NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 Y 4.6679 8.0033 121.6875 57.3960 40.0147 173.7291 26 Q 4.1238 7.2833 124.0052 51.2925 31.8760 173.1772 27 P 4.4056 0.0000 0.0000 60.6311 33.2972 173.4243 28 P 4.5934 0.0000 0.0000 61.9047 32.1322 177.5367 29 S 4.2925 8.7927 113.0390 61.3040 62.6588 174.8373 30 D 4.7950 8.0771 116.4114 53.6640 41.7604 174.7866 31 Y 4.4227 7.6096 118.6627 56.5123 38.5355 174.7856 32 K 4.5380 8.4247 126.2237 53.9490 34.0878 175.4896 33 Q 3.9810 8.7204 126.9200 56.6386 29.2964 175.5582 34 C 4.3854 8.7337 123.4649 59.5590 28.4717 172.7457 35 K 4.3591 8.8041 125.7444 57.2584 33.9445 176.3069 36 H 4.9391 7.8185 114.9076 54.7062 28.8142 174.5132 37 L 4.1996 7.2838 118.5429 54.8564 42.4928 177.8281 38 K 4.4428 8.2792 120.5553 55.2725 33.2627 177.3587 39 S 4.4400 8.4102 116.8112 58.2652 63.8093 173.3452 40 F 4.7800 8.3305 122.9183 55.8139 42.0391 173.5045 41 P 4.4027 0.0000 0.0000 62.3096 29.4025 177.0095 42 V 3.8899 8.1956 124.3686 65.2178 32.1241 178.5486 43 S 4.1677 8.0740 113.8817 61.2191 62.9877 175.4554 44 E 4.0371 7.5145 119.7690 58.7636 28.0071 177.9770 45 L 4.0825 7.4048 119.2322 57.6611 42.0281 179.4144 46 K 4.0868 8.0887 118.7410 59.3508 32.3039 177.9440 47 G 3.8584 7.3013 106.8450 45.7974 0.0000 172.7790 48 D 5.0415 8.2867 117.5811 54.0015 41.2422 177.0940 49 N 4.7928 8.0605 116.0444 53.8204 41.6745 173.9839 50 K 4.5068 7.8558 115.4465 54.7920 34.1162 174.3271 51 E 5.0042 8.2890 119.6527 53.2694 32.8807 174.1252 52 L 4.8805 8.5202 120.0687 53.5108 44.9101 175.0317 53 W 5.4343 9.3406 126.3761 55.0224 30.9875 175.3497 54 L 4.9599 8.6524 125.2940 53.7961 45.4244 175.1951 55 M 5.0324 8.3156 122.0948 54.3833 36.2034 174.9892 56 K 4.2858 10.0587 127.7985 55.2305 32.1621 174.3432 57 V 4.7157 7.8664 125.2351 59.8880 32.9808 173.6025 58 P 4.3930 0.0000 0.0000 62.4316 31.8754 177.4510 59 A 4.0929 8.5011 123.7272 54.9812 18.6382 178.6946 60 N 4.4051 8.3584 112.7487 56.3038 38.7608 175.4716 61 I 3.9896 7.2311 118.2761 60.5115 37.7961 175.4178 62 D 4.6037 8.4701 125.3131 52.9967 39.9260 176.5188 63 I 3.9974 8.0838 126.6386 62.5647 37.5524 177.8525 64 S 4.3278 7.9698 115.3876 61.1594 63.3753 175.7548 65 Q 4.0829 7.7087 119.3179 58.0488 28.6525 177.0538 66 L 3.9774 7.9007 117.7725 55.1932 41.9589 176.6422 67 K 4.2863 8.6503 124.4369 57.6846 33.1359 176.3235 68 S 4.6048 7.5841 110.2362 56.9120 66.0475 173.5664 69 L 4.6852 7.9550 122.2125 53.3800 41.3664 176.1827 70 P 4.5579 0.0000 0.0000 61.0214 30.1447 174.1809 71 L 4.5932 7.6815 121.6716 52.3646 44.1508 175.4477 72 D 4.4627 8.6778 126.1402 54.6283 41.4767 175.9072 73 T 4.2858 8.6135 117.6603 64.0014 69.5815 175.6125 74 D 4.3667 8.2958 120.4829 55.1731 40.0744 176.1611 75 A 4.2293 7.7154 123.0613 51.4110 18.4422 176.6079 76 T 3.9766 8.7813 118.5354 65.2005 68.6014 173.5623 77 V 4.6368 7.7765 121.6523 61.4235 33.0790 174.1990 78 S 4.9357 8.8360 123.1298 56.9705 66.5519 171.7871 79 T 5.2933 8.3077 109.7256 60.2514 72.4510 174.1404 80 V 4.1828 8.8085 121.1427 60.9326 34.0841 173.1604 81 E 4.3023 9.0275 128.3603 55.8285 29.4988 176.0390 82 L 4.5359 8.9277 128.0941 53.2837 42.4118 177.0965 83 G 3.7863 8.9452 116.4876 45.0725 0.0000 171.2711 84 S 4.3617 8.4034 111.1408 59.0796 65.1421 173.8497 85 K 3.7413 7.9732 121.7189 56.3998 31.7949 176.3223 86 N 4.3767 8.4245 123.6625 53.7278 39.6108 174.0929 87 F 5.0217 8.6881 124.1864 56.3249 41.6929 174.2813 88 N 5.2699 9.5067 119.6830 51.6573 40.9995 174.0177 89 V 5.0019 8.9776 123.7422 60.9808 34.8291 173.8055 90 L 4.4780 8.9533 130.7977 53.4523 43.7056 175.2617 91 Q 4.7618 9.4332 131.0737 54.1790 27.4548 175.5299 92 N 4.2337 8.2696 119.4470 55.6313 37.5535 177.3598 93 T 3.7611 7.5572 111.9279 64.3121 67.8297 173.6949 94 S 4.6252 7.6082 117.0410 57.0282 62.4922 173.7048 95 T 4.5676 7.0859 108.3091 60.5814 71.2962 174.1888 96 Q 4.1907 8.5569 124.0459 57.6876 29.5409 177.0171 97 E 4.0607 8.2145 116.6994 59.8180 29.7500 178.2494 98 G 4.0214 7.6714 104.6022 45.4891 0.0000 173.5381 99 S 4.4802 7.7476 112.2025 57.4838 62.0559 173.6202 100 D 4.3281 7.4336 117.1124 53.4604 44.0207 175.4781 101 N 5.0464 8.2609 126.5275 52.7465 39.2750 175.3674 102 T 3.1024 7.5780 103.2476 61.5531 69.1225 175.2645 103 N 4.7216 7.7220 120.5000 54.7283 38.7396 175.0561 104 L 4.3004 7.9069 119.9390 53.9792 40.3753 175.7374 105 S 4.6858 8.3978 117.4810 55.5827 64.5724 174.0838 106 L 4.0218 7.7505 127.4744 55.4407 42.7774 175.5938 107 L 5.1674 8.4240 125.4447 52.8800 44.4591 175.8218 108 I 4.6513 8.5292 116.1000 58.3798 41.1541 172.7746 109 P 4.8415 0.0000 0.0000 61.8842 30.6929 175.7401 110 S 4.0056 7.9857 120.4424 60.3166 63.5881 174.0211 *113 K 4.0919 7.4513 121.8497 55.6676 33.3545 176.2729 114 K 4.2149 8.3105 118.1978 57.5726 32.5473 178.5107 115 E 3.8711 8.0633 119.6889 57.4018 30.1292 176.0414 116 T 4.7178 7.6132 106.4958 59.4638 71.6926 172.5521 117 L 4.7408 8.2968 122.3276 53.2030 43.7061 175.9200 118 K 4.6426 8.6501 121.8136 54.3801 36.1710 175.0192 119 V 4.2243 8.1074 121.1962 61.7286 32.6281 175.4290 120 A 4.1967 8.1601 130.4665 52.2640 19.2363 176.2726 121 T 4.6499 8.4754 113.2884 60.0304 70.9711 173.5812 122 S 4.5053 8.6951 117.4948 59.4892 64.7798 175.0790 123 K 4.3903 7.7064 115.3679 55.2428 34.6100 176.4774 *127 S 3.9853 7.8269 112.1785 57.8958 63.6423 171.8956 128 V 4.1347 7.6730 125.4656 61.6634 33.6559 174.0976 129 Y 4.9977 8.2113 124.5164 55.8985 41.1946 175.1059 130 F 4.3955 8.8646 119.4782 57.3688 39.4599 175.6874 131 D 4.6268 9.1073 126.0914 56.9444 41.8631 176.3168 132 R 4.4267 8.9952 118.3695 54.2837 33.4501 174.0427 133 V 4.4916 7.3559 123.8420 61.0962 34.9379 174.4438 134 F 5.0105 8.0897 121.1409 56.4944 43.8901 173.8176 135 T 4.7247 8.8705 120.1902 61.9856 69.8259 172.1138 136 I 4.8049 8.3937 126.9614 59.8952 38.5380 175.4617 137 S 4.9983 9.8715 123.3288 56.4883 67.4956 173.5240 138 E 4.5359 8.9322 121.0490 56.3733 30.5856 177.4321 139 T 4.1372 7.8158 109.9739 62.0238 69.0605 173.7857 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 25 Y 8.00 4.67 0.00 2.97 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 26 Q 7.28 4.12 0.00 1.87 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.12 2.26 0.00 27 P 0.00 4.41 0.00 2.22 2.14 0.00 3.21 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 1.96 1.96 0.00 28 P 0.00 4.59 0.00 2.54 2.15 0.00 3.62 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.03 0.00 29 S 8.79 4.29 0.00 3.99 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 30 D 8.08 4.80 0.00 2.52 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 7.61 4.42 0.00 2.99 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 32 K 8.42 4.54 0.00 1.72 1.71 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.42 7.81 33 Q 8.72 3.98 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 34 C 8.73 4.39 0.00 3.04 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 35 K 8.80 4.36 0.00 1.72 1.82 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.42 7.81 36 H 7.82 4.94 0.00 3.16 3.27 0.00 5.76 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 37 L 7.28 4.20 0.00 1.67 1.63 0.95 0.83 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 38 K 8.28 4.44 0.00 1.80 1.78 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.40 7.81 39 S 8.41 4.44 0.00 4.02 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 40 F 8.33 4.78 0.00 2.90 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 41 P 0.00 4.40 0.00 2.02 1.85 0.00 2.26 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.84 0.00 42 V 8.20 3.89 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 1.05 0.00 0.00 1.14 0.00 0.00 43 S 8.07 4.17 0.00 4.00 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 44 E 7.51 4.04 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 2.29 2.21 0.00 45 L 7.40 4.08 0.00 1.92 1.67 1.05 0.85 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 46 K 8.09 4.09 0.00 1.74 1.89 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.52 7.81 47 G 7.30 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 48 D 8.29 5.04 0.00 2.66 2.66 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 0.00 0.00 0.00 0.00 49 N 8.06 4.79 0.00 2.60 2.76 0.00 0.00 7.20 6.68 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 50 K 7.86 4.51 0.00 1.92 1.72 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.40 7.81 51 E 8.29 5.00 0.00 2.02 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 0.00 2.52 2.33 0.00 52 L 8.52 4.88 0.00 1.81 1.65 1.04 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 53 W 9.34 5.43 0.00 3.26 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 8.65 4.96 0.00 1.01 1.12 0.60 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 55 M 8.32 5.03 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.93 0.00 56 K 10.06 4.29 0.00 1.64 1.70 0.00 1.59 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.36 7.81 57 V 7.87 4.72 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 0.69 0.00 0.00 0.92 0.00 0.00 58 P 0.00 4.39 0.00 2.29 2.03 0.00 3.44 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.16 0.00 59 A 8.50 4.09 1.30 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 0.00 0.00 60 N 8.36 4.41 0.00 2.83 3.00 0.00 0.00 6.94 7.45 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 61 I 7.23 3.99 1.77 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.45 0.85 0.00 0.00 62 D 8.47 4.60 0.00 2.68 2.59 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 63 I 8.08 4.00 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.92 0.90 0.00 0.00 64 S 7.97 4.33 0.00 3.98 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 65 Q 7.71 4.08 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.48 0.00 66 L 7.90 3.98 0.00 1.77 1.61 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 67 K 8.65 4.29 0.00 1.70 1.81 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.40 7.81 68 S 7.58 4.60 0.00 3.93 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 69 L 7.96 4.69 0.00 1.45 1.46 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.56 0.00 2.09 2.00 0.00 3.70 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 2.03 2.06 0.00 71 L 7.68 4.59 0.00 1.54 1.60 0.73 0.23 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 8.68 4.46 0.00 2.68 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 8.61 4.29 4.37 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 1.46 0.00 0.00 74 D 8.30 4.37 0.00 2.83 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 75 A 7.72 4.23 1.38 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 76 T 8.78 3.98 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 77 V 7.78 4.64 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 0.94 0.00 0.00 78 S 8.84 4.94 0.00 4.04 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 79 T 8.31 5.29 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 80 V 8.81 4.18 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 0.63 0.00 0.00 1.00 0.00 0.00 81 E 9.03 4.30 0.00 2.05 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 2.32 2.30 0.00 82 L 8.93 4.54 0.00 1.81 1.62 0.52 1.00 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 83 G 8.95 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 84 S 8.40 4.36 0.00 3.80 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 85 K 7.97 3.74 0.00 1.55 1.37 0.00 1.88 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.37 1.42 7.81 86 N 8.42 4.38 0.00 2.65 2.62 0.00 0.00 7.19 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 8.69 5.02 0.00 3.21 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 88 N 9.51 5.27 0.00 2.86 2.77 0.00 0.00 6.50 8.32 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 89 V 8.98 5.00 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 0.99 0.00 0.00 0.99 0.00 0.00 90 L 8.95 4.48 0.00 1.79 1.54 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 9.43 4.76 0.00 2.35 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.51 0.00 0.00 0.00 0.00 0.00 2.80 2.76 0.00 92 N 8.27 4.23 0.00 2.79 2.89 0.00 0.00 6.29 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 93 T 7.56 3.76 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 1.01 0.00 0.00 94 S 7.61 4.63 0.00 4.03 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 95 T 7.09 4.57 4.44 0.00 0.00 0.00 0.00 0.00 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 8.56 4.19 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.12 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 97 E 8.21 4.06 0.00 1.97 1.95 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 2.29 2.28 0.00 98 G 7.67 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 99 S 7.75 4.48 0.00 4.14 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 0.00 100 D 7.43 4.33 0.00 2.54 2.43 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 0.00 101 N 8.26 5.05 0.00 2.79 2.67 0.00 0.00 6.86 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 7.58 3.10 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 0.65 0.00 0.00 103 N 7.72 4.72 0.00 2.83 2.95 0.00 0.00 6.88 9.00 0.00 0.00 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 7.91 4.30 0.00 2.04 1.84 0.79 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.40 4.69 0.00 3.76 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 0.00 106 L 7.75 4.02 0.00 1.45 1.34 0.69 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.42 5.17 0.00 1.49 1.49 0.90 0.77 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 0.00 108 I 8.53 4.65 1.88 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 1.23 0.67 0.70 0.00 0.00 109 P 0.00 4.84 0.00 2.21 2.13 0.00 3.79 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 2.15 1.96 0.00 110 S 7.99 4.01 0.00 4.00 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 *113 K 7.45 4.09 0.00 1.90 1.89 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.41 7.81 114 K 8.31 4.21 0.00 1.82 1.86 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.62 1.43 7.81 115 E 8.06 3.87 0.00 1.90 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 2.26 2.28 0.00 116 T 7.61 4.72 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 8.30 4.74 0.00 1.51 1.58 0.91 0.80 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 0.00 118 K 8.65 4.64 0.00 1.67 1.66 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.32 7.81 119 V 8.11 4.22 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 0.66 0.00 0.00 0.89 0.00 0.00 120 A 8.16 4.20 1.15 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 0.00 121 T 8.48 4.65 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 0.00 122 S 8.70 4.51 0.00 3.91 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 0.00 123 K 7.71 4.39 0.00 1.70 1.81 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.33 1.40 7.81 *127 S 7.83 3.99 0.00 3.67 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 0.00 128 V 7.67 4.13 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 0.84 0.00 0.00 0.83 0.00 0.00 129 Y 8.21 5.00 0.00 2.89 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 0.00 130 F 8.86 4.40 0.00 3.05 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 0.00 131 D 9.11 4.63 0.00 2.98 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 0.00 132 R 9.00 4.43 0.00 1.90 0.99 0.00 3.14 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.42 0.00 133 V 7.36 4.49 1.86 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 0.66 0.00 0.00 0.75 0.00 0.00 134 F 8.09 5.01 0.00 2.93 2.74 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 0.00 135 T 8.87 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 1.22 0.00 0.00 136 I 8.39 4.80 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 1.21 0.57 0.72 0.00 0.00 137 S 9.87 5.00 0.00 3.67 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 0.00 138 E 8.93 4.54 0.00 1.90 1.87 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 2.69 2.46 0.00 139 T 7.82 4.14 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.