NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.3133 0.0000 0.0000 62.5221 32.6153 175.1533 3 R 4.0801 8.4295 120.8475 54.4416 30.8541 174.4633 4 A 4.5233 8.1724 129.4762 50.0493 19.6106 175.5749 5 K 4.2697 8.1096 120.2031 56.9370 33.1997 177.1740 6 T 3.7993 7.8122 115.5617 63.7301 69.8001 178.3195 7 G 4.0128 7.5259 112.2820 47.0548 0.0000 176.6718 8 V 3.7358 8.5567 117.4184 64.3435 31.0903 176.9846 9 V 3.4000 7.9119 116.0865 66.8384 31.2762 177.6702 10 R 3.8546 7.9263 116.9722 59.5384 30.3210 178.4710 11 R 3.8221 7.9606 117.9076 59.8173 30.0116 177.7836 12 R 3.8728 7.6562 116.7300 59.5970 30.0267 178.8916 13 K 3.8624 7.9092 117.4954 60.1258 32.1867 179.0958 14 H 4.0999 8.4285 116.0683 58.7286 28.6506 177.4855 15 K 4.1840 8.3567 118.9181 57.8003 32.0785 178.1784 16 K 4.0909 7.9110 119.9852 60.2428 32.5269 178.6018 17 I 3.6837 7.5038 119.7644 63.9086 36.8296 178.6229 18 L 4.0158 7.7769 119.9383 57.7285 41.6620 179.0959 19 K 3.6310 7.7020 118.4955 59.8456 31.7127 179.1566 20 L 4.0519 7.3803 117.1050 56.9824 41.7674 178.4049 21 A 3.4665 8.5055 119.8829 51.0475 18.9418 177.0076 22 K 3.7292 6.5506 114.9714 58.0592 32.3624 177.0327 23 G 3.9794 8.8405 112.2671 45.3846 0.0000 173.2212 24 Y 4.8209 7.5418 117.0329 57.2558 39.2924 175.9743 25 W 4.2383 9.1116 133.1613 59.3638 31.2178 178.7840 26 G 4.4892 9.0545 114.7272 44.6671 0.0000 177.7953 27 L 4.0829 8.9010 125.5128 57.0769 41.7293 178.8693 28 R 4.1620 8.2545 117.7834 58.5074 30.2998 177.3138 29 S 4.8774 8.2032 109.4930 57.5984 64.3417 174.4867 30 K 4.3883 9.7716 119.2714 55.9639 33.9471 175.9009 31 S 4.5739 7.9190 115.9183 56.7734 62.4021 176.2986 *32 F 4.5875 8.4370 130.8029 56.0827 36.7013 173.4854 33 R 4.5701 10.1740 121.2938 57.8339 32.8087 177.1022 34 K 4.1849 8.0481 115.0513 58.4736 31.9228 178.9298 35 A 4.7012 7.7211 122.5745 55.0403 18.5820 178.4545 36 R 3.5827 8.3498 115.7884 59.6301 29.8163 178.4117 37 E 4.0329 8.0662 116.1860 59.8196 29.5616 179.5647 38 T 3.7349 7.2011 113.1749 67.2186 68.8360 175.7758 39 L 4.1113 8.4852 120.0563 58.6467 41.7361 180.4651 40 F 4.2663 7.4200 116.1477 60.4970 39.2418 178.2086 41 A 3.7379 8.1779 120.3557 54.8536 17.8601 179.1272 42 A 4.3403 8.4784 118.6883 53.8938 18.3533 179.5124 43 G 3.7133 7.7369 104.5853 47.3321 0.0000 175.9079 44 N 4.3124 8.0576 119.2036 55.7251 38.3892 177.1541 45 Y 4.2618 7.8623 118.0147 61.1039 37.8507 177.7463 46 A 4.0653 7.5395 119.0177 56.0591 18.6780 178.4036 47 Y 3.9232 8.4509 117.7010 60.3959 38.8085 177.7825 48 A 4.1730 9.0190 122.0608 55.8074 18.6138 178.9824 49 H 4.5382 8.5759 114.0910 57.9581 28.8391 178.0678 50 R 3.9233 7.9139 119.9024 59.4612 30.1484 178.3415 51 K 3.8660 8.1208 117.8805 58.8808 31.9842 179.3000 52 R 3.7918 8.2573 117.8470 59.5358 30.2616 178.6024 53 R 3.5917 8.3191 118.6486 59.4917 29.8752 178.4246 54 K 3.8912 8.0461 118.0475 59.6106 31.6964 179.6382 55 R 3.9528 7.8328 115.5621 59.0474 29.2090 178.0480 56 D 4.2312 8.0803 118.8428 57.0015 41.4110 177.7016 57 F 4.4204 7.8086 118.1293 59.7333 39.0513 177.6346 58 R 3.7975 7.4337 118.4145 59.7323 29.6939 178.3926 59 R 3.8169 7.4075 116.1874 59.3358 30.2201 178.6251 60 L 3.8843 7.6453 119.8509 57.9501 41.8846 179.2168 61 W 4.3547 7.4893 118.1888 59.8956 29.3033 177.9614 62 I 3.5027 8.1836 120.0530 64.9390 36.7276 178.4252 63 V 3.6900 8.1573 118.8053 66.2267 31.0622 178.2808 64 R 4.0773 7.7463 116.5751 58.9747 30.2465 178.5660 65 I 3.9336 8.4145 120.5323 64.0355 36.8445 177.5554 66 N 4.4953 9.0381 117.7099 56.7734 39.0266 178.0122 67 A 4.6126 7.7778 120.7340 51.5484 18.5839 177.4562 68 A 4.7233 9.4516 126.5503 54.7633 26.3000 179.2773 69 C 3.9156 9.1683 110.6255 60.4904 29.7665 175.2174 70 R 4.8689 7.9817 118.4254 56.4568 29.5412 176.2571 71 Q 4.4197 8.7680 116.5911 57.3217 29.6059 176.1119 72 H 4.7068 7.8561 113.8454 55.6948 28.5303 175.3825 73 G 4.3272 8.0888 114.4238 45.8936 0.0000 175.1697 74 L 4.2929 7.6572 119.3309 54.3488 41.9841 175.3997 75 N 5.2796 8.2121 116.8856 51.4252 41.0303 173.9735 76 Y 4.1595 8.9812 119.2410 61.4035 38.0705 177.9642 77 S 4.0895 8.4009 113.8378 62.2238 62.8629 176.9913 78 T 3.9470 8.0616 118.4131 66.5677 67.7407 176.0473 79 F 4.3252 8.6002 122.5443 62.4933 38.5725 176.7132 80 I 3.0813 7.8319 118.2172 64.5946 36.9291 177.8439 81 H 4.0729 8.0948 117.1781 59.4514 29.9592 177.3975 82 G 3.5297 8.2996 108.7277 47.2949 0.0000 175.0646 83 L 3.7900 8.9551 123.9758 57.5396 41.8525 179.2036 84 K 3.8873 9.1057 119.7517 59.3953 32.0425 178.9088 85 K 3.9240 8.2942 118.4183 59.1999 32.0993 178.2918 86 A 4.0832 8.3102 120.8237 53.5061 18.3157 178.3545 87 G 3.8954 7.9813 105.4609 45.2495 0.0000 173.8759 88 I 3.9119 6.9410 120.5566 61.1645 37.2614 175.5223 89 E 4.6749 8.5325 122.5706 56.0243 30.8736 177.2295 90 V 4.0659 7.2344 125.7757 60.9857 30.4973 177.8305 91 D 4.0659 9.3777 113.3125 54.1505 41.6816 173.8843 92 R 3.7634 8.6547 113.7368 56.4516 28.4745 177.6589 93 K 4.1606 8.2008 123.5779 58.1205 30.9609 177.2527 94 N 2.0000 7.1975 114.3839 55.7391 38.5574 175.9458 95 L 4.3923 7.5431 117.0206 55.0158 42.0906 178.4195 96 A 4.7381 8.1463 122.7118 54.4126 17.8786 179.0850 97 D 4.2967 8.4704 118.2497 57.3519 38.8995 180.2744 98 L 3.7331 7.9283 119.5003 56.8875 41.6028 178.5017 99 A 3.6139 6.9945 118.6986 53.5763 18.0316 177.9292 100 V 3.9840 7.6724 115.3775 62.8739 32.9291 175.3850 101 R 3.9884 7.5379 118.0971 56.8380 30.9988 175.8433 102 E 3.8909 8.7424 124.0039 56.8386 25.9910 173.1552 103 P 4.3039 0.0000 0.0000 65.2502 31.8035 177.6780 104 Q 3.6994 8.2827 116.6544 59.1300 28.3289 178.9795 105 V 3.7978 7.2588 117.5159 64.7935 31.8011 177.7059 106 F 4.3529 8.1687 120.1657 61.3128 39.5801 176.4989 107 A 4.0450 9.0588 121.5396 55.8340 18.2773 179.5384 108 E 3.9439 8.0733 116.4334 59.4651 29.3939 179.7581 109 L 4.0425 8.0801 119.4239 57.3229 41.5251 179.7714 110 V 3.0721 7.1376 117.9560 66.5515 31.4966 176.7837 111 E 3.6844 8.3263 115.1818 59.6798 29.1631 180.2959 112 R 3.8934 8.0262 117.5372 59.1885 30.5797 178.5653 113 A 3.9995 7.7911 120.7781 55.1807 18.6572 179.7881 114 K 4.1355 8.8034 116.7727 59.2867 32.8330 179.1738 115 A 4.0238 8.9297 123.8009 54.8531 18.0223 178.5411 116 A 4.5017 7.7393 116.1141 52.5439 18.3627 177.7025 117 Q 4.4751 7.6276 115.0103 55.9739 30.9032 175.8118 118 G 3.9477 8.1412 113.3433 46.1666 0.0000 173.6318 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 2 P 0.00 4.31 0.00 2.19 2.12 0.00 3.72 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 1.88 1.96 0.00 3 R 8.43 4.08 0.00 1.86 1.87 0.00 3.20 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 4 A 8.17 4.52 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 5 K 8.11 4.27 0.00 1.88 1.83 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.46 7.81 6 T 7.81 3.80 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 7 G 7.53 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 0.00 0.00 0.00 8 V 8.56 3.74 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 0.88 0.00 0.00 0.93 0.00 0.00 9 V 7.91 3.40 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 1.04 0.00 0.00 1.01 0.00 0.00 10 R 7.93 3.85 0.00 1.92 1.90 0.00 3.23 0.00 0.00 3.30 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 11 R 7.96 3.82 0.00 1.89 1.94 0.00 3.24 0.00 0.00 3.32 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.76 0.00 12 R 7.66 3.87 0.00 2.12 1.98 0.00 3.32 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 13 K 7.91 3.86 0.00 1.94 1.87 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.51 7.81 14 H 8.43 4.10 0.00 3.41 3.34 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.36 4.18 0.00 1.69 2.02 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.58 7.81 16 K 7.91 4.09 0.00 1.90 1.95 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.45 7.81 17 I 7.50 3.68 1.91 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.83 0.83 0.00 0.00 18 L 7.78 4.02 0.00 1.71 1.68 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.70 3.63 0.00 1.86 1.85 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 20 L 7.38 4.05 0.00 1.81 1.68 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.51 3.47 1.44 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 0.00 0.00 0.00 22 K 6.55 3.73 0.00 1.67 1.72 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.60 1.52 7.81 23 G 8.84 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 24 Y 7.54 4.82 0.00 3.11 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 25 W 9.11 4.24 0.00 3.41 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 26 G 9.05 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 27 L 8.90 4.08 0.00 1.74 1.78 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.25 4.16 0.00 2.10 2.10 0.00 3.05 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 29 S 8.20 4.88 0.00 3.95 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 30 K 9.77 4.39 0.00 1.73 1.84 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.72 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.53 1.46 7.81 31 S 7.92 4.57 0.00 3.84 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 0.00 *32 F 8.44 4.59 0.00 2.34 2.16 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 33 R 10.17 4.57 0.00 1.79 1.86 0.00 3.08 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 34 K 8.05 4.18 0.00 1.80 1.89 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.46 1.47 7.81 35 A 7.72 4.70 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 36 R 8.35 3.58 0.00 1.66 1.90 0.00 2.25 0.00 0.00 2.81 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.92 0.00 37 E 8.07 4.03 0.00 2.29 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 0.00 2.46 2.48 0.00 38 T 7.20 3.73 4.41 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 0.39 0.00 0.00 39 L 8.49 4.11 0.00 1.70 1.73 0.90 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.42 4.27 0.00 3.30 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 41 A 8.18 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.48 4.34 1.45 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 0.00 0.00 43 G 7.74 3.71 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 0.00 0.00 0.00 44 N 8.06 4.31 0.00 2.56 2.80 0.00 0.00 6.97 7.48 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 45 Y 7.86 4.26 0.00 2.97 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 46 A 7.54 4.07 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 47 Y 8.45 3.92 0.00 3.16 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 48 A 9.02 4.17 1.51 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 0.00 0.00 49 H 8.58 4.54 0.00 3.24 3.29 0.00 5.62 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 7.91 3.92 0.00 1.69 1.89 0.00 3.09 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.96 0.00 51 K 8.12 3.87 0.00 1.94 1.75 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.50 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.46 7.81 52 R 8.26 3.79 0.00 1.94 1.88 0.00 3.21 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 53 R 8.32 3.59 0.00 1.72 2.03 0.00 2.94 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.11 0.00 54 K 8.05 3.89 0.00 1.80 1.87 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.76 1.59 7.81 55 R 7.83 3.95 0.00 1.99 2.17 0.00 2.93 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 56 D 8.08 4.23 0.00 2.50 2.41 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 57 F 7.81 4.42 0.00 2.68 1.45 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 58 R 7.43 3.80 0.00 2.02 1.92 0.00 3.21 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.99 0.00 59 R 7.41 3.82 0.00 2.01 1.89 0.00 3.13 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 60 L 7.65 3.88 0.00 1.53 1.36 0.82 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 61 W 7.49 4.35 0.00 3.71 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 I 8.18 3.50 1.67 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 1.61 0.67 -0.04 0.00 0.00 63 V 8.16 3.69 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 1.02 0.00 0.00 0.95 0.00 0.00 64 R 7.75 4.08 0.00 2.15 1.98 0.00 3.28 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 65 I 8.41 3.93 2.41 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.82 1.53 0.00 0.00 66 N 9.04 4.50 0.00 2.87 2.89 0.00 0.00 7.25 8.14 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 67 A 7.78 4.61 1.42 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 0.00 0.00 0.00 68 A 9.45 4.72 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 69 C 9.17 3.92 0.00 2.59 3.41 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 70 R 7.98 4.87 0.00 2.21 2.01 0.00 3.08 0.00 0.00 3.92 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 71 Q 8.77 4.42 0.00 2.23 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.63 6.98 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 72 H 7.86 4.71 0.00 3.03 3.24 0.00 5.64 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.09 4.33 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 0.00 74 L 7.66 4.29 0.00 1.90 1.82 0.80 0.22 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 75 N 8.21 5.28 0.00 3.02 3.04 0.00 0.00 5.50 7.57 0.00 0.00 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 Y 8.98 4.16 0.00 3.23 3.10 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 77 S 8.40 4.09 0.00 4.13 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 0.00 78 T 8.06 3.95 4.46 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 0.00 0.00 0.00 1.25 0.00 0.00 79 F 8.60 4.33 0.00 2.94 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 80 I 7.83 3.08 1.45 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.08 0.23 0.75 0.00 0.00 81 H 8.09 4.07 0.00 3.28 3.53 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.30 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.96 3.79 0.00 1.55 1.45 0.94 -0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 84 K 9.11 3.89 0.00 1.95 1.84 0.00 1.54 0.00 0.00 1.51 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.44 7.81 85 K 8.29 3.92 0.00 1.69 1.71 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.41 7.81 86 A 8.31 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 87 G 7.98 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 88 I 6.94 3.91 1.80 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.54 0.88 0.00 0.00 89 E 8.53 4.67 0.00 2.01 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 2.14 2.23 0.00 90 V 7.23 4.07 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 0.75 0.00 0.00 0.91 0.00 0.00 91 D 9.38 4.07 0.00 2.73 2.49 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 92 R 8.65 3.76 0.00 1.72 1.91 0.00 3.38 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.88 0.00 93 K 8.20 4.16 0.00 2.19 2.21 0.00 1.67 0.00 0.00 1.90 0.00 0.00 3.34 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.67 1.70 7.81 94 N 7.20 2.00 0.00 1.44 2.15 0.00 0.00 6.93 7.78 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 95 L 7.54 4.39 0.00 1.70 1.60 0.84 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.15 4.74 1.58 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 97 D 8.47 4.30 0.00 2.82 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 98 L 7.93 3.73 0.00 1.97 1.89 1.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 99 A 6.99 3.61 0.24 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 0.00 100 V 7.67 3.98 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 0.87 0.00 0.00 0.88 0.00 0.00 101 R 7.54 3.99 0.00 1.82 1.85 0.00 3.38 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 102 E 8.74 3.89 0.00 2.20 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 2.30 2.31 0.00 103 P 0.00 4.30 0.00 2.20 2.13 0.00 3.63 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.28 0.00 104 Q 8.28 3.70 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.90 0.00 0.00 0.00 0.00 0.00 2.47 2.52 0.00 105 V 7.26 3.80 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 0.84 0.00 0.00 0.96 0.00 0.00 106 F 8.17 4.35 0.00 3.13 3.20 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 0.00 107 A 9.06 4.04 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 0.00 108 E 8.07 3.94 0.00 1.97 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 2.33 2.36 0.00 109 L 8.08 4.04 0.00 1.66 1.75 1.04 0.88 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 0.00 110 V 7.14 3.07 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 0.83 0.00 0.00 0.02 0.00 0.00 111 E 8.33 3.68 0.00 2.21 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 2.55 2.51 0.00 112 R 8.03 3.89 0.00 2.04 1.94 0.00 3.28 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.84 0.00 113 A 7.79 4.00 1.56 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 0.00 0.00 114 K 8.80 4.14 0.00 1.94 2.06 0.00 1.25 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.67 1.42 7.81 115 A 8.93 4.02 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 0.00 116 A 7.74 4.50 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 Q 7.63 4.48 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 118 G 8.14 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 * Residues marked with a * may have inaccurate shift predictions.