NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 32 V 3.9994 8.1545 117.9091 60.5819 34.0016 177.3494 33 Q 3.3977 8.0409 116.1217 55.7677 25.5834 174.1203 34 A 4.7240 8.0523 121.2734 51.8651 19.7563 177.6174 35 A 4.4999 7.7018 124.5305 52.9555 19.5410 179.9196 36 V 3.8681 7.8416 121.5264 66.1551 31.5502 183.5231 37 S 4.7065 7.9199 117.6541 63.0798 62.3192 180.9678 38 Q 4.6782 7.8960 122.9544 59.3693 28.4997 183.2033 39 L 4.6030 7.7941 123.5543 59.8602 41.1939 185.0000 40 I 4.0609 7.6672 118.6957 65.0243 35.5985 180.6874 41 P 4.4569 0.0000 0.0000 65.4050 31.0725 178.6128 42 Q 3.9600 8.0741 116.1362 59.0592 28.5897 178.7437 43 A 4.0153 7.6140 124.3246 55.6860 18.1057 180.4351 44 R 3.8897 8.0682 119.4623 61.6456 29.4523 181.2850 45 S 4.3169 8.1854 115.0729 61.1016 63.0147 176.1880 46 A 4.1039 8.1470 123.7072 53.8597 17.4998 179.5506 47 I 3.7824 7.4629 121.5195 64.9200 37.2794 178.6845 48 Q 3.8845 7.4874 120.0164 60.4562 27.8862 180.7262 49 T 4.2890 7.9113 110.7213 64.1716 68.9964 175.4292 50 G 4.3112 6.7794 119.6004 46.5957 0.0000 175.0307 51 N 4.6723 7.4610 122.7184 51.3682 35.6670 177.1809 52 A 4.2356 8.2627 129.9696 54.7466 19.4308 180.8290 53 L 4.0605 8.1281 118.9641 59.9375 40.6230 181.2529 54 Q 4.3142 7.7754 118.1934 59.2249 28.5853 179.6712 55 G 3.5841 8.2073 106.5785 47.3668 0.0000 175.6960 56 L 3.9752 7.8496 124.6190 58.6810 42.0882 179.6790 57 K 4.0329 8.0432 122.1240 60.3550 31.5179 180.2523 58 T 4.3602 7.5117 114.8477 66.5576 68.9615 176.6647 59 L 4.3253 8.6928 122.3502 58.2746 40.3165 178.7058 60 L 4.5464 8.0853 118.6460 54.0411 41.7274 176.2796 61 S 4.7323 7.3851 113.2446 57.7987 65.6377 173.4097 62 Y 3.3778 8.4471 121.2505 58.9627 34.3124 169.8100 63 V 3.6704 7.2624 113.3317 59.3364 33.4993 174.9523 64 P 4.2866 0.0000 0.0000 62.6907 30.9180 177.0303 *65 Y 4.0695 8.3310 122.3572 56.0052 37.4549 172.8851 66 G 3.9724 8.4197 109.2856 46.7354 0.0000 172.7062 67 N 4.7728 8.2368 120.8940 52.8224 41.3729 172.3053 68 D 4.6431 8.7379 113.7478 55.4509 40.7179 177.7397 69 V 3.8848 7.5846 116.9249 61.5661 29.6301 176.7403 70 Q 4.2864 8.4482 129.2776 59.8913 28.5203 177.0709 71 E 4.0034 8.4144 120.0312 62.2557 29.2260 185.0000 72 V 4.0164 7.7081 118.3126 66.3729 31.8420 182.4461 73 R 4.2525 7.8646 118.5416 59.0704 29.9162 179.1031 74 T 4.0021 8.9348 118.9036 67.5640 68.0358 177.2660 75 Q 4.0078 7.7269 121.2588 60.2178 27.9374 180.2240 76 Y 4.0603 7.6885 119.6275 60.7811 38.9609 177.3282 77 L 3.8145 8.7136 121.7327 58.4219 42.0938 178.3898 78 N 4.2254 8.8478 116.4109 56.5640 38.4027 177.2340 79 A 3.8165 7.4345 120.6401 55.0003 18.5573 179.2103 80 F 3.7804 7.8334 119.5106 61.5499 39.4702 177.7936 81 V 3.3116 7.8911 118.4413 64.5637 31.0838 178.1014 82 D 4.2672 7.5531 118.7168 56.9166 40.9847 178.6011 83 V 3.5793 7.8267 119.0915 66.0986 31.2418 178.1503 84 L 3.6887 7.1860 118.4028 57.7568 41.0123 179.8055 85 S 4.2394 7.7226 114.2957 60.0726 63.0631 174.3111 86 N 5.0231 7.9287 118.4875 52.4492 37.3955 174.6000 87 I 4.3748 7.5337 122.0365 60.8894 38.9641 177.1305 88 R 3.9877 8.5889 123.9992 56.1884 30.1969 173.6741 89 A 3.8723 8.8591 123.7053 54.8131 18.0435 180.0116 90 A 3.9717 7.8873 117.3069 54.7074 18.6703 178.5123 91 D 4.5484 8.0973 116.4361 55.3362 41.2030 178.8249 92 I 3.3707 7.3146 121.3281 63.7165 36.9653 176.4527 93 P 4.1940 0.0000 0.0000 65.7438 30.4113 178.1333 94 A 4.0797 7.9955 122.7124 55.3991 18.3879 179.9991 *95 F 4.1034 7.8845 119.6500 62.0984 38.0498 180.6567 96 V 4.0014 7.8058 121.5254 65.3269 31.0692 178.9063 97 K 4.1776 7.6745 123.7056 59.5277 31.6226 181.8505 98 E 4.3843 7.6931 117.0512 58.0459 29.8821 177.4961 99 C 4.4369 7.4085 115.9432 59.8392 28.9619 174.1321 100 S 4.4711 9.3322 117.0844 58.1945 64.1650 175.6240 101 T 3.9745 8.3577 121.8630 66.3515 68.2197 176.7331 102 E 3.9076 8.1157 121.0539 59.3483 29.7727 178.5036 103 E 4.0411 8.0996 118.1055 59.4520 29.4801 179.2670 104 I 3.8198 8.3803 122.6078 65.2855 37.4111 178.6082 105 D 4.4156 8.1272 121.8772 58.7721 39.5808 180.5544 106 N 4.4502 8.0929 117.4446 56.5381 39.0298 177.0326 107 I 3.8433 8.3118 120.5926 64.1333 38.1602 178.0533 108 V 3.7471 8.2566 119.5186 66.0390 31.0831 177.4509 109 N 4.2991 8.0115 116.4023 56.6977 38.6469 176.7400 110 F 4.3915 7.9365 118.6668 59.8615 38.9189 177.8887 111 I 3.9209 8.0220 119.7898 64.9663 36.7704 178.0791 112 Y 4.1751 8.1484 118.3610 61.6283 37.7304 179.0335 113 R 4.3459 7.8313 119.6868 60.8215 29.6075 181.7841 114 G 4.2333 8.3678 104.6716 47.0113 0.0000 173.9279 115 L 4.0503 8.1247 122.6528 55.5224 41.4850 175.0939 116 A 4.3932 8.0955 132.8204 52.4113 22.8513 175.4727 117 N 4.6649 7.8304 112.0214 54.5587 39.5378 174.3312 *122 N 4.5027 7.7247 116.9113 51.2464 39.5330 177.0269 123 S 4.7335 8.2347 117.4083 57.6712 65.4296 174.4492 124 S 4.5501 8.4546 115.5155 59.6640 62.9722 176.1186 125 V 3.6970 7.8192 122.8572 65.0954 30.6998 177.8717 126 L 4.0416 8.0761 118.8819 57.7980 41.5542 179.2373 127 L 3.9310 7.8945 119.9578 58.0894 41.5824 178.5163 128 N 4.4081 8.0963 116.6823 56.0939 38.8698 176.9177 129 W 3.9115 8.3934 120.6883 59.9261 29.3150 177.7113 130 H 4.0943 8.6944 118.5017 59.4050 29.1683 176.7697 131 E 4.0803 8.2941 122.9425 59.7132 29.4615 179.7023 132 K 3.9592 7.6559 122.3341 59.8112 31.8161 181.0303 133 V 4.1464 7.9181 110.7146 62.2837 31.4846 177.4671 134 V 4.3590 7.5220 119.5739 64.0072 32.1725 177.4750 135 E 4.0278 7.9747 115.7281 58.4224 29.5668 178.0135 136 I 4.3554 7.7990 112.0017 60.8487 38.8218 176.4137 137 S 4.5382 7.8246 114.7499 57.8174 63.4669 174.6640 138 G 3.9882 7.8444 109.8927 45.1389 0.0000 174.9143 139 I 4.0623 8.0546 117.8574 63.1201 37.7834 178.6791 140 G 3.8569 8.3130 107.4799 47.8942 0.0000 174.9077 141 C 4.0605 8.1709 115.9860 61.6655 29.3737 176.1148 142 I 3.7202 7.6513 122.3104 63.6861 36.4547 178.4304 143 V 3.5673 7.7680 117.5407 66.3179 31.6187 177.8910 144 R 4.0440 8.3255 117.9236 59.0682 29.6607 179.1226 145 V 3.5346 7.7399 117.6018 65.9216 31.5689 177.8605 146 L 3.9904 8.0775 118.0756 57.6542 41.3785 178.1324 147 N 4.7070 8.2818 116.2164 53.8203 38.8824 175.7233 148 S 3.7591 6.6899 121.3376 57.3523 61.2247 174.5964 149 R 4.0488 8.5696 123.7802 56.6545 29.7580 176.8565 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 V 8.15 4.00 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 0.90 0.00 0.00 0.93 0.00 0.00 33 Q 8.04 3.40 0.00 2.31 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.39 0.00 0.00 0.00 0.00 0.00 2.17 1.99 0.00 34 A 8.05 4.72 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 35 A 7.70 4.50 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 36 V 7.84 3.87 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 0.80 0.00 0.00 0.93 0.00 0.00 37 S 7.92 4.71 0.00 3.65 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 38 Q 7.90 4.68 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.76 6.93 0.00 0.00 0.00 0.00 0.00 2.24 2.22 0.00 39 L 7.79 4.60 0.00 1.68 1.69 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.67 4.06 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 1.64 0.54 0.91 0.00 0.00 41 P 0.00 4.46 0.00 2.14 2.13 0.00 3.61 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 42 Q 8.07 3.96 0.00 2.24 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.43 0.00 43 A 7.61 4.02 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 44 R 8.07 3.89 0.00 1.84 1.96 0.00 3.27 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.52 0.00 45 S 8.19 4.32 0.00 4.05 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 0.00 46 A 8.15 4.10 1.41 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 0.00 0.00 47 I 7.46 3.78 2.02 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.97 0.94 0.00 0.00 48 Q 7.49 3.88 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.26 0.00 49 T 7.91 4.29 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 1.23 0.00 0.00 50 G 6.78 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 0.00 0.00 0.00 0.00 51 N 7.46 4.67 0.00 2.66 2.75 0.00 0.00 6.66 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 52 A 8.26 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 53 L 8.13 4.06 0.00 1.66 1.71 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 7.78 4.31 0.00 2.14 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.55 0.00 55 G 8.21 3.58 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 0.00 0.00 0.00 56 L 7.85 3.98 0.00 1.68 1.87 0.85 0.59 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 57 K 8.04 4.03 0.00 1.89 1.73 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.39 1.36 7.81 58 T 7.51 4.36 4.42 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 0.00 0.00 0.00 1.26 0.00 0.00 59 L 8.69 4.33 0.00 1.88 1.91 0.98 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.09 4.55 0.00 1.99 1.83 1.06 0.94 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 61 S 7.39 4.73 0.00 4.27 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 62 Y 8.45 3.38 0.00 3.09 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 63 V 7.26 3.67 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 0.87 0.00 0.00 0.92 0.00 0.00 64 P 0.00 4.29 0.00 1.97 1.95 0.00 3.28 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 *65 Y 8.33 4.07 0.00 2.33 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 0.00 0.00 0.00 0.00 66 G 8.42 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 67 N 8.24 4.77 0.00 2.77 2.68 0.00 0.00 7.02 8.47 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 68 D 8.74 4.64 0.00 2.79 2.76 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 V 7.58 3.88 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 0.68 0.00 0.00 0.93 0.00 0.00 70 Q 8.45 4.29 0.00 2.06 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.86 0.00 0.00 0.00 0.00 0.00 2.36 1.99 0.00 71 E 8.41 4.00 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 2.32 1.96 0.00 72 V 7.71 4.02 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 0.79 0.00 0.00 0.93 0.00 0.00 73 R 7.86 4.25 0.00 2.06 2.10 0.00 3.15 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.73 0.00 74 T 8.93 4.00 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 1.24 0.00 0.00 75 Q 7.73 4.01 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 76 Y 7.69 4.06 0.00 3.06 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 77 L 8.71 3.81 0.00 1.83 1.89 1.11 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.85 4.23 0.00 2.91 2.85 0.00 0.00 6.98 8.13 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 79 A 7.43 3.82 1.17 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 0.00 0.00 80 F 7.83 3.78 0.00 2.47 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 81 V 7.89 3.31 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 0.86 0.00 0.00 82 D 7.55 4.27 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.83 3.58 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 0.89 0.00 0.00 0.81 0.00 0.00 84 L 7.19 3.69 0.00 1.37 1.00 -0.26 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.72 4.24 0.00 4.00 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 86 N 7.93 5.02 0.00 2.79 2.83 0.00 0.00 6.85 7.34 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 87 I 7.53 4.37 2.22 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.89 1.10 0.00 0.00 88 R 8.59 3.99 0.00 1.73 1.82 0.00 3.27 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.21 0.00 89 A 8.86 3.87 1.25 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 0.00 0.00 0.00 90 A 7.89 3.97 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 91 D 8.10 4.55 0.00 2.88 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 92 I 7.31 3.37 1.43 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.54 -0.44 0.00 0.00 93 P 0.00 4.19 0.00 2.20 2.23 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.95 0.00 94 A 8.00 4.08 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.88 4.10 0.00 2.25 2.30 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 4.00 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 0.93 0.00 0.00 1.00 0.00 0.00 97 K 7.67 4.18 0.00 1.84 1.77 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.35 7.81 98 E 7.69 4.38 0.00 2.18 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 2.36 2.47 0.00 99 C 7.41 4.44 0.00 3.22 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 0.00 100 S 9.33 4.47 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 0.00 101 T 8.36 3.97 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 1.22 0.00 0.00 102 E 8.12 3.91 0.00 2.02 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 2.35 2.37 0.00 103 E 8.10 4.04 0.00 2.39 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 2.47 2.46 0.00 104 I 8.38 3.82 1.92 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.03 0.98 0.00 0.00 105 D 8.13 4.42 0.00 2.70 2.71 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 0.00 106 N 8.09 4.45 0.00 3.17 2.96 0.00 0.00 6.80 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 0.00 107 I 8.31 3.84 2.12 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 1.16 0.00 0.00 108 V 8.26 3.75 2.19 0.00 0.00 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 1.08 0.00 0.00 109 N 8.01 4.30 0.00 2.98 2.47 0.00 0.00 7.23 7.16 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 0.00 110 F 7.94 4.39 0.00 2.25 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 0.00 0.00 0.00 0.00 111 I 8.02 3.92 2.12 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.21 0.96 0.00 0.00 112 Y 8.15 4.18 0.00 3.00 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 0.00 113 R 7.83 4.35 0.00 1.96 1.84 0.00 3.27 0.00 0.00 3.23 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 114 G 8.37 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 0.00 115 L 8.12 4.05 0.00 1.66 1.68 0.72 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.10 4.39 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 0.00 117 N 7.83 4.66 0.00 2.79 2.81 0.00 0.00 5.86 8.04 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 *122 N 7.72 4.50 0.00 2.79 2.69 0.00 0.00 6.64 7.64 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 0.00 123 S 8.23 4.73 0.00 3.85 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 0.00 124 S 8.45 4.55 0.00 3.87 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 0.00 125 V 7.82 3.70 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 0.89 0.00 0.00 1.16 0.00 0.00 126 L 8.08 4.04 0.00 1.73 1.81 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 127 L 7.89 3.93 0.00 1.86 1.78 0.85 0.62 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 0.00 128 N 8.10 4.41 0.00 2.89 2.95 0.00 0.00 7.24 7.95 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 0.00 129 W 8.39 3.91 0.00 3.64 3.33 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.69 4.09 0.00 3.24 3.50 0.00 5.59 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 0.00 131 E 8.29 4.08 0.00 2.12 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 2.30 2.33 0.00 132 K 7.66 3.96 0.00 1.85 1.79 0.00 1.86 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.35 7.81 133 V 7.92 4.15 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 1.20 0.00 0.00 1.12 0.00 0.00 134 V 7.52 4.36 2.17 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 1.11 0.00 0.00 0.85 0.00 0.00 135 E 7.97 4.03 0.00 2.15 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 0.00 2.54 2.29 0.00 136 I 7.80 4.36 1.86 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 1.51 0.57 0.91 0.00 0.00 137 S 7.82 4.54 0.00 4.05 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 0.00 138 G 7.84 3.99 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 0.00 0.00 0.00 139 I 8.05 4.06 1.89 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 1.37 0.81 0.94 0.00 0.00 140 G 8.31 3.86 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 0.00 0.00 0.00 141 C 8.17 4.06 0.00 3.21 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 0.00 142 I 7.65 3.72 2.07 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.75 0.90 0.00 0.00 143 V 7.77 3.57 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 0.85 0.00 0.00 0.93 0.00 0.00 144 R 8.33 4.04 0.00 2.03 1.93 0.00 3.17 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 145 V 7.74 3.53 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 0.68 0.00 0.00 1.08 0.00 0.00 146 L 8.08 3.99 0.00 1.71 1.65 0.90 0.82 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 0.00 147 N 8.28 4.71 0.00 2.79 2.74 0.00 0.00 7.04 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 0.00 148 S 6.69 3.76 0.00 3.78 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 0.00 149 R 8.57 4.05 0.00 1.75 1.83 0.00 3.20 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 * Residues marked with a * may have inaccurate shift predictions.