NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 G 3.9469 8.3544 109.7407 45.0774 0.0000 173.5402 25 Y 3.9765 8.5207 125.1629 57.2220 39.4096 173.2513 26 Q 4.3339 7.1907 124.8067 53.1134 32.8395 173.2276 27 P 4.3523 0.0000 0.0000 60.3092 32.7264 173.9355 28 P 4.2999 0.0000 0.0000 62.6840 31.6584 177.8158 29 S 4.3288 8.7532 115.2156 60.5223 62.8689 174.5582 30 D 4.9253 8.1793 118.9487 52.9364 39.8459 174.4219 31 Y 4.5615 8.1429 116.8772 56.4142 40.0449 175.1428 32 K 4.6346 8.3109 124.0977 54.0270 35.1050 175.5325 33 Q 4.0277 8.6370 126.5472 56.4134 29.5433 175.7311 34 C 4.4021 8.5472 122.5230 59.1831 27.5615 173.5415 35 K 4.3610 8.3761 123.7365 56.7157 33.2354 176.6008 36 H 5.0810 7.6051 114.4240 54.2372 29.0597 173.7349 37 L 4.1314 7.7846 119.3303 54.5486 42.5053 178.4797 38 K 4.3035 8.4451 122.8933 55.7617 32.8589 177.0633 39 S 4.3652 8.4001 115.9009 58.3258 63.6577 173.5035 40 F 4.7741 8.4685 124.1703 55.7280 41.7463 173.6243 41 P 4.3934 0.0000 0.0000 61.7522 29.5211 176.5410 42 V 3.6850 8.3572 127.2134 66.6539 32.1446 178.2855 43 S 4.1381 8.1763 113.7162 61.4067 62.8485 176.2516 44 E 4.0035 7.7362 119.8558 58.7899 29.4133 177.8832 45 L 4.0278 7.4830 120.0913 57.6107 42.3742 177.8325 46 K 4.4050 7.2795 117.9960 54.0283 29.6857 175.5602 47 G 4.2429 7.3828 109.0434 43.9369 0.0000 171.5774 48 D 4.4159 8.8246 122.2170 57.2146 41.2062 177.9717 49 N 4.4565 8.1954 114.8379 55.6907 37.4818 175.8669 50 K 4.1667 7.1264 114.1734 55.7504 32.6880 176.3273 51 E 4.7295 8.2889 120.0043 54.5730 32.6282 174.9397 52 L 4.6250 9.3820 127.2620 54.0942 43.1701 175.4884 53 W 5.7370 9.1932 125.6358 55.1676 32.6291 174.1256 54 L 4.5375 8.2901 122.6913 53.0334 46.1250 174.7780 *56 K 4.2649 8.3583 120.2060 56.2781 33.1140 174.6768 57 V 4.7886 8.1627 126.0687 59.9153 34.8465 173.2460 58 P 4.3059 0.0000 0.0000 62.5333 31.7355 177.6404 59 A 4.0666 8.5434 124.8538 54.9761 18.4741 178.4462 60 N 4.5364 8.0609 111.4004 54.3052 37.8205 175.0171 61 I 3.9834 7.2858 121.1919 60.6208 37.8720 175.3834 62 D 4.6284 8.4444 125.5402 52.6194 40.3230 176.3319 63 I 3.7512 8.2355 128.4602 64.0669 37.4516 178.9648 64 S 4.1818 8.1768 113.7146 61.1177 62.7972 175.2346 65 Q 4.2008 7.7054 118.1850 57.0067 28.9314 176.1035 66 L 4.3764 7.5976 118.4809 54.1342 42.4205 176.7425 67 K 4.4741 8.5680 120.8455 56.8544 34.0289 176.6014 68 S 4.5808 7.7005 110.6749 56.5233 65.8011 173.6881 69 L 4.5748 8.1830 121.8898 52.7039 41.9997 175.3870 70 P 4.6433 0.0000 0.0000 62.2387 31.2723 177.4749 71 L 3.9659 7.7272 117.8086 54.7010 42.2154 176.8782 72 D 4.6547 8.4641 122.4913 53.0835 40.9671 176.9097 73 T 4.2062 8.5457 122.3695 64.7393 67.7915 174.9278 74 D 4.5337 8.0144 120.5489 56.2913 41.3718 177.1475 75 A 4.2445 7.2894 121.5899 52.4541 19.2365 177.3460 76 T 4.2160 8.5551 118.2065 65.4395 70.1188 175.0612 77 V 4.9104 7.6756 119.9872 61.2527 34.2569 174.9464 78 S 4.7694 9.0079 121.9461 57.8267 66.2931 172.5638 79 T 5.3910 8.4952 108.3634 60.3872 72.0104 173.7473 80 V 4.4154 8.7841 122.3268 59.5074 34.5885 175.7927 81 E 4.5532 8.5428 129.2492 55.1398 29.3073 176.1970 82 L 4.1752 7.9082 119.1648 56.8688 42.9384 176.5067 83 G 3.9353 8.7553 112.5829 47.0520 0.0000 174.2152 84 S 4.5574 9.1680 115.8595 58.8610 64.2539 173.8818 85 K 4.0971 7.8540 117.9167 55.9308 32.6086 175.3442 86 N 4.9300 8.0420 120.5331 52.6844 40.0880 174.1332 87 F 5.0640 8.8424 123.3218 55.7892 43.5037 173.7821 88 N 5.1413 9.1598 118.7947 52.9647 40.2785 174.4153 89 V 4.8385 8.6547 121.3045 61.0808 35.2217 174.0296 90 L 5.0591 8.6419 128.4445 53.4057 45.2111 175.0588 91 Q 4.2314 8.9387 129.3202 54.9539 28.8812 175.8978 92 N 4.2549 8.5784 125.8939 56.5081 38.8480 177.9554 93 T 3.9067 7.5609 105.8691 64.0592 68.8741 175.6544 94 S 4.1628 7.6488 117.9531 61.4701 62.7064 175.0993 95 T 4.0008 7.1099 109.8450 61.5943 68.8283 174.6664 96 Q 3.9644 8.3877 122.4314 57.7657 29.4028 177.1601 97 E 4.0575 7.5944 117.6933 59.9535 29.5586 178.3238 98 G 4.0503 7.7867 106.1429 45.6169 0.0000 175.7937 99 S 3.9812 8.1054 117.1938 59.7824 63.3129 173.4383 100 D 4.8065 7.9041 120.3834 52.6328 41.5781 175.2069 101 N 5.3647 8.6018 125.4656 52.2377 39.9090 175.8374 102 T 4.3570 7.8857 107.5378 62.4493 69.6743 174.9627 103 N 4.4940 8.0411 119.7966 53.9682 38.1659 174.2693 104 L 4.5429 7.4766 118.8199 53.1124 42.4780 175.7740 105 S 4.6966 8.5123 118.4709 56.0612 65.3372 173.0652 106 L 4.3234 8.2155 125.9067 54.2468 43.2661 174.7836 107 L 5.0819 8.4635 126.7877 53.1532 43.2032 175.8373 108 I 4.6046 8.6118 118.2509 57.9979 40.8587 173.0855 109 P 5.0198 0.0000 0.0000 62.6078 30.7904 176.0865 110 S 4.4104 8.5391 119.6906 57.6834 63.8312 175.3349 111 E 4.1557 8.7441 123.1307 59.0415 29.5951 178.6082 112 K 3.9927 7.4732 115.9804 58.7685 32.3450 177.8294 113 K 4.4419 7.4636 125.3907 54.4822 32.6293 176.6806 114 K 4.2929 8.5587 121.5068 56.7026 31.5333 178.4557 115 E 4.6223 8.1126 116.2817 55.9112 31.1015 175.5700 116 T 4.7474 7.9665 110.5253 59.9010 71.7974 173.0523 117 L 5.2015 8.5108 122.9383 53.0026 44.7675 175.5981 118 K 4.7181 8.6713 119.6598 54.9969 36.6703 175.3179 119 V 4.2645 8.3135 121.0190 62.1584 32.4910 174.8070 120 A 4.1524 8.8367 130.1174 53.0818 19.0709 176.3397 121 T 4.9246 8.4310 110.6685 60.8141 72.5094 173.0725 122 S 4.8146 8.0737 120.4218 56.8607 66.3033 176.0250 123 K 4.0413 8.7712 123.9449 58.3944 31.5170 174.2196 124 D 4.9459 7.2976 115.9154 53.3078 41.0090 178.1469 125 N 4.1538 8.5103 113.0780 54.8716 36.5678 176.5957 126 K 4.1956 7.7794 118.1101 56.1124 32.8294 177.5859 127 S 4.6713 8.5676 122.0990 57.5783 62.6504 174.1843 128 V 3.6212 7.8259 124.0077 63.5062 31.5244 174.9507 129 Y 4.7715 7.8473 124.7331 54.5501 40.7023 175.2220 130 F 4.5027 8.6040 120.1077 57.8100 39.7116 175.4787 131 D 4.7754 9.3651 126.6794 57.0070 41.4552 177.2093 132 R 4.4650 8.0879 115.7491 54.0570 34.8300 174.4984 133 V 4.5667 8.3822 122.4145 61.0189 34.2951 174.0910 134 F 5.1374 9.3766 126.8313 55.9044 41.9794 175.1577 135 T 4.6200 8.8384 119.9969 61.9420 70.6740 173.2241 136 I 4.7454 8.7192 129.4006 60.2794 37.8694 175.9117 137 S 4.9249 8.9662 121.8201 56.1296 66.3804 173.6996 138 E 4.8080 8.8979 120.8153 56.4737 30.1266 177.0232 139 T 4.2994 8.5895 111.3785 60.2759 69.7992 174.3499 140 A 4.0294 8.5404 126.2746 52.9777 18.6960 177.3882 141 R 4.5944 8.3186 121.0472 54.5742 33.8680 175.7212 142 I 4.2175 8.0582 123.1783 58.8173 36.4685 174.1173 143 P 4.4192 0.0000 0.0000 62.6979 31.0994 176.6810 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 24 G 8.35 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 25 Y 8.52 3.98 0.00 3.05 2.86 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 26 Q 7.19 4.33 0.00 1.78 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.83 0.00 0.00 0.00 0.00 0.00 2.28 2.15 0.00 27 P 0.00 4.35 0.00 2.23 2.18 0.00 3.24 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 28 P 0.00 4.30 0.00 2.75 2.16 0.00 3.49 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.70 0.00 29 S 8.75 4.33 0.00 3.99 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 30 D 8.18 4.93 0.00 2.69 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 31 Y 8.14 4.56 0.00 3.09 2.95 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 32 K 8.31 4.63 0.00 1.67 1.64 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.39 7.81 33 Q 8.64 4.03 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 34 C 8.55 4.40 0.00 3.02 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 35 K 8.38 4.36 0.00 1.54 1.70 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.41 7.81 36 H 7.61 5.08 0.00 3.11 3.18 0.00 5.71 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 7.78 4.13 0.00 1.79 1.64 0.93 0.77 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 38 K 8.45 4.30 0.00 1.79 1.78 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.40 7.81 39 S 8.40 4.37 0.00 4.00 3.89 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 40 F 8.47 4.77 0.00 2.91 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 41 P 0.00 4.39 0.00 2.04 2.04 0.00 2.73 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 42 V 8.36 3.68 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 1.05 0.00 0.00 1.10 0.00 0.00 43 S 8.18 4.14 0.00 4.00 4.09 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 0.00 0.00 0.00 0.00 44 E 7.74 4.00 0.00 1.93 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 2.26 2.13 0.00 45 L 7.48 4.03 0.00 1.63 1.85 1.04 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.28 4.40 0.00 1.83 1.73 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.35 7.81 47 G 7.38 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 0.00 0.00 0.00 0.00 48 D 8.82 4.42 0.00 2.68 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 49 N 8.20 4.46 0.00 2.81 2.94 0.00 0.00 6.04 7.13 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 50 K 7.13 4.17 0.00 1.82 1.73 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.62 7.81 51 E 8.29 4.73 0.00 1.88 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 0.00 2.34 2.35 0.00 52 L 9.38 4.62 0.00 1.79 1.57 1.12 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 53 W 9.19 5.74 0.00 3.24 3.21 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 54 L 8.29 4.54 0.00 0.27 0.81 0.69 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 *56 K 8.36 4.26 0.00 1.87 1.71 0.00 1.69 0.00 0.00 1.72 0.00 0.00 2.79 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.43 7.81 57 V 8.16 4.79 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 0.77 0.00 0.00 0.87 0.00 0.00 58 P 0.00 4.31 0.00 2.33 1.98 0.00 3.36 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.07 0.00 59 A 8.54 4.07 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 60 N 8.06 4.54 0.00 2.86 2.98 0.00 0.00 6.04 7.81 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 61 I 7.29 3.98 1.76 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.44 0.83 0.00 0.00 62 D 8.44 4.63 0.00 2.75 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.24 3.75 1.87 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 1.45 1.02 0.91 0.00 0.00 64 S 8.18 4.18 0.00 3.97 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 65 Q 7.71 4.20 0.00 2.19 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.86 0.00 0.00 0.00 0.00 0.00 2.60 2.48 0.00 66 L 7.60 4.38 0.00 1.80 1.58 0.90 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.57 4.47 0.00 1.71 1.82 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.33 7.81 68 S 7.70 4.58 0.00 3.90 3.76 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 0.00 0.00 0.00 69 L 8.18 4.57 0.00 1.61 1.64 0.94 1.02 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 70 P 0.00 4.64 0.00 2.05 2.07 0.00 3.69 0.00 0.00 3.85 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 71 L 7.73 3.97 0.00 1.54 1.33 0.49 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.46 4.65 0.00 2.77 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 73 T 8.55 4.21 4.48 0.00 0.00 0.00 0.00 0.00 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 74 D 8.01 4.53 0.00 2.71 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 75 A 7.29 4.24 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.56 4.22 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 1.23 0.00 0.00 77 V 7.68 4.91 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 0.85 0.00 0.00 0.93 0.00 0.00 78 S 9.01 4.77 0.00 3.90 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 79 T 8.50 5.39 4.45 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 1.23 0.00 0.00 80 V 8.78 4.42 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 0.78 0.00 0.00 0.98 0.00 0.00 81 E 8.54 4.55 0.00 1.96 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 2.35 2.28 0.00 82 L 7.91 4.18 0.00 1.81 1.71 0.88 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 83 G 8.76 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 0.00 0.00 0.00 84 S 9.17 4.56 0.00 3.82 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 85 K 7.85 4.10 0.00 1.70 1.32 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.43 7.81 86 N 8.04 4.93 0.00 2.61 2.55 0.00 0.00 6.80 7.02 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 87 F 8.84 5.06 0.00 2.97 2.99 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 88 N 9.16 5.14 0.00 2.78 2.77 0.00 0.00 6.59 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 89 V 8.65 4.84 2.14 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 1.14 0.00 0.00 0.97 0.00 0.00 90 L 8.64 5.06 0.00 1.75 1.46 0.91 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.94 4.23 0.00 1.96 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.55 0.00 0.00 0.00 0.00 0.00 1.77 1.16 0.00 92 N 8.58 4.25 0.00 2.69 2.77 0.00 0.00 6.45 6.67 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 93 T 7.56 3.91 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 1.23 0.00 0.00 94 S 7.65 4.16 0.00 3.92 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 95 T 7.11 4.00 4.21 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 1.18 0.00 0.00 96 Q 8.39 3.96 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.12 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 97 E 7.59 4.06 0.00 2.14 1.96 0.00 0.00 0.00 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 2.23 0.00 98 G 7.79 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 99 S 8.11 3.98 0.00 3.95 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 0.00 100 D 7.90 4.81 0.00 2.60 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.60 5.36 0.00 2.83 2.87 0.00 0.00 7.37 7.05 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 0.00 102 T 7.89 4.36 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 1.12 0.00 0.00 103 N 8.04 4.49 0.00 2.90 3.11 0.00 0.00 6.14 6.67 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 0.00 104 L 7.48 4.54 0.00 1.94 1.92 0.99 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.51 4.70 0.00 3.92 3.81 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 0.00 0.00 0.00 0.00 106 L 8.22 4.32 0.00 1.50 1.38 0.80 0.44 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 0.00 107 L 8.46 5.08 0.00 1.49 1.54 0.94 0.81 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 0.00 108 I 8.61 4.60 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.03 0.68 0.00 0.00 109 P 0.00 5.02 0.00 2.12 2.12 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 110 S 8.54 4.41 0.00 3.98 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 0.00 111 E 8.74 4.16 0.00 1.99 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 2.33 2.35 0.00 112 K 7.47 3.99 0.00 1.72 1.87 0.00 1.64 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.42 7.81 113 K 7.46 4.44 0.00 1.97 1.73 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.34 1.37 7.81 114 K 8.56 4.29 0.00 1.85 1.84 0.00 1.64 0.00 0.00 1.89 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.55 7.81 115 E 8.11 4.62 0.00 2.04 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 2.17 2.26 0.00 116 T 7.97 4.75 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 1.21 0.00 0.00 117 L 8.51 5.20 0.00 1.49 1.56 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 118 K 8.67 4.72 0.00 1.76 1.83 0.00 1.30 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.35 7.81 119 V 8.31 4.26 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 0.80 0.00 0.00 0.91 0.00 0.00 120 A 8.84 4.15 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 0.00 121 T 8.43 4.92 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 1.21 0.00 0.00 122 S 8.07 4.81 0.00 3.69 3.80 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 0.00 123 K 8.77 4.04 0.00 1.77 1.76 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.37 1.06 7.81 124 D 7.30 4.95 0.00 2.62 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.51 4.15 0.00 2.83 2.92 0.00 0.00 6.87 7.15 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 0.00 126 K 7.78 4.20 0.00 1.72 1.81 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.48 7.81 127 S 8.57 4.67 0.00 3.77 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 0.00 128 V 7.83 3.62 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 0.55 0.00 0.00 0.93 0.00 0.00 129 Y 7.85 4.77 0.00 3.08 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 0.00 130 F 8.60 4.50 0.00 3.16 3.06 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 0.00 131 D 9.37 4.78 0.00 2.90 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 0.00 132 R 8.09 4.46 0.00 0.78 0.73 0.00 2.75 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 133 V 8.38 4.57 1.88 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 0.80 0.00 0.00 0.89 0.00 0.00 134 F 9.38 5.14 0.00 2.78 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 0.00 135 T 8.84 4.62 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 0.00 136 I 8.72 4.75 1.74 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.49 0.63 0.00 0.00 137 S 8.97 4.92 0.00 3.89 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 0.00 138 E 8.90 4.81 0.00 1.96 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 2.68 2.46 0.00 139 T 8.59 4.30 4.21 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 1.20 0.00 0.00 140 A 8.54 4.03 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 0.00 141 R 8.32 4.59 0.00 1.75 1.78 0.00 3.19 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.74 0.00 142 I 8.06 4.22 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 1.41 0.81 0.91 0.00 0.00 143 P 0.00 4.42 0.00 2.04 1.98 0.00 3.71 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.