NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 D 4.8115 8.2076 120.4829 54.0270 41.4045 173.5470 6 K 4.8124 8.0748 119.7113 52.9185 35.7800 174.7099 7 I 4.7140 9.7197 115.6766 59.6238 41.1481 175.8192 8 T 4.5825 8.4222 120.6301 62.6995 71.0542 173.6566 9 V 4.5677 8.4583 121.9286 61.8554 35.6667 173.2383 *10 H 5.9449 10.1038 121.7330 53.1901 31.5872 172.7458 11 F 4.9420 8.7085 121.7075 55.7995 41.1776 175.1831 12 I 4.4294 9.1212 125.5259 60.4721 37.9065 175.5730 13 N 5.0707 8.6255 124.4291 53.4624 39.8153 175.0971 14 R 4.4632 8.6336 110.3913 57.4622 32.2733 175.9824 15 D 4.4224 7.7116 117.1363 55.0387 41.2823 176.7702 16 G 3.7256 7.7056 110.9885 45.1044 0.0000 173.6501 17 E 3.7249 8.0534 110.1357 59.8466 27.5826 175.1595 18 T 5.2459 8.0938 135.0000 64.3089 71.8038 175.0174 19 L 4.3920 9.0774 122.4796 57.0104 41.5437 176.3067 20 T 4.3789 7.9149 117.9353 65.3461 72.4414 171.5677 21 T 4.4190 7.8152 113.5781 61.5534 71.5220 171.9491 22 K 4.6660 8.9948 128.4245 56.0617 33.3213 176.2226 23 G 4.3544 10.0628 111.8223 44.2554 0.0000 171.2943 24 K 4.9081 8.2479 117.5614 53.9117 35.7430 175.3743 25 I 3.6971 8.0708 125.5571 65.3980 38.0390 175.0460 26 G 4.1502 9.4113 118.0253 45.1683 0.0000 171.9511 27 D 4.4624 8.3662 120.7631 53.5717 39.7228 176.2413 28 S 4.9782 8.0721 115.1382 56.9364 65.2051 174.0974 29 L 4.2528 8.3136 120.6662 56.3628 41.2800 175.8445 30 L 3.6901 8.1038 116.5124 56.4541 39.4633 173.4014 31 D 5.1578 7.6440 119.1128 53.5971 45.0266 175.9011 32 V 3.2905 8.5543 121.7900 63.8726 30.1305 174.6788 33 V 2.9120 8.1322 115.8515 65.4168 32.5313 178.9748 34 V 3.4546 7.9479 122.0023 65.1382 31.7351 177.4105 35 Q 3.9997 7.9307 118.8451 58.5579 28.8017 176.9418 36 N 4.6612 7.7726 113.1371 52.6207 40.6099 174.2522 37 N 4.3513 8.6643 115.8406 53.7753 37.8822 173.4318 38 L 3.7638 7.6694 116.7005 54.1806 42.7165 176.3015 39 D 4.2740 8.9637 122.5760 57.9375 41.6999 177.6698 40 I 3.2674 7.6923 114.8087 61.6799 35.6783 172.2314 41 D 4.7418 8.0556 121.8369 55.1461 40.1271 174.2312 42 G 3.2004 10.1654 120.6102 44.1203 0.0000 170.8973 43 F 3.4911 8.8358 111.3993 57.9491 36.2937 174.4993 44 G 3.8345 8.4723 109.2144 46.7365 0.0000 171.7531 45 A 3.8854 8.1474 125.7311 53.6560 19.5603 175.9100 46 C 3.6376 7.4253 110.0423 54.5437 34.3464 174.1219 47 E 3.9437 8.5338 113.3593 57.3882 29.1319 178.4776 48 G 3.6769 7.3039 107.9915 45.6567 0.0000 175.0383 49 T 3.2722 8.7103 115.7845 63.0758 66.0364 167.9558 50 L 3.8054 7.5016 128.4879 53.8139 42.2086 174.1145 51 A 5.0114 7.8023 135.0000 52.6525 19.5328 175.0219 52 C 4.9875 7.7720 109.7774 56.5632 32.2526 173.6293 53 S 4.5626 8.4320 112.2590 58.3547 64.2325 174.6862 54 T 4.4043 7.6720 112.0290 61.2141 66.9897 171.8986 55 C 4.6600 7.0447 121.1910 61.8590 34.8281 174.5001 *56 H 3.9706 7.9930 117.1049 57.9822 28.7234 177.0083 57 L 3.6807 7.4860 118.5074 53.0561 40.5944 173.1523 58 I 3.8534 8.2136 118.8922 61.7913 38.1175 175.5199 59 F 5.0401 8.3745 124.0020 56.5893 42.5490 174.0558 60 E 3.9967 8.2022 123.2794 55.4238 28.4056 177.9538 61 Q 4.3172 9.2596 124.4261 58.7132 28.4305 178.4256 *62 H 4.4206 8.2095 115.5177 57.3477 30.0985 174.7320 63 I 4.3466 9.2928 117.5785 63.8362 39.2319 176.9375 64 F 4.6622 8.4033 121.9986 61.2204 39.4936 176.7854 65 E 3.7332 8.0128 117.6926 59.1396 29.3216 177.4863 66 K 4.2672 7.5618 119.1350 55.5844 31.8729 178.2360 67 L 4.3121 7.3528 120.1070 54.8642 42.0615 176.4898 68 E 4.1691 8.2590 127.5285 52.9582 28.4431 176.5450 69 A 4.1591 6.9245 115.6659 52.9057 21.8365 176.1043 70 I 3.9719 8.2640 118.1943 60.1527 40.9877 173.7127 71 T 4.6076 7.9753 122.9415 61.2034 73.7853 173.7663 72 D 4.4907 8.7786 120.2137 57.8761 40.6419 178.3856 73 E 3.9424 7.9781 118.4567 59.1516 29.9570 177.8092 74 E 4.0603 8.0322 117.2555 60.1720 29.9365 177.5991 75 N 3.8668 8.4249 113.6792 54.4553 38.6471 174.7971 76 D 4.8982 8.3514 125.5685 54.4866 42.0789 175.2308 77 M 4.5004 7.6472 116.2796 56.4284 34.8542 177.6501 78 L 3.5998 8.2304 113.2493 56.4338 40.6353 177.2577 79 D 4.7083 10.1455 126.2477 54.6978 41.5369 175.2874 80 L 4.3643 7.3702 119.8037 52.4524 42.0255 174.9685 81 A 3.9849 7.7700 123.3388 52.1662 17.7725 175.3838 82 Y 4.0155 8.1651 119.0162 62.0766 36.8713 175.6350 83 G 3.8133 9.0464 116.4265 45.4341 0.0000 173.1702 84 L 4.0507 9.0329 120.4793 56.5393 40.8697 175.0725 85 T 4.5555 8.2683 114.6373 64.0808 70.3571 174.4905 86 D 4.9371 8.4956 120.1524 55.0028 44.0421 176.8826 87 R 4.8830 8.3622 115.7803 56.9641 32.5302 175.5025 88 S 4.5145 8.1435 113.3750 57.5577 64.0635 173.1505 89 R 3.8855 7.2777 117.9405 55.1356 32.0743 173.8046 90 L 3.8329 8.6309 129.6675 55.0675 41.9629 174.8474 91 G 3.7515 7.5842 111.7658 42.3091 0.0000 172.1332 92 C 4.1789 8.2554 114.5247 59.4281 26.5511 174.1518 93 Q 4.6091 7.3901 112.6153 55.8419 29.1298 173.5739 94 I 4.7383 7.7096 117.7713 60.5747 40.7431 175.0517 95 C 5.3928 8.5700 122.4770 58.2043 29.4921 173.2077 96 L 4.2553 8.7500 122.2397 56.3019 41.9669 175.9160 97 T 4.6375 8.0180 114.6345 62.6719 73.1011 175.1640 98 K 3.7592 8.7903 122.5931 58.9473 32.6777 178.8050 99 A 4.0019 7.9937 121.1578 55.4584 18.3732 178.1551 100 M 3.9762 7.3731 112.2303 56.1746 31.9616 176.3200 101 D 4.3139 7.3111 118.6312 55.9139 40.0765 175.3356 102 N 4.3956 9.8419 128.1445 53.8528 35.3289 174.6194 103 M 5.2626 7.5331 114.0178 53.6678 34.3319 175.7059 104 T 4.7887 8.2268 117.7712 62.2849 69.8786 174.4081 105 V 4.9286 9.1123 121.6062 59.4448 33.7947 175.5407 106 R 4.9155 8.2508 124.2447 54.2474 33.0630 174.7766 107 V 4.0562 8.4571 126.1643 60.8963 32.2415 175.1361 108 P 4.0227 0.0000 0.0000 63.3016 31.6075 172.6611 109 D 4.3232 7.6408 124.5194 53.9795 38.1373 173.7872 110 A 4.2076 8.1430 125.2831 52.1227 19.3432 175.6704 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 D 8.21 4.81 0.00 2.70 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 6 K 8.07 4.81 0.00 1.99 1.76 0.00 1.52 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.51 7.81 7 I 9.72 4.71 1.87 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 1.25 0.95 0.96 0.00 0.00 8 T 8.42 4.58 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 1.23 0.00 0.00 9 V 8.46 4.57 2.32 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 1.08 0.00 0.00 0.94 0.00 0.00 *10 H 10.10 5.94 0.00 2.90 2.95 0.00 5.84 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 8.71 4.94 0.00 3.03 2.97 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 12 I 9.12 4.43 1.96 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 1.13 0.61 0.93 0.00 0.00 13 N 8.63 5.07 0.00 2.66 2.60 0.00 0.00 6.85 7.68 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 14 R 8.63 4.46 0.00 1.81 1.92 0.00 3.28 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 15 D 7.71 4.42 0.00 2.66 2.62 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 16 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 17 E 8.05 3.72 0.00 2.18 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 2.37 2.33 0.00 18 T 8.09 5.25 4.40 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 1.23 0.00 0.00 19 L 9.08 4.39 0.00 1.98 1.69 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.91 4.38 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 1.30 0.00 0.00 21 T 7.82 4.42 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 1.29 0.00 0.00 22 K 8.99 4.67 0.00 1.69 1.74 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.77 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.46 7.81 23 G 10.06 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 0.00 0.00 0.00 0.00 24 K 8.25 4.91 0.00 1.69 1.68 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.40 7.81 25 I 8.07 3.70 1.88 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 1.17 0.76 0.93 0.00 0.00 26 G 9.41 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 27 D 8.37 4.46 0.00 2.89 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 28 S 8.07 4.98 0.00 3.96 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 29 L 8.31 4.25 0.00 1.85 1.68 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.10 3.69 0.00 1.75 1.75 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 31 D 7.64 5.16 0.00 2.84 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 32 V 8.55 3.29 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 1.17 0.00 0.00 1.10 0.00 0.00 33 V 8.13 2.91 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 0.90 0.00 0.00 0.84 0.00 0.00 34 V 7.95 3.45 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 0.73 0.00 0.00 0.98 0.00 0.00 35 Q 7.93 4.00 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 36 N 7.77 4.66 0.00 2.67 2.76 0.00 0.00 7.27 7.05 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 37 N 8.66 4.35 0.00 2.76 2.94 0.00 0.00 7.00 5.12 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 38 L 7.67 3.76 0.00 1.18 1.08 0.82 1.13 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 39 D 8.96 4.27 0.00 2.68 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 40 I 7.69 3.27 1.88 0.00 0.00 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 1.43 1.35 1.09 0.00 0.00 41 D 8.06 4.74 0.00 2.89 2.66 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 42 G 10.17 3.20 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 0.00 0.00 0.00 0.00 43 F 8.84 3.49 0.00 3.19 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 44 G 8.47 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 45 A 8.15 3.89 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 46 C 7.43 3.64 0.00 3.12 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 47 E 8.53 3.94 0.00 2.00 2.05 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 2.36 2.38 0.00 48 G 7.30 3.68 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 0.00 49 T 8.71 3.27 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 1.21 0.00 0.00 50 L 7.50 3.81 0.00 1.92 1.74 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 51 A 7.80 5.01 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 52 C 7.77 4.99 0.00 3.01 2.91 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 53 S 8.43 4.56 0.00 3.90 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 T 7.67 4.40 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 1.17 0.00 0.00 55 C 7.04 4.66 0.00 2.85 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 *56 H 7.99 3.97 0.00 2.61 2.48 0.00 6.05 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.49 3.68 0.00 1.88 1.84 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.21 3.85 2.07 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 1.26 1.50 0.93 0.00 0.00 59 F 8.37 5.04 0.00 2.79 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 60 E 8.20 4.00 0.00 1.82 1.83 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 2.36 2.33 0.00 61 Q 9.26 4.32 0.00 2.34 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.00 0.00 0.00 0.00 0.00 0.00 2.45 2.38 0.00 *62 H 8.21 4.42 0.00 2.90 3.12 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 9.29 4.35 2.00 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 1.26 0.93 0.99 0.00 0.00 64 F 8.40 4.66 0.00 3.21 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 65 E 8.01 3.73 0.00 2.04 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.34 0.00 66 K 7.56 4.27 0.00 1.95 1.86 0.00 1.84 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.52 7.81 67 L 7.35 4.31 0.00 1.69 1.76 1.09 -0.05 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 68 E 8.26 4.17 0.00 2.05 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 0.00 2.20 2.27 0.00 69 A 6.92 4.16 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 70 I 8.26 3.97 1.87 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.69 0.86 0.00 0.00 71 T 7.98 4.61 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 1.21 0.00 0.00 72 D 8.78 4.49 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 73 E 7.98 3.94 0.00 2.00 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 2.29 2.36 0.00 74 E 8.03 4.06 0.00 2.00 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 2.33 2.50 0.00 75 N 8.42 3.87 0.00 2.69 2.90 0.00 0.00 7.23 8.03 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 76 D 8.35 4.90 0.00 2.98 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 77 M 7.65 4.50 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.66 0.00 78 L 8.23 3.60 0.00 1.75 1.48 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 79 D 10.15 4.71 0.00 2.83 2.80 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 0.00 0.00 0.00 80 L 7.37 4.36 0.00 1.58 1.56 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.77 3.98 1.24 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 0.00 0.00 82 Y 8.17 4.02 0.00 2.92 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 83 G 9.05 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 84 L 9.03 4.05 0.00 1.76 1.91 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.27 4.56 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 1.23 0.00 0.00 86 D 8.50 4.94 0.00 2.70 2.59 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 87 R 8.36 4.88 0.00 2.00 2.27 0.00 3.17 0.00 0.00 3.26 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.50 0.00 88 S 8.14 4.51 0.00 3.87 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 89 R 7.28 3.89 0.00 0.67 0.99 0.00 3.10 0.00 0.00 2.98 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.43 0.00 90 L 8.63 3.83 0.00 1.50 1.46 0.83 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 91 G 7.58 3.75 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 0.00 0.00 0.00 92 C 8.26 4.18 0.00 3.08 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 93 Q 7.39 4.61 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.07 6.61 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 94 I 7.71 4.74 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 1.36 0.67 0.96 0.00 0.00 95 C 8.57 5.39 0.00 2.88 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 96 L 8.75 4.26 0.00 1.84 1.69 0.98 0.85 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 97 T 8.02 4.64 4.28 0.00 0.00 0.00 0.00 0.00 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 98 K 8.79 3.76 0.00 1.76 1.80 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.38 7.81 99 A 7.99 4.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.37 3.98 0.00 1.64 2.07 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.33 0.00 101 D 7.31 4.31 0.00 2.67 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 0.00 102 N 9.84 4.40 0.00 2.71 3.04 0.00 0.00 6.89 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 0.00 103 M 7.53 5.26 0.00 1.82 1.79 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 104 T 8.23 4.79 4.27 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 1.18 0.00 0.00 105 V 9.11 4.93 1.82 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 0.35 0.00 0.00 -0.45 0.00 0.00 106 R 8.25 4.92 0.00 1.82 1.71 0.00 3.18 0.00 0.00 3.40 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 107 V 8.46 4.06 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 0.82 0.00 0.00 0.94 0.00 0.00 108 P 0.00 4.02 0.00 2.43 2.23 0.00 3.86 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 109 D 7.64 4.32 0.00 2.72 2.84 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 0.00 110 A 8.14 4.21 1.14 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 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.