NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8782 8.1676 115.8910 57.2733 39.9051 177.0775 11 H 3.8396 6.1158 116.7755 56.1879 28.9326 174.0667 12 E 4.3294 8.3755 122.0824 59.1098 30.5295 178.9159 13 M 4.6209 7.2719 115.4518 55.6049 31.6071 177.1161 14 R 4.5026 7.5348 117.9597 55.5330 32.8326 175.6859 15 E 4.0328 7.8863 117.5758 55.0577 30.0227 174.8097 16 P 4.6664 0.0000 0.0000 63.2162 32.4716 174.9436 17 R 4.4149 7.8691 115.2791 55.4522 33.2978 174.0152 18 I 4.3785 8.2264 121.0378 60.6465 37.2373 175.7168 19 E 4.1769 9.3598 130.1291 58.3280 29.8235 176.8419 20 K 4.6679 7.4735 115.8165 55.9982 35.8957 174.0820 21 V 4.5539 8.5190 121.7862 61.3376 34.3723 174.6070 22 V 4.5257 8.1894 129.7805 61.5457 32.8269 174.9544 23 V 4.4582 8.1749 122.6091 60.7985 33.0937 175.0487 24 H 5.2703 9.1196 123.9323 55.1584 34.2658 172.1887 25 M 4.4826 8.6446 123.5188 53.3534 34.4300 174.5209 26 G 3.7680 8.2013 111.2734 47.0804 0.0000 171.5423 27 I 3.6529 8.5893 130.8120 61.5099 35.8999 177.2448 28 G 4.6286 5.3800 127.0700 46.6534 0.0000 172.3751 29 H 4.4670 7.2944 114.3865 55.6260 31.8868 174.3651 *35 A 4.2781 8.0341 123.9302 52.3514 18.8743 177.9619 36 N 4.5852 9.4170 117.9199 53.1454 38.6424 176.4863 37 A 4.3306 7.8077 121.9028 53.5859 19.5978 179.2365 38 E 4.0826 8.0729 115.9562 59.4326 29.2031 178.9156 39 D 4.3963 8.1248 118.7881 57.3480 40.9047 178.7161 40 I 3.7642 7.4825 112.3346 63.7879 37.7911 178.3143 41 L 4.1132 7.9377 120.4885 57.4972 41.6185 179.4635 42 G 3.6539 7.9052 105.8199 47.2022 0.0000 175.6453 43 E 4.0709 7.5977 119.6535 59.0555 29.6388 178.8230 44 I 3.9866 7.8754 118.1530 63.3786 38.1037 177.4384 45 T 4.3680 8.1105 109.8523 65.3181 69.5037 174.7898 46 G 3.7545 7.1091 112.1648 44.6252 0.0000 173.7853 47 Q 4.5244 7.4997 117.7933 53.9537 30.8933 174.6888 48 M 4.2341 8.2525 117.6910 54.8478 32.4236 174.4418 49 P 4.9594 0.0000 0.0000 61.7716 34.2012 174.6850 50 V 4.5554 8.2252 111.5502 59.5279 36.0642 176.1575 51 R 4.6655 8.4346 122.6580 56.0602 31.5625 175.8160 52 T 4.5678 8.1545 114.9950 62.3535 72.4230 173.5360 53 K 5.3097 8.5045 126.6514 55.9671 34.8890 174.2644 54 A 4.4213 7.4770 125.5537 52.7815 22.8561 175.9355 55 K 4.5800 8.1237 116.9592 55.8185 36.4643 173.4163 56 R 4.0458 8.7708 127.7488 55.7758 30.1783 176.7245 57 T 4.1649 8.4247 118.9691 63.4999 69.4796 173.9592 58 V 4.4726 8.6009 125.5504 60.7499 34.0885 176.8049 59 G 3.7692 8.7010 114.8600 47.7943 0.0000 173.4542 60 E 4.2639 8.0156 119.0925 56.8900 29.8004 176.2384 61 F 4.1981 8.1641 115.3940 60.7758 38.6828 175.4615 62 D 4.7230 7.9942 118.1363 52.7658 41.5571 176.8954 63 I 3.9453 7.3502 112.7357 62.0788 39.0974 176.8816 64 R 3.9679 7.6627 121.1081 55.3736 28.7691 175.1094 65 E 3.7795 8.3529 127.8756 58.7564 30.1596 176.4045 66 G 4.1816 7.6531 116.8247 45.9901 0.0000 171.3606 67 D 4.6607 8.1918 123.5617 51.0322 42.4211 173.4715 68 P 4.6642 0.0000 0.0000 63.6493 31.3446 176.2237 69 I 4.4771 9.2428 123.4246 61.7286 40.0719 174.7348 70 G 4.4014 7.4340 104.9373 46.0876 0.0000 171.4735 71 A 4.9440 8.4410 119.0383 51.5634 22.7517 175.8169 72 K 4.9744 8.7383 117.9391 56.0828 37.2058 175.3975 73 V 4.4976 8.5301 120.4238 61.8879 34.8341 173.1968 74 T 4.6174 8.5177 119.1623 60.6285 69.9682 173.9309 75 L 4.6964 8.6017 127.3548 53.0590 43.8360 175.9851 76 R 4.8365 7.9638 120.8487 54.2772 34.3498 176.4499 77 D 4.2978 8.9609 121.1146 55.7575 39.7809 176.1165 78 E 3.9644 9.0010 126.3351 60.9325 28.4947 178.1283 79 M 4.1795 8.2424 117.8136 58.2214 31.7835 178.6816 80 A 4.0076 7.8738 120.3522 55.0762 18.9292 179.3017 81 E 3.9572 7.9652 116.7300 59.7845 29.4271 179.5380 82 E 3.9419 8.4518 117.3289 58.9624 29.5464 178.9308 83 F 4.3683 7.6771 121.3424 61.0033 39.5840 177.5510 84 L 4.0497 8.3182 118.7583 57.7928 41.1264 179.4324 85 Q 3.9455 8.2345 118.0836 58.0658 28.6678 177.5644 86 T 4.5139 7.2890 108.4561 61.1848 69.4232 175.1252 87 A 4.3444 7.5483 124.2988 54.3337 21.8770 179.3238 88 L 3.7940 8.3663 116.0919 57.4941 41.6919 177.4481 89 P 4.3817 0.0000 0.0000 64.0389 31.1494 176.5849 90 L 4.4472 7.4160 117.4265 54.3404 42.3143 176.0911 91 A 4.6819 7.7698 121.3004 50.2825 21.6875 176.4555 92 E 4.3501 8.2732 120.7215 54.0424 28.5598 174.6053 93 L 3.8522 8.0827 121.5230 54.9378 42.1553 177.1967 94 A 4.6066 8.3707 127.1578 51.0618 21.5914 176.0457 95 T 4.2750 8.4314 113.1167 66.3420 69.0983 177.9759 96 S 4.2656 8.0484 115.1307 61.0208 63.4983 175.5520 97 Q 4.3712 7.9612 118.9595 56.9471 28.3725 175.3138 98 F 5.0851 7.8423 117.6216 55.6284 40.9955 175.4126 99 D 4.7284 9.5887 125.2275 53.7774 41.8006 176.9190 100 D 4.5273 8.5620 121.5288 56.9698 40.9763 177.6458 101 T 4.2767 7.8544 114.1124 63.2017 68.8084 174.5459 102 G 3.9783 8.0527 109.1134 47.0131 0.0000 173.4988 103 N 5.3189 8.1862 114.9715 50.8681 42.4205 173.7103 104 F 5.3118 7.9015 114.3508 53.9178 41.5368 173.5999 105 S 4.9760 8.6721 114.6928 56.4885 65.2048 172.9059 106 F 4.9158 8.5228 121.1585 56.2088 41.1478 174.6986 107 G 3.9184 8.9096 105.8084 44.4550 0.0000 173.7065 *128 L 4.1226 8.1568 125.7754 55.1841 42.8873 176.6599 129 D 4.7818 8.8845 127.2765 53.1055 43.2741 176.2326 130 V 4.4055 7.9597 121.2932 61.5192 34.5684 174.1021 131 T 4.6940 8.1707 124.4080 61.5163 71.8256 173.6050 132 V 4.3610 7.7332 125.3694 60.9837 34.1878 173.7306 133 N 4.6168 9.3361 128.1398 52.5995 39.8724 173.5429 134 L 5.2778 8.1286 126.2568 53.2641 44.4719 176.0599 135 V 4.1884 7.8119 119.4555 60.9760 35.1312 172.3621 136 R 4.3917 8.4226 120.2677 55.2622 31.1054 176.8570 137 P 4.1494 0.0000 0.0000 64.7926 31.5925 176.5985 138 G 4.2510 8.2552 108.7760 44.9401 0.0000 174.8494 139 Y 4.3070 8.2555 122.3629 60.1723 39.0503 175.8700 140 R 3.7950 8.2674 119.4261 59.4849 29.8778 178.1818 141 V 3.5296 7.5027 116.5726 65.4545 31.2463 177.0342 142 A 4.7297 7.8218 119.6119 51.7287 19.2698 177.6613 143 K 4.1154 7.4243 115.0108 56.5778 33.3629 176.8338 144 R 4.2270 7.6057 115.3193 55.7564 30.3715 176.4015 145 D 4.4781 8.3799 117.0810 56.6299 41.3635 177.6199 146 K 3.9589 7.9306 117.3414 57.5097 32.4508 176.8760 147 A 3.7998 8.7375 127.2840 52.7345 16.2847 176.8811 148 S 4.5629 7.8582 112.6273 60.2300 64.3741 173.5877 149 R 4.6579 8.5909 119.9392 54.9823 33.8276 173.8402 150 S 4.5938 8.5460 119.5060 57.6134 63.3629 173.9113 151 I 3.8363 8.3314 127.8562 60.6738 37.6718 174.4023 152 P 4.4583 0.0000 0.0000 62.4078 32.2486 177.3017 153 T 3.9272 8.7264 112.3048 65.4077 68.0481 176.7103 154 K 4.0595 8.0326 119.6688 58.8996 32.2650 177.7003 155 H 4.5164 8.0379 116.0557 55.6902 30.4691 175.3681 156 R 4.1659 7.1584 119.3946 56.2030 30.6140 176.3478 157 L 4.1341 8.3271 123.7405 55.1163 43.0562 176.1964 158 N 5.1037 8.2407 120.3092 50.6627 42.6046 174.3053 159 P 4.3259 0.0000 0.0000 65.7164 31.4603 178.9253 160 A 3.8432 7.8470 118.9087 55.4407 18.3367 179.3853 161 D 4.3859 8.1168 116.3062 56.9426 40.7641 178.9109 162 A 4.1521 8.0309 121.7817 55.1048 18.5364 179.4182 163 V 3.2443 7.6042 116.5437 66.1796 31.3755 177.6487 164 A 4.0884 7.8712 120.0815 55.4418 17.9602 179.2452 165 F 4.0865 7.7827 117.3258 61.5121 39.5678 177.2267 166 I 3.7291 7.8794 117.9551 64.4883 37.2764 177.5797 167 E 4.5729 8.8507 122.2476 58.6363 29.0447 178.2579 168 S 4.7135 7.8629 110.7218 57.8254 63.9071 175.2132 169 T 4.6837 7.7239 116.1113 63.0141 70.7164 173.0215 170 Y 3.3754 7.7864 124.4930 57.8813 35.4302 168.2034 171 D 4.3222 6.6857 117.5477 53.6378 42.2370 175.1180 172 V 4.6863 8.1003 117.6237 61.1041 34.9183 175.2446 173 E 4.3822 8.4751 121.4599 56.5030 31.7910 176.4381 174 V 4.2401 8.2957 117.3876 62.8832 32.5900 173.6535 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 10 F 8.17 4.88 0.00 3.35 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 11 H 6.12 3.84 0.00 3.07 2.59 0.00 5.45 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 12 E 8.38 4.33 0.00 1.74 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 2.31 2.21 0.00 13 M 7.27 4.62 0.00 2.26 2.09 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 14 R 7.53 4.50 0.00 1.73 1.87 0.00 3.22 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 15 E 7.89 4.03 0.00 2.13 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 0.00 2.43 2.25 0.00 16 P 0.00 4.67 0.00 0.49 1.54 0.00 3.57 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 1.87 1.92 0.00 17 R 7.87 4.41 0.00 1.81 1.90 0.00 2.75 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 18 I 8.23 4.38 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.80 0.95 0.00 0.00 19 E 9.36 4.18 0.00 1.89 1.96 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 2.18 1.97 0.00 20 K 7.47 4.67 0.00 1.76 1.81 0.00 1.46 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.31 1.32 7.81 21 V 8.52 4.55 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 1.01 0.00 0.00 0.95 0.00 0.00 22 V 8.19 4.53 1.96 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 0.81 0.00 0.00 0.84 0.00 0.00 23 V 8.17 4.46 1.95 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 0.07 0.00 0.00 0.75 0.00 0.00 24 H 9.12 5.27 0.00 3.08 2.99 0.00 5.52 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 M 8.64 4.48 0.00 1.89 1.86 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 26 G 8.20 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 27 I 8.59 3.65 1.93 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 1.29 0.72 0.73 0.00 0.00 28 G 5.38 4.63 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 0.00 0.00 0.00 29 H 7.29 4.47 0.00 3.16 3.33 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 8.03 4.28 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 36 N 9.42 4.59 0.00 2.85 2.96 0.00 0.00 5.88 7.26 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 37 A 7.81 4.33 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 38 E 8.07 4.08 0.00 2.00 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 2.31 2.34 0.00 39 D 8.12 4.40 0.00 2.68 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 40 I 7.48 3.76 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.79 0.92 0.00 0.00 41 L 7.94 4.11 0.00 1.83 1.72 0.87 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.91 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 0.00 0.00 0.00 43 E 7.60 4.07 0.00 2.08 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 0.00 2.35 2.50 0.00 44 I 7.88 3.99 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.85 1.09 0.00 0.00 45 T 8.11 4.37 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 0.96 0.00 0.00 46 G 7.11 3.75 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 0.00 0.00 0.00 47 Q 7.50 4.52 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.91 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 48 M 8.25 4.23 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.51 0.00 49 P 0.00 4.96 0.00 2.03 2.03 0.00 3.69 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 2.02 1.96 0.00 50 V 8.23 4.56 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 0.76 0.00 0.00 0.98 0.00 0.00 51 R 8.43 4.67 0.00 1.68 1.88 0.00 3.36 0.00 0.00 3.37 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.43 0.00 52 T 8.15 4.57 4.34 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 1.20 0.00 0.00 53 K 8.50 5.31 0.00 1.60 1.63 0.00 1.82 0.00 0.00 2.35 0.00 0.00 2.72 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.24 7.81 54 A 7.48 4.42 1.10 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 55 K 8.12 4.58 0.00 1.57 1.65 0.00 1.84 0.00 0.00 1.69 0.00 0.00 2.73 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.43 7.81 56 R 8.77 4.05 0.00 1.97 1.98 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 1.51 1.63 0.00 57 T 8.42 4.16 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 1.22 0.00 0.00 58 V 8.60 4.47 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 1.02 0.00 0.00 0.97 0.00 0.00 59 G 8.70 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 60 E 8.02 4.26 0.00 2.14 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 2.29 2.33 0.00 61 F 8.16 4.20 0.00 3.03 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 62 D 7.99 4.72 0.00 2.79 2.50 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 0.00 63 I 7.35 3.95 1.88 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 1.23 0.51 0.97 0.00 0.00 64 R 7.66 3.97 0.00 1.69 2.04 0.00 3.17 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 65 E 8.35 3.78 0.00 2.02 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 2.43 2.35 0.00 66 G 7.65 4.18 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 0.00 67 D 8.19 4.66 0.00 2.62 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 68 P 0.00 4.66 0.00 1.94 2.04 0.00 3.59 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 2.01 2.11 0.00 69 I 9.24 4.48 1.94 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 1.19 1.04 0.88 0.00 0.00 70 G 7.43 4.40 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 0.00 71 A 8.44 4.94 1.20 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 0.00 0.00 0.00 72 K 8.74 4.97 0.00 1.85 1.87 0.00 1.24 0.00 0.00 1.52 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.34 7.81 73 V 8.53 4.50 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 0.87 0.00 0.00 0.91 0.00 0.00 74 T 8.52 4.62 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 75 L 8.60 4.70 0.00 1.57 1.61 0.39 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.96 4.84 0.00 1.62 1.77 0.00 3.34 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.61 0.00 77 D 8.96 4.30 0.00 2.88 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 78 E 9.00 3.96 0.00 2.02 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 2.42 2.42 0.00 79 M 8.24 4.18 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 80 A 7.87 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.97 3.96 0.00 2.02 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 2.40 2.55 0.00 82 E 8.45 3.94 0.00 2.04 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 0.00 2.35 2.43 0.00 83 F 7.68 4.37 0.00 3.44 3.32 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 84 L 8.32 4.05 0.00 1.95 1.81 1.10 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.23 3.95 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.43 0.00 0.00 0.00 0.00 0.00 2.18 2.48 0.00 86 T 7.29 4.51 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 1.15 0.00 0.00 87 A 7.55 4.34 0.80 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 0.00 0.00 88 L 8.37 3.79 0.00 1.68 1.66 1.00 1.53 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 89 P 0.00 4.38 0.00 1.99 2.07 0.00 3.61 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 90 L 7.42 4.45 0.00 1.70 1.70 0.95 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.77 4.68 0.66 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 92 E 8.27 4.35 0.00 1.95 1.91 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 2.21 2.28 0.00 93 L 8.08 3.85 0.00 1.58 1.63 0.73 0.63 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 94 A 8.37 4.61 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 T 8.43 4.28 4.26 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 1.19 0.00 0.00 96 S 8.05 4.27 0.00 4.06 4.18 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 97 Q 7.96 4.37 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.82 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 98 F 7.84 5.09 0.00 3.10 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 99 D 9.59 4.73 0.00 2.72 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 D 8.56 4.53 0.00 2.73 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 T 7.85 4.28 4.48 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 0.00 0.00 0.00 1.24 0.00 0.00 102 G 8.05 3.98 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 0.00 0.00 0.00 103 N 8.19 5.32 0.00 2.79 2.70 0.00 0.00 6.49 8.13 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 0.00 104 F 7.90 5.31 0.00 2.81 1.63 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 0.00 105 S 8.67 4.98 0.00 3.73 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 0.00 106 F 8.52 4.92 0.00 3.10 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 0.00 107 G 8.91 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 *128 L 8.16 4.12 0.00 1.70 1.69 0.96 1.19 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 0.00 129 D 8.88 4.78 0.00 2.61 2.47 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 0.00 130 V 7.96 4.41 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.96 0.00 0.00 131 T 8.17 4.69 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 1.06 0.00 0.00 132 V 7.73 4.36 1.05 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 0.99 0.00 0.00 0.61 0.00 0.00 133 N 9.34 4.62 0.00 2.70 2.73 0.00 0.00 6.60 6.89 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 0.00 134 L 8.13 5.28 0.00 1.75 1.50 1.28 1.09 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 0.00 135 V 7.81 4.19 1.51 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 0.26 0.00 0.00 0.61 0.00 0.00 136 R 8.42 4.39 0.00 1.71 1.78 0.00 3.20 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 137 P 0.00 4.15 0.00 2.20 2.11 0.00 3.72 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 2.10 2.11 0.00 138 G 8.26 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 0.00 0.00 0.00 0.00 139 Y 8.26 4.31 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.27 3.80 0.00 1.93 1.94 0.00 3.24 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 141 V 7.50 3.53 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 0.91 0.00 0.00 0.99 0.00 0.00 142 A 7.82 4.73 1.06 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 0.00 0.00 143 K 7.42 4.12 0.00 1.60 1.77 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.70 1.22 7.81 144 R 7.61 4.23 0.00 1.90 1.96 0.00 3.06 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.55 0.00 145 D 8.38 4.48 0.00 2.67 2.73 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 0.00 0.00 0.00 146 K 7.93 3.96 0.00 1.73 1.74 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.42 7.81 147 A 8.74 3.80 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 0.00 0.00 0.00 0.00 0.00 148 S 7.86 4.56 0.00 3.90 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 0.00 149 R 8.59 4.66 0.00 1.89 1.71 0.00 3.12 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 1.51 1.60 0.00 150 S 8.55 4.59 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 0.00 151 I 8.33 3.84 1.98 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 1.44 1.15 1.03 0.00 0.00 152 P 0.00 4.46 0.00 2.21 1.99 0.00 3.64 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 2.12 2.08 0.00 153 T 8.73 3.93 4.26 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 1.23 0.00 0.00 154 K 8.03 4.06 0.00 1.77 1.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.58 7.81 155 H 8.04 4.52 0.00 3.16 3.36 0.00 5.95 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.16 4.17 0.00 2.14 1.88 0.00 3.44 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.75 0.00 157 L 8.33 4.13 0.00 1.53 1.73 0.87 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.24 5.10 0.00 2.95 2.68 0.00 0.00 6.96 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 0.00 159 P 0.00 4.33 0.00 2.14 2.15 0.00 3.61 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.43 0.00 160 A 7.85 3.84 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 0.00 161 D 8.12 4.39 0.00 2.83 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 A 8.03 4.15 1.68 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 0.00 163 V 7.60 3.24 1.95 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 0.80 0.00 0.00 0.03 0.00 0.00 164 A 7.87 4.09 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 0.00 165 F 7.78 4.09 0.00 3.00 3.32 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 0.00 166 I 7.88 3.73 2.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.16 0.87 0.00 0.00 167 E 8.85 4.57 0.00 2.03 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 0.00 2.25 2.13 0.00 168 S 7.86 4.71 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 0.00 169 T 7.72 4.68 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 1.29 0.00 0.00 170 Y 7.79 3.38 0.00 3.00 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 0.00 171 D 6.69 4.32 0.00 2.82 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 V 8.10 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 0.84 0.00 0.00 0.89 0.00 0.00 173 E 8.48 4.38 0.00 2.01 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 2.35 2.23 0.00 174 V 8.30 4.24 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 0.97 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.