153 7.6990 120.4943 61.8392 31.7790 175.5087 86 L 4.4533 8.4240 127.4283 55.2555 42.3069 177.1308 87 H 4.5129 9.3612 121.0191 55.4323 31.8743 176.1274 88 A 4.0996 8.3437 127.5705 55.9206 18.0991 180.7156 89 V 3.9012 8.3142 110.0171 64.7329 31.6039 178.6904 90 Q 4.0409 8.2277 117.4060 58.9536 28.5520 178.2951 91 E 4.2218 8.7357 120.6726 59.2008 29.7162 179.0150 92 G 3.5367 8.7347 106.2065 48.0164 0.0000 175.7317 93 F 4.0111 8.6875 120.4363 60.0651 38.7079 177.2641 94 Y 4.2947 8.0372 119.1785 60.8210 38.5116 177.9415 95 K 3.4342 7.8814 118.3126 59.1688 32.1556 177.8672 96 E 4.2367 7.9478 115.6024 55.4518 29.7748 175.8837 97 H 4.0465 7.5672 117.1724 57.3706 28.4751 174.7371 98 G 3.9431 8.6479 104.1262 45.0237 0.0000 172.7548 99 L 4.6582 7.4191 117.6709 54.3730 41.2839 173.2484 100 Q 4.5160 7.9114 115.8162 57.4062 32.0934 177.0101 101 C 4.1719 8.1681 119.7240 59.5281 30.5837 175.4371 102 G 4.4586 7.8832 108.2435 46.7749 0.0000 175.2048 103 F 3.9819 8.3257 122.9374 60.7489 39.7340 175.8606 104 C 4.4050 8.0750 113.4599 59.2798 30.7468 175.3461 105 T 3.7373 7.5783 118.3255 66.5151 68.0301 174.1846 106 P 4.1912 0.0000 0.0000 65.5636 31.3533 178.9314 107 G 3.5412 7.8274 103.9171 47.8973 0.0000 175.5188 108 M 4.1234 8.1075 121.1486 58.1692 31.9227 178.8529 109 L 3.7165 7.9409 119.4058 58.0792 41.5506 179.6017 110 M 4.0494 8.0425 118.5582 58.0623 31.7889 178.9632 111 R 3.9900 8.1655 118.7797 59.5267 30.4142 178.3156 112 A 4.2918 8.5484 121.0438 55.5211 18.1164 178.8849 113 Y 4.0503 8.2700 117.5470 60.6348 39.1166 177.9735 114 R 3.9076 7.7361 118.0353 58.9037 30.4081 177.9252 115 F 4.6551 8.7582 122.1076 60.8911 38.8392 177.0850 116 L 4.0702 8.2649 117.9966 57.1827 41.1219 179.0003 117 Q 4.0844 7.5788 117.0972 57.8694 29.0366 177.6062 118 E 4.3321 7.7048 119.5366 57.8099 29.7768 175.4772 119 N 4.7318 7.7841 117.7588 51.2979 39.8692 171.8864 120 P 4.4540 0.0000 0.0000 63.8685 32.2770 176.9227 121 N 5.0428 7.5056 112.8688 50.5463 36.7417 172.3621 122 P 4.7179 0.0000 0.0000 63.2596 33.1061 177.5162 123 T 4.3946 8.6115 111.3927 60.6054 71.4499 175.6203 124 E 3.8969 8.6036 120.5386 59.4340 29.6224 178.3589 125 A 3.9776 7.9865 120.2648 55.3414 18.4645 179.3434 126 E 4.0535 8.1312 116.6721 59.3204 29.5359 179.7308 127 I 3.4420 7.9635 120.1227 64.4395 37.0473 178.4626 128 R 3.8048 7.8850 117.6929 59.6113 30.2873 178.5721 129 M 4.2103 8.1653 117.9311 58.4431 32.1112 178.2574 130 G 3.4372 8.0407 104.3474 46.3888 0.0000 173.8685 131 M 4.5517 7.2230 120.0183 55.0702 32.5566 177.8183 132 T 3.8183 7.6690 111.4445 64.3828 68.6714 175.4093 133 G 3.8084 8.0623 109.4236 46.2104 0.0000 171.9971 134 N 5.4489 8.0082 118.0239 51.4563 40.5745 174.1974 135 L 5.0131 8.9765 124.4422 53.6410 43.8077 175.7450 136 C 4.8066 8.9980 121.7131 58.0570 34.0405 174.1080 137 R 4.3939 8.8697 123.2597 56.7066 30.8750 176.6907 138 C 4.5863 7.8956 114.3895 61.0006 30.0240 175.1770 139 T 3.8833 7.7085 108.2719 62.2280 69.0529 175.7657 140 G 3.7929 8.0867 109.1720 45.4026 0.0000 175.2402 141 Y 3.8082 7.4136 121.0061 59.3879 38.0701 171.6723 142 Q 3.9923 8.4510 120.5948 59.7584 28.9079 178.8955 143 N 4.3367 8.0639 116.3549 56.0302 38.6214 177.3949 144 I 3.2379 7.5086 121.0987 63.9788 37.1362 178.3511 145 V 3.5575 7.8689 119.1283 66.0853 31.3391 178.3595 146 K 3.9774 7.8030 118.0114 59.1955 31.7481 179.3158 147 A 3.9589 7.8877 121.5087 55.0140 18.1381 179.8789 148 V 3.6826 7.8100 116.8462 66.2599 31.6167 178.2945 149 Q 4.0427 8.3624 117.9922 59.0720 28.4114 178.1210 150 Y 3.9190 8.4083 120.5504 60.7291 38.8702 178.0807 151 A 4.1830 8.5838 121.5955 55.0969 18.0065 179.4898 152 A 3.9824 8.3444 119.5415 55.4141 18.2275 180.1299 153 R 3.8858 7.7604 115.7855 59.0792 30.2612 178.7941 154 K 4.0429 7.7478 119.3014 58.7998 31.9881 178.7654 155 L 4.1144 7.8347 118.5088 56.6394 41.5410 178.1637 156 Q 4.5051 7.2658 114.9416 55.4616 29.1019 175.1716 157 E 4.1283 7.6479 127.3921 56.3749 29.6781 175.9055 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 K 8.31 4.51 0.00 1.66 1.83 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.56 7.81 4 K 8.58 4.39 0.00 1.79 1.61 0.00 1.60 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.47 7.81 5 I 8.23 4.76 1.87 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 1.41 0.66 0.92 0.00 0.00 6 I 9.13 4.82 1.80 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.69 0.89 0.00 0.00 7 T 8.80 4.96 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 1.22 0.00 0.00 8 V 8.72 4.58 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 1.10 0.00 0.00 0.85 0.00 0.00 9 N 8.92 5.11 0.00 2.96 2.86 0.00 0.00 6.24 6.98 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 10 V 8.90 4.66 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 0.99 0.00 0.00 1.05 0.00 0.00 11 N 10.04 3.94 0.00 2.82 2.83 0.00 0.00 7.18 7.43 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 12 G 8.56 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 13 K 7.70 4.70 0.00 1.82 1.62 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.35 7.81 14 A 8.66 4.57 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 15 Q 9.17 4.33 0.00 2.19 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.82 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 16 E 8.80 4.94 0.00 2.00 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 2.27 2.46 0.00 17 K 9.23 4.87 0.00 1.88 1.83 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.52 1.83 7.81 18 A 8.65 5.12 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 19 V 8.48 4.60 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 0.83 0.00 0.00 20 E 8.66 4.52 0.00 2.01 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 0.00 2.41 2.28 0.00 21 P 0.00 4.25 0.00 2.02 2.11 0.00 3.67 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 2.02 2.07 0.00 22 R 7.84 4.07 0.00 1.92 2.05 0.00 3.04 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 1.60 1.66 0.00 23 T 7.83 3.97 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 1.35 0.00 0.00 24 L 8.51 4.53 0.00 1.86 1.63 1.01 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 25 L 8.87 4.01 0.00 1.78 1.93 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.99 3.66 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.96 0.82 0.00 0.00 27 H 8.14 4.36 0.00 3.48 3.37 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 8.36 4.14 0.00 3.17 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 29 L 8.41 3.88 0.00 1.87 1.68 0.95 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.02 4.06 0.00 1.95 1.96 0.00 3.32 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.72 0.00 31 E 8.52 4.09 0.00 2.03 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 2.44 2.48 0.00 32 E 7.75 3.99 0.00 1.70 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 2.06 1.97 0.00 33 L 7.31 4.18 0.00 1.63 1.55 0.85 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 34 N 7.75 4.76 0.00 2.81 2.87 0.00 0.00 7.27 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 35 L 8.05 4.36 0.00 1.65 1.79 0.88 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.86 4.33 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 1.20 0.00 0.00 37 G 8.50 3.47 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 0.00 38 A 7.67 3.94 1.14 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 39 H 8.57 4.93 0.00 2.31 2.24 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 I 8.44 4.57 1.97 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.61 0.97 0.00 0.00 41 G 8.99 4.23 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 0.00 0.00 0.00 42 C 7.70 4.68 0.00 3.11 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 43 E 8.77 4.65 0.00 2.08 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 2.18 2.22 0.00 44 T 7.83 4.40 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 45 S 8.16 3.93 0.00 4.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 H 8.38 4.60 0.00 3.14 3.37 0.00 5.91 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 47 C 8.27 4.14 0.00 3.18 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 48 G 8.58 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.95 4.18 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 50 C 7.75 4.57 0.00 3.08 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 51 T 7.28 4.27 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 1.22 0.00 0.00 52 V 8.87 4.53 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.92 0.00 0.00 53 D 8.60 5.21 0.00 2.89 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 54 I 8.87 4.74 1.81 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.52 0.87 0.00 0.00 55 D 9.87 4.39 0.00 2.72 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.37 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.85 4.80 0.00 1.73 1.79 0.00 3.13 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 58 S 8.66 4.87 0.00 3.80 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 59 V 8.84 4.42 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 0.99 0.00 0.00 0.94 0.00 0.00 60 K 8.68 4.64 0.00 1.76 1.76 0.00 1.73 0.00 0.00 1.92 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.44 7.81 61 S 8.66 4.22 0.00 4.08 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 C 7.91 4.46 0.00 3.11 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 7.93 4.72 4.26 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 1.22 0.00 0.00 64 H 7.93 4.85 0.00 3.15 3.08 0.00 5.85 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.55 4.86 0.00 1.63 1.48 0.90 0.66 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 66 A 8.50 3.83 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 67 V 7.65 3.56 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 0.74 0.00 0.00 0.88 0.00 0.00 68 Q 7.68 4.10 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.26 0.00 0.00 0.00 0.00 0.00 2.31 2.20 0.00 69 C 8.13 4.62 0.00 2.98 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 70 D 7.41 4.39 0.00 2.71 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 71 G 9.45 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 0.00 0.00 0.00 72 S 8.10 4.75 0.00 3.91 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 73 E 9.90 4.80 0.00 2.04 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 2.22 2.27 0.00 74 V 9.03 4.97 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 0.91 0.00 0.00 0.94 0.00 0.00 75 L 8.93 5.28 0.00 1.66 1.33 0.47 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 76 T 9.30 4.93 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 77 V 8.24 3.54 1.94 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 0.64 0.00 0.00 0.80 0.00 0.00 78 E 7.65 3.93 0.00 2.03 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 2.29 2.24 0.00 79 G 7.60 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 80 L 7.74 3.83 0.00 1.69 1.76 0.77 0.24 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 81 A 7.79 4.11 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 82 N 9.09 4.70 0.00 2.68 2.71 0.00 0.00 6.85 6.46 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 83 K 9.81 3.92 0.00 1.90 1.83 0.00 1.82 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.41 7.81 84 G 8.54 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 85 V 7.70 3.82 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 0.98 0.00 0.00 0.94 0.00 0.00 86 L 8.42 4.45 0.00 1.73 1.65 0.90 1.15 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 87 H 9.36 4.51 0.00 3.39 3.28 0.00 5.62 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 88 A 8.34 4.10 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.31 3.90 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 1.06 0.00 0.00 1.03 0.00 0.00 90 Q 8.23 4.04 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.91 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 91 E 8.74 4.22 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 92 G 8.73 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.69 4.01 0.00 3.16 3.20 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 94 Y 8.04 4.29 0.00 2.96 3.16 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 95 K 7.88 3.43 0.00 0.93 1.35 0.00 1.59 0.00 0.00 1.34 0.00 0.00 3.01 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.34 0.99 7.81 96 E 7.95 4.24 0.00 1.89 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 2.08 2.43 0.00 97 H 7.57 4.05 0.00 3.06 3.24 0.00 5.94 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.65 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 99 L 7.42 4.66 0.00 1.80 1.77 0.98 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 7.91 4.52 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.95 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 101 C 8.17 4.17 0.00 3.09 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 G 7.88 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 F 8.33 3.98 0.00 2.94 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 0.00 104 C 8.07 4.41 0.00 3.27 3.24 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 0.00 105 T 7.58 3.74 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 1.07 0.00 0.00 106 P 0.00 4.19 0.00 1.93 1.91 0.00 3.56 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 107 G 7.83 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 M 8.11 4.12 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.91 0.00 109 L 7.94 3.72 0.00 1.57 1.52 0.69 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 110 M 8.04 4.05 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.77 0.00 111 R 8.17 3.99 0.00 2.03 2.13 0.00 3.23 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 112 A 8.55 4.29 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 0.00 113 Y 8.27 4.05 0.00 2.91 3.25 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 0.00 114 R 7.74 3.91 0.00 2.26 2.12 0.00 3.30 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 115 F 8.76 4.66 0.00 3.13 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 0.00 116 L 8.26 4.07 0.00 2.01 1.67 1.10 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 7.58 4.08 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 118 E 7.70 4.33 0.00 1.96 1.90 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 2.37 2.54 0.00 119 N 7.78 4.73 0.00 2.25 1.78 0.00 0.00 7.28 7.27 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 0.00 120 P 0.00 4.45 0.00 2.01 2.03 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 121 N 7.51 5.04 0.00 2.78 2.76 0.00 0.00 7.02 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.72 0.00 2.48 2.14 0.00 3.77 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 123 T 8.61 4.39 4.26 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 1.27 0.00 0.00 124 E 8.60 3.90 0.00 2.07 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 2.38 2.39 0.00 125 A 7.99 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.13 4.05 0.00 2.44 2.22 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 2.39 2.40 0.00 127 I 7.96 3.44 2.04 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.33 0.86 0.00 0.00 128 R 7.89 3.80 0.00 1.70 1.90 0.00 3.13 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 129 M 8.17 4.21 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 130 G 8.04 3.44 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 0.00 131 M 7.22 4.55 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 132 T 7.67 3.82 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 1.24 0.00 0.00 133 G 8.06 3.81 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 0.00 0.00 0.00 134 N 8.01 5.45 0.00 2.81 2.81 0.00 0.00 6.87 7.88 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 0.00 135 L 8.98 5.01 0.00 1.59 1.71 0.99 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 136 C 9.00 4.81 0.00 2.74 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 0.00 0.00 0.00 137 R 8.87 4.39 0.00 1.83 1.93 0.00 3.39 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 138 C 7.90 4.59 0.00 2.89 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 T 7.71 3.88 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 140 G 8.09 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 0.00 0.00 0.00 141 Y 7.41 3.81 0.00 3.24 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 0.00 142 Q 8.45 3.99 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 143 N 8.06 4.34 0.00 2.67 2.98 0.00 0.00 7.09 7.29 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 0.00 144 I 7.51 3.24 2.09 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.57 0.94 0.00 0.00 145 V 7.87 3.56 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 1.11 0.00 0.00 0.99 0.00 0.00 146 K 7.80 3.98 0.00 1.89 1.84 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.63 7.81 147 A 7.89 3.96 0.66 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 0.00 0.00 148 V 7.81 3.68 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 1.25 0.00 0.00 1.06 0.00 0.00 149 Q 8.36 4.04 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 150 Y 8.41 3.92 0.00 3.13 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 0.00 151 A 8.58 4.18 1.64 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 0.00 0.00 152 A 8.34 3.98 1.49 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 0.00 153 R 7.76 3.89 0.00 1.78 1.86 0.00 3.07 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 154 K 7.75 4.04 0.00 1.57 1.77 0.00 1.71 0.00 0.00 1.75 0.00 0.00 3.30 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.41 7.81 155 L 7.83 4.11 0.00 1.82 1.70 0.97 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 156 Q 7.27 4.51 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 157 E 7.65 4.13 0.00 2.01 1.94 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 2.26 2.21 0.00