NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 G 3.9757 8.3549 109.7246 45.7603 0.0000 175.3548 17 I 3.6729 7.0665 121.4579 62.9267 37.4097 175.9159 18 T 3.9935 7.8903 116.9166 62.5063 69.9154 174.5285 19 G 3.6090 7.4501 112.7763 45.3925 0.0000 170.2362 20 T 4.6071 7.4455 116.2975 61.5209 70.6772 174.1042 21 W 4.6871 8.3956 125.7314 54.8976 33.4619 174.0711 22 Y 5.4686 9.1727 118.7837 56.5724 41.5584 175.2141 23 N 5.3935 9.2045 121.2533 50.6003 40.0548 175.8386 24 Q 4.0719 8.7924 116.1939 59.5585 28.4473 178.2727 25 L 4.0720 7.8512 117.3698 56.3394 41.8038 176.9447 26 G 3.6986 7.7585 104.7964 45.1509 0.0000 174.2780 27 S 4.5172 8.7548 117.7301 58.8531 64.4950 173.2789 28 T 5.1305 8.8426 118.5151 61.7066 72.0907 173.1277 29 F 5.1966 9.0399 121.1190 55.1244 41.2143 173.7144 30 I 4.6319 8.6305 124.9034 59.8761 38.5423 175.2073 31 V 4.9798 8.6104 120.3445 59.6909 35.8813 174.8205 32 T 4.7261 8.9457 119.9040 61.7452 71.2010 172.9812 33 A 4.8916 8.5489 129.2876 49.9221 19.6747 175.7904 34 G 3.8736 9.1611 115.7889 44.7393 0.0000 171.3066 35 A 3.5016 8.4269 124.4818 53.3212 19.4633 176.0512 36 D 4.4678 8.3264 112.4817 52.6401 39.9323 177.5346 37 G 3.0411 8.2356 106.5186 44.9725 0.0000 171.1580 38 A 4.7318 7.9676 120.4874 51.1628 20.4636 177.3252 39 L 5.2870 8.8786 120.4160 53.1937 44.9400 175.9434 40 T 4.9490 9.8071 113.8596 59.3182 72.5609 174.9078 41 G 3.6740 6.9205 108.0260 46.2158 0.0000 171.0710 42 T 5.1721 7.6948 108.7495 60.1307 72.6984 172.2656 43 Y 5.2331 9.0380 124.5846 56.2287 41.3040 174.2642 44 E 5.5400 9.0083 124.5290 53.9343 33.6129 176.3218 45 S 4.4313 8.8016 117.4168 59.7746 64.5154 174.3519 *49 N 4.4332 7.9604 115.2502 51.9405 38.1019 174.7543 50 A 3.7394 8.6727 122.1653 55.3997 18.3117 178.8137 51 E 4.2401 8.0059 111.7395 57.9332 30.2572 177.2136 52 S 4.7652 9.1461 114.9430 58.0798 64.4704 173.2884 53 R 4.9920 7.6670 121.1250 55.8992 31.0953 174.9199 54 Y 5.0261 9.0256 122.1930 56.1603 42.9794 174.5812 55 V 4.2963 8.6606 122.2410 62.8427 32.6643 175.1057 56 L 5.0954 9.4114 128.3420 54.4061 43.6780 175.1872 57 T 4.9727 8.5785 114.6294 61.3403 71.4321 173.1830 58 G 4.6538 8.8925 113.6774 46.3208 0.0000 171.8415 59 R 5.5822 8.6009 117.8733 55.1024 35.0853 173.8506 60 Y 5.2370 8.4552 117.4975 55.6059 41.4142 174.8429 61 D 4.3592 9.0964 120.7439 54.0265 40.2733 176.9608 62 S 4.3074 8.0916 120.7169 59.5179 63.7900 174.8696 63 A 4.6515 8.5311 124.1548 50.1848 18.8383 173.2392 64 P 4.7743 0.0000 0.0000 60.6030 32.8794 177.0192 65 A 4.2420 8.3248 121.5739 52.7138 18.7297 177.2253 66 T 4.5476 8.3782 108.5214 61.6452 69.0059 174.7170 67 D 4.6668 8.2727 118.9665 53.6256 39.5841 177.0291 68 G 3.9421 8.2809 106.9869 45.7484 0.0000 174.2116 69 S 4.3377 8.3320 115.8600 57.9372 63.4064 174.1057 70 G 4.0243 8.3243 109.9654 46.3349 0.0000 172.6350 71 T 4.8354 8.9673 116.6911 61.5322 70.3412 174.9347 72 A 4.8314 8.7038 129.0704 52.2748 19.9640 175.8303 73 L 4.9345 9.1724 120.3958 55.4706 44.7656 174.0275 74 G 4.5947 9.0457 105.3826 45.4266 0.0000 171.8989 75 W 5.7792 8.7528 117.4131 55.6290 32.3942 173.3602 76 T 5.3078 9.2057 116.6397 61.8287 71.7942 173.4635 77 V 4.5483 9.1221 124.8092 60.9982 34.6716 173.7799 78 A 4.7275 8.3654 129.5716 49.8943 20.3579 178.0114 79 F 4.1541 8.3296 125.0777 55.8978 37.6545 175.0064 80 K 5.2529 7.7559 120.8656 54.6886 35.4714 174.7365 81 N 4.9760 9.5304 122.3017 51.8271 40.0138 174.3548 82 N 3.9466 8.4484 114.0080 55.8761 38.6397 175.4204 83 Y 4.7043 7.1544 114.1509 57.9991 40.1176 175.8865 84 R 4.7224 9.6598 115.8700 54.4122 32.6606 174.0554 85 N 5.1228 8.5056 116.7733 52.4345 40.3180 173.8695 86 A 4.2655 9.3109 128.9859 52.1762 19.5967 176.2848 87 H 4.2036 8.8980 112.7650 55.9837 26.4552 174.0740 88 S 5.1264 7.5676 110.8452 57.6286 66.6152 173.2994 89 A 4.8942 8.8311 121.3026 50.5638 22.7971 175.1431 90 T 4.8473 9.1761 118.4922 61.6844 71.9621 173.3184 91 T 5.0292 8.3891 115.4254 59.6377 71.8353 172.7127 92 W 4.9515 9.0170 125.0921 54.7932 31.6526 174.6701 93 S 4.8337 8.6416 119.9236 56.8763 64.4938 172.9666 94 G 4.4880 8.6920 114.0744 46.5321 0.0000 171.7314 95 Q 5.2785 8.4189 117.5955 54.9608 32.8274 173.2775 96 Y 5.0227 9.2118 122.9596 56.4930 40.8417 174.1645 97 V 4.2593 8.3339 127.2701 61.0013 33.0352 176.7123 98 G 3.3975 9.1564 117.8605 48.7821 0.0000 174.4458 99 G 4.2852 6.7781 102.4934 42.4720 0.0000 173.9848 100 A 4.1712 9.0204 124.8113 53.5125 17.2890 180.4169 101 E 4.1523 9.2802 114.8166 56.2993 30.8776 176.8376 102 A 4.4865 8.4355 124.0095 52.2542 19.3227 176.7643 103 R 5.3522 8.8967 119.3164 54.6341 35.3950 174.3557 104 I 4.9633 8.9654 121.5776 59.8730 40.1695 174.3992 105 N 5.3443 8.9148 125.3796 52.1812 40.2258 174.5919 106 T 5.2284 9.4750 113.7432 59.9964 73.1875 172.3790 107 Q 5.1507 9.0524 123.2764 54.0448 32.2735 174.1754 108 W 5.3777 8.4159 121.5811 54.6018 32.3949 173.7735 109 L 5.2028 8.6015 119.9864 52.9152 44.9404 175.2336 110 L 4.9241 9.2111 126.3726 53.7254 44.3583 174.9064 111 T 5.1019 8.7723 123.6410 62.0327 70.9473 173.8916 112 S 5.1892 8.6148 121.7163 56.3970 65.6510 174.2784 113 G 3.8769 8.7529 111.5812 46.4108 0.0000 173.2524 114 T 4.7507 8.3315 114.5387 59.4378 71.9820 173.6083 115 T 4.5321 8.0234 112.8326 61.2314 69.7311 175.1740 116 E 3.9888 8.5524 120.3352 58.8167 29.6535 178.5125 117 A 4.2538 8.0132 120.4783 54.0313 19.0656 177.6127 118 N 4.6926 7.8511 112.1489 52.8986 39.0667 176.6723 119 A 4.3535 8.1258 123.5544 54.0571 18.6920 180.4293 120 W 4.3605 8.1935 112.5134 58.4400 28.3884 176.6611 121 K 4.2903 6.4958 118.6351 56.0916 32.2645 177.1868 122 S 4.3060 7.6890 115.5609 60.5245 63.9147 173.3781 123 T 5.0890 7.6535 117.3062 61.7142 70.8267 173.6260 124 L 4.8312 9.0386 126.7071 53.3869 44.3672 175.9059 125 V 4.3222 7.7693 119.6736 60.3480 34.5246 175.0559 126 G 3.1603 6.2887 108.3670 45.8906 0.0000 171.2388 127 H 5.4214 8.1545 113.6011 54.4462 31.8259 172.7426 128 D 5.1099 9.4594 118.9984 53.3786 45.6751 174.3043 129 T 5.2466 9.2199 119.3918 61.8549 71.6668 173.1098 130 F 6.0531 10.1614 124.7706 55.3835 42.2229 174.6945 131 T 5.3930 8.7883 110.9286 59.9312 72.6499 174.1181 132 K 4.4081 8.5153 119.4667 55.7469 32.2011 177.5104 133 V 3.9440 7.6882 124.6455 62.9480 31.6097 175.1435 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 16 G 8.35 3.98 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 0.00 0.00 0.00 17 I 7.07 3.67 1.36 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 -0.36 0.60 0.00 0.00 18 T 7.89 3.99 4.17 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 1.17 0.00 0.00 19 G 7.45 3.61 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 0.00 0.00 0.00 20 T 7.45 4.61 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 0.70 0.00 0.00 21 W 8.40 4.69 0.00 2.00 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 22 Y 9.17 5.47 0.00 2.94 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 23 N 9.20 5.39 0.00 2.69 2.71 0.00 0.00 6.60 7.37 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 24 Q 8.79 4.07 0.00 2.22 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.15 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 25 L 7.85 4.07 0.00 1.72 1.83 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.76 3.70 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 0.00 0.00 0.00 27 S 8.75 4.52 0.00 3.92 3.64 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 28 T 8.84 5.13 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 1.04 0.00 0.00 29 F 9.04 5.20 0.00 2.89 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 30 I 8.63 4.63 1.82 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 1.13 0.67 0.84 0.00 0.00 31 V 8.61 4.98 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 0.63 0.00 0.00 1.00 0.00 0.00 32 T 8.95 4.73 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 1.19 0.00 0.00 33 A 8.55 4.89 0.70 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 0.00 0.00 34 G 9.16 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 35 A 8.43 3.50 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 36 D 8.33 4.47 0.00 2.61 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 37 G 8.24 3.04 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 38 A 7.97 4.73 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 39 L 8.88 5.29 0.00 1.88 1.64 0.81 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 40 T 9.81 4.95 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 1.22 0.00 0.00 41 G 6.92 3.67 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 0.00 0.00 0.00 42 T 7.69 5.17 4.40 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 1.22 0.00 0.00 43 Y 9.04 5.23 0.00 3.01 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 44 E 9.01 5.54 0.00 1.81 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 2.22 2.18 0.00 45 S 8.80 4.43 0.00 3.85 3.96 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 0.00 0.00 0.00 *49 N 7.96 4.43 0.00 2.99 2.95 0.00 0.00 6.12 7.46 0.00 0.00 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 8.67 3.74 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 51 E 8.01 4.24 0.00 2.01 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 2.37 2.11 0.00 52 S 9.15 4.77 0.00 3.83 4.14 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 53 R 7.67 4.99 0.00 1.82 1.83 0.00 3.25 0.00 0.00 3.30 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.77 0.00 54 Y 9.03 5.03 0.00 3.08 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 55 V 8.66 4.30 2.12 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 0.80 0.00 0.00 0.96 0.00 0.00 56 L 9.41 5.10 0.00 1.77 1.64 0.45 -1.42 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 57 T 8.58 4.97 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 1.24 0.00 0.00 58 G 8.89 4.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 R 8.60 5.58 0.00 1.76 1.78 0.00 3.31 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 60 Y 8.46 5.24 0.00 2.97 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 61 D 9.10 4.36 0.00 2.75 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 62 S 8.09 4.31 0.00 3.91 3.45 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 0.00 63 A 8.53 4.65 1.20 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 0.00 0.00 0.00 64 P 0.00 4.77 0.00 2.27 2.19 0.00 3.45 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 65 A 8.32 4.24 1.32 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 0.00 0.00 66 T 8.38 4.55 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 1.24 0.00 0.00 67 D 8.27 4.67 0.00 2.79 2.80 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 68 G 8.28 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 69 S 8.33 4.34 0.00 3.90 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 70 G 8.32 4.02 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 0.00 0.00 0.00 71 T 8.97 4.84 4.54 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 1.48 0.00 0.00 72 A 8.70 4.83 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 73 L 9.17 4.93 0.00 1.92 1.94 1.11 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.05 4.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 W 8.75 5.78 0.00 3.36 3.18 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 76 T 9.21 5.31 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 1.24 0.00 0.00 77 V 9.12 4.55 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 0.30 0.00 0.00 0.85 0.00 0.00 78 A 8.37 4.73 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 79 F 8.33 4.15 0.00 2.99 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 80 K 7.76 5.25 0.00 1.85 1.70 0.00 1.77 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.37 1.55 7.81 81 N 9.53 4.98 0.00 2.72 2.71 0.00 0.00 6.70 7.54 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 82 N 8.45 3.95 0.00 1.67 2.49 0.00 0.00 6.64 7.46 0.00 0.00 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 Y 7.15 4.70 0.00 2.78 2.96 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 0.00 0.00 0.00 84 R 9.66 4.72 0.00 1.92 2.09 0.00 3.05 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 1.72 1.88 0.00 85 N 8.51 5.12 0.00 2.65 2.61 0.00 0.00 6.96 7.96 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 86 A 9.31 4.27 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 87 H 8.90 4.20 0.00 3.42 3.40 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.57 5.13 0.00 4.02 3.96 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 0.00 0.00 0.00 89 A 8.83 4.89 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 90 T 9.18 4.85 3.77 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 0.00 0.00 -0.38 0.00 0.00 91 T 8.39 5.03 4.16 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 1.14 0.00 0.00 92 W 9.02 4.95 0.00 1.78 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 0.00 0.00 0.00 0.00 93 S 8.64 4.83 0.00 3.76 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.69 4.49 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 0.00 0.00 0.00 95 Q 8.42 5.28 0.00 2.19 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 96 Y 9.21 5.02 0.00 3.01 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 97 V 8.33 4.26 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 0.84 0.00 0.00 0.92 0.00 0.00 98 G 9.16 3.40 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 0.00 99 G 6.78 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 0.00 0.00 0.00 0.00 100 A 9.02 4.17 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 0.00 101 E 9.28 4.15 0.00 2.13 1.99 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 2.31 2.36 0.00 102 A 8.44 4.49 1.47 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 0.00 0.00 103 R 8.90 5.35 0.00 1.84 1.94 0.00 3.13 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 104 I 8.97 4.96 1.88 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.33 1.12 0.00 0.00 105 N 8.91 5.34 0.00 2.76 2.82 0.00 0.00 6.06 6.42 0.00 0.00 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 T 9.48 5.23 4.47 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 1.40 0.00 0.00 107 Q 9.05 5.15 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.71 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 108 W 8.42 5.38 0.00 2.62 2.21 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 0.00 109 L 8.60 5.20 0.00 1.50 1.51 0.86 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 110 L 9.21 4.92 0.00 1.62 1.69 0.97 0.80 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 0.00 111 T 8.77 5.10 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 0.00 112 S 8.61 5.19 0.00 3.68 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 0.00 113 G 8.75 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 0.00 0.00 0.00 114 T 8.33 4.75 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 1.16 0.00 0.00 115 T 8.02 4.53 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 0.00 116 E 8.55 3.99 0.00 1.97 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 2.32 2.37 0.00 117 A 8.01 4.25 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 0.00 118 N 7.85 4.69 0.00 2.60 2.57 0.00 0.00 6.71 7.91 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 0.00 119 A 8.13 4.35 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 0.00 120 W 8.19 4.36 0.00 3.54 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 0.00 121 K 6.50 4.29 0.00 1.23 0.74 0.00 1.19 0.00 0.00 1.12 0.00 0.00 2.69 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.30 0.70 7.81 122 S 7.69 4.31 0.00 4.07 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 0.00 123 T 7.65 5.09 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 1.21 0.00 0.00 124 L 9.04 4.83 0.00 1.83 1.73 1.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 125 V 7.77 4.32 1.89 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 0.54 0.00 0.00 0.69 0.00 0.00 126 G 6.29 3.16 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 0.00 127 H 8.15 5.42 0.00 3.21 3.30 0.00 5.70 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 0.00 128 D 9.46 5.11 0.00 3.14 2.55 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 0.00 0.00 0.00 129 T 9.22 5.25 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 1.45 0.00 0.00 130 F 10.16 6.05 0.00 3.08 3.31 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 0.00 131 T 8.79 5.39 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 1.47 0.00 0.00 132 K 8.52 4.41 0.00 1.47 1.53 0.00 1.26 0.00 0.00 0.66 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.21 7.81 133 V 7.69 3.94 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 0.76 0.00 0.00 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.