NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 N 4.6646 8.4249 119.2058 52.7954 40.1273 173.9239 14 L 4.2170 8.4517 124.5800 55.1549 42.3592 175.1635 15 L 4.6455 8.3908 121.3786 53.6204 43.7531 175.8973 16 Y 4.3981 8.5088 122.8151 58.2367 39.8754 174.9188 17 T 3.8466 7.0193 117.3101 60.8745 70.1772 174.1059 18 R 4.0145 8.0599 125.2243 56.9902 30.0592 176.2153 19 N 4.3175 7.5011 118.1407 53.2896 38.9919 174.5583 20 D 4.4053 8.7233 125.6895 56.5259 41.6162 176.6804 21 V 3.6875 7.4867 118.5584 62.7409 32.1204 176.2881 22 S 4.2875 8.4944 121.6458 58.3892 64.8342 174.9441 23 D 4.2851 8.8601 124.4334 57.8843 40.6739 179.1094 24 S 4.0526 8.0542 112.8436 61.5139 62.3710 175.6732 25 E 3.9239 8.3112 121.6460 59.2397 29.3855 178.6123 26 K 3.8477 8.7185 118.8665 59.7600 32.0667 179.0957 27 K 3.8805 8.2206 117.9867 59.6001 32.0228 179.2507 28 A 3.9746 7.8835 120.3337 55.4305 18.3477 179.8673 29 T 3.7299 8.2030 114.5477 66.9279 68.6695 176.9550 30 V 3.6797 8.1190 120.5187 66.1456 31.4301 177.7169 31 E 3.9314 8.0214 118.7341 58.9194 29.2159 178.3251 32 L 3.9487 7.8363 120.3956 58.1072 42.1512 178.8642 33 L 3.9535 8.4234 119.0630 58.1007 41.6848 179.2032 34 N 4.4684 8.0734 116.0321 56.3806 38.3685 177.6673 35 R 3.9396 7.8383 118.9730 59.4072 30.2207 179.1112 36 Q 4.0735 7.6773 117.2891 58.9809 28.7317 178.6158 37 V 3.5332 8.1431 119.6639 66.4261 31.4359 178.1951 38 I 3.7671 7.9025 119.2050 64.3248 36.9036 178.2627 39 Q 3.9807 7.9825 120.1491 59.1107 28.8836 178.3497 40 F 3.8864 9.1240 119.1725 60.4833 39.0434 177.5543 41 I 3.7166 7.9626 119.5232 64.7571 37.0067 177.9935 42 D 4.3235 8.0844 118.5348 57.2155 41.0525 177.9745 43 L 3.8407 7.8256 121.2479 57.8502 42.0075 179.1814 44 S 4.0912 8.4638 114.8717 61.4231 63.2055 176.4619 45 L 3.9087 7.8893 122.7640 57.3909 41.2564 179.6837 46 I 3.4772 7.7088 119.7618 64.5332 36.9625 178.4357 47 T 3.7688 7.7695 116.5742 66.6147 68.2815 176.5448 48 K 3.3189 7.6432 121.3212 58.8467 31.9645 178.6251 49 Q 3.8895 7.3530 119.2715 59.1661 28.8047 178.2579 50 A 3.9383 7.6954 121.6561 55.2948 18.1883 178.7195 51 H 3.8952 7.8551 115.7538 59.5051 29.8646 177.1171 52 W 4.6536 7.8863 118.9240 59.4096 28.8332 177.5459 53 N 5.0364 8.1476 114.7873 52.4278 38.5525 174.5564 54 M 4.8379 6.9608 117.5206 54.4282 33.4459 175.1333 55 R 4.2964 8.8917 117.6879 55.5363 34.8291 173.8914 56 G 3.9170 8.5855 103.5457 43.9964 0.0000 173.1408 57 A 3.9940 8.4498 121.5461 53.5874 18.8339 177.0385 58 N 4.1500 8.8876 118.7435 54.7055 37.3701 176.3833 59 F 4.1812 8.0428 118.1418 60.5168 39.6442 175.1187 60 I 3.0899 7.8219 117.1753 64.1209 37.7871 177.6562 61 A 3.8056 7.7279 120.6122 55.1703 18.2623 179.6539 62 V 3.3344 7.3381 116.8022 66.0205 31.6960 177.5351 63 H 3.8359 8.4403 119.1206 59.4904 29.6805 177.0967 64 E 3.9012 8.0154 120.0651 59.1629 29.2559 178.8112 65 M 3.5717 7.6786 118.3963 58.4917 32.1676 178.3338 66 L 3.3497 7.3972 118.9954 57.3648 41.4465 178.9100 67 D 4.0968 6.9713 116.5614 56.9510 41.2091 178.2097 68 G 3.6312 7.3669 105.6773 47.8431 0.0000 175.3590 69 F 3.8759 7.0105 120.3855 60.1184 38.9023 177.5080 70 R 3.9143 7.8393 118.0621 60.0284 29.8926 178.4373 71 T 3.8764 7.6411 114.8965 66.6948 68.4801 176.4709 72 A 4.1162 8.0969 122.0521 55.0467 18.4829 179.2151 73 L 4.2714 8.6211 118.0337 58.5364 41.7475 180.0616 74 I 3.7827 8.0185 119.3597 64.2921 37.0032 178.1886 75 C 4.0881 7.9676 119.3007 62.7218 31.3574 175.3657 76 H 4.1064 8.2815 117.7101 58.7384 28.3333 177.1776 77 L 3.6133 8.1921 122.2549 58.4582 41.7696 179.0877 78 A 3.9888 8.2329 120.4272 55.3630 18.2444 179.7775 79 T 3.8028 7.7328 114.3025 66.8685 68.5044 176.9364 80 M 3.8934 8.1872 120.5507 58.2594 32.0719 178.4412 81 A 3.9575 7.9353 120.8629 55.5352 18.5988 179.6723 82 E 3.9664 8.5050 117.0283 59.1900 29.3110 179.6653 83 R 3.8377 7.8802 119.0329 59.0741 30.1225 178.2556 84 A 3.9240 7.9793 120.6222 55.3608 18.4296 179.7509 85 V 3.7283 7.6836 116.5064 66.3712 31.2666 178.2538 86 Q 4.0422 7.7678 116.9999 58.3959 28.5823 177.6154 87 L 4.3813 7.3248 117.3333 54.6520 42.1354 177.6875 88 G 3.9217 8.2174 109.2309 45.0084 0.0000 174.5639 89 G 4.2069 7.4573 108.2695 44.4660 0.0000 172.5967 90 V 4.2212 8.0136 118.2492 60.5523 33.4989 175.5885 91 A 4.2558 8.6445 130.8111 51.9591 18.8626 176.2110 92 L 4.6614 9.1938 123.9366 53.2610 42.6974 176.7933 93 G 4.2319 8.3959 112.4778 44.5576 0.0000 172.4968 94 T 4.2487 7.8332 110.2262 60.8708 71.1768 174.6153 95 T 3.8633 8.5271 116.9401 65.4705 67.2746 176.1781 96 Q 3.9702 8.0217 118.8688 59.5084 28.5781 178.6440 97 V 3.5974 7.4001 119.3475 65.3665 31.5104 178.0785 98 I 3.6871 7.8880 119.4634 64.5194 36.8234 177.8095 99 N 4.3041 8.2830 116.8082 56.9975 38.7215 176.4298 100 S 4.2446 8.0727 113.8302 60.8824 62.7217 175.3087 101 K 4.3609 8.1698 119.3374 55.5971 32.4395 177.0619 102 T 3.9693 7.5558 115.9554 61.6630 67.6174 172.1129 103 P 4.6288 0.0000 0.0000 62.6419 31.9704 175.0583 104 L 4.4843 7.5890 120.2876 52.7916 42.6087 176.3418 105 K 3.8292 8.8449 125.1667 56.6971 32.4549 175.8289 106 S 3.9794 8.7020 119.3788 58.4869 62.8351 173.1805 107 Y 4.1976 8.7114 128.9512 56.3049 39.3447 172.8527 108 P 4.3615 0.0000 0.0000 63.1853 31.7485 175.9222 109 L 4.6459 8.5188 121.2464 54.5582 41.7757 176.4378 110 D 4.8341 7.8479 116.5330 52.6957 40.3969 175.9743 111 I 4.1994 7.2976 113.1893 60.6643 39.3440 174.9905 112 H 5.1685 8.3341 114.2803 55.2762 32.6836 173.8363 113 N 4.8757 8.1125 116.7807 53.4205 40.5344 175.3373 114 V 3.6905 8.4724 126.8417 66.6062 31.6824 178.6212 115 Q 4.0450 8.9980 117.8503 58.9324 28.4234 178.5548 116 D 4.3297 8.2062 119.3819 57.8592 41.0219 178.2358 117 H 4.5260 8.1864 117.9034 58.1622 28.7311 177.5066 118 L 3.9640 8.3715 122.3755 58.1936 41.9694 179.2545 119 K 3.9555 8.1656 118.1655 59.5249 31.9284 178.8184 120 E 3.9871 8.5617 119.9236 59.4778 29.4645 178.9885 121 L 4.2304 8.8862 118.9742 57.6777 41.7134 178.9930 122 A 4.0410 8.5380 121.2012 55.5393 18.2890 179.1619 123 D 4.3434 8.2540 116.9574 57.9949 40.8685 179.5550 124 R 4.0429 8.0071 118.2593 59.3421 29.9354 178.9407 125 Y 3.7547 8.7612 117.1242 60.6850 37.9028 177.7475 126 A 4.0170 8.5775 122.2051 55.3005 18.4318 179.4776 127 I 3.5928 7.7610 118.1121 64.8122 37.2798 178.8353 128 V 3.4700 7.5151 118.4828 65.7640 31.3213 177.7722 129 A 3.8824 8.6576 121.4573 55.3807 18.1752 179.2757 130 N 4.2503 8.7311 114.9034 56.3773 38.6467 177.1497 131 D 4.3600 8.2848 119.6087 57.4745 41.2142 178.7668 132 V 3.8471 7.6780 118.2640 64.8328 31.4090 177.8625 133 R 3.9952 7.9800 119.3405 59.0952 29.3636 178.7444 134 K 4.0427 7.8014 118.3655 59.3410 32.1348 179.1130 135 A 4.0655 8.1183 120.7943 54.8743 17.8179 179.6554 136 I 3.6796 7.4221 117.4996 64.6913 37.0661 178.8112 137 G 3.6542 7.5935 104.1497 47.1718 0.0000 174.6636 138 E 4.2685 7.4214 120.5361 56.9820 29.7833 176.2155 139 A 4.1935 7.3161 122.5850 51.6549 18.6331 177.4088 140 K 4.0599 8.6090 123.4293 59.1274 32.8930 177.8494 141 D 4.4478 7.9473 118.9582 53.8102 41.9382 175.5520 142 D 4.3592 8.8696 127.5318 57.9814 40.8958 178.4218 143 D 4.4009 8.1271 118.1343 58.2327 40.9408 179.3846 144 T 3.8291 7.7326 114.0737 66.6148 68.3229 176.5618 145 A 4.0015 8.0346 122.7862 54.8511 18.2728 179.1998 146 D 4.2062 8.0546 116.6253 57.6041 41.3658 178.3476 147 I 3.6576 7.7844 120.2870 64.6763 37.1311 178.4763 148 L 4.0027 7.9522 119.5264 57.7932 41.3083 179.7614 149 T 3.7839 8.0412 115.7588 66.4035 68.5345 176.3134 150 A 3.9710 8.1730 122.6372 55.3547 18.4303 179.4571 151 A 3.3101 7.8379 118.9559 55.1672 18.3959 179.8393 152 S 3.9428 8.4350 111.8646 61.4824 62.1680 176.1198 153 R 3.7902 8.5507 121.8563 59.7780 29.6511 178.2029 154 D 3.9841 7.7945 118.0405 56.9744 40.7196 178.7622 155 L 3.7354 7.4647 119.5793 57.6699 41.5581 179.2604 156 D 4.3837 8.0852 118.9531 56.7927 40.6278 178.7794 157 K 3.9677 7.3287 119.0883 59.4889 32.1768 178.9392 158 F 3.9664 7.9389 118.4717 60.2738 38.6629 177.1748 159 L 3.9102 8.2641 120.4072 58.0220 41.7663 178.6946 160 W 4.3899 8.1838 128.0082 60.7967 30.3929 177.7854 161 F 4.1607 7.9907 116.1500 60.5940 38.6088 177.5382 162 I 3.8656 8.2314 119.6521 64.6277 37.1191 178.3486 163 E 4.0524 8.5938 119.6875 59.6131 29.0936 179.4586 164 S 4.3692 8.3196 113.8834 60.4036 62.9947 175.2142 165 N 4.7094 7.7306 117.6865 52.3337 38.9252 174.9195 166 I 4.2228 6.9416 122.4164 60.3702 37.8915 175.8443 167 E 4.1515 9.4566 124.7977 56.7557 29.1636 176.7862 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 13 N 8.42 4.66 0.00 2.71 2.79 0.00 0.00 7.01 6.89 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 14 L 8.45 4.22 0.00 1.67 1.62 1.03 0.68 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 15 L 8.39 4.65 0.00 1.53 1.61 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 8.51 4.40 0.00 2.94 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 17 T 7.02 3.85 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 1.06 0.00 0.00 18 R 8.06 4.01 0.00 1.75 1.92 0.00 3.25 0.00 0.00 3.16 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.52 0.00 19 N 7.50 4.32 0.00 2.61 2.66 0.00 0.00 7.04 8.31 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 20 D 8.72 4.41 0.00 2.64 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.49 3.69 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 0.84 0.00 0.00 0.95 0.00 0.00 22 S 8.49 4.29 0.00 4.09 3.98 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 23 D 8.86 4.29 0.00 2.79 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 24 S 8.05 4.05 0.00 3.88 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 25 E 8.31 3.92 0.00 2.12 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 2.29 2.39 0.00 26 K 8.72 3.85 0.00 1.95 1.96 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.44 1.69 7.81 27 K 8.22 3.88 0.00 1.95 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.64 7.81 28 A 7.88 3.97 1.40 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 29 T 8.20 3.73 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 1.18 0.00 0.00 30 V 8.12 3.68 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 0.98 0.00 0.00 0.97 0.00 0.00 31 E 8.02 3.93 0.00 2.12 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 0.00 2.30 2.45 0.00 32 L 7.84 3.95 0.00 1.81 1.81 0.96 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.42 3.95 0.00 1.84 1.65 0.87 0.63 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 34 N 8.07 4.47 0.00 2.84 2.88 0.00 0.00 7.14 7.59 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 35 R 7.84 3.94 0.00 2.20 1.99 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 36 Q 7.68 4.07 0.00 2.10 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.73 0.00 0.00 0.00 0.00 0.00 2.58 2.47 0.00 37 V 8.14 3.53 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 1.02 0.00 0.00 0.87 0.00 0.00 38 I 7.90 3.77 2.04 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 1.42 0.69 0.93 0.00 0.00 39 Q 7.98 3.98 0.00 2.34 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.28 2.38 0.00 40 F 9.12 3.89 0.00 3.01 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 41 I 7.96 3.72 1.95 0.00 0.00 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 1.45 0.89 0.93 0.00 0.00 42 D 8.08 4.32 0.00 2.90 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 43 L 7.83 3.84 0.00 1.74 1.52 -0.27 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.46 4.09 0.00 4.04 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 45 L 7.89 3.91 0.00 1.87 1.73 0.94 0.79 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 46 I 7.71 3.48 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 1.47 0.71 0.40 0.00 0.00 47 T 7.77 3.77 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 1.25 0.00 0.00 48 K 7.64 3.32 0.00 1.57 1.09 0.00 1.63 0.00 0.00 1.38 0.00 0.00 2.67 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.30 0.76 7.81 49 Q 7.35 3.89 0.00 2.26 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.54 2.62 0.00 50 A 7.70 3.94 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 51 H 7.86 3.90 0.00 2.91 3.09 0.00 5.95 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 52 W 7.89 4.65 0.00 3.66 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 53 N 8.15 5.04 0.00 2.90 3.01 0.00 0.00 6.73 8.98 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 54 M 6.96 4.84 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.93 0.00 55 R 8.89 4.30 0.00 1.83 1.69 0.00 3.03 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 1.31 1.50 0.00 56 G 8.59 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 0.00 0.00 0.00 57 A 8.45 3.99 1.27 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 0.00 0.00 58 N 8.89 4.15 0.00 2.96 2.83 0.00 0.00 6.83 7.71 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 59 F 8.04 4.18 0.00 3.22 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 60 I 7.82 3.09 1.92 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.95 0.87 0.00 0.00 61 A 7.73 3.81 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 62 V 7.34 3.33 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 0.89 0.00 0.00 0.87 0.00 0.00 63 H 8.44 3.84 0.00 2.13 2.75 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.02 3.90 0.00 1.88 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 2.26 2.37 0.00 65 M 7.68 3.57 0.00 1.82 1.74 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.43 0.00 66 L 7.40 3.35 0.00 1.61 1.47 0.82 0.85 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 67 D 6.97 4.10 0.00 2.46 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 68 G 7.37 3.63 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 0.00 69 F 7.01 3.88 0.00 2.94 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 70 R 7.84 3.91 0.00 1.79 1.99 0.00 3.02 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 71 T 7.64 3.88 4.42 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 0.00 0.00 0.00 1.24 0.00 0.00 72 A 8.10 4.12 1.75 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 73 L 8.62 4.27 0.00 2.14 1.88 1.14 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.02 3.78 1.91 0.00 0.00 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 1.45 0.87 0.94 0.00 0.00 75 C 7.97 4.09 0.00 3.03 3.05 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 76 H 8.28 4.11 0.00 3.48 3.17 0.00 5.70 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.19 3.61 0.00 1.86 1.90 1.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.23 3.99 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 79 T 7.73 3.80 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 1.18 0.00 0.00 80 M 8.19 3.89 0.00 1.90 2.03 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.38 0.00 81 A 7.94 3.96 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 82 E 8.51 3.97 0.00 2.10 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 2.31 2.35 0.00 83 R 7.88 3.84 0.00 2.02 2.08 0.00 3.12 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 1.59 1.65 0.00 84 A 7.98 3.92 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 85 V 7.68 3.73 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 1.01 0.00 0.00 0.99 0.00 0.00 86 Q 7.77 4.04 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.83 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 87 L 7.32 4.38 0.00 1.70 1.67 0.90 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.22 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 0.00 0.00 0.00 89 G 7.46 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 0.00 0.00 0.00 0.00 90 V 8.01 4.22 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 0.86 0.00 0.00 0.93 0.00 0.00 91 A 8.64 4.26 1.23 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 92 L 9.19 4.66 0.00 1.58 1.61 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.40 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 94 T 7.83 4.25 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 1.22 0.00 0.00 95 T 8.53 3.86 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 1.23 0.00 0.00 96 Q 8.02 3.97 0.00 2.29 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.67 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 97 V 7.40 3.60 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 1.12 0.00 0.00 0.94 0.00 0.00 98 I 7.89 3.69 2.02 0.00 0.00 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 1.72 0.96 0.93 0.00 0.00 99 N 8.28 4.30 0.00 2.72 3.08 0.00 0.00 7.28 7.18 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 0.00 100 S 8.07 4.24 0.00 3.96 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 0.00 101 K 8.17 4.36 0.00 1.76 1.83 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.57 7.81 102 T 7.56 3.97 4.32 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 1.35 0.00 0.00 103 P 0.00 4.63 0.00 2.21 2.13 0.00 3.81 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.98 0.00 104 L 7.59 4.48 0.00 1.86 1.67 0.84 0.92 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 0.00 105 K 8.84 3.83 0.00 1.73 1.77 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.45 7.81 106 S 8.70 3.98 0.00 3.90 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 0.00 107 Y 8.71 4.20 0.00 3.09 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 0.00 108 P 0.00 4.36 0.00 2.00 1.85 0.00 2.51 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.71 0.00 109 L 8.52 4.65 0.00 1.69 1.80 0.99 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.85 4.83 0.00 2.72 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 0.00 111 I 7.30 4.20 1.70 0.00 0.00 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 1.18 0.29 0.77 0.00 0.00 112 H 8.33 5.17 0.00 3.18 3.32 0.00 5.90 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.11 4.88 0.00 2.79 2.94 0.00 0.00 6.83 7.71 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 0.00 114 V 8.47 3.69 2.15 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 1.10 0.00 0.00 1.20 0.00 0.00 115 Q 9.00 4.05 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.57 0.00 116 D 8.21 4.33 0.00 2.82 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 0.00 117 H 8.19 4.53 0.00 3.45 3.49 0.00 5.64 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 8.37 3.96 0.00 2.08 1.70 0.92 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.17 3.96 0.00 2.02 1.86 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.69 7.81 120 E 8.56 3.99 0.00 2.22 2.15 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 1.65 2.23 0.00 121 L 8.89 4.23 0.00 1.96 1.74 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.54 4.04 1.44 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 0.00 123 D 8.25 4.34 0.00 3.00 2.78 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 0.00 0.00 0.00 124 R 8.01 4.04 0.00 1.94 2.01 0.00 3.45 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.91 0.00 125 Y 8.76 3.75 0.00 3.25 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 0.00 126 A 8.58 4.02 1.44 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 0.00 127 I 7.76 3.59 2.02 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 0.75 0.90 0.00 0.00 128 V 7.52 3.47 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 0.49 0.00 0.00 0.78 0.00 0.00 129 A 8.66 3.88 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 0.00 130 N 8.73 4.25 0.00 2.71 2.88 0.00 0.00 6.77 7.97 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 0.00 131 D 8.28 4.36 0.00 2.80 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 0.00 132 V 7.68 3.85 2.25 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 0.90 0.00 0.00 1.02 0.00 0.00 133 R 7.98 4.00 0.00 2.00 2.10 0.00 3.05 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 134 K 7.80 4.04 0.00 2.14 1.83 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.19 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.49 7.81 135 A 8.12 4.07 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 0.00 136 I 7.42 3.68 1.98 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.09 0.89 0.00 0.00 137 G 7.59 3.65 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 0.00 138 E 7.42 4.27 0.00 2.03 2.15 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 2.30 2.31 0.00 139 A 7.32 4.19 1.32 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 0.00 0.00 140 K 8.61 4.06 0.00 2.05 1.88 0.00 2.02 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.55 7.81 141 D 7.95 4.45 0.00 2.72 2.53 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 0.00 142 D 8.87 4.36 0.00 2.71 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 0.00 143 D 8.13 4.40 0.00 2.69 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 0.00 144 T 7.73 3.83 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 1.17 0.00 0.00 145 A 8.03 4.00 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 0.00 146 D 8.05 4.21 0.00 2.80 2.84 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 0.00 147 I 7.78 3.66 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.58 0.84 0.00 0.00 148 L 7.95 4.00 0.00 1.82 1.69 0.92 0.68 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 0.00 149 T 8.04 3.78 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 1.18 0.00 0.00 150 A 8.17 3.97 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 0.00 151 A 7.84 3.31 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 0.00 152 S 8.43 3.94 0.00 3.87 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 0.00 153 R 8.55 3.79 0.00 1.99 1.98 0.00 3.09 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 154 D 7.79 3.98 0.00 2.69 1.96 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 0.00 155 L 7.46 3.74 0.00 1.65 1.58 0.69 0.75 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 0.00 156 D 8.09 4.38 0.00 2.62 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 0.00 157 K 7.33 3.97 0.00 1.82 1.70 0.00 1.63 0.00 0.00 1.68 0.00 0.00 3.14 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.14 1.36 7.81 158 F 7.94 3.97 0.00 2.85 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 0.00 0.00 0.00 159 L 8.26 3.91 0.00 1.87 1.89 1.02 0.88 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 0.00 160 W 8.18 4.39 0.00 3.32 3.41 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 0.00 161 F 7.99 4.16 0.00 3.21 3.06 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 0.00 162 I 8.23 3.87 1.97 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.69 0.88 0.00 0.00 163 E 8.59 4.05 0.00 2.29 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 2.38 2.52 0.00 164 S 8.32 4.37 0.00 3.67 3.87 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 0.00 165 N 7.73 4.71 0.00 2.81 2.80 0.00 0.00 7.00 7.59 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 0.00 166 I 6.94 4.22 2.04 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.67 0.99 0.00 0.00 167 E 9.46 4.15 0.00 1.92 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 2.35 2.38 0.00