NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 N 4.6736 8.4249 119.2068 53.5095 39.5629 173.3615 26 Q 4.6295 8.2923 125.1937 54.5927 31.0395 170.1239 27 V 4.9385 9.5190 115.4537 59.6506 37.2481 174.4276 28 R 5.0862 8.8875 123.3051 53.0312 31.9874 173.2707 29 P 4.9704 0.0000 0.0000 62.2574 32.0951 176.9222 30 K 4.0240 9.3232 124.1140 56.6530 32.8815 178.1734 31 L 3.9332 8.7175 122.6603 57.6608 41.3719 178.2146 32 P 4.2153 0.0000 0.0000 65.1234 31.1687 178.4160 33 L 3.8040 7.7175 118.8931 57.8579 42.2406 178.1722 34 L 3.7566 7.9472 120.4184 58.0603 41.8623 178.7854 35 K 3.8047 8.2566 119.6885 59.7124 31.8943 178.7845 36 I 3.3337 6.8493 118.0774 64.0685 37.1967 178.1541 37 L 3.9871 7.7641 119.8328 58.2290 41.4884 179.3640 38 H 4.4594 8.8722 117.4280 58.2463 28.3747 177.6729 39 A 4.1781 8.0430 121.3205 54.1334 18.3034 178.3949 40 A 4.5933 7.7383 117.4864 51.8265 19.4824 177.7709 41 G 4.0185 7.9909 105.1242 44.8161 0.0000 174.5591 42 A 3.5279 7.5314 122.7916 52.0013 18.8942 176.4670 43 Q 4.6472 8.5781 118.9049 55.1236 31.7592 177.1922 44 G 3.7789 8.7862 108.6849 44.7811 0.0000 172.3044 45 E 4.8230 8.3002 114.5188 55.9202 31.9796 175.6286 46 M 5.0420 7.2458 118.4932 53.6004 35.4293 174.6648 47 F 5.1752 8.9278 119.8638 56.6306 44.6173 173.9535 48 T 4.7623 9.1336 110.7173 60.8330 70.1507 176.1330 49 V 3.6382 8.4724 121.7626 66.3407 31.4261 178.3852 50 K 4.0491 8.0803 117.6181 59.5378 31.8443 178.9933 51 E 3.9329 8.3306 118.8965 59.2245 29.3156 179.4438 52 V 3.5179 7.8603 118.3163 66.4327 31.5524 178.0773 53 M 4.0805 8.0980 118.3202 58.7308 31.7979 178.5205 54 H 4.0800 8.4430 116.4193 59.0598 28.7672 177.5316 55 Y 4.2438 8.1440 118.8052 60.7649 37.6350 178.1805 56 L 4.1498 8.3378 121.8987 57.9860 42.3049 179.1217 57 G 3.7037 8.5081 106.1385 48.0271 0.0000 175.5266 58 Q 4.0470 8.2220 120.7041 58.7254 28.6808 178.1450 59 Y 4.1037 8.4914 120.8327 61.1083 38.8080 178.3892 60 I 3.7140 8.0351 120.4406 64.5306 37.1747 178.2225 61 M 4.1907 8.0320 118.6545 59.0144 31.9958 178.8683 62 V 3.7264 8.0282 111.4235 63.8820 31.8006 177.9260 63 K 4.0250 7.9678 115.9579 55.6480 32.8449 176.4356 64 Q 3.2232 7.6885 117.7547 56.8852 26.8331 174.4525 65 L 4.1951 8.0342 116.9651 56.0108 42.5931 177.5729 66 Y 4.7460 7.4666 116.5017 56.0817 39.2938 174.2530 67 D 4.5711 8.6770 121.0327 53.2323 41.7832 177.1209 68 Q 4.2452 8.8326 126.3215 59.1902 28.7996 177.8024 69 Q 4.3970 8.3762 113.9079 56.5186 29.5737 176.3963 70 E 4.7724 8.0450 119.1354 55.1139 30.5306 175.1453 71 Q 4.3759 8.1814 120.6997 57.8648 29.5656 177.0487 72 H 4.4944 8.1240 113.0518 57.2053 30.2933 174.6951 73 M 4.4246 7.9428 120.7860 54.0842 33.6479 175.1571 74 V 4.4215 8.0000 124.1101 61.2167 34.1270 173.9243 75 Y 4.8705 9.2031 127.0916 56.7269 38.2516 175.0400 76 C 4.7020 8.5599 118.1833 57.3596 31.4697 174.0466 77 G 3.9284 8.1676 109.5893 47.6568 0.0000 174.0122 78 G 3.9121 9.0068 110.8046 46.1588 0.0000 172.9883 79 D 5.0776 7.7998 118.1154 51.4019 45.1815 176.4575 80 L 4.1001 8.5916 124.5122 58.2196 41.6330 179.6952 81 L 4.0322 8.8913 120.3495 58.1634 42.0415 179.2141 82 G 3.6880 8.1723 105.0928 48.0363 0.0000 175.3731 83 E 4.0248 8.1367 120.0437 58.9152 29.5017 178.9180 84 L 4.0809 7.9831 120.1300 57.8814 42.2710 178.4689 85 L 4.1707 8.1687 117.5098 54.3612 42.6158 176.6909 86 G 3.9008 8.0911 107.0085 45.4471 0.0000 172.5399 87 R 4.5434 7.3625 111.6218 55.4512 32.4317 174.7655 88 Q 4.5206 8.4810 116.8335 57.9900 30.1558 175.8428 89 S 5.0371 7.8588 110.6430 57.7847 65.5946 173.9935 90 F 4.8037 8.1913 114.4933 56.2414 41.5291 172.4443 91 S 5.0565 8.5294 114.5684 56.8559 63.9577 174.6935 92 V 4.2212 8.6424 119.2146 62.5415 31.0218 177.2624 93 K 4.0951 8.2505 120.7026 57.3462 32.3322 176.4479 94 D 4.7081 7.8581 118.4915 51.6912 40.9547 174.0541 95 P 4.2873 0.0000 0.0000 62.6188 31.2702 177.7511 96 S 3.9158 7.7073 115.7692 61.0237 62.8133 174.7812 97 P 4.1209 0.0000 0.0000 65.1617 30.9964 178.5946 98 L 3.8388 7.3029 117.3998 57.6903 41.5167 178.7505 99 Y 4.4062 7.8253 116.9585 61.3282 37.9708 178.5066 100 D 4.3654 7.8641 119.6727 57.6869 41.0694 178.6154 101 M 3.9966 7.7874 117.9949 58.5355 32.2082 178.1050 102 L 3.9607 8.2677 119.4914 57.8837 41.6378 179.2992 103 R 3.8726 7.9101 117.1864 59.6200 30.0931 178.2585 104 K 4.2246 7.8419 115.3261 57.8954 32.4785 177.1098 105 N 4.9829 7.9706 114.4200 52.5857 40.8764 173.7878 106 L 4.8732 7.9550 119.7279 52.8009 44.0587 175.9864 107 V 4.3690 8.3803 124.7746 61.0328 33.1824 175.0333 108 T 4.4455 8.5070 119.1823 61.7912 69.4929 173.8365 109 L 4.2020 8.3823 125.9046 53.9680 42.5274 176.9912 *110 A 4.0850 8.5287 125.8427 52.4454 18.8652 175.9589 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 25 N 8.42 4.67 0.00 2.71 2.85 0.00 0.00 6.98 6.19 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 26 Q 8.29 4.63 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.66 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 27 V 9.52 4.94 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 0.74 0.00 0.00 1.12 0.00 0.00 28 R 8.89 5.09 0.00 1.81 1.79 0.00 3.15 0.00 0.00 3.27 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 29 P 0.00 4.97 0.00 2.00 1.97 0.00 4.08 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 30 K 9.32 4.02 0.00 1.83 1.73 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.58 7.81 31 L 8.72 3.93 0.00 1.67 1.71 0.92 1.04 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 32 P 0.00 4.22 0.00 2.12 2.07 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 33 L 7.72 3.80 0.00 1.70 1.78 0.82 0.51 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 34 L 7.95 3.76 0.00 1.75 1.70 1.09 0.43 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 35 K 8.26 3.80 0.00 1.89 1.91 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.49 7.81 36 I 6.85 3.33 1.70 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.51 -0.21 0.00 0.00 37 L 7.76 3.99 0.00 1.52 1.22 0.44 0.88 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 38 H 8.87 4.46 0.00 3.09 3.31 0.00 5.65 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 39 A 8.04 4.18 1.56 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 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.74 4.59 1.63 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 0.00 0.00 41 G 7.99 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 0.00 0.00 0.00 42 A 7.53 3.53 0.34 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 43 Q 8.58 4.65 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.53 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 44 G 8.79 3.78 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 0.00 0.00 0.00 45 E 8.30 4.82 0.00 1.85 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 2.33 2.29 0.00 46 M 7.25 5.04 0.00 1.72 1.72 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 47 F 8.93 5.18 0.00 3.08 2.99 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 48 T 9.13 4.76 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 1.28 0.00 0.00 49 V 8.47 3.64 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 1.10 0.00 0.00 0.96 0.00 0.00 50 K 8.08 4.05 0.00 1.85 1.82 0.00 1.73 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.57 1.56 7.81 51 E 8.33 3.93 0.00 2.43 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 2.41 2.39 0.00 52 V 7.86 3.52 2.28 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 1.08 0.00 0.00 0.98 0.00 0.00 53 M 8.10 4.08 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.90 0.00 54 H 8.44 4.08 0.00 3.04 3.18 0.00 5.81 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Y 8.14 4.24 0.00 3.02 2.87 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 56 L 8.34 4.15 0.00 1.88 1.88 0.93 1.18 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 57 G 8.51 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 58 Q 8.22 4.05 0.00 2.39 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 59 Y 8.49 4.10 0.00 3.18 3.25 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 60 I 8.04 3.71 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.82 1.01 0.00 0.00 61 M 8.03 4.19 0.00 2.26 2.01 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 62 V 8.03 3.73 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 0.87 0.00 0.00 0.95 0.00 0.00 63 K 7.97 4.02 0.00 1.36 1.58 0.00 1.68 0.00 0.00 1.52 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.76 0.21 7.81 64 Q 7.69 3.22 0.00 2.03 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.93 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 65 L 8.03 4.20 0.00 1.75 1.87 1.09 0.70 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 66 Y 7.47 4.75 0.00 3.17 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 67 D 8.68 4.57 0.00 2.91 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 68 Q 8.83 4.25 0.00 2.09 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.71 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 69 Q 8.38 4.40 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.10 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 70 E 8.04 4.77 0.00 1.99 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 2.06 2.33 0.00 71 Q 8.18 4.38 0.00 2.05 2.00 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 2.47 2.48 0.00 72 H 8.12 4.49 0.00 3.23 3.54 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 M 7.94 4.42 0.00 1.72 2.10 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.17 0.00 74 V 8.00 4.42 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 0.00 0.00 0.84 0.00 0.00 0.57 0.00 0.00 75 Y 9.20 4.87 0.00 2.78 2.92 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 76 C 8.56 4.70 0.00 3.22 3.30 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 77 G 8.17 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 78 G 9.01 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 79 D 7.80 5.08 0.00 2.85 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 80 L 8.59 4.10 0.00 1.77 1.73 0.97 0.49 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 81 L 8.89 4.03 0.00 1.96 1.97 0.92 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.17 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.14 4.02 0.00 2.11 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 2.37 2.51 0.00 84 L 7.98 4.08 0.00 1.63 1.83 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.17 4.17 0.00 1.62 1.59 0.58 0.61 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 86 G 8.09 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 0.00 0.00 0.00 87 R 7.36 4.54 0.00 1.92 1.89 0.00 3.01 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 88 Q 8.48 4.52 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.76 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 89 S 7.86 5.04 0.00 3.13 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 F 8.19 4.80 0.00 3.09 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 91 S 8.53 5.06 0.00 3.97 3.80 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 92 V 8.64 4.22 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 0.77 0.00 0.00 0.96 0.00 0.00 93 K 8.25 4.10 0.00 1.74 1.83 0.00 1.38 0.00 0.00 1.51 0.00 0.00 2.79 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.39 1.31 7.81 94 D 7.86 4.71 0.00 2.58 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 P 0.00 4.29 0.00 1.28 1.72 0.00 3.51 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 96 S 7.71 3.92 0.00 3.98 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 97 P 0.00 4.12 0.00 1.66 1.89 0.00 3.35 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.07 0.00 98 L 7.30 3.84 0.00 1.59 1.60 0.88 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 99 Y 7.83 4.41 0.00 3.09 2.87 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 0.00 100 D 7.86 4.37 0.00 2.81 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 0.00 101 M 7.79 4.00 0.00 2.08 1.97 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.68 0.00 102 L 8.27 3.96 0.00 1.91 1.73 1.01 0.67 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 0.00 103 R 7.91 3.87 0.00 1.80 2.12 0.00 3.24 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 104 K 7.84 4.22 0.00 1.80 1.84 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.57 7.81 105 N 7.97 4.98 0.00 2.77 2.77 0.00 0.00 6.66 6.64 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 0.00 106 L 7.95 4.87 0.00 1.61 1.59 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.38 4.37 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 0.90 0.00 0.00 0.94 0.00 0.00 108 T 8.51 4.45 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 0.00 109 L 8.38 4.20 0.00 1.57 1.65 0.90 0.80 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 *110 A 8.53 4.08 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 * Residues marked with a * may have inaccurate shift predictions.