NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 3.9342 8.0249 121.4205 61.1007 37.7578 174.8764 6 K 4.1952 8.2783 126.2085 53.0861 32.9132 174.1449 7 P 4.2644 0.0000 0.0000 62.6036 32.9403 176.4394 8 L 4.2810 8.7825 122.3376 54.3441 42.6798 176.0535 9 E 3.7140 7.7507 117.2611 57.5065 29.2280 174.8627 10 D 4.9085 9.1930 123.0190 53.8771 40.5386 174.9616 11 K 4.7452 7.8114 117.4866 56.0233 33.7938 176.2874 12 I 4.7789 8.5539 114.3707 59.2608 41.6184 173.5691 13 L 4.9781 8.6452 126.5479 53.5223 43.9437 175.0587 14 V 4.7525 8.7317 126.6190 61.1267 34.6691 174.0512 15 Q 5.0134 9.0175 128.9874 54.6043 29.9542 174.9710 16 A 4.4970 8.4902 128.9118 52.3612 19.3088 176.6879 *22 T 4.2400 8.1932 114.8253 63.7606 69.9444 173.9138 23 T 4.5446 7.9914 119.3103 61.4140 71.1064 175.4344 24 A 4.0037 8.7228 128.4080 54.2276 18.7024 177.8956 25 S 4.3864 7.6713 109.1336 58.3197 63.2728 174.5334 26 G 4.2814 8.5371 109.4016 45.3627 0.0000 173.1063 27 L 4.7002 7.9867 118.4808 52.3617 44.6631 175.6331 28 V 4.3492 8.2934 122.1083 61.4215 32.3236 175.5486 29 I 4.2514 7.9826 128.8633 58.7557 36.7520 173.8128 30 P 3.9988 0.0000 0.0000 63.5914 31.4305 175.0594 *37 P 4.4828 0.0000 0.0000 62.6312 31.4653 175.3800 38 Q 4.4173 7.5549 124.1512 54.2254 32.0335 173.3142 39 E 4.8030 7.9278 122.1665 54.4097 33.0273 174.3047 40 G 4.2274 8.0704 108.7031 46.6580 0.0000 171.8299 41 T 5.2560 7.8742 115.6476 61.3437 71.4505 174.3878 42 V 3.8578 9.0711 127.5143 63.2703 31.8593 176.3346 43 V 3.7743 8.4585 127.8920 64.0841 33.0058 175.6011 44 A 4.7354 7.5467 119.7498 50.6534 22.5124 175.3179 45 V 4.5582 8.2181 118.6177 61.4949 35.2750 174.5826 46 G 4.0784 7.9519 112.5081 44.0891 0.0000 171.7568 47 P 4.2414 0.0000 0.0000 66.6303 31.2960 176.4922 48 G 4.1754 7.8609 100.5940 44.0000 0.0000 173.4450 49 R 4.0307 8.3932 118.8132 55.3131 30.4910 177.2088 50 W 4.2938 8.7269 125.2530 57.0020 30.0298 176.1691 51 D 4.7440 9.5721 120.0230 53.0955 39.8568 178.6991 52 E 4.1334 8.7960 120.0387 60.9207 29.2952 179.0717 53 D 4.4338 8.2218 116.5522 53.5274 40.2524 182.0135 54 G 4.0102 8.2149 104.9033 46.2945 0.0000 174.6084 55 E 4.1603 7.9722 117.7158 58.6846 29.6067 176.9937 56 K 4.9755 7.9707 117.2232 54.8919 36.8352 174.1095 57 R 4.5966 7.7487 118.7364 54.2860 32.0394 176.4784 58 I 3.9606 8.3857 124.6813 60.6027 38.1916 174.2400 59 P 4.6624 0.0000 0.0000 61.6716 32.4466 175.6758 60 L 4.4440 8.0490 120.2115 54.4399 42.6275 176.3415 61 D 4.9239 8.4029 120.3604 54.5089 41.4096 176.8664 62 V 4.5616 7.6080 110.4147 59.5658 35.5938 174.7162 63 A 4.7905 9.9909 125.7618 49.6572 22.2816 175.4532 64 E 4.3170 8.5845 118.6483 58.2460 29.8585 178.6518 65 G 4.0319 9.6054 110.6408 45.7146 0.0000 173.9193 66 D 4.4637 7.9358 121.0118 54.7401 42.1595 175.2722 67 T 4.8585 8.5799 118.2804 61.1195 68.9364 173.7877 68 V 5.0646 8.7642 121.5672 59.6698 35.9486 174.4517 69 I 4.9831 8.5158 122.9029 59.8511 39.8948 174.7625 70 Y 5.4660 7.9844 124.2109 55.8650 42.1081 173.7171 71 S 5.0895 8.6476 113.8182 56.7911 65.4933 174.5752 72 K 4.4925 8.3731 118.6535 56.3263 32.5342 176.3808 73 Y 4.2627 7.0906 117.8153 59.7816 38.1173 177.2379 74 G 3.9721 9.1804 110.6390 45.7988 0.0000 174.0014 75 G 3.8180 8.1235 106.9399 46.6171 0.0000 174.2107 76 T 4.6313 8.2076 116.3237 61.2748 71.2988 172.8477 77 E 4.8924 8.7728 128.0030 55.9254 30.8211 175.8765 78 I 4.7007 9.3370 119.6218 59.6867 41.3166 173.5937 79 K 5.1005 8.7078 124.9304 55.1447 34.4762 175.7020 80 Y 4.5181 9.3842 125.2501 57.6283 41.7967 174.5521 81 N 4.0711 9.5188 127.1595 54.1908 35.9670 174.7430 82 G 3.9696 8.0245 104.9610 45.1015 0.0000 172.5759 83 E 4.3471 7.7425 118.9044 54.4804 31.5839 174.1289 84 E 4.7473 8.0682 122.4881 54.7771 31.6865 174.1902 85 Y 5.5504 8.8978 124.5094 56.2820 41.9805 174.7120 86 L 5.0805 9.0889 121.1377 53.2594 45.7843 175.7869 87 I 4.7398 8.7149 125.6985 59.8594 38.1652 174.6086 88 L 4.9349 8.3241 127.5679 53.3216 43.8608 176.4213 89 S 4.4315 8.6262 114.4347 57.8870 63.3544 175.0148 90 A 3.9982 8.3446 128.9276 55.2754 18.2893 180.2505 91 R 4.0457 7.8265 114.2192 59.0904 30.3002 177.6147 92 D 4.5421 8.2548 117.3615 55.6342 41.2902 176.1890 93 V 4.1822 7.6474 119.7512 62.4706 31.4875 175.1799 94 L 4.5376 8.8506 128.1543 56.7965 42.9026 176.5564 95 A 4.6474 7.6553 117.8389 51.1919 22.8070 175.3750 96 V 4.8641 8.3155 111.6173 59.6733 35.0055 176.8698 97 V 3.9831 8.3349 116.4099 61.5696 31.7036 175.7759 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 1.65 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.87 0.80 0.00 0.00 6 K 8.28 4.20 0.00 1.75 1.70 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.46 7.81 7 P 0.00 4.26 0.00 2.05 1.91 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 8 L 8.78 4.28 0.00 1.74 1.58 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 9 E 7.75 3.71 0.00 2.16 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 2.31 2.38 0.00 10 D 9.19 4.91 0.00 2.81 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 11 K 7.81 4.75 0.00 1.71 1.67 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.64 1.51 7.81 12 I 8.55 4.78 1.91 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 1.02 0.72 0.87 0.00 0.00 13 L 8.65 4.98 0.00 1.66 1.44 0.81 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 14 V 8.73 4.75 1.81 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 0.92 0.00 0.00 0.61 0.00 0.00 15 Q 9.02 5.01 0.00 2.59 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.67 0.00 0.00 0.00 0.00 0.00 2.30 2.15 0.00 16 A 8.49 4.50 1.29 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 0.00 0.00 0.00 *22 T 8.19 4.24 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 1.24 0.00 0.00 23 T 7.99 4.54 4.37 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 1.30 0.00 0.00 24 A 8.72 4.00 1.29 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 0.00 0.00 0.00 25 S 7.67 4.39 0.00 4.08 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 26 G 8.54 4.28 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 0.00 27 L 7.99 4.70 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 1.54 0.00 0.00 0.00 0.00 0.00 0.00 28 V 8.29 4.35 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 7.98 4.25 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.72 0.91 0.00 0.00 30 P 0.00 4.00 0.00 2.03 2.10 0.00 3.69 0.00 0.00 3.74 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 4.48 0.00 1.99 2.01 0.00 3.63 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 1.90 2.02 0.00 38 Q 7.55 4.42 0.00 1.84 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 39 E 7.93 4.80 0.00 1.91 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.47 0.00 40 G 8.07 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 0.00 0.00 0.00 0.00 41 T 7.87 5.26 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 1.26 0.00 0.00 42 V 9.07 3.86 2.24 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 0.91 0.00 0.00 0.98 0.00 0.00 43 V 8.46 3.77 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 0.65 0.00 0.00 1.08 0.00 0.00 44 A 7.55 4.74 1.10 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 0.00 0.00 45 V 8.22 4.56 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 0.77 0.00 0.00 0.97 0.00 0.00 46 G 7.95 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 47 P 0.00 4.24 0.00 1.92 1.98 0.00 3.70 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 48 G 7.86 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 49 R 8.39 4.03 0.00 1.88 1.90 0.00 3.14 0.00 0.00 3.34 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 50 W 8.73 4.29 0.00 3.38 3.27 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 51 D 9.57 4.74 0.00 2.56 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 8.80 4.13 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 8.22 4.43 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 8.21 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 55 E 7.97 4.16 0.00 2.19 2.16 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 2.40 2.38 0.00 56 K 7.97 4.98 0.00 1.76 1.98 0.00 1.48 0.00 0.00 1.85 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.48 7.81 57 R 7.75 4.60 0.00 1.21 1.39 0.00 2.66 0.00 0.00 2.80 7.19 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 8.39 3.96 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 1.20 1.43 0.88 0.00 0.00 59 P 0.00 4.66 0.00 1.99 1.90 0.00 3.62 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 1.95 2.01 0.00 60 L 8.05 4.44 0.00 1.60 1.56 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.40 4.92 0.00 2.65 2.67 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 62 V 7.61 4.56 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 9.99 4.79 1.15 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 64 E 8.58 4.32 0.00 1.96 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 2.32 0.00 65 G 9.61 4.03 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 0.00 0.00 0.00 66 D 7.94 4.46 0.00 2.82 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 67 T 8.58 4.86 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 1.26 0.00 0.00 68 V 8.76 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 0.78 0.00 0.00 1.11 0.00 0.00 69 I 8.52 4.98 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 1.24 0.85 0.88 0.00 0.00 70 Y 7.98 5.47 0.00 3.20 3.08 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 71 S 8.65 5.09 0.00 4.00 4.03 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 72 K 8.37 4.49 0.00 1.76 1.90 0.00 1.64 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.65 1.45 7.81 73 Y 7.09 4.26 0.00 3.05 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 74 G 9.18 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 8.12 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 0.00 0.00 0.00 76 T 8.21 4.63 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 77 E 8.77 4.89 0.00 2.00 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 2.31 2.42 0.00 78 I 9.34 4.70 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.02 0.99 0.00 0.00 79 K 8.71 5.10 0.00 1.68 1.76 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.65 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.43 7.81 80 Y 9.38 4.52 0.00 3.10 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 81 N 9.52 4.07 0.00 2.15 2.49 0.00 0.00 7.32 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 8.02 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 83 E 7.74 4.35 0.00 1.93 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 2.18 2.42 0.00 84 E 8.07 4.75 0.00 1.93 1.69 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 2.25 2.34 0.00 85 Y 8.90 5.55 0.00 3.19 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 86 L 9.09 5.08 0.00 1.48 1.44 1.01 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.71 4.74 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 8.32 4.93 0.00 1.82 1.66 0.58 0.28 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 89 S 8.63 4.43 0.00 3.88 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 90 A 8.34 4.00 1.37 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 0.00 0.00 91 R 7.83 4.05 0.00 1.85 2.04 0.00 3.16 0.00 0.00 3.23 7.39 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 8.25 4.54 0.00 2.91 3.01 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 93 V 7.65 4.18 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 0.81 0.00 0.00 0.94 0.00 0.00 94 L 8.85 4.54 0.00 1.59 1.73 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.66 4.65 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 8.32 4.86 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 8.33 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 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.