NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 K 3.8615 8.1733 121.9309 55.3468 34.8859 175.3924 11 F 5.1772 7.8533 117.0947 55.0590 41.3936 173.1075 12 N 4.9559 10.0829 123.6712 52.4186 41.5387 174.1563 13 D 4.4894 9.9397 124.4873 55.4100 38.4755 175.0289 14 G 3.9405 8.6497 105.0085 45.4485 0.0000 173.4367 15 N 5.0429 8.0183 117.8517 50.8298 40.5526 173.9227 16 L 4.3958 8.8662 125.1262 55.0668 42.4847 176.0768 17 N 4.2039 9.2420 126.8281 52.1260 37.7323 175.3174 18 I 3.8486 8.1161 119.4565 62.3232 38.2282 177.3294 19 A 4.1368 8.2111 124.5794 54.0390 18.7785 176.8901 20 Y 4.3129 7.5135 117.4886 59.1984 38.9427 175.9057 21 A 3.3573 8.1075 128.1483 52.5213 16.9005 177.5567 22 K 4.2535 7.6101 116.6223 55.8270 33.0897 175.3151 23 P 4.5404 0.0000 0.0000 63.2545 32.5942 175.5865 24 T 5.0461 8.3658 112.2781 60.3002 72.7724 172.4002 25 T 4.9483 8.4287 112.0304 60.7547 73.3018 172.0165 26 Q 4.2914 7.9954 118.8859 54.8272 31.6832 175.2490 27 S 3.2590 7.4106 114.1349 60.8743 63.4950 174.1918 28 S 4.3865 6.9261 112.8114 57.8167 64.8592 174.2446 29 V 4.7155 8.1979 119.3055 61.0668 33.9535 173.7733 30 D 4.7617 8.4596 124.6865 53.3540 44.3112 174.4101 31 Y 3.7174 8.7004 117.4627 58.9866 35.4008 170.1125 32 N 4.2463 8.5590 112.7695 54.3724 37.0184 175.7990 33 G 4.1486 8.2950 106.9600 44.7060 0.0000 174.3001 34 D 4.7588 7.7371 119.5759 53.7762 42.3493 176.8326 35 P 4.9042 0.0000 0.0000 65.0368 31.4516 178.0329 36 N 4.7546 8.1209 117.4344 54.4293 37.1537 176.9067 37 R 4.0280 8.0355 120.0922 58.6449 30.3913 177.5529 38 A 4.5340 8.0391 118.7877 52.4615 18.7077 178.1466 39 V 4.7718 7.7915 111.4173 61.1644 32.7872 176.4634 40 D 4.6131 8.5393 117.8832 53.2181 39.6603 177.6697 41 G 4.0254 9.0419 108.5935 45.5542 0.0000 172.8400 42 N 4.8063 8.1284 118.4572 51.7450 40.1377 174.6049 43 R 3.8640 8.3630 124.1115 56.7242 30.7581 176.2982 44 N 4.0921 8.2176 117.2689 54.4914 39.1464 174.3988 45 G 3.9066 8.6215 112.7131 45.1855 0.0000 172.1707 46 N 4.9425 7.8638 120.0828 52.7135 39.4256 174.9893 47 F 3.9396 9.6413 129.8333 61.5568 39.5008 176.5061 48 N 4.5949 8.3520 115.0840 54.5356 38.5399 175.9753 49 S 4.0953 7.9121 113.4499 59.4186 63.3842 175.5601 50 G 3.7318 7.7063 108.4565 45.2659 0.0000 173.7212 51 S 4.6393 7.4604 112.0349 57.5782 62.8012 173.5539 52 V 4.7443 7.1398 119.1584 61.8225 33.8191 175.2616 53 T 4.4871 8.7562 118.2070 62.1653 71.0383 172.9941 54 H 4.9074 9.3333 119.1806 56.6576 33.6752 173.3781 55 T 5.1159 8.3256 116.8457 59.5458 71.1387 174.1530 56 R 4.2609 8.5138 121.7873 55.5476 31.4370 178.2529 57 A 4.3272 8.4417 122.0933 51.8566 16.6521 176.6035 58 D 4.7619 8.7188 122.4143 52.3493 44.4545 175.4272 59 N 5.2349 8.3066 113.9047 51.2104 37.9405 172.0322 60 P 4.9729 0.0000 0.0000 60.7638 34.5490 175.9786 61 S 4.5016 8.2992 114.3677 58.4364 64.1286 173.6500 62 W 5.7585 8.1930 118.9527 55.5444 32.0865 173.0226 63 W 5.7421 9.7220 129.2754 56.2975 34.2090 173.0275 64 E 5.0104 8.5743 125.7873 54.5651 33.2452 173.9157 65 V 4.3845 8.1757 125.3660 59.7597 34.4108 173.9535 66 D 4.9463 8.5378 123.4979 52.6135 42.1317 175.8613 67 L 4.1241 8.8354 126.2028 55.2165 41.5184 178.4282 68 K 4.1394 9.9641 119.0476 56.2130 31.1931 175.6124 69 K 4.5616 7.0612 115.7720 55.3831 36.3196 175.0076 70 M 4.4389 8.4584 120.4101 55.9249 32.6168 175.5668 71 D 4.8304 9.0805 122.1107 52.9465 46.1192 173.0888 72 K 5.0755 8.5889 117.1285 54.6047 35.1591 175.5960 73 V 4.4658 8.8500 125.1818 61.6380 33.7992 174.7519 74 G 4.1225 9.5085 115.7940 46.3111 0.0000 175.7952 75 L 4.8609 6.9606 127.5198 54.9739 43.6632 174.6045 76 V 4.9928 9.4758 126.3879 61.0473 34.3862 173.7900 77 K 5.0352 9.4355 129.6696 54.6859 34.9647 174.4458 78 I 4.8858 8.6298 128.4066 59.7890 39.9988 173.9646 79 Y 4.9563 9.1833 125.6173 56.2606 39.6250 175.2460 80 N 4.7948 9.1053 124.0493 52.7151 40.1092 174.5847 81 R 4.2830 8.5800 123.4667 57.3892 30.1001 176.1245 82 T 4.5770 8.8612 113.7461 61.8358 70.7714 175.1036 83 D 4.4220 8.2415 120.4938 55.6644 39.9940 175.7366 84 A 4.3015 7.9387 118.9405 52.0707 21.8852 174.5178 85 E 4.1010 8.7783 115.2438 56.3462 26.9209 177.6795 86 T 3.9714 7.8709 110.0229 64.3560 69.2614 176.1349 87 Q 4.1302 8.0386 119.7726 58.3071 28.9290 178.3277 88 R 3.8567 7.6646 117.6028 59.0741 30.2354 177.1128 89 L 4.1885 7.2215 120.1340 53.1176 40.2992 175.3033 90 S 4.8004 7.9891 115.2991 57.0736 66.7260 174.2644 91 N 4.1491 8.9254 118.3222 54.4843 37.4404 172.7102 92 F 5.4811 8.0639 114.0645 55.3941 42.5483 175.0364 93 D 5.3719 9.2481 120.0548 52.9548 43.5647 175.5979 94 V 4.9913 8.9992 122.2679 61.4140 34.1355 174.3008 95 I 4.8424 9.0072 128.9941 59.4540 40.6154 174.4812 96 L 4.9482 8.3049 126.7541 53.5720 43.5692 175.2939 97 Y 5.3302 8.8466 120.4494 56.3424 42.2508 176.0231 98 D 4.6568 8.8359 121.9460 52.4872 41.7933 176.2984 99 N 4.5187 8.7781 116.1723 56.2493 38.1492 175.7629 100 N 4.8787 8.7904 114.9167 52.5502 38.8854 174.9311 101 R 4.0253 7.8634 115.3753 57.1633 28.3964 176.1159 102 N 4.7091 7.7918 114.9393 52.3389 39.4851 174.7172 103 E 4.1074 8.8449 123.9624 56.3841 30.1778 176.4397 104 V 4.4531 8.2916 118.5624 61.6852 34.2517 175.3752 105 A 4.6638 7.5555 119.8542 51.2135 22.5633 174.9823 106 K 5.1190 8.4773 119.2056 55.3401 35.4525 175.1716 107 K 4.7394 9.4532 125.9449 54.8647 36.0599 174.3658 108 H 5.1437 8.7742 123.1274 54.5101 31.8556 173.8053 109 V 4.0106 7.8568 125.3232 61.2877 33.3823 175.7202 110 N 4.4607 8.7940 125.6975 55.7944 39.7322 174.6103 111 N 4.9989 7.6330 111.8581 52.4928 39.7329 172.8091 112 L 4.7507 8.3643 118.3188 53.0381 43.5541 177.1970 113 S 4.3723 8.8123 118.0161 59.6851 64.1453 173.9782 114 G 4.3760 7.5785 109.8118 44.3094 0.0000 172.3145 115 E 4.4336 8.6924 117.4717 58.0279 30.6364 176.4867 116 S 5.1051 7.7604 112.7391 56.7666 66.5352 173.5594 117 V 4.5430 8.5371 119.1894 60.0030 34.6091 174.4827 118 S 5.2459 8.6868 118.4873 56.8194 65.4605 173.3918 119 L 4.7308 9.1644 124.0023 52.8018 45.5684 175.0966 120 D 5.2641 8.4410 122.0535 52.7235 42.7928 175.3634 121 F 4.4208 9.4374 125.1246 56.7327 39.2663 176.4532 122 K 4.1175 9.2474 119.2492 57.7877 29.7591 175.5829 123 E 3.9027 8.4936 113.7898 56.8855 27.4490 174.8589 124 K 4.0426 7.8780 120.6913 56.6148 33.3323 176.1530 125 G 4.0813 8.7329 114.6746 46.3180 0.0000 172.5008 126 A 4.6891 8.8454 125.0472 51.3654 22.8532 176.4170 127 R 4.2629 8.9920 119.8672 56.0646 32.5977 175.6228 128 Y 5.2611 7.8963 115.3625 56.0126 41.7765 174.8598 129 I 4.9611 8.6609 123.5184 59.4701 40.5598 174.2431 130 K 5.1394 9.4481 129.0942 54.6041 35.1496 174.6767 131 V 5.0259 9.3860 127.5942 61.2588 33.7151 174.1708 132 K 5.2339 9.3054 129.3331 54.4813 34.9670 175.3109 133 L 4.6134 8.8258 128.2422 55.0864 41.9622 177.4562 134 L 4.4523 8.9649 121.7463 55.2054 42.3886 176.6640 135 T 4.5044 7.6855 116.5122 61.2796 69.5081 174.6146 136 S 4.0799 8.6973 121.5348 60.0960 63.1516 174.4223 137 G 3.8422 9.0355 111.0327 46.1798 0.0000 172.8925 138 V 4.4050 7.5462 118.7700 59.8153 33.3614 173.6879 139 P 4.5663 0.0000 0.0000 62.6866 32.3893 175.2837 140 L 4.5550 8.7560 125.6705 53.6315 44.0492 175.2635 141 S 5.2913 8.3184 121.2019 55.5478 66.8817 172.8050 142 L 4.5591 8.6943 123.8921 52.8145 44.2901 177.5446 143 A 4.0075 9.0847 126.7367 54.8357 19.2007 177.3900 144 E 4.7179 7.4874 111.9097 55.5171 33.0933 175.1817 145 V 4.9101 8.9942 126.0600 61.3684 33.9032 174.3037 146 E 4.8876 9.5102 128.2703 54.5946 32.3842 175.3438 147 V 4.7904 8.0615 122.4324 61.1082 34.9659 174.0897 148 F 5.4224 9.1894 125.6996 55.7667 42.3429 176.5866 149 R 4.8315 9.2497 118.9103 57.3468 30.5727 175.7884 150 E 4.6467 7.9102 117.2452 55.1705 33.0772 176.2998 *151 S 4.2554 8.5028 113.8734 58.4333 63.0531 170.9447 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 K 8.17 3.86 0.00 1.37 1.39 0.00 1.50 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.85 7.81 11 F 7.85 5.18 0.00 3.17 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 12 N 10.08 4.96 0.00 3.03 2.85 0.00 0.00 6.87 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 13 D 9.94 4.49 0.00 2.77 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 14 G 8.65 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 0.00 0.00 0.00 15 N 8.02 5.04 0.00 2.66 2.77 0.00 0.00 6.61 6.31 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 16 L 8.87 4.40 0.00 1.95 1.80 0.70 1.06 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 17 N 9.24 4.20 0.00 2.65 2.73 0.00 0.00 6.52 8.02 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 18 I 8.12 3.85 1.84 0.00 0.00 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 1.33 0.64 0.91 0.00 0.00 19 A 8.21 4.14 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.51 4.31 0.00 2.79 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 21 A 8.11 3.36 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 7.61 4.25 0.00 1.85 1.89 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.65 1.60 7.81 23 P 0.00 4.54 0.00 2.03 1.94 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 24 T 8.37 5.05 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 1.29 0.00 0.00 25 T 8.43 4.95 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 1.22 0.00 0.00 26 Q 8.00 4.29 0.00 2.12 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.94 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 27 S 7.41 3.26 0.00 3.49 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 6.93 4.39 0.00 3.89 3.87 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 29 V 8.20 4.72 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 0.86 0.00 0.00 0.92 0.00 0.00 30 D 8.46 4.76 0.00 2.67 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 31 Y 8.70 3.72 0.00 3.05 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 N 8.56 4.25 0.00 2.92 2.91 0.00 0.00 7.10 7.65 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 33 G 8.29 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 34 D 7.74 4.76 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 4.90 0.00 2.35 2.57 0.00 3.90 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.88 0.00 36 N 8.12 4.75 0.00 2.98 3.14 0.00 0.00 6.75 7.66 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 37 R 8.04 4.03 0.00 1.94 2.06 0.00 3.24 0.00 0.00 3.35 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 38 A 8.04 4.53 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.79 4.77 2.34 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 1.17 0.00 0.00 1.07 0.00 0.00 40 D 8.54 4.61 0.00 2.85 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 9.04 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 42 N 8.13 4.81 0.00 2.65 2.84 0.00 0.00 7.14 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.36 3.86 0.00 1.63 1.56 0.00 3.08 0.00 0.00 2.64 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 1.26 0.00 44 N 8.22 4.09 0.00 2.78 2.73 0.00 0.00 7.01 7.53 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 45 G 8.62 3.91 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 0.00 46 N 7.86 4.94 0.00 2.74 2.71 0.00 0.00 6.76 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 47 F 9.64 3.94 0.00 3.03 3.08 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 48 N 8.35 4.59 0.00 2.91 2.85 0.00 0.00 6.92 7.57 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 49 S 7.91 4.10 0.00 3.92 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 50 G 7.71 3.73 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 0.00 0.00 0.00 51 S 7.46 4.64 0.00 3.82 3.87 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 52 V 7.14 4.74 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 1.04 0.00 0.00 0.97 0.00 0.00 53 T 8.76 4.49 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 54 H 9.33 4.91 0.00 3.38 3.49 0.00 5.61 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 T 8.33 5.12 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 1.22 0.00 0.00 56 R 8.51 4.26 0.00 1.84 1.92 0.00 3.12 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 57 A 8.44 4.33 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 58 D 8.72 4.76 0.00 2.67 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.31 5.23 0.00 2.57 2.75 0.00 0.00 6.75 8.02 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 60 P 0.00 4.97 0.00 2.44 2.15 0.00 3.96 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.09 0.00 61 S 8.30 4.50 0.00 3.85 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 62 W 8.19 5.76 0.00 3.62 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 63 W 9.72 5.74 0.00 3.42 3.08 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 64 E 8.57 5.01 0.00 2.03 1.66 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 2.16 2.38 0.00 65 V 8.18 4.38 1.89 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 0.75 0.00 0.00 0.98 0.00 0.00 66 D 8.54 4.95 0.00 2.79 2.71 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 67 L 8.84 4.12 0.00 1.57 1.61 0.87 0.91 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 68 K 9.96 4.14 0.00 1.84 2.00 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.44 7.81 69 K 7.06 4.56 0.00 1.73 1.82 0.00 1.48 0.00 0.00 1.79 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.42 7.81 70 M 8.46 4.44 0.00 1.90 2.03 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.45 0.00 71 D 9.08 4.83 0.00 2.60 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 8.59 5.08 0.00 1.72 1.71 0.00 1.91 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.36 7.81 73 V 8.85 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 0.99 0.00 0.00 0.90 0.00 0.00 74 G 9.51 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 0.00 0.00 0.00 0.00 75 L 6.96 4.86 0.00 1.89 1.87 0.99 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 76 V 9.48 4.99 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 1.16 0.00 0.00 1.17 0.00 0.00 77 K 9.44 5.04 0.00 2.03 1.89 0.00 1.65 0.00 0.00 1.80 0.00 0.00 2.83 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.71 1.32 7.81 78 I 8.63 4.89 1.92 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.94 0.81 0.00 0.00 79 Y 9.18 4.96 0.00 2.97 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 80 N 9.11 4.79 0.00 2.72 2.76 0.00 0.00 7.19 7.32 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 81 R 8.58 4.28 0.00 1.85 1.81 0.00 3.18 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.93 0.00 82 T 8.86 4.58 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 1.30 0.00 0.00 83 D 8.24 4.42 0.00 2.81 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 A 7.94 4.30 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.78 4.10 0.00 2.05 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 2.23 2.09 0.00 86 T 7.87 3.97 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 87 Q 8.04 4.13 0.00 2.23 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 88 R 7.66 3.86 0.00 1.88 2.13 0.00 3.05 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 1.63 1.61 0.00 89 L 7.22 4.19 0.00 1.52 1.56 -0.05 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 90 S 7.99 4.80 0.00 4.21 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 N 8.93 4.15 0.00 2.98 2.88 0.00 0.00 7.03 8.54 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 92 F 8.06 5.48 0.00 3.15 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 93 D 9.25 5.37 0.00 2.78 2.71 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 94 V 9.00 4.99 2.40 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 1.31 0.00 0.00 1.27 0.00 0.00 95 I 9.01 4.84 1.82 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.63 0.28 0.00 0.00 96 L 8.30 4.95 0.00 1.36 1.38 -0.07 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.85 5.33 0.00 2.97 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 98 D 8.84 4.66 0.00 2.93 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 99 N 8.78 4.52 0.00 2.69 2.91 0.00 0.00 6.72 7.79 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 0.00 100 N 8.79 4.88 0.00 2.93 2.78 0.00 0.00 6.87 7.36 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 0.00 101 R 7.86 4.03 0.00 1.79 1.64 0.00 2.79 0.00 0.00 2.61 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.31 0.00 102 N 7.79 4.71 0.00 3.28 2.77 0.00 0.00 6.71 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 0.00 103 E 8.84 4.11 0.00 1.83 1.84 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 2.17 2.00 0.00 104 V 8.29 4.45 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 0.77 0.00 0.00 0.95 0.00 0.00 105 A 7.56 4.66 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 0.00 106 K 8.48 5.12 0.00 1.81 1.66 0.00 1.98 0.00 0.00 1.71 0.00 0.00 2.83 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.52 7.81 107 K 9.45 4.74 0.00 1.73 1.55 0.00 0.71 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.31 0.00 0.00 0.00 0.00 1.18 1.19 7.81 108 H 8.77 5.14 0.00 3.08 3.13 0.00 5.86 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 0.00 109 V 7.86 4.01 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 0.65 0.00 0.00 0.61 0.00 0.00 110 N 8.79 4.46 0.00 2.74 2.83 0.00 0.00 6.69 6.92 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 0.00 111 N 7.63 5.00 0.00 2.81 2.81 0.00 0.00 5.88 7.79 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 0.00 112 L 8.36 4.75 0.00 1.66 1.84 1.15 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 113 S 8.81 4.37 0.00 3.97 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 0.00 114 G 7.58 4.38 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 0.00 115 E 8.69 4.43 0.00 2.00 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 2.42 2.33 0.00 116 S 7.76 5.11 0.00 3.29 3.39 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 0.00 117 V 8.54 4.54 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 0.93 0.00 0.00 0.92 0.00 0.00 118 S 8.69 5.25 0.00 3.71 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 0.00 119 L 9.16 4.73 0.00 1.61 1.20 1.07 0.52 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 0.00 120 D 8.44 5.26 0.00 2.62 2.48 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 0.00 121 F 9.44 4.42 0.00 3.36 3.07 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 0.00 122 K 9.25 4.12 0.00 1.93 1.92 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.55 1.53 7.81 123 E 8.49 3.90 0.00 2.19 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 0.00 2.49 2.28 0.00 124 K 7.88 4.04 0.00 2.10 1.76 0.00 1.53 0.00 0.00 1.68 0.00 0.00 3.17 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.47 1.46 7.81 125 G 8.73 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 0.00 0.00 0.00 126 A 8.85 4.69 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 0.00 127 R 8.99 4.26 0.00 1.64 1.56 0.00 2.88 0.00 0.00 2.98 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.87 0.00 128 Y 7.90 5.26 0.00 3.08 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 0.00 129 I 8.66 4.96 1.98 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.76 1.02 0.00 0.00 130 K 9.45 5.14 0.00 2.08 1.89 0.00 1.29 0.00 0.00 1.62 0.00 0.00 2.67 0.00 0.00 2.27 0.00 0.00 0.00 0.00 1.51 1.63 7.81 131 V 9.39 5.03 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 0.80 0.00 0.00 1.18 0.00 0.00 132 K 9.31 5.23 0.00 2.01 1.78 0.00 1.79 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.61 7.81 133 L 8.83 4.61 0.00 1.68 1.67 0.95 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 134 L 8.96 4.45 0.00 1.85 1.78 1.09 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 135 T 7.69 4.50 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 1.24 0.00 0.00 136 S 8.70 4.08 0.00 4.00 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 0.00 137 G 9.04 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 7.55 4.41 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 0.84 0.00 0.00 0.95 0.00 0.00 139 P 0.00 4.57 0.00 1.83 2.17 0.00 3.68 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 140 L 8.76 4.56 0.00 1.72 1.49 0.75 1.33 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 0.00 141 S 8.32 5.29 0.00 3.63 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 0.00 142 L 8.69 4.56 0.00 1.05 1.13 0.14 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 143 A 9.08 4.01 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 0.00 144 E 7.49 4.72 0.00 2.07 1.61 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 0.00 2.03 2.27 0.00 145 V 8.99 4.91 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 1.02 0.00 0.00 0.29 0.00 0.00 146 E 9.51 4.89 0.00 2.24 1.72 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 2.29 2.39 0.00 147 V 8.06 4.79 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 1.02 0.00 0.00 1.00 0.00 0.00 148 F 9.19 5.42 0.00 3.14 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 0.00 149 R 9.25 4.83 0.00 1.89 2.05 0.00 3.24 0.00 0.00 4.01 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.64 0.00 150 E 7.91 4.65 0.00 2.12 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 2.31 2.34 0.00 *151 S 8.50 4.26 0.00 3.62 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 * Residues marked with a * may have inaccurate shift predictions.