NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 27 N 4.6572 8.5245 117.7897 51.5677 39.2605 173.7298 28 N 3.8939 8.9729 115.4016 53.9768 39.8816 170.8356 *29 Y 3.4131 8.5702 120.4354 58.5456 34.3417 166.6674 30 K 4.6536 8.3720 128.7626 52.4641 34.2275 174.3817 31 K 4.8804 8.2427 125.2662 52.4689 36.5843 177.4275 32 R 4.3968 8.1873 121.0342 60.6842 28.4355 172.2362 33 L 4.1023 8.8551 123.2846 54.6088 39.0051 172.1203 34 L 4.8648 7.9898 115.4636 52.3543 44.4266 178.5391 35 G 4.1697 8.6020 113.9582 43.5929 0.0000 172.9621 36 T 4.3544 8.2930 113.0872 59.7897 68.8732 175.0218 37 A 5.0007 9.0710 135.0000 51.3794 21.0550 178.7864 *38 F 3.5064 7.9814 114.8566 57.2847 36.7349 180.6572 39 K 3.9872 9.0137 118.3657 57.5013 29.7265 174.5105 *40 S 4.6816 7.9002 125.6276 59.1817 60.8691 179.0686 41 S 4.7175 9.2649 118.0927 58.3445 65.1740 174.8042 42 P 4.6800 0.0000 0.0000 62.4979 33.0793 181.1808 *43 F 4.0884 8.3601 120.3097 57.8635 36.2384 180.3623 44 G 3.8157 8.1979 104.4259 45.5173 0.0000 173.3980 45 G 3.9844 8.6153 109.7146 46.5379 0.0000 175.3998 46 S 4.3108 7.9661 117.7125 58.5059 63.0107 178.0029 47 S 4.4752 8.7892 119.5496 58.2623 62.7281 175.9725 *48 H 5.4228 7.5252 122.8475 55.1653 31.1016 179.1923 49 A 3.7369 7.5475 129.3376 52.5499 20.2589 178.1390 50 K 4.4402 8.4665 126.8306 55.5543 33.3894 173.5775 51 G 5.0401 7.4502 114.7517 47.1722 0.0000 173.6397 52 I 4.0603 7.9011 126.0643 60.3574 37.0399 175.5496 53 V 4.1059 8.0949 124.4510 60.4144 29.7242 178.1618 54 L 3.8812 7.2841 125.7505 57.5137 41.9460 179.2904 55 E 4.8103 9.0325 117.4871 55.1746 34.8016 177.3172 56 K 4.5749 8.6144 126.3314 55.1328 30.7492 177.4292 57 L 4.3581 8.0616 124.5560 52.7819 41.2315 175.4508 58 G 3.8636 8.5810 113.2822 46.5021 0.0000 171.7623 59 I 4.3745 8.0637 130.1527 61.4441 36.4933 172.4928 60 E 4.9034 8.6632 116.8806 57.8176 33.3647 172.7152 61 S 4.3396 9.3361 126.2458 59.1700 63.3545 172.3127 62 K 4.5247 7.8722 125.2248 54.9972 33.6925 177.8175 63 Q 4.0023 8.6202 117.9233 58.0482 27.8119 169.2132 64 P 4.2970 0.0000 0.0000 64.5249 29.4142 176.8449 65 N 4.7485 7.7591 118.1312 52.5209 39.0570 177.4382 66 S 4.6150 7.8466 109.1999 59.9863 65.9022 172.8622 67 A 4.2635 8.1891 127.7553 51.3226 22.7233 176.0145 68 I 4.4173 8.0482 122.1575 59.5556 35.3897 177.5019 69 R 4.2194 8.7817 132.8962 60.4799 29.1003 178.3826 70 K 4.5435 8.3304 123.3406 54.5155 27.1467 175.9408 71 C 5.6252 8.2437 125.8217 53.6086 42.9791 171.0831 72 V 4.9174 8.6076 115.8970 62.2341 35.7373 171.4854 73 R 5.0791 9.5486 128.7992 55.5444 31.6003 174.5244 74 V 4.9271 9.0183 123.6882 60.4295 36.9801 171.3938 75 Q 4.9030 8.7455 124.8383 55.1151 30.3821 176.6593 76 L 4.3499 9.1421 129.3701 54.6554 41.1909 176.4813 77 I 3.6637 8.2914 126.6438 62.5500 36.7202 174.7341 78 K 3.5939 8.7041 118.3730 59.0234 30.3309 179.4558 79 N 4.5435 9.2350 116.9514 53.1146 38.7393 178.8929 80 G 4.2831 8.4339 114.3300 48.4811 0.0000 175.1960 81 K 4.3067 7.1228 123.6777 52.9652 33.2235 177.8367 82 K 4.9396 8.7124 130.5154 54.1341 33.2842 175.1471 83 V 4.6806 9.0511 125.0264 59.9922 36.6537 172.9958 84 T 5.2108 8.4910 114.5086 60.0172 71.6049 174.2478 85 A 4.7382 9.3616 129.9296 49.5080 23.6572 175.8468 *86 F 4.0921 9.0331 122.6017 58.3311 38.8826 178.0581 87 V 3.9700 8.1670 123.9951 61.6655 31.4403 171.3922 88 P 4.0622 0.0000 0.0000 63.5537 29.9214 177.7645 89 N 5.0347 8.0585 125.2325 49.9243 44.7451 171.3968 90 D 5.5225 7.9676 132.2262 53.8717 40.9001 179.4221 91 G 4.1730 7.1635 108.6016 47.4726 0.0000 175.4519 92 C 5.0168 8.2823 116.6385 54.4013 40.9272 179.2900 93 L 4.3800 7.6257 123.6520 54.7141 40.4913 179.8972 94 N 4.5561 7.9991 122.3285 55.7335 38.1723 178.8308 *95 F 3.7716 7.8414 119.3816 57.1757 38.5204 178.7098 96 V 3.6279 7.0944 121.3773 62.7281 29.2131 178.1240 97 D 4.8088 7.6408 128.1991 52.3429 39.6172 179.7410 98 E 4.1942 8.8063 124.0190 58.9067 29.5709 177.5719 99 N 4.4147 7.9412 119.5641 54.3193 38.2910 176.5876 100 D 4.6342 7.7669 121.6928 52.5363 40.3587 179.8301 101 E 4.7656 8.5356 119.1920 55.8674 32.4508 177.9902 102 V 4.2082 8.2354 128.9452 61.1373 33.4071 174.2138 103 L 4.8507 8.0906 118.6096 55.6029 43.5079 173.8504 104 L 3.3034 8.0506 115.8638 56.5258 40.0796 176.4807 105 A 4.8784 7.2507 121.6184 52.7291 21.6805 177.5178 106 G 3.6879 8.4202 115.9582 46.6605 0.0000 173.7670 *107 F 4.4275 8.1908 117.7073 61.4128 38.5674 179.7960 108 G 3.6368 7.0182 110.2002 47.4109 0.0000 175.6123 109 R 4.4514 8.5691 128.5506 56.5495 31.8935 174.8060 110 K 4.2434 8.1162 116.3949 57.0775 32.8607 184.3382 111 G 3.9389 7.9292 110.8593 44.5998 0.0000 172.5883 112 K 4.2733 7.3488 117.9244 54.0537 35.7574 176.0508 113 A 4.7104 8.3022 121.7293 51.8786 20.5435 176.7604 114 K 3.3678 7.7116 116.2465 56.8918 32.0445 177.5625 115 G 4.0986 7.9028 109.2115 45.7733 0.0000 172.9425 116 D 4.3924 8.7635 128.1488 56.7497 39.7532 173.6289 117 I 3.8728 7.7851 122.4529 59.6582 34.8355 176.1312 118 P 4.3935 0.0000 0.0000 61.6489 31.4265 173.7583 119 G 3.8011 7.4146 109.1016 48.2074 0.0000 174.5173 120 V 4.3015 8.3895 119.1133 59.6085 33.9384 177.2559 121 R 4.0676 8.3114 128.4039 57.9420 29.7458 178.6751 *122 F 4.5790 8.0902 125.9136 59.0555 40.5292 177.3306 123 K 4.4347 8.7135 117.0266 57.2122 36.4341 172.0341 124 V 3.3563 8.0111 126.7118 61.2681 32.8220 172.7005 125 V 4.1742 8.8243 118.9867 60.9821 32.6033 177.7605 126 K 4.6068 8.4187 118.3948 52.9698 36.3859 178.6094 127 V 4.9609 8.4154 125.9377 59.2998 33.4868 168.2587 128 S 4.0173 8.5819 117.7659 60.1151 61.1869 176.4793 129 G 3.6302 7.8841 113.6290 44.4516 0.0000 170.6779 130 V 3.9492 6.9063 127.7558 61.1896 32.8647 170.9826 131 S 5.2118 7.8249 124.1133 56.6707 66.0380 173.0925 132 L 4.6059 7.9013 124.8191 54.0336 41.7000 176.6702 133 L 4.1377 7.8208 118.4413 57.0654 41.8520 181.7167 134 A 4.8353 7.7760 122.7053 52.4005 21.3561 174.9200 135 L 4.4949 8.3366 129.0610 54.9355 45.9412 175.7945 *136 W 4.2124 9.7058 127.6704 57.8261 28.2533 177.1136 137 K 4.1098 8.6911 131.0546 55.6363 32.3898 177.3554 138 E 4.1559 9.3006 112.9029 58.1246 29.2140 181.5240 139 K 4.5100 9.6835 125.2495 54.8067 37.4821 180.4688 140 K 3.7232 9.0377 120.4356 56.3021 31.0429 182.5262 141 E 4.7847 9.2494 114.9772 58.7661 35.5022 179.5620 142 K 4.3300 8.9952 117.6603 56.9159 31.5814 172.3975 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 27 N 8.52 4.66 0.00 2.76 2.68 0.00 0.00 6.48 7.11 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 28 N 8.97 3.89 0.00 2.90 2.69 0.00 0.00 6.67 6.66 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 *29 Y 8.57 3.41 0.00 2.52 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 0.00 0.00 0.00 0.00 30 K 8.37 4.65 0.00 1.74 1.59 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.26 0.97 7.81 31 K 8.24 4.88 0.00 1.71 1.59 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.24 0.96 7.81 32 R 8.19 4.40 0.00 1.82 1.60 0.00 3.23 0.00 0.00 3.26 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 33 L 8.86 4.10 0.00 1.76 1.75 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 34 L 7.99 4.86 0.00 1.62 1.44 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 35 G 8.60 4.17 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 0.00 36 T 8.29 4.35 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 37 A 9.07 5.00 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 *38 F 7.98 3.51 0.00 2.48 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 39 K 9.01 3.99 0.00 1.84 1.67 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 0.98 7.81 *40 S 7.90 4.68 0.00 3.62 3.08 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 0.00 0.00 0.00 0.00 41 S 9.26 4.72 0.00 3.55 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 42 P 0.00 4.68 0.00 2.05 1.94 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.54 0.00 *43 F 8.36 4.09 0.00 2.37 2.42 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 44 G 8.20 3.82 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 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.62 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 46 S 7.97 4.31 0.00 3.67 3.76 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 47 S 8.79 4.48 0.00 3.62 3.76 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 *48 H 7.53 5.42 0.00 3.01 2.06 0.00 7.13 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 49 A 7.55 3.74 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 50 K 8.47 4.44 0.00 1.46 1.70 0.00 1.93 0.00 0.00 1.82 0.00 0.00 3.00 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.44 1.02 7.81 51 G 7.45 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.90 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 1.20 0.70 0.91 0.00 0.00 53 V 8.09 4.11 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 0.65 0.00 0.00 0.93 0.00 0.00 54 L 7.28 3.88 0.00 1.65 1.57 0.92 0.79 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 55 E 9.03 4.81 0.00 1.57 1.76 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 2.13 2.11 0.00 56 K 8.61 4.57 0.00 1.52 1.64 0.00 1.76 0.00 0.00 1.74 0.00 0.00 2.72 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.27 0.99 7.81 57 L 8.06 4.36 0.00 1.30 1.61 0.92 0.96 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 58 G 8.58 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 59 I 8.06 4.37 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 1.20 0.70 0.91 0.00 0.00 60 E 8.66 4.90 0.00 1.70 1.69 0.00 0.00 0.00 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 1.87 0.00 61 S 9.34 4.34 0.00 3.34 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 62 K 7.87 4.52 0.00 1.67 1.66 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.33 1.25 7.81 63 Q 8.62 4.00 0.00 2.06 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 5.96 0.00 0.00 0.00 0.00 0.00 2.28 1.94 0.00 64 P 0.00 4.30 0.00 2.26 2.01 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.57 0.00 65 N 7.76 4.75 0.00 2.74 2.66 0.00 0.00 6.35 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 66 S 7.85 4.62 0.00 3.32 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 67 A 8.19 4.26 1.20 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 0.00 0.00 68 I 8.05 4.42 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 1.20 0.74 0.91 0.00 0.00 69 R 8.78 4.22 0.00 1.64 1.83 0.00 3.24 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.46 0.00 70 K 8.33 4.54 0.00 1.68 1.99 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.29 7.81 71 C 8.24 5.63 0.00 2.58 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 72 V 8.61 4.92 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 0.64 0.00 0.00 0.93 0.00 0.00 73 R 9.55 5.08 0.00 1.42 1.82 0.00 3.26 0.00 0.00 3.20 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.43 0.00 74 V 9.02 4.93 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 0.55 0.00 0.00 0.93 0.00 0.00 75 Q 8.75 4.90 0.00 1.75 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.94 0.00 0.00 0.00 0.00 0.00 2.22 2.17 0.00 76 L 9.14 4.35 0.00 1.32 1.62 0.92 1.14 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 77 I 8.29 3.66 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 1.16 1.08 0.91 0.00 0.00 78 K 8.70 3.59 0.00 1.76 1.53 0.00 1.78 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.05 7.81 79 N 9.24 4.54 0.00 2.74 2.75 0.00 0.00 6.58 7.51 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 80 G 8.43 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 0.00 0.00 0.00 81 K 7.12 4.31 0.00 1.47 1.69 0.00 1.78 0.00 0.00 1.85 0.00 0.00 2.84 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.45 1.08 7.81 82 K 8.71 4.94 0.00 1.53 1.61 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.30 1.00 7.81 83 V 9.05 4.68 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 0.65 0.00 0.00 0.93 0.00 0.00 84 T 8.49 5.21 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 85 A 9.36 4.74 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 *86 F 9.03 4.09 0.00 1.98 2.24 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 87 V 8.17 3.97 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 88 P 0.00 4.06 0.00 2.09 1.90 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.65 0.00 89 N 8.06 5.03 0.00 2.68 2.47 0.00 0.00 6.77 8.06 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 90 D 7.97 5.52 0.00 2.80 2.70 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 91 G 7.16 4.17 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 0.00 92 C 8.28 5.02 0.00 2.70 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 93 L 7.63 4.38 0.00 1.66 1.54 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 94 N 8.00 4.56 0.00 2.74 2.75 0.00 0.00 6.85 7.43 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 *95 F 7.84 3.77 0.00 2.20 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 0.00 0.00 0.00 0.00 96 V 7.09 3.63 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 0.84 0.00 0.00 0.93 0.00 0.00 97 D 7.64 4.81 0.00 2.58 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 98 E 8.81 4.19 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.89 0.00 99 N 7.94 4.41 0.00 2.64 2.75 0.00 0.00 6.93 8.07 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 0.00 100 D 7.77 4.63 0.00 2.64 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 0.00 101 E 8.54 4.77 0.00 1.60 1.84 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 2.19 1.84 0.00 102 V 8.24 4.21 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 0.65 0.00 0.00 0.93 0.00 0.00 103 L 8.09 4.85 0.00 1.37 1.62 0.92 0.67 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 0.00 104 L 8.05 3.30 0.00 1.63 1.66 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 105 A 7.25 4.88 1.43 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 0.00 106 G 8.42 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.19 4.43 0.00 2.28 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 0.00 0.00 0.00 108 G 7.02 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 R 8.57 4.45 0.00 1.81 1.82 0.00 3.26 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.15 0.00 110 K 8.12 4.24 0.00 1.76 1.73 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.29 0.99 7.81 111 G 7.93 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 0.00 0.00 0.00 112 K 7.35 4.27 0.00 1.73 1.55 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.22 0.95 7.81 113 A 8.30 4.71 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 0.00 114 K 7.71 3.37 0.00 1.78 1.62 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.38 1.06 7.81 115 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 0.00 116 D 8.76 4.39 0.00 2.61 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 0.00 117 I 7.79 3.87 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 1.27 1.10 0.91 0.00 0.00 118 P 0.00 4.39 0.00 1.98 2.01 0.00 3.73 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 2.03 1.62 0.00 119 G 7.41 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 0.00 120 V 8.39 4.30 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 0.74 0.00 0.00 0.93 0.00 0.00 121 R 8.31 4.07 0.00 1.83 1.66 0.00 3.24 0.00 0.00 3.26 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.19 0.00 *122 F 8.09 4.58 0.00 2.06 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 0.00 0.00 0.00 0.00 123 K 8.71 4.43 0.00 1.41 1.64 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.79 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.23 1.21 7.81 124 V 8.01 3.36 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 0.00 125 V 8.82 4.17 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 0.91 0.00 0.00 0.93 0.00 0.00 126 K 8.42 4.61 0.00 1.62 1.64 0.00 1.87 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.35 1.00 7.81 127 V 8.42 4.96 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 0.00 128 S 8.58 4.02 0.00 3.62 3.76 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 0.00 129 G 7.88 3.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 6.91 3.95 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 0.67 0.00 0.00 0.93 0.00 0.00 131 S 7.82 5.21 0.00 3.56 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 0.00 132 L 7.90 4.61 0.00 1.69 1.57 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 133 L 7.82 4.14 0.00 1.57 1.70 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.78 4.84 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 0.00 135 L 8.34 4.49 0.00 1.62 0.70 0.92 0.98 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 *136 W 9.71 4.21 0.00 2.50 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 0.00 0.00 0.00 0.00 137 K 8.69 4.11 0.00 1.77 1.51 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.00 7.81 138 E 9.30 4.16 0.00 1.88 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 2.32 1.90 0.00 139 K 9.68 4.51 0.00 1.71 1.66 0.00 1.92 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.13 0.85 7.81 140 K 9.04 3.72 0.00 1.87 1.48 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 0.98 7.81 141 E 9.25 4.78 0.00 1.93 1.68 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 1.98 1.70 0.00 142 K 9.00 4.33 0.00 1.96 1.77 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.23 0.99 7.81 * Residues marked with a * may have inaccurate shift predictions.