NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 A 4.0879 8.2531 123.5764 51.0301 20.3790 174.9883 24 G 3.2398 7.5857 103.9968 44.6942 0.0000 171.4033 25 T 4.4321 8.2809 122.8814 60.9986 72.7900 171.8092 26 V 4.2948 8.0727 125.9158 62.0670 32.7860 174.8457 27 F 4.9431 9.5689 128.1394 56.3437 40.7805 174.8228 28 T 5.2592 8.7227 113.4729 60.4674 70.9935 173.9390 29 T 4.8401 9.2259 120.3762 61.9978 72.9491 173.2375 30 V 5.0643 8.5318 118.0890 59.5236 34.9719 174.7367 31 E 4.7948 9.0361 122.8742 54.2256 33.0555 174.5461 32 D 4.6615 8.6725 121.5110 53.4588 42.2685 176.4071 33 L 4.7723 8.3062 125.0481 53.4192 43.3907 178.1517 34 G 3.8042 8.3948 111.1242 46.0755 0.0000 173.1462 35 S 4.7474 8.9412 115.8590 57.7107 65.5047 175.3418 36 K 4.9795 8.1381 120.1805 54.8911 35.7172 174.8657 37 I 4.6398 8.5206 124.2375 59.7560 39.5235 174.4362 38 L 4.5188 8.6761 129.5071 53.7658 43.4521 174.9100 39 L 5.0625 8.6749 127.5475 53.7620 43.6323 175.9743 40 T 5.3924 9.5476 120.0847 62.0499 72.9063 172.2638 41 C 5.6941 9.8809 121.8700 55.4184 42.6044 173.1134 42 S 5.4204 9.6544 119.6035 56.6826 65.6715 172.7151 43 L 4.1973 9.2162 128.2896 53.6531 42.8780 175.7378 44 D 4.5213 8.6266 129.5682 54.7420 40.8755 176.7065 45 D 4.5437 8.4641 124.7846 52.6694 39.3445 170.7822 *48 T 4.2217 7.8200 111.1288 64.6789 69.3466 172.5986 49 E 4.1861 8.6582 123.9825 56.5645 30.0823 177.4144 50 V 4.3168 8.2962 120.1412 60.7813 32.7959 176.0146 51 T 4.3954 9.1841 113.8463 60.8401 70.1588 173.9035 52 G 4.1873 6.7318 108.7452 44.4345 0.0000 170.9843 53 H 5.4116 8.9141 116.1884 54.0983 33.6734 172.9614 54 R 5.0850 8.5299 119.0193 54.7718 33.9412 173.6263 55 W 5.1634 9.4076 125.4345 54.8503 32.5745 174.5202 56 L 5.2224 8.9746 123.0217 52.8744 45.3304 175.2982 57 K 4.3249 8.7944 123.6596 54.7200 35.1879 176.0676 58 G 4.0127 8.1845 115.6493 47.0137 0.0000 174.3937 59 G 3.9281 8.9678 111.0505 44.6585 0.0000 172.5725 60 V 4.1834 7.8030 121.1787 60.4632 32.9737 175.1893 61 V 4.0924 8.2850 127.0720 63.2186 31.9211 175.0272 62 L 4.5166 8.9535 127.8640 56.2289 42.7480 176.9964 63 K 4.8637 7.8927 117.9339 54.9409 36.2130 174.4698 64 E 5.3644 8.6399 124.4896 55.1265 32.3637 173.3698 65 D 5.0615 9.5027 124.9348 50.9971 43.7586 174.9326 66 A 4.8538 8.2331 118.9055 51.7582 19.2601 176.0975 67 L 4.8157 7.6594 121.6201 52.3873 44.7909 176.4269 68 P 4.8188 0.0000 0.0000 61.2108 32.9287 174.3821 69 G 4.1501 8.8958 106.3670 45.2147 0.0000 174.4616 70 Q 4.2676 9.0706 122.6680 56.8185 29.7959 175.3073 71 K 5.1621 7.8099 120.4309 54.9628 35.2862 175.1672 72 T 4.8220 9.3648 120.2587 60.7056 71.0572 172.2197 73 E 5.3817 9.0266 126.3768 54.6691 33.4660 175.2153 74 F 4.0363 8.8251 124.2639 56.2011 42.5992 173.2140 75 K 4.3876 7.7604 128.1069 55.6837 33.0214 175.6785 76 V 4.2925 8.7595 128.4759 60.9536 33.8882 174.8128 77 D 4.8508 8.7680 127.6715 54.0030 41.6177 177.1845 78 S 4.1372 8.1432 115.7062 62.1779 62.7953 175.9863 79 D 4.5505 8.4213 119.3859 57.2367 40.7178 176.7398 80 D 5.1915 7.9227 115.6129 53.6343 39.7764 176.8628 81 Q 4.4673 8.0848 118.0378 55.8646 28.4163 175.3654 82 W 5.2068 7.3895 112.9225 55.6116 31.7917 175.6418 83 G 3.6098 9.1271 105.9517 44.2903 0.0000 171.3272 84 E 4.6200 8.2625 119.3043 54.7698 31.3958 175.2643 85 Y 4.9079 8.7709 124.5665 56.9448 40.2326 175.3906 86 S 4.7482 9.1593 117.8184 56.9257 66.9789 170.6543 87 C 4.0824 8.4055 118.7181 53.2030 44.9773 173.2472 88 V 4.3989 7.8709 120.4822 61.1793 34.5106 173.8909 89 F 4.8582 8.8977 125.9265 55.8269 40.8267 174.9007 90 L 4.8405 8.8233 123.8099 52.4447 44.0409 174.6440 91 P 5.1163 0.0000 0.0000 60.9446 33.4207 174.9227 92 E 3.9622 8.7581 120.4088 55.8163 29.8400 174.8567 93 P 4.4452 0.0000 0.0000 63.1180 31.8872 176.3248 94 M 4.3202 8.3583 116.2728 56.0317 32.1087 176.3726 95 G 4.1560 7.5505 105.4446 45.4536 0.0000 172.8614 96 T 4.6101 8.1841 116.9243 62.0163 72.5990 173.1817 97 A 4.7680 8.3087 126.8625 50.4430 22.4742 174.7601 98 N 4.9575 8.6446 116.6061 51.4254 40.7932 174.4354 99 I 4.2730 8.3075 123.8689 59.4704 38.9544 174.7654 100 Q 4.3241 8.5551 126.6796 54.4018 29.1921 174.9461 101 L 4.5485 8.1007 125.4454 54.3423 43.5239 177.0399 102 H 4.7411 8.1246 115.1391 55.6495 29.2081 174.1714 103 G 4.3794 8.1570 111.0519 45.9646 0.0000 171.0186 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 23 A 8.25 4.09 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 24 G 7.59 3.24 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 0.00 25 T 8.28 4.43 3.95 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 0.48 0.00 0.00 26 V 8.07 4.29 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 0.91 0.00 0.00 0.84 0.00 0.00 27 F 9.57 4.94 0.00 3.01 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 28 T 8.72 5.26 4.36 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 1.30 0.00 0.00 29 T 9.23 4.84 4.32 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 1.24 0.00 0.00 30 V 8.53 5.06 2.07 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 0.78 0.00 0.00 0.95 0.00 0.00 31 E 9.04 4.79 0.00 1.98 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 2.16 2.19 0.00 32 D 8.67 4.66 0.00 2.71 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.31 4.77 0.00 1.77 1.50 0.85 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 34 G 8.39 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 0.00 0.00 0.00 35 S 8.94 4.75 0.00 3.88 4.06 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 0.00 0.00 0.00 0.00 36 K 8.14 4.98 0.00 1.66 1.60 0.00 1.57 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.33 7.81 37 I 8.52 4.64 1.76 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 1.23 1.23 0.84 0.00 0.00 38 L 8.68 4.52 0.00 1.68 1.49 0.78 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.67 5.06 0.00 1.31 1.61 0.47 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.55 5.39 4.34 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 1.33 0.00 0.00 41 C 9.88 5.69 0.00 2.91 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 42 S 9.65 5.42 0.00 3.84 3.82 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 0.00 0.00 0.00 0.00 43 L 9.22 4.20 0.00 0.27 0.87 0.54 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.63 4.52 0.00 2.94 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 45 D 8.46 4.54 0.00 2.91 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 *48 T 7.82 4.22 4.23 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 1.20 0.00 0.00 49 E 8.66 4.19 0.00 1.93 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 2.29 2.34 0.00 50 V 8.30 4.32 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 0.98 0.00 0.00 1.07 0.00 0.00 51 T 9.18 4.40 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 1.25 0.00 0.00 52 G 6.73 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 53 H 8.91 5.41 0.00 3.05 2.89 0.00 5.78 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 54 R 8.53 5.08 0.00 1.79 1.57 0.00 3.01 0.00 0.00 3.29 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.76 0.00 55 W 9.41 5.16 0.00 3.13 2.68 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 56 L 8.97 5.22 0.00 1.43 1.48 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.79 4.32 0.00 1.03 1.19 0.00 1.00 0.00 0.00 0.99 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.61 0.21 7.81 58 G 8.18 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.97 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 60 V 7.80 4.18 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 1.00 0.00 0.00 0.93 0.00 0.00 61 V 8.29 4.09 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 0.95 0.00 0.00 0.91 0.00 0.00 62 L 8.95 4.52 0.00 1.57 1.79 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.89 4.86 0.00 2.07 1.88 0.00 1.81 0.00 0.00 1.82 0.00 0.00 2.99 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.57 1.53 7.81 64 E 8.64 5.36 0.00 2.00 1.78 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 2.22 2.50 0.00 65 D 9.50 5.06 0.00 2.81 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 66 A 8.23 4.85 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 67 L 7.66 4.82 0.00 1.81 1.63 0.97 1.00 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 68 P 0.00 4.82 0.00 2.21 2.14 0.00 3.54 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 69 G 8.90 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 70 Q 9.07 4.27 0.00 2.03 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.48 2.31 0.00 71 K 7.81 5.16 0.00 1.79 1.73 0.00 1.83 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.47 7.81 72 T 9.36 4.82 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 0.99 0.00 0.00 73 E 9.03 5.38 0.00 1.79 1.75 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 2.25 2.31 0.00 74 F 8.83 4.04 0.00 1.51 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.76 4.39 0.00 1.47 1.34 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.57 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.23 1.26 7.81 76 V 8.76 4.29 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 0.98 0.00 0.00 0.49 0.00 0.00 77 D 8.77 4.85 0.00 2.87 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 78 S 8.14 4.14 0.00 4.02 4.17 0.00 0.00 0.00 0.00 0.00 0.00 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 8.42 4.55 0.00 2.77 2.89 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 80 D 7.92 5.19 0.00 2.90 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 81 Q 8.08 4.47 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 82 W 7.39 5.21 0.00 3.55 3.04 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 0.00 0.00 0.00 83 G 9.13 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 84 E 8.26 4.62 0.00 2.03 1.75 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 2.25 2.32 0.00 85 Y 8.77 4.91 0.00 2.92 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 86 S 9.16 4.75 0.00 3.64 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 87 C 8.41 4.08 0.00 1.62 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 88 V 7.87 4.40 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 0.89 0.00 0.00 0.79 0.00 0.00 89 F 8.90 4.86 0.00 2.89 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 90 L 8.82 4.84 0.00 1.59 1.52 0.88 0.71 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 91 P 0.00 5.12 0.00 2.04 2.05 0.00 3.53 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.07 0.00 92 E 8.76 3.96 0.00 1.92 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 2.30 2.42 0.00 93 P 0.00 4.45 0.00 2.08 1.97 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 94 M 8.36 4.32 0.00 2.11 2.17 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 2.51 2.52 0.00 95 G 7.55 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 0.00 0.00 0.00 96 T 8.18 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 97 A 8.31 4.77 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 98 N 8.64 4.96 0.00 2.69 2.72 0.00 0.00 6.84 7.45 0.00 0.00 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 I 8.31 4.27 1.87 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 1.30 0.56 0.92 0.00 0.00 100 Q 8.56 4.32 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.95 0.00 0.00 0.00 0.00 0.00 2.21 2.23 0.00 101 L 8.10 4.55 0.00 1.64 1.58 0.94 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 102 H 8.12 4.74 0.00 3.04 3.21 0.00 6.04 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 0.00 103 G 8.16 4.38 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 0.00 * Residues marked with a * may have inaccurate shift predictions.