NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 V 3.9467 8.0544 120.3869 62.3546 32.6945 174.8734 29 S 4.0235 8.4898 122.3126 57.4016 63.0118 167.1521 30 V 4.5234 8.1310 126.8154 60.5171 34.8104 174.2139 31 Q 4.1350 8.5556 128.3729 55.4515 29.1732 174.9167 32 P 4.3455 0.0000 0.0000 62.9371 32.3261 175.5679 33 N 4.1448 8.7987 119.0043 54.3049 37.3971 174.4606 34 F 4.4542 8.3660 118.1513 58.5764 40.5061 174.5186 35 Q 4.2255 8.1790 127.7212 53.3914 28.6551 175.6724 36 Q 3.8196 8.0892 124.2456 59.0192 28.7515 177.5053 37 D 4.4185 7.9284 119.6538 56.2945 39.2829 178.2572 38 K 4.0384 7.5631 118.0294 58.0162 32.1632 178.1826 39 F 5.0306 7.9329 119.5287 58.6837 39.7440 175.3850 40 L 4.3620 6.9827 117.4349 55.4589 42.6116 176.4691 41 G 3.6732 8.7869 105.0694 43.9269 0.0000 171.9162 42 R 4.3379 7.9514 120.8118 55.7164 30.8186 177.2082 43 W 4.9725 9.0344 125.3709 54.7664 34.0375 174.0533 44 F 5.2494 9.1886 120.0372 55.5169 42.1697 174.7855 45 S 4.7997 9.0559 118.9080 58.6038 63.2761 174.2486 46 A 4.7142 9.1022 127.5215 52.2169 21.0986 175.9619 47 G 4.1906 7.6440 100.4880 45.6943 0.0000 172.3807 48 L 5.3905 8.8284 119.9582 54.4875 44.4276 174.2694 49 A 4.9440 8.6865 121.0504 49.3096 22.3658 175.0987 50 S 4.5728 8.0443 114.7391 56.5602 65.7700 172.8916 51 N 4.8498 8.2517 121.1429 52.6552 38.0177 174.6334 52 S 4.4880 7.6440 114.3948 56.5400 63.6812 173.6776 53 S 4.2816 8.9276 123.5077 61.1939 62.7357 175.9638 54 W 4.3232 8.2102 119.4936 59.3536 27.9931 177.2711 55 L 3.7641 6.0819 119.1988 53.7953 37.8079 178.2765 *62 L 4.2751 7.6843 124.5332 54.0692 42.9739 175.7049 63 S 4.7939 8.1226 112.2286 56.6054 66.1696 172.9520 64 M 4.6087 8.9117 121.3432 55.3888 32.5263 175.0789 65 C 5.1024 8.7950 119.7315 56.1801 33.6657 172.7141 66 K 4.5102 8.6122 121.9561 56.0749 33.4963 175.4494 67 S 5.1551 8.8589 123.0923 56.6064 66.7014 172.9970 68 V 4.6881 8.9729 123.8421 61.0852 34.0927 174.1476 69 V 4.8804 8.8503 128.2731 61.3792 33.2432 174.3500 70 A 5.1316 8.8997 128.8184 49.1960 22.9472 173.2610 71 P 4.8183 0.0000 0.0000 62.8504 32.2091 176.0718 72 A 4.6637 8.7718 125.6073 50.6523 20.7377 178.3515 73 T 3.8402 8.7707 116.7218 66.7737 68.6373 175.0984 74 D 4.6133 8.1154 118.0551 53.3879 39.4879 177.2207 75 G 4.0905 8.5234 109.2289 45.6007 0.0000 175.2961 76 G 4.3684 8.6272 114.5793 45.5654 0.0000 172.6339 77 L 5.2540 8.7354 121.6162 53.0425 46.2517 175.4652 78 N 5.2127 9.5290 120.6651 51.8356 40.6076 173.7776 79 L 4.9246 9.0511 127.4886 53.9333 43.9448 175.0125 80 T 5.0268 8.9909 124.9298 62.1056 70.5642 174.1413 81 S 5.4759 9.2728 123.2738 56.8430 66.3656 173.3988 82 T 5.7818 8.6938 111.9241 59.0859 71.5062 173.0512 83 F 5.1225 8.1383 119.1160 56.0247 41.9450 173.4923 84 L 4.8744 8.6582 122.1640 54.0244 42.2267 177.2114 85 R 4.6158 8.8399 123.9315 54.4459 34.0837 175.9608 86 K 3.7432 8.8993 125.5955 58.0986 31.1505 175.6476 87 N 4.8961 9.3304 122.2247 53.5282 39.2664 173.9642 88 Q 4.4781 8.1521 116.7403 54.2788 31.5197 173.8862 89 C 4.8528 8.3477 120.2677 57.9825 32.3807 172.9709 90 E 4.1403 8.4493 127.0762 56.2116 30.5967 176.1027 91 T 5.1323 8.2100 118.2660 61.9069 71.6449 173.6327 92 R 4.8569 9.4006 124.6007 54.6683 34.4284 174.5077 93 T 5.1253 8.5721 117.9226 62.1019 71.8473 173.0419 94 M 4.7513 8.9966 126.0080 53.3701 34.9604 174.5784 95 L 4.8439 8.8455 125.7880 54.0335 43.4362 175.7925 96 L 4.7990 9.0340 128.4084 53.5017 42.7016 175.9602 97 Q 4.7842 9.2500 124.6633 54.5287 30.2292 174.2920 98 P 4.4874 0.0000 0.0000 63.0814 31.9358 175.8773 99 A 4.5726 8.5105 124.4581 51.8916 19.4838 177.6168 100 G 4.0158 9.2339 105.9806 46.0626 0.0000 174.4027 101 S 4.6079 7.5364 113.4854 55.7716 66.0250 173.3908 102 L 4.0843 8.4163 123.3835 56.5913 41.7494 177.6194 103 G 2.8757 8.8354 111.9716 44.3102 0.0000 171.9157 104 S 4.8834 7.3913 115.1040 56.5640 64.9047 172.5041 105 Y 5.3538 9.2548 123.3085 56.5025 43.0821 173.7912 106 S 5.3028 9.4295 114.7036 56.8709 66.1093 171.9265 107 Y 5.2069 9.4362 127.5937 55.8598 41.8748 173.6485 108 R 4.6262 8.2774 126.6895 54.7340 31.8891 175.2749 109 S 4.3744 8.7682 122.4947 55.9560 63.0069 172.5497 110 P 4.2920 0.0000 0.0000 65.7528 31.4779 178.9831 111 H 4.1439 8.2197 113.9397 58.0916 28.6490 176.0486 112 W 4.6833 8.0742 116.7652 55.5858 29.0840 176.1283 113 G 4.1344 8.1537 107.0882 46.4164 0.0000 173.2698 114 S 4.8503 7.8687 112.6880 56.5605 67.9190 173.1567 115 T 5.0196 8.2198 111.8168 60.2039 71.6509 172.6546 116 Y 5.2883 9.1713 120.9947 56.3163 42.5546 174.4154 117 S 5.2204 9.4644 118.0088 57.2869 65.6379 173.1921 118 V 4.9487 9.0659 122.8875 61.3438 34.6425 174.1657 119 S 5.0488 9.1297 123.6446 56.7162 66.7233 173.8405 120 V 3.9716 8.3326 124.8733 61.9670 31.0124 176.5680 121 V 3.9058 8.5027 129.2026 64.9750 32.7960 175.5305 122 E 4.9463 7.7132 120.0763 55.2657 32.9762 173.9025 123 T 4.1818 8.8879 120.0047 61.0372 70.7575 172.7352 124 D 4.5572 7.3022 124.9583 52.6838 40.0083 177.6150 125 Y 4.3466 7.9093 123.1346 59.1184 37.3440 170.1687 126 D 4.7419 8.5644 116.7338 54.8010 42.1389 176.9802 127 Q 4.6806 9.0545 116.3173 57.0842 32.4836 174.7614 128 Y 5.8766 8.2259 114.3125 55.8195 42.0673 173.8224 129 A 4.7418 9.2939 121.4400 50.4440 23.2105 174.9270 130 L 4.8968 9.2197 122.6269 52.9746 43.8950 175.7108 131 L 5.2687 8.9182 123.9998 52.9814 45.5394 174.9451 132 Y 5.3125 8.9185 122.2970 56.0903 42.3565 174.2014 133 S 5.2531 8.3739 122.2112 56.6782 67.0070 173.0577 134 Q 5.0227 9.0024 121.0041 54.0171 32.1091 174.7161 135 G 4.0011 9.0066 109.3173 47.1028 0.0000 173.0399 136 S 4.8096 8.9697 116.7675 58.8137 65.4780 174.5079 137 K 4.4788 7.5954 117.1613 55.5771 37.0500 177.7330 138 G 4.0319 8.6062 109.2919 45.1107 0.0000 172.0976 139 P 4.2720 0.0000 0.0000 65.4811 31.4485 177.6407 140 G 4.0472 8.4798 106.3465 45.4006 0.0000 174.9854 141 E 3.8621 7.9953 123.1545 58.7375 29.5629 177.6828 142 D 4.5917 7.9862 115.7619 54.0368 40.5072 176.2811 143 F 4.5397 8.1897 124.0945 58.8855 40.5949 174.0783 144 R 4.7560 7.5225 122.3803 54.9151 34.8269 173.6383 145 M 4.5951 8.2951 121.2181 54.2725 36.3243 172.9266 146 A 5.4129 8.4606 128.1475 50.7445 21.8538 175.7005 147 T 4.9781 9.3599 118.0896 61.6058 72.8109 172.6412 148 L 4.7650 8.2639 127.6782 53.5274 44.0789 174.4396 149 Y 5.5983 8.9888 124.5875 56.2866 40.8239 174.9380 150 S 5.5404 9.3001 117.8893 56.7882 65.9621 175.3408 151 R 4.1153 9.4390 121.8775 58.2243 30.3518 176.5975 152 T 4.6738 7.8860 107.3899 59.5543 71.3903 174.0894 153 Q 3.6405 8.0340 119.7194 56.9894 28.9143 176.7517 154 T 4.3871 7.1083 108.3548 58.4482 68.6362 171.1984 155 P 4.3752 0.0000 0.0000 62.5062 32.3099 177.1200 156 R 4.0898 8.4570 118.8927 55.5584 30.5036 177.1474 157 A 3.9092 8.7036 120.9040 55.8111 18.1691 180.0565 158 E 4.1708 8.0586 117.5263 58.7480 29.5113 179.1057 159 L 3.9493 7.8385 120.5889 57.7225 42.1124 178.9986 160 K 4.3080 7.9861 118.1466 59.4584 31.5725 178.9638 161 E 4.0127 8.4220 118.9803 59.2242 29.3324 179.1560 162 K 3.9577 8.1948 119.6761 59.6479 32.1657 178.5844 163 F 4.4251 8.5717 120.8324 61.6145 39.3582 177.0568 164 T 3.7441 8.4770 115.3788 66.7792 68.2681 176.4162 165 A 4.0205 8.1943 122.5195 54.9114 18.2415 179.4695 166 F 4.1717 8.6167 119.6680 61.6281 39.4784 177.1521 167 C 3.7921 7.9404 116.4765 62.5867 27.9880 175.9352 168 K 3.9494 7.9831 120.8906 59.5709 31.5119 178.6008 169 A 3.9619 7.8567 119.9348 54.6302 18.2363 178.5458 170 Q 4.0625 7.0877 114.3331 55.3936 28.9581 176.8389 171 G 3.6564 7.5559 107.5725 45.2814 0.0000 173.9481 172 F 4.4065 7.3697 119.1091 56.7769 39.8031 175.8513 173 T 4.2597 8.2916 115.2098 60.6400 70.2242 175.0103 174 E 3.9093 8.8823 123.8108 59.4984 29.6443 178.9526 175 D 4.4490 8.0895 117.0034 55.6944 39.6789 176.8657 176 T 4.2270 8.0216 109.0750 61.8692 69.5772 173.9947 177 I 4.1665 7.2110 124.1884 60.7463 38.1633 175.4944 178 V 4.3441 8.8915 126.9699 61.0357 34.3888 174.1046 179 F 4.9841 8.8881 126.8782 56.7007 40.0914 175.1382 180 L 4.6275 8.7555 125.2159 52.9821 42.3953 174.9846 181 P 4.5274 0.0000 0.0000 62.0784 33.1712 176.4265 182 Q 4.0931 8.5186 121.6202 56.5401 29.0194 175.7084 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 28 V 8.05 3.95 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 0.98 0.00 0.00 1.01 0.00 0.00 29 S 8.49 4.02 0.00 3.96 3.72 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 30 V 8.13 4.52 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.85 0.00 0.00 31 Q 8.56 4.14 0.00 2.13 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.64 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 32 P 0.00 4.35 0.00 2.02 2.00 0.00 3.92 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 33 N 8.80 4.14 0.00 2.83 2.90 0.00 0.00 6.98 7.02 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 34 F 8.37 4.45 0.00 3.18 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 35 Q 8.18 4.23 0.00 1.26 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.54 0.00 0.00 0.00 0.00 0.00 2.26 2.09 0.00 36 Q 8.09 3.82 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.90 0.00 0.00 0.00 0.00 0.00 2.62 2.80 0.00 37 D 7.93 4.42 0.00 2.88 2.89 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 38 K 7.56 4.04 0.00 1.06 1.52 0.00 0.84 0.00 0.00 1.34 0.00 0.00 2.80 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.09 7.81 39 F 7.93 5.03 0.00 3.25 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 40 L 6.98 4.36 0.00 1.72 1.63 0.99 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.79 3.67 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 0.00 0.00 0.00 42 R 7.95 4.34 0.00 1.62 1.57 0.00 3.06 0.00 0.00 3.10 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.20 0.00 43 W 9.03 4.97 0.00 2.62 2.38 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 44 F 9.19 5.25 0.00 3.00 2.88 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 45 S 9.06 4.80 0.00 4.00 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 46 A 9.10 4.71 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 47 G 7.64 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 0.00 0.00 0.00 0.00 48 L 8.83 5.39 0.00 1.71 1.68 0.79 0.81 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 49 A 8.69 4.94 0.44 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 50 S 8.04 4.57 0.00 3.55 3.46 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 51 N 8.25 4.85 0.00 2.70 2.92 0.00 0.00 6.64 8.70 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 52 S 7.64 4.49 0.00 3.67 3.68 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 53 S 8.93 4.28 0.00 4.06 4.02 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 54 W 8.21 4.32 0.00 3.48 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 55 L 6.08 3.76 0.00 1.71 1.55 0.92 0.96 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 *62 L 7.68 4.28 0.00 1.67 1.73 0.97 0.91 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 63 S 8.12 4.79 0.00 3.95 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 M 8.91 4.61 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.48 0.00 65 C 8.79 5.10 0.00 3.36 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 66 K 8.61 4.51 0.00 1.95 1.69 0.00 1.50 0.00 0.00 1.84 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.22 0.84 7.81 67 S 8.86 5.16 0.00 3.28 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.97 4.69 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 0.93 0.00 0.00 0.84 0.00 0.00 69 V 8.85 4.88 2.18 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 1.17 0.00 0.00 1.02 0.00 0.00 70 A 8.90 5.13 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 71 P 0.00 4.82 0.00 1.99 2.06 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 72 A 8.77 4.66 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 73 T 8.77 3.84 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 74 D 8.12 4.61 0.00 2.83 2.81 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 75 G 8.52 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 0.00 0.00 0.00 76 G 8.63 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 77 L 8.74 5.25 0.00 1.35 1.51 0.86 1.09 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 78 N 9.53 5.21 0.00 2.62 2.76 0.00 0.00 6.40 7.30 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 79 L 9.05 4.92 0.00 1.70 1.61 1.07 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 80 T 8.99 5.03 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 1.27 0.00 0.00 81 S 9.27 5.48 0.00 3.77 3.79 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 82 T 8.69 5.78 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 83 F 8.14 5.12 0.00 3.15 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 84 L 8.66 4.87 0.00 1.45 1.49 0.92 0.72 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 85 R 8.84 4.62 0.00 1.92 1.80 0.00 3.29 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.70 0.00 86 K 8.90 3.74 0.00 1.93 1.12 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.46 7.81 87 N 9.33 4.90 0.00 2.69 2.81 0.00 0.00 6.55 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 88 Q 8.15 4.48 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.77 0.00 0.00 0.00 0.00 0.00 2.42 2.30 0.00 89 C 8.35 4.85 0.00 2.94 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 90 E 8.45 4.14 0.00 1.16 1.29 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 1.91 2.11 0.00 91 T 8.21 5.13 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 92 R 9.40 4.86 0.00 1.74 1.86 0.00 3.36 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.97 0.00 93 T 8.57 5.13 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 94 M 9.00 4.75 0.00 1.33 1.72 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.15 0.00 95 L 8.85 4.84 0.00 1.73 1.73 1.08 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 96 L 9.03 4.80 0.00 1.40 1.39 0.62 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 9.25 4.78 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.94 0.00 0.00 0.00 0.00 0.00 2.65 2.46 0.00 98 P 0.00 4.49 0.00 1.96 2.02 0.00 3.73 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 2.20 2.30 0.00 99 A 8.51 4.57 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 0.00 100 G 9.23 4.02 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 0.00 0.00 0.00 101 S 7.54 4.61 0.00 3.89 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 0.00 102 L 8.42 4.08 0.00 1.74 1.89 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 103 G 8.84 2.88 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 0.00 104 S 7.39 4.88 0.00 3.71 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 0.00 105 Y 9.25 5.35 0.00 2.94 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 0.00 106 S 9.43 5.30 0.00 3.91 3.74 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 0.00 107 Y 9.44 5.21 0.00 3.08 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 0.00 108 R 8.28 4.63 0.00 1.74 1.66 0.00 3.40 0.00 0.00 3.10 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 109 S 8.77 4.37 0.00 4.07 4.08 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 0.00 110 P 0.00 4.29 0.00 2.21 2.08 0.00 3.61 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 2.09 2.08 0.00 111 H 8.22 4.14 0.00 2.96 2.97 0.00 5.70 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.07 4.68 0.00 3.38 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 0.00 113 G 8.15 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 0.00 0.00 0.00 114 S 7.87 4.85 0.00 3.66 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 0.00 115 T 8.22 5.02 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 1.15 0.00 0.00 116 Y 9.17 5.29 0.00 3.03 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 0.00 117 S 9.46 5.22 0.00 3.90 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 0.00 118 V 9.07 4.95 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 0.93 0.00 0.00 1.01 0.00 0.00 119 S 9.13 5.05 0.00 3.84 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 0.00 120 V 8.33 3.97 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 0.60 0.00 0.00 0.19 0.00 0.00 121 V 8.50 3.91 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 1.28 0.00 0.00 1.17 0.00 0.00 122 E 7.71 4.95 0.00 2.00 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 2.44 2.36 0.00 123 T 8.89 4.18 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 0.80 0.00 0.00 124 D 7.30 4.56 0.00 2.86 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 0.00 125 Y 7.91 4.35 0.00 3.24 3.40 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 0.00 126 D 8.56 4.74 0.00 2.67 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 0.00 127 Q 9.05 4.68 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 128 Y 8.23 5.88 0.00 3.15 3.12 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 0.00 129 A 9.29 4.74 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 9.22 4.90 0.00 1.05 0.54 0.59 0.53 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 0.00 131 L 8.92 5.27 0.00 1.37 1.37 0.27 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 0.00 0.00 0.00 0.00 132 Y 8.92 5.31 0.00 3.36 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 0.00 133 S 8.37 5.25 0.00 3.65 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 Q 9.00 5.02 0.00 2.19 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.95 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 135 G 9.01 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 0.00 136 S 8.97 4.81 0.00 3.77 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 0.00 137 K 7.60 4.48 0.00 1.83 1.62 0.00 1.80 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.26 7.81 138 G 8.61 4.03 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 0.00 0.00 0.00 139 P 0.00 4.27 0.00 2.22 2.26 0.00 3.97 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 140 G 8.48 4.05 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 0.00 0.00 0.00 141 E 8.00 3.86 0.00 2.16 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 2.32 2.37 0.00 142 D 7.99 4.59 0.00 2.84 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 0.00 143 F 8.19 4.54 0.00 3.18 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 0.00 144 R 7.52 4.76 0.00 1.67 1.77 0.00 3.20 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 145 M 8.30 4.60 0.00 1.80 1.24 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 2.40 2.34 0.00 146 A 8.46 5.41 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 0.00 147 T 9.36 4.98 4.05 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 1.21 0.00 0.00 148 L 8.26 4.76 0.00 0.27 0.90 0.92 0.79 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 0.00 149 Y 8.99 5.60 0.00 2.61 2.36 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 0.00 150 S 9.30 5.54 0.00 4.06 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 0.00 151 R 9.44 4.12 0.00 1.64 1.86 0.00 2.53 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.44 0.00 152 T 7.89 4.67 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 1.22 0.00 0.00 153 Q 8.03 3.64 0.00 1.70 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.09 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 154 T 7.11 4.39 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 1.14 0.00 0.00 155 P 0.00 4.38 0.00 2.07 2.10 0.00 3.66 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 156 R 8.46 4.09 0.00 2.07 2.06 0.00 3.01 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 157 A 8.70 3.91 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 0.00 158 E 8.06 4.17 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.28 0.00 159 L 7.84 3.95 0.00 1.76 1.81 0.69 0.82 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 0.00 160 K 7.99 4.31 0.00 1.79 1.28 0.00 0.65 0.00 0.00 1.46 0.00 0.00 2.74 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.37 1.57 7.81 161 E 8.42 4.01 0.00 2.19 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 2.34 2.38 0.00 162 K 8.19 3.96 0.00 1.82 1.94 0.00 0.91 0.00 0.00 1.11 0.00 0.00 2.68 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.40 1.40 7.81 163 F 8.57 4.43 0.00 3.33 3.42 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 0.00 164 T 8.48 3.74 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 165 A 8.19 4.02 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 F 8.62 4.17 0.00 3.13 3.25 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 0.00 167 C 7.94 3.79 0.00 2.90 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 0.00 168 K 7.98 3.95 0.00 1.90 1.92 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.41 7.81 169 A 7.86 3.96 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 0.00 170 Q 7.09 4.06 0.00 1.80 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.72 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 171 G 7.56 3.66 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 0.00 0.00 0.00 172 F 7.37 4.41 0.00 3.06 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 0.00 173 T 8.29 4.26 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 174 E 8.88 3.91 0.00 2.11 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 2.38 1.89 0.00 175 D 8.09 4.45 0.00 2.81 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 0.00 176 T 8.02 4.23 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 1.22 0.00 0.00 177 I 7.21 4.17 1.90 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.57 0.63 0.00 0.00 178 V 8.89 4.34 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 0.91 0.00 0.00 0.94 0.00 0.00 179 F 8.89 4.98 0.00 3.05 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 0.00 180 L 8.76 4.63 0.00 1.68 1.62 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 181 P 0.00 4.53 0.00 2.13 2.20 0.00 3.74 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 182 Q 8.52 4.09 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 * Residues marked with a * may have inaccurate shift predictions.