NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8223 8.1676 115.8744 57.1419 40.2713 176.9624 11 H 4.0089 5.2900 117.7065 54.1627 28.9116 170.5210 12 E 4.2505 9.4418 122.9510 57.4983 30.0892 176.9123 13 M 4.5756 7.1575 114.2932 55.0036 32.3763 176.4042 14 R 4.5571 7.6302 116.9061 55.5884 32.3600 175.5291 15 E 4.0592 8.0446 117.3057 55.0468 30.1703 174.5384 16 P 4.1279 0.0000 0.0000 62.2331 32.4611 175.0011 17 R 4.1259 7.3498 112.3780 55.5988 32.9230 173.7989 18 I 4.2949 8.5492 122.0599 60.8267 38.1251 174.9713 19 E 4.4806 8.7923 129.2025 54.4610 31.2675 172.0212 20 K 4.6191 8.7286 132.4957 55.4324 34.1310 174.6870 21 V 4.5542 7.8246 119.5350 61.4005 34.8234 173.9092 22 V 4.5445 8.4618 128.7807 61.6426 33.1408 174.8873 23 V 5.0414 8.3486 122.6714 59.3270 33.3555 174.6256 24 H 5.1569 8.5588 124.7724 54.6201 33.7466 172.0399 25 M 4.4475 8.4828 124.6645 53.3242 33.0984 175.0950 26 G 4.0912 7.9875 111.8293 46.3459 0.0000 171.3230 27 I 4.1839 7.6567 127.2572 60.2289 39.7132 175.9543 28 G 4.0853 8.1301 111.1802 45.2668 0.0000 172.8409 29 H 4.9567 7.9903 120.5629 55.6478 29.8321 173.9516 *35 A 4.2073 6.9783 123.3129 52.1318 19.2456 176.6639 36 N 4.4761 8.8574 111.7461 56.4780 36.5892 176.5885 37 A 3.9715 7.9797 122.4132 54.5637 18.3470 178.9036 38 E 3.9221 8.7020 118.1388 60.1578 29.4606 179.1333 39 D 4.4451 7.5044 118.7570 57.6565 40.8595 179.6887 40 I 3.7558 7.7509 112.7843 63.9998 37.6121 178.0027 41 L 4.1014 7.7335 120.8934 57.4953 41.4409 179.6164 42 G 3.6405 8.4639 106.1003 47.7631 0.0000 175.5749 43 E 4.0818 7.7765 120.0209 59.0235 29.7823 178.7590 44 I 3.9093 8.1615 118.2604 63.3535 38.0205 176.5869 45 T 4.5823 8.0509 108.3867 63.9438 70.0893 174.6633 46 G 3.8109 7.0727 109.0716 44.1611 0.0000 173.3028 47 Q 4.5763 7.7438 115.7148 54.2499 31.5957 174.1935 48 M 3.8196 8.5493 118.6188 55.7153 32.4662 174.7636 49 P 4.8340 0.0000 0.0000 61.8468 33.3721 175.2351 50 V 4.4645 8.2741 120.4568 60.8233 34.3310 175.3790 51 R 4.3872 8.7335 125.7395 57.2423 31.2336 176.7918 52 T 4.5080 8.7006 117.4676 61.3750 70.2159 174.0103 53 K 5.3669 8.7716 124.6646 55.7862 33.2704 175.6065 54 A 4.8830 8.7341 122.6191 50.2494 22.1071 175.7991 55 K 4.4847 8.4561 117.6667 55.5437 34.9168 175.1841 56 R 4.1484 8.3969 122.1702 56.2409 29.6099 175.9287 57 T 4.5830 8.2520 116.9387 62.3782 70.0340 174.5982 58 V 4.5552 8.9471 125.2904 60.6097 35.0587 175.9478 59 G 3.8222 8.9053 112.7576 48.7225 0.0000 175.0069 60 E 4.2560 8.1078 118.7458 58.3324 28.2153 176.1224 61 F 4.1645 7.7560 112.9710 60.3689 38.8558 174.9625 62 D 4.9345 7.9202 117.9203 51.8502 40.2569 175.5431 63 I 4.2026 7.6475 114.4171 61.1009 39.4839 177.3129 64 R 3.8484 7.9149 121.6309 56.1693 29.4169 174.8453 65 E 3.9176 8.1997 128.8728 58.5358 30.3050 176.1466 66 G 3.9037 7.8587 110.8276 46.4932 0.0000 171.9066 67 D 4.5845 8.2788 122.1784 51.5090 42.4715 173.4550 68 P 4.6199 0.0000 0.0000 62.5244 31.4217 176.6603 69 I 4.6448 8.9993 126.0725 59.1526 39.6573 174.8887 70 G 4.4995 7.5390 107.7052 43.4069 0.0000 172.2259 71 A 5.9121 8.0578 121.4339 49.4521 23.4226 174.8575 72 K 5.0004 8.2748 116.7523 55.9518 37.0137 175.4778 73 V 4.6175 8.4355 120.1709 61.8923 34.9750 173.0690 74 T 4.7202 8.5331 118.9250 60.3666 69.9918 173.8172 75 L 4.7468 8.4970 126.9527 52.9208 44.1444 175.9856 76 R 4.7539 7.9919 120.6146 54.6777 33.9948 176.1874 77 D 4.4545 8.9386 120.6229 55.6322 38.8663 176.5837 78 E 3.9916 8.9161 123.8828 60.9414 27.7094 178.3965 79 M 4.1295 8.2311 117.8535 58.3089 31.8461 178.4872 80 A 4.3323 7.9637 120.8027 54.9577 18.8958 179.2734 81 E 3.9562 8.1395 116.6486 59.5441 29.5566 179.0574 82 E 4.1095 8.4642 118.7811 59.0553 29.9136 179.1345 83 F 4.4010 7.5689 119.7935 60.8090 39.9240 177.6733 84 L 4.2162 8.3256 118.3051 57.4101 41.0586 179.0803 85 Q 4.1906 8.0949 115.3608 56.6693 28.2563 176.2025 86 T 4.5429 7.7242 108.8925 61.6811 74.1486 175.5445 87 A 3.9727 7.7042 124.5027 54.4873 18.2500 179.1037 88 L 3.5184 7.9205 115.9132 57.7641 41.6644 178.0307 89 P 4.1025 0.0000 0.0000 65.5298 31.2334 177.5256 90 L 4.4379 7.9855 115.2926 53.7946 41.9584 176.1537 91 A 4.8592 7.9176 121.9328 50.4774 22.0405 175.2503 92 E 4.4275 8.3655 116.9887 58.5631 31.7334 176.5729 93 L 3.7314 6.8501 116.2530 52.6203 43.4469 175.7414 94 A 4.4875 8.6049 122.6026 52.5868 21.2829 174.4665 95 T 3.1947 8.6728 111.9295 62.5703 69.2518 173.9834 96 S 3.7991 8.6490 119.0259 60.4825 63.3962 173.2486 97 Q 4.4604 10.5903 118.3815 55.8261 28.5539 174.8624 98 F 4.8628 7.6212 114.3282 55.2599 41.1544 175.0768 99 D 4.6745 9.8367 123.4459 54.4063 41.6199 175.9987 100 D 4.6954 8.5456 120.0817 55.3957 41.2430 177.5073 101 T 4.5807 7.3257 112.9873 62.3056 68.9237 174.6393 102 G 3.9691 8.3886 108.8454 46.3368 0.0000 173.0689 103 N 5.2640 7.7630 116.3354 51.2194 41.7487 173.2698 104 F 4.2446 7.4815 109.1244 56.2406 41.1307 172.9929 105 S 5.1016 8.8093 116.2375 56.4716 65.1305 172.6405 106 F 4.9291 8.7597 120.5542 55.4226 41.5767 172.5655 107 G 4.2331 8.9666 102.1640 44.3917 0.0000 173.5806 *128 L 4.0066 8.5431 123.5995 55.1630 43.6087 176.2999 129 D 4.8017 8.6019 126.0123 52.9838 43.8909 176.3246 130 V 4.1165 7.9208 120.7573 62.0664 34.4515 173.6953 131 T 4.7139 8.6864 125.5961 61.6257 71.0035 174.0594 132 V 4.4507 7.7699 124.6910 61.0791 34.2987 173.5736 133 N 5.0321 8.6559 127.3397 52.2396 40.2843 173.5885 134 L 5.2814 8.1004 125.6899 53.2490 45.1074 175.7202 135 V 4.2271 7.8254 120.2878 61.4393 35.1033 171.3200 136 R 4.5267 8.2349 116.6478 54.8831 31.4451 177.3874 137 P 3.9936 0.0000 0.0000 65.2830 31.9245 177.3479 138 G 4.1563 7.7954 106.5164 46.0371 0.0000 175.3958 139 Y 4.2723 8.1472 122.9490 60.0577 38.9909 176.0042 140 R 3.8732 8.2120 119.1716 58.9450 30.0315 178.2153 141 V 3.5564 7.4869 116.5121 65.4538 31.2365 176.7721 142 A 4.8403 7.6503 119.6172 51.3990 19.3321 177.3976 143 K 4.2471 7.3886 114.7210 55.9840 33.9249 176.5974 144 R 4.2653 7.5563 115.5436 55.4533 30.4218 176.6074 145 D 4.4468 8.3816 117.4789 57.0634 41.2240 177.6015 146 K 4.0122 7.9207 118.4853 57.5996 32.6989 177.0227 147 A 3.7128 8.6868 123.7755 52.4040 16.2874 177.0116 148 S 4.5394 7.1976 113.7093 60.9540 64.0149 173.2021 149 R 4.5563 8.4548 118.8995 55.4503 33.7939 173.5828 150 S 4.6819 8.4776 117.8538 57.3897 63.5858 173.7790 151 I 3.9519 8.2294 127.1593 60.3163 37.7573 174.4490 152 P 4.4129 0.0000 0.0000 62.6223 32.1944 177.2069 153 T 3.9175 8.8026 112.7302 65.4003 68.0173 176.6556 154 K 4.0280 7.9787 119.6162 59.2084 32.2829 177.7561 155 H 4.6010 7.9793 115.3027 55.8702 30.1009 175.1361 156 R 4.2510 7.3321 118.9258 56.3872 30.6293 175.1142 157 L 4.5710 8.1551 120.3756 53.6786 43.4548 175.5456 158 N 4.6999 8.1718 123.2967 51.7321 41.0679 174.4585 159 P 4.3317 0.0000 0.0000 65.9556 31.4158 178.7015 160 A 3.8709 7.9100 118.7764 55.3717 18.1109 179.1648 161 D 4.4430 8.1681 115.9142 56.5153 40.8543 178.7863 162 A 4.0996 7.5959 121.8015 54.7917 19.0735 179.3054 163 V 3.1730 7.5193 116.5180 66.3510 31.3163 177.5953 164 A 3.9087 7.9152 120.0386 55.1511 17.9609 178.9017 165 F 4.1249 7.6891 117.6771 61.7680 39.6877 177.6650 166 I 3.5003 7.8392 118.7105 64.4018 36.8290 177.8314 167 E 4.5758 8.1011 120.4348 58.5704 29.3683 177.6600 168 S 4.5484 8.0935 112.0785 57.8600 64.8123 175.1070 169 T 4.7546 7.9312 113.1298 62.7449 70.7780 173.1933 170 Y 3.3733 7.9014 118.1655 57.7976 35.1046 168.7986 171 D 4.4035 6.7873 117.1171 54.0049 43.6972 175.4638 172 V 4.7414 7.9468 117.0292 61.1718 35.7252 178.4666 173 E 4.3619 8.9538 122.4663 56.3116 28.7790 177.3261 174 V 4.0411 7.7765 116.6976 63.7581 31.7644 175.0431 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 10 F 8.17 4.82 0.00 3.36 3.37 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 11 H 5.29 4.01 0.00 3.09 2.31 0.00 5.62 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 9.44 4.25 0.00 1.64 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 2.07 2.17 0.00 13 M 7.16 4.58 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.55 0.00 14 R 7.63 4.56 0.00 1.77 1.97 0.00 3.42 0.00 0.00 3.39 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 15 E 8.04 4.06 0.00 2.15 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 0.00 2.33 2.29 0.00 16 P 0.00 4.13 0.00 1.01 1.66 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 17 R 7.35 4.13 0.00 1.81 1.81 0.00 2.73 0.00 0.00 3.12 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.42 0.00 18 I 8.55 4.29 1.98 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.90 0.97 0.00 0.00 19 E 8.79 4.48 0.00 1.82 1.70 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 2.17 2.20 0.00 20 K 8.73 4.62 0.00 2.09 1.96 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.34 1.31 7.81 21 V 7.82 4.55 1.94 0.00 0.00 0.00 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 0.96 0.00 0.00 22 V 8.46 4.54 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 0.90 0.00 0.00 0.84 0.00 0.00 23 V 8.35 5.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.70 0.00 0.00 24 H 8.56 5.16 0.00 3.16 2.98 0.00 5.62 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 25 M 8.48 4.45 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 26 G 7.99 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 0.00 0.00 0.00 27 I 7.66 4.18 1.77 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 0.74 0.76 0.00 0.00 28 G 8.13 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 0.00 0.00 0.00 29 H 7.99 4.96 0.00 3.21 3.36 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *35 A 6.98 4.21 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 36 N 8.86 4.48 0.00 2.92 3.13 0.00 0.00 5.88 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 37 A 7.98 3.97 1.31 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 0.00 0.00 38 E 8.70 3.92 0.00 1.95 2.02 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 2.32 2.51 0.00 39 D 7.50 4.45 0.00 2.60 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 40 I 7.75 3.76 1.88 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 1.79 1.17 0.91 0.00 0.00 41 L 7.73 4.10 0.00 1.88 1.72 0.87 0.76 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 42 G 8.46 3.64 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 0.00 0.00 0.00 43 E 7.78 4.08 0.00 1.92 2.03 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 2.35 2.48 0.00 44 I 8.16 3.91 2.02 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.85 1.09 0.00 0.00 45 T 8.05 4.58 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 0.95 0.00 0.00 46 G 7.07 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 47 Q 7.74 4.58 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.62 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 48 M 8.55 3.82 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.60 0.00 49 P 0.00 4.83 0.00 1.91 1.94 0.00 3.59 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 50 V 8.27 4.46 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 1.05 0.00 0.00 0.91 0.00 0.00 51 R 8.73 4.39 0.00 1.72 1.85 0.00 3.35 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 52 T 8.70 4.51 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 1.21 0.00 0.00 53 K 8.77 5.37 0.00 1.63 1.74 0.00 1.73 0.00 0.00 2.36 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.28 7.81 54 A 8.73 4.88 1.23 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 55 K 8.46 4.48 0.00 1.72 1.70 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.41 7.81 56 R 8.40 4.15 0.00 1.98 1.99 0.00 3.20 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 57 T 8.25 4.58 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 58 V 8.95 4.56 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 1.02 0.00 0.00 0.94 0.00 0.00 59 G 8.91 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 0.00 0.00 0.00 60 E 8.11 4.26 0.00 2.14 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 0.00 2.31 2.34 0.00 61 F 7.76 4.16 0.00 3.04 3.02 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 62 D 7.92 4.93 0.00 2.96 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 63 I 7.65 4.20 1.93 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 1.45 0.85 1.06 0.00 0.00 64 R 7.91 3.85 0.00 1.77 2.04 0.00 3.20 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 65 E 8.20 3.92 0.00 1.97 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 0.00 2.29 2.30 0.00 66 G 7.86 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 67 D 8.28 4.58 0.00 2.64 2.70 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 68 P 0.00 4.62 0.00 1.94 2.03 0.00 3.62 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 69 I 9.00 4.64 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 1.14 1.03 0.93 0.00 0.00 70 G 7.54 4.50 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 71 A 8.06 5.91 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 72 K 8.27 5.00 0.00 1.75 1.87 0.00 1.44 0.00 0.00 1.69 0.00 0.00 2.76 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.38 7.81 73 V 8.44 4.62 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 0.90 0.00 0.00 0.86 0.00 0.00 74 T 8.53 4.72 4.19 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 1.15 0.00 0.00 75 L 8.50 4.75 0.00 1.48 1.52 0.48 0.54 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 76 R 7.99 4.75 0.00 1.62 1.77 0.00 3.30 0.00 0.00 3.22 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 77 D 8.94 4.45 0.00 2.89 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 0.00 0.00 0.00 0.00 78 E 8.92 3.99 0.00 2.02 2.02 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 2.42 2.42 0.00 79 M 8.23 4.13 0.00 2.01 2.28 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.58 0.00 80 A 7.96 4.33 1.41 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 0.00 0.00 81 E 8.14 3.96 0.00 2.16 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 2.45 2.62 0.00 82 E 8.46 4.11 0.00 2.01 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 0.00 2.36 2.55 0.00 83 F 7.57 4.40 0.00 3.32 3.27 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 84 L 8.33 4.22 0.00 1.93 1.81 1.10 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.09 4.19 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.73 0.00 0.00 0.00 0.00 0.00 2.19 2.45 0.00 86 T 7.72 4.54 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 1.14 0.00 0.00 87 A 7.70 3.97 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 88 L 7.92 3.52 0.00 1.71 1.69 0.96 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.10 0.00 2.11 2.13 0.00 3.67 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 2.00 2.19 0.00 90 L 7.99 4.44 0.00 1.76 1.73 0.91 0.70 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 91 A 7.92 4.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 E 8.37 4.43 0.00 1.93 1.95 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 0.00 2.19 2.29 0.00 93 L 6.85 3.73 0.00 1.72 1.86 1.00 0.77 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 94 A 8.60 4.49 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 95 T 8.67 3.19 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 1.12 0.00 0.00 96 S 8.65 3.80 0.00 4.23 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 0.00 97 Q 10.59 4.46 0.00 2.14 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 98 F 7.62 4.86 0.00 3.07 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 99 D 9.84 4.67 0.00 2.82 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 0.00 100 D 8.55 4.70 0.00 2.73 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 0.00 101 T 7.33 4.58 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 0.00 102 G 8.39 3.97 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 0.00 103 N 7.76 5.26 0.00 2.98 2.80 0.00 0.00 6.59 8.13 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 0.00 104 F 7.48 4.24 0.00 2.46 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 0.00 0.00 0.00 0.00 105 S 8.81 5.10 0.00 3.73 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 0.00 106 F 8.76 4.93 0.00 3.16 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 0.00 107 G 8.97 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 *128 L 8.54 4.01 0.00 1.75 1.60 0.94 1.15 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 0.00 129 D 8.60 4.80 0.00 2.73 2.45 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 0.00 130 V 7.92 4.12 0.92 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 0.89 0.00 0.00 0.92 0.00 0.00 131 T 8.69 4.71 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 1.05 0.00 0.00 132 V 7.77 4.45 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 1.08 0.00 0.00 0.76 0.00 0.00 133 N 8.66 5.03 0.00 2.81 2.90 0.00 0.00 6.55 6.32 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 0.00 134 L 8.10 5.28 0.00 1.72 1.52 1.33 1.14 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 0.00 135 V 7.83 4.23 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.26 0.00 0.00 0.75 0.00 0.00 136 R 8.23 4.53 0.00 1.81 1.96 0.00 2.97 0.00 0.00 3.02 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.46 0.00 137 P 0.00 3.99 0.00 2.28 2.14 0.00 3.62 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 2.11 0.00 138 G 7.80 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 0.00 0.00 0.00 139 Y 8.15 4.27 0.00 3.14 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 0.00 140 R 8.21 3.87 0.00 1.94 1.94 0.00 3.24 0.00 0.00 3.26 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 141 V 7.49 3.56 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 0.91 0.00 0.00 0.96 0.00 0.00 142 A 7.65 4.84 0.98 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 0.00 143 K 7.39 4.25 0.00 1.63 1.79 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.79 1.34 7.81 144 R 7.56 4.27 0.00 1.91 1.92 0.00 3.14 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.55 0.00 145 D 8.38 4.45 0.00 2.67 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 0.00 146 K 7.92 4.01 0.00 1.80 1.71 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.69 3.71 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 0.00 148 S 7.20 4.54 0.00 3.81 4.04 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 0.00 149 R 8.45 4.56 0.00 1.91 1.72 0.00 3.12 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 150 S 8.48 4.68 0.00 3.91 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 0.00 151 I 8.23 3.95 1.98 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.14 1.04 0.00 0.00 152 P 0.00 4.41 0.00 2.21 1.99 0.00 3.66 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.80 3.92 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 1.23 0.00 0.00 154 K 7.98 4.03 0.00 1.77 1.95 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.58 7.81 155 H 7.98 4.60 0.00 3.16 3.46 0.00 5.94 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 R 7.33 4.25 0.00 2.09 1.90 0.00 3.41 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.75 0.00 157 L 8.16 4.57 0.00 1.66 1.73 0.89 0.54 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 0.00 158 N 8.17 4.70 0.00 2.90 2.72 0.00 0.00 6.58 7.91 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 0.00 159 P 0.00 4.33 0.00 2.16 2.24 0.00 3.62 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.45 0.00 160 A 7.91 3.87 1.28 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 0.00 0.00 0.00 161 D 8.17 4.44 0.00 2.71 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 0.00 162 A 7.60 4.10 1.58 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 0.00 0.00 163 V 7.52 3.17 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 0.79 0.00 0.00 0.22 0.00 0.00 164 A 7.92 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 0.00 165 F 7.69 4.12 0.00 3.00 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 0.00 166 I 7.84 3.50 1.84 0.00 0.00 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 1.64 0.98 0.88 0.00 0.00 167 E 8.10 4.58 0.00 1.87 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 0.00 2.27 2.19 0.00 168 S 8.09 4.55 0.00 3.85 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 0.00 169 T 7.93 4.75 4.17 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 1.15 0.00 0.00 170 Y 7.90 3.37 0.00 3.00 3.12 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 0.00 171 D 6.79 4.40 0.00 2.88 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 0.00 172 V 7.95 4.74 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 0.84 0.00 0.00 0.89 0.00 0.00 173 E 8.95 4.36 0.00 1.97 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 2.41 2.19 0.00 174 V 7.78 4.04 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 1.07 0.00 0.00 0.89 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.