NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 R 4.2305 8.2549 119.6943 56.2563 31.5154 174.4317 6 H 4.6430 7.9802 116.1255 53.5084 32.0943 172.4774 7 F 4.9060 8.8420 121.2416 55.6814 43.6109 174.1096 8 V 4.6769 8.2375 121.9344 61.6287 35.3338 173.5967 9 H 5.4250 8.7974 124.0848 55.0089 32.7251 172.0016 10 Q 4.9284 9.0078 123.6020 55.0996 33.3127 173.4791 11 F 5.2283 7.9736 116.4011 58.5811 42.3662 173.5435 12 K 4.1280 7.6388 124.9062 54.1989 35.7444 175.1081 13 G 4.0161 8.2434 111.7922 44.5436 0.0000 172.0061 14 E 4.5913 8.6046 126.3788 54.2118 32.3707 174.7972 15 C 4.7439 8.2474 120.6311 55.3083 44.1795 172.8382 16 Y 4.5214 8.6824 122.9201 56.3246 39.4443 174.8500 17 F 5.1762 8.8637 123.0531 55.9457 41.3322 174.9141 18 T 4.5118 8.5134 120.7332 62.0127 71.2333 173.6665 19 N 4.2427 9.6181 124.3289 54.8660 38.4031 175.8204 20 G 4.2101 8.2054 112.6787 46.0713 0.0000 176.7980 21 T 4.2243 8.7278 116.7084 62.8220 69.5368 176.4455 22 Q 3.9937 8.1340 120.2966 58.4931 29.0279 176.9623 23 R 4.5359 8.0785 118.2004 55.1516 33.1861 173.7673 24 I 4.9984 8.4197 126.7286 59.4650 40.7535 175.0166 25 R 4.6731 8.8298 125.3570 54.4137 34.1236 173.6769 26 L 5.0769 8.6163 126.2563 53.5739 45.0163 175.6596 27 V 4.9898 8.1880 126.1542 61.4214 34.9667 175.0137 28 T 4.4130 8.0524 117.4688 63.1717 72.3866 172.9333 29 R 4.7449 8.4155 127.1452 54.5065 32.9726 174.8489 30 Y 4.7857 8.5167 121.9665 56.9941 39.6976 174.8795 31 I 4.7302 8.3210 123.9768 59.5977 40.7837 174.2190 32 Y 4.5275 9.3645 128.7464 58.9984 40.3843 176.2930 33 N 3.6298 8.1468 122.6414 54.4095 38.9854 175.1907 34 R 4.3483 9.0947 125.2604 56.4807 31.4698 173.6556 35 E 4.4593 8.4659 118.7313 54.7929 29.3423 174.9029 36 E 4.1836 8.7133 128.0768 56.4791 30.4385 175.8605 37 Y 4.9566 8.4397 121.7872 56.5857 40.4978 174.6810 38 L 5.0898 6.5854 120.1336 53.2081 46.5077 175.1619 39 R 5.5375 8.0410 116.2493 56.4624 34.4308 172.9589 40 F 4.4774 8.8312 129.3271 57.1840 41.3945 173.6124 41 D 5.0280 7.2319 125.2870 52.2586 43.2148 176.0821 42 S 4.1660 8.9618 122.1899 61.6900 63.2017 175.7888 43 D 4.4221 7.8880 120.0447 57.3139 40.7815 177.9547 44 V 3.4960 7.6219 116.8764 65.5185 31.4483 177.0321 45 G 3.9074 9.5895 106.0330 44.6920 0.0000 171.9598 46 E 4.5645 6.8094 116.0187 55.3166 32.9314 173.9034 47 Y 4.6751 9.2232 118.7068 58.1764 39.0255 176.1389 48 R 4.7147 8.8692 121.4006 54.0797 33.9685 174.9471 49 A 4.5653 8.9739 125.8088 52.8574 18.7029 177.0198 50 V 4.5613 9.0572 116.9188 62.3863 34.1108 174.7644 51 T 4.7796 7.7839 108.7739 59.6818 71.8832 173.7529 52 E 4.1746 8.6552 120.7701 58.0131 29.9283 177.3901 53 L 3.9957 7.7999 120.6409 57.8439 42.0751 177.9929 54 G 4.3790 7.5695 106.5532 45.4320 0.0000 175.9803 55 R 3.7477 8.1661 120.7822 59.2762 31.0044 176.0303 56 H 4.8982 7.9449 113.4534 56.6116 29.2698 177.4148 57 S 4.3838 8.0340 117.5720 61.5808 62.8209 175.9284 58 A 4.1104 7.6966 123.1876 55.2381 17.9823 179.4384 59 E 3.9963 8.3143 116.5335 60.3430 29.6106 178.1911 60 Y 4.0249 7.8594 118.2489 60.7246 38.5211 177.3463 61 Y 4.0469 8.5300 118.7460 61.4581 38.2163 178.6826 62 N 4.7882 8.1968 116.1418 56.1429 38.7454 177.0821 63 K 3.9835 7.8650 119.9813 59.6301 32.5314 178.4919 64 Q 3.5830 7.8971 118.1285 58.2875 28.8717 177.5321 *66 Y 5.2208 7.5305 114.2806 57.9559 40.0268 176.3084 *68 L 4.6114 7.6569 121.5055 55.1694 44.0745 178.2711 69 E 3.9875 8.2219 118.4113 59.3733 29.7283 178.6198 70 R 3.8318 7.9858 118.2756 59.6747 30.5826 178.1912 71 T 3.7303 7.8373 115.1064 66.8656 68.1987 176.7118 72 R 3.8175 7.5954 118.5277 58.8812 30.2603 178.3668 73 A 4.2920 7.5375 119.6528 53.9511 18.8878 178.9422 74 E 4.0234 7.9193 118.8335 58.7844 29.4606 179.3326 75 L 3.9951 7.4658 118.7886 57.3993 41.5999 177.7547 76 D 4.8371 9.0218 118.2844 54.5683 41.8998 177.6171 77 T 4.4801 7.8806 108.4996 61.5313 69.7902 175.2723 78 A 4.3627 7.9951 122.8245 53.7169 20.7132 176.9588 79 C 4.6445 7.7844 113.5414 58.7435 40.1703 175.7504 80 R 4.0222 8.5852 120.0619 60.2559 29.8783 178.1755 81 H 4.1512 7.7984 114.2009 59.4565 29.8639 176.6047 82 N 4.2246 8.2743 118.1628 56.8847 38.3078 176.3964 83 Y 3.7870 8.2029 120.4938 60.8661 38.6248 177.9887 84 E 3.9154 8.4390 119.2502 58.7429 29.7412 178.4086 85 E 4.5086 8.3316 116.9550 56.4617 31.1234 176.9044 86 T 4.4433 7.6307 105.9280 61.7384 71.3724 174.8800 87 E 4.1228 8.4527 121.8421 58.5019 30.2449 178.5254 88 V 3.2426 7.6501 117.7134 65.4761 31.3650 175.1391 89 P 4.4910 0.0000 0.0000 63.2691 30.9279 175.5815 90 T 4.3687 6.9388 105.9717 63.2972 71.5651 176.4560 91 S 3.9243 7.8488 117.7096 60.7446 63.3484 177.0266 92 L 4.1459 7.5754 118.4461 57.5327 41.4752 178.8487 93 R 3.9589 7.3492 118.0460 58.6055 30.2013 176.7675 94 R 4.0138 7.6971 118.9490 56.1326 30.2407 175.5579 94A L 5.1212 8.4875 124.5516 53.1252 44.9770 175.3558 95 E 4.8756 9.4537 123.6283 54.5946 32.0714 175.8617 96 Q 4.7315 8.5893 122.5236 54.1353 30.1172 174.1321 97 P 4.8383 0.0000 0.0000 62.2397 32.6202 176.3989 98 N 4.9915 8.6935 117.4632 51.5180 38.2429 173.2038 99 V 4.2327 7.7677 119.2418 62.7013 32.7372 175.6102 100 A 4.4684 8.9794 130.9537 50.8964 21.5244 175.0025 101 I 3.8869 8.4444 122.7275 62.4959 37.8387 176.1731 102 S 5.0663 8.2722 122.2657 57.5314 65.4432 172.2188 103 L 4.5977 8.5755 118.6726 53.7313 44.7825 176.4245 104 S 4.1914 9.0981 122.4419 58.3202 63.4163 175.6152 105 R 3.6529 8.2847 116.9711 57.8278 29.6454 175.7722 *112 H 4.6107 7.8277 114.3727 55.4945 29.2778 172.5871 113 N 4.8930 9.0560 123.8627 52.3857 41.9414 173.8684 114 T 4.7031 7.8830 114.5984 61.8616 72.4139 175.0768 115 L 3.8517 7.5692 130.1468 52.6415 39.6035 176.6958 116 V 3.4765 7.5586 119.2691 64.0064 33.1867 175.9123 117 C 5.1034 8.7046 128.8617 54.8746 44.8225 172.6400 118 S 4.5493 8.4691 122.1585 58.4004 64.3296 173.9048 119 V 4.7381 8.8309 123.0664 61.5023 33.5057 174.1667 120 T 4.9364 8.3490 116.6414 59.7154 72.1369 172.9803 121 D 4.8358 8.9265 121.2771 55.1401 38.2732 172.2617 122 F 5.2206 7.1843 115.6249 55.6264 42.9920 173.8491 123 Y 4.9185 8.3663 116.2462 56.1647 41.5516 172.4438 124 P 3.6726 0.0000 0.0000 62.8232 33.3962 176.2796 125 A 4.3683 8.5685 120.5956 52.0740 19.7930 177.1833 126 K 4.0272 7.8325 118.1363 56.2658 32.6530 175.4152 127 I 4.4857 7.8560 124.5355 60.8151 41.4890 173.3976 128 K 4.3343 8.6425 123.7488 55.4234 36.3419 175.7387 129 V 4.5259 8.3883 126.0690 61.0194 31.5948 174.7623 130 R 4.4141 8.9912 125.3242 54.4624 32.6793 175.0259 131 W 5.1926 8.2177 119.9028 55.1348 32.4681 174.8557 132 F 5.5792 9.6491 120.2678 56.0623 43.5838 174.2835 133 R 4.9402 9.3164 121.6962 54.6954 32.2587 174.6855 134 N 4.4168 9.9532 126.5478 54.3169 36.5998 175.9793 135 G 3.8462 8.7748 103.5201 45.4772 0.0000 173.6483 136 Q 4.8088 7.8222 118.4023 53.5234 31.2572 174.9162 137 E 4.4504 9.0345 123.2288 56.0019 30.4942 175.5329 138 E 4.7654 8.3837 124.1698 54.8663 32.1903 176.0780 139 T 4.4918 8.5203 110.9581 61.0280 70.3987 173.7682 140 V 4.1804 7.5499 122.6191 62.3376 33.3826 176.1041 141 G 3.9610 8.8173 117.2282 45.9977 0.0000 173.1456 142 V 3.4793 7.6453 119.7043 63.5620 31.5629 176.0666 143 S 4.6485 8.3996 123.6410 57.8248 64.8642 171.7170 144 S 5.0767 8.1876 114.9807 57.9000 65.1256 172.8940 145 T 4.7495 7.7357 112.7457 59.3766 71.5386 174.0028 146 Q 4.0489 8.7693 121.3959 55.7681 29.2933 175.6626 147 L 3.6636 7.9040 123.3106 53.6862 42.7086 175.9793 148 I 4.3180 8.7789 128.2679 59.9186 38.8414 174.9028 149 R 4.7102 8.6129 128.7327 55.5780 29.8585 175.9433 150 N 4.4200 8.7828 125.7329 54.7105 38.9692 175.3086 151 G 4.0982 8.2609 104.9300 45.7398 0.0000 173.0926 152 D 4.7185 7.8052 118.5857 53.6593 39.9071 176.7402 153 W 3.2912 8.0615 115.1603 58.7376 26.9299 174.1478 154 T 4.7967 7.0743 107.2106 60.0981 72.1880 172.5956 155 F 5.6650 8.0342 120.8602 55.4975 42.9787 173.9026 156 Q 5.5492 8.4015 114.1884 56.7526 30.9404 173.2205 157 V 4.7207 8.1490 118.3869 60.8256 35.2161 172.2582 158 L 4.8490 8.5977 123.2984 53.3265 44.0842 175.7232 159 V 4.5586 8.1862 125.1604 60.9795 31.7445 175.1886 160 M 4.3293 8.0983 126.8281 55.7975 33.3793 175.4417 161 L 3.9273 7.6595 114.9638 54.4850 44.2502 172.6483 162 E 4.5288 8.5967 128.0950 56.2152 30.4156 175.3351 163 M 4.6797 9.0013 123.6014 54.9155 35.2675 173.0798 164 T 4.9234 8.4159 109.4418 59.2259 71.2270 172.0843 165 P 4.7861 0.0000 0.0000 61.4634 32.2009 174.5413 166 H 4.6499 8.3037 121.2080 54.3258 29.7817 174.8736 167 Q 4.0271 8.6318 124.1762 58.2262 29.0645 177.2158 168 G 3.9543 8.8519 112.8594 45.2189 0.0000 173.2652 169 E 4.0196 7.6884 120.9214 55.7797 30.4074 175.8136 170 V 4.4263 8.2326 124.9348 60.2894 34.0930 174.3924 171 Y 5.7496 8.3173 120.1450 56.1772 42.4115 174.7116 172 T 5.2356 8.9962 115.6153 62.9864 73.5528 173.3958 173 C 4.1001 9.1521 127.4610 55.2271 43.8255 171.8432 174 H 4.9915 9.2465 128.2666 54.7404 31.3249 173.0052 175 V 4.7334 8.3219 126.6977 61.0152 34.0130 174.0140 176 E 4.9931 9.1289 127.4303 54.8528 32.1502 174.6109 177 H 5.0739 8.4721 122.5027 54.0277 33.4513 172.3464 178 P 4.3121 0.0000 0.0000 65.2678 31.6403 178.0322 179 S 4.3890 8.3853 111.4930 59.2352 63.4607 173.1907 180 L 4.9814 7.3971 122.0314 52.8277 43.5138 176.5313 181 K 4.0358 8.9717 123.7659 58.9176 32.2922 177.1829 182 S 4.6545 7.7454 112.7605 55.4434 63.5417 171.3896 183 P 4.3566 0.0000 0.0000 63.3313 31.8821 176.1847 184 I 4.2111 8.4174 124.4069 61.5159 38.5138 175.2058 185 T 5.7430 8.1990 114.5165 59.5605 71.8790 173.1301 186 V 4.5097 8.4322 123.9720 61.2263 34.7426 174.0402 187 E 5.8987 8.8673 126.1402 54.2598 32.5444 175.0973 188 W 5.1496 8.6659 129.9824 56.4182 34.5034 174.6502 189 S 4.4141 7.8918 120.5258 58.3817 62.5918 173.7114 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 R 8.25 4.23 0.00 1.80 1.46 0.00 3.23 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.64 0.00 6 H 7.98 4.64 0.00 2.98 3.08 0.00 5.84 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 F 8.84 4.91 0.00 3.02 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 4.68 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 0.92 0.00 0.00 0.93 0.00 0.00 9 H 8.80 5.42 0.00 3.32 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 Q 9.01 4.93 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.62 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 11 F 7.97 5.23 0.00 2.77 2.79 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 12 K 7.64 4.13 0.00 1.56 1.42 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.27 1.26 7.81 13 G 8.24 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 14 E 8.60 4.59 0.00 1.73 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 2.04 2.06 0.00 15 C 8.25 4.74 0.00 2.66 2.22 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 16 Y 8.68 4.52 0.00 2.70 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 17 F 8.86 5.18 0.00 2.56 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 18 T 8.51 4.51 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 1.23 0.00 0.00 19 N 9.62 4.24 0.00 2.87 2.93 0.00 0.00 7.23 7.98 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 20 G 8.21 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 0.00 0.00 0.00 0.00 21 T 8.73 4.22 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 1.42 0.00 0.00 22 Q 8.13 3.99 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 23 R 8.08 4.54 0.00 1.92 1.96 0.00 3.07 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 24 I 8.42 5.00 1.84 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.98 0.71 0.00 0.00 25 R 8.83 4.67 0.00 1.81 1.73 0.00 3.20 0.00 0.00 2.95 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 26 L 8.62 5.08 0.00 1.69 1.52 0.94 1.17 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 27 V 8.19 4.99 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 1.35 0.00 0.00 1.04 0.00 0.00 28 T 8.05 4.41 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 1.46 0.00 0.00 29 R 8.42 4.74 0.00 1.64 1.79 0.00 3.06 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.48 0.00 30 Y 8.52 4.79 0.00 2.41 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 31 I 8.32 4.73 1.93 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 1.12 0.97 1.05 0.00 0.00 32 Y 9.36 4.53 0.00 3.10 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 33 N 8.15 3.63 0.00 2.51 2.12 0.00 0.00 6.71 7.54 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 34 R 9.09 4.35 0.00 1.69 1.88 0.00 3.25 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 35 E 8.47 4.46 0.00 2.00 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 2.43 2.33 0.00 36 E 8.71 4.18 0.00 1.99 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 2.34 2.28 0.00 37 Y 8.44 4.96 0.00 3.15 3.21 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 0.00 38 L 6.59 5.09 0.00 1.52 1.09 0.89 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 39 R 8.04 5.54 0.00 2.25 1.74 0.00 3.17 0.00 0.00 3.18 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.36 0.00 40 F 8.83 4.48 0.00 2.58 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 41 D 7.23 5.03 0.00 2.59 2.26 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 42 S 8.96 4.17 0.00 4.14 4.34 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 43 D 7.89 4.42 0.00 2.69 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 44 V 7.62 3.50 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 0.70 0.00 0.00 0.83 0.00 0.00 45 G 9.59 3.91 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 0.00 0.00 0.00 46 E 6.81 4.56 0.00 2.24 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 2.18 2.24 0.00 47 Y 9.22 4.68 0.00 3.20 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 48 R 8.87 4.71 0.00 1.70 1.79 0.00 3.30 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 49 A 8.97 4.57 1.36 0.00 0.00 0.00 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131 W 8.22 5.19 0.00 3.12 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 0.00 132 F 9.65 5.58 0.00 3.22 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 0.00 133 R 9.32 4.94 0.00 2.00 1.92 0.00 3.54 0.00 0.00 3.58 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.81 0.00 134 N 9.95 4.42 0.00 2.94 2.89 0.00 0.00 7.08 7.21 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 0.00 135 G 8.77 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 0.00 136 Q 7.82 4.81 0.00 2.48 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.94 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 137 E 9.03 4.45 0.00 2.21 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 2.18 1.90 0.00 138 E 8.38 4.77 0.00 1.99 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 2.29 2.40 0.00 139 T 8.52 4.49 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 0.00 140 V 7.55 4.18 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 1.05 0.00 0.00 0.92 0.00 0.00 141 G 8.82 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 0.00 142 V 7.65 3.48 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 0.97 0.00 0.00 0.98 0.00 0.00 143 S 8.40 4.65 0.00 3.92 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 0.00 144 S 8.19 5.08 0.00 3.89 3.68 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 0.00 145 T 7.74 4.75 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 1.22 0.00 0.00 146 Q 8.77 4.05 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 147 L 7.90 3.66 0.00 1.53 1.36 0.72 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 148 I 8.78 4.32 2.14 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 1.14 1.50 0.95 0.00 0.00 149 R 8.61 4.71 0.00 1.98 1.91 0.00 3.24 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00 150 N 8.78 4.42 0.00 2.93 2.93 0.00 0.00 7.35 7.69 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 0.00 151 G 8.26 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 0.00 152 D 7.81 4.72 0.00 2.93 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 0.00 153 W 8.06 3.29 0.00 3.16 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 0.00 154 T 7.07 4.80 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 1.29 0.00 0.00 155 F 8.03 5.67 0.00 1.51 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 0.00 156 Q 8.40 5.55 0.00 2.21 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.28 0.00 157 V 8.15 4.72 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 0.66 0.00 0.00 0.98 0.00 0.00 158 L 8.60 4.85 0.00 1.65 1.63 0.94 0.52 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 0.00 159 V 8.19 4.56 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 1.08 0.00 0.00 0.86 0.00 0.00 160 M 8.10 4.33 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 161 L 7.66 3.93 0.00 0.34 0.30 0.49 -0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 162 E 8.60 4.53 0.00 1.89 1.73 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 2.22 2.44 0.00 163 M 9.00 4.68 0.00 1.85 2.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.80 0.00 164 T 8.42 4.92 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 1.23 0.00 0.00 165 P 0.00 4.79 0.00 2.35 2.45 0.00 3.53 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 166 H 8.30 4.65 0.00 3.23 3.24 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 Q 8.63 4.03 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 168 G 8.85 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 0.00 169 E 7.69 4.02 0.00 2.05 1.63 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 1.96 2.14 0.00 170 V 8.23 4.43 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 0.78 0.00 0.00 1.01 0.00 0.00 171 Y 8.32 5.75 0.00 3.27 3.23 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 0.00 172 T 9.00 5.24 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 173 C 9.15 4.10 0.00 2.37 2.69 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 0.00 174 H 9.25 4.99 0.00 3.59 3.42 0.00 5.79 0.00 0.00 0.00 0.00 6.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 V 8.32 4.73 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 0.71 0.00 0.00 0.73 0.00 0.00 176 E 9.13 4.99 0.00 1.82 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 2.18 2.06 0.00 177 H 8.47 5.07 0.00 3.01 3.02 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 P 0.00 4.31 0.00 2.06 2.08 0.00 2.88 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.98 0.00 179 S 8.39 4.39 0.00 4.09 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 0.00 180 L 7.40 4.98 0.00 1.57 1.73 0.87 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 181 K 8.97 4.04 0.00 1.73 1.87 0.00 1.61 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.50 7.81 182 S 7.75 4.65 0.00 3.81 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 0.00 183 P 0.00 4.36 0.00 2.02 1.91 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.17 0.00 184 I 8.42 4.21 1.79 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 1.26 0.82 0.86 0.00 0.00 185 T 8.20 5.74 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 1.31 0.00 0.00 186 V 8.43 4.51 2.07 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 1.10 0.00 0.00 0.99 0.00 0.00 187 E 8.87 5.90 0.00 1.96 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 2.54 2.21 0.00 188 W 8.67 5.15 0.00 3.57 3.29 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 0.00 189 S 7.89 4.41 0.00 3.81 3.66 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 * Residues marked with a * may have inaccurate shift predictions.