NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 H 4.6167 8.4449 120.3872 56.1016 29.9151 171.8769 4 R 4.2799 8.1328 125.5561 54.1478 31.7562 175.4848 5 K 4.6647 8.1816 121.7234 53.9999 36.5428 172.9784 6 D 4.3331 8.7090 117.6869 55.7414 40.3058 172.6325 7 H 5.0696 8.0383 110.8980 53.4113 32.6132 171.8650 8 F 5.1048 9.1004 116.7398 55.7607 41.7979 175.0647 9 I 4.8821 8.3314 123.4653 59.6640 39.4583 174.6032 10 V 4.7366 8.9437 127.7924 61.3013 34.0808 173.8739 11 C 4.9735 9.6798 126.3885 59.1614 29.7706 172.8449 12 G 4.3738 7.7816 110.1982 44.1432 0.0000 172.6660 13 H 4.9170 8.0511 112.9399 54.2404 29.4318 174.2081 14 S 4.4101 7.8266 115.9618 58.4986 65.0739 174.4675 15 I 3.6759 8.1435 121.8739 64.2736 36.7304 178.4095 16 L 3.8832 7.8718 120.4876 58.0165 42.0000 178.6744 17 A 3.9315 7.7899 120.1438 55.2229 18.3364 179.5415 18 I 3.6363 7.9406 118.4520 64.8709 37.2562 178.6028 19 N 4.3782 8.1556 116.9272 56.3931 38.2568 177.7195 20 T 3.9008 7.8110 117.5341 66.3239 68.4259 176.9933 21 I 3.6799 7.9082 121.8979 64.3026 37.0763 178.4305 22 L 3.9673 8.0139 119.7979 58.0657 41.2130 179.7127 23 Q 3.9671 8.2097 117.8803 58.8254 28.5675 178.9207 24 L 4.0056 7.9517 120.2347 57.6750 41.5869 179.1865 25 N 4.5292 8.4210 116.7231 56.5216 38.2994 177.4858 26 Q 4.0612 8.1998 118.3387 58.3111 28.7151 178.0882 27 R 4.5445 7.2440 116.1786 55.4598 30.3401 176.8407 28 G 3.9195 7.9362 106.0315 46.2499 0.0000 173.9107 29 Q 4.6616 7.8692 117.6906 54.5721 30.4937 175.1338 30 N 4.8652 8.7069 119.4423 52.6003 40.3789 174.2471 31 V 5.0584 8.4381 122.3382 61.4256 34.9469 174.4481 32 T 4.7796 9.3611 124.1757 61.9163 71.0463 173.2073 33 V 4.8516 8.6669 126.7938 61.3136 34.3595 174.4303 34 I 5.1441 8.5266 127.0027 58.7014 40.0215 174.4910 35 S 4.9845 8.5874 121.1738 56.2305 65.8453 173.4883 36 N 5.1869 8.7172 122.2053 51.9403 37.4770 175.1975 37 L 4.1426 7.2845 118.5598 54.1885 42.4175 175.8524 38 P 4.5214 0.0000 0.0000 62.8426 33.0681 177.9894 39 E 4.0400 8.9079 121.8097 62.4507 29.2609 180.8612 40 D 4.7230 7.9858 121.3515 58.4739 40.0291 180.1879 41 D 4.5862 8.0204 120.1469 57.1014 40.7934 178.6823 42 I 3.7891 8.1063 122.9788 64.7005 37.0125 179.2903 43 K 4.0395 7.8899 126.4070 60.6517 31.6455 182.9741 44 Q 4.2732 8.0499 121.8256 59.6534 27.9610 180.2206 45 L 4.1653 7.8178 121.0203 58.3916 42.2034 178.8174 46 E 4.0709 8.5576 121.2058 60.1330 29.1251 179.9805 47 Q 4.1155 7.8987 119.8834 59.8182 28.3246 180.5598 48 R 4.2205 7.7663 118.7812 59.0674 30.0912 178.3161 49 L 4.3082 8.1364 118.2969 58.4248 42.5019 177.4763 50 G 3.7578 7.2805 105.8842 45.6393 0.0000 172.3920 51 D 4.4771 8.5804 120.9394 56.4738 40.2259 173.5894 52 N 4.8930 7.8146 115.7603 51.6890 38.0681 177.0004 53 A 4.3204 7.9284 123.5780 52.5735 19.5391 178.2320 54 D 4.8232 8.4867 124.0617 52.4301 41.1081 172.8733 55 V 4.5164 7.8571 119.6038 61.1667 32.8440 175.2548 56 I 4.3385 9.2134 132.1126 59.0795 37.8718 173.6217 57 P 4.4657 0.0000 0.0000 62.9007 31.5567 176.5594 58 G 3.8658 7.8959 112.3614 45.8260 0.0000 169.7043 59 D 5.0147 7.8956 119.2553 52.2813 42.7746 177.7039 60 S 4.4545 8.7123 120.9141 60.0039 63.4973 174.9196 61 N 4.6835 9.4274 119.8473 55.4880 38.7028 174.6185 62 D 4.6862 8.1154 118.9089 53.2623 41.7475 177.2510 63 S 4.2044 8.7438 123.5481 61.3247 62.7992 176.6696 64 S 4.1703 8.7522 117.8236 61.3864 62.7808 176.9693 65 V 3.6978 7.6582 116.2509 63.9751 31.3613 178.4770 66 L 3.9961 7.7921 118.4410 57.6394 41.5214 179.2838 67 K 3.9231 8.2089 119.5963 59.2131 31.9143 178.6787 68 K 3.8490 7.8452 118.6227 59.6061 32.2878 178.4679 69 A 4.1994 8.3168 119.4512 53.5173 18.3596 178.0139 70 G 3.9264 8.1265 106.3611 45.5317 0.0000 175.6770 71 I 3.6726 7.3821 114.8061 63.1216 37.4769 176.9342 72 D 4.4705 8.0298 119.9989 56.3799 41.0836 176.9879 73 R 4.5352 8.2734 116.7462 55.6156 31.1430 175.2420 74 C 4.6727 7.7643 113.4022 57.5329 30.8570 173.5484 75 R 4.0603 8.4158 119.4588 58.4076 30.4731 176.8452 76 A 4.4759 6.8512 117.6460 51.4422 22.6091 174.8233 77 I 4.8458 8.4139 119.9037 59.1408 41.2665 174.3398 78 L 5.0811 9.2744 128.7838 53.1051 44.3689 175.6970 79 A 4.6905 9.0982 128.1881 50.3361 19.0309 176.6350 80 L 4.6468 8.4398 122.6576 55.1817 43.0588 177.4902 81 S 4.4672 7.5280 114.5738 57.5187 64.2628 173.4195 82 D 4.9547 8.3588 117.2174 53.7965 40.6184 175.8371 83 N 4.8804 7.7672 119.6008 51.5725 40.3297 174.9634 84 D 4.4705 8.6618 126.2562 56.7020 40.9312 178.6372 85 A 3.9900 8.0364 121.4347 55.3167 18.4936 179.1367 86 D 4.3809 8.9391 117.8180 57.6263 40.8704 178.8738 87 N 4.3513 8.2439 116.7052 56.3007 38.5465 177.3068 88 A 4.0442 8.2160 122.2053 55.0791 18.4146 179.5502 89 F 4.0649 8.3644 119.2712 61.3270 39.5376 177.4193 90 V 3.5673 8.2671 118.4013 66.1815 31.2096 178.1887 91 V 3.5600 7.7709 117.6643 65.8506 31.3817 177.9032 92 L 3.8540 7.6672 118.6458 57.9039 41.4333 179.3966 93 S 3.8645 8.1596 114.9982 61.6815 62.8241 176.7849 94 A 3.9442 7.8600 122.9374 55.2942 17.9408 179.9246 95 K 3.9557 7.9391 115.4868 59.1741 32.1321 178.4636 96 D 4.4654 7.7878 116.8655 55.9081 41.2566 177.5163 97 M 4.2165 7.4414 117.9912 57.4046 32.6742 176.9931 98 S 4.3961 7.8304 110.1617 60.1776 63.8020 173.8433 99 S 4.8629 8.1922 119.0072 58.6698 60.3959 169.5315 100 D 4.5723 7.6624 115.6770 53.9850 39.7722 176.7607 101 V 3.6875 7.4472 120.6024 61.5326 32.2073 175.3241 102 K 5.2313 8.7635 124.7841 55.6047 33.6695 175.2375 103 T 5.1767 8.8071 116.6726 59.8805 72.0731 172.8282 104 V 4.9572 8.6002 123.3460 61.0965 35.1501 173.9035 105 L 5.2073 9.0554 128.6230 53.3502 45.3734 174.6160 106 A 5.1724 8.5800 127.8333 50.4509 21.1032 176.1951 107 V 4.4312 8.1002 114.6511 60.1750 33.2417 176.7585 108 S 4.1593 10.2457 122.2490 60.5891 63.2867 173.5736 109 D 4.8689 8.5316 122.3473 52.0945 41.8439 176.5733 110 S 4.1368 8.7683 123.3250 61.6168 62.3374 176.5516 111 K 4.0498 8.3391 121.5022 59.1959 32.0937 178.0689 112 N 4.6093 8.5057 115.2683 53.5520 38.6347 176.4919 113 L 3.9343 7.6957 123.1959 58.6933 41.9156 178.7919 114 N 4.4011 8.0840 113.9253 55.9632 38.6609 177.2769 115 K 4.1285 7.8881 119.8723 59.5329 32.2889 179.3017 116 I 3.7029 7.8871 113.0897 63.7913 37.3885 178.0180 117 K 3.8065 8.0028 120.4122 59.8856 31.6102 178.8354 118 M 4.2069 8.0885 117.8914 57.5386 31.9065 178.0312 119 V 4.0631 7.7349 110.8026 60.3107 32.9286 175.3089 120 H 4.0097 7.9261 115.4695 56.1655 26.5925 173.2369 121 P 4.5168 0.0000 0.0000 62.6105 32.6865 176.5274 122 D 4.5847 8.5709 120.3463 56.9579 41.9377 176.6324 123 I 5.0602 8.1627 118.2643 59.3921 41.2012 174.8220 124 I 4.9052 8.5088 126.5363 59.3455 40.2171 174.8266 125 L 4.3405 9.1284 128.8353 53.4012 44.7958 175.3162 126 S 4.6351 8.4877 122.9316 56.2796 62.9042 172.3337 127 P 4.3751 0.0000 0.0000 66.0548 31.1864 178.5365 128 Q 4.0597 8.0054 116.0649 58.7973 28.7919 178.3504 129 L 4.1700 7.7977 120.8768 56.7804 41.8864 178.9460 130 F 4.3186 8.7987 121.2449 61.4815 39.4202 177.5534 131 G 3.6101 8.1393 105.1936 47.5736 0.0000 175.8700 132 S 4.1535 8.0229 116.2568 61.2615 63.1938 176.2568 133 E 3.8958 8.3304 123.0795 58.9706 29.2723 178.9099 134 I 3.5692 7.5036 119.9857 63.9572 37.0265 178.0753 135 L 3.8463 7.8885 121.0161 58.0118 41.7011 178.7222 136 A 3.9526 7.8315 119.4146 55.3233 18.6737 179.5502 137 R 3.9590 7.7886 116.1680 59.4982 30.3311 179.3421 138 V 3.5649 7.9065 118.0996 66.2655 31.2490 178.0851 139 L 4.0965 7.9720 117.4424 57.1195 41.5736 177.9128 140 N 4.6583 7.9929 115.5658 53.1692 38.7078 176.2421 141 G 3.8764 7.7656 106.3407 46.1746 0.0000 174.1826 142 E 4.1561 7.4641 118.7809 56.0741 30.1061 175.9916 143 E 4.4636 8.5017 121.3862 54.9031 31.0582 175.6984 144 I 4.2272 8.1840 124.6252 59.7352 38.3378 175.9388 145 N 4.7586 8.3139 124.1439 51.5845 40.3348 175.2021 146 N 4.3380 8.5407 117.5298 57.0178 38.7768 176.2762 147 D 4.4254 8.0733 119.8406 57.3847 40.7092 178.4959 148 M 4.0936 7.8976 118.3338 58.0347 32.3857 178.0247 149 L 4.1501 7.8386 120.2019 58.3965 42.3208 179.2103 150 V 3.6433 7.9655 118.0690 66.1081 31.1488 177.9010 151 S 4.1111 7.7905 111.9653 61.1752 62.2973 175.2394 152 M 4.3892 8.0633 119.2208 56.2011 32.2798 176.6303 153 L 4.5449 7.5272 118.7127 55.9127 43.6214 176.7943 154 L 4.5383 8.0114 118.6355 54.5590 42.1136 176.5969 155 N 4.5051 8.5748 121.2265 53.6685 38.8222 174.2683 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 3 H 8.44 4.62 0.00 3.13 3.31 0.00 5.68 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 4 R 8.13 4.28 0.00 1.61 1.07 0.00 3.25 0.00 0.00 3.40 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 5 K 8.18 4.66 0.00 1.71 1.50 0.00 1.95 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.26 0.99 7.81 6 D 8.71 4.33 0.00 2.63 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 7 H 8.04 5.07 0.00 3.38 3.45 0.00 5.46 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 F 9.10 5.10 0.00 3.04 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 9 I 8.33 4.88 1.86 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 1.10 0.56 0.93 0.00 0.00 10 V 8.94 4.74 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 0.97 0.00 0.00 0.94 0.00 0.00 11 C 9.68 4.97 0.00 2.87 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 12 G 7.78 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 0.00 0.00 0.00 0.00 13 H 8.05 4.92 0.00 3.22 3.32 0.00 5.53 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.83 4.41 0.00 4.13 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 15 I 8.14 3.68 1.87 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 1.53 0.53 0.91 0.00 0.00 16 L 7.87 3.88 0.00 1.74 1.64 0.89 1.20 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 17 A 7.79 3.93 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 18 I 7.94 3.64 1.87 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 1.54 0.77 0.91 0.00 0.00 19 N 8.16 4.38 0.00 3.00 2.85 0.00 0.00 7.12 7.19 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 20 T 7.81 3.90 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 1.10 0.00 0.00 21 I 7.91 3.68 2.03 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 1.52 0.85 0.92 0.00 0.00 22 L 8.01 3.97 0.00 1.83 1.71 0.92 0.96 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 23 Q 8.21 3.97 0.00 2.14 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 24 L 7.95 4.01 0.00 1.83 1.62 0.50 -0.04 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 25 N 8.42 4.53 0.00 2.87 2.87 0.00 0.00 7.02 8.77 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 26 Q 8.20 4.06 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.24 0.00 0.00 0.00 0.00 0.00 2.40 2.58 0.00 27 R 7.24 4.54 0.00 1.82 1.94 0.00 3.40 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.75 0.00 28 G 7.94 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 29 Q 7.87 4.66 0.00 2.20 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.69 0.00 0.00 0.00 0.00 0.00 2.41 2.58 0.00 30 N 8.71 4.87 0.00 2.71 2.78 0.00 0.00 6.37 7.68 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 31 V 8.44 5.06 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 0.94 0.00 0.00 1.00 0.00 0.00 32 T 9.36 4.78 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 1.32 0.00 0.00 33 V 8.67 4.85 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 1.03 0.00 0.00 0.96 0.00 0.00 34 I 8.53 5.14 1.90 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 1.12 1.65 0.98 0.00 0.00 35 S 8.59 4.98 0.00 3.89 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 36 N 8.72 5.19 0.00 2.86 3.00 0.00 0.00 6.43 7.79 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 37 L 7.28 4.14 0.00 1.54 1.57 0.74 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.52 0.00 2.37 1.96 0.00 3.73 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 2.10 2.13 0.00 39 E 8.91 4.04 0.00 2.06 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 2.24 1.97 0.00 40 D 7.99 4.72 0.00 2.68 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 41 D 8.02 4.59 0.00 2.83 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 42 I 8.11 3.79 2.01 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 1.69 0.88 0.94 0.00 0.00 43 K 7.89 4.04 0.00 1.78 1.81 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.32 7.81 44 Q 8.05 4.27 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.36 1.99 0.00 45 L 7.82 4.17 0.00 1.87 1.86 0.93 0.98 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 46 E 8.56 4.07 0.00 2.17 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 2.34 2.61 0.00 47 Q 7.90 4.12 0.00 2.18 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.00 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 48 R 7.77 4.22 0.00 2.13 2.16 0.00 3.39 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 49 L 8.14 4.31 0.00 1.83 1.71 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 50 G 7.28 3.76 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 0.00 0.00 0.00 51 D 8.58 4.48 0.00 2.71 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 52 N 7.81 4.89 0.00 2.73 2.70 0.00 0.00 6.63 7.46 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 53 A 7.93 4.32 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 54 D 8.49 4.82 0.00 2.80 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 55 V 7.86 4.52 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 0.86 0.00 0.00 0.94 0.00 0.00 56 I 9.21 4.34 1.89 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 1.30 0.87 0.92 0.00 0.00 57 P 0.00 4.47 0.00 2.07 2.08 0.00 3.87 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 58 G 7.90 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 0.00 0.00 0.00 59 D 7.90 5.01 0.00 2.66 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 60 S 8.71 4.45 0.00 4.05 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 61 N 9.43 4.68 0.00 2.95 3.17 0.00 0.00 6.88 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 62 D 8.12 4.69 0.00 2.77 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 63 S 8.74 4.20 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 64 S 8.75 4.17 0.00 4.04 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 65 V 7.66 3.70 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 0.85 0.00 0.00 1.06 0.00 0.00 66 L 7.79 4.00 0.00 1.92 1.71 1.05 0.59 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 67 K 8.21 3.92 0.00 1.82 1.95 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.43 7.81 68 K 7.85 3.85 0.00 1.92 2.06 0.00 1.87 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 69 A 8.32 4.20 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 70 G 8.13 3.93 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 0.00 0.00 0.00 71 I 7.38 3.67 1.85 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 1.28 0.68 0.89 0.00 0.00 72 D 8.03 4.47 0.00 2.67 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 73 R 8.27 4.54 0.00 1.92 1.85 0.00 3.01 0.00 0.00 3.17 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 74 C 7.76 4.67 0.00 2.98 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 75 R 8.42 4.06 0.00 0.67 1.63 0.00 3.08 0.00 0.00 3.44 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.81 0.00 76 A 6.85 4.48 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 77 I 8.41 4.85 1.86 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 1.24 1.60 0.94 0.00 0.00 78 L 9.27 5.08 0.00 1.61 1.54 1.07 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.10 4.69 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 80 L 8.44 4.65 0.00 1.50 1.61 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.53 4.47 0.00 4.09 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 82 D 8.36 4.95 0.00 2.66 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 83 N 7.77 4.88 0.00 2.64 2.65 0.00 0.00 7.22 8.38 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 84 D 8.66 4.47 0.00 2.73 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 85 A 8.04 3.99 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 86 D 8.94 4.38 0.00 2.84 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 87 N 8.24 4.35 0.00 2.94 2.88 0.00 0.00 6.91 7.91 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 88 A 8.22 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 89 F 8.36 4.06 0.00 3.29 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 90 V 8.27 3.57 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 0.94 0.00 0.00 1.01 0.00 0.00 91 V 7.77 3.56 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 0.97 0.00 0.00 1.00 0.00 0.00 92 L 7.67 3.85 0.00 1.50 1.43 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.16 3.86 0.00 3.82 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.86 3.94 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 95 K 7.94 3.96 0.00 1.83 1.85 0.00 1.69 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.65 1.56 7.81 96 D 7.79 4.47 0.00 2.66 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 97 M 7.44 4.22 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.49 0.00 98 S 7.83 4.40 0.00 3.84 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 99 S 8.19 4.86 0.00 3.89 4.30 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 0.00 100 D 7.66 4.57 0.00 2.81 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 0.00 101 V 7.45 3.69 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 0.68 0.00 0.00 0.90 0.00 0.00 102 K 8.76 5.23 0.00 1.86 1.85 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.49 7.81 103 T 8.81 5.18 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 1.25 0.00 0.00 104 V 8.60 4.96 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 0.97 0.00 0.00 0.95 0.00 0.00 105 L 9.06 5.21 0.00 1.68 1.42 0.93 1.26 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 0.00 106 A 8.58 5.17 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 0.00 107 V 8.10 4.43 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 0.70 0.00 0.00 0.93 0.00 0.00 108 S 10.25 4.16 0.00 3.97 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 0.00 109 D 8.53 4.87 0.00 2.67 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 0.00 110 S 8.77 4.14 0.00 4.09 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 0.00 111 K 8.34 4.05 0.00 1.92 1.92 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.69 1.63 7.81 112 N 8.51 4.61 0.00 2.82 2.85 0.00 0.00 6.52 6.75 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 0.00 113 L 7.70 3.93 0.00 1.83 1.72 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.08 4.40 0.00 2.73 2.87 0.00 0.00 6.92 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.89 4.13 0.00 1.98 1.86 0.00 1.79 0.00 0.00 1.88 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.50 7.81 116 I 7.89 3.70 1.88 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.66 0.97 0.00 0.00 117 K 8.00 3.81 0.00 2.00 1.87 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.69 1.63 7.81 118 M 8.09 4.21 0.00 2.00 2.28 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.59 0.00 119 V 7.73 4.06 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 0.78 0.00 0.00 1.00 0.00 0.00 120 H 7.93 4.01 0.00 3.24 3.35 0.00 5.85 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.52 0.00 2.33 2.05 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 1.97 1.98 0.00 122 D 8.57 4.58 0.00 2.79 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 0.00 123 I 8.16 5.06 1.85 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.84 0.91 0.00 0.00 124 I 8.51 4.91 1.85 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 1.10 0.59 0.89 0.00 0.00 125 L 9.13 4.34 0.00 1.46 1.38 0.48 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 126 S 8.49 4.64 0.00 3.95 3.78 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 0.00 127 P 0.00 4.38 0.00 2.21 2.13 0.00 3.72 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 128 Q 8.01 4.06 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.93 0.00 0.00 0.00 0.00 0.00 2.46 2.52 0.00 129 L 7.80 4.17 0.00 1.75 1.75 0.94 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.80 4.32 0.00 3.07 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 0.00 131 G 8.14 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 S 8.02 4.15 0.00 4.09 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 0.00 133 E 8.33 3.90 0.00 2.11 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 2.24 2.31 0.00 134 I 7.50 3.57 1.58 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 -0.02 0.76 0.00 0.00 135 L 7.89 3.85 0.00 1.98 1.63 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 136 A 7.83 3.95 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 0.00 137 R 7.79 3.96 0.00 2.03 1.95 0.00 3.16 0.00 0.00 3.34 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.93 0.00 138 V 7.91 3.56 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 1.01 0.00 0.00 0.95 0.00 0.00 139 L 7.97 4.10 0.00 1.68 1.70 0.90 1.09 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 0.00 140 N 7.99 4.66 0.00 2.99 2.89 0.00 0.00 7.01 8.46 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 0.00 141 G 7.77 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 0.00 142 E 7.46 4.16 0.00 2.06 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 2.33 2.26 0.00 143 E 8.50 4.46 0.00 1.94 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 2.23 2.30 0.00 144 I 8.18 4.23 1.84 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 1.43 0.52 0.88 0.00 0.00 145 N 8.31 4.76 0.00 2.95 2.97 0.00 0.00 5.83 6.96 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 0.00 146 N 8.54 4.34 0.00 2.79 2.87 0.00 0.00 6.90 8.49 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 0.00 147 D 8.07 4.43 0.00 2.77 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 0.00 148 M 7.90 4.09 0.00 1.99 2.26 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 2.61 2.59 0.00 149 L 7.84 4.15 0.00 1.84 1.86 0.99 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 150 V 7.97 3.64 2.11 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 1.03 0.00 0.00 1.00 0.00 0.00 151 S 7.79 4.11 0.00 3.95 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 0.00 152 M 8.06 4.39 0.00 2.30 2.57 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.63 0.00 153 L 7.53 4.54 0.00 1.81 1.59 0.83 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.01 4.54 0.00 1.64 1.61 0.93 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 155 N 8.57 4.51 0.00 2.65 2.83 0.00 0.00 7.08 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