NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1636 8.1727 122.0502 56.2850 34.1099 174.0362 2 V 4.5379 8.1657 127.1463 60.6940 32.3099 174.5093 3 F 4.3973 9.9039 128.7827 57.5821 40.2250 174.8743 4 E 4.3074 8.8705 120.4576 55.5089 31.1345 176.8413 5 R 3.3238 8.9712 121.0692 60.7453 29.8840 179.4988 6 C 4.3301 8.0177 115.2626 59.6474 37.8670 175.6953 7 E 3.8939 8.1176 120.6999 59.2491 29.2269 178.4853 8 L 3.5603 8.0083 120.0435 57.8221 42.0460 178.5630 9 A 3.9304 7.7811 120.6724 55.4914 18.4150 179.8946 10 R 3.8965 8.1421 116.4685 59.5429 30.0834 179.5450 11 T 3.8372 7.8017 115.5719 66.6715 68.5040 176.7226 12 L 3.8561 8.0033 121.1153 57.5607 41.5794 179.5055 13 K 3.9099 8.0136 119.6180 59.5782 31.9295 178.8925 14 R 3.9542 7.7099 117.6711 59.0110 30.0609 177.5434 15 L 4.3305 7.5190 116.2415 54.2845 41.7751 176.9468 16 G 3.8400 7.8096 107.0071 46.8928 0.0000 175.0603 17 M 3.8816 7.8782 121.1187 56.3798 32.3901 175.8422 18 D 4.3785 8.0091 118.0321 55.8680 41.1291 175.9034 19 G 3.9440 9.4208 115.8306 45.3422 0.0000 171.4598 20 Y 4.0981 8.1983 121.9418 58.7687 38.8532 176.3651 21 R 3.6479 8.9500 126.7149 57.2954 27.7692 177.2541 22 G 3.8019 8.3540 103.4646 45.7137 0.0000 174.0618 23 I 4.1221 7.6229 121.9130 58.9943 38.0623 175.8877 24 S 4.6159 8.3436 120.3961 57.7325 63.9586 174.9217 25 L 4.2111 9.0272 123.4500 58.6668 41.7579 179.3765 26 A 4.1748 8.1965 119.9527 55.2679 18.2654 179.2243 27 N 4.4636 8.2193 114.9921 56.2117 38.5522 177.7137 28 W 4.1655 7.9877 119.9882 59.9134 29.2341 178.3591 29 M 4.1644 8.4465 118.8156 58.5135 31.4986 177.9410 30 C 3.1110 8.0863 118.6022 59.0766 44.8680 175.2950 31 L 3.9447 8.0825 121.6253 58.2870 41.7055 178.8149 32 A 4.1538 8.3927 120.8042 54.9165 18.2807 179.3441 33 K 2.7462 8.0459 118.0343 59.4064 32.0026 179.1361 34 W 4.2521 7.5349 117.2259 59.3150 29.0411 178.4351 35 E 4.3051 8.3234 118.5113 58.7386 28.8931 177.8657 36 S 4.5281 7.9901 109.7428 56.5524 64.4777 174.5033 37 G 3.2009 8.0239 108.9546 46.9078 0.0000 173.3125 38 Y 3.6429 7.6458 113.4760 58.6219 34.9770 168.7189 39 N 5.3469 7.5370 118.4763 51.9614 39.9674 175.6987 40 T 4.0961 8.9586 117.6530 63.8771 69.1505 175.9137 41 R 4.4676 7.8570 116.6026 55.5773 29.9170 175.9867 42 A 4.3225 7.7271 121.8496 52.6712 19.2282 177.2146 43 T 4.9524 8.4690 111.9828 59.8612 72.2819 173.2520 44 N 4.8359 8.8400 122.1302 52.2054 41.9869 172.4359 45 Y 4.5749 8.7129 128.4038 57.4607 40.6889 173.9120 46 N 4.7122 8.4269 124.8397 51.1138 38.8010 175.0970 47 A 3.7262 8.4070 127.5176 54.9571 18.7623 179.1861 48 G 3.7662 8.0441 103.7767 48.0770 0.0000 173.6831 49 D 4.6811 7.3866 114.7274 52.0147 40.3904 175.8369 50 R 3.9726 8.1213 116.3944 56.8951 28.2269 175.8450 51 S 4.9175 7.7195 112.8743 57.2641 66.0937 172.9156 52 T 5.1078 8.7166 115.8442 61.9534 72.7226 172.7974 53 D 5.3768 8.9464 125.2673 53.2316 43.1474 175.0371 54 Y 4.8782 9.1612 121.2049 57.4045 41.3915 177.4834 55 G 4.4287 9.0575 112.3460 45.9120 0.0000 173.3472 56 I 3.9159 8.3144 116.9324 63.0415 37.8572 177.5088 57 F 4.7319 7.9886 115.3018 56.4111 39.7417 175.4897 58 Q 3.5695 7.8703 119.0751 57.1181 26.5454 173.9353 59 I 4.4137 8.1849 119.1465 60.9601 39.4663 176.7035 60 N 5.4577 9.1906 126.0893 53.3030 39.7057 175.7755 61 S 4.5643 9.2548 121.2455 60.9043 63.2780 175.5284 62 R 3.7130 8.8281 122.3906 58.5051 30.2956 178.1855 63 F 4.4732 7.9503 115.4257 57.1706 41.7675 176.7053 64 W 4.7020 8.0853 119.6599 57.5919 29.9914 173.6200 65 C 5.6014 7.9544 109.9312 53.5038 45.5878 172.2532 66 N 4.9006 8.9754 119.7920 52.1500 39.8031 174.8176 67 D 4.7980 8.5314 122.9311 52.2895 40.5116 177.8016 68 G 4.1203 8.4960 110.7292 45.9622 0.0000 174.8333 69 K 4.3688 7.9390 115.9029 56.7040 33.1211 176.0827 70 T 4.4072 7.7621 117.2873 61.6715 69.2558 172.9278 71 P 4.2454 0.0000 0.0000 63.7366 32.2259 176.4249 72 G 3.8886 8.3841 109.2403 46.6925 0.0000 172.3629 73 A 4.7208 7.5714 117.7171 50.1042 22.0462 177.2872 74 V 4.3234 8.4024 112.3071 59.1731 35.5745 175.9416 75 N 4.9878 8.0297 117.2569 51.9863 37.4947 174.5481 76 A 3.9517 8.9186 124.7691 54.8306 19.1440 178.5581 77 C 4.4861 8.4293 111.6066 57.5046 41.0668 173.0391 78 H 4.0865 7.9469 116.0573 56.6447 26.1914 174.4297 79 L 4.8300 8.3749 117.7201 52.8739 46.3506 176.6788 80 S 4.6598 8.3820 115.7650 58.0083 63.2751 175.9953 81 C 4.1594 8.6183 124.1576 59.4976 40.5296 176.3466 82 S 3.9113 7.6936 115.2317 61.2657 61.6547 175.9199 83 A 4.0933 7.8043 122.6461 54.5773 18.1502 177.9599 84 L 4.4581 7.6892 116.1962 55.0621 41.6627 177.6793 85 L 4.9995 7.8531 117.0592 54.5201 42.4695 176.7942 86 Q 4.3586 7.8126 117.7934 55.4083 29.5299 175.9353 87 D 4.4084 8.5147 119.7153 57.0819 41.1479 176.7226 88 N 4.5636 8.0330 118.2090 53.1886 39.0537 174.6696 89 I 4.1926 8.4699 119.0121 61.0452 38.0118 176.9114 90 A 3.9491 8.3434 124.6956 56.0189 18.1730 179.9894 91 D 4.2882 8.0811 116.3364 57.4349 40.9848 178.6608 92 A 4.1071 7.9986 120.8493 55.2001 18.4366 179.7444 93 V 3.4297 8.2849 116.9684 65.9831 31.7136 178.1268 94 A 3.8491 8.0336 120.6002 55.2883 18.1073 178.8458 95 C 4.2621 8.4148 116.8131 59.6222 39.2991 175.6177 96 A 3.9096 8.1012 122.5333 55.0575 17.6456 179.7426 97 K 3.7236 7.5817 116.1345 59.3571 32.3028 179.2784 98 R 4.0700 7.6897 118.5819 59.2831 30.1211 178.5159 99 V 2.2081 7.5355 118.2865 65.7786 31.0693 177.9769 100 V 3.8800 7.6658 109.7248 62.5324 31.2652 177.7433 101 R 4.1887 7.7121 118.4353 57.3977 30.4969 176.0581 102 D 4.7055 7.4547 118.8082 53.1174 41.6740 175.2933 103 P 4.2691 0.0000 0.0000 66.1788 31.2094 177.8987 104 Q 4.0109 8.1177 117.5756 56.6089 30.1191 177.0486 105 G 3.8228 7.9026 106.9472 46.8685 0.0000 176.4418 106 I 3.5488 7.8234 120.7823 63.5709 37.9075 177.8293 107 R 4.2067 7.2094 117.9663 57.8044 29.9399 177.5121 108 A 3.8819 7.6187 120.7552 54.0289 18.6285 177.4856 109 W 4.7220 8.0910 116.4711 55.2989 29.9287 177.3840 110 V 3.7293 8.7210 123.9022 66.0123 30.8919 177.5390 111 A 4.0515 8.3126 120.1430 54.8577 18.0832 179.2246 112 W 3.9656 8.4471 126.9653 60.6875 30.5632 178.4378 113 R 3.7131 8.1810 116.5103 59.2302 29.6355 178.4187 114 N 4.3647 7.8950 115.3200 55.5267 38.7618 176.8436 115 R 4.0886 7.5944 113.7009 56.0049 30.6144 175.7290 116 C 4.5374 7.6372 116.3562 58.0164 42.6880 174.3623 117 Q 3.2353 6.5268 119.0797 57.2904 28.6626 175.4037 118 N 4.1764 8.6599 120.4245 54.2633 36.1726 173.7644 119 R 4.4781 7.3344 115.5948 54.1354 32.9322 175.8287 120 D 4.5730 8.3661 118.7938 53.9028 40.0998 175.7733 121 V 4.4774 8.1312 118.4327 61.1014 32.4385 178.4349 122 R 4.0468 8.0139 121.6325 59.2584 29.9907 178.7209 123 Q 3.9531 8.2472 115.5172 59.4728 28.3255 178.6485 124 Y 4.2909 7.5304 114.6719 60.0291 38.0095 177.2064 125 V 4.3933 7.9359 110.7379 60.7161 33.0617 175.5590 126 Q 4.0484 7.6017 119.3896 57.2175 28.8027 176.9390 127 G 3.9395 8.8982 110.0449 46.1065 0.0000 174.5577 128 C 4.4494 7.9698 116.0992 56.5640 40.6782 173.9917 129 G 3.8404 8.1507 107.2044 46.8283 0.0000 174.1184 130 V 4.0122 7.8676 118.0147 61.0936 32.1511 175.8435 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 1 K 8.17 4.16 0.00 1.79 1.70 0.00 1.28 0.00 0.00 1.09 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.85 1.09 7.81 2 V 8.17 4.54 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 0.90 0.00 0.00 0.94 0.00 0.00 3 F 9.90 4.40 0.00 2.89 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 4 E 8.87 4.31 0.00 1.95 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 2.29 2.35 0.00 5 R 8.97 3.32 0.00 1.93 1.91 0.00 3.47 0.00 0.00 3.48 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.76 0.00 6 C 8.02 4.33 0.00 3.00 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 7 E 8.12 3.89 0.00 2.06 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 0.00 2.62 2.43 0.00 8 L 8.01 3.56 0.00 1.40 1.42 -0.03 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.78 3.93 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 10 R 8.14 3.90 0.00 1.99 1.99 0.00 3.14 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.80 3.84 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 1.19 0.00 0.00 12 L 8.00 3.86 0.00 1.74 1.59 0.97 0.87 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 13 K 8.01 3.91 0.00 1.93 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.71 3.95 0.00 1.99 2.07 0.00 3.30 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.52 4.33 0.00 1.68 1.55 0.84 0.91 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 16 G 7.81 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 17 M 7.88 3.88 0.00 1.29 1.95 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.23 0.00 18 D 8.01 4.38 0.00 2.67 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 19 G 9.42 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 20 Y 8.20 4.10 0.00 3.33 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 21 R 8.95 3.65 0.00 1.93 1.86 0.00 3.22 0.00 0.00 2.98 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.43 0.00 22 G 8.35 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 23 I 7.62 4.12 1.91 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.61 -0.21 0.00 0.00 24 S 8.34 4.62 0.00 4.07 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 25 L 9.03 4.21 0.00 2.08 1.82 0.98 1.10 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 26 A 8.20 4.17 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 27 N 8.22 4.46 0.00 2.84 2.73 0.00 0.00 6.90 7.17 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 28 W 7.99 4.17 0.00 3.55 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 29 M 8.45 4.16 0.00 2.18 2.36 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 30 C 8.09 3.11 0.00 2.53 3.12 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 0.00 31 L 8.08 3.94 0.00 1.83 1.81 0.63 -0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.39 4.15 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 33 K 8.05 2.75 0.00 1.46 1.74 0.00 0.68 0.00 0.00 1.13 0.00 0.00 2.61 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.99 0.21 7.81 34 W 7.53 4.25 0.00 3.35 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 35 E 8.32 4.31 0.00 2.02 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 0.00 2.57 2.38 0.00 36 S 7.99 4.53 0.00 4.06 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.02 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 0.00 0.00 0.00 38 Y 7.65 3.64 0.00 3.22 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 39 N 7.54 5.35 0.00 2.84 2.82 0.00 0.00 7.01 7.10 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 40 T 8.96 4.10 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 1.46 0.00 0.00 41 R 7.86 4.47 0.00 1.97 2.09 0.00 3.09 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 42 A 7.73 4.32 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 43 T 8.47 4.95 4.10 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 1.33 0.00 0.00 44 N 8.84 4.84 0.00 3.04 2.67 0.00 0.00 6.78 7.13 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 45 Y 8.71 4.57 0.00 3.08 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 46 N 8.43 4.71 0.00 2.64 2.59 0.00 0.00 6.56 7.42 0.00 0.00 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 A 8.41 3.73 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 48 G 8.04 3.77 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 0.00 0.00 0.00 49 D 7.39 4.68 0.00 2.70 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 50 R 8.12 3.97 0.00 2.04 2.20 0.00 3.13 0.00 0.00 3.20 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 51 S 7.72 4.92 0.00 3.92 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 52 T 8.72 5.11 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 0.61 0.00 0.00 53 D 8.95 5.38 0.00 2.70 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 54 Y 9.16 4.88 0.00 2.93 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 55 G 9.06 4.43 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 0.00 56 I 8.31 3.92 1.68 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 1.84 0.13 0.00 0.00 57 F 7.99 4.73 0.00 3.24 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 58 Q 7.87 3.57 0.00 2.53 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 6.82 0.00 0.00 0.00 0.00 0.00 2.52 2.70 0.00 59 I 8.18 4.41 2.15 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.05 1.13 0.00 0.00 60 N 9.19 5.46 0.00 3.10 3.09 0.00 0.00 6.97 7.22 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 61 S 9.25 4.56 0.00 4.06 4.41 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 62 R 8.83 3.71 0.00 1.55 1.30 0.00 2.62 0.00 0.00 2.81 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.96 0.00 63 F 7.95 4.47 0.00 1.57 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 0.00 0.00 0.00 64 W 8.09 4.70 0.00 3.59 3.32 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 65 C 7.95 5.60 0.00 3.16 3.09 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 0.00 0.00 0.00 0.00 66 N 8.98 4.90 0.00 2.78 2.70 0.00 0.00 7.07 8.43 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 67 D 8.53 4.80 0.00 2.89 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 68 G 8.50 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 0.00 0.00 0.00 0.00 69 K 7.94 4.37 0.00 1.93 1.94 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.47 7.81 70 T 7.76 4.41 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 1.15 0.00 0.00 71 P 0.00 4.25 0.00 2.01 1.97 0.00 3.81 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 72 G 8.38 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 0.00 0.00 0.00 73 A 7.57 4.72 1.17 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 0.00 0.00 0.00 0.00 0.00 74 V 8.40 4.32 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 0.63 0.00 0.00 0.84 0.00 0.00 75 N 8.03 4.99 0.00 2.78 2.64 0.00 0.00 6.76 7.99 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 76 A 8.92 3.95 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 77 C 8.43 4.49 0.00 3.39 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 78 H 7.95 4.09 0.00 3.35 3.37 0.00 5.62 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.37 4.83 0.00 1.67 1.50 0.97 0.77 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 80 S 8.38 4.66 0.00 3.83 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 81 C 8.62 4.16 0.00 2.20 1.30 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 0.00 82 S 7.69 3.91 0.00 3.79 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 83 A 7.80 4.09 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 84 L 7.69 4.46 0.00 1.94 1.81 1.06 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.85 5.00 0.00 1.80 1.72 1.11 0.95 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 86 Q 7.81 4.36 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 87 D 8.51 4.41 0.00 2.65 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 88 N 8.03 4.56 0.00 2.70 2.76 0.00 0.00 6.97 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 89 I 8.47 4.19 1.78 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.00 0.98 0.00 0.00 90 A 8.34 3.95 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 91 D 8.08 4.29 0.00 2.72 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.00 4.11 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 93 V 8.28 3.43 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 0.71 0.00 0.00 0.94 0.00 0.00 94 A 8.03 3.85 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 95 C 8.41 4.26 0.00 3.07 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 96 A 8.10 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.58 3.72 0.00 1.63 1.38 0.00 1.28 0.00 0.00 0.88 0.00 0.00 2.23 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.69 4.07 0.00 2.00 2.15 0.00 3.29 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 1.84 2.00 0.00 99 V 7.54 2.21 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.28 0.00 0.00 -0.79 0.00 0.00 100 V 7.67 3.88 2.14 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 1.16 0.00 0.00 1.44 0.00 0.00 101 R 7.71 4.19 0.00 2.22 2.02 0.00 3.34 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.78 0.00 102 D 7.45 4.71 0.00 3.11 2.59 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 0.00 103 P 0.00 4.27 0.00 2.15 2.19 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 104 Q 8.12 4.01 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.77 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.90 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 0.00 0.00 0.00 106 I 7.82 3.55 1.02 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 -0.30 -0.26 -0.55 0.00 0.00 107 R 7.21 4.21 0.00 1.96 2.02 0.00 3.20 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.46 0.00 108 A 7.62 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.09 4.72 0.00 3.52 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 0.00 110 V 8.72 3.73 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 1.09 0.00 0.00 0.99 0.00 0.00 111 A 8.31 4.05 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.45 3.97 0.00 3.44 3.46 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 0.00 113 R 8.18 3.71 0.00 2.09 1.99 0.00 3.54 0.00 0.00 3.42 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.11 0.00 114 N 7.90 4.36 0.00 2.69 2.70 0.00 0.00 6.93 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.59 4.09 0.00 0.92 0.85 0.00 2.73 0.00 0.00 2.85 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.89 0.00 116 C 7.64 4.54 0.00 1.70 2.71 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 0.00 117 Q 6.53 3.24 0.00 0.93 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.88 0.00 0.00 0.00 0.00 0.00 2.15 2.25 0.00 118 N 8.66 4.18 0.00 2.80 2.82 0.00 0.00 6.89 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 0.00 119 R 7.33 4.48 0.00 1.79 1.81 0.00 3.16 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.38 0.00 120 D 8.37 4.57 0.00 2.63 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 0.00 121 V 8.13 4.48 2.43 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 0.97 0.00 0.00 1.06 0.00 0.00 122 R 8.01 4.05 0.00 1.99 2.02 0.00 3.32 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 1.69 1.63 0.00 123 Q 8.25 3.95 0.00 2.02 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.89 0.00 0.00 0.00 0.00 0.00 2.03 1.37 0.00 124 Y 7.53 4.29 0.00 3.23 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 0.00 125 V 7.94 4.39 2.14 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 1.10 0.00 0.00 1.07 0.00 0.00 126 Q 7.60 4.05 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.85 0.00 0.00 0.00 0.00 0.00 2.48 2.45 0.00 127 G 8.90 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 0.00 128 C 7.97 4.45 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 0.00 129 G 8.15 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 0.00 130 V 7.87 4.01 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 0.76 0.00 0.00 0.96 0.00 0.00