NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 N 4.7148 8.2827 118.2195 52.3369 39.0119 175.5497 6 L 3.9635 7.9104 121.5015 57.3000 42.2879 176.5169 7 S 4.3028 8.8388 114.5193 60.6471 64.1898 173.3260 8 E 4.3541 7.4238 119.9248 55.8626 31.2891 171.6963 9 L 3.5007 8.6633 130.4515 54.4463 40.7791 173.4225 10 P 4.4414 0.0000 0.0000 63.8377 32.0332 176.8029 11 N 4.6798 8.9531 115.6018 53.3813 37.1673 174.1706 12 I 4.1805 7.2996 118.2448 59.6497 37.8983 175.7113 13 G 3.9825 8.4337 117.2239 44.7197 0.0000 173.8390 14 K 4.0483 8.5417 117.8968 58.6175 32.2632 179.3123 15 V 3.8253 7.6384 117.0091 63.5690 32.5789 177.4916 16 L 3.9953 7.9525 121.3421 58.4134 42.1964 178.2213 17 E 4.2016 7.9931 116.7432 58.6451 29.4340 178.6962 18 Q 3.8661 7.5166 121.2865 59.4998 29.2590 177.5126 19 D 4.4131 7.9854 118.6229 56.3514 41.3321 177.8784 20 L 3.9140 8.2922 121.7958 58.3168 42.1258 178.7137 21 I 3.6903 7.6772 119.5688 64.5636 36.8667 178.3536 22 K 3.9376 7.6767 117.3014 59.4842 32.0339 178.6497 23 A 4.2830 8.1661 117.6817 52.6082 18.1332 177.8185 24 G 3.8087 8.5030 106.0449 45.9977 0.0000 174.5576 25 I 4.5531 7.4690 121.5952 58.8490 37.9247 176.3259 26 K 4.3118 9.2367 131.0793 57.9170 33.4377 178.6471 27 T 3.4374 8.2642 103.2756 61.6091 68.8305 171.6070 28 P 4.2579 0.0000 0.0000 65.6615 31.4811 178.3162 29 V 3.8851 7.6504 115.0473 63.0525 31.9155 177.0756 30 E 4.1571 8.3098 121.5091 58.3602 29.7650 177.1092 31 L 4.3040 7.7642 118.7912 56.3803 42.2310 178.3939 32 K 4.0985 7.7205 117.7943 58.5290 32.1001 177.1006 33 D 5.0083 7.8863 117.0131 53.2355 39.9663 177.3853 34 V 4.2173 7.3988 112.1221 60.4060 34.2843 176.6976 35 G 3.9869 7.9506 110.2931 44.4835 0.0000 174.8425 36 S 4.0735 8.4718 113.0837 61.4898 62.7301 176.4325 37 K 3.7802 7.8775 122.3724 58.8653 31.7222 178.7894 38 E 3.9922 8.1393 117.5865 59.4413 29.5298 179.0663 39 A 4.0210 7.8132 120.3100 55.2360 18.4720 178.9797 40 F 4.0174 9.1660 120.2067 61.6922 39.3361 176.9893 41 L 3.9991 8.6969 118.5369 58.1738 41.6741 179.5752 42 R 4.0895 8.1262 117.5254 59.8024 30.1331 179.0316 43 I 3.8679 7.7557 117.7143 63.6934 37.6761 177.7263 44 W 4.1410 7.8637 128.8338 60.2487 30.5420 177.3203 45 E 4.0440 8.2765 118.1049 60.0637 28.9379 177.8350 46 N 4.5193 7.7332 115.6736 51.7429 38.7582 174.1836 47 D 4.6257 7.5006 119.5139 51.5181 41.2191 177.9581 48 S 3.1162 8.3684 119.7045 60.4078 62.3417 175.0701 49 S 4.2567 7.7433 112.8262 59.6451 63.1547 174.2140 50 V 3.8110 7.1546 121.2532 63.7361 32.6874 173.7129 51 C 4.6934 8.9645 128.0331 60.2487 39.2833 175.6405 *53 S 3.9854 8.7543 114.2263 58.5667 65.3771 176.1418 54 E 3.9516 8.0604 119.5012 59.1301 29.0820 179.2751 55 L 3.7815 7.6732 119.9268 58.3952 42.1009 178.5157 56 Y 4.2676 7.2943 115.7762 60.9662 37.7355 178.1749 57 A 4.0704 8.0090 121.9551 55.3217 18.3414 179.7553 58 L 3.9811 8.2062 117.7668 57.8889 41.8844 179.0391 59 E 4.2450 8.4030 118.2486 57.7911 29.4707 178.9409 60 G 3.6179 8.2647 106.0631 48.2920 0.0000 175.7110 61 A 4.0610 7.8645 122.3997 54.7207 18.3727 179.5196 62 V 3.7644 7.3459 116.1617 65.1410 31.9001 176.4035 63 Q 4.3898 7.7243 116.5484 55.1732 30.1222 175.5830 64 G 4.1912 8.2919 106.3828 45.4248 0.0000 172.4704 65 I 4.6903 7.2738 110.9802 58.2755 41.4043 175.0993 66 R 4.6174 8.3825 118.9565 54.6757 30.7092 178.1069 67 W 4.2817 9.0985 119.5017 59.6595 28.2590 177.7769 68 H 2.7414 7.0385 113.5732 57.6696 27.5163 175.8649 69 G 3.7378 7.3439 106.8623 45.0699 0.0000 173.7474 70 L 4.0787 8.2950 123.3896 54.7980 42.6550 176.7955 71 D 4.5973 8.3615 123.5610 52.7691 41.9523 176.3932 72 E 3.9344 8.9397 120.7861 60.1469 29.2458 179.1895 73 A 3.9218 7.7801 122.0123 54.7374 18.5758 179.6874 74 K 4.0393 8.5950 116.2887 59.6786 32.0747 179.6026 75 K 4.2438 8.4895 118.8404 58.8009 31.7749 179.6014 76 I 3.7343 7.7136 120.0538 64.2814 37.2101 177.3551 77 E 4.1986 8.0547 120.2142 59.7600 29.3101 179.1524 78 L 3.9707 7.9492 118.4747 57.3452 41.6503 179.4140 79 K 3.8354 8.2807 119.7399 59.4554 32.2467 178.6441 80 K 3.8191 8.9928 119.8886 59.8769 31.8453 179.0176 81 F 4.0992 8.0748 119.0284 61.2834 39.4538 176.4511 82 H 3.9508 8.7432 118.6740 59.2249 29.5631 177.3757 83 Q 3.8352 8.3498 118.4284 59.0379 28.3650 178.0636 84 S 4.1180 7.6952 114.4544 60.6646 62.3809 175.4574 85 L 3.6670 7.4986 123.0341 55.4906 41.9263 176.1508 86 E 4.6369 7.5455 122.5942 57.0605 30.0015 176.2677 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 N 8.28 4.71 0.00 3.08 3.12 0.00 0.00 5.77 5.79 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 6 L 7.91 3.96 0.00 1.70 1.75 0.95 0.75 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 7 S 8.84 4.30 0.00 3.91 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 8 E 7.42 4.35 0.00 1.95 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 2.32 0.00 9 L 8.66 3.50 0.00 1.77 1.74 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.44 0.00 2.29 2.19 0.00 3.82 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.01 0.00 11 N 8.95 4.68 0.00 3.21 3.28 0.00 0.00 6.43 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 12 I 7.30 4.18 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.80 1.09 0.00 0.00 13 G 8.43 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 14 K 8.54 4.05 0.00 1.81 1.89 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.86 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.39 7.81 15 V 7.64 3.83 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 0.98 0.00 0.00 0.94 0.00 0.00 16 L 7.95 4.00 0.00 1.83 1.82 0.96 0.96 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 17 E 7.99 4.20 0.00 2.21 2.22 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 2.47 2.51 0.00 18 Q 7.52 3.87 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 19 D 7.99 4.41 0.00 2.69 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 20 L 8.29 3.91 0.00 1.97 1.78 0.95 0.90 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 21 I 7.68 3.69 2.13 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 1.53 0.52 0.91 0.00 0.00 22 K 7.68 3.94 0.00 2.08 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.66 7.81 23 A 8.17 4.28 1.37 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 0.00 0.00 24 G 8.50 3.81 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 0.00 0.00 0.00 25 I 7.47 4.55 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.74 0.93 0.00 0.00 26 K 9.24 4.31 0.00 1.81 1.74 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.67 1.51 7.81 27 T 8.26 3.44 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 28 P 0.00 4.26 0.00 2.20 2.18 0.00 3.60 0.00 0.00 3.90 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 29 V 7.65 3.89 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 0.69 0.00 0.00 0.94 0.00 0.00 30 E 8.31 4.16 0.00 2.01 2.22 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 2.31 2.31 0.00 31 L 7.76 4.30 0.00 1.81 1.64 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 32 K 7.72 4.10 0.00 1.89 1.85 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.54 7.81 33 D 7.89 5.01 0.00 2.77 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 34 V 7.40 4.22 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 0.85 0.00 0.00 0.95 0.00 0.00 35 G 7.95 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 36 S 8.47 4.07 0.00 4.01 4.09 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 37 K 7.88 3.78 0.00 1.57 1.09 0.00 1.01 0.00 0.00 0.61 0.00 0.00 2.64 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.01 1.24 7.81 38 E 8.14 3.99 0.00 2.22 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 2.41 2.35 0.00 39 A 7.81 4.02 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 40 F 9.17 4.02 0.00 3.17 3.36 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 41 L 8.70 4.00 0.00 2.16 1.84 1.33 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.13 4.09 0.00 1.98 2.03 0.00 3.33 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.89 0.00 43 I 7.76 3.87 1.97 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 1.31 1.15 0.99 0.00 0.00 44 W 7.86 4.14 0.00 2.90 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 45 E 8.28 4.04 0.00 2.35 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 2.42 2.55 0.00 46 N 7.73 4.52 0.00 3.04 2.63 0.00 0.00 6.93 7.94 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 47 D 7.50 4.63 0.00 2.81 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 48 S 8.37 3.12 0.00 3.35 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 49 S 7.74 4.26 0.00 4.01 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 50 V 7.15 3.81 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 0.64 0.00 0.00 0.94 0.00 0.00 51 C 8.96 4.69 0.00 3.11 2.61 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 0.00 0.00 0.00 *53 S 8.75 3.99 0.00 3.90 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 54 E 8.06 3.95 0.00 2.42 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 2.38 2.41 0.00 55 L 7.67 3.78 0.00 1.06 1.06 0.48 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 7.29 4.27 0.00 2.15 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 0.00 0.00 0.00 57 A 8.01 4.07 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.21 3.98 0.00 1.92 1.76 1.09 0.74 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 59 E 8.40 4.25 0.00 2.08 1.97 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 2.31 2.38 0.00 60 G 8.26 3.62 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 0.00 61 A 7.86 4.06 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 62 V 7.35 3.76 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 0.86 0.00 0.00 0.98 0.00 0.00 63 Q 7.72 4.39 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.19 0.00 0.00 0.00 0.00 0.00 2.53 2.53 0.00 64 G 8.29 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 0.00 0.00 0.00 65 I 7.27 4.69 1.82 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 1.30 0.77 0.89 0.00 0.00 66 R 8.38 4.62 0.00 1.59 1.66 0.00 3.40 0.00 0.00 3.41 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.54 0.00 67 W 9.10 4.28 0.00 3.49 3.48 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 68 H 7.04 2.74 0.00 2.88 2.61 0.00 5.52 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 69 G 7.34 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 0.00 0.00 0.00 70 L 8.29 4.08 0.00 1.75 1.54 0.93 1.26 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 71 D 8.36 4.60 0.00 2.84 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 72 E 8.94 3.93 0.00 2.21 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 0.00 2.37 2.41 0.00 73 A 7.78 3.92 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 74 K 8.60 4.04 0.00 2.19 1.89 0.00 1.92 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.74 7.81 75 K 8.49 4.24 0.00 1.86 1.87 0.00 1.62 0.00 0.00 1.44 0.00 0.00 3.02 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.26 1.59 7.81 76 I 7.71 3.73 2.08 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 1.56 0.88 0.93 0.00 0.00 77 E 8.05 4.20 0.00 2.16 2.18 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 2.30 2.38 0.00 78 L 7.95 3.97 0.00 1.97 1.61 1.10 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.28 3.84 0.00 2.07 1.96 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.48 7.81 80 K 8.99 3.82 0.00 1.86 1.90 0.00 1.74 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.64 7.81 81 F 8.07 4.10 0.00 2.99 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 82 H 8.74 3.95 0.00 3.02 3.35 0.00 5.84 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.35 3.84 0.00 2.13 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.60 0.00 84 S 7.70 4.12 0.00 3.86 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 85 L 7.50 3.67 0.00 1.06 1.46 0.18 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 86 E 7.55 4.64 0.00 1.99 1.79 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 2.16 2.12 0.00 * Residues marked with a * may have inaccurate shift predictions.