NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -5 T 4.3937 8.1749 115.2505 62.3964 68.3464 173.7918 -4 E 5.3702 8.7446 119.4083 55.1304 32.0474 173.6812 -3 F 4.9618 9.7558 123.5246 56.0672 42.3292 174.4502 -2 K 4.0422 7.6665 125.7933 53.6484 34.9911 175.9445 -1 A 4.0668 7.3191 125.5316 51.8021 19.2955 177.0895 -4 G 4.9802 8.6546 108.0083 43.6304 0.0000 171.9812 -3 S 4.8118 9.7658 118.9246 56.6672 66.5292 173.2502 -2 A 4.0422 7.6165 129.1933 49.9484 20.9911 177.1445 -1 K 4.0668 7.3691 122.1316 55.5021 33.2955 175.8895 5 K 4.1834 7.9889 119.6993 59.4121 32.1476 178.9884 6 G 3.6973 8.1442 105.4062 47.6614 0.0000 175.2547 7 A 2.5800 7.6403 122.8124 54.6723 18.3353 179.6595 8 T 3.8947 7.6069 107.6491 64.6118 69.0448 176.9408 9 L 3.9475 7.9748 121.9646 57.3698 41.6329 178.9794 10 F 3.9469 8.3536 120.9288 61.4379 39.1144 177.3214 11 K 4.0796 7.9682 116.7126 59.5310 31.9298 178.8889 12 T 4.1895 7.7347 108.4210 63.0408 69.2046 175.6653 13 R 4.4821 8.0336 118.3909 55.8328 32.9631 176.0403 14 C 4.3603 8.0114 114.8851 60.4376 30.5674 175.7917 15 L 4.2205 7.3370 120.2887 57.2872 41.8842 178.3392 16 Q 4.0202 8.1070 118.4646 59.0536 28.8689 176.7999 17 C 4.8124 7.9859 111.8391 59.8276 30.0000 173.3056 18 H 5.3516 8.0096 114.7905 54.5406 33.5617 172.3512 19 T 5.0686 8.6961 109.7513 60.2037 71.6685 174.7662 20 V 4.5317 8.3499 119.7309 61.1892 33.2690 176.2564 21 E 4.1364 7.9495 118.9741 55.3942 30.2230 176.0319 22 K 3.7895 8.1059 122.4408 57.9327 32.5290 177.2506 23 G 3.9375 8.9372 114.4083 45.1511 0.0000 173.7958 24 G 3.7631 7.8044 109.1083 44.5729 0.0000 171.9895 25 P 4.5798 0.0000 0.0000 61.6182 32.7548 175.6917 26 H 4.7004 8.2988 116.3281 55.9403 30.2609 175.5603 27 K 4.6063 8.4932 124.4168 55.4781 32.7122 178.5560 28 V 3.7257 8.9567 124.3858 66.1771 31.6013 176.1165 29 G 3.9126 7.9924 107.7363 42.2165 0.0000 170.8647 30 P 4.2908 0.0000 0.0000 61.4877 32.0802 175.8846 31 N 4.5464 8.8138 118.1983 54.1753 39.5054 174.7433 32 L 4.3762 8.9362 123.7101 54.4237 42.5269 176.0938 33 H 4.0780 7.9620 118.8625 57.8975 29.9705 174.6765 34 G 3.9820 8.8837 113.8447 46.4706 0.0000 174.5478 35 I 3.6632 7.6168 122.7391 63.3925 38.0799 176.5836 36 F 4.4650 7.7207 118.9901 58.7941 39.0186 175.3569 37 G 4.0288 9.8536 116.0581 45.0968 0.0000 173.5323 38 R 4.3777 7.9207 120.0983 56.1786 31.6389 175.3492 39 H 5.0380 8.5726 120.2924 54.5325 30.4091 175.3485 40 S 4.3772 8.3739 116.1416 58.7647 63.6852 174.1066 41 G 2.0000 8.1933 108.5255 46.9379 0.0000 173.9593 42 Q 4.4819 7.7244 114.4804 54.6910 30.9132 176.3166 43 A 4.2866 8.3232 122.5470 51.9187 18.9841 177.2909 44 E 4.3444 8.7525 120.4395 56.9969 30.8552 176.9874 45 G 3.9887 9.1006 108.5609 45.7456 0.0000 172.3019 46 Y 4.3813 7.6541 119.8457 55.3103 41.1331 174.6686 47 S 4.4937 7.0304 121.2506 56.9686 61.6788 173.0899 48 Y 4.7477 8.2164 125.2234 56.9187 38.9356 176.4067 49 T 4.3126 8.3951 111.8644 61.3926 71.2273 175.3176 50 D 4.3680 8.6761 121.8119 57.5868 40.9427 178.6641 51 A 3.9696 8.1272 120.6761 55.5717 18.1368 179.4422 52 I 3.6555 7.6647 116.4769 64.0832 37.8160 178.1461 53 I 3.5605 7.1855 119.3994 64.4354 37.0743 178.3955 54 K 4.0778 7.7191 117.5441 58.9020 31.9058 179.0795 55 K 3.8502 7.9545 119.6342 57.3263 32.5465 176.1393 56 N 3.9355 7.6486 115.9751 54.0435 38.1076 174.1923 57 V 3.4181 7.0460 115.9507 62.6540 33.0643 174.5255 58 L 4.3105 7.8972 129.3840 53.1494 43.1838 175.8457 59 W 4.8233 8.6035 127.9288 56.5969 29.8250 175.3954 60 D 5.4668 8.7764 123.8370 50.2679 42.2428 176.4123 61 E 3.9894 8.7538 117.5167 59.5545 29.0834 179.1723 62 N 4.4356 8.2576 117.0363 56.3342 38.8239 176.9755 63 N 4.4376 9.2856 118.2191 56.6139 38.6388 177.1597 64 M 4.2694 8.4067 119.6236 58.7014 32.3825 178.1847 65 S 4.1077 7.8061 113.1591 61.5185 62.4015 176.0692 66 E 3.9022 7.4623 118.5480 59.2898 29.2613 178.2901 67 Y 4.3864 7.7327 119.5181 61.0388 38.8616 178.4972 68 L 3.8277 8.1985 119.6347 57.7183 41.4787 179.7070 69 T 4.6306 7.5567 116.9583 64.8986 69.0824 173.4114 70 N 4.7111 7.8697 117.5920 52.2124 40.7237 172.5502 71 P 3.8061 0.0000 0.0000 63.5687 32.0284 177.9520 *73 K 4.2180 7.9419 120.5748 56.5317 33.7523 176.2655 74 Y 4.4285 8.2258 119.0180 59.8059 39.1794 175.4576 75 I 4.5053 8.2543 120.5433 58.0408 38.0418 171.1652 76 P 4.4234 0.0000 0.0000 63.7879 31.8690 176.4824 77 G 4.1073 9.1275 111.2466 45.8171 0.0000 174.0304 78 T 4.0545 7.7805 114.0883 62.3931 67.7031 173.7070 79 K 4.3584 8.5483 124.8410 56.7724 33.2707 176.1218 80 M 4.0611 7.9160 120.6839 56.1584 32.4869 176.9472 81 A 4.4996 8.3413 133.2148 50.7372 17.7849 175.4791 82 S 4.6606 7.5269 114.8005 55.5416 65.5508 174.2259 83 G 3.5896 8.6489 115.3861 46.4550 0.0000 174.1431 84 G 3.9054 7.5848 103.8596 46.5318 0.0000 173.1937 85 L 4.5273 8.7573 119.2004 52.8137 41.7935 177.9775 86 K 4.0520 8.5170 124.4128 58.4086 32.7440 178.6859 87 K 4.3380 7.8365 119.1346 55.2325 33.6107 177.2282 88 E 4.0136 8.8698 125.0710 59.1615 29.6412 178.9189 89 K 4.0232 8.0448 118.4902 60.1808 32.5534 178.7944 90 D 4.3841 8.0404 119.5400 57.0443 40.8877 178.6920 91 R 3.9887 8.0651 118.6220 59.3229 30.0840 178.8710 92 N 4.7374 8.7483 116.5415 56.6003 38.6057 177.2044 93 D 4.4310 8.2166 120.1764 57.2581 40.9263 178.5917 94 L 4.1243 8.5312 121.0072 58.5316 42.1357 179.0674 95 I 3.8353 8.4545 119.9683 64.6694 36.7766 178.6502 96 T 3.9656 8.1288 116.7246 66.7325 68.2982 176.0943 97 Y 4.0744 8.2468 121.3998 60.7355 38.9037 178.0688 98 L 3.6420 8.6278 120.2408 57.4205 41.5039 179.1393 99 K 3.0466 8.0936 119.0176 59.3120 32.0384 178.3837 100 K 3.9270 7.3205 118.1825 59.3582 32.2638 178.3454 101 A 3.9893 7.6576 119.6762 53.9668 18.7581 178.3896 102 A 4.0407 7.7115 117.7541 52.3476 18.5801 177.1432 103 E 4.0271 7.7273 123.9579 56.3731 29.8186 175.8598 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 -5 T 8.17 4.39 4.55 0.00 0.00 0.00 0.00 0.00 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 -4 E 8.74 5.37 0.00 2.07 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 2.23 2.36 0.00 -3 F 9.76 4.96 0.00 2.94 3.10 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 -2 K 7.67 4.04 0.00 1.46 1.41 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.17 1.22 7.81 -1 A 7.32 4.07 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 -4 G 8.65 4.98 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 -3 S 9.77 4.81 0.00 3.69 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 -2 A 7.62 4.04 1.15 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 -1 K 7.37 4.07 0.00 1.61 1.50 0.00 0.61 0.00 0.00 1.78 0.00 0.00 2.13 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.32 7.81 5 K 7.99 4.18 0.00 1.87 1.96 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.76 1.57 7.81 6 G 8.14 3.70 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 0.00 0.00 0.00 7 A 7.64 2.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 7.61 3.89 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 1.19 0.00 0.00 9 L 7.97 3.95 0.00 1.96 1.78 0.98 0.69 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 10 F 8.35 3.95 0.00 3.21 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 11 K 7.97 4.08 0.00 1.77 1.88 0.00 1.75 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.61 1.83 7.81 12 T 7.73 4.19 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 1.22 0.00 0.00 13 R 8.03 4.48 0.00 1.75 1.87 0.00 3.22 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 1.56 1.65 0.00 14 C 8.01 4.36 0.00 1.23 2.14 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 15 L 7.34 4.22 0.00 1.79 1.75 1.17 0.89 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 16 Q 8.11 4.02 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.60 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 17 C 7.99 4.81 0.00 2.78 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 18 H 8.01 5.35 0.00 3.21 3.22 0.00 5.55 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.70 5.07 4.71 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 1.27 0.00 0.00 20 V 8.35 4.53 1.64 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 0.52 0.00 0.00 0.63 0.00 0.00 21 E 7.95 4.14 0.00 2.11 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 0.00 2.44 2.24 0.00 22 K 8.11 3.79 0.00 1.05 1.51 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.34 7.81 23 G 8.94 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 24 G 7.80 3.76 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 0.00 0.00 0.00 25 P 0.00 4.58 0.00 2.20 2.05 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 1.98 1.99 0.00 26 H 8.30 4.70 0.00 3.31 3.46 0.00 5.64 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 27 K 8.49 4.61 0.00 1.82 1.33 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.39 1.53 7.81 28 V 8.96 3.73 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 0.78 0.00 0.00 0.93 0.00 0.00 29 G 7.99 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 30 P 0.00 4.29 0.00 1.93 0.94 0.00 3.53 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.34 0.00 31 N 8.81 4.55 0.00 2.96 2.78 0.00 0.00 6.96 7.78 0.00 0.00 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 8.94 4.38 0.00 1.64 1.51 0.92 0.66 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 33 H 7.96 4.08 0.00 3.33 3.24 0.00 6.08 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 34 G 8.88 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 35 I 7.62 3.66 1.80 0.00 0.00 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 0.65 0.40 0.23 0.00 0.00 36 F 7.72 4.46 0.00 3.12 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 37 G 9.85 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 38 R 7.92 4.38 0.00 1.97 2.08 0.00 3.15 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 39 H 8.57 5.04 0.00 2.96 3.06 0.00 5.95 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 S 8.37 4.38 0.00 3.90 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 41 G 8.19 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 0.00 0.00 0.00 0.00 0.00 0.00 42 Q 7.72 4.48 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.25 0.00 43 A 8.32 4.29 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 44 E 8.75 4.34 0.00 2.17 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 2.33 2.37 0.00 45 G 9.10 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 46 Y 7.65 4.38 0.00 2.39 2.29 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 47 S 7.03 4.49 0.00 3.67 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 48 Y 8.22 4.75 0.00 3.10 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 49 T 8.40 4.31 4.31 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 1.32 0.00 0.00 50 D 8.68 4.37 0.00 2.73 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 51 A 8.13 3.97 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 52 I 7.66 3.66 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 1.52 1.35 1.13 0.00 0.00 53 I 7.19 3.56 1.97 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.77 0.85 0.00 0.00 54 K 7.72 4.08 0.00 1.72 1.82 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.64 7.81 55 K 7.95 3.85 0.00 1.71 1.91 0.00 1.57 0.00 0.00 1.39 0.00 0.00 2.31 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.18 1.20 7.81 56 N 7.65 3.94 0.00 2.83 2.68 0.00 0.00 7.18 7.60 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 57 V 7.05 3.42 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 -0.40 0.00 0.00 0.71 0.00 0.00 58 L 7.90 4.31 0.00 1.44 1.40 0.57 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 59 W 8.60 4.82 0.00 3.44 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 60 D 8.78 5.47 0.00 2.92 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 61 E 8.75 3.99 0.00 1.36 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 2.23 2.37 0.00 62 N 8.26 4.44 0.00 3.16 2.96 0.00 0.00 7.18 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 63 N 9.29 4.44 0.00 3.01 2.98 0.00 0.00 6.72 8.25 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 64 M 8.41 4.27 0.00 2.34 2.17 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.65 0.00 65 S 7.81 4.11 0.00 4.16 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 66 E 7.46 3.90 0.00 1.56 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 2.38 2.35 0.00 67 Y 7.73 4.39 0.00 3.26 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 68 L 8.20 3.83 0.00 1.77 1.67 0.94 0.70 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 69 T 7.56 4.63 4.42 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 1.22 0.00 0.00 70 N 7.87 4.71 0.00 2.62 2.69 0.00 0.00 7.25 7.73 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 71 P 0.00 3.81 0.00 2.09 1.49 0.00 3.68 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 1.71 0.00 *73 K 7.94 4.22 0.00 1.77 2.09 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.58 7.81 74 Y 8.23 4.43 0.00 3.14 3.45 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 75 I 8.25 4.51 2.11 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 1.09 0.74 0.93 0.00 0.00 76 P 0.00 4.42 0.00 2.04 2.02 0.00 3.61 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 2.02 2.11 0.00 77 G 9.13 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 7.78 4.05 4.51 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 1.45 0.00 0.00 79 K 8.55 4.36 0.00 1.95 1.96 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.49 7.81 80 M 7.92 4.06 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.46 0.00 81 A 8.34 4.50 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 82 S 7.53 4.66 0.00 3.73 3.60 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 83 G 8.65 3.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 G 7.58 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 85 L 8.76 4.53 0.00 1.78 1.62 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.52 4.05 0.00 1.73 1.87 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.19 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.52 7.81 87 K 7.84 4.34 0.00 1.98 1.74 0.00 1.68 0.00 0.00 1.90 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.49 7.81 88 E 8.87 4.01 0.00 2.05 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 2.39 2.42 0.00 89 K 8.04 4.02 0.00 2.02 2.06 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.55 7.81 90 D 8.04 4.38 0.00 2.90 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 91 R 8.07 3.99 0.00 2.12 2.08 0.00 3.23 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 92 N 8.75 4.74 0.00 2.88 3.03 0.00 0.00 7.07 8.09 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 93 D 8.22 4.43 0.00 2.90 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 94 L 8.53 4.12 0.00 1.85 1.82 1.28 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 95 I 8.45 3.84 1.86 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.82 0.15 0.00 0.00 96 T 8.13 3.97 4.52 0.00 0.00 0.00 0.00 0.00 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 97 Y 8.25 4.07 0.00 3.29 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 98 L 8.63 3.64 0.00 1.81 1.94 0.97 0.74 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 99 K 8.09 3.05 0.00 0.96 1.84 0.00 1.69 0.00 0.00 1.46 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.25 1.14 7.81 100 K 7.32 3.93 0.00 1.64 1.89 0.00 1.84 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.39 7.81 101 A 7.66 3.99 0.59 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 0.00 0.00 0.00 0.00 0.00 0.00 102 A 7.71 4.04 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 0.00 103 E 7.73 4.03 0.00 2.01 1.76 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 2.20 2.32 0.00 * Residues marked with a * may have inaccurate shift predictions.