NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9408 8.3549 109.7399 44.2786 0.0000 177.0661 2 P 4.1367 0.0000 0.0000 61.2803 32.0576 173.7729 3 T 4.5755 8.5281 111.7058 60.6739 72.0667 171.6359 4 G 4.1141 7.9232 114.9189 45.1778 0.0000 173.8644 5 T 4.5771 7.9519 112.9296 60.0132 71.9751 172.8937 6 G 3.8798 8.5489 108.3911 44.3375 0.0000 172.3537 7 E 4.0312 8.2722 116.8263 54.0835 30.9114 180.7007 8 S 4.1078 7.6881 119.0991 58.9843 61.8618 171.7946 9 K 4.1465 8.6132 111.7639 61.5985 32.8434 179.1591 10 C 4.0529 7.4502 109.9574 61.2189 24.8974 171.8320 11 P 4.6464 0.0000 0.0000 64.1153 32.6716 175.7849 12 L 4.9394 7.5337 122.5193 54.1175 44.5527 174.3935 13 M 4.9224 9.4286 126.4186 53.6499 36.0923 174.0571 14 V 4.9151 8.2858 123.4781 60.9226 35.3751 174.0826 15 K 4.9252 8.9938 127.7163 54.6340 35.4609 174.7523 16 V 4.8336 8.7643 127.1539 61.0539 34.4033 174.2240 17 L 5.0719 8.9982 126.9012 52.9216 45.9587 175.0138 18 D 5.1935 9.1090 121.2372 52.7066 42.3770 176.4733 19 A 4.3950 9.5148 128.6485 53.3333 18.2737 177.8233 20 V 4.2247 8.6714 114.2462 62.8925 32.7112 176.4295 21 R 4.5170 8.1348 115.4319 54.6902 32.4276 175.1008 22 G 3.9128 8.5120 105.7702 45.7841 0.0000 172.8923 23 S 4.8230 7.4360 111.4569 55.7388 67.0587 172.5087 24 P 4.5160 0.0000 0.0000 63.1221 31.8083 176.5030 25 A 4.2118 8.3818 125.3072 50.9752 17.9002 176.5154 26 I 3.8540 8.0347 121.5155 62.1606 38.2285 175.5998 27 N 4.2071 8.5939 124.4146 54.6325 37.9110 173.7533 28 V 4.0717 8.0382 116.4257 61.4067 33.2356 174.8079 29 A 4.6966 8.5463 129.4670 51.8150 20.0610 176.1711 30 V 4.7810 8.9841 121.7863 61.3067 35.0018 173.8843 31 H 4.8971 9.4409 125.0465 53.9204 31.7339 172.7072 32 V 4.7274 8.7863 124.2371 61.2015 33.4478 174.6194 33 F 5.7023 9.0135 125.8260 55.7918 42.9102 174.1793 34 R 4.6579 9.3629 120.6838 54.1759 33.6610 174.5987 35 K 3.9296 8.7737 126.8731 55.7381 32.1062 176.6349 36 A 4.3409 8.4263 130.4649 50.2888 19.4587 177.7231 37 A 3.8628 8.6087 122.7308 55.5762 18.3381 178.5973 38 D 4.5331 7.9638 112.8249 53.2968 39.5128 177.7792 39 D 4.3601 8.2064 119.5405 55.2436 41.7124 174.1072 40 T 4.0231 7.3262 115.4361 63.2963 69.3375 172.3464 41 W 5.1649 8.4514 122.2441 55.3483 30.4975 175.8264 42 E 4.8828 9.0962 123.4786 53.9203 31.7254 173.7724 43 P 4.3647 0.0000 0.0000 63.4599 31.4788 175.1628 44 F 4.6827 9.4889 127.4125 59.4689 40.4391 175.2036 45 A 4.6185 7.7039 117.5827 51.4859 22.6869 174.0065 46 S 4.7698 7.6785 112.2621 57.6185 66.0522 173.5518 47 G 3.9529 7.9638 107.4026 46.3559 0.0000 171.9533 48 K 5.3342 8.4841 118.8517 54.2635 35.0774 176.8021 49 T 4.2971 8.4668 114.0241 61.8315 70.3897 175.0870 50 S 4.9440 8.4953 119.0761 57.1878 65.1385 174.4256 51 E 4.1256 8.7142 118.9619 59.5229 29.0902 178.3535 52 S 4.3148 8.0276 110.7193 58.1210 63.8415 174.4259 53 G 3.8176 8.6833 110.2863 46.5046 0.0000 172.6958 54 E 5.1114 7.7645 117.0218 53.9226 33.8691 175.1100 55 L 4.8176 9.1696 123.9124 53.9533 44.5805 175.1249 56 H 4.9371 8.8826 122.7627 54.6020 31.9137 174.7939 57 G 3.9057 8.8173 106.1913 46.1843 0.0000 174.7641 58 L 3.9906 7.8449 121.0155 57.6628 41.6698 176.5963 59 T 4.5231 7.3261 109.7978 60.4464 70.5320 171.9783 60 T 4.7024 8.0099 113.2016 59.2057 72.3919 174.6495 61 E 4.0799 8.5958 121.0366 59.7161 29.5294 178.6114 62 E 3.9099 8.2934 116.2847 58.7755 29.5367 177.9911 63 E 4.4756 7.6383 118.2573 57.4668 31.5227 177.1058 64 F 5.0610 7.9961 121.3471 56.9019 36.3504 174.4380 65 V 4.0016 7.4239 115.5092 59.8534 32.8603 175.9727 66 E 4.6813 8.0076 119.4242 55.8285 29.9146 177.3305 67 G 4.0641 7.6314 107.5188 44.5650 0.0000 171.0504 68 I 4.9655 7.3514 119.9614 59.7415 39.6532 174.9960 69 Y 5.1494 8.6183 123.0426 55.9731 42.6333 174.2288 70 K 4.9056 8.8608 122.0926 54.7871 35.4682 174.9201 71 V 4.5808 9.0271 128.3629 61.5384 33.2531 173.9050 72 E 4.8273 9.2317 130.7955 54.9165 31.3042 174.4608 73 I 4.6035 8.8361 128.7335 59.6102 37.7420 176.1265 74 D 4.4045 8.4450 131.1288 53.0059 37.4367 177.2420 75 T 4.0412 7.4139 113.5693 64.4506 69.2055 176.5327 76 K 4.0344 7.6281 121.9520 59.7205 32.4771 178.2837 77 Y 4.3797 6.3709 115.8312 60.5774 37.4759 177.7331 78 Y 4.0532 7.7553 119.9177 60.5712 39.2948 177.4561 79 W 4.1777 7.9030 119.6729 59.4469 29.1277 178.8378 80 K 4.1629 8.4988 118.4689 59.3928 31.2857 179.0141 81 A 4.1296 7.8703 119.4056 53.9493 18.7559 178.4766 82 L 4.3827 7.8751 116.9046 54.0038 41.7607 178.2981 83 G 4.0063 8.2042 107.4984 45.6658 0.0000 173.8034 84 I 4.3669 7.1521 119.4843 59.7259 38.5981 175.4176 85 S 4.5219 8.5964 121.1687 57.1185 63.5323 172.1534 86 P 4.7138 0.0000 0.0000 60.7830 33.5945 175.2142 87 F 3.8680 8.1481 121.2149 60.7752 39.3485 175.7026 88 H 4.5238 7.6306 115.3717 54.4599 29.9918 175.1833 89 E 4.0362 8.4956 121.7552 59.6139 29.6272 176.0432 90 H 4.9530 7.3566 110.7414 55.8384 31.5232 172.9497 91 A 4.5202 8.7189 120.0320 50.2271 21.2369 175.2755 92 E 5.7467 8.9211 120.0292 54.3716 32.7866 175.7893 93 V 4.5366 8.1944 119.6682 61.3999 34.8571 173.8941 94 V 5.5940 8.8417 127.5374 60.5845 33.8964 174.1783 95 F 4.9571 8.2294 120.4687 56.7326 41.4482 172.5364 96 T 4.9008 8.7816 115.7738 62.1576 69.6477 174.1806 97 A 4.4144 9.0326 129.4222 50.7549 21.2607 176.6365 98 N 4.4139 9.0950 116.4924 54.0086 36.6562 174.9643 99 D 4.9437 8.4760 115.0186 52.5676 39.8265 177.4497 100 S 4.4899 7.8517 112.5646 57.1995 62.9076 175.4631 101 G 4.1369 8.2044 104.9927 45.6780 0.0000 171.1400 102 P 4.4248 0.0000 0.0000 62.9939 31.7209 175.5387 103 R 4.8464 8.0806 119.2165 54.8998 34.9652 174.2047 104 R 4.9867 8.4683 118.4518 54.8030 33.0574 175.0831 105 Y 5.0022 9.0125 120.7059 56.4164 41.4546 174.7476 106 T 4.8996 8.8845 120.8954 61.9345 71.3893 173.5916 107 I 4.5358 8.8437 129.6352 60.2168 38.1776 174.9807 108 A 5.2141 9.1386 129.8009 50.1162 21.9334 175.2438 109 A 5.0324 9.1524 122.1132 50.2225 22.8862 174.7120 110 L 4.8371 8.8972 125.1933 53.6156 44.0081 175.2081 111 L 5.3476 8.9650 126.3499 53.6278 44.6728 175.6689 112 S 4.9934 9.0011 116.4091 56.8509 67.7029 173.5853 113 P 3.4066 0.0000 0.0000 65.4970 31.0628 178.2155 114 Y 4.5722 7.5307 112.1418 57.0404 38.4942 175.0404 115 S 4.7365 7.8342 112.9654 58.0591 65.7995 173.2615 116 Y 5.3446 7.8738 120.2604 56.2035 40.2052 173.5046 117 S 4.8819 8.8238 115.8323 56.8981 66.6254 172.6618 118 T 5.2658 8.3825 114.5576 60.9760 70.5844 172.9574 119 T 4.8735 9.1831 122.9542 61.8901 73.3007 172.6366 120 A 5.1562 8.5941 125.1767 50.1147 22.4046 175.7994 121 V 4.3556 8.8118 120.4816 61.0947 34.3885 174.5800 122 V 5.2797 8.6361 127.5551 59.3136 33.5772 175.0309 123 T 4.6582 7.9004 112.2275 59.8567 72.9161 171.7998 124 N 4.8697 8.6795 121.2656 52.2346 39.9292 172.1269 125 P 4.0343 0.0000 0.0000 62.4073 30.5324 175.0131 126 K 4.5597 8.1274 123.8360 53.8639 34.9222 175.7776 127 E 4.1616 8.5381 119.2201 56.6390 29.3864 177.2088 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 G 8.35 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 2 P 0.00 4.14 0.00 2.14 2.02 0.00 3.63 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 3 T 8.53 4.58 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 1.24 0.00 0.00 4 G 7.92 4.11 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 0.00 5 T 7.95 4.58 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 1.18 0.00 0.00 6 G 8.55 3.88 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 0.00 7 E 8.27 4.03 0.00 2.04 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 2.39 2.28 0.00 8 S 7.69 4.11 0.00 4.01 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 9 K 8.61 4.15 0.00 1.92 1.89 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.40 1.48 7.81 10 C 7.45 4.05 0.00 3.14 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 11 P 0.00 4.65 0.00 2.45 2.45 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.91 0.00 12 L 7.53 4.94 0.00 0.89 1.11 0.95 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 13 M 9.43 4.92 0.00 1.99 1.68 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 14 V 8.29 4.92 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 0.89 0.00 0.00 0.89 0.00 0.00 15 K 8.99 4.93 0.00 1.83 1.55 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.37 7.81 16 V 8.76 4.83 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 0.68 0.00 0.00 0.80 0.00 0.00 17 L 9.00 5.07 0.00 1.59 1.52 0.93 0.63 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 18 D 9.11 5.19 0.00 2.67 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 19 A 9.51 4.39 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 20 V 8.67 4.22 2.66 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 0.95 0.00 0.00 0.99 0.00 0.00 21 R 8.13 4.52 0.00 1.88 1.97 0.00 3.60 0.00 0.00 3.30 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 22 G 8.51 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 23 S 7.44 4.82 0.00 3.88 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 24 P 0.00 4.52 0.00 2.06 2.18 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 25 A 8.38 4.21 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 26 I 8.03 3.85 1.89 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 1.38 0.75 0.91 0.00 0.00 27 N 8.59 4.21 0.00 2.85 2.93 0.00 0.00 7.13 7.56 0.00 0.00 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 V 8.04 4.07 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 0.61 0.00 0.00 0.39 0.00 0.00 29 A 8.55 4.70 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 30 V 8.98 4.78 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 0.92 0.00 0.00 0.85 0.00 0.00 31 H 9.44 4.90 0.00 2.90 2.65 0.00 5.64 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.79 4.73 2.26 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 1.12 0.00 0.00 0.94 0.00 0.00 33 F 9.01 5.70 0.00 2.73 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 34 R 9.36 4.66 0.00 1.54 1.75 0.00 3.08 0.00 0.00 3.11 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 35 K 8.77 3.93 0.00 1.01 1.36 0.00 1.19 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.02 1.00 7.81 36 A 8.43 4.34 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 37 A 8.61 3.86 1.26 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 0.00 0.00 38 D 7.96 4.53 0.00 2.79 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 39 D 8.21 4.36 0.00 2.68 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 40 T 7.33 4.02 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 1.21 0.00 0.00 41 W 8.45 5.16 0.00 2.88 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 42 E 9.10 4.88 0.00 2.16 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 0.00 2.57 2.43 0.00 43 P 0.00 4.36 0.00 2.01 2.08 0.00 3.79 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 2.14 2.33 0.00 44 F 9.49 4.68 0.00 3.14 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 45 A 7.70 4.62 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 46 S 7.68 4.77 0.00 3.66 3.57 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 47 G 7.96 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 48 K 8.48 5.33 0.00 1.59 1.67 0.00 1.75 0.00 0.00 1.94 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.37 7.81 49 T 8.47 4.30 4.06 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 1.15 0.00 0.00 50 S 8.50 4.94 0.00 4.03 4.06 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 51 E 8.71 4.13 0.00 1.97 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 0.00 2.30 2.24 0.00 52 S 8.03 4.31 0.00 3.97 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 53 G 8.68 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 54 E 7.76 5.11 0.00 1.98 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 2.20 2.38 0.00 55 L 9.17 4.82 0.00 1.61 1.42 0.91 1.17 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 56 H 8.88 4.94 0.00 3.00 3.18 0.00 6.02 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.82 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 58 L 7.84 3.99 0.00 1.57 1.71 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.33 4.52 4.37 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 0.99 0.00 0.00 60 T 8.01 4.70 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 1.26 0.00 0.00 61 E 8.60 4.08 0.00 2.10 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 0.00 2.49 2.42 0.00 62 E 8.29 3.91 0.00 2.03 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 0.00 2.36 2.35 0.00 63 E 7.64 4.48 0.00 1.95 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 0.00 2.68 2.62 0.00 64 F 8.00 5.06 0.00 3.28 3.03 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 0.00 0.00 0.00 65 V 7.42 4.00 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 0.84 0.00 0.00 1.05 0.00 0.00 66 E 8.01 4.68 0.00 2.01 1.85 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 2.58 2.26 0.00 67 G 7.63 4.06 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 68 I 7.35 4.97 1.68 0.00 0.00 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 1.31 0.57 1.05 0.00 0.00 69 Y 8.62 5.15 0.00 2.02 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 70 K 8.86 4.91 0.00 0.92 0.74 0.00 1.34 0.00 0.00 1.15 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.19 1.18 7.81 71 V 9.03 4.58 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 0.97 0.00 0.00 1.13 0.00 0.00 72 E 9.23 4.83 0.00 2.12 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 2.31 2.06 0.00 73 I 8.84 4.60 1.80 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.60 0.75 0.00 0.00 74 D 8.44 4.40 0.00 2.60 1.83 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 75 T 7.41 4.04 4.38 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 1.05 0.00 0.00 76 K 7.63 4.03 0.00 2.04 1.71 0.00 1.84 0.00 0.00 1.93 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.63 1.60 7.81 77 Y 6.37 4.38 0.00 3.14 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 78 Y 7.76 4.05 0.00 2.69 2.94 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 79 W 7.90 4.18 0.00 3.37 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 80 K 8.50 4.16 0.00 1.96 1.94 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.56 1.87 7.81 81 A 7.87 4.13 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 82 L 7.88 4.38 0.00 1.93 1.72 0.22 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.20 4.01 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 0.00 0.00 0.00 84 I 7.15 4.37 2.06 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 1.33 0.72 0.79 0.00 0.00 85 S 8.60 4.52 0.00 3.92 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 86 P 0.00 4.71 0.00 2.13 1.95 0.00 3.80 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.07 0.00 87 F 8.15 3.87 0.00 1.51 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 H 7.63 4.52 0.00 3.13 3.28 0.00 5.95 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 E 8.50 4.04 0.00 1.74 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 2.16 2.14 0.00 90 H 7.36 4.95 0.00 3.14 3.12 0.00 5.27 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.72 4.52 0.40 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 92 E 8.92 5.75 0.00 1.94 1.93 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 2.24 2.14 0.00 93 V 8.19 4.54 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 1.17 0.00 0.00 1.03 0.00 0.00 94 V 8.84 5.59 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 0.95 0.00 0.00 1.00 0.00 0.00 95 F 8.23 4.96 0.00 3.16 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 96 T 8.78 4.90 4.33 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 1.23 0.00 0.00 97 A 9.03 4.41 0.45 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 98 N 9.10 4.41 0.00 2.88 2.85 0.00 0.00 6.63 8.10 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 99 D 8.48 4.94 0.00 2.79 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 0.00 100 S 7.85 4.49 0.00 3.98 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 0.00 101 G 8.20 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 0.00 102 P 0.00 4.42 0.00 2.25 2.13 0.00 3.73 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 2.01 2.03 0.00 103 R 8.08 4.85 0.00 1.61 1.46 0.00 3.24 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.69 0.00 104 R 8.47 4.99 0.00 1.66 1.79 0.00 3.06 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 105 Y 9.01 5.00 0.00 2.97 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 0.00 106 T 8.88 4.90 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 0.00 107 I 8.84 4.54 1.84 0.00 0.00 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 1.11 0.35 nan 0.00 0.00 108 A 9.14 5.21 1.19 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 0.00 0.00 0.00 109 A 9.15 5.03 1.19 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 0.00 0.00 0.00 110 L 8.90 4.84 0.00 1.85 1.62 0.99 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.96 5.35 0.00 1.92 2.03 0.64 0.91 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 0.00 112 S 9.00 4.99 0.00 3.95 3.71 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 0.00 113 P 0.00 3.41 0.00 2.11 1.78 0.00 3.33 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.82 0.00 114 Y 7.53 4.57 0.00 2.82 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 0.00 115 S 7.83 4.74 0.00 3.80 3.71 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 0.00 116 Y 7.87 5.34 0.00 3.13 2.95 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 0.00 117 S 8.82 4.88 0.00 3.89 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 0.00 118 T 8.38 5.27 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 1.27 0.00 0.00 119 T 9.18 4.87 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 1.20 0.00 0.00 120 A 8.59 5.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 8.81 4.36 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 1.02 0.00 0.00 0.91 0.00 0.00 122 V 8.64 5.28 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 0.66 0.00 0.00 0.63 0.00 0.00 123 T 7.90 4.66 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 1.14 0.00 0.00 124 N 8.68 4.87 0.00 2.70 2.74 0.00 0.00 7.01 7.69 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 0.00 125 P 0.00 4.03 0.00 2.09 2.04 0.00 3.68 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 126 K 8.13 4.56 0.00 1.78 1.68 0.00 1.66 0.00 0.00 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