NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 R 4.3086 8.2549 120.8609 56.0996 31.2766 174.5067 6 V 4.3273 7.9755 116.9642 58.3385 34.7250 173.7814 7 N 4.3659 8.7607 122.6914 56.2004 39.7563 174.5091 8 S 4.7763 7.5385 108.6601 57.1826 66.3259 172.7710 9 D 4.8682 8.3397 116.2349 54.3407 41.9592 177.2026 10 V 3.8221 7.9735 111.9513 62.0008 32.1784 176.1103 11 L 4.5428 7.6959 121.1042 53.0868 41.8016 175.2060 12 T 5.0970 8.1770 113.2677 59.6049 71.6898 174.0465 13 V 4.0623 8.7189 122.7468 62.7862 33.7430 176.8550 *25 K 4.3100 7.9997 120.5471 55.3087 33.8095 173.8011 26 P 4.7280 0.0000 0.0000 62.4232 32.0489 176.5661 27 L 3.9008 8.9663 123.3304 58.5120 41.9306 179.5398 28 R 3.9226 8.0991 115.3822 59.7631 28.9781 178.3046 29 D 4.3650 8.0180 119.2435 57.3486 40.8516 178.9674 30 S 4.1542 8.1374 115.6586 61.3732 62.7708 176.9433 31 V 3.5605 7.5524 120.7251 65.6877 31.3167 178.1250 32 K 3.9479 8.0960 118.2718 59.5679 31.9248 179.3281 33 Q 3.9244 8.0715 118.0586 58.9269 28.6289 178.7183 34 A 3.9602 7.8613 121.6074 55.1618 18.3818 179.7734 35 L 3.5564 7.8621 117.4020 57.4718 41.5719 179.4755 36 K 3.8791 8.4930 119.9673 59.6278 31.9181 178.2775 37 N 4.3056 8.4683 116.2246 56.7116 38.9058 175.9216 38 Y 4.2464 7.7337 119.9488 60.9112 39.2714 177.6913 39 F 4.5173 8.5294 118.7037 60.4323 38.7801 176.9986 40 A 4.2949 7.6499 118.7781 52.7057 18.3546 177.2441 41 Q 4.1176 7.3989 115.3729 54.3831 31.2449 175.0026 *45 Q 4.0244 8.5248 121.0225 55.7999 28.8146 173.7375 46 D 4.7414 8.2980 122.1551 53.0177 42.2162 176.6005 47 V 4.6156 8.1741 122.2227 61.4216 34.3486 175.1041 48 N 5.1563 8.7152 120.4808 53.0665 38.7374 174.3619 49 D 4.8473 7.9673 117.3385 52.4065 40.1752 177.0805 50 L 3.9881 8.3828 124.1965 59.1563 41.9924 177.5428 51 Y 3.9563 7.9933 119.1590 60.7426 38.8697 177.2801 52 E 3.9382 8.3165 119.7678 58.9897 29.5850 178.2319 53 L 3.8458 7.9371 120.3802 58.2397 42.1590 179.2836 54 V 3.4120 7.5680 118.0175 65.6643 31.4717 177.5543 55 L 3.6774 7.9408 120.2593 58.2011 41.7695 178.9130 56 A 4.3262 8.1096 122.1492 54.6199 18.1014 179.1855 57 E 3.8262 7.7754 116.6561 58.4257 29.7713 178.2377 58 V 3.9684 7.2185 117.3318 64.6897 32.2545 177.5820 59 E 3.9060 8.4627 118.7128 59.2449 29.2731 179.0554 60 Q 3.5289 7.2555 118.0774 58.4777 28.7191 177.4590 61 P 4.2141 0.0000 0.0000 65.5625 31.2009 178.1906 62 L 3.8627 7.5927 120.1876 58.0307 42.0489 178.8942 63 L 3.9678 8.0972 119.2497 57.7167 41.5371 178.8743 64 D 4.3079 8.1144 117.8537 57.8256 41.1388 178.2876 65 M 4.0833 8.2640 119.2366 58.3774 31.9874 179.0286 66 V 3.6359 8.0667 118.5562 66.3678 31.6772 178.0573 67 M 4.1564 8.2905 118.4671 58.3551 31.6997 178.8776 68 Q 3.9668 8.1351 118.4044 59.1466 28.7185 177.9967 69 Y 4.1214 8.3153 120.0187 60.1815 39.2173 177.1995 70 T 4.2976 8.1170 108.5390 60.2934 69.4316 174.7505 71 R 3.8945 8.3941 118.2623 57.8078 28.0679 176.5749 72 A 3.6081 8.6656 116.0910 53.1407 17.0965 178.9585 73 N 4.5803 7.8591 117.0406 53.7484 38.7103 175.3486 74 Q 4.0185 8.5965 128.2772 59.2267 28.8921 179.0772 75 T 3.8946 7.8061 116.2444 66.6888 68.6653 176.9011 76 R 3.9553 7.9884 119.3103 59.0483 30.1551 178.8320 77 A 4.0059 8.4179 120.6975 55.1750 18.3736 179.5580 78 A 3.9717 8.1946 119.3944 55.3588 18.2424 179.8189 79 L 3.9274 7.8122 116.4121 58.1467 41.7285 179.1810 80 M 4.1915 7.9544 117.3383 58.8794 32.3117 177.8959 81 M 4.2788 8.0794 117.5632 55.9224 32.2748 176.8358 82 G 3.8438 8.3742 107.1182 46.2574 0.0000 172.9379 83 I 4.6590 7.4772 110.8624 57.7492 41.0664 174.7064 84 N 4.7209 8.2747 118.8386 51.7623 39.7235 175.9406 85 R 3.9539 8.5311 120.3794 59.7906 30.0967 178.5493 86 G 3.6488 8.1275 104.7598 48.1598 0.0000 175.5937 87 T 3.9053 8.9981 118.3596 66.2163 68.3956 176.5364 88 L 3.9746 7.8513 122.1424 58.3751 42.0871 179.2680 89 R 3.9195 8.2092 118.0824 58.9946 29.9631 178.9727 90 K 3.8883 8.1434 119.4398 59.5213 32.0040 179.0892 91 K 3.9476 8.1242 118.7302 59.3391 31.8750 179.3367 92 L 4.1062 8.2883 119.6725 57.6840 41.5115 179.5312 93 K 3.8620 8.2539 119.6562 59.4006 31.9520 178.5112 94 K 3.6996 7.6346 118.6562 59.1054 31.9340 177.2006 95 Y 4.8321 7.4590 115.1409 56.6613 38.5848 175.8925 96 G 4.1998 8.1763 107.1312 47.3600 0.0000 174.5787 97 M 4.5373 8.7543 116.3212 54.5846 32.7382 176.4312 98 N 4.5414 8.0142 122.1987 53.0283 37.8336 174.8796 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 R 8.25 4.31 0.00 1.79 1.90 0.00 3.14 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 6 V 7.98 4.33 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 0.75 0.00 0.00 0.93 0.00 0.00 7 N 8.76 4.37 0.00 2.68 2.86 0.00 0.00 6.79 7.63 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 8 S 7.54 4.78 0.00 3.94 3.77 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 0.00 0.00 0.00 9 D 8.34 4.87 0.00 2.62 2.63 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 10 V 7.97 3.82 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 0.69 0.00 0.00 0.91 0.00 0.00 11 L 7.70 4.54 0.00 1.66 1.58 0.89 0.56 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 12 T 8.18 5.10 4.31 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 1.20 0.00 0.00 13 V 8.72 4.06 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 0.74 0.00 0.00 0.91 0.00 0.00 *25 K 8.00 4.31 0.00 1.87 1.87 0.00 1.76 0.00 0.00 1.86 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.40 1.49 7.81 26 P 0.00 4.73 0.00 2.24 2.16 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 1.95 0.00 27 L 8.97 3.90 0.00 1.80 1.69 0.88 0.71 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 28 R 8.10 3.92 0.00 2.07 2.19 0.00 3.02 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 29 D 8.02 4.37 0.00 3.02 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 30 S 8.14 4.15 0.00 3.98 3.88 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 31 V 7.55 3.56 2.20 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 1.02 0.00 0.00 0.94 0.00 0.00 32 K 8.10 3.95 0.00 2.01 1.84 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.63 7.81 33 Q 8.07 3.92 0.00 2.05 2.13 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 2.59 2.51 0.00 34 A 7.86 3.96 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 35 L 7.86 3.56 0.00 1.65 1.06 0.88 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.49 3.88 0.00 1.82 2.02 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.50 7.81 37 N 8.47 4.31 0.00 2.72 3.02 0.00 0.00 7.24 7.59 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 38 Y 7.73 4.25 0.00 2.93 2.90 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 39 F 8.53 4.52 0.00 3.17 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 40 A 7.65 4.29 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 41 Q 7.40 4.12 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.66 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 *45 Q 8.52 4.02 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.89 0.00 0.00 0.00 0.00 0.00 2.23 2.42 0.00 46 D 8.30 4.74 0.00 2.67 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 47 V 8.17 4.62 2.21 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 1.08 0.00 0.00 1.08 0.00 0.00 48 N 8.72 5.16 0.00 2.82 2.84 0.00 0.00 5.87 8.06 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 49 D 7.97 4.85 0.00 2.83 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 50 L 8.38 3.99 0.00 1.94 1.85 0.89 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 51 Y 7.99 3.96 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.32 3.94 0.00 2.20 1.97 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 2.41 2.45 0.00 53 L 7.94 3.85 0.00 1.91 1.73 0.83 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.57 3.41 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 0.80 0.00 0.00 0.85 0.00 0.00 55 L 7.94 3.68 0.00 1.17 1.57 0.82 1.10 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 56 A 8.11 4.33 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 57 E 7.78 3.83 0.00 1.90 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 2.21 2.25 0.00 58 V 7.22 3.97 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 0.93 0.00 0.00 0.84 0.00 0.00 59 E 8.46 3.91 0.00 1.98 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 2.35 2.45 0.00 60 Q 7.26 3.53 0.00 1.79 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.80 0.00 0.00 0.00 0.00 0.00 1.65 1.16 0.00 61 P 0.00 4.21 0.00 2.19 2.23 0.00 3.40 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.07 0.00 62 L 7.59 3.86 0.00 1.73 1.87 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.10 3.97 0.00 1.86 1.73 1.10 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.11 4.31 0.00 2.77 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 65 M 8.26 4.08 0.00 2.05 2.08 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 2.88 0.00 66 V 8.07 3.64 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.00 0.00 0.00 67 M 8.29 4.16 0.00 2.09 2.29 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 2.64 2.87 0.00 68 Q 8.14 3.97 0.00 2.33 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.64 0.00 69 Y 8.32 4.12 0.00 2.99 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 70 T 8.12 4.30 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 1.41 0.00 0.00 71 R 8.39 3.89 0.00 1.92 2.01 0.00 3.22 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 72 A 8.67 3.61 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 73 N 7.86 4.58 0.00 2.88 2.84 0.00 0.00 7.21 6.43 0.00 0.00 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 Q 8.60 4.02 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.70 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 75 T 7.81 3.89 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 76 R 7.99 3.96 0.00 1.99 2.01 0.00 3.33 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.77 0.00 77 A 8.42 4.01 1.41 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 0.00 0.00 0.00 78 A 8.19 3.97 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 0.00 0.00 79 L 7.81 3.93 0.00 1.83 1.77 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 80 M 7.95 4.19 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 81 M 8.08 4.28 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.55 0.00 82 G 8.37 3.84 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 0.00 0.00 0.00 83 I 7.48 4.66 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.79 0.93 0.00 0.00 84 N 8.27 4.72 0.00 3.02 3.00 0.00 0.00 5.54 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 85 R 8.53 3.95 0.00 1.95 1.98 0.00 3.24 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 86 G 8.13 3.65 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 0.00 0.00 0.00 87 T 9.00 3.91 4.43 0.00 0.00 0.00 0.00 0.00 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 88 L 7.85 3.97 0.00 1.80 1.87 0.95 1.04 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 89 R 8.21 3.92 0.00 2.11 1.97 0.00 3.37 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 90 K 8.14 3.89 0.00 1.91 2.00 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.45 7.81 91 K 8.12 3.95 0.00 2.06 2.00 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.69 7.81 92 L 8.29 4.11 0.00 1.88 1.75 0.95 0.97 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 93 K 8.25 3.86 0.00 1.90 1.91 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.42 7.81 94 K 7.63 3.70 0.00 1.57 1.42 0.00 1.56 0.00 0.00 1.10 0.00 0.00 2.77 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.33 1.12 7.81 95 Y 7.46 4.83 0.00 3.04 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 96 G 8.18 4.20 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 97 M 8.75 4.54 0.00 2.01 2.28 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 2.80 2.48 0.00 98 N 8.01 4.54 0.00 2.83 2.80 0.00 0.00 6.00 7.56 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 * Residues marked with a * may have inaccurate shift predictions.