NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 N 4.8504 8.4249 119.2047 54.1553 41.4629 174.9406 8 S 4.4572 7.9644 124.2724 57.0482 70.0800 175.8542 9 F 5.1008 9.4688 125.4485 57.5194 38.7738 176.4448 10 V 4.0060 8.0082 112.0460 63.5349 31.4619 176.7960 11 G 4.3551 7.6486 106.6211 45.2828 0.0000 173.0533 12 L 4.3341 8.4088 122.0765 55.1001 44.0216 175.4096 13 R 4.7617 8.3585 120.3103 54.6557 32.0183 176.0424 14 V 5.3461 8.4498 116.5934 58.5614 36.1728 174.8914 15 V 4.7542 8.0200 113.4852 59.5580 35.3493 175.1468 16 A 4.5432 8.9276 125.1623 50.0739 21.5948 175.2033 17 K 4.7962 8.3622 121.1355 55.6339 35.3644 177.5901 18 W 4.5110 9.3899 125.4604 58.6194 29.8725 176.6208 19 S 4.8400 7.9729 110.7974 56.2866 64.7293 173.9854 20 S 4.4497 8.5434 118.9569 58.4725 62.0968 173.5151 21 N 4.8673 8.8960 120.8716 52.5322 40.1880 175.4718 22 G 3.9993 9.0629 108.8933 44.8568 0.0000 172.9215 23 Y 5.2478 7.1046 115.4795 55.2547 41.2172 174.7037 24 F 5.2606 8.4838 119.4130 56.3225 42.9113 174.9397 25 Y 4.4381 8.8168 120.0040 56.9410 40.7417 174.0669 26 S 5.0362 8.6848 113.9387 57.1186 64.8382 173.4627 27 G 4.1822 8.6858 111.5925 44.3601 0.0000 171.2045 28 K 5.0313 9.0644 119.0670 54.8002 35.8267 176.0906 29 I 4.5028 8.6581 117.6160 61.2103 38.9288 176.2426 30 T 4.5302 8.9159 119.8115 65.0921 70.7531 174.6031 31 R 4.7469 7.7084 117.4504 55.3004 35.1046 173.3190 32 D 5.0740 8.5563 120.3474 53.2166 42.8435 175.6436 33 V 4.0543 8.1553 118.7867 60.8377 33.6334 175.9413 34 G 3.5808 8.4067 114.0974 46.6206 0.0000 173.1475 35 A 4.3436 8.4070 128.5559 53.0187 19.9061 176.8761 36 G 3.8641 8.8645 112.2582 44.9254 0.0000 172.4521 37 K 4.7323 6.5801 117.1010 55.4405 35.4183 175.4719 38 Y 4.7467 8.3871 117.1873 56.2230 42.7796 174.4186 39 K 4.6193 9.1399 125.4939 54.7449 34.0310 174.7307 40 L 5.3472 8.9009 127.4047 53.9447 44.5928 175.0742 41 L 5.4372 8.8715 121.2732 53.1305 45.6662 176.1980 42 F 4.6581 9.5151 124.3006 57.2444 39.4451 176.2991 43 D 4.5271 8.8265 122.7697 55.4496 39.0807 176.6423 44 D 4.8696 8.5265 117.5171 52.9827 40.2492 176.1785 45 G 3.9355 9.2221 108.4362 46.7086 0.0000 173.7593 46 Y 4.4439 8.3045 120.9762 55.3846 39.8396 173.4633 47 E 5.0380 8.0650 127.7791 55.1835 31.6063 174.2001 48 C 4.7640 8.3324 117.4930 58.0638 33.6471 171.7738 49 D 5.4115 8.7094 117.8796 52.8614 43.6274 175.9907 50 V 4.6530 8.4969 114.4199 59.9086 36.7710 173.7176 51 L 4.4454 8.5122 123.5858 54.3764 43.1389 177.9702 52 G 3.7278 9.0452 115.0881 48.1739 0.0000 175.5152 53 K 4.1082 8.2075 116.5362 58.3657 32.0385 176.1471 54 D 4.8657 7.2955 117.4908 53.5282 42.6791 175.5737 55 I 4.9822 7.9308 127.8998 58.8410 39.5665 174.2855 56 L 4.1337 7.8672 126.5781 52.6893 44.9829 174.8371 57 L 3.5641 7.3042 119.8834 56.7439 40.8072 175.3409 58 C 5.0914 8.5580 124.0448 57.4991 34.6533 173.3066 59 D 4.3963 8.6864 119.5283 56.0223 40.4820 174.9348 60 P 4.0942 0.0000 0.0000 64.4165 31.4543 175.7962 61 I 4.6836 7.2433 119.8224 57.2462 41.3852 173.9587 62 P 4.1643 0.0000 0.0000 63.1979 31.3964 177.5423 63 L 4.0234 8.5843 122.2275 56.3419 41.9827 177.2451 64 D 4.7705 8.6044 117.2047 54.4728 43.1091 175.4568 65 T 4.3248 7.7640 117.1760 61.5854 70.4881 173.6433 66 E 4.4645 8.8692 128.5242 56.6839 28.9567 176.0616 67 V 4.3193 8.7982 120.4761 59.5569 35.5073 174.2439 68 T 4.7280 7.8465 115.7440 60.7622 69.0639 173.0465 69 A 5.1185 8.6048 129.3952 49.7078 21.6076 176.4672 70 L 4.3008 8.7530 124.3388 55.5041 41.5710 176.1405 71 S 4.8019 8.4170 119.3890 55.4910 66.7109 173.3093 72 E 3.9300 8.5778 118.5951 55.6722 30.1212 177.6726 73 D 3.9141 8.7832 119.2751 57.1537 41.0445 177.3110 74 E 4.1464 7.4778 113.5098 56.1233 30.5392 175.8564 75 Y 4.6819 6.8864 114.7363 57.0198 39.1687 175.7122 76 F 4.4466 7.4377 115.6090 57.4881 38.5434 174.6248 77 S 5.0033 8.9901 117.4752 56.8397 66.1611 173.2130 78 A 5.4151 7.9277 123.4840 50.9215 20.4959 176.4693 79 G 4.0714 8.2278 105.2108 45.5254 0.0000 171.9079 80 V 4.7201 8.3775 120.9576 60.7388 33.3739 175.4777 81 V 3.9698 8.6019 122.6890 62.0295 31.8932 176.3039 82 K 4.2911 8.5345 122.5771 57.3097 35.3014 177.1737 83 G 4.1558 7.5535 106.5421 44.5441 0.0000 171.2542 84 H 5.8766 8.5086 119.0271 54.4890 31.9359 172.3246 85 R 4.7352 8.9054 114.7042 55.1206 33.2653 173.6012 86 K 4.6382 8.3151 120.2159 54.8144 35.2524 175.0460 87 E 4.5937 8.9120 127.8324 54.2706 32.2468 175.9178 88 S 4.5983 8.1938 118.7836 57.1909 60.3501 174.3852 89 G 4.2270 8.0976 106.2286 45.1812 0.0000 171.4450 90 E 4.7498 8.4557 119.7754 53.9942 32.5369 173.7454 91 L 5.1953 8.5617 126.3212 53.4447 45.9566 174.4791 92 Y 5.5489 8.5948 123.3822 55.8441 41.8149 173.0011 93 Y 5.1092 9.7268 126.1118 55.8282 41.3206 174.4233 94 S 4.3371 8.5806 123.0774 57.1567 64.4387 173.3067 95 I 4.4306 8.2625 127.6900 59.5235 38.7737 174.9604 96 E 4.6244 9.2890 130.8101 55.1458 30.5742 175.0976 97 K 4.6567 9.1670 129.5031 55.7373 35.7329 176.4134 98 E 3.6824 9.8661 126.0294 56.2588 28.4295 174.2154 99 G 4.0513 7.3293 104.4638 45.7430 0.0000 173.1951 100 Q 4.6485 8.2267 117.3374 54.3576 32.8657 174.1116 101 R 4.6576 8.3389 118.1190 54.6775 31.6110 176.1878 102 K 4.1241 8.7676 124.3731 54.4539 34.0419 175.6013 103 W 5.2205 8.5706 126.0911 55.6671 29.9084 175.3311 104 Y 5.3718 8.9911 123.0377 55.5197 41.7501 175.5715 105 K 4.6216 9.0385 122.3511 56.9933 33.5745 178.7391 106 R 3.7021 8.8119 123.8710 59.2016 30.3656 178.0793 107 M 4.1699 7.9736 113.9747 57.3685 31.3683 176.7764 108 A 4.3403 7.9329 121.7560 52.0206 19.0923 176.3142 109 V 4.9214 7.4575 109.2609 60.0918 35.0089 175.0029 110 I 4.6674 8.2082 122.9540 59.5410 41.8747 174.0298 111 L 4.4588 7.7549 122.3716 54.3436 43.6785 175.4982 112 S 4.9113 7.8614 114.6295 56.9320 65.5974 175.1613 113 L 4.3982 8.9775 121.1142 58.5076 40.9609 180.0283 114 E 3.9434 8.1892 117.0288 58.7855 29.2386 178.5534 115 Q 4.3311 8.0780 116.4030 57.1240 29.2672 177.2848 116 G 4.1210 7.5989 105.9416 47.1121 0.0000 175.8610 117 N 4.4385 8.8013 118.5348 55.5641 38.6047 177.4310 118 R 4.0258 7.5509 116.2169 58.7741 29.7229 178.2576 119 L 4.0462 7.8355 120.4628 57.4471 42.3270 178.4119 120 R 4.0685 7.8006 115.3242 59.3090 29.0679 177.1324 121 E 4.2086 8.0243 115.9748 57.4838 30.6586 176.9670 122 Q 4.1371 7.6841 115.8280 57.2795 29.6629 175.7313 123 Y 4.8301 8.7676 112.0529 56.0912 39.2268 177.1621 124 G 4.8670 7.2951 117.3580 46.4790 0.0000 174.3078 125 L 3.7690 7.7693 119.1917 54.1930 42.2528 178.0219 126 G 4.1306 7.8034 103.5124 44.7369 0.0000 171.9041 127 P 4.4904 0.0000 0.0000 63.7771 32.1828 175.9989 128 Y 4.7254 7.9001 118.3156 55.4129 41.6484 174.7654 129 E 4.1923 7.6589 120.2844 56.3369 29.9329 175.8057 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 7 N 8.42 4.85 0.00 2.70 2.80 0.00 0.00 6.85 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 S 7.96 4.46 0.00 3.82 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 9.47 5.10 0.00 3.09 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 10 V 8.01 4.01 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 0.63 0.00 0.00 0.94 0.00 0.00 11 G 7.65 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 0.00 0.00 0.00 0.00 12 L 8.41 4.33 0.00 1.89 1.83 0.81 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.36 4.76 0.00 1.93 1.76 0.00 3.16 0.00 0.00 3.44 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 14 V 8.45 5.35 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 0.74 0.00 0.00 0.76 0.00 0.00 15 V 8.02 4.75 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 0.76 0.00 0.00 0.86 0.00 0.00 16 A 8.93 4.54 0.65 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 0.00 0.00 17 K 8.36 4.80 0.00 1.58 1.68 0.00 1.12 0.00 0.00 1.37 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.47 1.17 7.81 18 W 9.39 4.51 0.00 3.38 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 S 7.97 4.84 0.00 4.01 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.54 4.45 0.00 3.90 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 21 N 8.90 4.87 0.00 2.80 2.69 0.00 0.00 7.42 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 22 G 9.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.10 5.25 0.00 2.61 2.80 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 24 F 8.48 5.26 0.00 2.76 2.79 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 25 Y 8.82 4.44 0.00 3.22 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 26 S 8.68 5.04 0.00 3.75 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 27 G 8.69 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 0.00 0.00 0.00 0.00 28 K 9.06 5.03 0.00 1.76 1.85 0.00 1.34 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.40 7.81 29 I 8.66 4.50 2.16 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.00 0.93 0.00 0.00 30 T 8.92 4.53 4.28 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 1.24 0.00 0.00 31 R 7.71 4.75 0.00 1.74 1.78 0.00 3.11 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 32 D 8.56 5.07 0.00 2.59 2.46 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 33 V 8.16 4.05 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 0.86 0.00 0.00 0.89 0.00 0.00 34 G 8.41 3.58 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 35 A 8.41 4.34 1.21 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 0.00 0.00 0.00 36 G 8.86 3.86 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 0.00 37 K 6.58 4.73 0.00 1.73 1.75 0.00 1.46 0.00 0.00 1.60 0.00 0.00 2.64 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.12 1.29 7.81 38 Y 8.39 4.75 0.00 3.11 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 39 K 9.14 4.62 0.00 2.01 1.88 0.00 1.66 0.00 0.00 1.90 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.43 7.81 40 L 8.90 5.35 0.00 1.87 1.78 1.14 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.87 5.44 0.00 1.93 1.57 1.07 1.43 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 42 F 9.52 4.66 0.00 3.29 3.22 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 43 D 8.83 4.53 0.00 2.82 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 44 D 8.53 4.87 0.00 2.83 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.22 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 46 Y 8.30 4.44 0.00 2.81 2.39 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 47 E 8.06 5.04 0.00 2.00 1.78 0.00 0.00 0.00 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 2.54 0.00 48 C 8.33 4.76 0.00 3.20 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 49 D 8.71 5.41 0.00 2.54 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 50 V 8.50 4.65 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 1.02 0.00 0.00 1.03 0.00 0.00 51 L 8.51 4.45 0.00 1.62 1.53 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 52 G 9.05 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.21 4.11 0.00 1.85 1.99 0.00 1.46 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.62 7.81 54 D 7.30 4.87 0.00 2.75 2.40 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 55 I 7.93 4.98 1.71 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.70 0.78 0.00 0.00 56 L 7.87 4.13 0.00 1.48 1.84 0.83 0.31 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 57 L 7.30 3.56 0.00 1.22 1.49 0.96 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.56 5.09 0.00 3.02 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 8.69 4.40 0.00 2.56 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 60 P 0.00 4.09 0.00 2.15 1.91 0.00 3.61 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.54 0.00 61 I 7.24 4.68 1.90 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 1.36 0.70 0.92 0.00 0.00 62 P 0.00 4.16 0.00 2.20 2.06 0.00 3.71 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 2.20 2.34 0.00 63 L 8.58 4.02 0.00 1.51 1.60 0.83 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.60 4.77 0.00 2.42 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 65 T 7.76 4.32 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 1.21 0.00 0.00 66 E 8.87 4.46 0.00 1.93 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 2.27 2.37 0.00 67 V 8.80 4.32 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 0.55 0.00 0.00 1.02 0.00 0.00 68 T 7.85 4.73 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 0.58 0.00 0.00 69 A 8.60 5.12 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 0.00 0.00 70 L 8.75 4.30 0.00 1.74 1.58 1.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.42 4.80 0.00 4.04 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 72 E 8.58 3.93 0.00 2.27 2.21 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 2.46 2.36 0.00 73 D 8.78 3.91 0.00 2.60 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 74 E 7.48 4.15 0.00 1.16 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 2.06 2.02 0.00 75 Y 6.89 4.68 0.00 2.88 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 76 F 7.44 4.45 0.00 3.00 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 77 S 8.99 5.00 0.00 3.80 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 78 A 7.93 5.42 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 0.00 0.00 0.00 0.00 0.00 0.00 79 G 8.23 4.07 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 0.00 0.00 0.00 80 V 8.38 4.72 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 0.90 0.00 0.00 0.95 0.00 0.00 81 V 8.60 3.97 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 0.95 0.00 0.00 1.07 0.00 0.00 82 K 8.53 4.29 0.00 1.34 1.61 0.00 1.50 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.24 1.37 7.81 83 G 7.55 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 0.00 0.00 0.00 0.00 84 H 8.51 5.88 0.00 3.04 2.78 0.00 5.73 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.91 4.74 0.00 1.71 1.89 0.00 2.21 0.00 0.00 2.56 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.22 0.00 86 K 8.32 4.64 0.00 1.73 1.65 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.67 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.41 7.81 87 E 8.91 4.59 0.00 1.88 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 2.21 2.22 0.00 88 S 8.19 4.60 0.00 3.90 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 89 G 8.10 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 90 E 8.46 4.75 0.00 2.05 1.80 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 2.55 2.39 0.00 91 L 8.56 5.20 0.00 1.78 1.55 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 8.59 5.55 0.00 3.24 2.99 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 93 Y 9.73 5.11 0.00 3.29 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 94 S 8.58 4.34 0.00 2.72 2.63 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 95 I 8.26 4.43 1.78 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.07 0.93 0.00 0.00 96 E 9.29 4.62 0.00 1.80 1.72 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 2.31 2.29 0.00 97 K 9.17 4.66 0.00 1.76 1.49 0.00 1.69 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.42 7.81 98 E 9.87 3.68 0.00 2.12 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 99 G 7.33 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 8.23 4.65 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 101 R 8.34 4.66 0.00 1.44 1.37 0.00 3.13 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.47 0.00 102 K 8.77 4.12 0.00 1.22 0.74 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.14 1.21 7.81 103 W 8.57 5.22 0.00 2.97 2.92 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 0.00 104 Y 8.99 5.37 0.00 3.02 2.64 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 0.00 105 K 9.04 4.62 0.00 1.93 2.29 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.60 1.40 7.81 106 R 8.81 3.70 0.00 1.79 1.76 0.00 2.55 0.00 0.00 2.87 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.53 0.00 107 M 7.97 4.17 0.00 2.34 2.29 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.70 0.00 108 A 7.93 4.34 0.63 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 0.00 109 V 7.46 4.92 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.98 0.00 0.00 110 I 8.21 4.67 1.09 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 1.05 0.50 0.19 0.00 0.00 111 L 7.75 4.46 0.00 1.16 1.42 -0.05 0.88 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 0.00 112 S 7.86 4.91 0.00 4.17 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.98 4.40 0.00 1.74 2.04 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.19 3.94 0.00 2.02 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 2.41 2.59 0.00 115 Q 8.08 4.33 0.00 2.05 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.95 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 116 G 7.60 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 0.00 117 N 8.80 4.44 0.00 2.69 2.91 0.00 0.00 7.13 7.98 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 0.00 118 R 7.55 4.03 0.00 2.00 2.07 0.00 3.16 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.66 0.00 119 L 7.84 4.05 0.00 1.84 1.98 1.13 1.02 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 0.00 120 R 7.80 4.07 0.00 2.00 2.27 0.00 3.14 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 121 E 8.02 4.21 0.00 2.04 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 2.16 2.18 0.00 122 Q 7.68 4.14 0.00 1.47 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.93 0.00 0.00 0.00 0.00 0.00 1.91 1.16 0.00 123 Y 8.77 4.83 0.00 2.89 2.83 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 0.00 124 G 7.30 4.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 7.77 3.77 0.00 1.82 1.69 0.50 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 126 G 7.80 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 0.00 0.00 0.00 127 P 0.00 4.49 0.00 2.34 2.40 0.00 3.85 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 2.25 0.00 128 Y 7.90 4.73 0.00 2.85 2.88 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 0.00 129 E 7.66 4.19 0.00 1.98 1.74 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 1.67 1.97 0.00