NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.1190 8.2127 108.0377 45.5813 0.0000 176.1007 2 L 2.4855 7.7773 132.2044 53.9753 41.2720 173.2440 3 D 4.6550 8.7821 127.8450 56.4600 42.0880 175.8947 4 N 5.0683 7.5954 113.3768 52.2250 41.0096 172.1396 5 E 5.2606 8.3910 114.7083 55.9415 32.0593 174.3632 6 L 4.7887 8.7506 121.6726 53.9942 46.1465 174.5087 7 S 5.4187 8.6749 119.0699 56.7553 66.4571 173.1317 8 L 4.7423 9.2182 125.3296 53.1759 45.2213 175.4462 9 V 4.4057 8.5199 126.6570 62.2494 32.1207 175.4195 10 D 4.7576 9.3860 129.5023 52.1068 40.9028 177.1738 11 G 3.8533 8.6846 107.2908 47.1410 0.0000 174.2049 12 Q 4.5839 8.1034 117.5028 55.7240 29.1202 174.9253 13 D 4.3996 7.9144 114.9894 56.6314 39.0663 173.9783 14 R 4.6985 8.5233 117.6767 54.8810 32.5308 176.7603 15 T 4.7209 8.6865 121.5034 62.8302 69.0663 173.4224 16 L 4.8173 9.2362 127.8188 53.7774 43.8007 176.2673 17 T 5.3891 8.8646 119.6144 61.7785 72.7930 173.3743 18 V 5.0501 9.0319 123.4478 60.2945 35.1812 174.1492 19 Q 5.3063 10.4206 122.4055 54.1986 32.6896 174.1149 20 Q 5.1300 9.2712 124.0696 54.2821 31.5847 174.1965 21 W 5.2867 9.4667 126.4525 55.5567 33.3427 175.5142 22 D 4.7181 9.4386 123.3118 55.7622 38.4169 173.7677 23 T 4.5604 8.2391 115.3046 63.6300 69.4916 174.6343 24 F 4.7870 8.8499 127.4122 56.6619 42.8429 173.4682 25 L 4.1009 6.1935 126.5022 52.9355 41.6337 174.9591 26 N 3.9048 8.5257 123.7105 52.2349 39.3756 173.8082 27 G 4.2336 8.4038 114.0978 46.0201 0.0000 171.6926 28 V 4.6186 8.2858 116.4112 59.1042 36.4156 175.2451 29 F 4.4030 8.4067 120.6767 57.1378 39.4383 174.1260 30 P 4.7514 0.0000 0.0000 61.7186 31.9002 177.1088 31 L 4.2014 8.4729 122.1518 56.5982 42.3602 176.9797 32 D 4.6516 8.0372 115.8144 52.6977 39.8159 176.3292 33 R 3.7838 7.5474 116.8773 57.1239 28.5815 175.0547 34 N 4.6880 7.9919 117.2867 52.3269 39.3024 176.2034 35 R 3.9532 8.7721 125.3081 59.0918 30.5102 177.4402 36 L 4.3188 8.3325 116.4272 55.6248 42.1348 175.8383 37 T 5.0437 7.8045 116.5346 61.9415 70.1103 174.4597 38 R 4.6820 9.1920 125.5946 54.9782 32.5091 175.0586 39 E 4.5061 8.6243 122.2432 54.0555 33.0211 174.3685 40 W 4.9601 7.1390 123.1823 54.7734 32.1804 173.9469 41 F 5.1631 9.0981 117.9527 55.8583 42.2062 174.1519 42 H 4.9703 8.8330 122.1224 55.5175 31.2711 174.2464 43 S 5.0895 10.2154 121.0305 56.5655 67.6977 174.3069 44 G 4.8177 7.1735 108.2508 44.5464 0.0000 171.8855 45 R 5.0904 9.3915 119.2535 54.6237 34.6721 174.6960 46 A 5.2278 8.9166 125.5729 50.9904 20.3663 176.1906 47 K 5.0642 9.3191 120.5212 54.7094 36.2472 174.9884 48 Y 4.9972 8.6005 120.0867 55.6567 41.3345 174.6104 49 I 4.5731 8.3594 119.3601 59.9850 42.4274 174.9839 50 V 4.7206 8.4433 123.9864 60.0025 33.5867 174.3606 51 A 4.5287 8.7862 127.4419 50.8028 22.0353 174.8483 52 G 3.7494 9.0845 104.4753 42.4930 0.0000 170.4547 53 P 4.0171 0.0000 0.0000 66.0900 30.4944 175.8129 54 G 4.4281 9.1532 111.4074 44.8124 0.0000 173.4974 55 A 4.0038 8.1363 124.5264 55.4877 18.2449 180.0705 56 D 4.8507 8.1114 111.4090 54.9779 40.8366 176.3130 57 E 4.7918 8.5001 115.8630 55.5504 31.9886 175.0945 58 F 4.5900 8.3773 124.4301 58.9550 40.6332 173.5787 59 E 4.8189 7.9536 124.7277 54.8018 32.4785 175.2357 60 G 4.0300 7.7218 110.3049 46.2288 0.0000 171.8122 61 T 5.1547 9.0237 116.6918 61.6344 73.3658 172.8686 62 L 5.1971 9.0240 126.8968 53.4784 44.5760 175.1148 63 E 5.1132 8.9489 124.5312 54.7853 34.3357 174.5751 64 L 4.3539 7.4033 121.3048 53.4459 45.6366 172.5974 65 G 3.9030 7.2897 116.4128 45.8900 0.0000 173.0045 66 Y 4.7728 7.2375 122.5283 56.7139 40.8930 172.3245 67 Q 5.1469 9.3332 119.4706 54.5224 31.8899 174.8411 68 I 4.5564 8.9142 124.2438 59.6801 39.7184 174.8904 69 G 3.3860 9.0010 115.5650 45.8748 0.0000 173.5311 *122 G 4.1271 8.9389 117.3861 44.3215 0.0000 170.9146 123 P 4.3500 0.0000 0.0000 63.3960 32.1447 177.6547 124 G 3.9214 6.3975 105.5037 44.5413 0.0000 171.7102 125 I 5.1026 7.7619 121.2839 59.0413 38.7691 175.6815 126 Q 4.6464 8.5686 125.4110 53.9520 32.8763 173.8026 127 E 4.8880 8.8292 124.0360 54.9484 31.3659 175.0047 128 V 4.1684 8.7711 127.1515 61.0031 33.7073 174.4720 129 A 4.5744 8.5435 130.9217 51.4180 17.9211 176.9040 130 T 4.1635 8.6178 119.3457 67.0543 69.3183 174.7205 131 F 5.0783 7.5332 114.5091 55.3383 42.0922 173.6224 132 S 4.9240 8.7871 114.2779 57.7072 65.0633 173.8861 133 V 4.4782 8.7688 120.2926 60.0055 36.4234 173.2968 134 D 4.8591 8.9998 125.8081 55.3417 41.1405 176.4021 135 V 4.7015 8.7387 117.0275 59.8184 35.2639 174.8488 136 S 4.9690 8.7104 114.9700 58.5604 64.4440 174.7696 137 G 4.0748 9.1165 106.8277 45.1293 0.0000 174.5367 138 A 4.2676 8.4378 121.0590 54.4273 18.5795 177.1754 139 E 4.0556 7.9012 113.3912 54.2190 34.0607 174.3492 140 G 4.3370 7.4039 106.8504 43.7958 0.0000 172.1153 141 G 4.3771 7.7370 105.3935 44.9818 0.0000 173.0330 142 V 4.4022 7.9771 122.7598 59.6409 33.9696 174.4010 143 A 5.3216 8.4468 124.4900 50.1172 22.0819 175.7417 144 V 4.5082 9.1635 119.7472 59.8775 34.7598 174.3473 145 S 4.8969 8.6546 118.3235 56.7312 64.4894 173.4133 146 N 4.1773 8.2000 122.2482 54.3027 36.1422 174.1225 147 A 4.3597 8.3585 120.6910 52.6206 20.4465 177.3321 148 H 4.8593 8.8869 119.3958 54.4405 31.7050 174.1057 149 G 3.5177 7.2671 111.2894 44.6994 0.0000 171.0645 150 T 3.6946 7.2719 112.5717 61.0900 70.2405 172.5663 151 V 4.5623 8.2576 124.4235 61.1270 35.1256 172.1894 152 T 4.8640 8.2254 116.2161 60.9012 71.0122 173.5949 153 G 3.8353 8.9187 108.4458 45.8835 0.0000 174.7893 154 A 4.0955 8.2761 124.0243 51.4678 16.2814 176.6690 155 A 4.0736 8.2106 122.7421 51.5326 17.8942 175.1554 156 G 3.5880 9.0852 115.8666 46.4331 0.0000 172.2549 157 G 3.9056 8.5848 117.1426 44.5695 0.0000 171.4872 158 V 4.3545 7.7806 116.4155 61.6780 34.9725 173.2769 159 L 4.9599 8.5326 127.7018 53.5845 44.1080 175.7620 160 L 4.8996 8.7663 121.6831 53.0585 45.2052 175.6604 161 R 4.8482 8.5935 125.7527 54.2074 31.3647 173.3019 162 P 5.1660 0.0000 0.0000 61.4761 33.2551 175.0043 163 F 5.2954 8.0715 117.2293 54.8823 41.4202 173.3453 164 A 5.1599 9.0782 123.1134 50.2658 21.8563 175.4224 165 R 4.9901 9.0866 121.6535 54.3305 33.8647 173.7247 166 L 5.1515 9.0594 128.2811 53.5169 44.6572 174.7926 167 I 5.0592 8.5761 127.1906 59.4899 40.2718 174.7019 168 A 4.9195 9.6760 129.2938 49.8350 21.2149 178.0615 169 S 4.1192 8.4631 115.8176 60.5951 62.9846 175.2908 170 T 4.2815 7.7510 110.2753 61.4273 68.8189 174.7576 171 G 4.0624 8.4900 112.3978 45.7382 0.0000 174.3471 172 D 4.8154 7.7800 118.9782 54.4846 42.1100 175.6644 173 S 4.9648 8.3813 114.8818 57.2579 66.3230 173.5184 174 V 4.6218 9.1728 120.2805 60.4089 34.9170 173.8860 175 T 4.8744 8.4998 117.0415 60.5677 70.3369 172.4272 176 T 4.5512 8.9820 123.9885 60.9761 68.9695 172.7009 177 Y 5.1392 8.8753 126.3307 56.4657 40.4911 175.5105 178 G 4.2502 8.8131 110.6336 44.4143 0.0000 172.6615 179 E 4.3908 8.6941 119.7457 54.8450 30.1106 175.2867 180 P 5.3525 0.0000 0.0000 63.0023 31.7644 175.3743 181 W 4.7555 8.9769 120.7738 55.0890 32.3255 174.5293 182 N 4.9705 8.6363 122.1092 52.2699 39.5660 174.7491 183 M 4.3505 8.8767 127.8765 54.6124 31.2316 176.7215 184 N 3.8730 8.3767 120.5938 53.9161 39.6703 174.2227 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 1 G 8.21 4.12 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 0.00 2 L 7.78 2.49 0.00 0.27 0.95 0.45 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 3 D 8.78 4.66 0.00 2.63 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 4 N 7.60 5.07 0.00 2.82 2.90 0.00 0.00 5.71 7.66 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 5 E 8.39 5.26 0.00 2.09 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 0.00 2.14 2.28 0.00 6 L 8.75 4.79 0.00 1.76 1.52 1.04 0.80 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 7 S 8.67 5.42 0.00 3.76 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 9.22 4.74 0.00 1.71 1.49 0.95 0.94 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 9 V 8.52 4.41 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 0.87 0.00 0.00 0.95 0.00 0.00 10 D 9.39 4.76 0.00 3.07 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 11 G 8.68 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 12 Q 8.10 4.58 0.00 2.17 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.85 0.00 0.00 0.00 0.00 0.00 2.26 2.40 0.00 13 D 7.91 4.40 0.00 2.88 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 14 R 8.52 4.70 0.00 2.11 1.88 0.00 3.28 0.00 0.00 3.45 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 15 T 8.69 4.72 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 1.22 0.00 0.00 16 L 9.24 4.82 0.00 1.68 1.59 1.14 0.53 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 17 T 8.86 5.39 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 1.31 0.00 0.00 18 V 9.03 5.05 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 0.89 0.00 0.00 1.10 0.00 0.00 19 Q 10.42 5.31 0.00 2.42 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 20 Q 9.27 5.13 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 21 W 9.47 5.29 0.00 3.43 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 22 D 9.44 4.72 0.00 3.03 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 23 T 8.24 4.56 4.45 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 0.00 0.00 0.00 1.02 0.00 0.00 24 F 8.85 4.79 0.00 3.01 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 25 L 6.19 4.10 0.00 0.29 0.96 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.53 3.90 0.00 2.11 2.79 0.00 0.00 6.95 7.74 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 27 G 8.40 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 0.00 0.00 0.00 0.00 28 V 8.29 4.62 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 0.95 0.00 0.00 0.99 0.00 0.00 29 F 8.41 4.40 0.00 3.12 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 30 P 0.00 4.75 0.00 2.32 1.97 0.00 4.03 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.07 0.00 31 L 8.47 4.20 0.00 1.60 1.67 0.95 1.18 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 32 D 8.04 4.65 0.00 2.81 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 33 R 7.55 3.78 0.00 1.91 2.03 0.00 3.29 0.00 0.00 3.12 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 34 N 7.99 4.69 0.00 2.70 2.78 0.00 0.00 7.21 9.00 0.00 0.00 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 R 8.77 3.95 0.00 1.86 2.04 0.00 3.28 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.70 0.00 36 L 8.33 4.32 0.00 1.94 1.71 0.94 0.65 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 T 7.80 5.04 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 1.22 0.00 0.00 38 R 9.19 4.68 0.00 1.99 2.12 0.00 3.28 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 39 E 8.62 4.51 0.00 1.86 1.54 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 1.90 1.99 0.00 40 W 7.14 4.96 0.00 3.18 3.07 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 41 F 9.10 5.16 0.00 2.86 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 42 H 8.83 4.97 0.00 3.27 3.30 0.00 5.54 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 10.22 5.09 0.00 3.92 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 44 G 7.17 4.82 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 0.00 0.00 0.00 45 R 9.39 5.09 0.00 1.72 1.84 0.00 3.38 0.00 0.00 3.23 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.90 0.00 46 A 8.92 5.23 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 47 K 9.32 5.06 0.00 1.72 1.66 0.00 0.63 0.00 0.00 1.22 0.00 0.00 2.42 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.18 1.20 7.81 48 Y 8.60 5.00 0.00 3.03 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 49 I 8.36 4.57 1.80 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.40 0.81 0.00 0.00 50 V 8.44 4.72 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 0.38 0.00 0.00 0.88 0.00 0.00 51 A 8.79 4.53 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 52 G 9.08 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 53 P 0.00 4.02 0.00 2.21 2.18 0.00 3.92 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 2.17 2.02 0.00 54 G 9.15 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 55 A 8.14 4.00 1.46 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 0.00 0.00 0.00 56 D 8.11 4.85 0.00 2.69 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 8.50 4.79 0.00 1.98 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 2.48 2.40 0.00 58 F 8.38 4.59 0.00 3.20 3.09 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 59 E 7.95 4.82 0.00 1.65 1.63 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 2.34 2.13 0.00 60 G 7.72 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 61 T 9.02 5.15 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 1.33 0.00 0.00 62 L 9.02 5.20 0.00 1.52 1.54 1.07 1.05 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 63 E 8.95 5.11 0.00 1.97 1.80 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 2.23 2.24 0.00 64 L 7.40 4.35 0.00 1.24 0.25 0.88 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 65 G 7.29 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 66 Y 7.24 4.77 0.00 2.98 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 67 Q 9.33 5.15 0.00 2.13 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 68 I 8.91 4.56 1.97 0.00 0.00 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 1.45 1.54 1.00 0.00 0.00 69 G 9.00 3.39 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 0.00 *122 G 8.94 4.13 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 0.00 0.00 0.00 123 P 0.00 4.35 0.00 2.21 2.21 0.00 3.84 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 2.03 2.02 0.00 124 G 6.40 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 0.00 125 I 7.76 5.10 1.87 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 1.36 1.76 0.92 0.00 0.00 126 Q 8.57 4.65 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 127 E 8.83 4.89 0.00 1.97 1.83 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 2.39 2.44 0.00 128 V 8.77 4.17 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 0.65 0.00 0.00 0.89 0.00 0.00 129 A 8.54 4.57 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 0.00 130 T 8.62 4.16 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 1.35 0.00 0.00 131 F 7.53 5.08 0.00 2.96 3.13 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 0.00 132 S 8.79 4.92 0.00 3.89 3.80 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 0.00 133 V 8.77 4.48 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 0.62 0.00 0.00 1.09 0.00 0.00 134 D 9.00 4.86 0.00 2.56 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 0.00 135 V 8.74 4.70 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 0.73 0.00 0.00 0.69 0.00 0.00 136 S 8.71 4.97 0.00 3.95 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 0.00 137 G 9.12 4.07 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 0.00 138 A 8.44 4.27 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 0.00 139 E 7.90 4.06 0.00 1.85 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 140 G 7.40 4.34 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 0.00 141 G 7.74 4.38 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 0.00 142 V 7.98 4.40 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 0.53 0.00 0.00 -0.31 0.00 0.00 143 A 8.45 5.32 1.21 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 0.00 0.00 0.00 144 V 9.16 4.51 2.31 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 0.80 0.00 0.00 1.03 0.00 0.00 145 S 8.65 4.90 0.00 3.88 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 0.00 146 N 8.20 4.18 0.00 2.94 2.83 0.00 0.00 6.99 7.23 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 0.00 147 A 8.36 4.36 1.46 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 0.00 0.00 0.00 148 H 8.89 4.86 0.00 3.18 3.19 0.00 5.87 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 0.00 149 G 7.27 3.52 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 0.00 0.00 0.00 150 T 7.27 3.69 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 1.00 0.00 0.00 151 V 8.26 4.56 2.29 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 0.92 0.00 0.00 1.02 0.00 0.00 152 T 8.23 4.86 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 1.22 0.00 0.00 153 G 8.92 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 0.00 154 A 8.28 4.10 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 0.00 155 A 8.21 4.07 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 0.00 156 G 9.09 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 0.00 0.00 0.00 157 G 8.58 3.91 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 0.00 158 V 7.78 4.35 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 0.87 0.00 0.00 0.97 0.00 0.00 159 L 8.53 4.96 0.00 1.68 1.53 0.94 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 160 L 8.77 4.90 0.00 1.44 1.20 0.33 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 161 R 8.59 4.85 0.00 1.98 1.98 0.00 3.11 0.00 0.00 3.12 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 162 P 0.00 5.17 0.00 2.33 1.97 0.00 4.01 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.72 0.00 163 F 8.07 5.30 0.00 2.41 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 0.00 164 A 9.08 5.16 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 0.00 165 R 9.09 4.99 0.00 1.89 1.77 0.00 2.94 0.00 0.00 2.88 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.76 0.00 166 L 9.06 5.15 0.00 1.83 1.55 0.91 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 167 I 8.58 5.06 1.88 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 1.16 0.59 0.97 0.00 0.00 168 A 9.68 4.92 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 0.00 169 S 8.46 4.12 0.00 3.87 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 0.00 170 T 7.75 4.28 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 1.18 0.00 0.00 171 G 8.49 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 0.00 172 D 7.78 4.82 0.00 2.77 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 0.00 173 S 8.38 4.96 0.00 3.83 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 0.00 174 V 9.17 4.62 2.12 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 0.82 0.00 0.00 0.97 0.00 0.00 175 T 8.50 4.87 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 1.27 0.00 0.00 176 T 8.98 4.55 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 1.31 0.00 0.00 177 Y 8.88 5.14 0.00 2.90 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 0.00 178 G 8.81 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 0.00 0.00 0.00 0.00 179 E 8.69 4.39 0.00 1.95 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 2.32 2.21 0.00 180 P 0.00 5.35 0.00 2.09 2.12 0.00 3.36 0.00 0.00 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.89 0.00 181 W 8.98 4.76 0.00 3.03 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 0.00 182 N 8.64 4.97 0.00 2.68 2.73 0.00 0.00 7.08 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 0.00 183 M 8.88 4.35 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 184 N 8.38 3.87 0.00 2.78 2.77 0.00 0.00 7.11 7.56 0.00 0.00 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.