NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 V 3.9683 8.0549 120.3738 62.6597 32.8210 174.4054 12 Q 4.2707 8.1284 124.8848 53.5831 32.6463 173.5239 13 F 5.3944 9.1880 121.1207 56.0209 42.2113 174.8805 14 L 4.6527 8.5986 121.6395 54.0947 43.2511 176.1359 15 R 5.2699 9.4584 121.4123 54.1735 34.4696 175.0184 16 T 4.0905 8.6350 111.8914 63.2571 69.8459 175.0093 17 D 4.8301 9.2912 122.5788 54.2587 39.6313 174.3090 18 D 4.7925 7.6187 119.9805 53.4378 42.7268 175.2215 19 E 4.9682 8.6268 121.7566 55.4833 31.4892 175.6931 20 V 4.7359 9.1190 117.0474 59.8790 37.1481 174.4908 21 V 4.9884 8.6403 113.8700 59.7608 35.4301 175.1697 22 L 5.0361 8.5548 123.5955 53.5242 43.3988 175.4618 23 Q 5.5434 9.1689 123.0781 54.4110 33.0012 174.4437 24 C 4.7570 8.7227 115.4360 57.0997 33.8016 172.3057 25 S 4.7268 8.2108 113.6025 57.0251 64.5316 174.1427 26 A 4.0143 8.6413 127.0907 51.8308 19.3542 177.5988 27 T 4.2219 7.2694 114.8184 64.6265 70.5805 171.4741 28 V 3.8109 9.1428 130.9580 61.9400 27.4209 171.9767 *33 L 4.2556 8.8369 113.6736 54.8533 43.6248 174.2266 34 K 4.7725 8.1769 122.1010 54.7987 37.2851 174.7814 35 L 5.0874 8.5416 121.1421 53.3920 44.3773 175.4336 36 C 5.3333 8.8104 121.2794 57.5190 30.7479 173.2381 37 L 4.5312 9.3530 126.6337 55.5636 42.4218 175.8401 38 A 4.9009 8.5306 125.9341 50.8345 23.0212 174.4539 39 A 4.5451 8.0844 117.2327 52.0522 22.7117 177.5880 40 E 4.0887 9.5757 121.2243 59.3649 30.1397 178.7197 41 G 3.8411 8.7398 104.5398 45.7908 0.0000 173.8902 42 F 4.6270 8.3698 114.3072 55.3360 39.5511 173.8042 43 G 3.7595 7.8163 112.4127 45.2092 0.0000 172.7470 44 N 4.9084 8.2557 119.3636 51.8562 40.6069 174.3728 45 R 4.5316 8.4359 123.7917 56.7006 32.1341 176.4355 46 L 4.6831 8.0941 119.3416 54.8589 42.2184 176.9234 47 C 4.8457 8.6395 121.3263 60.0750 29.5576 172.6141 48 F 5.0473 8.7448 115.2250 56.1624 41.4626 172.5741 49 L 5.1984 8.8493 117.6323 53.1456 44.1725 176.1370 50 E 4.8023 8.8503 123.3822 53.6693 32.1357 173.1908 51 P 5.1544 0.0000 0.0000 63.2658 32.6394 175.4816 52 T 4.0768 8.6239 111.3116 61.7822 72.7279 172.7178 *61 D 4.6770 8.9360 120.3920 54.1989 43.0335 177.1434 62 L 3.8948 8.2902 117.0765 57.8379 42.6513 179.3266 63 A 3.7911 8.0383 120.0572 54.6347 18.3347 177.9917 64 I 4.5222 7.6295 106.3408 60.4613 38.6878 176.7838 65 C 4.6525 7.6100 116.8637 60.1396 30.2981 173.2872 66 C 4.5144 8.1189 122.0274 59.0538 32.1654 172.4234 67 F 5.2069 9.5110 125.0972 55.9932 42.3834 174.1703 68 T 4.8303 9.2281 120.2222 62.2005 70.7161 174.6854 69 L 4.4403 8.6260 126.8741 54.1906 40.2122 177.4049 70 E 4.0098 8.9080 122.4013 58.8310 29.8413 176.7238 71 Q 4.6822 7.8218 118.6516 54.7083 33.4057 173.2195 72 S 5.0980 8.6793 117.5402 57.1012 64.8276 172.7869 73 L 4.9388 9.2835 127.3649 52.4306 46.0866 176.8425 74 S 4.3544 8.2518 115.1185 57.8328 64.1641 175.3741 75 V 3.4987 8.4213 121.3063 66.1577 31.0217 178.3740 76 R 3.9040 7.8727 117.5766 59.3771 29.9979 178.0817 77 A 3.8740 7.8740 120.4503 55.0124 18.3503 179.1412 78 L 3.3990 8.0191 119.1044 58.4501 42.0593 179.2926 79 Q 3.8625 8.4283 118.0220 58.9168 28.6397 178.7728 80 E 3.8948 8.3219 120.0019 59.5310 29.2763 179.0182 81 M 3.9678 8.0220 117.5749 58.5844 32.3279 178.0095 82 L 4.0400 7.5805 118.0204 57.6730 41.8692 178.9695 83 A 4.0832 7.8149 119.7398 54.2065 19.0550 178.4606 84 N 4.7923 7.8475 115.0602 52.5026 38.3879 175.3493 85 T 4.5686 7.2257 116.0193 61.8158 72.4925 173.3828 *97 G 4.0880 8.1475 112.8006 46.0131 0.0000 174.4650 98 H 5.1986 8.8635 117.8803 53.8961 27.3629 173.7752 99 R 4.2954 7.8591 118.7134 56.1372 31.7781 178.2630 100 T 4.6146 8.4132 119.9956 63.3575 69.4902 174.5838 101 L 4.3196 9.1493 125.9387 54.8697 43.2182 176.0813 102 L 5.2779 8.1317 120.5431 52.7698 45.9873 175.8688 103 Y 4.1962 8.8276 120.9576 59.6512 38.3769 177.2905 104 G 3.9863 9.3081 112.8196 43.4436 0.0000 173.7708 105 H 4.8197 8.1252 116.4086 55.6246 30.4739 174.1324 106 A 5.4290 9.5458 124.1521 50.5187 21.1512 176.2253 107 I 5.1191 9.4048 116.2848 59.0512 41.3988 174.2149 108 L 4.3079 8.5259 125.7379 53.1584 44.2589 174.8830 109 L 4.9163 8.4327 126.4391 53.2639 43.7384 175.1313 110 R 4.4067 8.7819 125.6824 54.6971 32.2186 174.7257 111 H 4.2138 9.3954 127.5296 55.7677 29.9516 175.1077 112 A 3.7036 8.0993 128.8104 55.7669 18.0173 178.2469 113 H 4.2615 8.0328 113.3615 59.3883 30.2389 176.6889 114 S 3.9811 7.8043 113.4753 59.2652 63.3114 175.2897 115 R 3.7688 8.3607 118.5225 56.5898 28.0004 175.7331 116 M 4.3886 7.5332 119.2140 54.4772 34.8419 174.1286 117 Y 5.1274 8.4609 116.3376 55.9796 41.3882 175.6395 118 L 4.6431 8.9221 126.5264 55.5555 43.1678 176.0151 119 S 5.1794 9.9705 121.1119 57.1460 67.4944 172.2508 120 C 4.8498 8.5668 121.4076 58.2394 31.7686 173.4797 121 L 4.4548 8.8524 127.6592 54.5559 42.1979 176.9246 122 T 3.7717 8.2465 109.0523 63.0412 69.9326 175.1463 123 T 4.1787 7.6894 111.9477 61.5892 69.6220 172.4945 124 S 4.6230 8.0803 109.9835 58.8229 65.0779 177.0515 125 R 4.5665 8.3648 123.7732 55.5980 32.6572 174.2021 *130 K 4.1441 7.6374 120.0365 56.5255 33.2864 175.8079 131 L 4.3790 8.3940 120.7549 54.7619 41.8648 175.7060 132 A 4.5953 7.3991 118.8674 50.1132 22.1461 176.3188 133 F 5.0458 8.5644 118.3778 55.8783 41.4747 175.6010 134 D 4.9443 8.6711 121.2729 54.5218 42.2457 175.5502 135 V 4.6507 8.2315 119.9758 61.3502 35.0320 175.6741 136 G 4.2628 8.3695 112.0812 46.3884 0.0000 171.7377 137 L 4.9764 8.4564 120.8094 53.4479 43.2702 175.8818 138 Q 4.5642 8.7695 122.8579 54.0869 31.4007 175.4130 139 E 3.9172 9.1887 125.5510 59.3512 29.7110 176.7397 140 D 4.7945 7.8368 115.9504 52.8549 43.3333 176.3035 141 A 4.0093 8.0753 128.6293 51.4381 17.7120 176.7285 142 T 4.5548 7.2781 111.1307 60.2404 72.3046 175.2618 143 G 3.8686 8.7071 109.6911 45.1762 0.0000 172.8555 144 E 4.2901 8.3702 115.5166 57.4142 30.2003 178.8038 145 A 4.3518 8.2717 121.4698 54.0539 18.5248 177.9379 146 C 5.2494 7.7935 108.5304 57.2160 30.5275 173.1261 147 W 5.0677 7.6046 119.2122 55.5039 32.6668 174.5905 148 W 5.5500 9.1297 122.4469 55.2037 33.0115 174.3092 149 T 5.0458 9.2282 114.8039 60.8448 70.9110 173.3519 150 M 5.0876 8.5992 123.9099 54.5187 34.1477 174.9036 151 H 5.4693 9.4394 120.0914 53.1890 33.2763 171.6404 152 P 4.4301 0.0000 0.0000 62.5666 31.8780 176.7658 153 A 4.2441 8.6245 125.1799 54.5321 19.2405 177.0856 154 S 4.6277 7.3998 108.2737 57.1916 65.7412 174.0338 155 K 4.3134 8.5681 118.1217 57.8504 32.0592 178.1261 156 Q 4.1017 7.6485 118.0344 57.8168 28.7814 176.2834 157 R 4.7481 7.0932 114.0131 54.3656 33.6466 174.3939 158 S 4.4994 8.2163 112.0832 56.4235 65.7313 173.2324 159 E 4.2418 8.7685 124.1636 58.5239 29.4406 177.9576 160 G 4.1014 8.9415 112.7806 45.3926 0.0000 173.5677 161 E 4.4678 8.4330 119.5730 55.2719 31.3509 176.2595 162 K 4.4898 8.4473 120.3585 56.5669 33.2692 177.1237 163 V 4.0922 8.3348 124.1945 61.9473 32.6732 175.5054 164 R 4.9730 8.9373 127.0895 55.1221 32.1605 176.2835 165 V 3.8154 8.5113 122.8468 64.4314 31.7227 176.6416 166 G 4.0556 8.2096 115.5183 44.9383 0.0000 173.2860 167 D 4.6329 7.6458 119.5960 54.4893 41.6727 175.6984 168 D 5.2348 8.7280 122.6246 53.4702 41.9731 175.6349 169 L 5.2845 9.2354 123.3538 54.2229 44.9302 175.0187 170 I 5.0741 9.2285 119.8992 59.6294 40.0439 175.0071 171 L 5.3129 8.8729 125.5905 53.2060 44.4121 175.2522 172 V 4.7945 8.8263 124.6685 60.8841 34.2501 174.5804 173 S 3.6901 9.1789 123.5711 57.8264 62.5559 174.6819 174 V 3.5436 7.9398 128.4334 66.1745 31.4098 177.6120 175 S 4.1927 8.0089 115.0119 60.1587 63.2638 175.4237 176 S 4.4650 7.5314 112.9054 57.0198 64.2589 174.5309 177 E 3.7540 8.5907 119.2266 57.0588 27.3710 173.9553 178 R 4.6844 7.5378 117.6396 54.8625 33.2829 174.9673 179 Y 5.2366 8.7772 118.7119 56.8471 40.0691 175.0013 180 L 4.6573 9.1388 126.0177 55.8312 42.6293 175.7004 181 H 5.2347 10.1966 126.8678 54.3603 33.9057 172.0043 182 L 4.8524 8.5431 127.3333 54.1548 42.4939 175.5851 183 S 4.6022 8.9405 122.9449 57.2977 64.0122 172.7535 184 T 4.5007 8.3963 121.5643 60.0659 68.4686 173.2372 *189 L 4.1463 8.2770 130.4152 55.0858 41.9227 174.7465 190 Q 4.8525 9.0924 124.5804 53.9137 33.7789 173.8965 191 V 5.0430 8.3705 119.1908 61.6132 34.0077 174.1896 192 D 4.8827 9.6860 125.9960 52.8010 43.7434 173.5176 193 A 5.8473 9.4777 120.7767 49.9229 20.7723 175.6145 194 S 4.8222 8.3904 115.4341 57.1128 66.8448 174.8247 195 F 4.8078 8.5705 116.8287 59.4681 38.9691 175.6349 196 M 4.4611 7.7759 121.0907 53.9753 33.0370 176.0190 197 Q 4.3857 8.1082 121.5860 55.4010 30.3739 175.3535 198 T 4.6201 8.0349 115.0728 62.1428 72.5507 173.6852 199 L 4.7709 8.1794 125.5244 54.0936 42.9058 176.0294 200 W 5.2554 9.2324 121.4641 55.0593 33.9124 173.9045 201 N 5.5529 9.4737 118.2670 51.8797 40.9038 173.7003 202 M 5.0812 8.6823 121.1458 53.9586 34.7350 174.2762 203 N 5.2438 8.6092 121.7609 50.4958 41.5329 173.0649 204 P 5.0814 0.0000 0.0000 61.7827 32.5221 176.5700 205 I 3.9405 8.1790 114.8002 61.2646 37.8163 175.7586 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 11 V 8.05 3.97 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 0.89 0.00 0.00 12 Q 8.13 4.27 0.00 2.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.70 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 13 F 9.19 5.39 0.00 2.97 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 14 L 8.60 4.65 0.00 1.64 1.58 0.98 0.96 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 15 R 9.46 5.27 0.00 1.76 1.84 0.00 3.22 0.00 0.00 3.44 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.63 0.00 16 T 8.63 4.09 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 1.21 0.00 0.00 17 D 9.29 4.83 0.00 2.48 2.85 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 18 D 7.62 4.79 0.00 2.64 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.63 4.97 0.00 1.96 1.85 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 2.31 2.36 0.00 20 V 9.12 4.74 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 0.71 0.00 0.00 0.95 0.00 0.00 21 V 8.64 4.99 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 0.90 0.00 0.00 1.03 0.00 0.00 22 L 8.55 5.04 0.00 1.37 1.44 0.20 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 9.17 5.54 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 24 C 8.72 4.76 0.00 2.21 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 25 S 8.21 4.73 0.00 3.63 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 26 A 8.64 4.01 1.19 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 0.00 0.00 0.00 27 T 7.27 4.22 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 1.19 0.00 0.00 28 V 9.14 3.81 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 0.75 0.00 0.00 0.92 0.00 0.00 *33 L 8.84 4.26 0.00 1.66 1.58 0.92 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.18 4.77 0.00 1.65 1.68 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.37 7.81 35 L 8.54 5.09 0.00 1.52 1.56 0.86 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 36 C 8.81 5.33 0.00 2.92 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 37 L 9.35 4.53 0.00 1.49 1.47 0.78 0.50 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 38 A 8.53 4.90 0.55 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 39 A 8.08 4.55 1.14 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 0.00 0.00 40 E 9.58 4.09 0.00 2.14 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 0.00 2.54 2.57 0.00 41 G 8.74 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 42 F 8.37 4.63 0.00 2.95 3.01 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 43 G 7.82 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 44 N 8.26 4.91 0.00 2.81 2.73 0.00 0.00 7.15 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 45 R 8.44 4.53 0.00 1.83 2.12 0.00 3.19 0.00 0.00 3.50 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 46 L 8.09 4.68 0.00 1.63 1.70 0.97 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 47 C 8.64 4.85 0.00 2.92 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 48 F 8.74 5.05 0.00 3.04 3.15 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 49 L 8.85 5.20 0.00 1.63 1.66 1.03 0.88 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 50 E 8.85 4.80 0.00 2.06 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 2.23 2.30 0.00 51 P 0.00 5.15 0.00 2.13 2.05 0.00 3.87 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 52 T 8.62 4.08 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 *61 D 8.94 4.68 0.00 2.80 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 62 L 8.29 3.89 0.00 1.69 1.64 0.89 0.80 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 63 A 8.04 3.79 1.12 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 0.00 0.00 64 I 7.63 4.52 1.87 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.22 1.11 0.00 0.00 65 C 7.61 4.65 0.00 2.97 3.01 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 66 C 8.12 4.51 0.00 2.90 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 F 9.51 5.21 0.00 2.90 2.78 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 68 T 9.23 4.83 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 1.20 0.00 0.00 69 L 8.63 4.44 0.00 1.61 1.62 0.97 0.55 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 70 E 8.91 4.01 0.00 2.07 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 2.53 2.61 0.00 71 Q 7.82 4.68 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.85 0.00 0.00 0.00 0.00 0.00 2.62 2.67 0.00 72 S 8.68 5.10 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 73 L 9.28 4.94 0.00 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2.49 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.20 1.21 7.81 163 V 8.33 4.09 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 0.69 0.00 0.00 0.15 0.00 0.00 164 R 8.94 4.97 0.00 2.46 1.89 0.00 3.70 0.00 0.00 3.53 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.86 0.00 165 V 8.51 3.82 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 0.74 0.00 0.00 0.94 0.00 0.00 166 G 8.21 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 0.00 0.00 0.00 167 D 7.65 4.63 0.00 2.88 2.85 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 0.00 168 D 8.73 5.23 0.00 2.61 2.66 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 0.00 169 L 9.24 5.28 0.00 1.98 2.02 1.03 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 170 I 9.23 5.07 2.17 0.00 0.00 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 1.51 1.19 1.33 0.00 0.00 171 L 8.87 5.31 0.00 1.46 1.55 0.42 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 172 V 8.83 4.79 2.17 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 0.78 0.00 0.00 0.84 0.00 0.00 173 S 9.18 3.69 0.00 3.09 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 0.00 174 V 7.94 3.54 2.16 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 0.71 0.00 0.00 0.94 0.00 0.00 175 S 8.01 4.19 0.00 3.89 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 0.00 176 S 7.53 4.46 0.00 4.09 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 0.00 177 E 8.59 3.75 0.00 2.13 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 2.18 2.24 0.00 178 R 7.54 4.68 0.00 1.86 1.99 0.00 3.17 0.00 0.00 2.85 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.83 0.00 179 Y 8.78 5.24 0.00 3.27 3.05 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 0.00 0.00 0.00 180 L 9.14 4.66 0.00 1.28 1.39 0.35 -1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 181 H 10.20 5.23 0.00 3.47 3.43 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 L 8.54 4.85 0.00 1.46 1.37 0.95 0.86 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 0.00 183 S 8.94 4.60 0.00 4.42 3.77 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 0.00 184 T 8.40 4.50 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 1.20 0.00 0.00 *189 L 8.28 4.15 0.00 1.67 1.69 0.91 0.75 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 0.00 190 Q 9.09 4.85 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.53 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 191 V 8.37 5.04 2.17 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 0.94 0.00 0.00 1.09 0.00 0.00 192 D 9.69 4.88 0.00 3.00 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 0.00 193 A 9.48 5.85 1.48 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 0.00 0.00 194 S 8.39 4.82 0.00 3.69 3.88 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 0.00 195 F 8.57 4.81 0.00 3.14 3.08 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 0.00 196 M 7.78 4.46 0.00 2.02 1.73 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.68 0.00 197 Q 8.11 4.39 0.00 1.83 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.67 0.00 0.00 0.00 0.00 0.00 1.16 1.67 0.00 198 T 8.03 4.62 4.66 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 0.54 0.00 0.00 199 L 8.18 4.77 0.00 1.46 1.61 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 200 W 9.23 5.26 0.00 3.20 3.03 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 0.00 201 N 9.47 5.55 0.00 2.63 2.71 0.00 0.00 7.18 7.42 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 0.00 202 M 8.68 5.08 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.47 0.00 203 N 8.61 5.24 0.00 2.67 2.70 0.00 0.00 6.64 7.95 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 0.00 204 P 0.00 5.08 0.00 1.94 1.99 0.00 3.73 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.94 0.00 205 I 8.18 3.94 1.86 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 1.27 0.52 0.91 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.