NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3616 0.0000 0.0000 62.3537 31.8795 175.5920 3 R 3.9178 7.8834 121.2605 55.5715 31.0933 174.8172 4 A 4.6125 8.7149 125.9150 48.8052 19.8351 174.6082 5 K 3.8820 8.2211 118.6543 56.5315 32.0121 177.5214 6 T 3.9347 8.7865 118.9411 64.6973 70.3087 178.1763 7 G 3.9478 8.4960 108.4080 46.4290 0.0000 174.6663 8 V 4.1571 8.5201 124.3069 63.0611 33.9466 175.9536 9 V 3.3166 6.8323 118.1644 66.5409 31.1486 177.3771 10 R 3.6524 7.9854 116.9921 59.7549 29.8140 178.1203 11 R 3.7359 7.8670 117.1717 59.7856 29.9284 178.6683 12 R 3.8658 7.8601 117.2312 59.3089 30.1508 179.0317 13 K 3.8659 8.1915 118.4735 60.4536 31.9056 178.4426 14 H 4.0124 8.5672 117.3310 57.9368 28.4412 177.5398 15 K 3.6358 8.7674 121.3671 60.5966 32.0197 178.3813 16 K 3.9381 8.1429 120.2033 59.7599 32.2416 178.3656 17 I 3.8560 7.9920 119.2624 64.2373 37.3399 178.1122 18 L 4.0175 8.8281 121.9141 58.3477 41.7336 179.2446 19 K 4.1182 7.9100 118.2508 58.9623 31.9401 179.1578 20 L 3.9806 7.6077 118.0183 56.7618 41.6150 178.2361 21 A 4.3313 7.3598 117.7133 50.1078 19.6271 176.2825 22 K 3.6932 7.3168 118.0318 57.0179 32.3338 175.8894 23 G 3.5343 8.7410 113.3866 45.7170 0.0000 175.6537 24 Y 4.8880 6.9895 122.9290 57.9511 37.7763 174.9794 25 W 4.6267 9.4557 135.0000 57.2519 34.5831 180.9180 26 G 3.7155 6.7587 104.6701 44.4147 0.0000 179.0735 27 L 4.1068 9.0115 129.0342 56.9283 41.9161 178.3969 28 R 4.2584 8.0993 118.6235 58.2571 30.0361 177.3022 29 S 5.0015 7.8655 111.8499 58.3923 63.6502 174.9165 30 K 4.4735 8.3214 118.9214 58.9130 35.8498 177.5039 31 S 4.2471 8.0174 114.0734 57.9983 63.1726 174.1914 32 F 4.2218 9.2411 127.9017 61.5349 39.0009 177.5602 33 R 2.8544 7.6310 114.5147 58.8078 29.6826 178.2051 34 K 3.7512 8.3042 119.8733 59.1146 31.9989 178.8228 35 A 4.3626 7.6011 122.1172 54.6344 18.2331 179.1883 36 R 3.4387 7.0552 115.8311 59.7553 30.0995 178.0466 37 E 4.4090 7.9936 117.8212 60.1140 29.5164 179.6083 38 T 3.7849 8.0011 115.3614 66.7929 68.4687 176.5603 39 L 4.0002 8.3811 120.9207 57.6919 41.3235 179.2431 40 F 4.3335 8.4957 118.1426 60.8468 38.9278 177.5757 41 A 3.8308 8.0290 119.1451 55.0952 18.1950 179.1190 42 A 4.2962 8.2160 119.3826 55.6495 18.5564 179.7726 43 G 3.8418 8.8224 104.3563 48.4471 0.0000 175.5670 44 N 4.5616 7.8640 118.5411 56.0628 38.5728 176.8805 45 Y 4.4867 8.2359 118.4619 61.3439 38.0464 178.6776 46 A 4.1123 8.5846 121.7163 55.6018 18.0390 179.0410 47 Y 4.2136 7.7216 116.2577 60.8487 38.8840 178.2378 48 A 3.8050 8.1810 121.6220 55.4807 18.5302 179.3441 49 H 4.2524 8.8429 114.5184 58.1674 28.7801 178.1639 50 R 3.8817 7.8862 121.2868 59.5035 29.5770 178.6438 51 K 4.0974 7.5123 116.6067 58.9157 31.9116 179.7112 52 R 3.9305 7.9518 119.0926 59.0818 29.4950 178.5614 53 R 4.4854 8.0405 120.1928 58.9889 29.9149 178.4145 54 K 4.0171 7.7583 117.2377 59.3312 31.9854 179.1218 55 R 3.8843 7.7215 116.9647 60.4085 30.0419 177.8700 56 D 4.1621 8.7348 117.6129 58.2833 40.7172 178.9324 57 F 3.2638 8.0747 117.2208 60.6772 39.0665 177.2917 58 R 3.8647 7.7123 117.0451 60.1264 29.8168 179.0222 59 R 3.8081 8.0229 116.8557 59.2742 30.1086 178.7950 60 L 3.7276 7.7286 120.4857 58.1260 41.9211 179.0923 61 W 4.5284 8.3520 118.6342 60.2055 29.0301 178.3724 62 I 3.8727 7.7486 119.1244 64.5573 36.4427 178.5414 63 V 3.7166 8.2527 119.2329 66.0709 31.4082 178.0582 64 R 3.9262 7.7090 117.4246 59.4727 30.0062 178.8853 65 I 3.8869 8.3183 119.6108 64.6502 37.2522 177.5737 66 N 4.5198 9.1671 118.4727 57.2847 38.5602 176.7369 67 A 4.1205 8.0262 120.0678 55.1441 18.6967 178.7167 68 A 4.0223 8.2512 120.6975 55.1618 18.4311 179.4382 69 C 4.3468 9.1461 112.1381 61.1159 29.8141 176.1474 70 R 4.3239 8.3022 122.7681 58.8499 29.3580 178.2189 71 Q 4.0460 8.0476 118.7054 58.9760 29.1385 177.0417 72 H 4.5343 8.1717 115.4522 55.6614 30.3801 175.1706 73 G 3.7958 8.4733 109.1955 43.8619 0.0000 172.0812 74 L 4.3837 6.9322 121.2868 54.4982 42.8326 174.4247 75 N 4.7364 7.9408 116.6553 52.9121 40.5576 175.9351 76 Y 4.2117 8.3541 123.4678 60.9908 39.0431 178.5145 77 S 4.1366 8.3821 114.8080 61.7910 63.1288 176.5366 78 T 3.8463 7.8366 118.7073 66.8538 68.2478 175.5189 79 F 4.1197 8.8681 122.2267 62.2572 39.2087 177.0834 80 I 3.3339 8.0760 118.6552 64.6524 37.1410 177.6933 81 H 4.1076 8.0013 118.5303 59.5409 29.5433 177.1623 82 G 3.6365 8.0082 106.6667 47.8010 0.0000 175.5522 83 L 3.9180 7.5975 121.4964 57.5208 41.5445 179.5081 84 K 3.8553 8.3029 118.5843 59.1466 32.0445 178.0622 85 K 4.1064 7.7447 118.7378 58.5489 32.4436 177.7757 86 A 4.1912 8.1511 118.9251 51.5405 19.6740 176.9149 87 G 3.7919 7.6332 105.8180 45.8872 0.0000 175.8093 88 I 4.4186 6.8185 111.1139 59.0855 38.5423 176.0639 89 E 3.9052 8.8892 129.2364 59.0263 29.3209 178.3761 90 V 2.8168 6.3823 112.4282 65.2914 32.7785 176.8548 91 D 4.6269 7.8527 119.7571 52.4619 39.3487 175.2764 92 R 3.9309 7.9389 118.4174 56.3064 30.5698 178.7937 93 K 4.0664 8.7199 121.8922 59.7736 32.3176 177.5332 94 N 2.0000 7.7497 116.6188 56.4986 38.4576 176.0381 95 L 4.2087 7.5456 113.7531 55.1208 41.8594 178.2208 96 A 4.7460 7.9574 122.5409 52.1999 18.4623 179.2191 97 D 4.5028 7.6947 118.5071 54.8855 39.0419 178.0817 98 L 4.0650 8.1915 120.1893 57.0435 41.9115 179.1414 99 A 3.6941 7.7773 120.0725 54.0729 18.4758 178.0835 100 V 3.9956 8.3817 115.1457 63.8980 32.9790 176.0628 101 R 4.3605 7.7668 119.6282 55.3465 31.7645 175.6655 102 E 4.1418 8.8344 124.0089 56.4830 26.5758 173.5977 103 P 4.5640 0.0000 0.0000 65.4468 31.5418 178.4890 104 Q 4.0244 8.1403 117.2915 58.8067 28.6852 178.5794 105 V 3.5932 7.7434 119.0092 66.1793 31.4724 177.7152 106 F 4.0317 8.4001 119.4359 61.2189 39.1326 176.3976 107 A 3.8741 8.4209 120.6506 55.5307 18.1349 179.3425 108 E 3.8308 8.3310 116.5560 59.5884 29.5641 179.6855 109 L 3.7932 7.8724 118.8595 57.6887 41.5730 179.7915 110 V 2.9881 7.5511 118.3433 65.7358 31.4249 177.7294 111 E 3.8621 8.4994 118.6158 59.7127 29.3571 179.4576 112 R 3.8823 8.6325 118.5158 59.4939 29.9831 179.0050 113 A 3.9977 7.9412 120.2857 54.7858 18.4821 179.6749 114 K 3.8135 8.2273 117.2787 59.8291 32.0463 179.3060 115 A 4.1867 7.8510 118.4009 54.0024 18.4203 179.1094 116 A 4.0327 7.7050 119.3530 55.3467 18.5543 179.1582 117 Q 4.1652 7.8064 116.6389 57.3291 29.3433 176.5710 118 G 3.7468 7.2096 110.6110 46.4583 0.0000 172.0351 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 P 0.00 4.36 0.00 2.05 2.09 0.00 3.64 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 1.92 2.07 0.00 3 R 7.88 3.92 0.00 1.85 1.82 0.00 3.17 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 4 A 8.71 4.61 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 5 K 8.22 3.88 0.00 1.74 1.86 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.45 7.81 6 T 8.79 3.93 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 1.17 0.00 0.00 7 G 8.50 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 V 8.52 4.16 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.91 0.00 0.00 9 V 6.83 3.32 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.91 0.00 0.00 10 R 7.99 3.65 0.00 1.80 1.76 0.00 3.11 0.00 0.00 3.09 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.46 0.00 11 R 7.87 3.74 0.00 1.84 2.03 0.00 3.21 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 12 R 7.86 3.87 0.00 2.08 1.93 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 13 K 8.19 3.87 0.00 1.86 1.82 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.61 7.81 14 H 8.57 4.01 0.00 3.16 3.13 0.00 5.66 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.77 3.64 0.00 1.96 2.10 0.00 1.32 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.68 1.47 7.81 16 K 8.14 3.94 0.00 1.81 2.02 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.47 1.49 7.81 17 I 7.99 3.86 2.02 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.31 0.97 0.00 0.00 18 L 8.83 4.02 0.00 1.82 1.88 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.91 4.12 0.00 1.78 1.81 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.09 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.77 7.81 20 L 7.61 3.98 0.00 1.78 1.74 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 21 A 7.36 4.33 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 22 K 7.32 3.69 0.00 1.84 1.71 0.00 1.67 0.00 0.00 1.81 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.67 1.51 7.81 23 G 8.74 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Y 6.99 4.89 0.00 3.03 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 25 W 9.46 4.63 0.00 3.47 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 26 G 6.76 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 9.01 4.11 0.00 1.79 1.78 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.10 4.26 0.00 2.02 2.31 0.00 3.11 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 29 S 7.87 5.00 0.00 4.05 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 30 K 8.32 4.47 0.00 1.73 1.83 0.00 1.76 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.58 1.33 7.81 31 S 8.02 4.25 0.00 4.04 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 32 F 9.24 4.22 0.00 2.94 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 33 R 7.63 2.85 0.00 1.76 1.69 0.00 3.06 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 34 K 8.30 3.75 0.00 1.90 1.94 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.65 7.81 35 A 7.60 4.36 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 36 R 7.06 3.44 0.00 1.33 1.75 0.00 3.10 0.00 0.00 3.31 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.27 0.00 37 E 7.99 4.41 0.00 2.26 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 2.46 2.42 0.00 38 T 8.00 3.78 4.27 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 0.58 0.00 0.00 39 L 8.38 4.00 0.00 1.55 1.62 0.89 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 40 F 8.50 4.33 0.00 3.28 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 41 A 8.03 3.83 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 42 A 8.22 4.30 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 43 G 8.82 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 44 N 7.86 4.56 0.00 2.78 2.82 0.00 0.00 7.04 7.21 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 45 Y 8.24 4.49 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 46 A 8.58 4.11 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 47 Y 7.72 4.21 0.00 3.12 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 48 A 8.18 3.81 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 49 H 8.84 4.25 0.00 3.26 3.36 0.00 5.62 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 7.89 3.88 0.00 2.22 1.94 0.00 3.20 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 51 K 7.51 4.10 0.00 1.69 1.74 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.22 1.32 7.81 52 R 7.95 3.93 0.00 1.95 1.96 0.00 3.27 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 53 R 8.04 4.49 0.00 2.06 2.14 0.00 3.24 0.00 0.00 3.34 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 54 K 7.76 4.02 0.00 2.17 1.81 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.54 7.81 55 R 7.72 3.88 0.00 1.94 1.96 0.00 3.10 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.90 0.00 56 D 8.73 4.16 0.00 2.73 2.23 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 57 F 8.07 3.26 0.00 2.30 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 58 R 7.71 3.86 0.00 1.99 1.95 0.00 3.11 0.00 0.00 3.19 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.82 0.00 59 R 8.02 3.81 0.00 1.68 1.88 0.00 3.09 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 1.58 1.69 0.00 60 L 7.73 3.73 0.00 1.48 1.30 0.31 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 61 W 8.35 4.53 0.00 3.68 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 62 I 7.75 3.87 1.85 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 1.70 1.10 0.06 0.00 0.00 63 V 8.25 3.72 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 1.02 0.00 0.00 0.96 0.00 0.00 64 R 7.71 3.93 0.00 2.07 2.01 0.00 3.40 0.00 0.00 3.20 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.99 0.00 65 I 8.32 3.89 2.28 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.17 1.24 0.00 0.00 66 N 9.17 4.52 0.00 2.93 2.87 0.00 0.00 7.20 7.64 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 67 A 8.03 4.12 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 68 A 8.25 4.02 1.11 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 0.00 0.00 69 C 9.15 4.35 0.00 2.87 3.21 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 70 R 8.30 4.32 0.00 2.32 2.16 0.00 3.19 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.56 0.00 71 Q 8.05 4.05 0.00 2.27 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 72 H 8.17 4.53 0.00 3.33 3.31 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.47 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 74 L 6.93 4.38 0.00 1.80 1.73 0.82 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.94 4.74 0.00 2.88 2.88 0.00 0.00 6.44 7.48 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 76 Y 8.35 4.21 0.00 3.43 3.02 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 77 S 8.38 4.14 0.00 4.14 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 0.00 78 T 7.84 3.85 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 79 F 8.87 4.12 0.00 3.11 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 80 I 8.08 3.33 1.49 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 -0.16 0.76 0.00 0.00 81 H 8.00 4.11 0.00 3.30 3.58 0.00 5.79 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 82 G 8.01 3.64 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 0.00 83 L 7.60 3.92 0.00 1.78 1.64 1.26 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.30 3.86 0.00 1.61 1.80 0.00 1.66 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.47 7.81 85 K 7.74 4.11 0.00 1.90 1.70 0.00 1.83 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.30 1.45 7.81 86 A 8.15 4.19 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 87 G 7.63 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 88 I 6.82 4.42 1.84 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 1.41 0.80 0.94 0.00 0.00 89 E 8.89 3.91 0.00 1.92 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 2.26 2.28 0.00 90 V 6.38 2.82 2.05 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 0.72 0.00 0.00 0.91 0.00 0.00 91 D 7.85 4.63 0.00 2.70 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 92 R 7.94 3.93 0.00 1.99 2.01 0.00 2.95 0.00 0.00 3.14 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 93 K 8.72 4.07 0.00 2.03 2.14 0.00 1.87 0.00 0.00 1.95 0.00 0.00 3.02 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.67 1.55 7.81 94 N 7.75 2.00 0.00 1.44 2.12 0.00 0.00 7.15 6.66 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 95 L 7.55 4.21 0.00 1.55 1.60 0.84 0.63 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 96 A 7.96 4.75 1.62 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 97 D 7.69 4.50 0.00 2.88 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 98 L 8.19 4.06 0.00 2.10 1.94 1.01 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.78 3.69 0.64 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 0.00 100 V 8.38 4.00 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 0.82 0.00 0.00 0.95 0.00 0.00 101 R 7.77 4.36 0.00 1.91 1.84 0.00 3.49 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 102 E 8.83 4.14 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.24 0.00 103 P 0.00 4.56 0.00 2.31 2.34 0.00 3.89 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.94 0.00 104 Q 8.14 4.02 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 105 V 7.74 3.59 2.34 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 1.03 0.00 0.00 0.96 0.00 0.00 106 F 8.40 4.03 0.00 3.22 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 0.00 107 A 8.42 3.87 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 0.00 108 E 8.33 3.83 0.00 2.14 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 2.32 2.36 0.00 109 L 7.87 3.79 0.00 1.65 1.61 0.91 0.56 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 0.00 110 V 7.55 2.99 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 0.81 0.00 0.00 0.17 0.00 0.00 111 E 8.50 3.86 0.00 2.08 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 2.44 2.48 0.00 112 R 8.63 3.88 0.00 1.96 1.96 0.00 3.26 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 1.78 0.00 113 A 7.94 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.23 3.81 0.00 1.88 1.84 0.00 1.63 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.61 1.54 7.81 115 A 7.85 4.19 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 0.00 116 A 7.71 4.03 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 0.00 117 Q 7.81 4.17 0.00 2.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.03 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 118 G 7.21 3.75 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 0.00 0.00 0.00