NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.3866 8.0433 120.6327 54.8821 44.1788 178.8860 8 E 3.8756 8.1068 118.0532 58.8375 29.3541 177.6050 9 A 4.0768 8.1465 120.6818 55.1005 18.8698 179.0514 10 Q 3.9648 8.1229 117.5582 59.0614 29.2534 177.9357 11 A 4.0148 8.1526 121.9275 54.8786 18.2501 179.1815 12 W 4.1601 8.2242 125.2729 60.8081 30.9453 177.6017 13 A 4.9643 8.1533 121.8319 54.8643 17.6919 179.5942 14 L 3.9697 8.3812 117.8125 57.9253 41.6657 179.7286 15 L 3.9983 7.9598 118.7237 57.1902 41.5572 178.6536 16 E 4.1326 7.7443 117.4622 57.7617 29.1185 177.9483 17 A 4.6445 7.5120 120.1389 51.9642 19.4144 177.0837 18 V 3.9735 7.5158 118.7703 62.3798 32.2457 174.4954 19 Y 4.6989 8.6233 125.8986 56.6043 40.1122 175.3112 20 D 4.5293 8.9158 123.8910 52.5231 41.6019 175.0948 21 P 4.2499 0.0000 0.0000 65.8667 31.6878 177.6349 22 E 4.0944 8.5310 115.6697 59.0229 27.9716 177.9232 23 L 4.4778 7.8257 115.1688 53.5084 42.8248 176.9840 24 G 4.1761 8.2895 106.4541 46.3802 0.0000 173.5012 25 L 4.4373 7.0221 116.3606 51.3795 45.7989 176.1094 26 D 4.3849 7.1026 119.9063 52.9049 41.7019 177.8174 27 V 3.4483 8.1846 114.1656 64.2650 31.4478 179.3381 28 V 3.2103 7.3472 117.6323 66.0087 31.4702 177.7510 29 N 4.4924 8.5141 115.9848 55.6865 38.1528 177.0438 30 L 4.3522 7.6456 119.2511 55.3510 41.7762 177.7717 31 G 4.2272 7.6365 105.5380 47.1562 0.0000 174.5874 32 L 3.9562 7.8802 119.7913 55.5579 41.9479 177.1046 33 I 4.1375 7.5455 119.9602 60.4894 37.5193 174.7128 34 Y 4.9071 8.7579 124.3097 59.8631 39.1159 175.9532 35 D 4.9399 7.9619 117.1170 52.8811 45.1595 174.0308 36 L 5.2071 8.5781 126.2836 53.6886 45.4018 175.3635 37 V 4.6553 9.3885 126.2092 61.4249 35.0883 173.6297 38 V 4.6134 9.2775 128.7086 61.3664 33.2704 176.0847 39 E 4.7081 9.2813 127.7956 53.6049 31.2654 172.1082 40 P 4.6864 0.0000 0.0000 61.9163 32.7033 173.8758 41 P 5.6347 0.0000 0.0000 62.8928 32.2944 175.1440 42 R 5.8592 8.6347 119.7685 54.2333 33.7639 174.0578 43 A 5.1641 8.4773 124.5156 50.3478 22.7535 174.1407 44 Y 5.2793 9.5097 123.3051 55.6830 42.4476 174.6908 45 V 4.7543 7.9723 124.9603 59.9941 34.9610 174.1413 46 R 4.9713 8.5600 124.5191 53.9246 33.0444 174.9379 *48 T 4.1406 8.0760 116.9828 61.9553 68.2383 172.2389 49 L 4.6363 7.7647 121.5375 52.5340 44.6201 177.2817 50 T 3.2718 8.0060 110.3231 63.3713 69.0560 174.7396 51 T 4.7254 7.4313 111.3383 58.4765 71.2837 171.9652 52 P 3.6081 0.0000 0.0000 63.6748 32.0139 176.3407 53 G 3.9093 6.7635 108.4951 45.2347 0.0000 172.9753 54 C 4.5490 8.4704 120.0868 58.2712 29.0878 172.1440 55 P 4.6569 0.0000 0.0000 61.6697 32.2328 176.0755 56 L 4.0427 8.5324 119.3161 57.6430 41.6493 177.4125 57 H 4.7804 7.8150 116.8523 53.7703 32.3389 173.7085 58 D 4.5656 8.4035 128.5225 53.0400 38.2541 176.1430 59 S 3.8803 7.6328 120.2828 60.9805 63.4419 175.5492 60 L 3.9536 7.8395 122.5975 58.1495 41.8294 179.1333 61 G 3.9869 8.0121 106.4137 47.2347 0.0000 175.0835 62 E 3.8894 8.1685 121.5487 59.0043 29.6131 178.8103 63 A 3.9914 8.3562 121.2672 55.0561 18.3667 179.8114 64 V 3.4598 7.7034 116.8316 65.9226 31.4812 178.3784 65 R 3.8372 7.7999 117.8830 59.4093 29.7557 178.8447 66 Q 3.9417 7.7898 115.8510 59.0618 28.8534 178.4686 67 A 4.1256 7.8319 120.1933 55.4610 18.6955 179.3974 68 L 4.2192 7.9628 116.6771 57.1516 41.4779 179.1309 69 S 4.3179 7.8280 112.7056 58.9293 62.5880 174.7469 70 R 4.5860 7.7052 119.6342 55.5774 31.8502 176.3557 71 L 4.0949 7.8009 117.9483 53.4836 42.1697 174.8233 72 P 4.1263 0.0000 0.0000 64.5761 31.2557 176.2367 73 G 3.6628 8.9666 113.6692 46.5282 0.0000 172.8450 74 V 4.6267 7.7375 118.1741 61.0800 33.4995 173.9370 75 E 4.7132 8.9139 126.3839 55.9784 32.1588 175.8428 76 E 4.5692 8.4457 117.7256 54.5106 32.0359 174.9556 77 V 4.8519 8.4552 124.7421 60.9035 33.7044 174.0841 78 E 4.5686 9.4161 129.4361 54.4998 31.7331 174.5467 79 V 4.4809 8.3852 127.0683 61.2127 33.1152 173.8661 80 E 4.3495 8.5928 128.5220 55.0677 31.0660 175.6525 81 V 4.0873 8.2581 125.2566 61.5948 32.2427 174.5956 82 T 4.4490 8.0447 121.5527 60.3443 70.4473 173.5174 83 F 4.9419 8.4687 119.4507 56.9709 39.8415 174.6458 84 E 4.6869 8.4132 120.6269 53.7795 31.5704 174.3755 85 P 4.6140 0.0000 0.0000 61.3368 32.3505 174.2497 86 P 4.8347 0.0000 0.0000 61.7073 31.9991 176.2380 87 W 4.5074 8.9680 132.0671 57.6921 31.6643 174.8282 88 T 4.3769 6.8131 111.9017 59.5824 71.4227 174.7060 89 L 3.5690 7.8483 121.1331 57.0224 41.7245 179.4506 90 A 4.0247 7.1722 120.4395 54.5327 18.3073 178.5886 91 R 4.1694 7.5613 114.1776 57.2574 30.5546 176.9197 92 L 4.4812 7.5625 118.6551 54.6547 42.3370 177.1079 93 S 4.5659 8.6362 116.5183 57.4270 64.2654 175.0195 94 E 3.9758 8.7113 120.8238 59.3327 29.0342 178.6497 95 K 3.9837 8.0245 118.2450 58.9935 32.6966 178.4428 96 A 4.0869 7.9473 121.6595 55.1067 18.4652 179.8098 97 R 4.0182 8.0526 114.1010 58.8141 29.2785 178.8453 98 R 3.9634 7.4559 119.5739 59.0783 30.1919 177.7018 99 L 4.2306 7.5721 116.8165 55.9994 41.8867 177.9938 100 L 4.2507 7.3715 116.6586 53.1408 41.9352 176.4090 101 G 4.0049 7.6702 105.8077 46.1736 0.0000 174.0599 102 W 4.6995 8.0748 124.8995 56.6109 29.2033 176.2232 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 7 L 8.04 4.39 0.00 1.75 1.81 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.11 3.88 0.00 2.06 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 2.39 0.00 9 A 8.15 4.08 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 10 Q 8.12 3.96 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 11 A 8.15 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 12 W 8.22 4.16 0.00 3.53 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 13 A 8.15 4.96 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.38 3.97 0.00 1.86 1.73 0.98 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.96 4.00 0.00 1.54 1.43 0.80 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.74 4.13 0.00 2.07 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 2.07 2.25 0.00 17 A 7.51 4.64 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 18 V 7.52 3.97 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 0.88 0.00 0.00 19 Y 8.62 4.70 0.00 2.77 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.92 4.53 0.00 2.60 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 P 0.00 4.25 0.00 2.06 2.13 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.16 0.00 22 E 8.53 4.09 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 2.33 2.34 0.00 23 L 7.83 4.48 0.00 1.60 1.55 1.03 1.35 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 24 G 8.29 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 25 L 7.02 4.44 0.00 1.51 1.26 0.86 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 26 D 7.10 4.38 0.00 2.65 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 V 8.18 3.45 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 0.72 0.00 0.00 0.73 0.00 0.00 28 V 7.35 3.21 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 0.42 0.00 0.00 0.04 0.00 0.00 29 N 8.51 4.49 0.00 2.73 2.80 0.00 0.00 7.11 7.59 0.00 0.00 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 L 7.65 4.35 0.00 1.76 1.70 0.81 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.64 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 0.00 0.00 0.00 0.00 32 L 7.88 3.96 0.00 1.56 1.57 0.59 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.55 4.14 1.84 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.47 0.98 0.00 0.00 34 Y 8.76 4.91 0.00 3.01 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 35 D 7.96 4.94 0.00 2.94 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 36 L 8.58 5.21 0.00 1.82 1.68 1.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 37 V 9.39 4.66 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.03 0.00 0.00 38 V 9.28 4.61 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 0.87 0.00 0.00 0.99 0.00 0.00 39 E 9.28 4.71 0.00 2.03 1.81 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 2.24 2.30 0.00 40 P 0.00 4.69 0.00 1.94 2.21 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 41 P 0.00 5.63 0.00 2.12 2.26 0.00 3.81 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 2.21 1.81 0.00 42 R 8.63 5.86 0.00 1.90 1.89 0.00 3.12 0.00 0.00 3.33 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 43 A 8.48 5.16 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 44 Y 9.51 5.28 0.00 2.95 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 45 V 7.97 4.75 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 0.57 0.00 0.00 0.84 0.00 0.00 46 R 8.56 4.97 0.00 1.96 1.91 0.00 3.30 0.00 0.00 3.39 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.53 0.00 *48 T 8.08 4.14 3.63 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 0.87 0.00 0.00 49 L 7.76 4.64 0.00 1.91 1.47 0.96 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.01 3.27 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 0.22 0.00 0.00 51 T 7.43 4.73 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 1.23 0.00 0.00 52 P 0.00 3.61 0.00 1.93 1.92 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.90 0.00 53 G 6.76 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 54 C 8.47 4.55 0.00 3.04 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.66 0.00 2.17 2.05 0.00 3.82 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 1.96 1.96 0.00 56 L 8.53 4.04 0.00 1.67 1.81 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 57 H 7.81 4.78 0.00 2.97 3.14 0.00 5.92 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 D 8.40 4.57 0.00 2.78 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 59 S 7.63 3.88 0.00 3.81 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 60 L 7.84 3.95 0.00 1.64 1.54 0.83 0.87 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 61 G 8.01 3.99 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 0.00 0.00 0.00 62 E 8.17 3.89 0.00 2.07 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 0.00 2.32 2.36 0.00 63 A 8.36 3.99 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 64 V 7.70 3.46 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 0.92 0.00 0.00 0.90 0.00 0.00 65 R 7.80 3.84 0.00 2.14 1.94 0.00 3.16 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 66 Q 7.79 3.94 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.90 0.00 0.00 0.00 0.00 0.00 2.39 2.68 0.00 67 A 7.83 4.13 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 68 L 7.96 4.22 0.00 1.71 1.73 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.83 4.32 0.00 3.99 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 70 R 7.71 4.59 0.00 1.97 1.92 0.00 3.33 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 71 L 7.80 4.09 0.00 1.75 1.63 0.98 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 72 P 0.00 4.13 0.00 2.18 2.12 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 73 G 8.97 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 74 V 7.74 4.63 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.95 0.00 0.00 75 E 8.91 4.71 0.00 1.85 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 2.21 2.33 0.00 76 E 8.45 4.57 0.00 2.03 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 2.45 2.23 0.00 77 V 8.46 4.85 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 0.93 0.00 0.00 78 E 9.42 4.57 0.00 2.13 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 0.00 2.35 2.29 0.00 79 V 8.39 4.48 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 0.74 0.00 0.00 0.84 0.00 0.00 80 E 8.59 4.35 0.00 1.85 1.85 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 2.41 2.59 0.00 81 V 8.26 4.09 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 0.38 0.00 0.00 0.84 0.00 0.00 82 T 8.04 4.45 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 1.35 0.00 0.00 83 F 8.47 4.94 0.00 3.18 3.02 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 84 E 8.41 4.69 0.00 2.02 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 0.00 2.34 2.34 0.00 85 P 0.00 4.61 0.00 2.18 2.02 0.00 3.30 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 1.67 1.69 0.00 86 P 0.00 4.83 0.00 2.33 2.23 0.00 3.45 0.00 0.00 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.98 0.00 87 W 8.97 4.51 0.00 3.39 3.23 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 88 T 6.81 4.38 4.01 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 1.13 0.00 0.00 89 L 7.85 3.57 0.00 1.56 1.82 0.46 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 90 A 7.17 4.02 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 91 R 7.56 4.17 0.00 1.64 2.11 0.00 3.13 0.00 0.00 3.55 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.46 0.00 92 L 7.56 4.48 0.00 1.77 1.72 1.26 1.33 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 93 S 8.64 4.57 0.00 4.08 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 94 E 8.71 3.98 0.00 2.13 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 2.40 2.45 0.00 95 K 8.02 3.98 0.00 1.81 1.85 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.51 7.81 96 A 7.95 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 97 R 8.05 4.02 0.00 2.39 2.36 0.00 3.10 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.81 0.00 98 R 7.46 3.96 0.00 2.00 2.14 0.00 3.26 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 99 L 7.57 4.23 0.00 1.71 1.65 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.37 4.25 0.00 0.77 0.13 0.02 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 101 G 7.67 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 0.00 102 W 8.07 4.70 0.00 3.40 2.98 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 * Residues marked with a * may have inaccurate shift predictions.