NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 37 K 4.2785 8.3149 120.1338 55.9917 32.9333 175.5458 38 K 4.0483 8.4535 123.7519 54.4647 32.7641 175.9032 39 S 4.5619 9.0927 110.5242 57.2780 64.1466 175.1076 40 K 3.7550 8.5835 125.5741 57.2804 32.1817 176.1813 41 I 4.4655 7.9346 115.6096 57.9761 40.7890 174.0980 42 S 3.9272 8.6566 113.9417 58.6009 61.6390 174.5729 43 A 4.2424 8.5753 130.6041 54.0010 18.2602 177.7764 44 S 4.4662 7.5220 110.1907 59.4312 63.7690 175.9276 45 R 4.3186 8.3009 120.8457 58.3172 29.9247 177.9233 46 K 3.8580 8.0676 118.0457 59.7416 31.8434 178.6216 47 L 4.0161 7.9232 119.0874 57.4334 41.7229 178.5266 48 Q 3.9975 8.5571 120.0873 59.1425 29.0616 177.6305 49 L 4.0598 7.6658 119.4565 57.5359 41.9756 179.3183 50 K 3.9264 8.7458 118.8816 59.7647 31.9938 179.5578 51 T 3.9037 7.6458 115.7096 66.6469 68.3735 176.8078 52 L 4.0467 7.7242 120.8616 57.6749 41.5202 179.3863 53 L 4.0237 8.6187 119.5244 57.6926 41.4458 179.3882 54 L 4.1482 7.8343 118.1571 57.1860 41.6988 178.9505 55 Q 3.9505 8.0816 119.5941 58.7346 28.7799 178.2612 56 I 3.6736 7.8706 119.6840 64.0377 38.1770 177.4479 57 A 3.9479 7.7280 121.5223 55.1041 18.1358 179.5674 58 K 3.8392 8.2580 118.0740 59.8185 32.3221 178.6438 59 Q 3.9734 7.6683 118.1377 59.2781 28.6810 178.8848 60 E 3.9065 8.3709 119.2868 59.6086 29.6066 179.1594 61 L 3.8988 8.2109 120.3886 58.4728 42.1255 178.6685 62 E 4.0701 8.1632 118.1020 58.4084 29.6017 178.7328 63 R 3.8554 7.8168 119.2976 59.3922 30.3127 177.6986 64 E 3.9074 8.8048 119.2743 59.4239 29.5489 178.7468 65 A 4.0028 8.0209 120.7131 55.1140 18.2870 179.2629 66 E 3.9485 8.1443 117.7719 59.2719 29.6653 178.8516 67 E 4.0125 8.1918 118.7153 58.9025 29.4292 179.0264 68 R 4.1688 7.7269 120.2303 58.9942 30.1346 178.6731 69 R 4.0132 8.0973 118.0239 59.1929 29.9549 179.2188 70 G 3.5139 7.7388 105.4635 47.7873 0.0000 175.3619 71 E 3.9595 8.7040 122.1975 58.9575 29.6077 179.6816 72 K 4.1194 8.4534 119.7506 59.3931 31.9475 179.0871 73 G 3.5889 7.7861 105.4873 47.6919 0.0000 175.7663 74 R 4.0699 8.2614 120.3445 58.7693 30.0898 178.7234 75 A 3.9809 8.3928 121.0362 55.4429 18.0422 179.7559 76 L 4.0224 8.0845 116.6165 57.2864 41.3740 179.3904 77 S 4.2876 7.8602 112.9683 60.4365 62.3944 175.4008 78 T 4.2501 7.6737 111.0933 64.1659 69.5270 176.8783 79 R 4.1288 8.0517 119.1271 57.3739 31.2056 176.6892 80 A 4.7139 7.4628 120.0361 50.6010 19.1297 176.6305 81 Q 4.1494 8.1121 119.8424 55.6497 29.7103 174.7330 82 P 4.0546 0.0000 0.0000 61.0810 32.5178 175.2504 83 L 4.0386 8.3764 123.9042 54.6391 42.3347 175.7025 84 E 4.5163 8.7390 127.1790 54.7683 30.4788 175.0415 85 L 4.4711 8.3437 125.2373 54.2800 42.8727 176.9683 86 A 3.9819 7.7416 122.9667 53.6130 18.5879 177.6546 87 G 4.0681 9.3884 112.2711 44.9540 0.0000 172.9720 88 L 4.3515 7.2651 117.6796 54.1532 44.6518 174.0232 89 G 4.0074 8.2737 114.7630 44.8611 0.0000 174.6474 90 F 3.8671 8.6437 119.7077 60.9623 39.5061 177.3279 91 A 3.8254 8.0614 120.1921 55.2954 18.2841 179.2747 92 E 3.9504 8.0002 116.4745 58.9090 29.5476 179.1875 93 L 3.9057 7.7296 120.3179 57.9995 42.1824 178.5369 94 Q 3.7003 7.7403 119.5415 58.8172 28.7859 177.6399 95 D 4.2590 7.5927 119.1467 56.7539 41.3241 177.9900 96 L 3.9209 8.1444 121.1696 57.8579 42.0740 178.7258 97 A 3.9773 8.1123 120.8433 55.4224 18.3545 179.8230 98 R 3.9675 7.5141 115.9042 59.4902 30.0089 179.4091 99 Q 4.0088 7.8489 117.5575 58.8826 28.6540 178.7266 100 L 3.9807 7.9560 120.0866 57.9794 41.5099 178.9282 101 H 4.0641 8.9018 118.3489 59.2377 29.6729 177.2323 102 A 4.0097 8.1019 122.6337 55.0207 18.2065 179.5462 103 R 3.7892 8.1847 117.4062 59.4077 30.1505 178.6875 104 V 3.5480 8.1043 118.4612 66.3514 31.3542 177.7615 105 D 4.3272 7.7373 118.3816 57.0731 40.7433 178.6694 106 K 3.8976 8.1969 120.3585 59.7355 32.1977 179.1405 107 V 3.6631 8.2310 118.7850 65.8249 31.3067 177.4576 108 D 4.3189 8.3031 118.0364 56.9509 40.8994 177.8717 109 E 3.9805 8.0275 120.3252 59.2143 29.5999 178.5241 110 E 3.9884 8.1114 118.2709 59.2488 29.4720 179.3640 111 R 3.8427 8.2960 118.9495 59.6163 30.1784 177.8121 112 Y 3.9073 8.2983 119.5716 60.7770 38.8219 177.7677 113 D 4.3989 8.5704 119.9477 57.4683 40.9361 178.5310 114 I 3.5889 7.4971 118.5196 64.2802 38.0346 177.2104 115 E 3.7712 8.2037 119.7731 59.4577 29.1644 178.8438 116 A 3.7824 7.7723 120.6883 54.9243 18.3677 179.7812 117 K 3.8723 7.7927 116.8833 59.5599 32.2038 179.7982 118 V 3.5542 7.9846 118.8991 66.2620 31.0674 178.2700 119 T 3.8683 8.2877 115.9136 66.3970 68.2943 176.8828 120 K 4.0027 8.2219 120.5463 59.5761 32.0771 178.8527 121 N 4.2692 8.2596 116.7967 56.6405 38.4647 177.3091 122 I 3.7056 7.6187 120.6149 64.7202 37.3255 178.6321 123 T 3.9336 7.5976 109.2378 64.5294 68.5210 176.4121 124 E 3.8879 8.1659 122.1310 59.0612 29.7314 178.4588 125 I 3.6556 8.1033 120.1772 64.7417 37.2384 178.1917 126 A 4.2256 8.0328 120.9745 54.9772 17.9724 179.5149 127 D 4.2458 7.8775 117.3135 57.5540 41.1701 178.7381 128 L 3.9946 8.2101 119.7613 58.2898 41.6203 179.5925 129 T 3.8382 8.4286 115.8113 66.9319 68.5043 176.3616 130 Q 4.0587 8.0307 120.7536 59.4155 28.9796 177.7866 131 K 4.0182 8.4167 121.7740 59.1644 32.2345 178.3102 132 I 3.7173 8.7309 119.5091 64.0490 37.9829 178.1934 133 F 4.0467 8.3933 121.7047 61.2289 39.0282 176.7382 134 D 4.4670 8.0563 117.4665 58.1115 40.9558 178.2544 135 L 4.0205 8.1624 119.6569 57.1832 41.3370 179.2962 136 R 4.0195 8.2686 121.5951 59.1272 30.4137 178.8026 137 G 3.6107 7.5574 103.2160 45.3046 0.0000 173.8477 138 K 4.3916 7.5143 119.5856 54.3739 31.9927 174.9785 *149 I 3.8134 7.2378 119.4915 60.8621 39.3848 175.7882 150 S 4.5425 8.0533 118.1442 56.4212 61.9761 174.0093 151 A 4.0082 8.3007 131.0300 54.8426 18.1104 178.4135 152 D 4.3212 8.1476 116.0614 56.6713 39.5743 178.3508 153 A 4.1782 7.7472 121.6209 54.7633 18.5320 178.9488 154 M 3.9456 8.3447 117.1250 59.1129 32.0925 178.1445 155 M 4.0513 8.0422 118.6315 58.6793 32.3436 178.2573 156 Q 4.1169 8.0414 116.9267 57.3536 29.1000 177.2052 157 A 4.1163 7.3894 120.4865 55.6182 19.4983 179.0797 158 L 4.1199 9.5574 117.3307 57.7480 42.1275 179.6345 159 L 4.1118 8.4300 119.1438 57.2850 41.3087 179.1012 160 G 4.3842 8.0419 104.1953 44.5780 0.0000 174.8662 161 A 4.1549 8.4008 124.8841 54.1462 18.3331 178.3761 162 R 4.0377 7.3751 117.3165 56.5194 29.4803 176.4850 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 37 K 8.31 4.28 0.00 1.76 1.85 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.47 7.81 38 K 8.45 4.05 0.00 1.83 1.74 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 39 S 9.09 4.56 0.00 3.91 3.83 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 40 K 8.58 3.76 0.00 1.76 1.85 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.46 1.48 7.81 41 I 7.93 4.47 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 1.30 0.54 1.01 0.00 0.00 42 S 8.66 3.93 0.00 3.87 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 43 A 8.58 4.24 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 44 S 7.52 4.47 0.00 3.90 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 45 R 8.30 4.32 0.00 1.82 2.09 0.00 3.12 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.84 0.00 46 K 8.07 3.86 0.00 1.83 1.86 0.00 1.73 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.52 7.81 47 L 7.92 4.02 0.00 1.71 1.67 0.92 0.57 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 48 Q 8.56 4.00 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.61 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 49 L 7.67 4.06 0.00 1.73 1.69 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.75 3.93 0.00 1.75 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.62 7.81 51 T 7.65 3.90 4.30 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 1.21 0.00 0.00 52 L 7.72 4.05 0.00 1.81 1.71 0.97 0.57 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 53 L 8.62 4.02 0.00 1.86 1.72 0.92 0.72 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 54 L 7.83 4.15 0.00 1.71 1.70 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.08 3.95 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 56 I 7.87 3.67 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 1.45 1.71 0.95 0.00 0.00 57 A 7.73 3.95 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 58 K 8.26 3.84 0.00 2.01 1.95 0.00 1.55 0.00 0.00 1.65 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.53 7.81 59 Q 7.67 3.97 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.51 0.00 0.00 0.00 0.00 0.00 2.39 2.68 0.00 60 E 8.37 3.91 0.00 2.16 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 2.34 2.53 0.00 61 L 8.21 3.90 0.00 1.87 1.83 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.16 4.07 0.00 2.16 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 0.00 2.30 2.35 0.00 63 R 7.82 3.86 0.00 2.05 2.09 0.00 3.16 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 64 E 8.80 3.91 0.00 2.02 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 0.00 2.31 2.34 0.00 65 A 8.02 4.00 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 66 E 8.14 3.95 0.00 2.25 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 2.30 2.39 0.00 67 E 8.19 4.01 0.00 2.25 1.97 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 2.32 2.51 0.00 68 R 7.73 4.17 0.00 2.07 2.03 0.00 3.14 0.00 0.00 3.26 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 69 R 8.10 4.01 0.00 2.20 1.97 0.00 3.18 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 70 G 7.74 3.51 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 0.00 71 E 8.70 3.96 0.00 1.96 2.03 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 2.33 2.44 0.00 72 K 8.45 4.12 0.00 1.83 1.89 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.46 7.81 73 G 7.79 3.59 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 74 R 8.26 4.07 0.00 2.01 1.98 0.00 3.15 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 75 A 8.39 3.98 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 76 L 8.08 4.02 0.00 1.71 1.73 0.92 0.68 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 77 S 7.86 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 78 T 7.67 4.25 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 1.27 0.00 0.00 79 R 8.05 4.13 0.00 1.81 2.03 0.00 3.11 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 80 A 7.46 4.71 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 81 Q 8.11 4.15 0.00 2.17 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.66 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 82 P 0.00 4.05 0.00 2.07 2.02 0.00 3.67 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 2.03 2.13 0.00 83 L 8.38 4.04 0.00 1.58 1.58 0.92 0.85 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 84 E 8.74 4.52 0.00 1.91 1.82 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 0.00 2.18 2.34 0.00 85 L 8.34 4.47 0.00 1.66 1.68 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.74 3.98 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 87 G 9.39 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 0.00 0.00 0.00 0.00 88 L 7.27 4.35 0.00 1.58 1.51 0.96 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.27 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 90 F 8.64 3.87 0.00 3.14 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 91 A 8.06 3.83 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 92 E 8.00 3.95 0.00 1.97 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 2.31 2.45 0.00 93 L 7.73 3.91 0.00 1.73 1.56 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 94 Q 7.74 3.70 0.00 1.70 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.60 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 95 D 7.59 4.26 0.00 2.68 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 96 L 8.14 3.92 0.00 1.83 1.79 0.91 1.05 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 97 A 8.11 3.98 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 98 R 7.51 3.97 0.00 2.09 1.97 0.00 3.08 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 99 Q 7.85 4.01 0.00 2.29 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 100 L 7.96 3.98 0.00 1.89 1.71 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 101 H 8.90 4.06 0.00 3.23 3.46 0.00 5.58 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 0.00 102 A 8.10 4.01 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 0.00 103 R 8.18 3.79 0.00 2.06 2.10 0.00 3.11 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 104 V 8.10 3.55 2.20 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 0.93 0.00 0.00 0.98 0.00 0.00 105 D 7.74 4.33 0.00 2.85 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 0.00 106 K 8.20 3.90 0.00 1.93 2.00 0.00 1.52 0.00 0.00 1.57 0.00 0.00 3.18 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.50 7.81 107 V 8.23 3.66 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 0.97 0.00 0.00 108 D 8.30 4.32 0.00 2.95 2.65 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 0.00 109 E 8.03 3.98 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 2.33 2.30 0.00 110 E 8.11 3.99 0.00 2.21 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 2.35 2.65 0.00 111 R 8.30 3.84 0.00 2.03 2.17 0.00 3.12 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 112 Y 8.30 3.91 0.00 3.22 3.14 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 0.00 113 D 8.57 4.40 0.00 2.90 2.75 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 0.00 114 I 7.50 3.59 1.86 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 1.39 1.46 1.05 0.00 0.00 115 E 8.20 3.77 0.00 2.07 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 0.00 2.14 2.25 0.00 116 A 7.77 3.78 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 0.00 117 K 7.79 3.87 0.00 1.98 1.84 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.57 7.81 118 V 7.98 3.55 2.18 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 1.00 0.00 0.00 0.92 0.00 0.00 119 T 8.29 3.87 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 1.17 0.00 0.00 120 K 8.22 4.00 0.00 1.93 1.84 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.61 7.81 121 N 8.26 4.27 0.00 2.88 2.87 0.00 0.00 7.08 6.92 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 0.00 122 I 7.62 3.71 2.01 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 1.56 0.84 0.89 0.00 0.00 123 T 7.60 3.93 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 1.20 0.00 0.00 124 E 8.17 3.89 0.00 2.08 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 0.00 2.30 2.35 0.00 125 I 8.10 3.66 2.03 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 1.72 0.61 0.91 0.00 0.00 126 A 8.03 4.23 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 0.00 127 D 7.88 4.25 0.00 2.97 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 0.00 128 L 8.21 3.99 0.00 1.67 1.74 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 129 T 8.43 3.84 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 0.00 130 Q 8.03 4.06 0.00 2.21 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 131 K 8.42 4.02 0.00 2.06 1.98 0.00 1.60 0.00 0.00 1.59 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.51 7.81 132 I 8.73 3.72 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.19 1.07 0.00 0.00 133 F 8.39 4.05 0.00 3.30 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 0.00 134 D 8.06 4.47 0.00 3.00 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 0.00 135 L 8.16 4.02 0.00 1.85 1.60 0.92 0.70 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 0.00 136 R 8.27 4.02 0.00 1.61 1.90 0.00 3.16 0.00 0.00 3.19 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 137 G 7.56 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 0.00 138 K 7.51 4.39 0.00 1.69 1.70 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.28 7.81 *149 I 7.24 3.81 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 1.30 0.76 0.91 0.00 0.00 150 S 8.05 4.54 0.00 3.91 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 0.00 151 A 8.30 4.01 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 0.00 152 D 8.15 4.32 0.00 2.82 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 0.00 153 A 7.75 4.18 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 0.00 154 M 8.34 3.95 0.00 2.19 2.09 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 2.60 2.60 0.00 155 M 8.04 4.05 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.86 0.00 156 Q 8.04 4.12 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 157 A 7.39 4.12 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 0.00 158 L 9.56 4.12 0.00 1.79 1.69 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 159 L 8.43 4.11 0.00 1.85 1.72 0.92 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 160 G 8.04 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 0.00 161 A 8.40 4.15 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 0.00 162 R 7.38 4.04 0.00 2.02 1.93 0.00 3.15 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 * Residues marked with a * may have inaccurate shift predictions.