NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *5 S 4.4688 8.4345 117.0997 56.6124 64.8899 173.8681 6 D 4.8828 8.1766 117.0420 50.9296 43.9025 176.0233 7 L 4.8823 8.9263 123.7856 51.7875 46.6024 176.0522 8 I 3.8871 8.2181 122.9935 60.3889 37.6216 174.5169 9 P 4.2694 0.0000 0.0000 62.3057 31.7408 176.2450 10 A 3.6013 8.4146 126.1137 51.2158 19.0000 175.5092 11 P 4.3502 0.0000 0.0000 61.1248 32.6505 174.5225 12 P 4.1947 0.0000 0.0000 62.9365 31.8444 177.8182 13 L 3.8695 8.3610 121.7358 57.0482 41.9074 179.6071 14 S 4.0101 8.0076 115.3831 61.6612 63.0289 175.9274 15 K 4.0215 7.7243 119.7891 54.8659 31.4879 179.3810 16 V 4.1605 6.8683 118.4778 60.9779 31.9070 173.5028 17 P 4.4666 0.0000 0.0000 62.4168 32.1264 174.6411 18 L 4.8920 7.7792 119.9322 52.7238 44.9712 175.6254 19 Q 4.0291 8.2647 126.9088 56.1670 29.5691 175.5968 20 Q 3.8668 8.4355 129.1604 56.5398 29.3958 175.4630 21 N 4.0872 8.7638 125.7944 54.4200 36.6570 172.6228 22 F 4.4388 8.1126 119.9778 58.0076 40.1975 174.6855 23 Q 4.2223 8.3932 129.1056 54.3414 28.0593 176.2668 24 D 4.6289 8.4724 128.8214 56.5783 39.2821 178.7250 25 N 4.4939 8.2983 121.8338 57.5778 37.6472 179.6201 26 Q 4.5064 7.5297 119.4425 59.0214 28.5477 181.5637 27 F 4.9954 8.0343 120.1487 60.6397 39.9521 175.9350 28 Q 4.3307 8.0978 115.0640 57.1412 29.1922 176.5590 29 G 3.4747 7.9591 105.9169 44.4447 0.0000 171.5644 30 K 4.6820 7.8607 122.4758 54.6230 33.7249 177.1782 31 W 4.6183 8.5676 125.9539 54.9770 33.1220 173.8287 32 Y 4.8815 9.0300 122.2776 57.2458 40.1928 176.6720 33 V 4.2994 8.1225 122.9002 61.0340 29.7937 175.7269 34 V 3.9992 8.6899 119.7776 62.6921 32.5235 176.3730 35 G 3.6497 7.5922 106.5909 44.5053 0.0000 172.0567 36 L 5.0466 9.2490 124.2541 54.1420 45.3489 173.9364 37 A 5.3813 9.0461 128.5614 48.9208 22.8062 175.0468 38 G 3.7626 8.0255 107.7127 44.8291 0.0000 174.3432 39 N 3.9751 7.1534 118.0984 54.5932 37.2750 175.8361 40 A 4.6935 7.7794 119.8475 51.6683 19.8071 175.5662 41 I 4.4516 7.9980 122.0938 60.8584 39.2189 175.3902 42 L 4.9627 8.1450 127.6073 53.1808 44.8492 175.4897 43 R 3.9260 8.2284 122.6858 56.5151 29.5760 174.2911 *48 P 4.2643 0.0000 0.0000 61.4667 33.3385 177.0289 49 Q 4.0940 8.5347 121.2775 56.3629 28.8319 176.9135 50 K 4.5972 8.6388 124.5299 54.9857 33.1547 176.9950 51 M 4.6269 8.8506 124.5395 56.1211 33.2590 174.8800 52 Y 5.1617 8.5863 120.3126 55.5833 42.1155 173.3919 53 A 5.0987 8.7232 121.6846 50.6690 22.5347 175.7795 54 T 4.8303 8.5061 115.9160 61.8243 72.6079 173.0219 55 I 4.7249 8.9313 127.5908 59.7458 39.9703 174.2873 56 Y 4.4923 9.6919 128.8679 57.1569 39.6152 175.5139 57 E 4.8735 8.7192 124.3531 54.5325 31.4356 172.3571 58 L 4.5178 8.3524 128.9413 53.9224 42.3493 177.2182 59 K 4.1924 9.2079 129.5942 56.6873 32.7762 179.0159 60 E 3.9660 8.9063 119.4506 59.9655 29.6102 179.8951 61 D 4.4803 8.0540 117.5429 54.6104 39.7935 180.1201 62 K 4.0639 7.9426 118.9289 55.3648 30.5314 181.4896 63 S 4.7187 7.5658 113.4207 59.0688 64.4240 171.7026 64 Y 5.2507 8.7013 119.2744 56.2275 40.8669 175.1326 65 N 4.7949 9.4686 123.8099 52.4717 39.9060 173.6987 66 V 3.8503 8.5909 128.1376 61.4733 32.7334 173.9989 67 T 4.9964 8.3186 123.5059 60.2154 70.2013 172.7801 68 S 5.1336 8.8229 126.7465 57.4731 66.1281 174.2419 69 V 4.1197 8.8490 125.3525 60.5415 32.4220 171.5297 70 L 4.9605 8.7083 127.1093 52.1475 44.6984 176.0980 71 F 5.4065 8.9836 127.0975 57.2404 40.1755 174.9313 72 R 4.2351 8.6636 126.1360 55.4560 33.0201 174.7137 73 K 4.0005 9.0653 124.1625 55.9987 28.8416 174.2538 74 K 4.0569 7.6039 114.1184 55.2829 29.5903 177.3360 75 K 4.7793 7.4258 116.4461 55.9489 36.3312 174.9288 76 C 4.9431 8.8080 120.0253 56.8455 40.8742 172.7999 77 D 4.9198 9.1444 124.7459 52.9507 43.0727 175.4924 78 Y 5.0386 8.5438 121.0176 56.8949 41.1718 176.0612 *79 W 4.5365 8.9683 131.1701 56.1298 29.3750 171.9178 80 I 4.8459 8.1454 126.2136 58.6929 36.5283 172.7006 81 R 4.6793 8.6467 121.9509 55.0799 33.3089 173.5233 82 T 5.0530 8.5020 115.3196 61.8323 71.8700 173.2652 83 F 5.6249 9.1108 127.8559 57.0039 41.0514 175.7897 84 V 4.7554 9.2564 124.6150 59.0904 33.3138 170.2419 85 P 4.6082 0.0000 0.0000 62.8523 31.6347 176.8010 86 G 4.0562 8.2190 113.5997 45.5719 0.0000 172.9243 87 S 4.2261 9.1412 116.5216 61.9728 63.4843 175.1171 88 Q 4.3597 7.9361 120.8293 52.1234 29.0609 175.6684 89 P 4.5037 0.0000 0.0000 63.3773 32.0481 176.8386 90 G 3.0135 8.4953 110.1868 44.5940 0.0000 172.6269 91 E 4.7809 7.1318 119.0065 54.7358 32.1974 175.1849 92 F 5.5236 8.7084 120.5014 56.3795 44.0953 173.7916 93 T 4.9478 9.2472 112.6030 59.7693 71.9293 173.1696 94 L 4.5092 8.5670 125.2082 54.5021 42.6120 176.7206 95 G 3.7775 10.1823 118.2051 47.4602 0.0000 173.6006 96 N 4.4010 8.9919 119.7925 52.7197 35.2877 174.4101 97 I 4.0225 8.0069 121.2879 64.7803 38.4284 177.5525 98 K 4.2205 8.1095 118.0157 58.5253 32.0257 177.4644 99 S 4.3420 7.9785 112.5021 58.2651 63.3328 173.6621 100 Y 4.4759 7.6884 120.2389 55.5871 37.9079 173.2155 101 P 4.4198 0.0000 0.0000 64.3517 32.0198 177.2717 102 G 4.0759 9.0741 110.8137 45.4533 0.0000 172.9010 103 L 4.5124 7.7729 122.0884 55.4050 42.6440 175.3330 104 T 4.6723 9.0118 122.8340 64.7693 69.8740 174.9234 105 S 4.9081 7.8931 114.6565 56.8605 66.8975 171.6531 106 Y 5.0962 8.5392 121.6319 56.1305 42.0015 173.8211 107 L 4.9763 9.0295 127.6032 53.4798 45.9880 174.9496 108 V 4.5801 9.0065 125.7831 61.3860 34.9416 174.8726 109 R 4.4605 8.0790 126.2522 55.3211 33.2401 174.1934 110 V 3.4960 8.1822 128.6227 63.0952 31.6666 176.8113 111 V 3.8654 9.1129 129.5002 64.9575 31.6561 176.1400 112 S 4.6094 7.4864 112.8251 58.0771 65.9992 172.8515 113 T 4.5085 7.9034 114.8055 61.9547 69.9228 172.4383 114 N 5.0720 8.0828 116.6183 51.7591 38.3446 176.2473 115 Y 3.8142 8.3206 123.7841 60.5074 37.7295 171.3691 116 N 4.7183 9.2770 115.5253 53.1311 38.6907 177.5869 117 Q 4.5383 9.6033 118.0299 58.6680 31.3579 173.9554 *118 H 5.0277 9.1206 113.6459 53.8205 30.9994 172.0532 119 A 4.5742 7.6632 114.3985 52.3702 19.3628 176.0750 120 M 5.0252 8.9341 122.9907 53.7914 35.6208 174.0610 121 V 4.6378 8.1399 125.8331 60.9548 35.0978 173.7248 122 F 5.0484 9.2535 130.3923 56.8228 41.5441 174.3055 123 F 5.0113 8.4987 124.1222 55.5057 42.2621 173.6798 124 K 4.9963 8.7908 125.7977 54.2591 34.9776 174.9219 125 K 4.8851 8.8475 125.6691 55.2557 36.1730 175.0906 126 V 4.8281 8.9229 125.5368 61.6192 33.1038 174.7200 127 S 4.9984 8.7484 122.3448 57.3365 66.5085 174.3604 128 Q 3.6705 9.3952 121.5730 57.1790 26.4296 173.6651 129 N 4.1906 8.4799 110.9039 53.9040 36.5807 173.6201 130 R 4.2100 7.8345 119.3728 54.4477 31.2826 174.6252 131 E 4.5662 8.4030 126.9271 55.5368 29.8587 174.4566 132 Y 5.1214 8.7552 125.5541 56.6347 40.5670 175.0333 133 F 5.4796 8.9505 116.1581 55.9276 41.9558 173.0740 134 K 4.5232 8.7869 117.9049 55.9958 36.3761 174.4351 135 I 5.3533 9.2956 122.3717 59.8062 40.7370 174.5373 136 T 4.8039 8.5055 116.2466 59.8144 71.7276 173.2366 137 L 4.3138 7.6663 128.1340 53.8616 42.0005 174.3468 138 Y 5.1110 8.3949 123.8858 57.6292 38.7068 175.4837 139 G 4.4347 9.4794 111.1169 44.4022 0.0000 173.8681 140 R 4.0086 9.5787 125.4232 58.2338 30.6740 176.4155 141 T 4.9010 7.8818 107.7688 59.1898 71.4592 174.9786 142 K 3.6423 8.4290 123.2602 58.6890 32.1985 177.6311 143 E 4.7800 7.5413 116.2413 54.5883 32.8196 180.8072 144 L 4.8275 8.0358 120.1318 54.0908 45.3973 177.4814 145 T 4.3438 8.3222 110.3483 62.6310 68.1636 173.0542 146 S 4.4449 8.6020 121.4781 64.4795 62.2953 177.0584 147 E 4.2965 8.2150 122.0863 62.2355 29.6520 184.1187 148 L 4.3753 8.0511 125.8376 59.8183 41.0051 181.7194 149 K 4.6510 8.3095 126.4927 59.4340 31.2712 180.1677 150 E 5.0508 7.5106 113.1681 56.9703 31.6057 184.3276 151 N 3.9740 7.9393 116.7815 57.2539 38.1298 181.3509 152 F 4.6313 9.1004 122.0675 61.5012 39.6948 177.9085 153 I 3.5860 7.9201 121.6658 65.1932 36.7748 179.3591 154 R 3.9802 7.5531 119.6042 61.1631 29.4918 180.3362 155 F 4.5996 8.6780 120.7779 61.6415 39.4387 177.0935 156 S 3.9614 8.0326 117.1544 62.5440 62.6648 177.5837 157 K 4.2027 8.2200 129.6764 59.9894 31.0860 181.7967 158 S 4.3552 7.5444 117.4382 62.7596 62.0946 177.9345 159 L 4.4624 7.5989 120.3920 54.4704 41.5917 176.4852 160 G 3.6815 7.7603 104.9060 47.1051 0.0000 174.9688 161 L 4.5990 7.5922 119.5425 51.6173 43.7826 175.2472 162 P 4.4066 0.0000 0.0000 62.7206 31.8528 177.9332 163 E 4.0995 8.6845 114.7925 58.5281 30.3355 179.6277 164 N 4.3354 8.4346 115.7249 57.6943 39.1213 175.7583 165 H 5.0350 8.1509 112.1288 55.5647 29.2249 174.4830 166 I 4.4880 7.0503 120.9224 60.1707 38.3078 175.5550 167 V 4.5022 8.4445 125.0252 61.4228 35.5271 173.9273 168 F 5.1409 8.9292 125.3092 54.7121 40.1964 172.8817 169 P 4.5583 0.0000 0.0000 63.6668 32.1356 177.2370 170 V 4.0330 9.1913 124.1322 60.3843 32.4957 172.3133 171 P 4.7075 0.0000 0.0000 62.1406 31.9256 175.4540 172 I 4.6822 8.2204 116.4066 60.3103 40.8783 174.7663 173 D 4.9654 8.1227 116.3007 52.9481 41.4522 174.2535 174 Q 3.9704 7.6795 116.1068 56.9786 29.3508 176.5177 175 C 4.3438 8.8657 125.1393 58.4474 38.9932 175.2980 176 I 3.6408 7.6310 108.8587 62.1568 38.0844 175.4514 177 D 4.6151 7.7080 126.9922 54.5845 40.8680 175.9980 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 S 8.43 4.47 0.00 3.65 3.65 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 6 D 8.18 4.88 0.00 2.71 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.93 4.88 0.00 1.48 1.46 0.47 0.87 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 8 I 8.22 3.89 1.87 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.41 1.07 0.00 0.00 9 P 0.00 4.27 0.00 2.00 1.96 0.00 3.69 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 2.00 2.07 0.00 10 A 8.41 3.60 1.22 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 0.00 0.00 11 P 0.00 4.35 0.00 1.90 1.75 0.00 3.14 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.56 0.00 12 P 0.00 4.19 0.00 2.08 1.94 0.00 3.45 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 2.02 2.04 0.00 13 L 8.36 3.87 0.00 1.69 1.57 0.92 0.71 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 14 S 8.01 4.01 0.00 3.90 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 15 K 7.72 4.02 0.00 1.82 1.75 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.24 7.81 16 V 6.87 4.16 1.66 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 0.41 0.00 0.00 -0.21 0.00 0.00 17 P 0.00 4.47 0.00 2.19 2.14 0.00 3.94 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 1.97 1.97 0.00 18 L 7.78 4.89 0.00 1.49 1.44 0.73 0.58 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 19 Q 8.26 4.03 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.63 0.00 0.00 0.00 0.00 0.00 2.39 2.59 0.00 20 Q 8.44 3.87 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.40 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 21 N 8.76 4.09 0.00 2.89 2.86 0.00 0.00 7.18 7.02 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 22 F 8.11 4.44 0.00 2.99 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 23 Q 8.39 4.22 0.00 1.56 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.57 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 24 D 8.47 4.63 0.00 3.10 3.22 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 25 N 8.30 4.49 0.00 2.84 2.78 0.00 0.00 6.50 7.46 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 26 Q 7.53 4.51 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.97 0.00 0.00 0.00 0.00 0.00 2.27 2.22 0.00 27 F 8.03 5.00 0.00 3.15 3.44 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 28 Q 8.10 4.33 0.00 2.56 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.58 0.00 0.00 0.00 0.00 0.00 2.64 2.45 0.00 29 G 7.96 3.47 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 0.00 30 K 7.86 4.68 0.00 1.53 1.33 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.69 1.14 7.81 31 W 8.57 4.62 0.00 2.46 2.54 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 0.00 0.00 0.00 0.00 32 Y 9.03 4.88 0.00 3.09 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 33 V 8.12 4.30 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.37 0.00 0.00 34 V 8.69 4.00 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 0.89 0.00 0.00 0.93 0.00 0.00 35 G 7.59 3.65 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 0.00 36 L 9.25 5.05 0.00 1.81 1.55 0.92 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 37 A 9.05 5.38 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 38 G 8.03 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 0.00 0.00 0.00 39 N 7.15 3.98 0.00 2.73 2.71 0.00 0.00 6.73 7.02 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 40 A 7.78 4.69 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 41 I 8.00 4.45 2.13 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 1.07 1.26 0.89 0.00 0.00 42 L 8.15 4.96 0.00 1.37 1.37 0.92 0.81 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 43 R 8.23 3.93 0.00 1.63 1.78 0.00 3.27 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.49 0.00 *48 P 0.00 4.26 0.00 1.99 2.08 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.12 0.00 49 Q 8.53 4.09 0.00 1.74 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 7.09 0.00 0.00 0.00 0.00 0.00 2.37 1.98 0.00 50 K 8.64 4.60 0.00 1.69 1.88 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.47 7.81 51 M 8.85 4.63 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 52 Y 8.59 5.16 0.00 3.30 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 53 A 8.72 5.10 1.18 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 54 T 8.51 4.83 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 55 I 8.93 4.72 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.84 0.90 0.00 0.00 56 Y 9.69 4.49 0.00 2.66 2.54 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 0.00 0.00 0.00 0.00 57 E 8.72 4.87 0.00 1.69 1.85 0.00 0.00 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132 Y 8.76 5.12 0.00 3.11 2.74 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 0.00 133 F 8.95 5.48 0.00 2.74 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 0.00 134 K 8.79 4.52 0.00 1.91 1.74 0.00 1.20 0.00 0.00 1.53 0.00 0.00 2.42 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.27 1.52 7.81 135 I 9.30 5.35 2.22 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 1.28 0.69 1.39 0.00 0.00 136 T 8.51 4.80 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 1.25 0.00 0.00 137 L 7.67 4.31 0.00 0.43 0.92 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 138 Y 8.39 5.11 0.00 2.52 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 9.48 4.43 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 0.00 140 R 9.58 4.01 0.00 1.91 1.92 0.00 2.21 0.00 0.00 2.75 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.17 0.00 141 T 7.88 4.90 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 1.25 0.00 0.00 142 K 8.43 3.64 0.00 1.55 1.66 0.00 1.44 0.00 0.00 1.35 0.00 0.00 2.59 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 0.90 7.81 143 E 7.54 4.78 0.00 2.04 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 144 L 8.04 4.83 0.00 1.59 1.43 0.92 0.81 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 0.00 145 T 8.32 4.34 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 0.00 146 S 8.60 4.44 0.00 3.73 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 0.00 147 E 8.22 4.30 0.00 1.97 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 2.31 1.94 0.00 148 L 8.05 4.38 0.00 1.64 1.70 0.92 0.94 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 0.00 149 K 8.31 4.65 0.00 1.76 1.86 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.38 1.33 7.81 150 E 7.51 5.05 0.00 2.00 1.89 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 2.12 2.08 0.00 151 N 7.94 3.97 0.00 2.76 2.70 0.00 0.00 6.58 7.58 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 0.00 152 F 9.10 4.63 0.00 3.13 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.92 3.59 1.98 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 1.38 0.42 0.96 0.00 0.00 154 R 7.55 3.98 0.00 1.91 1.85 0.00 3.27 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 155 F 8.68 4.60 0.00 3.15 3.26 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 0.00 156 S 8.03 3.96 0.00 3.80 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 0.00 157 K 8.22 4.20 0.00 1.76 1.84 0.00 1.80 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.20 7.81 158 S 7.54 4.36 0.00 3.73 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 L 7.60 4.46 0.00 1.84 1.45 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 160 G 7.76 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 0.00 0.00 0.00 161 L 7.59 4.60 0.00 1.69 1.54 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 162 P 0.00 4.41 0.00 2.25 2.19 0.00 3.66 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.99 0.00 163 E 8.68 4.10 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 2.32 1.87 0.00 164 N 8.43 4.34 0.00 2.80 2.88 0.00 0.00 7.22 7.89 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 0.00 165 H 8.15 5.03 0.00 3.20 3.45 0.00 5.67 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 0.00 166 I 7.05 4.49 1.86 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 1.11 0.53 0.68 0.00 0.00 167 V 8.44 4.50 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 1.02 0.00 0.00 0.98 0.00 0.00 168 F 8.93 5.14 0.00 2.96 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 0.00 169 P 0.00 4.56 0.00 2.19 2.17 0.00 3.86 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 2.28 2.25 0.00 170 V 9.19 4.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.93 0.00 0.00 171 P 0.00 4.71 0.00 2.01 2.02 0.00 3.70 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 172 I 8.22 4.68 1.90 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.79 1.04 0.00 0.00 173 D 8.12 4.97 0.00 2.73 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 0.00 174 Q 7.68 3.97 0.00 1.01 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.10 0.00 0.00 0.00 0.00 0.00 1.72 2.11 0.00 175 C 8.87 4.34 0.00 3.12 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 0.00 176 I 7.63 3.64 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.54 0.91 0.00 0.00 177 D 7.71 4.62 0.00 2.55 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.