NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 D 4.6256 8.3649 119.5550 52.8638 41.5305 174.9009 8 L 4.4101 7.4597 120.8503 52.9678 43.8933 176.1821 9 L 3.9823 9.0732 124.0548 58.2658 43.3053 179.0975 10 F 4.1361 7.7773 116.4124 60.0575 39.0522 177.1862 11 A 4.1519 8.1220 121.9562 54.0890 18.2293 177.6531 12 Q 4.4327 8.0806 113.6216 55.4933 29.6718 175.4282 13 L 4.8489 7.4835 119.1134 52.6075 44.0714 177.1830 14 S 4.5183 9.2313 119.6721 57.0328 65.5169 173.5726 15 P 4.4104 0.0000 0.0000 66.2630 30.7139 178.5245 16 E 3.7443 7.9564 117.9540 59.1310 29.3985 178.6202 17 D 4.2492 7.9600 119.0015 57.3733 40.6721 178.8372 18 L 4.2634 7.7264 117.9129 57.9912 42.0824 179.4097 19 I 3.9234 7.9108 119.6145 64.5263 36.8796 178.1829 20 E 4.1724 8.4623 118.9362 58.2625 29.6522 177.7420 21 W 5.3438 8.2706 118.3229 56.6500 29.9835 178.4597 22 S 4.3001 8.0444 116.8508 61.3797 62.6079 175.1768 23 D 4.2970 7.7321 118.9480 55.7799 40.6758 176.1253 24 Y 4.6401 7.4653 114.7464 57.5034 40.2608 175.7716 25 L 4.3988 7.7222 119.1768 52.5660 43.2390 175.2909 26 P 4.4318 0.0000 0.0000 62.7552 33.2966 177.6031 27 E 4.0982 8.8638 120.7340 59.5289 29.4386 179.7369 28 S 4.1881 8.1911 113.9843 61.5811 62.8521 176.4017 29 F 4.1180 8.1641 123.6283 61.1954 39.2326 177.1216 30 T 4.0078 8.2062 115.4474 66.9416 68.3327 176.2896 31 D 4.2075 8.5158 121.0655 57.4478 40.6514 179.2069 32 R 3.6171 7.8196 118.3378 58.7447 29.7215 178.8484 33 A 3.5286 7.2785 119.7692 54.9990 18.4573 179.3949 34 L 3.8638 7.6627 116.2307 57.8503 41.7556 179.4132 35 A 4.0285 7.6319 119.3953 54.2799 18.3715 177.6960 36 Q 4.2772 7.2099 117.5692 55.6285 30.8974 175.6024 *38 G 3.7494 7.3976 105.7178 44.5507 0.0000 174.1207 39 E 3.9109 8.6565 120.4957 59.2662 29.5561 179.4994 40 R 3.9826 7.9750 117.5934 59.4295 30.1925 178.9128 41 Q 4.0384 7.9346 117.3292 58.9635 28.8205 178.6088 42 R 3.9892 8.2147 119.2044 59.3953 30.0503 179.1611 43 Q 4.0990 8.2588 117.9241 58.9409 28.7325 178.6763 44 R 3.9740 8.0720 119.7476 59.3153 30.0124 178.3510 45 F 4.0239 8.4397 120.4770 61.4191 39.5177 176.9695 46 E 4.0526 8.5194 118.2427 59.3478 29.2231 179.4873 47 L 4.1277 8.0735 119.0609 58.1777 41.5656 179.1313 48 Y 3.9282 8.0745 115.4048 60.9730 37.7881 177.9071 49 D 4.2113 8.0905 118.6014 56.5482 41.3029 177.2919 50 Q 3.9714 7.5429 118.7866 56.0498 29.7753 175.1083 51 Y 4.8375 7.5985 117.1472 55.8142 40.5553 175.8694 52 S 4.5059 8.9965 119.5407 56.9828 64.5317 174.8656 53 E 3.9827 8.6208 117.6219 58.5130 29.6108 177.0304 54 N 4.9670 8.1282 117.7311 53.1052 39.6536 172.7157 55 E 5.0587 7.9778 116.2582 53.6776 31.7548 177.3627 56 I 3.8003 8.6410 124.2095 63.5915 38.5082 177.9025 57 G 2.8227 8.0046 107.9781 47.8913 0.0000 175.4518 58 R 3.7916 7.5749 119.5958 58.3643 29.9257 177.2608 59 Y 4.6156 7.4045 113.9453 56.9000 39.1154 175.9057 60 T 4.0605 7.2716 118.3005 63.6285 69.3297 172.7151 61 D 4.8121 8.8457 125.3556 52.7804 42.6705 176.9929 62 H 4.6099 8.7603 123.4802 58.0450 29.2480 175.8958 63 Q 3.9238 8.2517 119.6118 55.7272 28.9626 175.6326 *65 L 3.4625 8.3981 122.0058 54.2552 43.0184 176.0983 66 V 5.1233 8.2300 122.6822 60.0044 34.6419 174.8190 67 L 5.0856 9.0021 122.0905 53.0105 46.7314 176.2507 68 S 5.3564 8.7820 116.1437 57.1254 65.0731 173.8223 69 D 4.6588 8.6063 117.1248 54.0628 39.2400 177.2383 70 K 4.2230 7.9724 117.4632 56.9855 32.9256 176.9846 71 A 4.2200 7.9416 123.2550 51.9412 19.3198 176.6585 72 T 4.9801 8.8769 110.4276 59.2627 71.6797 175.5349 73 V 3.4928 8.5260 120.8927 66.3354 31.2436 177.7337 74 A 3.9515 8.0057 120.1281 55.3883 18.2562 179.6846 75 Q 3.9005 7.9719 115.7871 58.9100 28.7448 178.8945 76 A 4.0108 7.8736 121.3203 55.2742 18.6850 179.4136 77 Q 3.7277 8.3707 117.0345 59.2292 28.7439 179.3092 78 R 4.0556 8.0093 119.2948 59.1181 29.6753 178.3613 79 F 4.3377 8.2465 120.7879 61.4457 39.1650 177.2364 80 F 4.4712 8.1625 116.3195 60.4685 38.8182 177.4976 81 R 4.3213 8.1477 116.7664 57.9997 30.1649 178.0730 82 R 4.4432 8.0861 113.9544 55.5576 30.5537 176.2981 83 I 4.5820 7.1705 119.1096 59.3330 40.0774 174.1595 84 E 4.6462 8.7637 125.1898 54.2502 30.9861 174.7913 85 L 4.7059 8.1796 126.7995 52.9169 45.3721 174.9602 86 D 4.3072 8.7827 124.9829 56.0361 42.1410 175.7465 87 C 4.0952 8.6766 122.5418 61.1225 25.5662 173.4465 88 N 5.1998 7.8572 115.2969 52.1236 41.2330 173.3162 89 D 4.9528 9.3908 124.3966 53.5656 41.5264 174.2844 90 N 5.6852 8.5866 115.0942 52.1939 43.6134 172.8601 91 L 4.3168 8.6464 121.3841 53.3189 45.9561 174.8896 92 F 5.6809 8.7149 124.4339 56.0961 41.6552 174.5782 93 I 5.0198 8.7984 123.7231 59.7570 39.7404 175.2072 94 V 5.0433 8.6136 119.3325 59.5334 35.9992 175.7651 95 D 5.2454 8.4694 122.7860 52.2593 41.1690 176.7245 96 E 4.0118 8.6691 115.5534 58.4928 29.8040 177.0552 97 A 4.4260 8.1223 121.3653 51.9118 19.3001 176.8970 98 D 4.6401 8.4024 116.1589 55.5034 39.1088 173.8978 99 K 4.5691 8.4095 120.4917 55.9398 32.3230 176.0620 100 Y 4.4785 8.8001 125.5537 58.1138 39.1519 176.1162 101 L 4.1401 8.5305 127.4093 54.6659 43.5847 176.6796 102 G 3.7164 5.6115 103.1016 46.2974 0.0000 171.2042 103 T 5.4522 7.8732 114.9756 61.8631 72.3892 173.7786 104 V 4.7672 8.9412 119.0715 59.7276 34.6695 175.0658 105 R 5.1736 8.3955 122.7224 54.4641 32.0532 177.0970 106 R 3.3269 8.8672 124.0295 59.9263 29.6953 178.2878 107 Y 4.0207 7.9428 116.8777 60.9060 38.9859 177.4586 108 D 4.5664 8.2240 119.5484 57.2520 41.3126 178.4003 109 I 3.8534 8.1564 113.1452 63.0129 37.4860 177.1808 110 F 4.3177 7.7698 117.7314 57.8409 38.9574 175.7851 111 K 4.3015 7.9544 117.5970 56.3952 32.7699 175.6270 112 H 4.7717 7.3574 115.0138 53.7135 31.1906 173.9800 113 E 4.2951 9.0588 120.4197 55.3493 30.1518 176.9360 114 P 4.2879 0.0000 0.0000 65.4155 31.6184 177.8702 115 H 4.5067 7.8764 111.7536 56.5654 29.1925 175.2506 116 E 4.1614 7.8041 122.0369 55.2623 30.1361 174.5346 117 P 4.7617 0.0000 0.0000 62.2440 32.3199 177.6066 118 L 3.9959 8.7224 123.0574 57.8182 41.2719 179.7135 119 I 3.8811 7.7533 117.4630 63.3219 37.9838 176.8453 120 S 4.5753 7.6954 112.8916 58.5909 63.3579 174.1257 121 L 4.7673 7.8675 122.8199 54.4165 42.5384 176.5992 122 L 4.1377 7.9578 118.4808 54.3191 42.2122 177.2635 123 S 4.2849 8.7747 118.6743 58.3883 62.9088 174.3275 124 E 4.1775 8.7529 126.5537 59.4497 29.5034 178.0809 125 D 4.5014 7.6560 116.3410 56.0487 41.0756 176.6788 126 S 4.3778 8.0678 115.0910 57.9082 63.4826 173.6401 127 R 4.7138 8.5427 121.0719 53.9792 31.8983 174.7025 128 A 4.6539 8.0612 119.7301 49.9849 22.0482 175.7076 129 L 4.3725 8.6159 121.6849 54.1414 43.3796 176.8266 130 T 4.4606 8.3459 112.8422 61.3468 69.9221 175.5869 131 A 3.6889 8.6730 127.0166 54.7368 18.5102 178.8612 132 N 4.6564 7.8988 110.8898 53.3496 38.2579 175.6748 133 T 3.9140 7.7347 117.7302 64.0056 69.2219 174.0026 134 T 5.0545 8.0992 116.6406 60.9738 70.9203 175.6943 135 L 3.8847 8.3586 122.3508 58.0550 41.6501 179.8376 136 L 3.8839 7.7740 119.6957 58.0371 42.0840 178.5191 137 D 4.3150 8.0151 118.5123 56.9299 40.7266 178.5255 138 A 3.8853 8.2617 121.4077 55.1462 18.3737 179.4743 139 A 3.8867 8.1140 119.4370 55.3586 18.3858 179.6424 140 E 3.8818 8.3468 116.8513 59.5590 29.3276 179.4893 141 A 4.0202 7.7626 119.5908 55.1402 18.4883 179.5601 142 I 3.8368 7.4543 117.2239 64.3510 37.3739 177.8829 143 E 3.9843 8.1960 119.1423 58.9548 30.5784 177.6133 144 H 4.7865 8.1742 116.5056 54.3936 28.0815 173.1612 145 S 4.5666 7.3147 112.6549 57.7604 65.9910 174.5264 146 R 4.4896 8.5345 116.4246 56.2131 29.4269 175.4969 147 E 4.5834 8.0654 118.1308 55.7449 30.9801 175.9168 148 I 4.5777 8.0242 113.6073 60.6875 39.0371 174.3270 149 E 5.2277 7.7721 118.6468 55.7972 32.1255 174.4264 150 L 5.0522 8.8047 120.6664 52.1611 46.1995 174.4392 151 P 4.2296 0.0000 0.0000 62.5728 32.9095 174.9462 152 V 4.7570 8.6261 122.1702 61.0281 34.0596 174.3769 153 I 5.0268 8.5656 121.3686 59.1085 41.1724 175.4247 154 D 4.9884 8.5984 123.9242 52.1881 41.1532 176.5886 155 D 4.4577 8.5677 117.0909 55.4665 39.6103 176.8083 156 A 4.1499 8.2637 121.9852 52.7268 18.9396 178.2288 157 G 4.0031 8.3634 104.9053 44.9368 0.0000 173.2964 158 E 4.6637 8.0545 119.9721 55.2676 30.3176 175.6355 159 L 4.3667 8.4170 126.0653 55.3017 41.8338 176.4837 160 I 4.3037 8.8270 120.1819 59.9523 39.1541 176.3680 161 G 3.9179 6.7298 107.2594 45.9974 0.0000 170.7399 162 R 5.0165 8.1871 115.6371 54.5707 33.7787 174.2116 163 V 4.7846 8.6879 119.5179 61.3464 34.6252 174.8384 164 T 4.8599 8.3122 116.9981 60.2123 71.2775 175.3169 165 L 3.9107 8.8464 124.4222 58.3440 42.0966 179.1155 166 R 3.8355 8.0679 117.8372 59.5672 29.9405 178.1401 167 A 3.9795 8.1347 120.1246 55.1080 18.3858 179.3687 168 A 3.8720 8.1052 119.2619 55.5078 18.3848 180.0297 169 T 3.7415 7.9021 113.9670 66.7215 68.4771 176.2735 170 A 3.9263 7.7328 122.0357 55.3569 18.3250 179.2595 171 L 3.7174 7.8932 116.8986 58.3567 41.7998 179.7678 172 V 3.4775 7.7682 117.5124 66.2092 31.3963 177.6639 173 R 3.9012 8.1870 118.0643 59.6583 29.5913 178.4586 174 E 3.9005 8.2429 117.7278 59.7395 29.7149 178.5422 175 H 4.4029 8.2814 117.8799 58.9803 29.9502 176.9062 *176 Y 4.2355 7.9754 124.8203 62.9053 36.9820 181.9006 177 E 4.4980 8.2891 124.2486 58.1930 29.9993 178.8015 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 7 D 8.36 4.63 0.00 2.71 2.59 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 8 L 7.46 4.41 0.00 1.70 1.64 0.94 0.83 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 9 L 9.07 3.98 0.00 1.47 1.06 0.82 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 10 F 7.78 4.14 0.00 3.07 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 11 A 8.12 4.15 1.30 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 0.00 0.00 0.00 12 Q 8.08 4.43 0.00 2.24 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.53 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 13 L 7.48 4.85 0.00 1.65 1.65 1.23 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 14 S 9.23 4.52 0.00 4.12 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 15 P 0.00 4.41 0.00 2.30 2.47 0.00 3.66 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 2.01 2.17 0.00 16 E 7.96 3.74 0.00 1.98 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 2.21 1.47 0.00 17 D 7.96 4.25 0.00 2.86 2.55 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 18 L 7.73 4.26 0.00 2.19 2.08 0.91 1.20 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 19 I 7.91 3.92 2.06 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.22 0.95 0.00 0.00 20 E 8.46 4.17 0.00 2.09 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 2.56 2.47 0.00 21 W 8.27 5.34 0.00 3.76 3.31 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 22 S 8.04 4.30 0.00 4.08 4.16 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 23 D 7.73 4.30 0.00 1.58 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 24 Y 7.47 4.64 0.00 2.42 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.72 4.40 0.00 1.76 1.67 1.28 0.51 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 26 P 0.00 4.43 0.00 2.27 2.03 0.00 3.56 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 2.19 2.20 0.00 27 E 8.86 4.10 0.00 2.14 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 0.00 2.40 1.94 0.00 28 S 8.19 4.19 0.00 4.08 4.18 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 29 F 8.16 4.12 0.00 3.32 3.34 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 T 8.21 4.01 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 31 D 8.52 4.21 0.00 2.71 2.63 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 32 R 7.82 3.62 0.00 1.38 1.23 0.00 3.02 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.66 0.00 33 A 7.28 3.53 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 34 L 7.66 3.86 0.00 1.53 1.53 0.37 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 35 A 7.63 4.03 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 36 Q 7.21 4.28 0.00 1.83 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.45 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 *38 G 7.40 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 0.00 0.00 0.00 39 E 8.66 3.91 0.00 2.09 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 2.39 2.49 0.00 40 R 7.97 3.98 0.00 1.92 2.00 0.00 3.18 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 41 Q 7.93 4.04 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.89 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 42 R 8.21 3.99 0.00 2.03 2.00 0.00 3.09 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 43 Q 8.26 4.10 0.00 2.39 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 44 R 8.07 3.97 0.00 2.06 2.07 0.00 3.26 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.67 0.00 45 F 8.44 4.02 0.00 3.21 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 46 E 8.52 4.05 0.00 2.29 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 2.72 2.59 0.00 47 L 8.07 4.13 0.00 2.00 1.82 0.95 1.07 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 48 Y 8.07 3.93 0.00 2.91 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 49 D 8.09 4.21 0.00 2.08 2.63 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 50 Q 7.54 3.97 0.00 1.91 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.36 0.00 0.00 0.00 0.00 0.00 1.25 1.98 0.00 51 Y 7.60 4.84 0.00 2.92 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 52 S 9.00 4.51 0.00 3.99 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 53 E 8.62 3.98 0.00 2.14 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 2.29 2.32 0.00 54 N 8.13 4.97 0.00 2.81 2.78 0.00 0.00 7.07 7.65 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 55 E 7.98 5.06 0.00 2.22 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 2.25 2.23 0.00 56 I 8.64 3.80 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0.00 2.02 2.18 0.00 3.09 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.75 0.00 83 I 7.17 4.58 2.15 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 1.50 1.22 0.95 0.00 0.00 84 E 8.76 4.65 0.00 1.94 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 2.23 2.29 0.00 85 L 8.18 4.71 0.00 1.56 1.46 0.94 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 86 D 8.78 4.31 0.00 2.67 2.58 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 87 C 8.68 4.10 0.00 3.14 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 88 N 7.86 5.20 0.00 2.64 2.82 0.00 0.00 7.05 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 D 9.39 4.95 0.00 2.65 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 90 N 8.59 5.69 0.00 2.69 2.59 0.00 0.00 6.39 6.74 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 0.00 124 E 8.75 4.18 0.00 2.28 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 2.31 1.90 0.00 125 D 7.66 4.50 0.00 2.77 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 0.00 126 S 8.07 4.38 0.00 4.19 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 0.00 127 R 8.54 4.71 0.00 1.90 1.94 0.00 2.97 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 128 A 8.06 4.65 0.65 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 0.00 0.00 129 L 8.62 4.37 0.00 1.45 1.48 0.85 0.46 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 0.00 130 T 8.35 4.46 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 1.18 0.00 0.00 131 A 8.67 3.69 0.97 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 0.00 0.00 132 N 7.90 4.66 0.00 2.86 2.98 0.00 0.00 6.05 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 0.00 133 T 7.73 3.91 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 1.19 0.00 0.00 134 T 8.10 5.05 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 0.00 135 L 8.36 3.88 0.00 1.62 1.63 0.80 1.13 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 0.00 136 L 7.77 3.88 0.00 1.60 1.59 0.74 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 137 D 8.02 4.32 0.00 2.82 2.67 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 0.00 138 A 8.26 3.89 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 0.00 139 A 8.11 3.89 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 0.00 140 E 8.35 3.88 0.00 2.26 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 0.00 2.41 2.33 0.00 141 A 7.76 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 0.00 142 I 7.45 3.84 1.84 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 0.75 0.91 0.00 0.00 143 E 8.20 3.98 0.00 1.92 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 2.13 2.25 0.00 144 H 8.17 4.79 0.00 3.24 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 S 7.31 4.57 0.00 3.93 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 0.00 146 R 8.53 4.49 0.00 1.89 2.03 0.00 3.08 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.69 0.00 147 E 8.07 4.58 0.00 2.01 2.10 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 2.31 2.42 0.00 148 I 8.02 4.58 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.21 0.91 0.00 0.00 149 E 7.77 5.23 0.00 2.07 2.14 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 2.28 2.57 0.00 150 L 8.80 5.05 0.00 1.51 1.44 0.89 1.00 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 0.00 151 P 0.00 4.23 0.00 1.08 0.49 0.00 3.55 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 1.41 1.30 0.00 152 V 8.63 4.76 1.92 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 0.85 0.00 0.00 0.79 0.00 0.00 153 I 8.57 5.03 1.83 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 1.24 0.53 0.69 0.00 0.00 154 D 8.60 4.99 0.00 3.03 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 0.00 155 D 8.57 4.46 0.00 2.81 2.87 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 0.00 0.00 0.00 156 A 8.26 4.15 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 0.00 157 G 8.36 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 0.00 0.00 0.00 158 E 8.05 4.66 0.00 2.25 1.91 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 2.42 2.32 0.00 159 L 8.42 4.37 0.00 1.73 1.68 0.68 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 160 I 8.83 4.30 1.96 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 1.37 0.74 1.03 0.00 0.00 161 G 6.73 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 0.00 0.00 0.00 162 R 8.19 5.02 0.00 2.00 2.12 0.00 3.06 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 163 V 8.69 4.78 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 1.05 0.00 0.00 0.90 0.00 0.00 164 T 8.31 4.86 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 0.00 165 L 8.85 3.91 0.00 1.76 1.71 0.89 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 166 R 8.07 3.84 0.00 1.92 1.93 0.00 3.25 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 167 A 8.13 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.11 3.87 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 0.00 169 T 7.90 3.74 4.36 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 1.19 0.00 0.00 170 A 7.73 3.93 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 0.00 171 L 7.89 3.72 0.00 1.75 1.61 0.76 0.06 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 0.00 172 V 7.77 3.48 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 0.96 0.00 0.00 0.92 0.00 0.00 173 R 8.19 3.90 0.00 1.91 2.18 0.00 3.15 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 174 E 8.24 3.90 0.00 2.16 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 2.33 2.36 0.00 175 H 8.28 4.40 0.00 3.12 3.49 0.00 5.75 0.00 0.00 0.00 0.00 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *176 Y 7.98 4.24 0.00 2.47 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 0.00 0.00 0.00 177 E 8.29 4.50 0.00 2.08 1.75 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 2.26 2.19 0.00 * Residues marked with a * may have inaccurate shift predictions.