NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 K 4.1828 8.3144 121.7866 56.3397 32.9597 173.1282 20 K 4.5703 7.3735 121.7076 54.0498 35.4733 173.4379 21 R 3.9173 9.3048 117.7775 58.0421 31.1963 176.6027 22 F 4.9817 7.8865 115.4801 55.4580 41.3433 174.2222 23 E 4.6498 8.5307 124.7477 54.2099 32.7092 174.5561 24 V 3.8573 8.3237 124.8011 62.4226 32.0361 175.3092 25 K 4.2980 8.7354 128.3772 57.8306 33.0130 176.2050 26 K 4.7463 7.5817 116.2968 54.7982 35.1753 174.4380 27 W 5.3769 8.5212 132.4816 55.9070 33.6674 174.4478 28 N 4.4815 8.2755 121.8346 51.2175 38.7825 173.9716 29 A 3.5118 7.1532 125.3297 50.6674 19.9210 176.8988 30 V 4.2661 7.6637 118.0876 60.9471 34.5156 174.7147 31 A 4.6608 8.4190 128.6370 50.2185 21.7932 174.7985 32 L 4.5899 8.4728 122.3951 52.5469 43.2987 176.3925 33 W 4.6562 8.4386 120.7305 55.4289 29.6603 175.2334 34 A 4.4251 8.1558 121.2995 50.6272 21.7625 174.8546 35 W 4.6535 8.9190 117.9843 56.8315 28.6951 176.6866 36 D 3.7534 8.7202 120.5846 54.7663 43.7786 182.0691 37 I 2.6464 7.4310 117.0444 60.2149 38.8549 176.1829 38 V 4.2057 8.1302 120.3056 62.7277 35.2317 172.2441 39 V 3.8971 8.3544 124.3114 62.9225 29.4370 174.1071 40 D 4.8665 7.3980 120.8458 52.7625 43.7468 175.7245 41 N 4.5462 10.4529 118.5744 53.2223 39.9711 173.8611 42 C 4.3911 9.2683 120.0577 57.7318 44.2730 174.3812 43 A 4.1739 8.7930 125.9516 54.3245 19.4257 178.9526 44 I 3.6559 7.5790 115.6487 64.5203 38.4360 176.0523 45 C 5.0193 7.3227 121.7654 54.4029 40.2037 174.1438 46 R 4.8010 8.0031 118.5306 56.6111 32.5111 172.8991 47 N 4.7182 7.7438 115.9922 53.4678 40.4113 173.7902 48 H 5.0750 8.8274 120.3605 56.1925 30.2032 176.0816 49 I 3.2180 8.4461 125.9984 64.3561 37.0315 176.3079 50 M 4.2732 7.6850 116.8697 55.6885 32.5723 174.6625 51 D 4.9793 8.3229 118.1236 52.5113 43.5196 175.6515 52 L 4.2482 8.3309 120.0943 55.4121 42.2857 175.6770 53 C 4.9170 8.0780 114.1452 54.0348 44.3082 176.0745 54 I 3.4373 7.6123 121.3512 64.0221 37.3685 177.4660 55 E 4.2041 8.1988 119.6333 59.2653 29.6600 178.4513 56 C 4.1668 8.1629 116.8749 62.6358 28.1801 175.5210 57 Q 4.1392 8.0535 119.1502 57.8209 28.7407 176.8187 58 A 4.6136 7.7791 119.2973 53.6839 20.8490 177.1860 59 N 4.9044 8.0885 112.9683 53.4510 39.1126 174.6883 60 Q 4.4134 8.0405 116.4253 56.5256 29.3755 175.6913 61 A 4.4659 7.8325 118.0502 51.7658 19.8087 178.4715 62 S 4.4164 7.3514 108.2213 57.9224 65.9294 174.9539 63 A 3.6582 8.8773 124.3364 53.1570 18.1268 177.0686 *67 E 3.9932 8.5783 123.1942 56.1511 29.7484 174.8107 68 C 4.3758 8.9273 125.8919 57.7180 38.8564 173.1307 69 T 4.6956 8.2091 115.4178 59.9626 71.9726 173.3336 70 V 5.0393 8.4210 113.4185 60.2778 34.0720 175.6474 71 A 5.1870 8.9567 123.2609 50.4510 22.9361 175.2933 72 W 5.1587 10.0895 120.5589 54.9448 32.9706 175.0533 73 G 3.4928 8.6533 108.5294 43.8259 0.0000 174.5814 74 V 3.8086 8.3826 122.5365 64.4376 31.5069 176.6245 75 C 4.4859 7.9768 113.7261 58.0262 29.7709 173.7583 76 N 4.7918 8.8040 117.4673 54.8753 37.8577 173.1127 77 H 4.9388 7.7881 113.3487 54.6422 30.7148 174.0421 78 A 4.6706 7.5498 122.5148 50.0819 21.7293 175.0932 79 F 4.8441 8.4129 118.7251 55.9641 44.6332 173.6441 80 H 4.8520 8.9582 116.4816 55.6757 29.3442 176.7387 81 F 4.3319 9.4010 126.1723 62.0041 39.2420 177.4291 82 H 4.1640 8.2648 115.2617 58.6156 28.4487 177.3246 83 C 4.1605 7.8468 118.2654 62.4763 28.2898 175.5609 84 I 3.4386 7.6163 119.7572 63.2847 37.2147 178.1891 85 S 4.0296 7.3021 115.3789 61.4757 62.3891 176.0793 86 R 3.9520 7.4189 120.6262 59.0419 29.7325 178.4202 87 W 3.8311 7.9066 127.9864 60.2966 29.9085 177.9108 88 L 4.2835 7.7406 120.0149 56.7478 40.7443 179.4592 89 K 4.0939 7.3394 116.7723 58.5843 31.9836 178.3968 90 T 3.9275 7.1984 109.2954 63.5458 69.5832 175.3482 91 R 4.3002 6.3248 117.9777 54.5927 33.8476 174.7933 92 Q 4.7188 8.4048 127.1625 56.1346 28.4415 174.5684 93 V 5.2580 7.1660 109.8668 59.3717 36.1609 175.4247 94 C 4.4086 8.6772 121.8438 58.6138 31.9592 171.7508 95 P 3.2493 0.0000 0.0000 65.3968 30.9614 177.8780 96 L 3.9285 7.6788 116.8323 57.2408 42.1691 176.8646 97 D 4.9348 7.4157 118.6357 52.5800 41.3544 176.0358 98 N 5.1649 8.3844 115.6467 53.6306 40.4683 174.4703 99 R 4.5656 8.5010 117.0110 55.0699 31.9354 176.1050 100 E 4.2620 8.8903 119.2922 57.2441 29.7520 176.3026 101 W 4.6367 8.9509 132.7433 56.7610 32.4843 175.4269 102 E 4.3849 6.6541 125.9935 54.6922 32.3631 174.0230 103 F 4.4104 8.8956 126.5535 58.4164 39.3799 174.6464 104 Q 4.4008 9.6969 125.4467 57.7365 30.5272 175.1158 105 K 4.9516 8.0303 118.0506 55.7406 35.2285 175.5988 106 Y 4.3110 9.0315 122.0992 58.3708 40.0424 176.8811 107 G 3.8917 8.2374 107.7206 45.6853 0.0000 172.6668 108 H 4.4963 8.8365 119.5105 56.3641 29.8259 175.1156 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 19 K 8.31 4.18 0.00 1.72 1.81 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.42 7.81 20 K 7.37 4.57 0.00 1.78 1.70 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.58 7.81 21 R 9.30 3.92 0.00 1.49 1.47 0.00 3.23 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.45 0.00 22 F 7.89 4.98 0.00 3.01 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 23 E 8.53 4.65 0.00 1.87 1.77 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 2.18 2.28 0.00 24 V 8.32 3.86 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 0.79 0.00 0.00 0.79 0.00 0.00 25 K 8.74 4.30 0.00 1.78 1.84 0.00 1.85 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.39 1.43 7.81 26 K 7.58 4.75 0.00 1.75 1.66 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.49 7.81 27 W 8.52 5.38 0.00 3.09 3.03 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 28 N 8.28 4.48 0.00 2.53 2.54 0.00 0.00 6.94 7.35 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 29 A 7.15 3.51 0.18 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 30 V 7.66 4.27 1.98 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 0.78 0.00 0.00 0.79 0.00 0.00 31 A 8.42 4.66 1.19 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 32 L 8.47 4.59 0.00 1.54 1.44 0.81 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 33 W 8.44 4.66 0.00 3.33 2.94 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 34 A 8.16 4.43 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 35 W 8.92 4.65 0.00 3.31 3.21 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 36 D 8.72 3.75 0.00 2.74 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 I 7.43 2.65 1.92 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 1.35 0.68 0.93 0.00 0.00 38 V 8.13 4.21 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 0.71 0.00 0.00 0.96 0.00 0.00 39 V 8.35 3.90 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 0.88 0.00 0.00 0.98 0.00 0.00 40 D 7.40 4.87 0.00 2.82 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 N 10.45 4.55 0.00 2.70 3.07 0.00 0.00 7.05 7.54 0.00 0.00 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 C 9.27 4.39 0.00 3.11 3.12 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 43 A 8.79 4.17 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 44 I 7.58 3.66 1.68 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.03 0.71 0.00 0.00 45 C 7.32 5.02 0.00 3.01 2.37 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 46 R 8.00 4.80 0.00 1.76 1.87 0.00 3.04 0.00 0.00 3.52 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.37 0.00 47 N 7.74 4.72 0.00 2.78 2.76 0.00 0.00 6.70 8.16 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 48 H 8.83 5.08 0.00 3.31 3.49 0.00 5.93 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 I 8.45 3.22 1.69 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.55 0.77 0.00 0.00 50 M 7.69 4.27 0.00 2.13 2.18 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 2.60 2.70 0.00 51 D 8.32 4.98 0.00 2.82 2.64 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 0.00 0.00 0.00 0.00 52 L 8.33 4.25 0.00 1.66 1.72 0.98 0.87 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 53 C 8.08 4.92 0.00 2.92 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 54 I 7.61 3.44 1.83 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 1.39 0.47 0.89 0.00 0.00 55 E 8.20 4.20 0.00 1.95 1.94 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 2.35 2.36 0.00 56 C 8.16 4.17 0.00 3.01 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 57 Q 8.05 4.14 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.83 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 58 A 7.78 4.61 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 59 N 8.09 4.90 0.00 2.87 2.82 0.00 0.00 6.98 7.22 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 60 Q 8.04 4.41 0.00 2.27 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 61 A 7.83 4.47 1.28 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 0.00 0.00 0.00 62 S 7.35 4.42 0.00 3.93 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 63 A 8.88 3.66 1.28 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 0.00 0.00 0.00 *67 E 8.58 3.99 0.00 2.01 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 2.24 2.38 0.00 68 C 8.93 4.38 0.00 3.12 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 69 T 8.21 4.70 4.33 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 70 V 8.42 5.04 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 1.26 0.00 0.00 71 A 8.96 5.19 1.55 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 0.00 0.00 0.00 72 W 10.09 5.16 0.00 3.31 3.16 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 73 G 8.65 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.38 3.81 1.94 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 0.77 0.00 0.00 0.91 0.00 0.00 75 C 7.98 4.49 0.00 3.38 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 76 N 8.80 4.79 0.00 2.52 2.87 0.00 0.00 7.07 8.07 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 77 H 7.79 4.94 0.00 3.23 2.95 0.00 5.80 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.55 4.67 -0.20 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 79 F 8.41 4.84 0.00 2.90 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 80 H 8.96 4.85 0.00 3.29 3.34 0.00 5.83 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.40 4.33 0.00 3.12 3.12 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 82 H 8.26 4.16 0.00 3.28 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 7.85 4.16 0.00 2.92 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 84 I 7.62 3.44 1.34 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.31 1.06 0.00 0.00 85 S 7.30 4.03 0.00 3.52 3.67 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 0.00 0.00 0.00 0.00 86 R 7.42 3.95 0.00 2.07 1.89 0.00 3.08 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 87 W 7.91 3.83 0.00 3.34 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 88 L 7.74 4.28 0.00 1.83 1.66 0.71 0.56 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 89 K 7.34 4.09 0.00 1.81 1.77 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.52 7.81 90 T 7.20 3.93 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 0.86 0.00 0.00 91 R 6.32 4.30 0.00 1.52 1.28 0.00 3.01 0.00 0.00 3.06 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.45 0.00 92 Q 8.40 4.72 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.51 0.00 0.00 0.00 0.00 0.00 2.53 2.59 0.00 93 V 7.17 5.26 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 0.86 0.00 0.00 1.21 0.00 0.00 94 C 8.68 4.41 0.00 3.57 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 95 P 0.00 3.25 0.00 1.36 0.76 0.00 3.17 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 96 L 7.68 3.93 0.00 1.12 1.37 0.64 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 97 D 7.42 4.93 0.00 2.78 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 98 N 8.38 5.16 0.00 2.70 2.84 0.00 0.00 6.77 7.66 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 99 R 8.50 4.57 0.00 1.92 1.90 0.00 3.25 0.00 0.00 3.30 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 100 E 8.89 4.26 0.00 2.03 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 2.32 2.32 0.00 101 W 8.95 4.64 0.00 3.39 3.14 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 0.00 102 E 6.65 4.38 0.00 1.91 1.50 0.00 0.00 0.00 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 2.36 0.00 103 F 8.90 4.41 0.00 3.24 3.03 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 0.00 104 Q 9.70 4.40 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.69 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 105 K 8.03 4.95 0.00 1.78 1.51 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.13 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.67 1.48 7.81 106 Y 9.03 4.31 0.00 2.81 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 0.00 107 G 8.24 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 0.00 0.00 0.00 108 H 8.84 4.50 0.00 3.13 3.27 0.00 5.96 0.00 0.00 0.00 0.00 6.91 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.