NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3667 8.2649 123.5944 52.0262 19.9331 175.7448 2 N 4.7051 8.6067 116.8000 50.9113 40.6152 172.8324 3 A 4.6886 8.4124 126.7115 50.5708 22.2225 175.7997 *4 F 3.4924 7.4355 113.5035 58.8503 38.8561 174.6706 5 L 4.6506 7.4309 120.9904 52.9388 43.7083 177.1161 *8 L 4.2964 8.3402 121.9278 54.1615 43.6471 177.0603 9 R 4.5216 7.6831 117.2630 53.4100 31.5557 174.4490 10 P 4.2965 0.0000 0.0000 62.3376 31.8383 176.4433 11 G 3.8095 8.3253 109.2355 46.3025 0.0000 172.8031 12 S 4.4036 8.0194 113.7056 56.4751 65.3401 174.5884 13 L 3.9093 8.3978 123.9347 56.1658 40.7586 178.3663 *15 R 4.1445 7.8387 117.9153 56.4726 31.5463 176.5668 *17 C 4.9296 8.0648 113.0870 57.4524 42.2836 174.1685 18 K 4.3549 8.2525 119.3264 56.0632 31.8128 176.9622 *21 Q 4.2047 7.9078 118.9899 56.1343 29.8371 173.3455 22 C 4.7638 8.7034 120.8157 54.5125 43.3492 172.4660 23 S 4.9593 8.1223 114.8672 56.3651 65.1444 175.3761 24 F 2.7214 8.0075 121.4797 57.6201 36.4780 174.5668 *27 A 4.2049 7.9946 127.2782 51.7086 20.7439 179.8378 28 R 4.8166 7.1502 116.0741 55.8663 28.7414 178.5528 *30 I 3.9822 7.3045 116.6904 61.0037 39.2865 177.3500 31 F 3.9915 8.5988 122.0137 58.6057 39.2934 176.8073 32 K 4.1398 8.2051 124.2841 57.5756 31.1984 175.6287 33 D 4.4282 7.6838 117.4271 53.6867 41.9684 176.6550 34 A 4.1649 8.7478 126.6464 54.0291 18.7633 179.0588 *36 R 4.3876 7.9734 118.4056 57.4730 32.3631 178.2343 37 T 3.7692 8.0885 114.6497 66.2305 68.3277 176.9448 38 K 4.1512 8.6762 120.9883 59.4959 31.9967 178.7040 39 L 3.9497 8.0688 119.8902 58.4869 41.8707 178.9311 40 F 4.1160 7.9170 119.8528 61.0215 39.2570 176.9734 41 W 3.8936 8.8299 128.7483 60.3416 29.8322 177.7926 42 I 3.6954 8.5130 113.3377 63.7976 36.4390 177.6985 43 S 4.5114 7.0415 112.3393 60.0506 63.5259 175.4271 44 Y 3.6106 7.3113 121.7247 59.3714 38.3864 176.2377 45 S 3.9965 7.3660 113.5374 59.3846 64.7247 174.8925 46 D 4.5177 7.0428 121.8728 58.8704 39.1965 173.8924 47 G 3.3394 6.0473 105.8899 41.8143 0.0000 173.3826 48 D 5.1914 7.9763 117.1489 51.8217 39.9610 176.9028 49 Q 4.0440 9.6612 127.1069 58.6786 29.1174 178.1836 50 C 4.0845 7.9025 112.8429 57.9635 40.5238 175.4224 51 A 3.8344 7.8983 123.7268 55.1975 17.9245 178.9426 52 S 4.1171 7.4578 107.1531 58.6183 63.6015 173.9112 53 S 3.6118 7.6293 115.5492 59.0491 60.3099 170.1366 54 P 4.2487 0.0000 0.0000 64.0399 32.2789 177.6882 55 C 4.6278 7.7555 117.0235 55.8174 40.7886 173.4601 56 Q 4.0491 9.2190 126.1042 56.0485 29.6340 176.1593 57 N 3.9303 9.4866 113.4833 54.5558 35.9092 175.4956 58 G 3.9471 8.1699 106.0042 44.8489 0.0000 175.0259 59 G 3.8588 7.8337 106.9705 46.6922 0.0000 173.5013 60 S 4.9767 9.2741 117.6839 56.9201 65.6561 172.3766 61 C 5.4829 8.6700 122.0599 54.7862 44.9230 172.7451 62 K 4.5994 9.5805 128.4290 54.5626 33.3615 175.2098 63 D 4.8756 8.7210 127.4178 55.0984 42.7252 175.1520 64 Q 4.4678 8.4333 121.7789 55.1410 31.7729 173.7854 65 L 4.2137 8.4892 118.9381 54.5666 41.5206 176.7299 66 Q 3.3596 8.4879 126.0907 56.1674 26.5598 173.3105 67 S 4.5211 7.6056 110.0498 59.0702 65.3488 174.0996 68 Y 5.1541 7.4390 117.4878 56.7155 40.7161 173.6655 69 I 4.5997 9.1889 119.6623 59.8433 41.0945 174.0764 70 C 5.4462 8.9493 124.0397 55.4742 39.1867 173.1364 71 F 4.6952 9.8089 122.8399 56.1785 40.3643 174.3681 72 C 5.0615 8.7379 121.3519 55.3256 37.2842 174.0848 73 L 4.3923 8.4887 120.9794 53.9620 42.1356 176.3760 74 P 4.1649 0.0000 0.0000 65.9802 31.3608 177.3398 75 A 4.2434 7.9623 118.3385 51.8603 18.5540 176.0234 76 F 5.8443 7.9010 114.7445 55.7416 43.1174 173.2374 77 E 4.5717 8.6165 118.3239 55.8232 31.7015 174.1810 78 G 4.2245 8.6262 104.7793 44.2673 0.0000 174.7096 79 R 3.9459 8.5061 118.6635 58.7636 30.1704 176.7095 80 N 5.0542 8.8088 114.3050 52.5974 40.1290 173.5961 81 C 4.4698 7.8173 112.1928 58.3491 37.9828 173.9149 82 E 4.2319 8.1201 118.7496 58.3770 30.6266 177.9600 83 T 4.1675 8.2701 116.8814 63.5664 69.2878 173.0460 84 H 4.9583 8.8010 123.6287 53.8586 30.2207 176.1542 85 K 4.0139 8.6640 125.5039 59.3724 32.0994 179.2533 86 D 4.3520 7.8766 117.4830 56.7878 40.7792 176.6993 87 D 4.6281 7.6192 116.6680 54.8893 41.2466 176.8903 88 Q 4.3065 7.8574 117.8331 55.9515 29.2131 176.9062 89 L 4.3751 7.6415 121.1719 55.2302 39.9919 175.9880 90 I 4.7839 7.0709 114.1801 58.6848 41.0867 177.9335 91 C 4.1319 8.9956 120.0107 60.5035 40.1866 176.1373 92 V 3.8656 7.7260 109.6433 61.5960 31.2437 175.2713 93 N 4.7328 8.5395 120.1490 52.1902 39.8950 173.7832 94 E 3.9267 9.3169 127.2420 57.6512 27.4082 174.5671 95 N 4.6025 8.2873 110.7484 53.8069 37.5398 174.1180 96 G 4.0426 9.3390 101.1994 45.9642 0.0000 175.8976 97 G 3.9633 8.4528 107.4024 45.3028 0.0000 174.3528 98 C 4.4720 8.0999 117.9568 56.5682 40.8385 173.6305 99 E 3.9992 8.8827 125.2506 58.5094 30.3681 176.9429 100 Q 4.1463 8.0212 112.1449 55.9038 31.0676 176.2115 101 Y 4.9390 5.3700 119.0057 57.6564 40.8942 174.7621 102 C 5.2202 8.8495 122.6874 54.9497 46.1734 172.8800 103 S 4.8069 9.1770 123.0459 56.8823 64.3011 173.7376 104 D 4.8734 8.6053 124.8276 54.6532 41.6485 175.5939 105 H 4.6341 8.4174 117.0566 54.6753 32.4104 172.7892 106 T 3.8738 9.1253 112.4690 63.5066 69.0702 175.3082 107 G 3.7387 7.9791 114.8683 46.7996 0.0000 174.0819 108 T 4.2522 7.5528 115.3628 62.4409 69.5145 173.9747 109 K 4.2984 8.1629 124.0840 55.8941 33.0931 176.5032 110 R 4.3678 8.6614 125.5962 56.8608 31.0758 175.6102 111 S 4.8171 9.1358 119.7091 56.8122 65.5860 172.7155 112 C 5.1280 8.8870 121.5155 56.6864 41.1732 173.3439 113 R 4.6343 8.8611 119.2655 55.8944 34.3541 172.4473 114 C 4.7898 8.6733 115.8045 57.1805 39.7128 172.8945 115 H 5.0978 8.9772 118.8546 54.4382 31.0221 174.1231 116 E 4.1163 8.3453 123.3680 58.6103 29.8360 177.7793 117 G 4.0068 9.7165 110.6082 45.0018 0.0000 171.7664 118 Y 5.4240 7.7063 115.5362 56.3366 42.5244 174.7651 119 S 4.7737 9.3497 114.7036 56.4547 66.8388 173.1481 120 L 4.5662 8.5530 124.7560 55.2218 42.3533 177.2108 121 L 4.3389 8.9286 126.3340 54.0806 43.2001 177.2137 122 A 4.1162 8.4576 121.3122 55.3709 18.4468 178.7117 123 D 4.3585 8.1200 114.5909 54.3115 39.5573 177.8696 124 G 4.0560 7.9098 107.0906 46.1034 0.0000 174.4950 125 V 4.4265 7.5778 111.6157 61.1073 35.3365 175.9920 126 S 5.0236 8.5823 116.1811 57.8213 64.7543 172.7737 127 C 5.6632 9.2041 119.2370 55.4233 41.3021 173.7221 128 T 4.9287 9.0864 113.3047 58.9962 71.5171 171.8046 129 P 4.5806 0.0000 0.0000 63.2349 31.5399 176.3388 130 T 4.3719 8.9933 113.7149 62.0007 70.4182 174.8251 131 V 4.5121 7.2237 114.0499 58.8960 35.3361 174.9607 132 E 3.7842 8.7734 122.5429 58.9120 29.5277 176.9697 133 Y 4.6647 7.2183 116.0296 54.9935 37.8153 173.3037 134 P 4.2576 0.0000 0.0000 61.9156 32.0262 176.6416 135 C 4.0793 8.4097 114.0136 61.8633 29.8135 175.3021 136 G 4.0098 7.9339 110.9161 44.8937 0.0000 173.5741 137 K 4.5551 7.8530 117.0736 53.8302 35.9490 177.4048 138 I 4.2310 7.8544 124.1963 59.3481 35.9842 174.8193 139 P 4.3210 0.0000 0.0000 65.9314 31.0867 178.4250 140 I 3.9476 7.8252 115.1244 63.4218 37.9824 176.8662 141 L 4.4054 7.2780 117.5574 55.6914 42.1998 176.8636 142 E 4.3630 8.1542 122.5855 56.4159 29.7633 175.7845 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 A 8.26 4.37 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 2 N 8.61 4.71 0.00 2.78 2.73 0.00 0.00 6.72 6.46 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 3 A 8.41 4.69 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 *4 F 7.44 3.49 0.00 2.32 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 0.00 0.00 0.00 5 L 7.43 4.65 0.00 1.60 1.59 0.92 0.94 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 *8 L 8.34 4.30 0.00 1.84 1.76 0.91 0.91 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 9 R 7.68 4.52 0.00 1.77 1.82 0.00 3.21 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 10 P 0.00 4.30 0.00 2.11 2.01 0.00 3.76 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 11 G 8.33 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 12 S 8.02 4.40 0.00 3.72 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 13 L 8.40 3.91 0.00 1.61 1.63 0.89 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 *15 R 7.84 4.14 0.00 1.79 1.97 0.00 3.26 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 *17 C 8.06 4.93 0.00 3.30 3.35 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 18 K 8.25 4.35 0.00 1.77 1.89 0.00 1.89 0.00 0.00 1.86 0.00 0.00 3.17 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.77 1.60 7.81 *21 Q 7.91 4.20 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.94 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 22 C 8.70 4.76 0.00 3.17 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 23 S 8.12 4.96 0.00 4.07 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 24 F 8.01 2.72 0.00 2.15 2.68 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 *27 A 7.99 4.20 1.47 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 28 R 7.15 4.82 0.00 1.07 1.50 0.00 3.26 0.00 0.00 3.11 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.36 0.00 *30 I 7.30 3.98 1.72 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.50 0.21 0.00 0.00 31 F 8.60 3.99 0.00 2.90 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 32 K 8.21 4.14 0.00 1.89 1.92 0.00 1.82 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.46 7.81 33 D 7.68 4.43 0.00 2.70 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 34 A 8.75 4.16 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 *36 R 7.97 4.39 0.00 2.17 2.17 0.00 3.21 0.00 0.00 3.42 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 37 T 8.09 3.77 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 0.86 0.00 0.00 38 K 8.68 4.15 0.00 1.79 1.94 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.81 1.66 7.81 39 L 8.07 3.95 0.00 1.73 1.70 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 40 F 7.92 4.12 0.00 2.48 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 41 W 8.83 3.89 0.00 3.82 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 42 I 8.51 3.70 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.62 0.99 0.00 0.00 43 S 7.04 4.51 0.00 3.93 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 44 Y 7.31 3.61 0.00 1.76 1.78 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 45 S 7.37 4.00 0.00 3.71 3.16 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 46 D 7.04 4.52 0.00 2.84 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 47 G 6.05 3.34 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 48 D 7.98 5.19 0.00 2.69 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 49 Q 9.66 4.04 0.00 2.51 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.49 6.65 0.00 0.00 0.00 0.00 0.00 2.59 2.46 0.00 50 C 7.90 4.08 0.00 3.18 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 51 A 7.90 3.83 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 52 S 7.46 4.12 0.00 4.01 3.94 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 0.00 0.00 0.00 0.00 53 S 7.63 3.61 0.00 3.90 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 54 P 0.00 4.25 0.00 1.90 1.89 0.00 3.56 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.85 0.00 55 C 7.76 4.63 0.00 3.10 3.10 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 0.00 56 Q 9.22 4.05 0.00 2.27 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.30 6.04 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 57 N 9.49 3.93 0.00 1.79 1.42 0.00 0.00 7.06 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 58 G 8.17 3.95 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 0.00 0.00 0.00 0.00 0.00 0.00 59 G 7.83 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 60 S 9.27 4.98 0.00 3.75 3.74 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 61 C 8.67 5.48 0.00 2.89 2.89 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 62 K 9.58 4.60 0.00 1.99 1.98 0.00 1.74 0.00 0.00 1.61 0.00 0.00 3.08 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.44 7.81 63 D 8.72 4.88 0.00 2.98 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.43 4.47 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 65 L 8.49 4.21 0.00 1.65 1.60 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.49 3.36 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.80 0.00 0.00 0.00 0.00 0.00 2.48 2.24 0.00 67 S 7.61 4.52 0.00 3.79 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 68 Y 7.44 5.15 0.00 3.07 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 69 I 9.19 4.60 2.01 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.18 0.53 0.00 0.00 70 C 8.95 5.45 0.00 2.93 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 71 F 9.81 4.70 0.00 2.86 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 72 C 8.74 5.06 0.00 2.94 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 73 L 8.49 4.39 0.00 2.01 1.75 1.00 1.06 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 74 P 0.00 4.16 0.00 2.05 2.16 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 75 A 7.96 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 F 7.90 5.84 0.00 3.04 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 77 E 8.62 4.57 0.00 2.11 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 0.00 2.25 2.28 0.00 78 G 8.63 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 0.00 0.00 0.00 0.00 79 R 8.51 3.95 0.00 1.76 2.00 0.00 3.18 0.00 0.00 3.11 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 80 N 8.81 5.05 0.00 2.82 3.02 0.00 0.00 6.89 7.32 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 81 C 7.82 4.47 0.00 3.07 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 82 E 8.12 4.23 0.00 1.99 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 0.00 2.29 2.41 0.00 83 T 8.27 4.17 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 1.25 0.00 0.00 84 H 8.80 4.96 0.00 3.26 3.08 0.00 5.64 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.66 4.01 0.00 1.67 1.79 0.00 1.73 0.00 0.00 1.61 0.00 0.00 3.08 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.56 1.37 7.81 86 D 7.88 4.35 0.00 2.57 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 87 D 7.62 4.63 0.00 2.85 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 88 Q 7.86 4.31 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.51 0.00 0.00 0.00 0.00 0.00 2.63 2.42 0.00 89 L 7.64 4.38 0.00 1.57 1.61 0.96 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 90 I 7.07 4.78 2.00 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 1.55 0.79 0.91 0.00 0.00 91 C 9.00 4.13 0.00 3.03 3.21 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 92 V 7.73 3.87 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 0.66 0.00 0.00 0.93 0.00 0.00 93 N 8.54 4.73 0.00 2.65 2.87 0.00 0.00 7.27 8.19 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 94 E 9.32 3.93 0.00 2.15 1.97 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 2.30 2.21 0.00 95 N 8.29 4.60 0.00 2.93 2.81 0.00 0.00 7.61 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 96 G 9.34 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 0.00 0.00 0.00 97 G 8.45 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 0.00 0.00 0.00 98 C 8.10 4.47 0.00 3.06 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 99 E 8.88 4.00 0.00 1.96 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 2.20 2.21 0.00 100 Q 8.02 4.15 0.00 1.73 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.59 0.00 0.00 0.00 0.00 0.00 1.86 2.03 0.00 101 Y 5.37 4.94 0.00 2.95 2.77 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 0.00 102 C 8.85 5.22 0.00 3.04 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 0.00 103 S 9.18 4.81 0.00 3.88 3.66 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 0.00 104 D 8.61 4.87 0.00 2.52 2.56 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 0.00 0.00 0.00 105 H 8.42 4.63 0.00 3.17 3.17 0.00 5.90 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 9.13 3.87 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 0.00 107 G 7.98 3.74 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 0.00 0.00 0.00 108 T 7.55 4.25 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 1.14 0.00 0.00 109 K 8.16 4.30 0.00 1.77 1.70 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.44 7.81 110 R 8.66 4.37 0.00 1.87 1.84 0.00 3.47 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 111 S 9.14 4.82 0.00 3.92 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 0.00 112 C 8.89 5.13 0.00 3.03 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 0.00 113 R 8.86 4.63 0.00 1.86 1.95 0.00 3.14 0.00 0.00 3.22 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 114 C 8.67 4.79 0.00 2.85 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 0.00 115 H 8.98 5.10 0.00 2.91 3.09 0.00 5.61 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.35 4.12 0.00 1.94 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 0.00 2.32 2.40 0.00 117 G 9.72 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 0.00 0.00 0.00 118 Y 7.71 5.42 0.00 2.93 2.77 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 0.00 119 S 9.35 4.77 0.00 3.82 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 0.00 120 L 8.55 4.57 0.00 1.68 1.63 0.97 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 121 L 8.93 4.34 0.00 1.94 1.62 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.46 4.12 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 0.00 123 D 8.12 4.36 0.00 2.83 2.93 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 0.00 0.00 0.00 124 G 7.91 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 0.00 125 V 7.58 4.43 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 0.71 0.00 0.00 1.07 0.00 0.00 126 S 8.58 5.02 0.00 3.90 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 0.00 127 C 9.20 5.66 0.00 2.83 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 0.00 128 T 9.09 4.93 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 0.00 129 P 0.00 4.58 0.00 1.84 1.74 0.00 3.67 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 2.03 2.19 0.00 130 T 8.99 4.37 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 1.17 0.00 0.00 131 V 7.22 4.51 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 0.68 0.00 0.00 0.80 0.00 0.00 132 E 8.77 3.78 0.00 1.71 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 1.47 1.96 0.00 133 Y 7.22 4.66 0.00 2.98 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 0.00 134 P 0.00 4.26 0.00 1.64 1.38 0.00 3.80 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.81 0.00 135 C 8.41 4.08 0.00 3.15 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 0.00 136 G 7.93 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 0.00 0.00 0.00 137 K 7.85 4.56 0.00 1.78 1.74 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.18 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.51 1.49 7.81 138 I 7.85 4.23 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.95 0.93 0.00 0.00 139 P 0.00 4.32 0.00 2.24 2.36 0.00 3.64 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.39 0.00 140 I 7.83 3.95 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.63 0.92 0.00 0.00 141 L 7.28 4.41 0.00 1.83 1.71 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 142 E 8.15 4.36 0.00 2.12 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 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.