NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 S 4.4112 8.3344 115.4253 57.3203 64.3559 172.8948 13 L 2.6199 8.0647 122.7387 53.9028 41.9014 174.5576 14 P 4.3080 0.0000 0.0000 61.2485 33.1268 173.7933 15 P 4.1920 0.0000 0.0000 62.9769 31.4445 177.8449 16 R 4.3394 9.0166 122.4246 58.4720 30.1450 177.8439 17 E 3.9832 7.9944 114.5140 58.5908 30.1673 177.4123 18 D 4.5739 8.3558 120.7987 52.4842 39.0139 176.0431 19 A 3.9825 8.0151 125.8774 54.5081 18.8257 178.9669 20 A 3.9516 7.9141 118.8432 55.3707 18.4756 179.7071 21 R 3.8115 7.9876 117.2789 59.3409 30.1364 178.8806 22 V 3.5415 7.9459 117.9057 65.9534 31.5780 177.7351 23 A 4.0944 8.2522 120.6579 55.5217 18.2310 179.9037 24 R 3.7195 8.1017 116.4663 58.9495 30.0482 178.9195 25 F 4.0303 8.4674 120.8321 61.3349 39.2515 177.3320 26 V 3.4451 7.9877 117.5741 66.2936 31.1382 177.7972 27 T 3.8942 7.7141 114.0141 67.1529 68.4306 175.6191 28 H 4.5867 7.7621 119.7430 58.7590 30.0363 177.1649 29 V 3.6361 7.2434 111.3684 61.4266 31.7740 176.3860 30 S 4.3024 7.0420 116.2752 58.0091 63.4573 173.9177 31 D 4.9340 8.5848 123.9081 54.6060 41.5024 175.3711 32 W 5.7350 7.4545 114.8651 56.1053 31.5616 173.0097 33 G 4.1036 9.5778 106.3930 45.7434 0.0000 171.5785 34 A 5.4710 8.7347 121.7056 50.1975 21.2378 175.8406 35 L 5.1070 8.9568 124.3843 53.1735 44.8769 174.8794 36 A 5.6282 9.3427 129.0801 50.5970 20.7288 176.1361 37 T 4.9285 8.4196 111.4236 59.8980 73.4114 172.4018 38 I 4.6797 8.2409 122.2137 60.1721 38.1652 176.3084 39 S 4.2604 9.5081 123.5631 58.3428 63.3229 174.4351 40 T 4.4888 8.5469 115.7986 61.1842 69.0111 174.4161 41 L 4.0973 7.5295 123.3065 54.7298 42.2977 177.4455 42 E 3.8769 9.0185 123.3760 59.7183 29.6251 178.2603 43 A 4.1824 8.1434 119.3950 54.8658 18.5582 178.5357 44 V 4.4939 7.4307 108.9981 60.5700 32.6663 175.7726 45 R 4.2095 8.0890 119.7875 57.9219 30.3442 176.5401 46 G 4.0289 8.8457 113.6277 45.4068 0.0000 173.9023 47 R 4.4191 7.6997 119.4058 54.9196 31.5363 174.3741 48 P 4.8491 0.0000 0.0000 63.0505 32.1698 175.2852 49 F 5.0571 9.7142 124.9313 56.3140 42.7513 173.3606 50 A 5.1950 7.5939 125.2857 50.5126 21.8674 174.5979 51 D 4.5551 8.5103 118.0946 53.3162 45.5756 173.8813 52 V 4.9729 8.3198 122.0204 61.1865 33.4098 174.7227 53 L 5.0844 8.9164 127.0291 52.8832 45.2082 176.3642 54 S 5.1240 9.0655 119.1221 58.9060 63.6318 173.3016 55 L 5.0740 8.8094 122.2532 55.1312 43.9053 174.9489 56 S 4.7279 8.7599 113.0292 57.1586 66.1272 173.8819 57 D 5.6005 9.8237 124.5873 51.6714 40.7009 175.7862 58 G 4.6940 7.7176 105.5194 43.2232 0.0000 171.4693 59 P 4.5142 0.0000 0.0000 61.8464 32.2091 176.1851 60 P 4.1229 0.0000 0.0000 65.6970 31.2074 177.7006 61 G 3.9006 8.0028 102.8601 45.8044 0.0000 173.9456 62 A 4.5626 8.3108 123.2547 50.6679 19.4477 175.5648 63 G 4.0148 7.5521 110.0349 44.2327 0.0000 172.3966 64 S 4.2474 9.0947 120.9707 58.8967 63.6367 175.6419 65 G 3.8443 8.4740 109.4467 44.2366 0.0000 173.5546 66 V 3.9823 7.6508 120.6995 61.2358 32.5099 173.5538 67 P 4.3482 0.0000 0.0000 62.4638 32.1728 175.1112 68 Y 4.9360 8.2042 123.1744 56.7783 40.0840 175.0911 69 F 5.4552 9.3620 120.3055 55.9650 43.9282 173.3888 70 Y 5.2853 9.0718 121.4451 56.2362 40.6199 174.4866 71 L 5.2462 8.5338 126.1412 52.9174 46.4864 175.5062 72 S 4.5324 8.6190 114.6447 55.6137 64.9253 173.4184 73 P 4.4524 0.0000 0.0000 64.9852 31.2815 177.7169 74 L 4.0289 7.4174 117.5267 56.6951 41.9054 178.0530 75 Q 4.0970 7.9337 119.4752 55.1392 30.1462 176.5325 76 L 3.8377 8.6679 125.0866 58.5276 41.7237 180.1714 77 S 4.2134 8.0460 114.1160 61.4856 62.7473 176.7749 78 V 3.6794 7.7239 120.6594 65.9514 30.9183 178.0031 79 S 4.0857 8.3064 115.2348 61.6186 62.6460 176.4866 80 N 4.1641 8.0335 118.8699 56.4231 38.1158 177.5038 81 L 4.3762 7.7738 120.3232 57.3998 41.7576 179.3567 82 Q 4.0980 8.2573 117.2989 58.4020 28.6197 177.8541 83 E 4.6197 7.3826 117.8876 56.5612 30.4114 175.8414 84 N 4.5851 8.0074 117.9118 52.1528 40.7795 172.3879 85 P 4.6535 0.0000 0.0000 63.8679 32.6613 175.6881 86 Y 5.0144 8.1644 119.3911 58.5848 38.4688 175.0577 87 A 4.9786 9.1414 123.7271 51.3866 23.6337 175.0322 88 T 5.1530 8.8181 115.4227 61.6960 72.4899 172.8755 89 L 5.1989 9.1779 128.2704 53.6627 44.2633 175.1439 90 T 5.2315 8.6949 119.8552 59.3956 71.5608 172.2199 *92 T 4.5581 8.1560 116.1056 61.5468 68.2569 174.4353 93 L 4.1003 8.9787 126.8736 56.9802 41.7822 179.1208 94 A 4.4331 8.0811 121.3277 54.4221 18.3395 178.6113 95 Q 4.2434 7.9948 114.4646 57.8037 29.0405 175.9682 96 T 4.6418 7.8253 108.5530 60.3556 71.3049 174.2242 97 N 4.6608 8.6024 117.8447 54.4415 38.8525 176.6866 98 F 4.1344 8.5509 122.6621 62.5792 39.4955 176.3475 99 C 4.4118 8.3848 115.4567 59.8405 38.7583 175.8026 100 K 3.8094 8.0797 119.6487 59.5076 31.4554 178.8368 101 K 3.7102 7.7559 118.2236 59.4415 32.1372 177.5330 102 H 4.2820 7.0608 112.7506 54.2036 28.8026 175.2666 103 G 3.9018 7.3791 108.5480 46.2839 0.0000 173.8431 104 F 4.7668 7.6983 118.5457 56.3379 39.7737 175.5432 105 D 4.5470 8.8151 125.0212 53.6431 41.7074 175.1377 106 P 4.3096 0.0000 0.0000 65.5150 31.4163 177.0690 107 Q 4.2077 8.1990 116.7865 56.3873 29.6453 175.6716 108 S 4.2860 7.9747 113.9943 57.8674 63.1611 173.0705 109 P 4.3871 0.0000 0.0000 65.0091 31.3374 178.4043 110 L 3.5846 7.2127 119.0133 57.4708 41.3834 176.7320 111 C 4.8312 7.6653 119.0570 55.0694 37.8711 171.5002 112 V 4.1482 8.5398 124.4398 62.7295 32.2741 173.9428 113 H 5.3175 8.9161 122.1639 53.8685 32.1151 172.1232 114 I 5.2061 7.8595 113.6184 59.1274 41.5356 174.4856 *116 L 4.3341 8.4257 120.8457 55.0287 42.5145 175.4720 117 S 5.3665 9.4439 119.0450 55.8773 65.3213 174.1022 118 G 4.8673 7.6900 111.8936 46.4555 0.0000 171.3366 119 T 5.2500 7.9361 111.5485 59.9119 72.3300 173.6181 120 V 5.1009 8.5146 123.8981 61.7012 32.9659 174.9713 121 T 4.9172 8.6689 117.2557 59.4014 72.5601 173.3651 122 K 4.8365 8.6521 122.2868 56.3984 32.7614 177.2454 123 V 4.0132 9.0371 126.2738 63.0408 32.3841 175.7071 124 N 4.8653 8.7459 125.1125 51.1305 39.0881 175.5022 125 E 3.9772 8.7304 116.1410 59.5688 29.3890 178.4353 126 T 4.0221 7.9888 108.2340 63.0591 69.6924 174.2536 127 E 4.4645 7.9599 123.6646 54.4688 29.4096 175.2934 *129 D 4.2832 7.8117 121.7313 54.0894 43.7155 178.5536 130 I 3.4993 7.4208 119.1046 64.0853 37.0029 178.0921 131 A 2.5800 7.1388 121.5358 54.4826 18.1024 179.6176 132 K 2.7477 6.6638 117.4861 59.3066 32.2508 178.4428 133 H 3.9839 7.7635 118.4429 59.2225 29.3776 177.2610 134 S 4.0711 7.9218 117.0929 61.5875 62.5667 176.8841 135 L 4.0588 7.9537 121.4508 58.0199 41.4003 179.5906 136 F 4.1563 8.4583 116.5520 60.4338 38.8334 176.8194 137 I 3.7440 7.4864 117.7445 63.4679 37.9625 176.6922 138 R 4.1871 7.3358 119.6767 57.7996 30.4065 175.9853 139 H 4.7876 8.0901 114.6786 52.8446 28.9855 172.0072 140 P 3.8876 0.0000 0.0000 65.1809 32.3232 178.3859 141 E 4.0074 7.2149 121.7743 55.4544 28.2201 178.3290 *143 K 3.7979 7.9658 118.5514 56.1644 34.2179 177.4833 144 T 4.2814 7.3407 106.1418 61.5251 69.3937 175.2470 145 W 4.4160 7.6441 122.8418 55.9084 29.7147 173.9159 146 P 4.4778 0.0000 0.0000 62.7522 31.1759 177.4584 147 S 4.4387 9.0880 119.0359 61.0903 63.0212 176.4737 148 S 4.2802 8.1455 114.3709 60.9092 62.8135 174.4579 149 H 4.1692 8.3735 116.9354 55.5020 28.9097 174.5076 150 N 4.2006 7.9537 116.0997 53.7728 36.1301 174.6751 151 W 4.4502 7.8009 116.5131 57.1738 30.2013 177.1314 152 F 5.1347 8.5924 117.3570 55.2168 41.6475 173.4299 153 F 5.3216 9.0994 118.4968 57.2604 40.4678 174.6505 154 A 5.7951 9.6909 124.2939 50.4473 23.5234 174.4794 155 K 5.0715 9.2689 116.8868 55.4614 36.7137 175.0345 156 L 4.9991 8.6430 124.2830 54.4676 43.1838 175.7090 157 N 4.8453 9.5203 125.1435 52.3036 39.6193 174.3351 158 I 4.6603 8.4792 125.7206 61.0302 37.6583 175.9943 159 T 4.5599 9.4240 117.0813 62.2079 71.2780 174.4112 160 N 4.7555 7.8827 117.8865 51.1706 43.0992 173.6200 161 I 4.7265 7.2722 122.2289 59.1301 41.2653 174.4014 162 W 5.0110 8.9042 125.0423 54.8275 32.8468 174.1491 163 V 4.2912 9.1574 124.9808 61.2366 33.2281 174.4309 164 L 4.9692 8.7244 128.9825 53.0163 42.2194 176.1725 165 D 5.1756 8.1402 119.6469 51.3527 40.6305 174.6881 166 Y 4.3238 7.2804 118.5539 56.5109 41.4803 173.5535 167 F 4.2029 6.0038 121.5914 58.5336 39.3374 176.0561 168 G 4.0392 9.0400 110.9681 45.3163 0.0000 174.0238 169 G 3.9007 7.7339 108.1966 43.9017 0.0000 170.9720 170 P 4.4962 0.0000 0.0000 63.6700 31.6534 175.8904 171 K 4.5673 9.2863 122.8857 55.2975 33.7529 175.5606 172 I 4.4466 8.2905 119.0537 59.7624 37.6260 175.1200 173 V 4.5986 7.8977 126.3829 61.0140 34.2503 175.0499 174 T 4.2834 8.8258 117.6999 60.3561 70.0858 173.7235 175 P 4.0961 0.0000 0.0000 66.0604 31.3895 178.5168 176 E 4.0463 8.1824 117.2572 59.3218 29.2160 178.4538 177 E 3.9643 8.2044 118.6239 59.6004 29.6771 178.7801 178 Y 4.0257 8.1459 119.4963 60.9330 38.4717 177.3090 179 Y 4.5750 8.4351 116.4965 59.5411 37.9463 176.4734 180 N 4.8089 7.6941 116.1196 52.0487 39.3161 175.3076 181 V 3.6707 6.8683 120.6871 63.3098 32.0789 175.9088 182 T 4.1987 8.2233 122.6654 63.8853 69.3901 173.6040 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 12 S 8.33 4.41 0.00 4.04 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.06 2.62 0.00 1.23 1.48 0.58 0.54 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 14 P 0.00 4.31 0.00 1.95 1.87 0.00 3.25 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.90 0.00 15 P 0.00 4.19 0.00 2.11 2.06 0.00 3.55 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 2.06 2.06 0.00 16 R 9.02 4.34 0.00 1.63 1.93 0.00 3.25 0.00 0.00 3.89 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 17 E 7.99 3.98 0.00 2.01 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 2.20 2.24 0.00 18 D 8.36 4.57 0.00 2.64 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 19 A 8.02 3.98 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.91 3.95 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.99 3.81 0.00 2.07 2.01 0.00 3.05 0.00 0.00 3.06 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 22 V 7.95 3.54 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 0.96 0.00 0.00 1.00 0.00 0.00 23 A 8.25 4.09 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.10 3.72 0.00 1.87 1.81 0.00 2.21 0.00 0.00 2.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.42 0.00 25 F 8.47 4.03 0.00 3.09 3.24 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 26 V 7.99 3.45 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 0.95 0.00 0.00 1.08 0.00 0.00 27 T 7.71 3.89 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 1.32 0.00 0.00 28 H 7.76 4.59 0.00 3.12 3.30 0.00 5.79 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 29 V 7.24 3.64 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 0.10 0.00 0.00 0.61 0.00 0.00 30 S 7.04 4.30 0.00 3.88 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 31 D 8.58 4.93 0.00 2.95 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 32 W 7.45 5.74 0.00 3.65 3.12 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 33 G 9.58 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 34 A 8.73 5.47 1.35 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 0.00 0.00 35 L 8.96 5.11 0.00 1.73 1.51 0.95 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 36 A 9.34 5.63 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 37 T 8.42 4.93 4.31 0.00 0.00 0.00 0.00 0.00 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 38 I 8.24 4.68 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.91 0.98 0.00 0.00 39 S 9.51 4.26 0.00 3.84 3.93 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 0.00 0.00 0.00 40 T 8.55 4.49 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 1.17 0.00 0.00 41 L 7.53 4.10 0.00 1.66 1.55 0.71 0.80 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 42 E 9.02 3.88 0.00 1.92 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 2.30 2.25 0.00 43 A 8.14 4.18 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 V 7.43 4.49 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 0.73 0.00 0.00 0.96 0.00 0.00 45 R 8.09 4.21 0.00 1.85 1.83 0.00 3.25 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 46 G 8.85 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 0.00 0.00 0.00 0.00 47 R 7.70 4.42 0.00 2.18 1.92 0.00 3.20 0.00 0.00 3.33 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.64 0.00 48 P 0.00 4.85 0.00 2.09 2.08 0.00 3.74 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 49 F 9.71 5.06 0.00 3.05 2.92 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 50 A 7.59 5.19 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 51 D 8.51 4.56 0.00 2.82 2.53 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 52 V 8.32 4.97 2.04 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 0.72 0.00 0.00 0.93 0.00 0.00 53 L 8.92 5.08 0.00 1.77 1.72 0.50 0.64 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 54 S 9.07 5.12 0.00 3.94 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 55 L 8.81 5.07 0.00 1.59 1.82 0.96 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.76 4.73 0.00 4.00 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 57 D 9.82 5.60 0.00 2.94 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 58 G 7.72 4.69 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 59 P 0.00 4.51 0.00 2.24 2.16 0.00 3.93 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 2.09 2.02 0.00 60 P 0.00 4.12 0.00 2.08 2.16 0.00 3.66 0.00 0.00 3.64 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 61 G 8.00 3.90 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.14 4.98 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 88 T 8.82 5.15 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 1.24 0.00 0.00 89 L 9.18 5.20 0.00 1.71 1.64 1.12 1.11 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 90 T 8.69 5.23 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 1.23 0.00 0.00 *92 T 8.16 4.56 4.22 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 1.15 0.00 0.00 93 L 8.98 4.10 0.00 1.80 1.81 0.49 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.08 4.43 1.35 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 0.00 0.00 95 Q 7.99 4.24 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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1.60 1.51 0.00 139 H 8.09 4.79 0.00 3.16 2.95 0.00 5.68 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 3.89 0.00 1.93 2.02 0.00 3.58 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 141 E 7.21 4.01 0.00 1.78 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 2.55 2.36 0.00 *143 K 7.97 3.80 0.00 1.59 1.76 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.84 1.22 7.81 144 T 7.34 4.28 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 1.15 0.00 0.00 145 W 7.64 4.42 0.00 2.70 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 0.00 146 P 0.00 4.48 0.00 2.24 2.25 0.00 3.89 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.86 0.00 147 S 9.09 4.44 0.00 4.17 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 0.00 148 S 8.15 4.28 0.00 4.04 4.11 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 0.00 149 H 8.37 4.17 0.00 2.54 2.52 0.00 5.83 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 0.00 150 N 7.95 4.20 0.00 2.79 2.88 0.00 0.00 6.94 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 0.00 151 W 7.80 4.45 0.00 2.85 1.74 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 0.00 152 F 8.59 5.13 0.00 3.17 3.16 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 0.00 153 F 9.10 5.32 0.00 3.30 3.17 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 0.00 154 A 9.69 5.80 1.67 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 0.00 0.00 0.00 155 K 9.27 5.07 0.00 1.69 2.05 0.00 1.35 0.00 0.00 1.87 0.00 0.00 2.92 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.49 1.49 7.81 156 L 8.64 5.00 0.00 2.10 1.76 1.14 1.45 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 0.00 157 N 9.52 4.85 0.00 2.77 2.82 0.00 0.00 6.57 7.36 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 0.00 158 I 8.48 4.66 1.83 0.00 0.00 0.50 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 0.68 0.65 0.00 0.00 159 T 9.42 4.56 4.27 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 1.32 0.00 0.00 160 N 7.88 4.76 0.00 2.50 1.60 0.00 0.00 6.92 7.70 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 0.00 161 I 7.27 4.73 1.79 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 1.16 0.77 0.00 0.00 162 W 8.90 5.01 0.00 3.21 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 0.00 163 V 9.16 4.29 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 0.93 0.00 0.00 0.99 0.00 0.00 164 L 8.72 4.97 0.00 1.53 1.53 0.94 0.53 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 0.00 165 D 8.14 5.18 0.00 2.73 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 0.00 166 Y 7.28 4.32 0.00 2.72 2.77 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 0.00 167 F 6.00 4.20 0.00 2.90 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 0.00 168 G 9.04 4.04 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 0.00 169 G 7.73 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 0.00 170 P 0.00 4.50 0.00 2.38 2.27 0.00 3.81 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 2.12 2.08 0.00 171 K 9.29 4.57 0.00 1.70 1.76 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.41 7.81 172 I 8.29 4.45 1.63 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 1.19 0.49 0.66 0.00 0.00 173 V 7.90 4.60 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 0.99 0.00 0.00 0.90 0.00 0.00 174 T 8.83 4.28 4.20 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 1.20 0.00 0.00 175 P 0.00 4.10 0.00 2.24 2.23 0.00 3.55 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 176 E 8.18 4.05 0.00 2.07 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 2.58 2.45 0.00 177 E 8.20 3.96 0.00 2.21 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 2.32 0.00 178 Y 8.15 4.03 0.00 2.83 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 0.00 179 Y 8.44 4.58 0.00 3.20 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 0.00 180 N 7.69 4.81 0.00 2.86 2.86 0.00 0.00 6.89 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 0.00 181 V 6.87 3.67 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 0.94 0.00 0.00 182 T 8.22 4.20 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 * Residues marked with a * may have inaccurate shift predictions.