NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 4.6730 8.4249 119.2003 53.9728 38.8610 173.3336 2 Q 4.4247 8.2709 124.8932 55.1749 29.3473 175.7189 3 C 4.5968 9.1340 116.9414 55.8183 38.9829 171.9760 4 P 4.5301 0.0000 0.0000 62.5225 31.5955 176.2353 5 T 4.1505 8.2808 110.9018 63.4074 69.0501 174.1802 6 D 4.5832 8.9626 121.9081 54.4140 38.4696 173.4849 7 W 4.8671 8.1179 118.9145 54.9167 31.6285 175.1621 8 E 4.6325 9.6175 123.4692 55.2223 30.8949 175.1547 9 A 5.0326 8.5066 125.4387 51.2161 20.7727 176.7987 10 E 4.1912 9.5277 120.2244 56.1932 33.3477 174.7747 11 G 3.8063 8.5036 116.7941 47.3294 0.0000 173.1805 12 D 4.7803 8.7297 124.6934 54.6332 41.1232 175.2331 13 H 5.3251 8.1866 115.4892 54.3727 33.6507 171.6157 14 C 5.8557 8.3691 116.2224 55.6768 38.9056 173.0126 15 Y 5.6284 9.6110 119.1268 56.6620 42.2880 174.6727 16 R 4.6613 8.9861 122.0916 55.0078 33.7062 173.2439 17 F 4.6984 8.6267 129.5553 56.8430 40.1817 174.6881 18 F 3.7081 7.7829 125.5550 54.8974 40.1666 176.2702 19 N 4.4039 7.4864 127.1696 51.7759 37.5029 174.5131 20 T 4.7214 6.9072 116.1393 61.8811 73.7474 174.8170 21 L 4.4683 8.7148 126.8924 55.5090 42.6500 176.1104 22 T 4.5687 8.8876 117.1426 61.6848 71.7347 172.4657 23 T 4.9475 8.2156 112.6078 59.9741 70.0729 175.4489 24 W 2.5400 7.8962 131.7669 60.2061 30.4203 177.9692 25 E 3.7785 7.7949 117.8938 59.4144 28.8328 178.7966 26 N 4.0990 7.8078 116.3834 56.4333 39.0022 176.8618 27 A 2.7846 7.6568 122.5375 54.6629 18.2750 179.1074 28 H 3.5628 7.5433 117.0877 59.5698 29.8769 177.2323 29 H 3.8743 7.6639 117.8511 58.8689 28.2873 177.6805 30 E 3.8000 7.7947 119.3135 59.5566 29.5954 178.5572 31 C 4.7923 8.1581 116.6099 60.0882 37.9561 176.3259 32 V 4.1000 8.1461 121.3490 65.0904 30.8670 177.8416 33 S 4.1824 7.8581 112.8316 60.3324 62.7521 174.2781 34 Y 4.5281 7.4459 119.0836 57.9798 37.9775 175.9779 35 S 4.3202 7.7534 116.7048 58.7818 63.5690 174.2789 36 C 4.6334 8.6350 119.9943 57.8298 29.9631 175.2542 37 S 4.1539 8.5710 121.1929 61.1817 62.9750 177.1273 38 T 3.9278 7.9117 110.0399 63.6121 68.6649 174.7532 39 L 4.5559 7.8713 119.5770 53.5478 42.2346 175.5141 40 N 4.1367 7.7947 115.3634 54.1773 36.9936 173.4984 41 V 4.4037 7.7717 117.4767 61.6212 33.4898 174.4774 42 R 4.7991 8.6456 127.5481 54.5800 32.3961 175.0333 43 S 5.1493 8.6125 119.2923 57.0610 64.9845 172.2167 44 D 4.9657 8.6789 124.0719 52.9914 45.2442 174.2097 45 L 4.5404 8.4957 121.4795 54.5799 42.4401 177.8922 46 V 3.8057 8.5769 122.3665 62.4262 32.0931 175.3856 47 S 3.6778 8.4186 118.2861 55.8266 65.0641 173.4861 48 V 4.3547 5.6950 121.0008 61.7314 33.3223 174.7619 49 H 5.0034 9.0048 123.4288 55.1164 29.9319 174.0266 50 S 4.3590 6.8741 113.0198 56.1399 66.2649 175.7633 51 A 3.8728 8.3458 124.2164 55.4268 18.0458 179.9533 52 A 3.9611 7.8553 118.7356 55.1940 18.4679 179.3576 53 E 3.9404 8.3997 118.1508 59.1845 29.6673 178.4370 54 Q 4.2093 8.1649 119.7284 59.5049 29.0810 178.5698 55 A 4.1158 8.2247 121.4372 55.3254 18.4642 178.7590 56 Y 3.8593 8.2260 117.9792 60.8804 38.8243 178.5732 57 V 3.5920 8.1949 119.0170 65.9601 31.6339 177.4953 58 F 4.6513 9.0278 120.7660 61.9463 39.3022 176.9912 59 N 4.1060 8.8071 116.1214 55.9206 38.3382 177.0563 60 Y 3.9708 7.7919 121.2550 60.3512 38.8733 177.1343 61 W 3.2219 7.8593 129.3083 60.5661 30.5074 177.9993 62 R 3.4408 7.3265 116.0277 57.7498 29.4654 178.8408 63 G 3.5610 7.5810 105.3430 46.7694 0.0000 175.1031 64 I 4.2600 6.7609 119.6783 61.5272 38.2320 175.4341 65 D 4.7014 7.4846 120.1770 52.7811 41.4744 175.9518 66 S 4.3893 8.3848 120.7725 58.7103 64.1904 174.6473 67 Q 4.0545 8.0215 120.7598 55.2107 29.0244 175.9507 68 A 3.5696 8.4872 124.8160 51.3125 19.1225 177.8576 69 G 4.1141 7.3839 108.3270 45.4864 0.0000 170.7347 70 Q 5.0903 7.8899 117.4629 53.9115 32.9074 174.8827 71 L 4.2818 7.9963 121.3943 52.5727 44.2191 175.7456 72 W 5.1969 8.8630 127.8446 57.2671 30.4978 175.4737 73 I 4.8436 8.9951 116.3151 58.5743 41.4808 175.0991 74 G 4.4856 9.2534 107.0210 46.8232 0.0000 172.6917 75 L 5.2016 8.2227 123.1195 53.8268 43.6280 174.9586 76 Y 5.2229 9.0174 122.5402 55.9263 41.9407 174.2172 77 D 4.3775 7.8940 119.1216 52.4761 40.1098 177.5490 78 K 3.5117 7.5080 122.2966 59.3523 31.8371 176.7956 79 Y 4.4481 6.9681 112.2187 57.7994 38.4065 175.5658 80 N 4.3866 7.6599 114.5084 52.0567 40.9428 171.6289 81 E 3.9198 8.3753 122.7249 57.6187 30.0821 176.9264 82 G 3.8560 9.5658 115.0453 44.8009 0.0000 172.5704 83 D 4.7368 7.4744 119.1450 52.5085 41.3094 175.1263 84 F 4.5397 8.7555 124.3976 56.7917 39.9661 174.9200 85 I 4.6479 8.6834 116.7319 58.7350 41.6549 174.1008 86 W 5.6834 8.6382 122.0714 55.6680 30.1467 178.0490 87 T 4.0812 9.4266 115.6656 64.7532 68.1442 174.6029 88 D 4.7755 7.8683 118.4833 52.2082 39.6052 177.4231 89 G 4.1046 8.4971 108.3452 45.9229 0.0000 174.6167 90 S 4.4543 8.3918 114.1657 57.7721 63.7307 174.3717 91 K 4.4701 8.4593 120.7645 56.7701 32.8188 177.5585 92 V 4.7223 8.3411 114.1409 61.4384 31.5327 177.7455 93 G 3.8829 8.4421 109.8632 47.6776 0.0000 173.3695 94 Y 4.7220 8.2891 120.4727 56.1562 40.2087 174.4592 95 T 3.6081 7.2072 115.2161 59.6457 72.6781 173.7650 96 K 3.7362 4.0000 120.8501 54.4910 32.1226 175.6934 97 W 4.6606 7.1260 119.4961 56.3873 30.3287 178.1193 98 A 4.1867 9.3065 126.6898 51.5501 19.3643 177.0205 99 G 3.7604 8.5401 107.2289 47.9071 0.0000 174.3027 100 G 4.0730 9.3127 112.5617 45.2094 0.0000 172.9290 101 Q 4.6395 7.5773 117.8293 52.9649 31.7647 173.5099 102 P 4.4111 0.0000 0.0000 61.6589 32.1051 175.7495 103 D 4.7359 8.8516 118.4209 52.2006 40.7347 175.0285 104 N 4.1707 9.0068 118.8230 54.0358 38.2787 173.8170 105 W 4.5476 8.4693 126.6939 59.1860 31.5499 174.8703 106 N 3.9559 8.5258 120.8728 54.0472 35.6899 173.2591 107 N 4.1817 7.9906 112.0220 54.4589 37.7061 174.2711 108 A 4.5986 8.0515 114.0081 51.5711 20.3517 176.1999 109 E 4.6825 8.3045 119.2266 56.6303 30.6635 175.3190 110 D 5.4316 8.1547 121.6384 52.7978 43.3385 174.8317 111 Y 4.3519 8.0002 117.2795 55.9149 41.3154 175.3975 112 G 4.4660 9.6212 112.1407 46.1813 0.0000 172.4824 113 Q 5.2445 8.8013 118.3386 54.6222 32.5236 173.7660 114 F 5.3463 9.0770 121.1941 58.0262 40.4268 175.4664 115 R 4.9690 9.3763 122.6664 56.0280 31.4921 176.8601 116 H 4.8348 8.9513 114.4127 56.9235 29.3159 175.0306 117 T 4.4833 7.7868 109.3983 60.0870 71.5236 173.0550 118 E 3.7908 9.2661 117.7236 57.6818 26.8116 176.0944 119 G 3.0977 8.6397 101.0244 46.1160 0.0000 174.2224 120 G 3.9214 7.3704 105.3341 44.1853 0.0000 174.0452 121 A 3.9757 7.2190 120.6171 52.2642 19.4347 177.9010 122 W 5.3921 9.2612 121.3876 56.0552 31.1328 175.1355 123 N 5.7149 9.5836 121.9076 51.8813 42.1233 172.4980 124 D 5.5838 8.8555 123.4859 52.6484 42.0126 174.8376 125 N 5.6042 9.6828 120.6558 52.4487 43.1687 172.6223 126 S 5.6010 9.3503 114.2009 55.7935 65.5653 175.2606 127 A 3.7977 8.9661 121.8866 54.0970 18.2261 178.2667 128 A 4.3664 7.7106 117.4988 53.2176 19.5661 177.6426 129 A 4.5185 7.8817 117.4932 52.2579 19.8177 176.5833 130 Q 5.3122 8.5590 117.0218 54.6105 32.2636 174.8333 131 A 4.4418 8.8604 122.1908 50.7337 23.3564 175.9805 132 K 5.1569 8.6866 119.4954 56.0906 34.0093 175.6014 133 Y 5.1906 7.9682 116.9569 56.1899 41.9973 173.6110 134 M 5.1292 8.5187 119.5570 54.2425 35.5194 173.7881 135 C 5.5658 9.3072 123.5119 55.6659 40.2786 172.5966 136 K 5.1786 9.1531 121.5381 54.9465 35.2626 174.8470 137 L 4.6813 8.9950 127.2277 53.7944 43.6435 175.6173 138 T 4.5010 8.4470 120.0674 61.7989 71.6234 173.4327 139 F 4.5189 8.5913 126.1185 56.0740 38.6981 175.5281 140 E 4.1986 8.6414 123.9706 56.2005 29.0750 176.1086 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 N 8.42 4.67 0.00 2.70 2.85 0.00 0.00 6.90 6.19 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 2 Q 8.27 4.42 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.86 0.00 0.00 0.00 0.00 0.00 2.18 2.44 0.00 3 C 9.13 4.60 0.00 3.20 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.53 0.00 1.94 1.93 0.00 3.46 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.98 0.00 5 T 8.28 4.15 4.31 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 1.26 0.00 0.00 6 D 8.96 4.58 0.00 2.85 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 7 W 8.12 4.87 0.00 3.36 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 8 E 9.62 4.63 0.00 1.76 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.47 0.00 9 A 8.51 5.03 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 10 E 9.53 4.19 0.00 1.16 1.24 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 1.47 1.88 0.00 11 G 8.50 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 0.00 0.00 0.00 12 D 8.73 4.78 0.00 2.55 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 13 H 8.19 5.33 0.00 3.20 2.73 0.00 5.55 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 14 C 8.37 5.86 0.00 2.76 3.23 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 15 Y 9.61 5.63 0.00 3.23 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 16 R 8.99 4.66 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.74 0.00 17 F 8.63 4.70 0.00 2.14 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 0.00 0.00 0.00 0.00 18 F 7.78 3.71 0.00 1.51 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 0.00 0.00 0.00 0.00 19 N 7.49 4.40 0.00 2.42 2.62 0.00 0.00 7.02 7.70 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 20 T 6.91 4.72 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 1.28 0.00 0.00 21 L 8.71 4.47 0.00 1.59 1.69 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.89 4.57 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 1.12 0.00 0.00 23 T 8.22 4.95 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 1.28 0.00 0.00 24 W 7.90 2.54 0.00 1.78 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 E 7.79 3.78 0.00 1.93 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 2.49 2.33 0.00 26 N 7.81 4.10 0.00 2.72 2.60 0.00 0.00 7.11 7.28 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 27 A 7.66 2.78 0.68 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 0.00 0.00 28 H 7.54 3.56 0.00 1.79 2.83 0.00 5.61 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 29 H 7.66 3.87 0.00 3.15 3.15 0.00 5.68 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 30 E 7.79 3.80 0.00 1.62 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 2.22 2.23 0.00 31 C 8.16 4.79 0.00 3.11 3.27 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 32 V 8.15 4.10 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 1.22 0.00 0.00 0.81 0.00 0.00 33 S 7.86 4.18 0.00 3.83 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 34 Y 7.45 4.53 0.00 3.38 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.75 4.32 0.00 3.87 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 36 C 8.63 4.63 0.00 2.89 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 37 S 8.57 4.15 0.00 3.99 4.10 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 38 T 7.91 3.93 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 39 L 7.87 4.56 0.00 1.65 1.75 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 40 N 7.79 4.14 0.00 2.92 2.94 0.00 0.00 6.57 7.70 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 41 V 7.77 4.40 1.98 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 0.51 0.00 0.00 1.02 0.00 0.00 42 R 8.65 4.80 0.00 1.66 1.77 0.00 3.28 0.00 0.00 3.04 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.65 0.00 43 S 8.61 5.15 0.00 3.88 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 44 D 8.68 4.97 0.00 2.79 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.50 4.54 0.00 1.47 1.69 -0.02 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.58 3.81 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 1.13 0.00 0.00 47 S 8.42 3.68 0.00 2.72 3.54 0.00 0.00 0.00 0.00 0.00 0.00 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 V 5.69 4.35 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 1.07 0.00 0.00 1.23 0.00 0.00 49 H 9.00 5.00 0.00 3.10 3.35 0.00 5.94 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 50 S 6.87 4.36 0.00 3.94 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 51 A 8.35 3.87 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 52 A 7.86 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 53 E 8.40 3.94 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 54 Q 8.16 4.21 0.00 2.20 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 55 A 8.22 4.12 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 56 Y 8.23 3.86 0.00 3.11 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 57 V 8.19 3.59 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.16 0.00 0.00 58 F 9.03 4.65 0.00 3.40 3.36 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 59 N 8.81 4.11 0.00 2.73 2.78 0.00 0.00 6.75 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 60 Y 7.79 3.97 0.00 2.44 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 61 W 7.86 3.22 0.00 2.83 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 62 R 7.33 3.44 0.00 1.00 1.28 0.00 2.21 0.00 0.00 2.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 63 G 7.58 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 6.76 4.26 1.72 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.06 1.10 0.00 0.00 65 D 7.48 4.70 0.00 2.61 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.38 4.39 0.00 3.93 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 67 Q 8.02 4.05 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 68 A 8.49 3.57 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 G 7.38 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 70 Q 7.89 5.09 0.00 1.79 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 71 L 8.00 4.28 0.00 0.27 0.35 0.21 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 72 W 8.86 5.20 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 73 I 9.00 4.84 2.14 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.94 0.45 0.00 0.00 74 G 9.25 4.49 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 0.00 75 L 8.22 5.20 0.00 1.10 1.33 -0.37 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 9.02 5.22 0.00 2.63 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.89 4.38 0.00 2.11 1.54 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.51 3.51 0.00 1.32 1.46 0.00 1.67 0.00 0.00 2.24 0.00 0.00 2.65 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.30 1.07 7.81 79 Y 6.97 4.45 0.00 2.84 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 80 N 7.66 4.39 0.00 2.71 2.50 0.00 0.00 6.74 7.14 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 81 E 8.38 3.92 0.00 1.79 1.76 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 2.20 2.29 0.00 82 G 9.57 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 7.47 4.74 0.00 2.60 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 F 8.76 4.54 0.00 3.19 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 85 I 8.68 4.65 1.99 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 1.03 0.89 0.93 0.00 0.00 86 W 8.64 5.68 0.00 3.52 3.33 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 87 T 9.43 4.08 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 0.84 0.00 0.00 88 D 7.87 4.78 0.00 2.84 2.97 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 0.00 0.00 0.00 0.00 89 G 8.50 4.10 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 0.00 90 S 8.39 4.45 0.00 3.96 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 91 K 8.46 4.47 0.00 1.91 1.95 0.00 1.85 0.00 0.00 1.85 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.50 7.81 92 V 8.34 4.72 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 0.80 0.00 0.00 1.07 0.00 0.00 93 G 8.44 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 94 Y 8.29 4.72 0.00 3.20 3.34 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 95 T 7.21 3.61 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 1.30 0.00 0.00 96 K 4.00 3.74 0.00 0.79 0.74 0.00 1.54 0.00 0.00 1.43 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.91 1.03 7.81 97 W 7.13 4.66 0.00 3.11 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 A 9.31 4.19 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 99 G 8.54 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 0.00 100 G 9.31 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 7.58 4.64 0.00 2.37 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 102 P 0.00 4.41 0.00 1.92 0.49 0.00 2.50 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.64 0.00 103 D 8.85 4.74 0.00 2.88 2.97 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 0.00 0.00 0.00 0.00 104 N 9.01 4.17 0.00 2.95 2.80 0.00 0.00 6.79 7.52 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 0.00 105 W 8.47 4.55 0.00 3.55 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 0.00 106 N 8.53 3.96 0.00 2.72 2.66 0.00 0.00 7.08 8.00 0.00 0.00 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 N 7.99 4.18 0.00 2.71 2.75 0.00 0.00 6.73 8.11 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 0.00 108 A 8.05 4.60 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 0.00 109 E 8.30 4.68 0.00 2.00 2.02 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 2.42 2.65 0.00 110 D 8.15 5.43 0.00 1.58 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 0.00 0.00 0.00 111 Y 8.00 4.35 0.00 2.82 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 9.62 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.80 5.24 0.00 1.91 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.56 2.37 0.00 114 F 9.08 5.35 0.00 2.88 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 0.00 115 R 9.38 4.97 0.00 1.98 1.99 0.00 3.19 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 116 H 8.95 4.83 0.00 2.93 3.70 0.00 5.51 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 0.00 117 T 7.79 4.48 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 118 E 9.27 3.79 0.00 2.08 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 2.22 0.00 119 G 8.64 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 0.00 0.00 0.00 120 G 7.37 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 0.00 121 A 7.22 3.98 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 W 9.26 5.39 0.00 2.69 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 0.00 123 N 9.58 5.71 0.00 2.92 2.76 0.00 0.00 6.87 8.03 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 0.00 124 D 8.86 5.58 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 N 9.68 5.60 0.00 3.03 3.16 0.00 0.00 6.55 6.99 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 0.00 126 S 9.35 5.60 0.00 4.10 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 8.97 3.80 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 0.00 128 A 7.71 4.37 1.35 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 0.00 0.00 0.00 129 A 7.88 4.52 1.59 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 0.00 0.00 130 Q 8.56 5.31 0.00 1.99 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.68 0.00 0.00 0.00 0.00 0.00 2.39 2.42 0.00 131 A 8.86 4.44 0.01 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 0.00 132 K 8.69 5.16 0.00 1.77 2.00 0.00 1.75 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.62 1.95 7.81 133 Y 7.97 5.19 0.00 3.03 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 0.00 134 M 8.52 5.13 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.63 0.00 135 C 9.31 5.57 0.00 3.04 3.33 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 0.00 136 K 9.15 5.18 0.00 1.67 1.52 0.00 1.50 0.00 0.00 1.47 0.00 0.00 2.40 0.00 0.00 2.24 0.00 0.00 0.00 0.00 1.03 0.66 7.81 137 L 9.00 4.68 0.00 1.13 0.74 0.09 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 138 T 8.45 4.50 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 1.20 0.00 0.00 139 F 8.59 4.52 0.00 2.90 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 0.00 140 E 8.64 4.20 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00