NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 42 R 4.1921 8.2501 120.8591 56.1137 32.0562 176.0279 43 A 3.8667 7.8988 120.8339 50.9470 18.7938 174.6791 44 Q 4.3868 9.1963 124.6410 54.4681 32.2451 172.7403 45 H 4.7355 8.8192 123.1760 54.7935 30.1490 175.4895 46 I 4.4067 8.1808 123.4414 60.6409 37.4858 175.2252 47 V 4.2673 8.5733 128.9863 60.6458 32.8788 173.3977 48 P 5.0597 0.0000 0.0000 62.7153 31.8866 175.2952 49 C 5.2655 8.9991 120.3791 58.3169 32.7989 173.6305 50 T 4.6156 8.6764 110.3728 60.5471 70.1807 176.0075 51 I 3.6776 9.1021 124.9914 64.7372 36.8383 178.7419 52 S 4.1059 7.8800 113.9758 61.7119 62.8244 176.4460 53 Q 4.1089 8.1284 121.3907 58.6738 28.6176 178.6601 54 L 3.9297 7.8044 119.8767 58.0010 41.4564 179.7607 55 L 4.0703 8.0451 117.7579 57.2786 41.6014 178.7295 56 S 4.5258 7.5008 111.9804 57.4861 63.4700 174.1763 57 A 4.4036 7.2331 124.6954 52.6025 18.9035 177.6517 58 T 4.4851 9.1427 119.3322 62.6340 70.5011 173.6057 59 L 4.9063 8.4761 126.3913 53.8744 44.0210 175.0656 60 V 4.2644 8.3454 117.9427 63.1200 34.5956 176.5900 61 D 4.2822 8.2302 117.7423 56.2801 41.3289 175.8090 62 E 4.2890 7.8677 118.2118 54.8365 29.5298 174.9092 63 V 4.4418 7.8271 117.5897 59.3625 35.3142 175.2020 64 F 5.0673 8.6506 122.9702 57.4858 40.6200 174.7172 65 R 5.0852 9.5507 121.2394 54.6430 34.6003 174.2486 66 I 4.5100 8.9825 125.3028 58.9660 38.7779 176.4041 67 G 3.8190 8.8084 119.4456 47.0727 0.0000 173.6393 68 N 4.6103 8.7324 122.7559 52.4582 37.8911 174.1970 69 V 4.2534 7.6012 120.8386 61.5809 32.1593 174.6590 70 E 4.6170 8.6693 128.6738 56.2158 30.2572 175.6522 71 I 4.5193 8.7323 126.1037 60.2168 40.6668 173.4472 72 S 4.6572 9.0195 120.0933 59.1749 64.5591 172.4513 73 Q 5.0352 7.9681 116.5788 55.1519 30.4222 174.7951 74 V 5.1856 9.0193 116.7686 59.7893 36.6754 174.3708 75 T 5.1939 8.5938 112.0109 60.0795 71.6958 173.0428 76 I 4.8449 8.6362 116.7357 59.1369 41.6817 174.1062 77 V 4.7934 7.9506 121.6559 61.4355 34.2302 174.5692 78 G 4.0478 8.7245 113.4007 46.0033 0.0000 171.0425 79 I 4.3750 7.8827 120.1459 58.6849 40.4493 175.0346 80 I 4.1861 8.2486 130.2431 61.7723 37.1690 176.7984 81 R 4.4420 9.1844 127.0297 58.0131 31.3500 176.4768 82 H 4.8592 7.8611 116.1113 54.9320 33.3827 172.2423 83 A 4.8219 8.2186 125.4130 50.0751 22.0807 175.1224 84 E 4.3167 8.6811 123.7648 54.0559 31.3644 174.2866 85 K 4.4675 8.3444 127.8936 55.5931 33.1315 175.6361 86 A 4.7628 8.6894 128.6046 49.4992 22.5096 174.9047 87 P 4.3432 0.0000 0.0000 65.3113 31.6148 177.7510 88 T 4.5688 7.7700 105.7742 61.5755 70.2798 172.8836 89 N 5.1584 7.5793 117.6047 52.1864 41.3677 173.2036 90 I 4.7207 8.4441 120.0966 59.3321 40.8610 174.8335 91 V 4.5020 7.9939 126.5991 61.4768 33.3324 173.9914 92 Y 5.1489 9.0630 126.1735 56.5839 40.6167 174.9777 93 K 4.9405 9.0120 122.9014 55.2614 33.9685 175.4160 94 I 4.8120 8.6110 126.6813 59.3272 40.1887 174.2547 95 D 5.0834 8.8708 126.5701 52.3073 43.4821 175.6068 96 D 4.8487 8.8406 123.9015 53.1552 39.8753 176.9375 97 M 3.4557 8.7366 120.4449 56.1962 31.2912 177.9596 98 T 4.0815 8.0747 107.1135 63.4984 69.5082 173.7524 99 A 4.3761 7.2671 122.0530 51.4808 21.5164 175.2695 100 A 4.2085 8.3708 118.9311 51.4973 19.0373 175.9600 101 P 4.5398 0.0000 0.0000 63.3882 32.2239 175.5653 102 M 4.6139 8.7072 122.6563 53.7554 34.8972 174.7901 103 D 4.9233 8.6106 125.1541 54.4303 42.5123 175.1733 104 V 4.7641 9.1376 123.8814 61.0875 34.4305 173.8768 105 R 4.7851 8.9343 128.9556 54.5124 32.4005 174.3030 106 Q 4.7532 8.8400 127.6034 53.9287 31.5906 174.2579 107 W 4.8169 8.7618 127.1778 56.1740 29.8118 176.7730 108 V 3.7385 8.8135 125.5308 63.2513 31.8159 175.2921 *118 T 4.1126 8.2609 119.0977 61.5260 68.1510 173.7796 119 V 3.9231 8.1615 127.0744 61.0790 32.3093 176.0370 120 V 3.7478 8.7140 124.9158 61.7887 32.1825 174.1334 121 P 4.3888 0.0000 0.0000 61.8787 31.8564 174.3319 122 P 4.5469 0.0000 0.0000 63.7859 31.7901 176.0507 123 E 3.7104 9.0385 117.5804 57.4637 27.6225 174.2380 124 T 4.5688 7.0868 115.5096 62.0137 70.5975 173.8221 125 Y 4.3732 8.5746 124.3132 58.1088 39.2968 175.1957 126 V 4.9023 8.9398 116.5464 59.4871 36.6814 174.1288 127 K 4.8731 8.9710 124.9453 54.9837 34.0799 175.0971 128 V 4.7408 8.8175 127.5136 60.9793 34.1251 173.7788 129 A 4.8039 8.5731 130.0480 50.3053 21.4548 175.8471 130 G 4.1454 8.3035 108.2405 46.1553 0.0000 170.9707 131 H 5.5561 9.1512 117.2582 53.5940 30.9961 174.6782 132 L 4.4735 8.5398 126.3237 55.3743 42.5003 176.3117 133 R 5.0796 9.0606 124.4484 54.5964 34.5230 174.3477 134 S 5.2572 8.8511 114.7177 56.8510 65.9425 172.9971 135 F 4.6580 9.4029 128.6119 57.5153 41.9379 174.6298 136 Q 3.2552 9.0479 128.7765 57.1193 25.8711 174.6351 137 N 4.3041 7.9563 110.5443 53.4735 37.6885 174.8528 138 K 4.2893 7.9333 121.1306 55.4754 32.8173 175.4841 139 K 5.1685 8.4475 125.9241 55.6942 33.8793 175.7143 140 S 4.7451 8.8684 116.7013 57.5955 67.1609 172.4738 141 L 5.2038 8.7664 119.5046 52.9475 44.9494 175.9973 142 V 4.7776 8.5789 121.8705 61.2419 33.6032 174.2047 143 A 4.9617 8.8776 131.0880 51.1396 19.3850 176.7984 144 F 4.8984 8.5173 117.1505 56.9916 39.4101 176.0354 145 K 4.5673 7.3202 120.9542 55.4778 35.7045 174.1326 146 I 4.8894 8.4316 127.4049 59.7852 40.2550 174.4286 147 M 4.6242 8.8937 128.1393 52.7158 34.5671 173.1100 148 P 4.7307 0.0000 0.0000 62.8923 32.2824 176.1471 149 L 4.2258 8.7923 125.1440 54.8057 41.4912 176.8668 150 E 4.2555 8.9883 123.0022 56.5667 30.9772 175.2947 151 D 4.8020 7.7378 118.0741 52.3184 42.5200 176.0526 152 M 4.2894 8.4934 126.8402 57.2629 31.9747 178.0464 153 N 4.4473 8.4477 117.4116 56.1272 38.6036 176.9402 154 E 3.9914 8.2571 120.3364 59.0417 29.3538 179.1385 155 F 4.1652 8.0143 120.4589 61.5484 39.6333 177.2551 156 T 3.2379 7.7617 114.7828 66.9185 68.2140 176.4754 157 T 3.8237 8.1199 117.8249 66.7902 68.2999 176.0880 158 H 4.2102 8.1370 120.1696 59.2537 29.7502 177.2251 159 I 3.5780 7.2666 121.2421 64.4896 36.9594 178.3919 160 L 3.9424 7.6265 119.1560 57.8032 41.4113 179.4942 161 E 3.9248 8.4392 118.9296 59.1997 29.3654 179.3972 162 V 3.7205 7.8665 118.5744 66.2013 31.5813 178.2375 163 I 3.6754 7.4511 119.1520 64.3956 36.8950 178.0392 164 N 4.2832 8.2307 117.6866 56.4665 38.7404 176.6860 165 A 3.9379 8.3921 122.6164 55.7202 18.5201 179.4453 166 H 4.1201 8.2503 114.6627 58.8210 28.2927 177.7744 167 M 3.9706 8.1229 120.1583 58.6325 32.0847 178.5369 168 V 3.5797 8.0248 118.5430 66.1635 31.9180 178.0901 169 L 4.0028 8.3008 119.2957 57.5912 41.2324 179.6281 170 S 5.0369 8.0216 115.7066 60.6037 62.7902 176.8100 171 K 3.9677 7.6328 120.9507 59.2737 31.9136 178.7823 172 A 4.1284 7.9969 120.0904 55.1667 18.3501 178.9755 173 N 4.4428 7.9887 113.3528 54.5599 38.8537 175.3529 174 S 4.6421 7.2770 119.2847 57.7758 64.7229 172.7109 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 42 R 8.25 4.19 0.00 1.78 2.02 0.00 3.20 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 43 A 7.90 3.87 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 44 Q 9.20 4.39 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.83 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 45 H 8.82 4.74 0.00 3.19 3.20 0.00 5.70 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 I 8.18 4.41 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.60 0.99 0.00 0.00 47 V 8.57 4.27 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 0.89 0.00 0.00 0.96 0.00 0.00 48 P 0.00 5.06 0.00 1.97 2.01 0.00 3.35 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.81 0.00 49 C 9.00 5.27 0.00 2.83 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 50 T 8.68 4.62 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 51 I 9.10 3.68 2.04 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 1.56 0.65 0.95 0.00 0.00 52 S 7.88 4.11 0.00 4.03 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 53 Q 8.13 4.11 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 54 L 7.80 3.93 0.00 1.81 1.64 0.88 0.62 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 55 L 8.05 4.07 0.00 1.74 1.73 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 56 S 7.50 4.53 0.00 3.83 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.23 4.40 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 58 T 9.14 4.49 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 1.23 0.00 0.00 59 L 8.48 4.91 0.00 1.47 1.44 -0.15 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 60 V 8.35 4.26 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 0.71 0.00 0.00 0.96 0.00 0.00 61 D 8.23 4.28 0.00 2.58 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 62 E 7.87 4.29 0.00 1.88 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 2.12 2.16 0.00 63 V 7.83 4.44 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 0.95 0.00 0.00 0.92 0.00 0.00 64 F 8.65 5.07 0.00 3.39 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 65 R 9.55 5.09 0.00 1.71 2.00 0.00 3.11 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 66 I 8.98 4.51 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.31 0.95 0.00 0.00 67 G 8.81 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 0.00 0.00 0.00 68 N 8.73 4.61 0.00 2.97 3.07 0.00 0.00 5.55 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 69 V 7.60 4.25 2.27 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 1.00 0.00 0.00 0.94 0.00 0.00 70 E 8.67 4.62 0.00 2.01 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 2.34 2.39 0.00 71 I 8.73 4.52 1.96 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.83 0.95 0.00 0.00 72 S 9.02 4.66 0.00 3.96 3.80 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 73 Q 7.97 5.04 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.54 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 74 V 9.02 5.19 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 0.76 0.00 0.00 0.95 0.00 0.00 75 T 8.59 5.19 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 1.19 0.00 0.00 76 I 8.64 4.84 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.21 0.95 0.00 0.00 77 V 7.95 4.79 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 1.12 0.00 0.00 0.77 0.00 0.00 78 G 8.72 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 79 I 7.88 4.38 0.56 0.00 0.00 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 0.96 1.07 0.61 0.00 0.00 80 I 8.25 4.19 1.76 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 0.91 0.21 1.05 0.00 0.00 81 R 9.18 4.44 0.00 1.72 1.96 0.00 3.32 0.00 0.00 3.07 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 82 H 7.86 4.86 0.00 3.15 3.08 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 83 A 8.22 4.82 1.13 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 84 E 8.68 4.32 0.00 2.06 1.71 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 2.13 2.17 0.00 85 K 8.34 4.47 0.00 1.70 1.61 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.36 7.81 86 A 8.69 4.76 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 87 P 0.00 4.34 0.00 2.07 2.16 0.00 3.65 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 2.04 2.09 0.00 88 T 7.77 4.57 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 1.29 0.00 0.00 89 N 7.58 5.16 0.00 2.16 2.18 0.00 0.00 6.61 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 90 I 8.44 4.72 1.48 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 0.90 0.51 -0.02 0.00 0.00 91 V 7.99 4.50 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 0.89 0.00 0.00 0.71 0.00 0.00 92 Y 9.06 5.15 0.00 2.91 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 93 K 9.01 4.94 0.00 1.72 1.74 0.00 1.55 0.00 0.00 1.62 0.00 0.00 2.79 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.54 1.43 7.81 94 I 8.61 4.81 1.83 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.71 0.82 0.00 0.00 95 D 8.87 5.08 0.00 2.70 2.37 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 96 D 8.84 4.85 0.00 2.95 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 97 M 8.74 3.46 0.00 2.25 2.43 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.68 0.00 98 T 8.07 4.08 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 99 A 7.27 4.38 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.37 4.21 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 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.54 0.00 1.93 1.99 0.00 3.64 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 102 M 8.71 4.61 0.00 2.06 1.88 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 2.50 2.48 0.00 103 D 8.61 4.92 0.00 2.72 2.56 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 0.00 104 V 9.14 4.76 2.16 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 0.76 0.00 0.00 0.92 0.00 0.00 105 R 8.93 4.79 0.00 1.72 1.53 0.00 2.21 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.06 0.00 106 Q 8.84 4.75 0.00 2.13 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 107 W 8.76 4.82 0.00 3.28 3.15 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 0.00 108 V 8.81 3.74 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 0.74 0.00 0.00 0.99 0.00 0.00 *118 T 8.26 4.11 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 119 V 8.16 3.92 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 0.74 0.00 0.00 0.98 0.00 0.00 120 V 8.71 3.75 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 0.68 0.00 0.00 0.87 0.00 0.00 121 P 0.00 4.39 0.00 2.20 1.95 0.00 3.65 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 2.12 0.00 122 P 0.00 4.55 0.00 2.02 1.98 0.00 3.79 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 2.01 2.10 0.00 123 E 9.04 3.71 0.00 2.04 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 2.20 2.38 0.00 124 T 7.09 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 1.18 0.00 0.00 125 Y 8.57 4.37 0.00 2.91 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 0.00 126 V 8.94 4.90 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 0.53 0.00 0.00 0.76 0.00 0.00 127 K 8.97 4.87 0.00 1.79 1.63 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.44 7.81 128 V 8.82 4.74 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 0.86 0.00 0.00 0.81 0.00 0.00 129 A 8.57 4.80 0.62 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 0.00 0.00 130 G 8.30 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 0.00 0.00 0.00 131 H 9.15 5.56 0.00 3.25 3.36 0.00 5.82 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 8.54 4.47 0.00 1.50 1.35 0.67 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 133 R 9.06 5.08 0.00 1.80 1.90 0.00 3.42 0.00 0.00 3.27 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 134 S 8.85 5.26 0.00 4.20 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 0.00 135 F 9.40 4.66 0.00 3.04 2.92 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 0.00 136 Q 9.05 3.26 0.00 1.89 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 5.81 0.00 0.00 0.00 0.00 0.00 1.83 1.16 0.00 137 N 7.96 4.30 0.00 2.86 2.98 0.00 0.00 7.14 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 0.00 138 K 7.93 4.29 0.00 1.87 1.95 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.45 7.81 139 K 8.45 5.17 0.00 1.65 1.63 0.00 1.87 0.00 0.00 1.58 0.00 0.00 3.14 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.35 7.81 140 S 8.87 4.75 0.00 4.00 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 0.00 141 L 8.77 5.20 0.00 1.59 1.57 0.87 0.78 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 0.00 142 V 8.58 4.78 2.28 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 1.23 0.00 0.00 1.11 0.00 0.00 143 A 8.88 4.96 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 F 8.52 4.90 0.00 3.03 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 0.00 145 K 7.32 4.57 0.00 1.85 1.53 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.84 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.52 7.81 146 I 8.43 4.89 1.83 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.76 0.64 0.00 0.00 147 M 8.89 4.62 0.00 2.01 1.88 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 148 P 0.00 4.73 0.00 1.96 1.95 0.00 3.71 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 2.01 2.07 0.00 149 L 8.79 4.23 0.00 1.71 1.62 0.97 0.93 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 0.00 150 E 8.99 4.26 0.00 1.95 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 2.24 2.27 0.00 151 D 7.74 4.80 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 0.00 152 M 8.49 4.29 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 153 N 8.45 4.45 0.00 2.88 2.87 0.00 0.00 6.86 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 0.00 154 E 8.26 3.99 0.00 2.24 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 2.34 2.33 0.00 155 F 8.01 4.17 0.00 2.98 3.09 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 0.00 156 T 7.76 3.24 4.29 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 1.09 0.00 0.00 157 T 8.12 3.82 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 1.23 0.00 0.00 158 H 8.14 4.21 0.00 3.36 3.42 0.00 5.79 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 0.00 159 I 7.27 3.58 1.79 0.00 0.00 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 1.38 1.01 0.81 0.00 0.00 160 L 7.63 3.94 0.00 1.82 1.66 0.87 0.66 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 0.00 161 E 8.44 3.92 0.00 2.08 1.93 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 2.30 2.41 0.00 162 V 7.87 3.72 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.84 0.00 0.00 163 I 7.45 3.68 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.68 0.89 0.00 0.00 164 N 8.23 4.28 0.00 2.89 2.78 0.00 0.00 7.15 7.74 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 0.00 165 A 8.39 3.94 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 0.00 166 H 8.25 4.12 0.00 3.28 3.37 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 M 8.12 3.97 0.00 2.21 2.14 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 2.60 2.54 0.00 168 V 8.02 3.58 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 1.03 0.00 0.00 1.00 0.00 0.00 169 L 8.30 4.00 0.00 1.74 1.68 0.85 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 170 S 8.02 5.04 0.00 4.09 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 0.00 171 K 7.63 3.97 0.00 1.94 1.91 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.67 7.81 172 A 8.00 4.13 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 0.00 173 N 7.99 4.44 0.00 2.95 2.90 0.00 0.00 7.06 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 0.00 174 S 7.28 4.64 0.00 3.87 3.97 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 * Residues marked with a * may have inaccurate shift predictions.