NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 26 C 4.6747 8.4549 118.1666 56.5774 41.1242 175.5620 27 R 4.5218 8.7721 125.4023 53.8966 34.3248 171.0468 28 E 3.8514 9.4278 119.5491 57.9538 31.1424 177.0260 29 K 3.6308 8.3364 117.8809 55.8725 29.2935 175.7451 30 Q 5.1281 6.8088 121.7155 56.1968 30.1845 172.4382 31 Y 4.9294 7.9334 119.1008 54.9330 41.0806 173.9560 32 L 5.2189 8.5883 118.8627 54.1703 44.0334 176.8153 33 I 4.6630 7.5765 120.1047 61.5890 37.3440 177.9115 34 N 4.5390 9.3219 127.0005 57.2004 38.2040 174.4744 35 S 4.6030 7.5778 113.6610 58.1799 66.5027 176.0165 36 Q 4.5149 7.5634 121.9543 54.5985 30.6174 174.0619 37 C 5.1405 8.4929 119.7553 55.6584 38.3864 174.0846 38 C 4.7993 8.1880 121.0003 55.3729 42.4645 173.1683 39 S 4.7120 7.7776 115.1567 57.2217 63.4423 175.5405 40 L 4.5876 8.3068 123.5694 54.8855 42.6542 176.7211 41 C 5.2282 8.6388 115.4945 55.5282 38.7641 174.2180 42 Q 2.5244 8.3163 120.6034 55.0762 29.6610 174.1859 43 P 4.3247 0.0000 0.0000 63.4010 30.0526 174.9794 44 G 4.3356 7.3925 120.2413 45.1582 0.0000 170.1913 45 Q 4.5203 7.3459 120.4098 53.8231 31.5067 174.9282 46 K 4.2623 8.3849 123.0590 56.7093 34.1810 175.1402 47 L 4.6700 9.3426 123.3018 54.0763 43.4750 175.7824 48 V 4.1483 8.5121 124.9559 64.2011 33.0402 175.7278 49 S 4.8046 7.6519 114.9345 56.7641 67.4893 173.2134 50 D 5.1970 8.7822 123.0251 54.0970 41.9393 174.6026 51 C 4.8918 8.5272 114.4341 54.8546 44.1809 173.3467 52 T 4.3099 8.8673 118.2078 61.8283 67.2461 174.3276 53 E 4.7957 8.9937 119.4644 55.6946 29.9231 176.4557 54 F 4.8797 8.0757 116.3810 58.6494 44.6642 174.6464 55 T 4.6629 7.7808 109.1726 59.8992 71.4661 173.1375 56 E 4.5183 8.3690 121.8364 54.4823 31.9721 175.2168 57 T 4.3096 8.3427 109.2823 62.4249 69.0058 173.3294 58 E 4.8820 8.9418 123.2117 54.7498 32.6832 174.2809 59 C 5.2344 8.6227 117.9368 55.5050 39.3628 173.2587 60 L 4.8583 7.8580 118.8876 52.4054 44.0808 174.5748 61 P 4.7918 0.0000 0.0000 62.6021 32.3188 176.8324 62 C 4.4428 8.3543 119.6292 56.4124 40.9805 174.4556 63 G 3.9204 8.2442 111.4306 46.1279 0.0000 172.6519 64 E 4.5860 8.0994 116.4770 55.6677 29.5635 176.1930 65 S 4.7949 7.3470 113.6629 58.1019 65.6105 174.5840 66 E 5.0036 7.6632 118.7166 56.0166 32.5502 174.1376 67 F 4.7005 8.2553 114.0467 57.4601 41.5785 173.5879 68 L 4.0853 7.8589 119.2407 53.2540 44.7000 176.4742 69 D 4.9391 8.1901 129.5126 51.7271 39.3489 176.6158 70 T 4.1925 7.1256 112.7837 62.1727 70.3651 172.6191 71 W 4.7467 9.6102 128.4977 56.9982 28.8686 174.7379 72 N 5.1682 8.4283 123.4696 50.6584 40.5765 175.1607 73 R 5.0042 8.0343 113.7840 55.8520 29.4683 175.0410 74 E 4.2773 8.4388 119.9648 56.9476 30.5402 176.6810 75 T 4.0215 8.1738 112.1900 61.5139 69.9832 174.4891 76 H 4.7632 7.7623 118.5647 53.9733 32.1732 174.0272 77 C 4.4415 8.6136 121.3542 56.9765 42.1511 171.9934 78 H 5.1784 8.2712 117.6751 54.4940 30.5765 174.7846 79 Q 4.8755 8.5046 119.5499 55.3299 30.0903 175.2312 80 H 4.5868 9.3350 119.7834 56.1568 29.2316 175.4148 81 K 3.9523 8.9341 124.1143 57.0610 32.6243 174.9317 82 Y 4.7112 8.4454 124.3739 56.2707 40.8041 177.4593 83 C 4.3155 7.8455 127.6814 54.6276 36.2687 172.8978 84 D 3.8848 7.3922 119.6657 53.6992 41.5501 175.3113 85 P 4.0835 0.0000 0.0000 65.6344 31.5032 178.2629 86 N 4.4757 8.5254 116.2562 55.7771 38.6641 175.6844 87 L 4.2949 7.9783 116.6485 54.7305 42.3163 177.1974 88 G 2.9739 8.2432 107.8369 45.9805 0.0000 173.1163 89 L 4.8427 7.1669 118.1927 52.6411 45.1426 175.6946 90 R 4.4842 8.2661 114.2609 54.7927 32.9812 174.7570 91 V 3.5566 8.2378 121.3984 63.6973 31.2457 175.1607 92 Q 4.1903 9.0604 131.3357 58.5442 30.0237 176.2276 93 Q 4.4018 7.7089 120.2169 54.6046 32.3936 174.5038 94 K 4.0994 8.8464 126.3633 56.8418 32.9909 175.7955 95 G 4.0455 8.3260 106.8389 43.8724 0.0000 173.6522 96 T 4.5094 8.3177 115.1055 60.5075 71.1898 175.0511 97 S 4.6808 8.5812 116.1525 59.1520 62.8207 174.9830 98 E 5.2023 8.4440 115.0999 57.2571 31.7158 174.7673 99 T 4.4990 7.7245 109.9628 60.7386 71.9682 172.8153 100 D 3.6428 7.7577 124.7575 53.5802 42.2450 175.6845 101 T 4.3628 8.1605 118.5168 63.6335 69.7202 173.8696 102 I 4.4565 8.6593 124.6032 59.9119 39.7990 174.6922 103 C 5.3789 8.6393 124.1020 56.0613 43.2846 172.6378 104 T 4.6071 8.0354 108.5017 60.8497 72.0403 172.3793 105 C 5.2179 8.5727 120.0719 56.5211 40.9886 172.9490 106 E 4.5258 8.2187 119.1541 54.8776 31.0366 176.2942 107 E 4.0653 8.2626 120.7694 58.5950 29.7453 177.3551 108 G 3.8660 9.4551 111.4039 44.4697 0.0000 171.9790 109 W 5.9341 8.4547 118.3839 54.2059 33.2336 173.9976 110 H 5.9463 8.2080 114.6495 54.1699 31.5758 173.6038 111 C 5.0824 8.8448 116.4861 56.7989 41.0052 173.6076 112 T 4.5478 8.3736 116.3857 62.2999 68.4443 174.6944 113 S 4.5935 7.6418 115.3920 58.2626 64.4525 175.5631 114 E 3.7018 8.4361 119.6181 60.1314 29.4890 176.6102 115 A 4.0590 7.6585 121.7462 52.1573 19.5477 179.3833 116 C 4.7101 8.5676 125.9859 56.6856 41.7428 172.9514 117 E 4.1089 8.0325 124.1795 58.9547 30.0283 177.6984 118 S 4.9390 7.7989 111.6549 56.6881 66.8839 172.7334 119 C 6.0953 8.9538 117.2637 54.5814 43.4699 173.6227 120 V 4.6946 8.0986 119.3611 60.7640 35.1607 174.4818 121 L 3.1348 7.5497 124.8700 54.1521 42.2172 175.7734 122 H 4.2628 8.9471 122.5475 55.7227 29.1589 175.2681 123 R 3.8046 8.6103 120.3576 56.3824 29.4550 176.4319 124 S 4.8301 8.3359 117.0938 56.5800 65.3774 170.8333 125 C 4.8178 7.6791 114.2348 56.3623 48.2937 176.9282 *132 K 4.2436 7.5896 121.3914 55.2257 35.5725 178.9388 133 Q 4.2426 7.8947 120.7062 55.6728 29.9273 175.1395 134 I 4.0293 8.1982 119.6510 60.5340 40.0849 173.9863 135 A 4.9684 8.6205 123.2883 50.0060 22.3493 174.4405 136 T 4.7204 8.2542 108.0222 60.0090 72.1313 174.5856 137 G 4.1220 8.8037 108.8156 48.6273 0.0000 175.2759 138 V 4.3879 7.3307 108.2781 60.7541 33.8214 176.1179 139 S 4.3171 8.2765 115.2741 57.8966 62.9083 172.0762 140 D 4.9305 8.1862 124.6681 52.5607 43.6397 175.4629 141 T 4.7476 8.1436 112.0789 60.4408 70.4372 173.8719 142 I 4.4800 8.8053 122.2226 59.8377 41.1823 174.4740 143 C 5.0609 8.7777 127.7053 56.7263 42.2919 172.5930 144 E 5.2502 8.2938 119.4546 55.8760 30.3328 175.1143 145 P 4.3963 0.0000 0.0000 63.1234 31.3318 176.4769 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 26 C 8.45 4.67 0.00 2.96 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 27 R 8.77 4.52 0.00 1.77 1.75 0.00 3.21 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.69 0.00 28 E 9.43 3.85 0.00 1.83 1.77 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 2.28 2.32 0.00 29 K 8.34 3.63 0.00 1.45 1.16 0.00 1.18 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.30 0.66 7.81 30 Q 6.81 5.13 0.00 2.28 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.07 0.00 31 Y 7.93 4.93 0.00 3.10 3.14 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 0.00 0.00 0.00 0.00 32 L 8.59 5.22 0.00 1.78 1.71 1.01 0.62 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 33 I 7.58 4.66 1.95 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.85 0.99 0.00 0.00 34 N 9.32 4.54 0.00 2.73 2.90 0.00 0.00 6.63 7.57 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 35 S 7.58 4.60 0.00 3.92 3.92 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 36 Q 7.56 4.51 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.92 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 37 C 8.49 5.14 0.00 2.83 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 38 C 8.19 4.80 0.00 2.12 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.78 4.71 0.00 3.87 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 40 L 8.31 4.59 0.00 2.09 2.09 1.21 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 41 C 8.64 5.23 0.00 2.88 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 42 Q 8.32 2.52 0.00 1.78 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.09 0.00 0.00 0.00 0.00 0.00 2.12 2.22 0.00 43 P 0.00 4.32 0.00 1.73 2.01 0.00 2.88 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.55 0.00 44 G 7.39 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 0.00 0.00 0.00 0.00 45 Q 7.35 4.52 0.00 1.85 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.21 0.00 46 K 8.38 4.26 0.00 1.71 1.89 0.00 1.24 0.00 0.00 1.69 0.00 0.00 2.73 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.55 1.34 7.81 47 L 9.34 4.67 0.00 1.69 1.70 1.12 1.01 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 48 V 8.51 4.15 2.26 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 0.82 0.00 0.00 0.94 0.00 0.00 49 S 7.65 4.80 0.00 3.89 3.69 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 0.00 0.00 0.00 50 D 8.78 5.20 0.00 2.63 2.73 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 51 C 8.53 4.89 0.00 3.19 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 52 T 8.87 4.31 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 53 E 8.99 4.80 0.00 2.19 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 0.00 2.27 2.38 0.00 54 F 8.08 4.88 0.00 2.86 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 55 T 7.78 4.66 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 1.29 0.00 0.00 56 E 8.37 4.52 0.00 2.07 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 2.20 2.27 0.00 57 T 8.34 4.31 4.26 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 1.33 0.00 0.00 58 E 8.94 4.88 0.00 2.07 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 2.18 2.25 0.00 59 C 8.62 5.23 0.00 2.73 3.28 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 60 L 7.86 4.86 0.00 1.59 1.53 0.91 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 P 0.00 4.79 0.00 1.92 1.96 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 62 C 8.35 4.44 0.00 2.80 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 63 G 8.24 3.92 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 0.00 0.00 0.00 64 E 8.10 4.59 0.00 1.96 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 0.00 2.26 2.35 0.00 65 S 7.35 4.79 0.00 3.84 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 66 E 7.66 5.00 0.00 1.89 1.93 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 2.20 2.26 0.00 67 F 8.26 4.70 0.00 3.23 3.13 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 0.00 0.00 0.00 0.00 68 L 7.86 4.09 0.00 1.44 1.43 0.91 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 69 D 8.19 4.94 0.00 2.93 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 70 T 7.13 4.19 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 1.23 0.00 0.00 71 W 9.61 4.75 0.00 3.26 3.32 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 0.00 72 N 8.43 5.17 0.00 2.76 3.05 0.00 0.00 5.64 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 73 R 8.03 5.00 0.00 1.50 2.08 0.00 2.75 0.00 0.00 2.94 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.44 0.00 74 E 8.44 4.28 0.00 2.03 1.83 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 2.49 2.26 0.00 75 T 8.17 4.02 4.13 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 0.00 0.00 0.00 1.18 0.00 0.00 76 H 7.76 4.76 0.00 3.03 3.18 0.00 5.89 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.61 4.44 0.00 3.07 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 78 H 8.27 5.18 0.00 2.28 3.04 0.00 5.60 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 8.50 4.88 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 80 H 9.33 4.59 0.00 3.15 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 K 8.93 3.95 0.00 2.07 1.75 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.48 1.45 7.81 82 Y 8.45 4.71 0.00 2.88 2.85 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 0.00 83 C 7.85 4.32 0.00 2.71 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 84 D 7.39 3.88 0.00 2.88 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 P 0.00 4.08 0.00 2.13 2.14 0.00 3.67 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 2.03 1.93 0.00 86 N 8.53 4.48 0.00 2.85 2.96 0.00 0.00 7.00 7.77 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 87 L 7.98 4.29 0.00 1.81 1.68 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 88 G 8.24 2.97 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 89 L 7.17 4.84 0.00 1.55 1.44 0.86 0.93 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 90 R 8.27 4.48 0.00 1.71 1.94 0.00 2.87 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.49 0.00 91 V 8.24 3.56 2.01 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 0.69 0.00 0.00 0.83 0.00 0.00 92 Q 9.06 4.19 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.34 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 93 Q 7.71 4.40 0.00 2.08 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.57 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 94 K 8.85 4.10 0.00 1.61 1.71 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.70 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.40 1.43 7.81 95 G 8.33 4.05 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 0.00 96 T 8.32 4.51 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 1.19 0.00 0.00 97 S 8.58 4.68 0.00 4.05 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 98 E 8.44 5.20 0.00 2.01 2.15 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 2.22 2.11 0.00 99 T 7.72 4.50 4.11 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 1.19 0.00 0.00 100 D 7.76 3.64 0.00 1.86 2.31 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 0.00 101 T 8.16 4.36 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 1.22 0.00 0.00 102 I 8.66 4.46 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.10 0.87 0.00 0.00 103 C 8.64 5.38 0.00 2.78 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 0.00 104 T 8.04 4.61 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 0.00 105 C 8.57 5.22 0.00 2.93 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 0.00 106 E 8.22 4.53 0.00 1.16 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.79 0.00 107 E 8.26 4.07 0.00 2.15 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 2.34 2.34 0.00 108 G 9.46 3.87 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 0.00 0.00 0.00 109 W 8.45 5.93 0.00 3.15 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 0.00 110 H 8.21 5.95 0.00 3.40 3.71 0.00 5.82 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.84 5.08 0.00 2.93 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 0.00 112 T 8.37 4.55 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 0.00 113 S 7.64 4.59 0.00 4.02 3.92 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 0.00 114 E 8.44 3.70 0.00 1.93 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 2.31 2.41 0.00 115 A 7.66 4.06 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 0.00 116 C 8.57 4.71 0.00 2.95 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 0.00 117 E 8.03 4.11 0.00 2.02 2.01 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 2.33 2.32 0.00 118 S 7.80 4.94 0.00 3.90 3.94 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 0.00 119 C 8.95 6.10 0.00 3.16 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 0.00 120 V 8.10 4.69 1.94 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 1.01 0.00 0.00 0.98 0.00 0.00 121 L 7.55 3.13 0.00 1.05 0.96 0.41 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 122 H 8.95 4.26 0.00 2.86 3.25 0.00 5.69 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.61 3.80 0.00 1.88 1.94 0.00 2.96 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.61 0.00 124 S 8.34 4.83 0.00 3.94 3.87 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 0.00 125 C 7.68 4.82 0.00 3.03 2.97 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 *132 K 7.59 4.24 0.00 1.90 1.00 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.74 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.50 7.81 133 Q 7.89 4.24 0.00 2.32 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.48 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 134 I 8.20 4.03 1.84 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 1.26 0.90 0.90 0.00 0.00 135 A 8.62 4.97 1.11 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 0.00 0.00 136 T 8.25 4.72 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 1.22 0.00 0.00 137 G 8.80 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 0.00 138 V 7.33 4.39 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 0.74 0.00 0.00 0.95 0.00 0.00 139 S 8.28 4.32 0.00 3.83 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 0.00 140 D 8.19 4.93 0.00 2.44 2.41 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 0.00 141 T 8.14 4.75 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 1.11 0.00 0.00 142 I 8.81 4.48 1.85 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 1.21 1.31 0.98 0.00 0.00 143 C 8.78 5.06 0.00 2.88 3.03 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 0.00 144 E 8.29 5.25 0.00 2.09 1.94 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 2.06 2.15 0.00 145 P 0.00 4.40 0.00 2.05 2.01 0.00 3.70 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 2.02 2.08 0.00 * Residues marked with a * may have inaccurate shift predictions.