NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 I 4.2672 7.8827 121.4055 61.1626 39.2089 173.8434 6 K 5.0451 8.4739 126.2666 54.3155 35.9996 172.9545 7 A 5.4163 9.4716 127.2211 50.8506 23.9245 173.9548 8 I 5.1930 8.7315 117.3021 60.1616 42.0763 173.3288 9 A 5.1694 9.3801 128.4342 50.3043 23.0162 175.0493 10 V 4.5825 8.4393 120.8643 61.3158 33.9091 174.2681 11 L 4.8535 9.0556 129.0194 53.6053 43.4077 176.0622 12 K 4.9788 8.8312 121.7481 55.9580 37.2737 175.9329 13 G 4.1043 7.8969 107.3386 46.9119 0.0000 172.9425 14 D 4.5890 8.4781 117.1393 51.3343 39.7668 175.2943 15 S 4.5593 6.9501 114.4226 57.4580 65.3661 175.2000 16 P 4.4400 0.0000 0.0000 63.7483 31.5791 176.6332 17 V 4.1564 7.5966 121.0135 63.2305 32.0438 175.1441 18 Q 4.8104 8.5849 124.3088 55.3924 32.6125 173.9081 19 G 4.1364 8.2063 106.3756 46.2632 0.0000 171.7805 20 V 5.0196 8.0165 118.7072 61.1995 34.8246 174.4736 21 I 4.8607 8.8853 128.8141 59.6720 40.0251 174.8033 22 T 5.0673 8.8854 117.1242 60.0686 71.8980 173.3927 23 F 5.4105 9.2879 121.5935 56.0689 42.7293 174.1391 24 T 5.2762 9.1539 113.4315 60.2034 72.2843 172.6957 25 Q 4.5540 8.8960 123.6430 54.8613 31.9829 173.6286 26 E 3.7537 9.3056 127.5572 59.2483 30.1567 176.9232 *30 G 3.7891 7.5088 107.4968 44.2183 0.0000 170.2100 31 P 4.6293 0.0000 0.0000 62.6687 32.4715 175.6823 32 V 4.4266 8.7343 121.8343 62.2545 33.3783 174.6726 33 T 4.8997 9.0122 125.2754 62.4423 70.2212 173.6877 34 V 4.5620 8.9898 127.3166 61.1822 33.7626 174.4316 35 S 5.5741 8.6784 121.5156 56.0213 66.6308 174.0015 36 G 4.3756 7.4188 110.0926 44.9003 0.0000 170.7669 37 E 5.1229 8.0869 118.1550 54.4429 33.2034 175.4001 38 I 4.8142 8.6163 124.1624 59.4859 40.5056 174.9399 39 K 4.8460 8.9983 125.3990 54.8010 36.3283 175.8648 40 N 4.2382 8.6601 115.1053 54.7870 35.6854 174.8444 41 M 4.4289 7.7807 118.4630 53.8434 33.4393 175.6124 42 D 4.4800 8.3254 119.3035 54.4784 41.4759 176.6668 43 A 4.3647 8.3316 124.7812 52.9487 19.5045 176.9085 44 N 4.3126 8.7349 115.3345 53.6487 36.8303 173.4267 45 A 4.9144 8.2492 117.8352 50.1961 23.2660 175.9733 46 Q 5.0638 8.4718 116.6452 54.3529 32.2085 175.4084 47 R 4.9668 8.9990 122.0726 54.1076 34.6822 175.0259 48 G 4.0245 9.0737 111.2369 46.3589 0.0000 172.3924 49 F 5.5173 9.0367 125.3748 56.8303 42.5494 173.0961 50 H 5.2100 8.8610 122.4453 54.1524 33.8485 172.7749 51 V 4.3069 8.7329 122.4877 62.8200 32.6577 175.0532 52 H 5.1734 9.3318 125.4408 54.4300 30.8291 176.0864 53 Q 3.7961 8.8817 122.5477 58.7521 29.3084 176.4256 54 F 4.9955 8.2617 117.7893 54.9609 41.5958 176.8424 55 G 4.4764 8.4180 111.6166 44.5831 0.0000 174.1413 56 D 4.7227 8.0234 118.6806 52.6540 42.2321 174.2525 57 N 5.1834 8.8150 123.8445 52.5383 39.1232 175.7491 58 S 4.2555 8.6554 113.9714 60.0550 63.5261 174.0313 59 N 4.9473 8.2628 120.6080 52.9360 39.4838 174.0758 60 G 3.9970 7.8406 109.1991 46.9163 0.0000 176.2436 61 C 4.4371 8.6107 116.2000 59.4420 37.2003 175.9034 62 T 3.8681 7.7458 117.4673 66.3291 67.7255 175.8270 63 S 4.4890 7.9002 112.4919 59.2506 63.5759 175.3039 64 A 4.6318 7.4726 126.6834 54.4131 18.2950 178.7404 65 G 4.1460 8.0895 106.0053 44.2980 0.0000 170.8652 66 P 4.6896 0.0000 0.0000 61.9345 33.7601 175.2085 67 H 4.4929 8.4194 116.5101 55.7633 29.5015 175.6379 68 F 4.2854 9.0472 125.5587 57.9666 40.2221 175.3006 69 N 4.8994 7.6989 125.8970 51.7687 38.8740 173.2236 70 P 4.1327 0.0000 0.0000 65.2034 32.1055 177.8396 71 T 4.1341 7.5931 107.2364 60.7251 69.4256 174.3008 72 G 3.7955 7.7428 110.0555 47.6734 0.0000 172.3622 73 T 4.8057 8.1452 114.8427 60.2453 70.2896 172.7516 74 N 4.9842 8.3660 117.1734 51.6561 41.6870 174.0472 75 H 4.1407 8.6769 121.0612 56.6200 30.6329 174.6210 76 G 4.2892 7.8878 111.3316 44.3276 0.0000 171.7700 77 D 4.5095 8.3089 118.1224 53.6012 41.8302 176.7457 78 R 4.1181 8.9005 122.9068 58.6870 29.9901 177.3224 79 T 4.2777 7.7558 104.2865 61.4198 69.4530 174.5113 80 A 4.3246 7.5349 125.5171 51.5081 19.4944 177.5466 81 E 3.9131 8.8076 120.8902 58.6238 30.1415 177.3373 82 V 4.1915 7.5310 120.3781 61.2623 32.0956 174.3199 83 R 4.9504 7.7817 121.3924 55.6019 32.0803 174.5575 84 H 4.3590 8.9064 117.2870 55.5715 29.3459 176.9554 85 V 3.4956 8.3570 122.5071 66.1957 31.4354 177.2408 86 G 3.8069 8.1707 106.3680 46.0915 0.0000 172.6250 87 D 4.9604 8.1994 121.7863 53.8774 40.3462 176.4086 88 L 4.7028 8.3921 123.5581 53.9762 42.7564 179.2137 89 G 3.8968 7.9610 108.0203 45.6473 0.0000 171.9670 90 N 5.4573 8.6486 117.4259 52.1344 40.4165 175.3280 91 V 4.3638 8.6481 116.0487 59.8328 34.7032 174.7906 92 K 5.0638 8.3570 121.8997 55.1190 34.3442 175.5473 93 T 4.8656 8.6511 114.9560 60.1782 71.7935 174.6995 94 D 4.7012 8.6269 123.1288 52.1753 41.5631 176.7505 95 A 4.0086 8.4275 120.6714 54.9846 18.3763 178.4936 96 S 4.4381 8.2507 110.0797 58.2306 63.4018 174.5742 97 G 3.9790 7.9949 108.1067 46.6866 0.0000 172.5573 98 V 4.8073 8.1341 119.5920 60.6812 33.8825 174.2434 99 A 4.9478 8.8179 130.3199 50.0014 20.4676 176.2317 100 K 4.5980 8.4981 123.3805 55.2132 32.2511 176.1274 101 V 3.6641 8.5494 126.2283 62.5647 32.9040 175.0265 102 Q 4.4666 8.3591 129.1342 55.5231 30.7429 173.0476 103 I 4.7190 9.0187 127.4977 59.3590 41.6392 174.4217 104 S 5.1940 8.8106 120.7994 56.6115 64.1717 172.4784 105 D 4.9700 9.2302 126.9977 52.8366 43.8754 176.2013 106 S 4.5378 9.0025 120.3138 59.2882 63.7449 174.9406 107 Q 4.3116 8.1504 118.6854 57.5306 29.3795 176.5673 108 L 4.2432 7.9735 116.6284 55.2541 42.4042 176.2267 109 S 4.6596 8.2634 113.8445 57.3924 65.3708 174.2465 110 L 4.6145 8.8596 123.3926 54.6251 41.8723 176.7768 111 V 4.3815 7.3703 111.1548 60.6800 36.0009 176.1768 112 G 3.8868 8.5261 109.9338 44.1937 0.0000 172.2250 113 P 4.2695 0.0000 0.0000 65.6343 31.3007 177.0455 114 H 5.0724 8.0727 112.8635 55.4480 28.8195 174.9358 115 S 4.3709 8.0852 115.3676 58.7949 62.6760 174.1613 116 I 3.7205 8.2721 119.3887 60.4343 38.0263 175.6870 117 I 3.7260 7.1816 123.5244 63.0517 37.4136 176.4694 118 G 3.8463 9.3970 113.1887 45.5754 0.0000 173.1607 119 R 5.0222 7.4416 119.7413 54.7676 33.7506 174.6390 120 T 5.0439 7.9629 114.6948 62.4764 72.3241 173.1389 121 I 4.6345 8.5219 126.2768 59.7349 40.0991 174.4143 122 V 4.9285 8.6563 128.6638 61.0711 35.0142 173.6305 123 I 5.1336 8.6688 127.7300 59.8432 40.0995 174.4165 124 H 5.3936 9.0008 126.1497 54.4280 30.4565 175.0340 125 A 4.2665 9.0398 121.5692 53.6060 19.1288 177.2328 126 G 4.2672 8.2262 101.9971 43.7807 0.0000 171.9048 127 E 4.7183 8.4989 119.6460 54.9549 30.2859 175.1903 128 D 4.6053 9.3984 126.8230 54.2864 41.8211 175.7073 129 D 4.5318 9.2031 125.6801 53.3752 39.9632 177.4122 130 L 3.7828 9.4451 120.0283 55.4863 39.5631 175.5151 131 G 3.9637 8.6482 105.2693 46.2679 0.0000 174.6014 132 K 4.5481 7.9190 116.3402 55.7687 32.4294 175.5787 133 T 4.7220 7.6911 108.9875 59.7219 71.5243 173.2299 134 D 4.6352 8.5010 118.7729 53.6030 39.9678 176.1810 135 H 4.2025 8.1346 121.6868 55.6606 30.2893 174.4232 136 P 4.2607 0.0000 0.0000 65.1799 31.5254 176.8592 137 E 4.3123 8.3240 117.4252 57.0352 30.4412 177.9163 138 S 4.1846 8.3900 114.7734 61.4868 62.4138 175.4897 139 L 4.3369 7.8437 118.8138 55.5418 41.4388 178.4621 140 K 4.2033 7.6562 118.2623 57.9634 33.1361 177.2680 141 T 4.0155 7.9102 103.9887 59.9339 70.5014 174.7725 142 G 3.7193 8.0174 110.9409 44.8849 0.0000 173.0419 143 N 4.0141 7.6125 115.5923 54.4725 37.8295 174.1262 144 A 4.5792 7.2057 116.8024 51.0094 19.8300 179.4127 145 G 3.9718 7.9227 105.4097 45.2804 0.0000 173.5919 146 A 4.1561 8.3219 120.3895 52.3770 19.9670 178.1234 147 R 4.2614 8.4501 119.3445 55.1873 29.1047 176.5518 148 S 4.3907 8.8436 121.2551 61.3626 64.1518 174.1775 149 A 4.7679 7.8014 118.5897 51.4244 22.5819 174.0152 150 C 5.3032 9.1769 113.4112 54.8836 46.9507 173.0541 151 G 4.8073 8.7543 105.5916 44.7956 0.0000 172.4821 152 V 4.3255 8.3543 123.2268 62.6079 32.7762 175.4950 153 I 4.2391 8.9103 129.6326 60.8142 37.9338 175.2179 154 G 4.4323 9.0162 114.9891 43.8744 0.0000 172.0208 155 I 4.2856 8.3422 121.7484 61.1873 37.6535 175.4157 156 A 4.8759 8.6945 127.7481 49.4958 22.3277 176.2221 157 A 4.1105 8.4088 120.4600 52.6078 18.5729 177.8121 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 5 I 7.88 4.27 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 1.24 0.52 0.92 0.00 0.00 6 K 8.47 5.05 0.00 1.89 1.61 0.00 1.68 0.00 0.00 1.98 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.66 7.81 7 A 9.47 5.42 1.18 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 0.00 0.00 8 I 8.73 5.19 1.94 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 1.22 1.51 0.96 0.00 0.00 9 A 9.38 5.17 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.44 4.58 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 1.01 0.00 0.00 0.95 0.00 0.00 11 L 9.06 4.85 0.00 1.67 1.61 1.06 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.83 4.98 0.00 1.68 1.64 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.41 7.81 13 G 7.90 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 14 D 8.48 4.59 0.00 2.63 2.62 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 15 S 6.95 4.56 0.00 3.96 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 16 P 0.00 4.44 0.00 2.20 2.20 0.00 3.77 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 2.13 1.95 0.00 17 V 7.60 4.16 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 0.82 0.00 0.00 0.98 0.00 0.00 18 Q 8.58 4.81 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.38 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 19 G 8.21 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 0.00 0.00 0.00 20 V 8.02 5.02 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 1.03 0.00 0.00 0.94 0.00 0.00 21 I 8.89 4.86 1.90 0.00 0.00 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 1.34 1.19 0.43 0.00 0.00 22 T 8.89 5.07 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 1.21 0.00 0.00 23 F 9.29 5.41 0.00 2.88 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 24 T 9.15 5.28 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 1.25 0.00 0.00 25 Q 8.90 4.55 0.00 2.08 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.60 0.00 26 E 9.31 3.75 0.00 1.98 1.91 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 2.30 2.33 0.00 *30 G 7.51 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 0.00 0.00 0.00 31 P 0.00 4.63 0.00 2.12 2.09 0.00 3.77 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 32 V 8.73 4.43 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 1.24 0.00 0.00 1.03 0.00 0.00 33 T 9.01 4.90 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 1.21 0.00 0.00 34 V 8.99 4.56 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 0.82 0.00 0.00 1.07 0.00 0.00 35 S 8.68 5.57 0.00 3.83 3.55 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 36 G 7.42 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 37 E 8.09 5.12 0.00 1.86 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 2.23 2.26 0.00 38 I 8.62 4.81 1.78 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.70 0.90 0.00 0.00 39 K 9.00 4.85 0.00 1.60 1.65 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.35 7.81 40 N 8.66 4.24 0.00 3.00 2.93 0.00 0.00 6.92 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 41 M 7.78 4.43 0.00 2.07 2.10 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 2.57 2.49 0.00 42 D 8.33 4.48 0.00 2.66 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 43 A 8.33 4.36 1.26 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 0.00 0.00 44 N 8.73 4.31 0.00 2.85 2.87 0.00 0.00 6.67 6.86 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 45 A 8.25 4.91 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 46 Q 8.47 5.06 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 47 R 9.00 4.97 0.00 1.66 1.95 0.00 3.49 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 48 G 9.07 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 49 F 9.04 5.52 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 50 H 8.86 5.21 0.00 3.08 2.85 0.00 5.68 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.73 4.31 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 0.87 0.00 0.00 0.87 0.00 0.00 52 H 9.33 5.17 0.00 3.07 3.44 0.00 5.69 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 Q 8.88 3.80 0.00 1.75 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.62 0.00 0.00 0.00 0.00 0.00 1.25 2.10 0.00 54 F 8.26 5.00 0.00 3.28 2.84 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 55 G 8.42 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 0.00 0.00 0.00 0.00 56 D 8.02 4.72 0.00 2.60 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 57 N 8.81 5.18 0.00 2.71 2.76 0.00 0.00 7.37 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 58 S 8.66 4.26 0.00 3.99 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 59 N 8.26 4.95 0.00 2.77 2.74 0.00 0.00 6.93 7.82 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 60 G 7.84 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 0.00 0.00 0.00 61 C 8.61 4.44 0.00 2.99 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 62 T 7.75 3.87 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 1.24 0.00 0.00 63 S 7.90 4.49 0.00 4.04 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 64 A 7.47 4.63 1.40 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 65 G 8.09 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 0.00 0.00 0.00 66 P 0.00 4.69 0.00 2.05 2.20 0.00 3.63 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 67 H 8.42 4.49 0.00 2.77 3.13 0.00 5.72 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 68 F 9.05 4.29 0.00 2.89 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 69 N 7.70 4.90 0.00 2.61 2.43 0.00 0.00 6.94 7.71 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 70 P 0.00 4.13 0.00 1.92 1.81 0.00 2.95 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 1.26 0.88 0.00 71 T 7.59 4.13 4.19 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 0.00 0.00 0.00 1.15 0.00 0.00 72 G 7.74 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 0.00 0.00 0.00 73 T 8.15 4.81 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 74 N 8.37 4.98 0.00 2.67 2.66 0.00 0.00 6.50 8.16 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 75 H 8.68 4.14 0.00 3.28 3.28 0.00 5.97 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 7.89 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 77 D 8.31 4.51 0.00 2.69 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 78 R 8.90 4.12 0.00 1.84 1.99 0.00 3.16 0.00 0.00 4.01 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 79 T 7.76 4.28 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 1.22 0.00 0.00 80 A 7.53 4.32 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 81 E 8.81 3.91 0.00 1.93 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 2.28 2.29 0.00 82 V 7.53 4.19 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 0.98 0.00 0.00 0.91 0.00 0.00 83 R 7.78 4.95 0.00 1.96 1.87 0.00 2.93 0.00 0.00 3.98 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 84 H 8.91 4.36 0.00 3.49 3.37 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.36 3.50 1.61 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 0.85 0.00 0.00 0.70 0.00 0.00 86 G 8.17 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 0.00 0.00 0.00 87 D 8.20 4.96 0.00 2.83 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 88 L 8.39 4.70 0.00 1.89 1.86 0.87 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 89 G 7.96 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 0.00 0.00 0.00 90 N 8.65 5.46 0.00 2.64 2.76 0.00 0.00 6.66 7.68 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 91 V 8.65 4.36 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 0.33 0.00 0.00 0.73 0.00 0.00 92 K 8.36 5.06 0.00 1.65 1.67 0.00 1.62 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.38 7.81 93 T 8.65 4.87 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 1.17 0.00 0.00 94 D 8.63 4.70 0.00 2.89 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 95 A 8.43 4.01 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 96 S 8.25 4.44 0.00 3.99 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 97 G 7.99 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 98 V 8.13 4.81 2.34 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 1.04 0.00 0.00 0.91 0.00 0.00 99 A 8.82 4.95 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 0.00 100 K 8.50 4.60 0.00 1.60 1.75 0.00 1.72 0.00 0.00 1.60 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.38 7.81 101 V 8.55 3.66 1.91 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 0.72 0.00 0.00 0.45 0.00 0.00 102 Q 8.36 4.47 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.47 0.00 0.00 0.00 0.00 0.00 2.23 2.44 0.00 103 I 9.02 4.72 1.95 0.00 0.00 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 1.16 0.55 0.98 0.00 0.00 104 S 8.81 5.19 0.00 3.86 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 0.00 105 D 9.23 4.97 0.00 2.83 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.00 4.54 0.00 3.91 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 0.00 107 Q 8.15 4.31 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 108 L 7.97 4.24 0.00 1.72 1.68 1.09 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.26 4.66 0.00 3.84 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 0.00 110 L 8.86 4.61 0.00 1.78 1.64 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.37 4.38 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 0.66 0.00 0.00 0.94 0.00 0.00 112 G 8.53 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 0.00 0.00 0.00 113 P 0.00 4.27 0.00 2.06 2.18 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 114 H 8.07 5.07 0.00 3.16 3.40 0.00 5.73 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.09 4.37 0.00 3.89 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.27 3.72 1.52 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.23 0.87 0.00 0.00 117 I 7.18 3.73 1.78 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 1.13 0.74 0.85 0.00 0.00 118 G 9.40 3.85 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 0.00 0.00 0.00 119 R 7.44 5.02 0.00 1.55 1.83 0.00 2.21 0.00 0.00 2.30 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.31 0.00 120 T 7.96 5.04 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 1.22 0.00 0.00 121 I 8.52 4.63 2.01 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.14 1.11 0.00 0.00 122 V 8.66 4.93 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 0.72 0.00 0.00 0.74 0.00 0.00 123 I 8.67 5.13 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.21 0.99 0.00 0.00 124 H 9.00 5.39 0.00 3.24 3.49 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 A 9.04 4.27 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 0.00 126 G 8.23 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 0.00 0.00 0.00 0.00 127 E 8.50 4.72 0.00 2.10 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 2.39 2.27 0.00 128 D 9.40 4.61 0.00 2.75 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 0.00 129 D 9.20 4.53 0.00 2.91 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 L 9.45 3.78 0.00 1.88 1.85 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.65 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 0.00 0.00 0.00 132 K 7.92 4.55 0.00 1.86 1.80 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.56 1.48 7.81 133 T 7.69 4.72 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 1.29 0.00 0.00 134 D 8.50 4.64 0.00 2.81 2.81 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 0.00 135 H 8.13 4.20 0.00 3.22 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.26 0.00 2.18 2.12 0.00 3.16 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.87 0.00 137 E 8.32 4.31 0.00 2.08 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 2.45 2.29 0.00 138 S 8.39 4.18 0.00 3.96 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 0.00 139 L 7.84 4.34 0.00 1.73 1.68 0.92 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 140 K 7.66 4.20 0.00 1.79 1.80 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.23 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.47 7.81 141 T 7.91 4.02 4.07 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 1.12 0.00 0.00 142 G 8.02 3.72 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 0.00 0.00 0.00 143 N 7.61 4.01 0.00 2.71 2.85 0.00 0.00 7.01 7.70 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 0.00 144 A 7.21 4.58 1.26 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 0.00 0.00 145 G 7.92 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 0.00 146 A 8.32 4.16 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 0.00 147 R 8.45 4.26 0.00 1.68 1.84 0.00 3.22 0.00 0.00 3.14 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 148 S 8.84 4.39 0.00 3.94 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 0.00 149 A 7.80 4.77 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 0.00 150 C 9.18 5.30 0.00 3.02 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 0.00 151 G 8.75 4.81 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 0.00 0.00 0.00 152 V 8.35 4.33 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 0.94 0.00 0.00 153 I 8.91 4.24 1.79 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.29 0.44 0.00 0.00 154 G 9.02 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.34 4.29 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 1.26 0.55 0.91 0.00 0.00 156 A 8.69 4.88 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 0.00 157 A 8.41 4.11 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 * Residues marked with a * may have inaccurate shift predictions.