NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 D 4.6605 8.3644 119.5599 53.0784 41.6114 174.1843 33 Y 4.3918 8.3144 118.8057 56.8937 39.6714 169.2265 34 V 3.9021 7.0137 126.4844 61.1969 34.4620 175.0135 35 E 3.9879 8.3852 123.6959 55.3280 29.4305 173.4707 36 Q 4.2028 8.4218 125.1114 53.7027 27.9683 176.0744 37 R 3.9226 8.3407 123.2614 56.0235 30.6503 176.2188 38 I 3.6724 8.2119 124.4014 61.3078 38.5585 175.5343 39 D 4.5951 8.3410 124.8679 51.8103 43.4011 175.9247 40 L 4.0251 8.3997 128.2701 57.4736 41.6440 179.1670 41 N 4.3470 8.1834 116.4162 56.4277 38.3628 177.2672 42 Q 3.9742 7.9197 117.8844 58.6711 28.9391 178.1098 43 L 4.0727 7.5661 120.6676 57.8652 42.3127 178.1772 44 L 4.5027 8.0830 116.8290 54.1652 42.7335 176.7343 45 I 4.3915 7.4527 119.9814 59.8957 38.5459 175.2785 46 Q 4.1983 8.8147 124.5078 58.1413 29.5317 176.4744 47 H 4.8731 7.6278 117.9617 52.4695 28.4400 172.5148 48 P 4.2931 0.0000 0.0000 65.6891 31.2014 178.8087 49 S 4.2956 8.1040 110.9249 59.8384 63.4758 174.0611 50 A 4.8795 8.4803 122.1929 51.7847 20.7740 174.9328 51 T 5.2820 8.1766 114.1146 63.3100 70.8339 173.3587 52 Y 5.1713 8.7650 123.1115 55.7366 42.3890 173.2946 53 F 5.4513 8.7611 113.9532 55.0157 40.5065 174.6048 54 V 4.3569 9.0010 121.9541 60.8738 34.6741 173.8908 55 K 4.9143 8.5386 128.0380 55.0669 33.2003 176.1179 56 A 4.2946 9.1366 130.0822 52.3302 19.6628 176.2605 57 S 4.9230 8.1598 115.4843 57.7738 66.6885 176.0140 58 G 3.9524 9.4685 114.0532 45.0399 0.0000 173.3356 59 D 4.9256 8.1196 117.7143 52.8836 39.9016 177.9896 60 S 3.2221 7.8053 116.0634 61.0809 63.3173 174.8837 61 M 4.8391 7.5589 120.7386 54.8421 32.9443 177.5516 62 I 3.9830 7.5542 115.4922 63.5783 37.7807 178.0315 63 D 4.3721 8.4021 120.5255 56.5594 40.6823 177.5022 64 G 3.6592 7.6916 106.3894 46.2868 0.0000 174.5941 65 G 3.9344 8.2476 108.3233 44.9936 0.0000 173.3917 66 I 4.2488 7.5217 121.3813 59.9294 38.3226 175.0039 67 S 4.6751 8.8651 120.9407 55.7863 66.2331 173.0533 68 D 4.4594 8.5645 121.1617 56.4071 41.0569 175.6716 69 G 4.1207 8.8157 114.6646 45.5950 0.0000 173.6710 70 D 4.5855 7.9210 118.8044 54.5732 42.4441 175.5463 71 L 5.0392 8.4667 120.8359 53.5920 43.7968 175.5482 72 L 5.0155 9.4216 124.6939 53.1498 44.0329 175.6364 73 I 4.5949 8.5719 125.8518 60.4785 38.4023 174.8882 74 V 4.4832 8.7891 128.3885 60.9606 33.7245 173.7663 75 D 5.1692 9.0225 128.3345 52.6964 42.8283 176.1461 76 S 4.8507 9.0168 120.0694 58.3611 63.7376 174.6217 77 A 4.4479 8.4817 123.0633 52.0794 19.0144 177.0506 78 I 4.5077 7.3077 109.6211 59.0165 39.9120 175.3702 79 T 4.0922 8.4149 120.4279 62.5749 68.9759 174.5735 80 A 4.0756 8.5828 129.5950 52.6878 19.1181 176.2892 81 S 4.7899 8.2027 115.7390 56.1182 66.8625 173.1699 82 H 4.3776 8.6367 121.3624 57.9919 29.7735 174.2827 83 G 4.0981 9.0555 115.4428 45.5255 0.0000 173.7835 84 D 4.5622 7.9330 119.1765 54.3826 42.3238 175.6520 85 I 4.6465 8.2482 122.3989 60.4242 38.9065 175.2802 86 V 4.9542 8.9232 119.9927 59.5738 36.2484 174.7881 87 I 4.7175 8.4553 123.2775 60.2361 38.4166 174.9821 88 A 5.5789 9.3711 128.1321 50.3633 23.5458 174.2189 89 A 4.8947 9.5333 120.7598 50.3110 21.8326 175.7042 90 V 4.3598 8.7287 123.8164 61.5568 33.2607 175.8002 91 D 4.6497 9.2235 130.3550 55.6236 38.5751 175.1887 92 G 3.8158 8.3209 104.0727 45.4940 0.0000 173.0052 93 E 4.6617 7.5534 119.3665 54.1710 32.1237 175.9071 94 F 5.1428 8.9294 123.3928 58.1337 40.1262 174.7188 95 T 4.5323 8.9854 109.6143 61.0590 72.4142 172.4020 96 V 4.7551 8.4119 123.1644 61.5086 33.0493 174.6290 97 K 4.7027 8.7704 126.3963 54.8531 37.7696 174.9337 98 K 4.7031 8.7007 122.9368 55.3655 33.6569 175.2726 99 L 4.5316 8.8816 130.8737 54.8134 43.4898 175.0173 100 Q 4.6592 9.2094 127.8725 54.5143 30.9537 175.6193 101 L 4.5617 8.9028 125.5129 54.8416 43.6109 176.8359 102 R 4.7462 7.8665 116.2620 53.4462 33.3093 173.8259 103 P 4.4659 0.0000 0.0000 64.9270 31.8883 176.3010 104 T 4.6780 7.3741 107.2402 59.3251 72.0209 173.3452 105 V 4.0768 8.2075 123.0956 63.4286 32.5742 174.7832 106 Q 5.0097 9.5641 125.7319 54.7324 34.1279 173.6615 107 L 5.1491 9.2687 122.2572 53.2452 44.1163 175.4312 108 I 4.8412 8.4171 118.5382 58.3972 40.3507 174.4365 109 P 4.8891 0.0000 0.0000 61.9133 33.4901 175.4798 110 M 4.7969 8.5782 115.1900 53.2574 32.8425 175.3750 111 N 4.9131 7.7173 116.5251 52.5735 42.1170 174.8587 112 S 4.1982 9.0311 121.2342 60.9965 63.0169 175.2291 113 A 4.1895 8.3958 122.6431 53.4338 18.7316 176.7561 114 Y 4.5428 7.9190 113.2122 56.4316 39.8811 175.2858 115 S 4.8526 8.2511 118.0391 56.0597 65.1401 172.5483 116 P 4.6892 0.0000 0.0000 63.0110 32.4601 175.6772 117 I 4.5225 8.7158 122.1264 59.9823 39.8120 175.2380 118 T 4.4729 8.6236 123.9955 63.0920 69.7674 175.3423 119 I 4.2843 8.1264 126.9387 60.0719 37.3506 175.8479 120 S 4.5802 8.7160 124.3662 56.8934 64.5534 175.5486 121 S 4.2115 8.4547 114.7620 61.2670 62.7684 174.9173 122 E 4.2545 8.0935 118.3464 56.8979 29.7721 175.6751 123 D 5.0672 7.5835 118.8954 52.6607 43.3496 175.5885 124 T 4.5798 8.5677 111.2149 59.9523 71.0859 172.5270 125 L 4.8799 8.5386 128.2718 53.3539 44.5210 175.1903 126 D 4.3975 8.5035 124.7672 52.8850 44.4093 173.8138 127 V 4.5798 8.1804 126.5387 61.8635 32.3789 175.3824 128 F 4.6904 10.7487 126.1668 56.8297 39.9458 175.8048 129 G 4.3789 7.5453 110.3193 44.6575 0.0000 171.1914 130 V 4.6539 7.8363 121.1756 60.8850 33.4884 175.1203 131 V 4.1951 8.6022 129.2811 63.0330 31.2299 175.4563 132 I 4.2737 8.5649 121.5797 62.1282 39.3808 175.4464 133 H 5.0453 7.8657 117.6063 54.1238 33.5905 172.3954 134 V 4.7756 8.3916 119.8035 61.1547 34.1987 174.8355 135 V 4.2382 8.9284 128.3995 61.2921 33.0799 174.1624 136 K 4.7683 8.5631 127.6570 55.0214 33.2670 176.5302 137 A 4.5515 8.5277 127.4700 51.4491 20.1918 176.6833 138 M 4.4963 8.7998 120.9875 55.1723 34.8542 176.9152 *139 R 4.2636 8.1939 120.4860 56.2407 29.4582 179.2843 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 32 D 8.36 4.66 0.00 2.71 2.54 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 0.00 0.00 0.00 0.00 33 Y 8.31 4.39 0.00 2.97 2.92 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 0.00 0.00 0.00 34 V 7.01 3.90 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 0.70 0.00 0.00 0.80 0.00 0.00 35 E 8.39 3.99 0.00 2.03 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 0.00 2.23 1.90 0.00 36 Q 8.42 4.20 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 37 R 8.34 3.92 0.00 1.75 1.83 0.00 3.24 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 38 I 8.21 3.67 1.87 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 1.29 0.92 0.90 0.00 0.00 39 D 8.34 4.60 0.00 2.75 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.40 4.03 0.00 1.70 1.67 0.88 0.66 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 41 N 8.18 4.35 0.00 2.73 2.87 0.00 0.00 7.18 8.09 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 42 Q 7.92 3.97 0.00 2.42 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.07 0.00 0.00 0.00 0.00 0.00 2.36 1.98 0.00 43 L 7.57 4.07 0.00 1.69 1.83 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.08 4.50 0.00 1.66 1.65 0.84 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 45 I 7.45 4.39 2.04 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 1.33 0.56 0.95 0.00 0.00 46 Q 8.81 4.20 0.00 1.86 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.19 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 47 H 7.63 4.87 0.00 3.25 3.23 0.00 5.83 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 P 0.00 4.29 0.00 2.20 2.23 0.00 3.84 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 49 S 8.10 4.30 0.00 4.03 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 50 A 8.48 4.88 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 51 T 8.18 5.28 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 1.28 0.00 0.00 52 Y 8.77 5.17 0.00 2.89 2.98 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 0.00 0.00 0.00 0.00 53 F 8.76 5.45 0.00 3.04 3.02 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 0.00 0.00 0.00 54 V 9.00 4.36 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 0.89 0.00 0.00 1.02 0.00 0.00 55 K 8.54 4.91 0.00 1.92 1.72 0.00 1.87 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.66 7.81 56 A 9.14 4.29 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 57 S 8.16 4.92 0.00 3.71 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 G 9.47 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 0.00 0.00 0.00 0.00 59 D 8.12 4.93 0.00 2.87 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 7.81 3.22 0.00 3.42 3.17 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 61 M 7.56 4.84 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.33 0.00 62 I 7.55 3.98 1.87 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 1.60 1.54 0.96 0.00 0.00 63 D 8.40 4.37 0.00 2.73 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 64 G 7.69 3.66 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 0.00 0.00 0.00 65 G 8.25 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 66 I 7.52 4.25 1.99 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 1.41 0.74 0.90 0.00 0.00 67 S 8.87 4.68 0.00 3.93 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.56 4.46 0.00 2.61 2.61 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 69 G 8.82 4.12 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 0.00 70 D 7.92 4.59 0.00 2.71 2.61 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 71 L 8.47 5.04 0.00 1.57 1.56 0.45 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 72 L 9.42 5.02 0.00 1.60 1.56 0.92 0.56 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 73 I 8.57 4.59 1.90 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 1.14 0.66 0.93 0.00 0.00 74 V 8.79 4.48 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 0.00 0.00 0.82 0.00 0.00 0.72 0.00 0.00 75 D 9.02 5.17 0.00 2.70 2.49 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 76 S 9.02 4.85 0.00 4.06 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 77 A 8.48 4.45 1.16 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 78 I 7.31 4.51 1.88 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 1.55 0.78 0.99 0.00 0.00 79 T 8.41 4.09 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 1.20 0.00 0.00 80 A 8.58 4.08 1.24 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 81 S 8.20 4.79 0.00 3.98 3.75 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 82 H 8.64 4.38 0.00 3.11 3.20 0.00 5.69 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 83 G 9.06 4.10 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 0.00 84 D 7.93 4.56 0.00 2.87 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 85 I 8.25 4.65 1.86 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 1.33 0.72 0.91 0.00 0.00 86 V 8.92 4.95 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 1.01 0.00 0.00 87 I 8.46 4.72 2.12 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 1.20 0.92 1.04 0.00 0.00 88 A 9.37 5.58 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 89 A 9.53 4.89 1.05 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 0.00 0.00 90 V 8.73 4.36 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 0.96 0.00 0.00 0.95 0.00 0.00 91 D 9.22 4.65 0.00 2.87 2.70 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 0.00 0.00 0.00 92 G 8.32 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 93 E 7.55 4.66 0.00 2.02 1.85 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 2.20 2.38 0.00 94 F 8.93 5.14 0.00 2.88 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 95 T 8.99 4.53 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 96 V 8.41 4.76 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 0.83 0.00 0.00 0.95 0.00 0.00 97 K 8.77 4.70 0.00 1.70 1.64 0.00 1.72 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.54 7.81 98 K 8.70 4.70 0.00 1.83 1.83 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.47 7.81 99 L 8.88 4.53 0.00 1.80 1.62 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 9.21 4.66 0.00 2.17 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.36 0.00 0.00 0.00 0.00 0.00 2.22 2.47 0.00 101 L 8.90 4.56 0.00 1.73 1.71 0.98 0.91 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 0.00 102 R 7.87 4.75 0.00 1.70 1.77 0.00 3.16 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 103 P 0.00 4.47 0.00 2.18 2.19 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 104 T 7.37 4.68 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 0.00 105 V 8.21 4.08 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 1.00 0.00 0.00 0.93 0.00 0.00 106 Q 9.56 5.01 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.51 0.00 0.00 0.00 0.00 0.00 2.29 2.49 0.00 107 L 9.27 5.15 0.00 1.53 1.59 0.95 0.74 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 0.00 108 I 8.42 4.84 1.88 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 1.38 0.91 0.92 0.00 0.00 109 P 0.00 4.89 0.00 2.18 2.12 0.00 3.75 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 2.04 2.11 0.00 110 M 8.58 4.80 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 111 N 7.72 4.91 0.00 2.85 2.74 0.00 0.00 6.78 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 0.00 112 S 9.03 4.20 0.00 4.04 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 0.00 113 A 8.40 4.19 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 0.00 114 Y 7.92 4.54 0.00 2.97 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 0.00 115 S 8.25 4.85 0.00 3.86 3.79 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 0.00 116 P 0.00 4.69 0.00 2.01 2.04 0.00 3.64 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 2.05 2.15 0.00 117 I 8.72 4.52 1.98 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 1.26 0.71 0.93 0.00 0.00 118 T 8.62 4.47 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 0.00 119 I 8.13 4.28 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 1.23 0.84 0.90 0.00 0.00 120 S 8.72 4.58 0.00 4.13 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 0.00 121 S 8.45 4.21 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 0.00 122 E 8.09 4.25 0.00 1.96 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 0.00 2.28 2.38 0.00 123 D 7.58 5.07 0.00 2.81 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 0.00 124 T 8.57 4.58 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 1.19 0.00 0.00 125 L 8.54 4.88 0.00 1.63 1.55 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.50 4.40 0.00 2.75 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 0.00 0.00 0.00 0.00 127 V 8.18 4.58 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 0.88 0.00 0.00 0.91 0.00 0.00 128 F 10.75 4.69 0.00 3.21 3.29 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 0.00 129 G 7.55 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 0.00 130 V 7.84 4.65 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 1.09 0.00 0.00 0.94 0.00 0.00 131 V 8.60 4.20 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 0.79 0.00 0.00 0.91 0.00 0.00 132 I 8.56 4.27 1.65 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 1.30 0.63 0.86 0.00 0.00 133 H 7.87 5.05 0.00 3.06 3.15 0.00 5.57 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.39 4.78 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 0.78 0.00 0.00 0.93 0.00 0.00 135 V 8.93 4.24 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 0.85 0.00 0.00 0.88 0.00 0.00 136 K 8.56 4.77 0.00 1.66 1.71 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.38 1.42 7.81 137 A 8.53 4.55 1.21 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 0.00 0.00 138 M 8.80 4.50 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.47 0.00 *139 R 8.19 4.26 0.00 1.88 2.14 0.00 3.30 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.10 0.00 * Residues marked with a * may have inaccurate shift predictions.