NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 A 4.2604 8.2649 123.5817 52.3068 20.1026 175.6115 17 N 4.7779 7.9679 116.5383 50.6673 42.2709 173.6539 18 R 3.8482 8.8689 121.5443 60.3302 30.5037 178.3194 19 A 4.0927 7.9854 119.8398 54.9973 18.5084 179.6950 20 G 3.5021 7.9675 103.7727 47.9768 0.0000 175.5938 21 R 3.9179 8.2978 122.0915 59.3784 30.0716 178.6426 22 Q 3.9809 8.2895 117.4115 58.5727 28.6190 178.5190 23 A 3.9977 7.9327 121.7413 55.1807 18.4505 179.7570 24 R 3.8760 8.0280 116.5652 59.5223 30.0664 179.3056 25 I 3.6756 7.8341 119.5417 64.3521 36.7054 178.5725 26 V 3.5658 7.8982 118.7554 65.9442 31.4996 177.8966 27 A 4.0177 7.9999 120.4083 55.2693 18.2915 179.6108 28 I 3.7627 8.3165 118.5938 64.6664 37.0060 178.7374 29 L 4.1573 8.1743 118.8221 57.1524 41.4720 179.0347 30 S 4.4140 7.7314 113.2222 59.7773 63.4532 174.9817 31 S 4.5245 7.6286 113.7254 57.9165 63.8935 173.2832 32 A 4.7299 7.7702 122.8020 50.4591 21.6827 175.8851 33 Q 4.3687 8.4046 118.6371 54.3668 28.6413 175.1224 34 V 4.3006 8.0702 123.0361 61.5695 32.0801 176.6088 35 R 4.4944 9.0454 127.0469 57.3540 30.9585 176.9560 36 S 4.8895 7.5236 111.5547 56.3746 66.8918 175.0984 37 Q 3.9265 8.6763 121.3641 58.7144 28.5573 178.2734 38 N 4.2757 8.1697 117.9766 56.7534 38.9477 176.5729 39 E 3.9776 8.1228 119.9273 59.3092 29.5064 179.0066 40 L 3.8991 7.9729 120.1869 58.1366 42.0233 178.8626 41 A 3.9456 8.3675 120.7968 55.0527 18.2663 179.5420 42 A 3.9194 7.8351 118.8000 55.2757 18.1041 179.7455 43 L 3.9705 8.1088 117.6487 58.0781 41.6913 179.9012 44 L 3.9463 8.2558 118.7771 57.6969 41.6079 179.3906 45 A 4.2830 8.6425 122.0495 54.4328 18.0246 179.4854 46 A 4.1125 8.0197 119.0991 54.1547 18.4542 177.8651 47 E 4.5195 7.5804 114.5001 56.2287 30.0537 177.4025 48 G 3.8987 8.2141 107.8899 46.4216 0.0000 174.1858 49 I 4.1208 7.6859 121.9318 59.9418 37.7156 174.6365 50 E 4.7435 8.7131 125.4040 54.6645 30.7558 175.6013 51 V 4.5159 7.9646 116.0366 58.8871 36.1034 175.8661 52 T 4.3807 7.9869 112.0969 60.7096 71.5341 175.4474 53 Q 3.9213 8.4867 120.8263 59.1001 28.9506 177.7568 54 A 3.9714 7.9978 121.3267 55.6856 18.4286 179.5873 55 T 3.8306 7.4175 113.7279 66.7570 68.4026 176.9479 56 L 3.9223 7.8411 120.6791 57.5908 41.6030 179.2653 57 S 4.0433 8.4705 113.5464 61.6697 62.2106 176.6412 58 R 3.9262 7.9882 120.4487 59.2557 29.7215 178.6595 59 D 4.3436 8.6672 119.0062 57.6255 40.8206 179.0949 60 L 3.9917 8.1529 119.4692 57.3492 41.5513 179.2633 61 E 3.9147 8.2237 119.5147 59.4155 29.4463 178.6072 62 E 3.9987 8.1611 117.4422 59.5462 29.6114 179.2040 63 L 4.2040 8.1941 118.0799 55.5282 41.6330 178.1275 64 G 3.8425 7.8649 106.0648 45.8086 0.0000 173.2558 65 A 4.4894 8.0903 121.4670 51.6981 18.9994 178.4268 66 V 4.4437 8.7902 114.9445 59.3248 35.5636 175.4555 67 K 4.1204 8.5194 125.5778 55.4729 31.8720 175.1421 68 L 4.7186 8.9000 130.6083 53.7744 43.8997 175.2786 69 R 4.7859 8.2719 120.1715 55.3941 32.3007 175.4607 70 G 3.9613 8.2831 109.6227 44.3736 0.0000 172.6098 71 A 4.0560 8.4371 122.5180 53.3440 19.2238 177.6106 72 D 4.3495 8.6071 122.0934 55.8477 38.4411 174.4360 73 G 3.9640 8.0593 102.7601 44.8476 0.0000 175.7659 74 G 3.8112 7.9331 106.6981 46.1624 0.0000 174.5976 75 T 4.0527 8.4382 115.7291 63.9199 69.2887 175.7015 76 G 3.9822 8.5203 106.8210 44.8183 0.0000 172.3872 77 I 4.7996 8.1074 112.0074 58.7919 41.2371 174.2002 78 Y 4.7529 8.8522 122.3605 58.2088 38.4444 175.6053 79 V 4.6710 9.1158 116.4057 59.7806 36.6784 174.7694 80 V 4.5672 8.2588 115.9391 58.6605 33.5393 174.2158 81 P 4.2563 0.0000 0.0000 64.4218 32.7164 176.3885 82 E 3.7121 8.2884 120.4555 57.4936 26.8353 175.8221 *89 G 3.8505 8.3482 115.8080 47.2971 0.0000 170.3293 90 V 4.5555 7.2853 117.9939 60.6289 34.1896 176.0239 91 S 4.2091 8.7311 120.7070 59.7007 62.8259 174.3618 92 G 3.9164 9.1060 113.3160 46.2614 0.0000 175.1373 93 G 3.7901 8.2366 108.3069 48.3137 0.0000 176.2844 94 T 4.0466 7.8278 111.8259 63.7881 68.9108 176.1200 95 D 4.2279 7.8957 121.0226 57.0697 41.1414 177.6323 96 R 3.8494 8.2373 118.7766 59.7262 30.3449 177.9054 97 M 4.0924 7.8786 117.0216 58.7035 32.4502 178.0108 98 A 4.0435 8.5858 121.3522 55.1190 18.2359 179.3574 99 R 3.8458 8.0956 116.8995 59.6926 30.4091 178.2288 100 L 4.2431 7.7749 117.1015 56.2936 41.7770 179.1078 101 L 4.0808 7.7889 119.8689 57.5617 41.3072 179.3737 102 G 3.6675 8.0242 104.3886 47.7928 0.0000 175.2421 103 E 4.1448 8.0658 119.3344 58.7986 30.2807 177.8558 104 L 4.4127 8.5647 116.9291 54.3819 43.1434 175.9185 105 L 4.2194 7.7628 121.1213 53.7475 41.3760 176.1467 106 V 3.9562 8.7524 128.0380 65.6194 32.0179 176.0111 107 S 4.7985 7.6276 112.4556 57.6973 65.9051 173.4248 108 T 5.1069 8.1650 110.0678 60.5582 72.0453 171.9641 109 D 4.7127 8.5886 121.0710 54.4291 45.4751 173.0268 110 D 5.0974 8.3124 118.3366 53.0132 42.5150 175.0176 111 S 4.4195 9.5149 111.6590 58.6494 66.9348 174.7125 112 G 3.7813 8.3209 117.5820 47.2259 0.0000 173.6567 113 N 4.8157 8.7868 122.1058 52.4273 37.3897 173.5050 114 L 5.2846 8.1811 119.2389 53.3059 44.8377 175.1537 115 A 5.0042 8.8297 125.0605 50.4201 21.7915 175.9320 116 V 4.6163 8.9225 121.9795 61.2176 33.9802 174.2307 117 L 5.0752 8.7206 128.4296 53.0991 44.2476 175.7868 118 R 5.2274 8.7212 121.9524 54.7193 33.0356 175.1827 119 T 5.5658 8.6103 111.8794 57.8299 73.1421 171.3197 120 P 4.4221 0.0000 0.0000 61.6540 32.7600 174.5664 121 P 4.4214 0.0000 0.0000 64.3874 31.5697 177.5061 122 G 4.0164 8.9103 110.2886 45.5947 0.0000 174.6384 123 A 4.3669 7.9440 120.2912 52.8466 18.7697 178.9860 124 A 3.9254 7.7467 120.0904 55.5983 18.4480 179.6329 125 H 4.0589 8.2344 114.1145 58.8966 28.7355 177.3901 126 Y 4.3283 7.9915 121.1042 60.7339 38.7262 177.5283 127 L 3.7600 7.9598 120.9411 57.9360 42.1303 178.6474 128 A 3.9111 8.2364 121.0600 55.0620 18.2789 179.4622 129 S 4.0238 8.3405 111.5680 61.5942 62.5024 176.3517 130 A 3.9574 7.7037 123.0014 55.0116 17.8273 179.6090 131 I 3.6910 7.7130 117.6071 64.7272 37.6555 177.7787 132 D 4.5666 8.3873 119.9862 57.8510 40.4904 179.4935 133 R 4.0098 8.1863 117.7699 58.8778 29.7858 178.9036 134 A 3.9382 7.8666 119.3308 52.5277 19.1130 176.9784 135 A 3.7149 7.7181 118.8444 52.9874 16.8948 177.7564 136 L 4.1064 7.5485 120.7323 54.6861 42.6053 177.6801 137 P 4.3103 0.0000 0.0000 65.3477 31.7008 177.2365 138 Q 4.2238 8.0162 115.4015 56.0466 29.0187 174.6147 139 V 4.6914 7.3537 119.3387 61.1179 32.4082 175.6795 140 V 3.7521 9.0998 129.8170 64.8882 32.2465 175.7829 141 G 4.1808 7.2458 106.1693 46.4787 0.0000 171.6241 142 T 5.3563 8.3938 108.7064 59.9167 72.2855 173.4724 143 I 4.6549 8.5985 122.7066 59.5685 40.8603 174.1589 144 A 5.0032 8.6509 128.2683 49.1043 20.9835 176.0543 145 G 4.0991 8.8745 109.9307 45.7862 0.0000 174.4136 146 D 4.6507 8.9259 122.6165 55.3227 41.9579 176.6741 147 D 5.1164 7.8055 114.7236 51.7747 41.5470 174.9031 148 T 5.1457 7.8090 114.7125 62.3190 73.2733 172.6093 149 I 4.9244 8.7943 125.6344 59.4956 40.9683 174.3670 150 L 4.8188 8.6795 126.9168 53.4957 43.5030 175.5757 151 V 4.7085 8.6302 124.7041 61.1175 33.7997 174.4525 152 V 4.5376 8.7364 129.0738 61.7629 32.5805 174.8926 153 A 4.6902 8.9810 131.1609 51.6715 19.5560 176.6150 154 R 4.2038 8.9801 123.1067 55.3461 31.2994 176.0186 155 E 4.3350 8.9299 126.4168 56.4561 30.0224 174.7587 156 P 4.7444 0.0000 0.0000 62.7297 31.7481 175.8769 157 T 3.8978 7.7135 116.1518 64.6106 68.9958 174.5188 158 T 4.6354 8.2017 115.7774 60.0988 72.2142 175.9860 159 G 3.7250 8.8279 108.8763 48.1282 0.0000 175.8498 160 A 4.0177 7.9650 122.4329 54.9872 18.4636 179.3784 161 Q 3.8778 8.1509 118.0761 59.1702 29.0791 178.1982 162 L 3.8430 7.8934 119.7837 57.8854 41.6349 179.3837 163 A 4.3433 8.4889 120.9634 55.2469 18.3427 179.8884 164 G 3.5475 8.3258 104.2995 47.9962 0.0000 175.4852 165 M 3.9158 8.3589 120.9519 58.4948 32.0197 178.2251 166 F 4.2340 8.1577 118.1448 60.8446 38.8839 177.6055 167 E 4.1281 8.4040 117.2380 59.3479 29.2956 178.5827 168 N 4.4963 8.1339 116.2399 56.0912 39.1296 176.5594 169 L 4.1808 7.9065 119.1210 56.3249 41.8766 177.0877 170 R 4.1280 7.4055 121.1665 56.7628 30.1507 176.0399 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 16 A 8.26 4.26 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 17 N 7.97 4.78 0.00 2.81 2.77 0.00 0.00 6.42 6.78 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 18 R 8.87 3.85 0.00 1.86 1.93 0.00 3.17 0.00 0.00 3.34 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 19 A 7.99 4.09 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 20 G 7.97 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 8.30 3.92 0.00 1.92 2.12 0.00 3.08 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 22 Q 8.29 3.98 0.00 2.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 23 A 7.93 4.00 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 24 R 8.03 3.88 0.00 1.97 2.00 0.00 3.56 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.82 0.00 25 I 7.83 3.68 2.02 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.84 0.87 0.00 0.00 26 V 7.90 3.57 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 1.02 0.00 0.00 0.98 0.00 0.00 27 A 8.00 4.02 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 28 I 8.32 3.76 2.07 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 1.54 1.00 0.92 0.00 0.00 29 L 8.17 4.16 0.00 1.62 1.78 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 30 S 7.73 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 31 S 7.63 4.52 0.00 4.11 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 32 A 7.77 4.73 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 33 Q 8.40 4.37 0.00 2.02 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.78 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 34 V 8.07 4.30 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 1.19 0.00 0.00 0.97 0.00 0.00 35 R 9.05 4.49 0.00 2.14 1.98 0.00 3.30 0.00 0.00 3.50 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 36 S 7.52 4.89 0.00 4.07 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 37 Q 8.68 3.93 0.00 2.11 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.15 2.37 0.00 38 N 8.17 4.28 0.00 2.84 2.83 0.00 0.00 7.25 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 39 E 8.12 3.98 0.00 2.28 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 2.34 2.34 0.00 40 L 7.97 3.90 0.00 1.69 1.77 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.37 3.95 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 42 A 7.84 3.92 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 43 L 8.11 3.97 0.00 1.86 1.75 0.98 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.26 3.95 0.00 1.82 1.85 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.64 4.28 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 46 A 8.02 4.11 1.47 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 0.00 0.00 47 E 7.58 4.52 0.00 1.91 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 2.37 0.00 48 G 8.21 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 49 I 7.69 4.12 1.99 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 0.75 0.91 0.00 0.00 50 E 8.71 4.74 0.00 1.91 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 2.20 2.28 0.00 51 V 7.96 4.52 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 0.76 0.00 0.00 0.91 0.00 0.00 52 T 7.99 4.38 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 53 Q 8.49 3.92 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.54 2.38 0.00 54 A 8.00 3.97 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 55 T 7.42 3.83 4.37 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 1.24 0.00 0.00 56 L 7.84 3.92 0.00 1.80 1.61 0.91 0.59 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 57 S 8.47 4.04 0.00 3.95 4.06 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 0.00 0.00 0.00 58 R 7.99 3.93 0.00 2.05 1.95 0.00 3.26 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.76 0.00 59 D 8.67 4.34 0.00 2.73 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 60 L 8.15 3.99 0.00 1.76 1.65 0.33 0.92 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 61 E 8.22 3.91 0.00 2.06 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 0.00 2.31 2.36 0.00 62 E 8.16 4.00 0.00 2.09 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 2.35 2.63 0.00 63 L 8.19 4.20 0.00 1.87 1.74 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 64 G 7.86 3.84 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 0.00 0.00 0.00 65 A 8.09 4.49 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 66 V 8.79 4.44 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 0.94 0.00 0.00 67 K 8.52 4.12 0.00 1.23 1.50 0.00 1.31 0.00 0.00 1.42 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.04 0.48 7.81 68 L 8.90 4.72 0.00 1.68 1.46 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.27 4.79 0.00 1.92 1.78 0.00 3.06 0.00 0.00 3.31 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.61 0.00 70 G 8.28 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 71 A 8.44 4.06 1.24 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 0.00 0.00 72 D 8.61 4.35 0.00 2.78 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 73 G 8.06 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 74 G 7.93 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 0.00 0.00 0.00 75 T 8.44 4.05 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 1.18 0.00 0.00 76 G 8.52 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 77 I 8.11 4.80 1.95 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 1.21 0.92 0.91 0.00 0.00 78 Y 8.85 4.75 0.00 2.87 2.93 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 79 V 9.12 4.67 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 0.78 0.00 0.00 0.95 0.00 0.00 80 V 8.26 4.57 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 0.76 0.00 0.00 0.95 0.00 0.00 81 P 0.00 4.26 0.00 2.04 2.03 0.00 3.82 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 82 E 8.29 3.71 0.00 2.15 1.47 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 2.19 2.30 0.00 *89 G 8.35 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 90 V 7.29 4.56 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 0.92 0.00 0.00 0.93 0.00 0.00 91 S 8.73 4.21 0.00 3.92 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 92 G 9.11 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 93 G 8.24 3.79 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 0.00 0.00 0.00 94 T 7.83 4.05 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 1.19 0.00 0.00 95 D 7.90 4.23 0.00 2.73 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 96 R 8.24 3.85 0.00 1.77 2.13 0.00 3.48 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 97 M 7.88 4.09 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.65 0.00 98 A 8.59 4.04 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 99 R 8.10 3.85 0.00 2.10 2.07 0.00 3.26 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 100 L 7.77 4.24 0.00 1.78 1.60 0.42 0.58 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 0.00 101 L 7.79 4.08 0.00 1.83 1.74 1.05 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 102 G 8.02 3.67 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 0.00 103 E 8.07 4.14 0.00 2.06 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 2.33 2.41 0.00 104 L 8.56 4.41 0.00 1.68 1.68 1.00 0.76 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 0.00 105 L 7.76 4.22 0.00 1.65 1.63 0.93 0.80 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 0.00 106 V 8.75 3.96 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 0.80 0.00 0.00 0.90 0.00 0.00 107 S 7.63 4.80 0.00 3.88 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.17 5.11 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 1.24 0.00 0.00 109 D 8.59 4.71 0.00 2.74 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.31 5.10 0.00 2.78 2.61 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 0.00 111 S 9.51 4.42 0.00 3.82 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 0.00 112 G 8.32 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 0.00 0.00 0.00 113 N 8.79 4.82 0.00 2.89 3.05 0.00 0.00 5.76 6.67 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 0.00 114 L 8.18 5.28 0.00 1.70 1.58 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.83 5.00 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 0.00 116 V 8.92 4.62 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 0.95 0.00 0.00 0.93 0.00 0.00 117 L 8.72 5.08 0.00 1.45 1.34 0.09 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.72 5.23 0.00 1.68 1.78 0.00 3.37 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 1.52 1.66 0.00 119 T 8.61 5.57 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 1.18 0.00 0.00 120 P 0.00 4.42 0.00 2.11 2.02 0.00 3.62 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 2.13 2.13 0.00 121 P 0.00 4.42 0.00 2.04 2.01 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 122 G 8.91 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 0.00 123 A 7.94 4.37 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 0.00 124 A 7.75 3.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 H 8.23 4.06 0.00 3.23 3.42 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 Y 7.99 4.33 0.00 2.93 3.11 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 0.00 127 L 7.96 3.76 0.00 1.77 1.58 0.82 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 128 A 8.24 3.91 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 0.00 129 S 8.34 4.02 0.00 4.02 4.09 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 0.00 0.00 0.00 0.00 130 A 7.70 3.96 1.15 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 0.00 0.00 131 I 7.71 3.69 2.04 0.00 0.00 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 1.69 0.73 1.07 0.00 0.00 132 D 8.39 4.57 0.00 2.91 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 0.00 133 R 8.19 4.01 0.00 1.86 1.98 0.00 3.13 0.00 0.00 3.18 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 134 A 7.87 3.94 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 0.00 135 A 7.72 3.71 1.33 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 0.00 0.00 136 L 7.55 4.11 0.00 1.69 1.55 0.86 1.00 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 P 0.00 4.31 0.00 2.02 2.10 0.00 3.64 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.09 0.00 138 Q 8.02 4.22 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.85 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 139 V 7.35 4.69 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 0.80 0.00 0.00 0.97 0.00 0.00 140 V 9.10 3.75 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 0.78 0.00 0.00 0.93 0.00 0.00 141 G 7.25 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 0.00 0.00 0.00 142 T 8.39 5.36 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 1.28 0.00 0.00 143 I 8.60 4.65 1.86 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 1.16 1.05 0.90 0.00 0.00 144 A 8.65 5.00 0.91 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 0.00 145 G 8.87 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 0.00 146 D 8.93 4.65 0.00 2.69 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 0.00 147 D 7.81 5.12 0.00 2.96 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 0.00 148 T 7.81 5.15 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 1.24 0.00 0.00 149 I 8.79 4.92 1.75 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.68 0.89 0.00 0.00 150 L 8.68 4.82 0.00 1.63 1.58 0.91 0.52 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 0.00 151 V 8.63 4.71 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 1.10 0.00 0.00 0.86 0.00 0.00 152 V 8.74 4.54 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 0.97 0.00 0.00 0.94 0.00 0.00 153 A 8.98 4.69 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 0.00 154 R 8.98 4.20 0.00 1.86 1.85 0.00 3.33 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 155 E 8.93 4.33 0.00 2.00 1.88 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 2.32 2.31 0.00 156 P 0.00 4.74 0.00 2.16 2.12 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.96 0.00 157 T 7.71 3.90 4.35 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 1.25 0.00 0.00 158 T 8.20 4.64 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 0.00 159 G 8.83 3.72 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 0.00 0.00 0.00 160 A 7.97 4.02 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 0.00 161 Q 8.15 3.88 0.00 2.14 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 162 L 7.89 3.84 0.00 2.02 1.87 0.92 1.05 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 0.00 163 A 8.49 4.34 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 0.00 164 G 8.33 3.55 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 0.00 165 M 8.36 3.92 0.00 1.83 1.90 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.24 0.00 166 F 8.16 4.23 0.00 3.25 3.04 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 0.00 167 E 8.40 4.13 0.00 2.10 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 2.60 2.49 0.00 168 N 8.13 4.50 0.00 2.81 2.93 0.00 0.00 7.27 7.14 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 0.00 169 L 7.91 4.18 0.00 1.71 1.73 0.82 0.75 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 0.00 170 R 7.41 4.13 0.00 2.03 1.91 0.00 3.45 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 * Residues marked with a * may have inaccurate shift predictions.