NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 3.9349 8.0249 121.4177 61.0721 37.7793 174.8395 6 K 4.2116 8.2753 125.9964 53.0367 33.2674 174.0758 7 P 4.2586 0.0000 0.0000 62.5942 32.9087 176.4523 8 L 4.1868 8.9236 122.7304 54.5507 42.5333 176.4736 9 E 3.6546 7.7275 117.3262 57.5034 29.0698 174.5371 10 D 4.9480 9.1222 122.4088 53.8681 40.6028 174.9308 11 K 4.5489 7.8001 117.3666 55.9949 33.8426 176.3694 12 I 4.6563 8.4268 114.8736 59.1687 41.5017 173.8193 13 L 4.8424 8.5120 127.5253 54.0554 43.3311 175.1440 14 V 4.7274 8.7844 127.1194 61.1303 34.6430 174.0554 15 Q 4.8392 8.9736 128.6556 54.7478 30.0718 175.1611 16 A 4.5777 8.4452 128.8457 52.0938 19.4612 176.5910 *22 T 4.2517 8.1719 114.7415 63.8470 69.8880 174.0118 23 T 4.6157 8.0164 119.4673 61.3694 71.4422 175.4117 24 A 4.1089 8.6426 127.2323 54.4705 18.5895 178.6228 25 S 4.2496 7.8400 109.5712 59.8077 62.8495 174.2872 26 G 4.2172 7.6015 109.0540 45.3231 0.0000 173.2355 27 L 4.7364 8.0170 118.7074 52.3705 44.7878 175.5634 28 V 4.3434 8.2667 121.3615 61.3119 32.5670 175.5447 29 I 4.2579 7.9895 128.7414 58.7625 36.8201 173.8632 30 P 4.0413 0.0000 0.0000 63.7119 31.3502 175.1720 *37 P 4.6120 0.0000 0.0000 62.6202 31.4360 175.3371 38 Q 4.4087 7.4495 124.1951 54.2304 32.0001 173.2660 39 E 4.9642 7.9981 122.0060 54.3994 32.9119 174.4103 40 G 4.1768 8.0366 109.0583 46.7522 0.0000 171.7031 41 T 5.1041 7.7580 115.8624 61.3218 71.2218 174.4398 42 V 3.8525 8.8178 127.4335 63.4140 31.7417 176.3238 43 V 4.1218 8.4419 128.5921 64.3175 32.5780 175.5566 44 A 4.7064 7.5845 119.8780 50.9283 22.4315 175.2122 45 V 4.5417 8.1925 118.2776 61.5041 35.1679 174.6726 46 G 4.0416 7.9862 113.1539 44.1564 0.0000 171.9051 47 P 4.2490 0.0000 0.0000 66.6027 31.3001 176.4621 48 G 3.9910 7.8612 100.5061 43.9857 0.0000 173.3927 49 R 4.0974 8.3527 118.5934 55.2350 30.6872 177.1072 50 W 4.2478 8.7312 124.7052 57.0595 29.9993 176.3084 51 D 4.7356 9.3830 120.2263 53.0555 39.8713 178.5961 52 E 4.1535 8.7949 119.8629 60.8536 29.5506 179.1028 53 D 4.4483 8.1858 116.8604 53.7740 40.2637 182.5518 54 G 3.9080 8.1838 105.0315 45.9030 0.0000 174.4966 55 E 4.2010 7.7542 117.7887 58.8034 29.6625 177.0086 56 K 4.8150 7.9126 117.1660 54.9769 36.6171 174.2642 57 R 4.4838 7.7671 118.8221 54.6745 31.6074 176.2200 58 I 4.1564 8.2723 123.7455 59.7845 38.4155 174.2454 59 P 4.3663 0.0000 0.0000 62.1556 32.0916 175.9616 60 L 4.4672 8.0647 120.5194 54.3727 42.7789 176.1680 61 D 4.8977 8.4351 119.7812 54.3819 41.1945 176.8227 62 V 4.5812 7.6023 110.7625 59.5634 35.2687 174.5256 63 A 4.7782 9.1971 124.6839 49.8497 22.4264 175.5298 64 E 4.3457 8.4783 118.6837 58.0574 29.8868 177.8870 65 G 4.0816 9.3065 110.8408 45.5157 0.0000 174.0277 66 D 4.4411 7.7977 120.4147 54.8949 42.0312 175.4768 67 T 4.7579 8.5799 118.3214 61.2003 68.8655 173.7234 68 V 5.0575 8.9299 121.7825 59.6791 36.0448 174.4120 69 I 4.9509 8.5217 123.5075 60.0074 39.6165 174.7177 70 Y 5.3385 8.0612 123.9898 56.0394 42.0098 173.4806 71 S 5.0602 8.6065 113.5886 56.6525 65.7660 174.5602 72 K 4.4856 8.3757 118.9396 56.4815 32.3922 176.4455 73 Y 4.3365 7.8382 117.5673 59.5782 38.0935 176.5421 74 G 3.9667 9.1467 110.8251 46.0314 0.0000 173.7701 75 G 3.8559 7.9128 106.5034 46.4344 0.0000 174.4553 76 T 4.6433 8.4589 116.5452 61.1365 70.8997 172.6914 77 E 4.8124 8.6959 127.5275 55.9809 30.7223 175.7648 78 I 4.7991 9.1190 119.5809 59.3681 41.3882 173.8024 79 K 5.0750 8.7538 124.0900 55.1082 34.3366 175.6533 80 Y 4.5649 9.1209 125.4984 57.2879 41.2250 174.6294 81 N 3.8241 9.4931 127.1307 54.2878 36.0110 175.3444 82 G 3.9883 8.2761 105.7890 45.2715 0.0000 173.5318 83 E 4.2827 7.5543 119.3761 54.9218 31.0816 174.2942 84 E 4.7078 8.1700 123.0220 54.8407 31.6308 174.2318 85 Y 5.4008 8.8433 124.1281 56.2688 42.1412 174.6512 86 L 5.1556 9.2122 120.5764 53.2744 46.2698 175.6840 87 I 4.7085 8.5495 125.3238 59.8056 38.6575 174.7710 88 L 5.0703 8.5041 127.3074 53.4253 44.1377 176.3635 89 S 4.4713 8.7012 114.8570 57.9324 63.3492 174.8657 90 A 4.0792 8.3568 129.7569 55.4447 18.2367 180.1225 91 R 4.0686 7.7804 113.8543 58.9359 30.3089 177.5787 92 D 4.5349 8.4646 117.9392 55.6810 41.3185 176.1891 93 V 4.3093 7.6355 119.5947 62.1622 31.5452 175.3650 94 L 4.4218 8.9629 128.6357 57.4097 42.6096 176.5657 95 A 4.5914 7.6035 117.9521 51.4002 22.7796 175.2726 96 V 4.8467 8.3147 111.3443 59.7666 35.1723 177.0251 97 V 3.9791 8.4402 116.0884 61.5927 31.6744 175.8789 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 I 8.02 3.93 1.62 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.81 0.78 0.00 0.00 6 K 8.28 4.21 0.00 1.74 1.69 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.46 7.81 7 P 0.00 4.26 0.00 2.04 1.93 0.00 3.62 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 8 L 8.92 4.19 0.00 1.75 1.58 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 9 E 7.73 3.65 0.00 2.20 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 0.00 2.32 2.38 0.00 10 D 9.12 4.95 0.00 2.83 3.11 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 0.00 0.00 0.00 0.00 11 K 7.80 4.55 0.00 1.72 1.68 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.66 1.52 7.81 12 I 8.43 4.66 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.80 0.88 0.00 0.00 13 L 8.51 4.84 0.00 1.73 1.50 0.81 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.78 4.73 1.76 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 0.61 0.00 0.00 0.69 0.00 0.00 15 Q 8.97 4.84 0.00 2.46 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.65 0.00 0.00 0.00 0.00 0.00 2.23 1.94 0.00 16 A 8.45 4.58 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 *22 T 8.17 4.25 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 23 T 8.02 4.62 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 1.27 0.00 0.00 24 A 8.64 4.11 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 25 S 7.84 4.25 0.00 4.22 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 26 G 7.60 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 8.02 4.74 0.00 1.65 1.51 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.27 4.34 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 0.81 0.00 0.00 0.92 0.00 0.00 29 I 7.99 4.26 1.82 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.72 0.90 0.00 0.00 30 P 0.00 4.04 0.00 2.02 2.10 0.00 3.69 0.00 0.00 3.75 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 *37 P 0.00 4.61 0.00 1.98 2.01 0.00 3.62 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.01 0.00 38 Q 7.45 4.41 0.00 1.83 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 39 E 8.00 4.96 0.00 1.92 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 2.21 2.42 0.00 40 G 8.04 4.18 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 0.00 41 T 7.76 5.10 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 1.25 0.00 0.00 42 V 8.82 3.85 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 0.92 0.00 0.00 0.96 0.00 0.00 43 V 8.44 4.12 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 0.70 0.00 0.00 1.14 0.00 0.00 44 A 7.58 4.71 1.12 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 0.00 0.00 45 V 8.19 4.54 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 0.77 0.00 0.00 0.95 0.00 0.00 46 G 7.99 4.04 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 0.00 0.00 0.00 47 P 0.00 4.25 0.00 1.94 2.00 0.00 3.72 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 2.00 2.04 0.00 48 G 7.86 3.99 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 0.00 0.00 0.00 49 R 8.35 4.10 0.00 1.89 1.89 0.00 3.14 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 50 W 8.73 4.25 0.00 3.38 3.26 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 51 D 9.38 4.74 0.00 2.55 2.56 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 52 E 8.79 4.15 0.00 1.98 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 0.00 2.34 2.27 0.00 53 D 8.19 4.45 0.00 2.60 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 54 G 8.18 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 55 E 7.75 4.20 0.00 2.26 2.18 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 2.40 2.37 0.00 56 K 7.91 4.82 0.00 1.74 1.96 0.00 1.47 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.46 7.81 57 R 7.77 4.48 0.00 1.25 1.40 0.00 2.72 0.00 0.00 2.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 58 I 8.27 4.16 1.81 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 1.19 1.29 0.88 0.00 0.00 59 P 0.00 4.37 0.00 1.99 1.91 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 60 L 8.06 4.47 0.00 1.60 1.56 0.89 0.99 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 61 D 8.44 4.90 0.00 2.65 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 62 V 7.60 4.58 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 0.73 0.00 0.00 0.92 0.00 0.00 63 A 9.20 4.78 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 64 E 8.48 4.35 0.00 1.97 1.91 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 2.30 2.30 0.00 65 G 9.31 4.08 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 0.00 0.00 0.00 66 D 7.80 4.44 0.00 2.83 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 67 T 8.58 4.76 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 1.27 0.00 0.00 68 V 8.93 5.06 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 0.72 0.00 0.00 1.11 0.00 0.00 69 I 8.52 4.95 1.88 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 1.26 0.83 0.85 0.00 0.00 70 Y 8.06 5.34 0.00 3.18 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 71 S 8.61 5.06 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.38 4.49 0.00 1.74 1.89 0.00 1.62 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.60 1.40 7.81 73 Y 7.84 4.34 0.00 2.99 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 74 G 9.15 3.97 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 0.00 0.00 0.00 75 G 7.91 3.86 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 0.00 0.00 0.00 76 T 8.46 4.64 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 1.23 0.00 0.00 77 E 8.70 4.81 0.00 2.01 1.87 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 2.32 2.44 0.00 78 I 9.12 4.80 1.93 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 1.33 0.65 0.98 0.00 0.00 79 K 8.75 5.07 0.00 1.70 1.79 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.67 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.44 7.81 80 Y 9.12 4.56 0.00 3.08 3.10 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 0.00 0.00 0.00 0.00 81 N 9.49 3.82 0.00 2.29 2.57 0.00 0.00 7.31 7.65 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 82 G 8.28 3.99 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 0.00 0.00 0.00 83 E 7.55 4.28 0.00 2.10 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 2.24 2.48 0.00 84 E 8.17 4.71 0.00 1.95 1.70 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 2.26 2.29 0.00 85 Y 8.84 5.40 0.00 3.23 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.21 5.16 0.00 1.45 1.44 1.02 0.98 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 87 I 8.55 4.71 1.86 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 1.25 1.22 0.89 0.00 0.00 88 L 8.50 5.07 0.00 1.82 1.67 0.64 0.07 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 89 S 8.70 4.47 0.00 3.89 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 90 A 8.36 4.08 1.40 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 0.00 0.00 0.00 91 R 7.78 4.07 0.00 1.86 2.04 0.00 3.17 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 92 D 8.46 4.53 0.00 2.87 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 93 V 7.64 4.31 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 0.82 0.00 0.00 0.93 0.00 0.00 94 L 8.96 4.42 0.00 1.58 1.73 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.60 4.59 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.31 4.85 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 0.78 0.00 0.00 0.94 0.00 0.00 97 V 8.44 3.98 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 0.66 0.00 0.00 0.95 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.