NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *2 E 4.3397 8.3027 116.7825 54.2726 32.1772 175.8463 3 S 4.6649 7.8090 114.8630 57.3216 64.9134 172.2290 4 S 3.9488 7.3032 110.9423 57.4070 65.5222 174.8462 5 V 4.3904 7.8635 120.6082 60.3356 35.0056 173.3440 6 D 5.0659 8.5822 123.3547 53.0125 42.1859 175.7154 7 I 4.7197 8.6463 124.8378 59.4704 40.7276 174.6096 8 Q 5.1115 9.6468 125.2361 54.0410 32.1031 174.6714 9 G 4.3888 9.2829 111.3098 44.6046 0.0000 172.2174 10 N 5.4763 8.2995 123.9097 51.0701 40.5861 174.9266 11 D 4.5974 8.7582 116.7360 55.8836 41.0788 176.9411 12 Q 4.2925 8.4676 118.3370 55.2602 28.8709 175.1323 13 M 2.9465 7.5922 116.0869 56.2398 31.1612 176.3139 14 Q 4.4405 7.4062 113.9718 54.2313 33.3378 174.9225 15 F 5.2081 8.3913 119.2242 56.4233 40.3116 176.0385 16 N 4.5712 8.7288 119.7519 55.2659 37.3837 175.4002 17 T 4.7936 7.8734 111.0009 60.3407 70.6067 172.5895 18 N 5.2516 8.8021 121.3404 53.0360 40.3827 173.8432 19 A 5.4323 8.3039 120.5635 50.8812 22.7396 176.2061 20 I 4.7238 9.3561 122.9841 59.7294 41.1722 174.6101 21 T 5.0461 8.6406 122.1183 61.7572 71.1436 173.4306 22 V 4.1698 8.6935 126.4352 60.8012 33.7547 174.1706 23 D 4.8110 8.7997 128.8361 53.9267 40.8688 176.4948 24 K 4.0832 8.9280 126.2711 59.2064 33.3817 177.4654 25 S 4.3863 8.4317 117.1442 57.6338 62.2198 174.1721 *27 K 4.4540 7.7305 121.3181 56.7597 35.0599 177.6362 28 Q 4.9776 7.9015 115.3947 54.0162 33.1887 174.5762 29 F 4.7885 8.5892 122.5430 56.6878 43.1726 173.4606 30 T 4.6913 7.0102 121.2379 61.4859 71.7293 173.0099 31 V 4.2287 8.4368 126.2538 61.0024 34.0220 173.8353 32 N 4.8681 8.6876 126.3830 51.6479 40.4329 173.5881 33 L 5.1844 9.0430 127.4568 53.3427 44.2907 175.3927 34 S 5.2099 9.0795 119.8720 56.9823 67.3930 172.5253 35 H 5.7417 8.4289 118.3133 52.4056 30.7526 170.9412 36 P 4.6330 0.0000 0.0000 62.3678 32.5738 175.0580 37 G 3.8687 8.9758 105.6576 44.6647 0.0000 172.4973 38 N 4.9545 9.5884 113.6081 52.4228 40.8658 174.8636 39 L 4.3724 7.9897 119.4622 52.9283 42.9456 174.9127 40 P 4.7248 0.0000 0.0000 61.6031 32.4276 177.3394 41 K 3.9839 8.5066 117.8320 59.6162 32.4269 178.2067 42 N 4.9345 8.1706 114.9976 53.9223 37.8382 175.4671 43 V 4.4345 7.7761 117.6220 64.0371 33.8265 175.3624 44 M 4.3680 7.3353 118.5390 54.0749 32.2389 174.7990 45 G 3.8577 6.6064 104.1847 45.8954 0.0000 173.6577 46 H 5.4469 9.1740 118.8595 53.8008 33.1820 172.2488 47 N 5.7000 9.1544 118.3359 50.8930 41.2722 173.0122 48 W 4.8737 9.3778 128.7497 55.6567 33.4363 174.0706 49 V 4.5816 7.8654 127.0104 60.6735 34.3146 173.6891 50 L 4.8457 8.1870 129.4428 53.1078 44.5730 175.2579 51 S 5.1592 8.7770 119.8238 56.6620 67.6007 173.5351 52 T 4.3702 8.6092 109.4865 61.2169 69.3564 175.0473 53 A 3.9486 8.8143 125.4501 55.6293 18.0463 180.1680 54 A 3.9245 7.9170 117.5343 55.0252 18.7735 178.5944 55 D 4.5660 7.8716 115.2696 55.1384 41.2630 178.2605 56 M 3.6460 7.5902 119.7906 58.6950 32.1117 177.5150 57 Q 3.8954 8.0325 118.9848 59.3211 29.1344 178.6901 58 G 3.5754 7.9555 105.9161 47.8071 0.0000 175.5793 59 V 3.6604 7.7381 120.8052 65.6407 31.4824 178.3945 60 V 3.5817 7.8500 117.9910 66.2310 31.3090 178.0111 61 T 3.8262 7.9131 115.4824 67.0287 68.1387 176.4143 62 D 4.5887 8.0445 119.2592 57.1280 41.1136 178.7813 63 G 4.1103 8.3774 107.9975 47.4975 0.0000 175.3340 64 M 4.0802 8.1543 119.6278 58.3350 32.3308 177.5536 65 A 4.2636 7.5326 116.8214 53.4976 19.1149 178.6999 66 S 4.3581 8.2432 113.7740 57.8930 63.3193 175.4378 67 G 3.8227 7.6330 105.8922 44.6813 0.0000 173.9634 68 L 3.2083 7.7904 120.3953 57.6751 42.0733 178.7266 69 D 4.4492 7.7933 115.8895 55.0481 39.9401 176.7105 70 K 4.3841 7.7731 118.9069 55.6268 32.2878 175.8618 71 D 4.6716 8.2954 116.6563 55.7313 39.2185 173.1227 72 Y 3.8558 7.5309 112.2358 58.9832 36.1598 170.6779 73 L 4.9686 7.6535 116.3290 52.4718 45.8274 176.9002 74 K 4.1385 8.4980 123.5411 54.9052 32.6882 174.4260 75 P 4.2643 0.0000 0.0000 64.3311 31.7091 175.6366 76 D 4.3679 8.7648 120.9921 55.1227 38.5431 173.5445 77 D 4.4413 7.7293 119.0421 54.1790 41.3094 176.7953 78 S 4.3814 8.6363 121.3991 60.1868 63.4751 175.2474 79 R 4.0670 8.2363 119.6967 57.6269 30.2024 176.5203 80 V 4.1248 7.3263 118.3736 61.8816 31.5325 175.6107 81 I 4.0218 8.6471 129.8142 64.2996 37.6723 176.3896 82 A 4.6783 7.5765 120.2604 51.7057 22.1686 174.9107 83 H 5.4405 8.6196 113.7446 55.3070 31.3410 173.1178 84 T 4.6885 8.5498 111.1753 60.1233 71.2906 173.7822 85 K 4.6056 9.2781 122.3127 56.0836 34.4049 176.0088 86 L 4.7992 8.6343 122.8405 54.5448 42.7170 175.6521 87 I 4.8481 9.2553 119.8413 59.2335 41.5309 174.6314 88 G 4.3513 9.4656 110.8383 43.6641 0.0000 172.5774 89 S 4.4300 7.8453 114.3921 60.0650 62.8579 175.4096 90 G 3.8938 8.8562 111.4632 45.5663 0.0000 172.9595 91 E 4.6656 7.8179 119.5504 55.2937 32.1339 174.9124 92 K 5.0036 8.2363 118.2968 55.8319 36.4354 175.1589 93 D 4.7571 8.8998 120.7162 53.4976 45.1274 173.8891 94 S 5.2080 8.4915 116.7307 56.5435 65.9827 173.3358 95 V 4.5942 8.5011 124.0971 60.3021 34.7808 174.1343 96 T 5.1240 8.6540 119.9692 61.7094 71.1077 173.2505 97 F 5.1274 8.5666 120.1053 54.8156 42.2922 173.8668 98 D 4.8206 8.7860 120.1396 54.1229 41.4481 177.9278 99 V 3.6690 8.6873 124.5197 65.5363 31.6603 175.9431 100 P 4.4553 0.0000 0.0000 64.0891 31.1504 177.1872 101 K 4.1791 8.1080 117.7362 57.8830 32.2212 176.8451 102 L 4.7854 7.7720 118.7340 52.6267 43.9709 175.6057 103 K 4.7931 8.8744 118.3459 54.8473 35.7342 175.9877 104 E 4.1044 8.6499 119.7275 57.7956 29.8799 177.9008 105 G 3.9023 8.8103 109.2924 45.6219 0.0000 172.8093 106 E 4.3741 7.4851 119.0222 54.1490 31.3218 174.5750 107 Q 4.2938 8.0634 126.6192 55.2674 30.7254 173.7335 108 Y 5.2447 8.1904 122.4966 56.5457 41.5996 174.6019 109 M 5.4499 9.2119 121.2453 53.5459 36.3531 174.5051 110 F 5.3511 8.4149 117.1959 54.5204 41.1209 174.2489 111 F 5.8824 7.2685 113.2338 57.5745 40.8734 171.6584 112 C 5.6015 9.1330 120.3217 58.3181 32.6882 173.3748 113 T 4.5323 9.2109 115.1855 61.2194 69.3053 174.8031 114 F 3.4243 8.0795 125.7172 57.4384 39.8408 172.1419 115 P 4.0564 0.0000 0.0000 64.7615 31.4077 174.9999 116 G 4.2040 8.9942 111.2338 46.0716 0.0000 175.0302 117 H 4.2747 8.6097 117.1060 58.6028 28.8210 177.7183 118 S 4.6149 8.1162 112.4692 60.4425 63.1672 175.1519 119 A 4.1127 7.7581 124.4243 54.6274 18.2168 178.1481 120 L 4.5088 7.8140 113.1488 56.0231 43.9949 177.2445 121 M 4.6298 8.2958 121.1903 53.3837 29.9415 175.4844 122 K 5.0959 7.7019 118.4766 55.8293 36.8110 176.2986 123 G 3.6245 7.8679 107.5316 45.9637 0.0000 171.7960 124 T 5.1923 8.3554 110.0380 59.8603 71.6458 173.5342 125 L 5.4593 8.9541 125.3812 53.8342 45.5130 175.2206 126 T 4.9768 8.7859 121.4700 61.7372 72.9591 172.4156 127 L 4.8940 8.6646 127.0974 53.8579 43.4075 176.3242 128 K 4.3103 8.8831 125.3331 56.6518 32.7159 176.1624 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 *2 E 8.30 4.34 0.00 1.91 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 2.21 1.88 0.00 3 S 7.81 4.66 0.00 3.95 3.83 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 4 S 7.30 3.95 0.00 3.56 3.43 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 5 V 7.86 4.39 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 0.51 0.00 0.00 0.87 0.00 0.00 6 D 8.58 5.07 0.00 2.51 2.58 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 7 I 8.65 4.72 1.63 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.44 0.89 0.00 0.00 8 Q 9.65 5.11 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 9 G 9.28 4.39 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 10 N 8.30 5.48 0.00 2.85 2.95 0.00 0.00 6.57 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 11 D 8.76 4.60 0.00 2.70 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 12 Q 8.47 4.29 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 13 M 7.59 2.95 0.00 2.01 1.99 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 2.00 2.21 0.00 14 Q 7.41 4.44 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.84 6.69 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 15 F 8.39 5.21 0.00 3.31 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 16 N 8.73 4.57 0.00 2.93 3.02 0.00 0.00 6.64 7.00 0.00 0.00 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 T 7.87 4.79 4.32 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 1.28 0.00 0.00 18 N 8.80 5.25 0.00 2.77 2.82 0.00 0.00 6.58 7.43 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 19 A 8.30 5.43 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 20 I 9.36 4.72 2.00 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.66 0.96 0.00 0.00 21 T 8.64 5.05 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 1.27 0.00 0.00 22 V 8.69 4.17 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 0.76 0.00 0.00 -0.04 0.00 0.00 23 D 8.80 4.81 0.00 2.82 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 24 K 8.93 4.08 0.00 1.91 1.94 0.00 1.64 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.45 1.44 7.81 25 S 8.43 4.39 0.00 3.96 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 *27 K 7.73 4.45 0.00 1.74 1.92 0.00 1.59 0.00 0.00 1.81 0.00 0.00 2.80 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.47 7.81 28 Q 7.90 4.98 0.00 1.78 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.70 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 29 F 8.59 4.79 0.00 2.64 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 0.00 0.00 0.00 30 T 7.01 4.69 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 1.03 0.00 0.00 31 V 8.44 4.23 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 -0.19 0.00 0.00 0.10 0.00 0.00 32 N 8.69 4.87 0.00 2.68 2.62 0.00 0.00 6.07 7.40 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 33 L 9.04 5.18 0.00 1.65 1.66 1.15 0.86 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 34 S 9.08 5.21 0.00 3.91 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 35 H 8.43 5.74 0.00 3.29 3.29 0.00 5.63 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.63 0.00 2.00 2.01 0.00 3.90 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 37 G 8.98 3.87 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 0.00 0.00 0.00 38 N 9.59 4.95 0.00 2.61 2.80 0.00 0.00 6.98 6.69 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 39 L 7.99 4.37 0.00 1.78 1.53 0.90 1.34 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 40 P 0.00 4.72 0.00 2.22 2.17 0.00 3.68 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 2.22 1.95 0.00 41 K 8.51 3.98 0.00 2.03 2.16 0.00 1.58 0.00 0.00 1.92 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.53 1.52 7.81 42 N 8.17 4.93 0.00 2.95 3.07 0.00 0.00 5.74 7.68 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 43 V 7.78 4.43 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 0.79 0.00 0.00 0.99 0.00 0.00 44 M 7.34 4.37 0.00 1.82 1.82 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 2.36 2.54 0.00 45 G 6.61 3.86 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 0.00 0.00 0.00 46 H 9.17 5.45 0.00 3.17 3.23 0.00 5.56 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 9.15 5.70 0.00 2.84 3.05 0.00 0.00 5.82 8.88 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 48 W 9.38 4.87 0.00 3.39 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 49 V 7.87 4.58 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 0.67 0.00 0.00 0.95 0.00 0.00 50 L 8.19 4.85 0.00 0.91 1.21 0.86 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.78 5.16 0.00 4.11 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 52 T 8.61 4.37 4.14 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 1.28 0.00 0.00 53 A 8.81 3.95 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 54 A 7.92 3.92 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 55 D 7.87 4.57 0.00 2.90 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 56 M 7.59 3.65 0.00 1.94 1.87 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 2.04 0.00 57 Q 8.03 3.90 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 58 G 7.96 3.58 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 0.00 59 V 7.74 3.66 2.33 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 1.30 0.00 0.00 1.04 0.00 0.00 60 V 7.85 3.58 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 0.99 0.00 0.00 0.64 0.00 0.00 61 T 7.91 3.83 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 1.19 0.00 0.00 62 D 8.04 4.59 0.00 2.76 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 63 G 8.38 4.11 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 0.00 0.00 0.00 64 M 8.15 4.08 0.00 2.15 2.03 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 2.60 2.55 0.00 65 A 7.53 4.26 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 66 S 8.24 4.36 0.00 4.00 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 67 G 7.63 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 68 L 7.79 3.21 0.00 1.63 1.55 1.09 1.13 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 69 D 7.79 4.45 0.00 2.78 2.72 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 70 K 7.77 4.38 0.00 1.69 1.89 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.85 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.33 7.81 71 D 8.30 4.67 0.00 2.85 2.82 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 72 Y 7.53 3.86 0.00 3.22 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 73 L 7.65 4.97 0.00 1.72 1.47 0.73 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.50 4.14 0.00 1.80 1.86 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.43 7.81 75 P 0.00 4.26 0.00 2.08 1.99 0.00 3.88 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 2.11 0.00 76 D 8.76 4.37 0.00 2.81 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 77 D 7.73 4.44 0.00 2.90 2.58 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 78 S 8.64 4.38 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.24 4.07 0.00 1.96 2.17 0.00 3.17 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.58 0.00 80 V 7.33 4.12 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 0.81 0.00 0.00 0.96 0.00 0.00 81 I 8.65 4.02 1.75 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 0.64 0.63 0.00 0.00 82 A 7.58 4.68 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 83 H 8.62 5.44 0.00 3.15 3.25 0.00 5.71 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 8.55 4.69 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 1.34 0.00 0.00 85 K 9.28 4.61 0.00 1.92 1.95 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.68 1.46 7.81 86 L 8.63 4.80 0.00 1.83 1.85 1.27 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 87 I 9.26 4.85 1.99 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 1.46 0.92 0.98 0.00 0.00 88 G 9.47 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 0.00 0.00 0.00 0.00 89 S 7.85 4.43 0.00 4.11 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 90 G 8.86 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 0.00 0.00 0.00 91 E 7.82 4.67 0.00 2.07 1.90 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 2.26 2.54 0.00 92 K 8.24 5.00 0.00 1.58 1.64 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.45 7.81 93 D 8.90 4.76 0.00 2.81 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.49 5.21 0.00 3.83 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 95 V 8.50 4.59 2.23 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 0.97 0.00 0.00 1.04 0.00 0.00 96 T 8.65 5.12 4.20 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 0.00 0.00 0.00 1.09 0.00 0.00 97 F 8.57 5.13 0.00 3.12 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 98 D 8.79 4.82 0.00 2.82 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 99 V 8.69 3.67 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 1.04 0.00 0.00 0.87 0.00 0.00 100 P 0.00 4.46 0.00 2.11 2.11 0.00 3.70 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 101 K 8.11 4.18 0.00 1.97 1.87 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.62 7.81 102 L 7.77 4.79 0.00 1.62 1.33 0.81 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.87 4.79 0.00 1.94 1.92 0.00 1.37 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.46 7.81 104 E 8.65 4.10 0.00 2.01 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 0.00 2.35 2.34 0.00 105 G 8.81 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 0.00 106 E 7.49 4.37 0.00 1.89 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 1.47 1.90 0.00 107 Q 8.06 4.29 0.00 2.11 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.60 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 108 Y 8.19 5.24 0.00 3.30 2.82 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 0.00 109 M 9.21 5.45 0.00 1.92 2.03 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 2.47 2.59 0.00 110 F 8.41 5.35 0.00 1.59 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.27 5.88 0.00 3.12 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 0.00 112 C 9.13 5.60 0.00 3.10 2.97 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 0.00 113 T 9.21 4.53 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 1.50 0.00 0.00 114 F 8.08 3.42 0.00 3.10 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 0.00 115 P 0.00 4.06 0.00 1.65 1.76 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.49 0.00 116 G 8.99 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.61 4.27 0.00 3.45 3.37 0.00 5.64 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 0.00 118 S 8.12 4.61 0.00 3.94 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 0.00 119 A 7.76 4.11 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 0.00 120 L 7.81 4.51 0.00 1.56 1.67 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 121 M 8.30 4.63 0.00 1.51 2.09 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.17 0.00 122 K 7.70 5.10 0.00 1.64 1.74 0.00 1.54 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.29 1.38 7.81 123 G 7.87 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 T 8.36 5.19 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 1.21 0.00 0.00 125 L 8.95 5.46 0.00 2.07 1.73 1.11 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 126 T 8.79 4.98 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 127 L 8.66 4.89 0.00 1.71 1.64 0.93 0.58 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 0.00 128 K 8.88 4.31 0.00 1.61 1.63 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.39 7.81 * Residues marked with a * may have inaccurate shift predictions.