NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.5348 8.1076 122.4650 52.1790 20.6993 174.9404 3 Q 4.8937 8.3294 115.9976 54.1389 32.2399 172.3155 4 K 4.4813 9.8842 121.5571 55.3942 36.3726 175.9937 5 T 5.0269 8.1708 123.0655 62.3816 70.5097 173.6904 6 F 5.0180 9.6617 122.6797 55.6715 44.2016 173.3506 7 K 5.0613 8.5881 120.5031 54.7141 34.8362 174.7917 8 V 4.4158 8.8487 128.5971 62.8504 31.9197 176.0601 9 T 4.4657 8.9739 116.8732 61.3295 71.2496 174.2318 10 A 4.2315 7.9103 126.6854 52.0647 19.1802 177.7471 11 D 4.3564 8.9395 123.4160 57.5555 40.9729 177.8478 12 S 4.3987 8.1242 110.0788 57.5217 63.4150 175.6964 13 G 3.8268 7.5955 111.0901 45.6121 0.0000 174.2656 14 I 4.0580 7.9109 119.5147 60.2647 36.0721 175.3739 15 H 4.8263 7.7476 121.7042 54.0061 31.6534 175.6647 16 A 3.9429 8.8084 119.5406 56.0360 18.1420 179.6064 17 R 3.7915 7.9493 116.7054 59.1551 30.2424 176.6794 18 P 4.3104 0.0000 0.0000 65.9311 31.2320 178.0891 19 A 3.9758 7.9441 120.4393 55.1437 18.1710 179.8049 20 T 3.8162 7.8859 114.4215 66.5579 68.3703 176.9797 21 V 3.5579 7.5775 119.7247 66.1742 31.4538 178.1151 22 L 3.9550 7.8976 118.5306 57.8016 41.3828 179.7704 23 V 4.0202 7.8508 119.5718 65.5427 31.2365 178.0816 24 Q 4.0058 8.0722 117.1149 59.1922 28.8031 178.8191 25 T 4.1028 7.7961 116.6310 66.6560 68.5866 176.6936 26 A 4.1561 8.3448 123.0358 55.3375 18.1635 179.4517 27 S 4.1885 8.1851 110.5168 60.8186 62.4495 175.5461 28 K 4.1538 7.7528 118.8934 56.0101 32.3272 175.7744 29 Y 4.6893 7.0529 116.7184 55.9382 40.9290 175.6697 30 D 4.4443 10.0813 122.9928 57.0562 41.2674 177.4571 31 A 4.3615 8.3747 120.1190 52.2809 19.3438 177.2236 32 D 4.5956 9.1999 120.0047 54.1267 42.4965 175.8649 33 V 4.8482 8.4440 122.2437 61.2255 34.5110 173.8210 34 N 5.5824 9.3679 124.7932 51.3043 42.9522 172.9850 35 L 5.1528 8.8260 123.3961 53.3281 44.9519 174.5930 36 E 5.2721 9.4300 127.6114 54.7388 32.6201 174.0827 37 Y 4.9168 9.2365 127.3158 56.7369 42.6118 174.2883 38 N 3.8692 9.7722 125.7689 54.4316 37.3669 174.7524 39 G 3.9319 9.2568 104.8048 44.7756 0.0000 174.0136 40 K 4.5657 7.9434 120.0882 54.7931 33.9544 175.0342 41 T 5.1673 8.4047 119.5736 61.9784 70.7841 173.9229 42 V 4.6186 8.9108 118.5787 59.1376 36.7141 174.2460 43 N 4.6779 8.5871 121.1891 53.6807 39.6998 174.8764 44 L 4.3260 9.3692 127.6530 55.6576 43.0187 177.5363 45 K 4.5455 8.2195 116.1348 56.8480 32.5576 176.3924 46 S 4.6445 7.6891 114.5134 56.0226 64.8053 174.5718 47 I 3.7197 8.2874 130.2707 64.7179 37.0841 178.0132 48 M 4.1076 8.0710 118.7628 58.3418 31.8881 178.0523 49 G 3.7240 7.8825 105.0629 48.1211 0.0000 175.4864 50 V 3.7448 7.6650 120.9475 65.4249 31.5558 178.2929 51 V 3.6205 8.1010 118.5296 65.7983 31.1563 178.0042 52 S 4.2216 8.0786 113.1925 61.2761 62.6297 176.2261 53 L 4.2400 7.7744 121.7927 55.0210 41.9772 176.8249 54 G 3.9050 8.1334 106.4401 46.3407 0.0000 174.4104 55 I 3.1523 7.4675 119.4774 60.7992 37.9472 175.9316 56 A 4.9967 7.9526 126.9180 49.1019 22.0859 174.6210 57 K 4.0902 8.4113 119.7952 58.6962 32.2634 176.5867 58 G 4.0043 9.4456 114.7719 45.1268 0.0000 173.8044 59 A 4.3062 7.8212 121.5839 52.3107 19.6124 175.9414 60 E 5.1994 8.9260 121.3095 54.5576 31.6340 175.1445 61 I 5.1199 9.2176 119.3668 59.5912 41.8013 174.0000 62 T 5.1487 9.0213 120.0819 61.9571 71.7424 173.0747 63 I 5.1495 9.1292 126.5740 59.5484 40.1933 174.8786 64 S 5.3363 9.3440 120.7264 56.4643 66.5778 172.6937 65 A 5.2482 8.8013 121.7978 50.4520 22.2509 176.0464 66 S 4.5912 10.2825 117.0989 56.8259 66.9556 174.4475 67 G 3.6060 8.5791 113.2363 45.8680 0.0000 172.0872 68 A 4.0752 8.4387 122.0770 54.3045 18.8155 178.2109 69 D 5.1057 7.8829 115.4794 52.7765 40.2946 178.1599 70 E 3.9886 8.0280 121.9125 60.6723 29.3538 177.8008 71 N 4.4089 8.0464 116.7529 55.6283 38.7362 176.6827 72 D 4.3334 8.0192 118.8780 56.6771 41.4833 177.7235 73 A 2.5800 8.2481 121.7598 54.8551 18.1671 179.6710 74 L 3.9198 7.7761 117.1607 57.8137 41.6062 179.5550 75 N 4.2908 7.9402 115.9362 56.2124 38.4745 176.9999 76 A 4.0013 7.9876 122.2986 55.5383 18.4348 179.7772 77 L 3.8437 7.9112 117.1625 57.6046 41.6361 179.3039 78 E 3.8327 8.5304 121.9270 60.0345 29.4393 179.3602 79 E 4.0111 8.2841 117.1449 61.3585 29.8064 180.5769 80 T 4.1912 7.8006 115.9747 66.8402 69.0045 175.9084 81 M 4.0986 7.9453 119.7209 58.3966 32.2175 178.3789 82 K 4.4498 7.8517 117.5307 56.7920 32.4729 178.1504 *84 E 4.1196 8.2172 119.3227 54.9151 31.1017 176.1988 85 G 3.9178 8.0591 105.2711 46.6643 0.0000 174.5060 86 L 4.0459 8.0113 123.8063 57.5445 42.9328 176.8166 87 G 4.4156 7.7124 101.8096 45.5104 0.0000 173.3238 88 E 4.6742 9.1886 119.2240 56.8140 30.5835 175.6222 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 2 A 8.11 4.53 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 3 Q 8.33 4.89 0.00 2.18 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.61 0.00 0.00 0.00 0.00 0.00 2.20 2.40 0.00 4 K 9.88 4.48 0.00 1.69 1.32 0.00 0.70 0.00 0.00 0.88 0.00 0.00 2.56 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.12 1.38 7.81 5 T 8.17 5.03 4.14 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 1.23 0.00 0.00 6 F 9.66 5.02 0.00 2.90 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 7 K 8.59 5.06 0.00 1.85 1.68 0.00 1.74 0.00 0.00 1.77 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.43 7.81 8 V 8.85 4.42 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 0.85 0.00 0.00 0.88 0.00 0.00 9 T 8.97 4.47 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 1.23 0.00 0.00 10 A 7.91 4.23 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 11 D 8.94 4.36 0.00 2.68 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 12 S 8.12 4.40 0.00 3.91 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 13 G 7.60 3.83 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 0.00 0.00 0.00 14 I 7.91 4.06 1.78 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.53 0.83 0.00 0.00 15 H 7.75 4.83 0.00 3.38 3.42 0.00 5.67 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 A 8.81 3.94 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 17 R 7.95 3.79 0.00 1.89 1.86 0.00 3.20 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 18 P 0.00 4.31 0.00 2.19 2.19 0.00 3.40 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.79 0.00 19 A 7.94 3.98 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 20 T 7.89 3.82 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 1.20 0.00 0.00 21 V 7.58 3.56 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 1.00 0.00 0.00 1.03 0.00 0.00 22 L 7.90 3.96 0.00 1.84 1.65 0.83 0.52 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 23 V 7.85 4.02 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 1.38 0.00 0.00 0.97 0.00 0.00 24 Q 8.07 4.01 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 25 T 7.80 4.10 4.41 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 1.32 0.00 0.00 26 A 8.34 4.16 1.42 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 0.00 0.00 27 S 8.19 4.19 0.00 3.99 4.16 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 0.00 0.00 0.00 0.00 28 K 7.75 4.15 0.00 1.47 1.39 0.00 1.61 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.62 7.81 29 Y 7.05 4.69 0.00 3.13 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 30 D 10.08 4.44 0.00 2.77 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 31 A 8.37 4.36 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 32 D 9.20 4.60 0.00 2.59 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 33 V 8.44 4.85 2.11 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 1.06 0.00 0.00 1.02 0.00 0.00 34 N 9.37 5.58 0.00 2.67 2.73 0.00 0.00 5.98 6.56 0.00 0.00 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 L 8.83 5.15 0.00 1.69 1.51 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 36 E 9.43 5.27 0.00 2.02 1.80 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 2.40 2.37 0.00 37 Y 9.24 4.92 0.00 3.04 2.78 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 0.00 0.00 0.00 0.00 38 N 9.77 3.87 0.00 1.44 2.29 0.00 0.00 7.36 7.98 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 39 G 9.26 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 0.00 0.00 0.00 40 K 7.94 4.57 0.00 2.05 1.75 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.36 1.25 7.81 41 T 8.40 5.17 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 42 V 8.91 4.62 2.11 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 0.77 0.00 0.00 1.00 0.00 0.00 43 N 8.59 4.68 0.00 2.86 2.70 0.00 0.00 6.54 6.66 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 44 L 9.37 4.33 0.00 1.83 1.69 0.91 0.25 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 45 K 8.22 4.55 0.00 1.99 1.82 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.14 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.39 7.81 46 S 7.69 4.64 0.00 3.82 3.85 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 47 I 8.29 3.72 1.87 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 1.52 0.42 0.90 0.00 0.00 48 M 8.07 4.11 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.67 0.00 49 G 7.88 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 0.00 0.00 0.00 50 V 7.66 3.74 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 0.95 0.00 0.00 0.92 0.00 0.00 51 V 8.10 3.62 2.08 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 1.00 0.00 0.00 0.97 0.00 0.00 52 S 8.08 4.22 0.00 4.08 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 53 L 7.77 4.24 0.00 1.73 1.86 1.01 1.46 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 54 G 8.13 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 55 I 7.47 3.15 1.65 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.31 0.30 0.57 0.00 0.00 56 A 7.95 5.00 1.21 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 0.00 0.00 0.00 57 K 8.41 4.09 0.00 1.97 1.75 0.00 1.93 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.47 7.81 58 G 9.45 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 59 A 7.82 4.31 1.25 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 60 E 8.93 5.20 0.00 2.04 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 2.27 2.46 0.00 61 I 9.22 5.12 2.06 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 1.33 0.96 0.95 0.00 0.00 62 T 9.02 5.15 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 1.27 0.00 0.00 63 I 9.13 5.15 2.11 0.00 0.00 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 1.31 0.91 0.95 0.00 0.00 64 S 9.34 5.34 0.00 3.90 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 65 A 8.80 5.25 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 66 S 10.28 4.59 0.00 3.69 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 67 G 8.58 3.61 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 0.00 0.00 0.00 68 A 8.44 4.08 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 69 D 7.88 5.11 0.00 3.04 2.95 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 70 E 8.03 3.99 0.00 2.22 2.42 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 2.38 2.34 0.00 71 N 8.05 4.41 0.00 2.83 2.89 0.00 0.00 6.80 8.08 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 72 D 8.02 4.33 0.00 2.83 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 73 A 8.25 2.58 0.97 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 0.00 0.00 0.00 0.00 0.00 74 L 7.78 3.92 0.00 1.93 1.73 0.88 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 75 N 7.94 4.29 0.00 2.86 2.86 0.00 0.00 6.88 9.27 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 76 A 7.99 4.00 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 77 L 7.91 3.84 0.00 1.64 1.60 0.85 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.53 3.83 0.00 2.36 2.23 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 2.42 2.65 0.00 79 E 8.28 4.01 0.00 2.08 1.86 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 2.26 2.23 0.00 80 T 7.80 4.19 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 1.17 0.00 0.00 81 M 7.95 4.10 0.00 1.96 1.84 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 82 K 7.85 4.45 0.00 1.87 1.81 0.00 1.80 0.00 0.00 1.63 0.00 0.00 3.18 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.70 1.76 7.81 *84 E 8.22 4.12 0.00 1.92 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 2.15 2.29 0.00 85 G 8.06 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 86 L 8.01 4.05 0.00 1.83 1.57 0.87 0.68 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 87 G 7.71 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 0.00 0.00 0.00 0.00 88 E 9.19 4.67 0.00 1.89 1.88 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 2.29 2.31 0.00 * Residues marked with a * may have inaccurate shift predictions.