NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 29 A 4.1958 8.2649 123.5654 51.9581 20.4958 178.6413 30 V 3.4836 7.9766 106.5812 63.8676 31.6886 177.3140 31 E 2.9894 6.8623 111.4324 57.7071 32.8592 181.7637 32 K 4.3652 7.9869 124.1443 54.1133 31.2988 179.1887 *34 A 4.5089 7.2271 120.8700 52.1246 20.1920 177.4025 35 G 3.5151 8.1733 107.5037 46.5161 0.0000 170.9359 36 D 5.0765 7.1397 119.0976 52.1639 43.1954 176.1132 37 W 5.2575 8.5021 121.9077 54.5924 33.9570 174.1923 38 W 5.0945 8.6857 122.4316 55.3299 30.7037 175.5769 39 V 5.1540 9.3802 118.0780 59.6633 35.8393 174.6763 40 T 4.8292 8.7068 111.3290 59.8776 72.5918 173.1340 41 V 4.2781 8.0798 122.4047 61.5029 33.8075 174.6594 42 N 5.2383 8.8763 125.9041 51.9994 41.5133 173.6960 43 A 4.7576 8.1727 119.9148 50.5759 23.1499 175.6839 44 F 4.7280 8.5944 120.0923 56.6436 39.8005 175.6982 45 I 4.4039 8.6816 125.8585 60.4032 39.3851 175.9033 46 D 4.1873 9.6978 125.9185 55.5725 38.0856 174.8448 47 G 3.9327 8.6986 106.7999 46.1452 0.0000 174.4392 48 K 4.7590 7.8049 123.2608 52.7965 35.6462 179.8645 49 E 3.8662 8.9703 126.1452 55.3746 30.1781 175.8202 50 V 4.2100 8.8065 128.9159 61.1634 33.5957 174.4695 51 E 4.1283 8.9796 129.0468 57.3857 30.3397 177.1709 52 D 4.8158 9.1816 125.2084 54.7101 39.4163 173.0933 53 P 4.3671 0.0000 0.0000 65.2018 31.9791 178.0833 54 F 4.8611 8.0736 115.8396 57.4254 39.4046 176.1679 55 G 3.9463 8.3464 108.3429 46.2759 0.0000 175.0555 56 A 4.1247 8.5280 124.5482 52.7882 19.0532 180.3213 57 G 3.8456 8.4958 104.2200 45.5483 0.0000 172.1305 58 H 4.6179 8.5951 117.2339 55.5799 29.5848 175.1694 59 L 5.1296 9.5720 122.8220 53.1225 45.3427 176.3788 60 Q 4.8003 8.3752 120.8732 54.6309 30.3278 175.2534 *62 S 4.8716 8.3559 115.6776 58.9214 64.7901 173.0767 63 T 5.1266 8.9931 112.1570 60.4232 71.7307 172.3291 64 Y 4.9187 7.9506 120.2370 55.9421 41.1455 174.1978 65 N 4.5578 9.0258 118.2551 53.5917 39.5527 175.2283 66 T 4.6082 8.2696 110.0054 61.0337 69.8958 175.6336 67 A 4.3583 8.7825 125.0646 55.0366 18.4453 178.7174 68 S 4.4123 8.1055 109.5845 58.0176 63.5444 173.1991 69 N 4.1393 8.4909 118.3476 54.2052 37.3790 174.2210 70 S 4.2354 7.8463 110.8389 58.6646 63.2213 173.3631 71 E 4.3063 8.6041 124.1451 57.2619 30.3330 177.0796 72 T 4.5316 7.7133 107.4529 61.4924 69.6658 173.5184 73 E 5.1477 7.3214 117.9445 55.0164 32.7374 173.7181 *75 W 4.5923 8.2184 116.9412 56.4509 30.8526 174.4316 76 L 4.8260 9.1272 125.3196 53.1888 44.5148 174.6830 77 D 5.0474 8.8018 125.7333 52.7365 43.8360 174.6074 78 D 4.4702 8.8952 125.0637 52.9133 39.8762 176.9522 79 L 3.7089 9.2052 118.6138 55.9564 39.6401 175.5459 80 G 4.0014 8.6892 104.4253 46.0199 0.0000 174.7894 81 N 4.6313 8.3580 117.2632 54.1350 38.7586 174.5605 82 F 4.8689 8.1290 116.6065 57.2228 42.1642 174.4205 83 W 3.9543 9.1950 134.7048 56.7789 32.3178 174.5759 84 E 3.9853 9.4188 117.5509 56.8496 25.6781 172.7561 85 Y 5.4840 9.2124 118.4935 55.4313 42.6846 175.5676 86 K 5.1551 8.9217 121.5137 55.4734 36.0807 174.4453 87 L 5.0357 9.2763 126.3613 55.1730 44.2840 173.7172 88 K 4.0783 8.1570 118.8253 55.5013 33.3062 176.9285 89 V 4.4709 7.7332 115.7588 59.3457 35.6084 174.8024 90 N 4.8407 9.1644 121.5490 53.3303 39.6802 174.4340 91 V 4.8934 8.9123 121.9112 61.2042 35.1982 174.7830 92 N 4.8400 9.0128 124.4883 51.8021 40.2932 174.1156 93 Y 4.0504 8.8892 127.8501 60.3533 39.4719 177.3249 94 A 4.0520 8.2986 121.5859 55.1111 18.6028 178.4382 95 A 4.0614 8.1842 117.0847 53.0361 18.9138 177.6843 96 R 3.8424 8.1577 114.8234 57.7561 28.2346 175.6935 97 T 5.2660 7.6757 106.1762 60.1926 72.4842 172.6226 98 F 5.5520 7.9964 116.3490 56.1174 41.8496 173.0681 99 S 4.9335 8.6703 113.6172 58.3936 66.4879 174.7492 100 T 4.5709 8.4336 111.3541 60.6913 71.0416 175.4412 101 T 4.1577 8.3709 119.6411 62.5625 67.7527 176.7933 102 G 3.7657 8.0532 116.4420 44.9921 0.0000 170.1983 103 F 4.3812 8.8868 119.7972 57.3305 39.5588 175.4645 104 V 4.5608 8.7034 123.8445 60.5363 34.8830 174.4280 105 D 4.8966 8.7358 125.1627 54.9522 41.2074 175.7559 106 N 4.7348 9.1732 122.8267 53.5683 39.3526 174.9612 107 V 4.1349 8.8378 124.8047 64.2416 32.0589 177.3594 108 T 4.1986 8.5880 117.1486 66.6596 68.5139 173.8979 109 Y 4.7828 7.4294 118.1381 55.9431 40.8019 174.8006 110 E 4.0982 8.8941 116.7035 56.5333 29.2703 175.4744 111 S 4.7088 7.5681 118.2937 57.1978 66.1237 174.7449 112 K 5.2410 9.2012 118.7733 54.7561 35.9772 175.8670 113 V 4.8829 9.0400 121.3719 61.1485 35.6544 173.7747 114 K 4.4704 8.4391 128.3463 54.4608 34.6616 174.4367 115 I 4.8674 8.4502 128.7985 59.7685 39.4365 174.9333 116 T 4.6828 7.9455 115.4202 59.7904 72.3273 172.2333 117 D 4.2052 8.7274 118.3683 54.8540 40.0773 173.6880 118 G 2.2527 7.1534 103.9536 45.1751 0.0000 173.5064 119 K 5.1474 8.7732 125.2039 54.9011 36.3563 174.6027 120 V 4.8901 8.5649 126.7315 61.1888 33.7671 174.4314 121 L 4.8103 8.6951 128.2241 52.4936 44.3546 175.6794 122 E 4.4366 8.9462 125.2167 57.0593 30.8058 176.7449 123 K 4.3443 9.5829 126.2749 57.3714 30.5821 175.9286 124 A 4.1985 7.6550 121.9044 53.5240 19.3898 178.5291 125 A 4.6424 8.1337 119.2222 51.2382 20.7260 175.7803 126 T 4.7591 7.9520 114.9631 61.9155 71.7608 174.8198 127 T 3.3389 7.9808 115.4931 59.9432 69.8908 173.7813 128 P 4.0890 0.0000 0.0000 65.3883 31.3233 177.6215 129 S 4.4019 7.7650 112.4180 57.8483 62.6630 172.2808 130 G 3.5082 7.7934 114.6065 44.6591 0.0000 171.2108 *132 P 4.5518 0.0000 0.0000 63.0114 32.8489 175.8843 133 A 4.8292 8.7646 121.5727 50.5506 23.3408 175.4636 134 D 5.1784 9.0472 119.7503 54.8018 42.3237 175.7287 135 S 5.5893 9.4691 117.1689 56.8292 66.2136 172.7254 136 I 4.8315 8.5622 121.3177 59.3255 41.0599 174.2391 137 V 4.9377 8.6882 127.6997 61.7815 35.1413 172.7560 138 Y 4.6863 8.3654 125.7965 56.6005 43.9816 173.5613 *140 V 4.2308 8.3483 116.8553 61.7647 33.4398 175.0180 141 Q 4.6539 8.1533 120.5314 54.0929 33.2298 173.9547 142 F 5.3184 8.3254 121.2009 55.4456 41.0935 176.4486 143 D 4.1795 9.2454 124.2546 55.8135 39.3159 176.8171 144 D 4.7493 8.3073 117.6776 53.0846 39.9099 175.4977 145 D 5.0780 8.4514 121.3735 53.6248 40.7651 176.9371 146 E 4.1948 8.9219 127.1996 58.9664 29.7269 178.0415 147 D 4.5558 8.4526 117.0707 54.4676 41.3273 176.2942 148 G 4.0971 7.9053 107.3593 46.3193 0.0000 173.6002 149 L 4.2903 7.9788 116.9406 54.0277 43.1280 176.7056 150 T 4.6132 8.0201 116.5204 62.3294 70.3883 173.4054 151 Y 4.8147 8.8819 125.1657 56.5229 39.9853 175.2962 152 K 4.4776 8.7490 124.7448 54.8283 34.4994 174.7545 153 V 4.4276 8.0726 128.7521 61.3759 33.1872 174.6013 154 S 4.8736 8.4146 121.7766 56.9777 66.3487 173.5307 155 G 4.6813 8.2584 110.5909 46.6013 0.0000 171.6336 156 F 6.0142 8.2101 114.3399 54.9466 42.2696 173.9878 157 R 4.0440 9.1665 120.7951 55.6997 30.2589 176.1720 158 R 4.2125 8.5815 128.2251 57.4558 29.8489 176.5273 159 T 3.8307 8.9234 116.0968 62.1718 69.5302 175.9406 160 G 3.9187 8.3117 109.3395 44.8381 0.0000 173.1149 161 F 4.8759 7.9070 120.3478 55.9893 39.9102 174.9893 162 P 4.2551 0.0000 0.0000 65.7545 31.1561 178.3122 163 A 3.9858 8.0813 120.4443 54.3813 18.3665 177.3953 164 D 4.5498 8.1936 114.2137 54.2144 41.2891 176.1561 165 D 4.4085 7.3776 119.4926 52.7825 42.6574 176.6329 166 F 4.1176 6.9325 118.1749 57.6403 39.4565 175.4942 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 29 A 8.26 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 30 V 7.98 3.48 2.17 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 0.70 0.00 0.00 0.98 0.00 0.00 31 E 6.86 2.99 0.00 2.02 1.70 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 2.21 1.93 0.00 32 K 7.99 4.37 0.00 1.78 1.71 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.39 1.26 7.81 *34 A 7.23 4.51 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 35 G 8.17 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 7.14 5.08 0.00 2.30 2.30 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 37 W 8.50 5.26 0.00 3.19 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 38 W 8.69 5.09 0.00 2.48 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 39 V 9.38 5.15 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 0.88 0.00 0.00 1.01 0.00 0.00 40 T 8.71 4.83 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 41 V 8.08 4.28 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.32 0.00 0.00 42 N 8.88 5.24 0.00 2.41 2.57 0.00 0.00 6.23 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 43 A 8.17 4.76 0.91 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 44 F 8.59 4.73 0.00 2.86 2.93 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 45 I 8.68 4.40 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 1.30 0.64 0.94 0.00 0.00 46 D 9.70 4.19 0.00 2.83 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 47 G 8.70 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 48 K 7.80 4.76 0.00 1.43 1.63 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.75 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.25 1.21 7.81 49 E 8.97 3.87 0.00 1.47 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.56 0.00 50 V 8.81 4.21 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 0.82 0.00 0.00 0.89 0.00 0.00 51 E 8.98 4.13 0.00 1.96 1.79 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 2.24 2.24 0.00 52 D 9.18 4.82 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 53 P 0.00 4.37 0.00 2.19 2.11 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.75 0.00 54 F 8.07 4.86 0.00 3.24 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 55 G 8.35 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 56 A 8.53 4.12 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 0.00 0.00 57 G 8.50 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 0.00 0.00 0.00 58 H 8.60 4.62 0.00 2.36 2.78 0.00 5.84 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 L 9.57 5.13 0.00 1.60 1.62 1.17 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 8.38 4.80 0.00 1.63 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.59 0.00 0.00 0.00 0.00 0.00 1.16 1.24 0.00 *62 S 8.36 4.87 0.00 4.05 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.99 5.13 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 1.00 0.00 0.00 64 Y 7.95 4.92 0.00 3.02 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 N 9.03 4.56 0.00 2.82 2.87 0.00 0.00 6.99 7.54 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 66 T 8.27 4.61 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 1.01 0.00 0.00 67 A 8.78 4.36 1.38 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 0.00 0.00 0.00 68 S 8.11 4.41 0.00 3.89 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 69 N 8.49 4.14 0.00 2.77 2.85 0.00 0.00 7.06 7.55 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 70 S 7.85 4.24 0.00 3.85 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 71 E 8.60 4.31 0.00 1.96 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 2.17 2.23 0.00 72 T 7.71 4.53 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 73 E 7.32 5.15 0.00 2.01 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 2.06 2.07 0.00 *75 W 8.22 4.59 0.00 2.49 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 76 L 9.13 4.83 0.00 1.34 1.34 0.22 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.80 5.05 0.00 2.64 2.69 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 0.00 0.00 0.00 0.00 78 D 8.90 4.47 0.00 2.85 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 79 L 9.21 3.71 0.00 1.80 1.77 0.86 1.20 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 80 G 8.69 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 0.00 0.00 0.00 81 N 8.36 4.63 0.00 2.93 3.00 0.00 0.00 6.60 7.58 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 82 F 8.13 4.87 0.00 3.04 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 W 9.20 3.95 0.00 3.01 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 84 E 9.42 3.99 0.00 2.36 2.24 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 2.38 2.21 0.00 85 Y 9.21 5.48 0.00 3.14 3.19 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 86 K 8.92 5.16 0.00 1.86 1.73 0.00 1.84 0.00 0.00 1.81 0.00 0.00 2.64 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.41 1.44 7.81 87 L 9.28 5.04 0.00 1.74 1.86 0.93 1.00 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 88 K 8.16 4.08 0.00 1.21 1.28 0.00 1.23 0.00 0.00 1.50 0.00 0.00 2.32 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.30 0.21 7.81 89 V 7.73 4.47 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 0.80 0.00 0.00 0.68 0.00 0.00 90 N 9.16 4.84 0.00 2.71 2.70 0.00 0.00 6.46 7.72 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 91 V 8.91 4.89 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 0.86 0.00 0.00 0.93 0.00 0.00 92 N 9.01 4.84 0.00 2.79 2.67 0.00 0.00 6.89 7.17 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 93 Y 8.89 4.05 0.00 2.92 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 94 A 8.30 4.05 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 95 A 8.18 4.06 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 96 R 8.16 3.84 0.00 1.98 2.17 0.00 2.94 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.44 0.00 97 T 7.68 5.27 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 1.20 0.00 0.00 98 F 8.00 5.55 0.00 3.07 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 S 8.67 4.93 0.00 3.88 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 0.00 100 T 8.43 4.57 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 1.12 0.00 0.00 101 T 8.37 4.16 4.20 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 0.00 0.00 0.00 1.18 0.00 0.00 102 G 8.05 3.77 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 0.00 0.00 0.00 103 F 8.89 4.38 0.00 2.91 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 0.00 104 V 8.70 4.56 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 1.04 0.00 0.00 0.89 0.00 0.00 105 D 8.74 4.90 0.00 2.64 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 0.00 0.00 0.00 0.00 106 N 9.17 4.73 0.00 2.69 2.80 0.00 0.00 7.09 7.73 0.00 0.00 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 8.84 4.13 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 0.89 0.00 0.00 1.25 0.00 0.00 108 T 8.59 4.20 4.66 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 0.00 0.00 0.00 1.38 0.00 0.00 109 Y 7.43 4.78 0.00 3.07 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 0.00 110 E 8.89 4.10 0.00 2.01 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 2.23 1.86 0.00 111 S 7.57 4.71 0.00 4.03 3.77 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 0.00 112 K 9.20 5.24 0.00 1.93 1.92 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.38 7.81 113 V 9.04 4.88 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 0.73 0.00 0.00 1.07 0.00 0.00 114 K 8.44 4.47 0.00 0.79 0.74 0.00 1.18 0.00 0.00 1.29 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.92 0.94 7.81 115 I 8.45 4.87 1.80 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.99 0.83 0.00 0.00 116 T 7.95 4.68 4.12 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 1.06 0.00 0.00 117 D 8.73 4.21 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 7.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.77 5.15 0.00 1.75 1.53 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.71 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.33 1.26 7.81 120 V 8.56 4.89 2.19 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 1.14 0.00 0.00 1.02 0.00 0.00 121 L 8.70 4.81 0.00 1.66 1.57 0.93 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.95 4.44 0.00 2.10 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 2.42 2.55 0.00 123 K 9.58 4.34 0.00 1.87 1.87 0.00 1.81 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.55 7.81 124 A 7.66 4.20 1.42 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 0.00 0.00 0.00 125 A 8.13 4.64 1.46 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 0.00 0.00 126 T 7.95 4.76 4.20 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 0.00 0.00 0.00 1.16 0.00 0.00 127 T 7.98 3.34 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 1.08 0.00 0.00 128 P 0.00 4.09 0.00 2.00 1.98 0.00 3.61 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.06 0.00 129 S 7.77 4.40 0.00 3.92 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 0.00 130 G 7.79 3.51 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 0.00 0.00 0.00 *132 P 0.00 4.55 0.00 2.15 2.13 0.00 3.80 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.01 0.00 133 A 8.76 4.83 1.38 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 0.00 0.00 0.00 134 D 9.05 5.18 0.00 2.90 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 0.00 135 S 9.47 5.59 0.00 3.94 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 0.00 136 I 8.56 4.83 0.56 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.28 0.46 0.00 0.00 137 V 8.69 4.94 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 0.92 0.00 0.00 0.91 0.00 0.00 138 Y 8.37 4.69 0.00 2.96 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *140 V 8.35 4.23 2.30 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 0.93 0.00 0.00 0.10 0.00 0.00 141 Q 8.15 4.65 0.00 1.71 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.16 0.00 142 F 8.33 5.32 0.00 2.37 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 0.00 143 D 9.25 4.18 0.00 2.53 2.41 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 0.00 144 D 8.31 4.75 0.00 3.02 2.99 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 0.00 0.00 0.00 145 D 8.45 5.08 0.00 3.16 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 0.00 146 E 8.92 4.19 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 147 D 8.45 4.56 0.00 3.05 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 0.00 148 G 7.91 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 0.00 149 L 7.98 4.29 0.00 1.12 1.20 1.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 150 T 8.02 4.61 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 1.21 0.00 0.00 151 Y 8.88 4.81 0.00 2.82 2.93 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 0.00 152 K 8.75 4.48 0.00 1.68 1.44 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.72 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.20 1.30 7.81 153 V 8.07 4.43 0.67 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 0.61 0.00 0.00 0.60 0.00 0.00 154 S 8.41 4.87 0.00 3.82 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 8.26 4.68 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 0.00 156 F 8.21 6.01 0.00 3.29 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 0.00 157 R 9.17 4.04 0.00 1.61 1.90 0.00 3.14 0.00 0.00 2.90 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.74 0.00 158 R 8.58 4.21 0.00 1.58 1.71 0.00 2.95 0.00 0.00 3.11 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.82 0.00 159 T 8.92 3.83 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 160 G 8.31 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 0.00 161 F 7.91 4.88 0.00 3.27 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 0.00 162 P 0.00 4.26 0.00 2.23 2.37 0.00 3.85 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.02 0.00 163 A 8.08 3.99 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 D 8.19 4.55 0.00 2.91 2.87 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 D 7.38 4.41 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 0.00 166 F 6.93 4.12 0.00 2.23 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.