NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 P 4.3503 0.0000 0.0000 62.4747 32.5218 176.3911 11 E 3.8446 8.6605 121.5877 57.3766 29.9972 174.7697 12 I 4.5377 8.0147 117.6405 59.3928 42.1430 173.2584 13 V 4.4148 7.9750 117.5932 60.5714 35.7315 174.6875 14 G 4.3447 8.8052 109.7786 44.9324 0.0000 171.8840 15 P 4.6206 0.0000 0.0000 61.9801 32.2404 176.1817 16 E 4.2588 9.0390 118.5498 58.7778 29.4271 177.9425 17 K 4.5565 7.7615 115.0408 54.5357 35.0511 175.7677 18 V 3.6149 8.1707 121.4587 62.5716 31.4127 175.3709 19 Q 4.6254 8.3297 124.8389 53.7920 33.0504 174.0602 20 S 4.1866 8.5857 114.1868 58.8208 63.0646 173.7684 21 P 4.1883 0.0000 0.0000 64.0522 31.3348 175.9438 22 Y 4.7153 7.1392 116.6321 56.0677 39.3575 173.7515 23 P 4.8518 0.0000 0.0000 62.4153 33.4516 175.2486 24 I 4.4670 8.3757 120.3897 59.7052 40.0398 174.8551 25 R 4.8815 8.3241 126.4179 54.4267 31.8420 175.7102 26 F 5.0576 8.4732 116.5097 55.9713 41.6488 172.3656 27 E 5.3015 9.2863 121.0603 54.7228 32.1936 174.9364 28 G 4.4459 9.1256 112.2322 44.9127 0.0000 171.4319 29 K 4.9643 8.5514 119.2299 55.4040 34.0448 176.3574 30 V 4.4070 8.9960 125.9056 62.1688 32.0894 175.4289 31 V 4.0238 8.5354 128.8702 61.2050 32.7706 175.8534 32 H 4.0808 9.0036 120.2969 55.6577 25.7650 176.4691 33 G 3.8059 7.7625 109.2560 45.4721 0.0000 172.8807 34 F 4.6487 8.2503 117.4006 54.8770 39.0094 176.3916 35 G 3.8763 8.4949 115.3136 45.4980 0.0000 173.9218 36 R 4.1352 8.7004 120.6523 58.6950 29.9266 179.6805 37 G 3.6244 8.0751 105.6137 47.9672 0.0000 175.8413 38 S 4.2109 8.0648 117.1465 60.5667 63.0324 176.2063 39 K 3.9820 7.9791 123.3002 59.4011 31.7387 178.4379 40 E 4.0515 8.3064 118.8148 58.6594 29.6320 177.7960 41 L 4.4461 7.5362 116.6973 54.0840 41.9956 176.9982 42 G 3.9720 7.9810 106.9990 46.5675 0.0000 174.5904 43 I 4.6454 7.8126 121.0764 57.3170 37.3137 172.1475 44 P 4.3945 0.0000 0.0000 63.7051 31.9426 175.8664 45 T 5.2619 8.9078 119.8290 61.5111 72.2559 172.5941 46 A 4.4746 9.2042 127.4142 49.9910 22.3588 174.3849 47 N 5.0905 8.4185 119.8835 51.8087 40.3886 174.5694 48 I 4.4938 8.3674 125.8000 60.6320 38.1382 176.2001 49 S 4.0812 8.5144 121.7160 58.2713 62.3528 173.5735 50 E 3.9462 9.2003 127.6935 59.3493 29.4806 177.2110 51 D 4.3911 7.6907 115.6502 54.2577 40.0519 176.3265 52 A 3.8934 8.7327 122.3605 52.2299 17.0564 178.5576 53 I 4.0313 6.9687 105.8888 60.4837 39.5956 177.9856 54 Q 3.8698 8.1716 119.6596 59.1362 28.8414 177.8093 55 E 4.0245 8.0876 116.7488 59.2749 29.7714 179.2244 56 L 3.9704 7.7728 116.8205 56.8480 41.9583 177.6989 57 L 4.4562 7.5525 116.8995 54.6549 42.2744 178.7605 58 R 3.3629 6.9302 120.9280 59.2077 30.1047 176.7033 59 Y 4.6282 7.5109 111.4417 57.6088 38.4149 175.6080 60 R 4.4121 7.8218 119.6060 55.2285 31.2214 176.3835 61 D 4.6537 8.3708 121.4154 53.6070 41.7121 176.5281 62 S 4.5325 8.3444 116.3192 58.4681 64.2382 174.0278 63 G 3.7940 7.9838 107.0956 44.4714 0.0000 171.6237 64 V 4.8295 8.2445 121.1112 61.6496 33.4210 176.1482 65 Y 5.1943 9.5610 125.3659 56.2716 41.7475 174.2260 66 F 5.3567 9.1378 114.5009 54.4813 41.8474 175.4723 67 G 4.6121 7.6311 107.5845 46.7763 0.0000 171.9677 68 Y 5.5569 8.5205 121.0480 56.3032 42.5523 174.2215 69 A 5.1350 9.3718 122.1905 50.7038 23.4484 174.6716 70 M 5.0971 9.4122 120.7256 53.7662 35.1902 174.8222 71 V 4.7304 8.8333 124.3945 61.9217 35.8069 174.5271 72 Q 3.5525 9.5467 123.0611 56.0990 26.2474 174.1965 73 K 3.9274 8.2619 109.9733 57.2378 30.3106 175.7946 74 R 4.5607 8.0278 116.8408 54.3348 34.1720 174.3644 75 V 4.5101 7.8111 121.9762 61.3358 33.1726 174.9130 76 F 5.1720 9.2173 125.6571 54.8738 43.4404 172.7697 77 P 5.1562 0.0000 0.0000 63.6508 33.0280 174.5203 78 M 5.2176 8.6429 117.0131 54.9229 35.1234 173.5339 79 V 5.0758 8.5889 111.5100 59.8854 36.2010 174.7998 80 M 5.2688 9.2917 122.8252 54.1810 36.0244 173.8194 81 S 5.2169 9.2003 122.5693 57.3943 64.9841 173.2639 82 V 5.6230 9.3558 124.8679 60.2478 34.4453 174.8040 *94 S 4.5189 8.4765 119.9219 58.2182 64.2313 172.4270 95 A 5.0650 8.1097 122.6228 50.5739 22.5004 174.2991 96 E 4.8263 9.5434 124.6071 54.4455 32.3071 174.6873 97 V 4.5574 9.0116 128.2379 61.8878 33.6894 174.1300 98 H 5.3328 9.0296 125.8125 54.0163 30.4463 174.0670 99 L 4.3880 8.9174 124.6560 54.5794 42.5070 177.0294 100 I 4.5364 8.2927 124.0710 60.0750 38.1768 175.0967 101 E 4.9409 8.4387 122.8855 55.8309 31.6804 175.0630 102 R 4.7633 8.5975 118.5600 56.6061 31.2453 176.1732 103 Q 4.4723 8.6974 115.8252 54.6745 30.7215 175.6135 104 G 3.8040 8.3786 105.1063 46.4432 0.0000 173.9424 105 E 3.8043 8.4255 117.2423 55.9314 30.2033 177.7223 106 D 4.3874 7.9342 121.1654 53.2250 40.2505 175.0385 107 F 4.5694 7.9641 125.1165 55.7423 40.1812 175.6423 108 Y 5.1360 9.1827 120.8535 57.3554 42.3167 175.4152 109 E 4.1765 7.8866 120.0658 56.9212 30.1425 176.7279 110 E 4.6590 8.7263 118.4538 56.5520 31.0971 175.3552 111 I 4.9944 7.7570 120.6917 59.5883 39.8742 174.6502 112 M 5.0500 9.0586 125.6613 53.8679 36.0251 173.8120 113 R 5.1706 8.7569 124.0678 54.5600 32.8676 175.3111 114 V 4.8955 8.7557 123.5196 61.0533 35.2070 174.3817 115 I 4.8205 8.9855 127.4060 59.4827 40.4317 174.6179 116 V 4.2206 8.8090 129.0571 62.4453 31.9409 176.3063 117 L 4.2035 8.3695 127.8377 55.2285 43.6604 176.0934 118 G 2.6466 6.1181 104.0157 45.5196 0.0000 171.2034 119 Y 4.8985 7.9809 120.2396 56.2803 40.8359 175.3914 120 I 4.0741 7.8589 126.5611 61.8518 38.7667 175.8809 121 R 4.1719 6.0278 115.3507 54.8250 31.9892 171.9884 122 P 5.3891 0.0000 0.0000 61.0402 32.6097 175.7566 123 E 4.1509 8.5621 117.9864 56.5571 29.8813 176.6796 124 L 4.8333 7.9933 120.7285 52.5565 44.5373 176.3167 125 N 4.4904 8.5022 118.5769 53.0805 39.0647 174.7710 126 Y 4.2129 8.7371 123.7499 58.2327 39.2054 175.6948 127 A 4.4169 7.8974 130.5802 51.9111 20.1032 176.1863 128 G 3.7180 6.0311 105.0029 46.1422 0.0000 175.5070 129 L 4.0151 8.6017 120.5630 58.4061 42.0617 179.1546 130 D 4.3342 8.0033 118.2608 57.0722 40.6827 178.5665 131 K 3.8754 7.8587 119.8589 59.1683 32.3268 178.3846 132 L 3.9383 7.8174 120.6336 58.4195 42.0758 179.1134 133 I 3.7077 7.9585 119.7675 64.4503 37.0323 178.3755 134 E 4.0708 8.5757 119.8192 59.4158 29.2509 179.1212 135 D 4.3724 8.4085 119.3367 57.2648 40.7812 178.8821 136 I 3.6760 7.5779 119.9195 64.7344 37.1054 178.2200 137 H 4.1866 8.0707 116.9939 58.9681 28.3981 178.1444 138 T 3.8000 8.0013 117.5686 66.7774 68.2922 176.2453 139 D 4.2989 8.4328 121.1583 57.6420 40.7954 179.2344 140 I 3.6548 7.8864 120.0245 64.2911 37.1188 178.3703 141 R 3.8110 7.8552 119.4644 59.5512 29.9066 178.7562 142 V 3.5857 7.8940 117.8167 65.6666 31.4463 177.8522 143 A 3.2229 8.1026 120.9185 54.8723 18.0283 179.3982 144 L 3.8795 7.6140 116.1147 58.0823 42.0164 179.3001 145 N 4.3929 7.9409 116.0359 56.6200 38.3277 177.7859 146 S 3.8678 7.8900 115.0817 60.9650 61.7614 175.6575 147 M 4.3807 7.6867 119.6349 55.4399 31.7957 177.3936 148 D 4.5354 7.7508 119.5341 56.0742 41.9378 176.7743 149 R 4.2454 7.0816 116.5648 55.0788 30.8888 175.5569 150 P 4.3908 0.0000 0.0000 65.7642 30.7870 178.7744 151 S 4.1348 8.2381 111.1543 60.8292 62.5640 175.2887 152 Y 4.5099 8.2257 119.2479 60.8653 37.9992 177.7863 153 S 4.7696 8.9477 116.7971 60.9271 62.9219 176.5860 154 S 4.2556 8.0725 117.7450 61.2052 62.7122 175.4802 155 Y 4.1522 8.2925 119.5309 59.4234 37.3754 177.6017 156 K 3.5894 7.8208 120.7138 58.0687 32.1563 177.1488 157 K 4.5587 7.4127 117.0950 55.8054 32.5838 175.7941 158 D 4.3867 7.9159 119.4540 53.7660 41.6931 175.6951 159 P 4.4227 0.0000 0.0000 65.5412 31.5554 178.3829 160 F 4.2588 8.4760 119.5791 60.6547 39.2690 175.4817 161 F 4.9630 8.1109 118.0569 57.0458 38.8911 175.6814 162 K 4.0776 8.0469 128.4336 56.9069 31.8694 176.3096 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 P 0.00 4.35 0.00 2.35 2.09 0.00 3.68 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 1.82 1.93 0.00 11 E 8.66 3.84 0.00 1.99 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 2.32 2.30 0.00 12 I 8.01 4.54 1.78 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.83 0.86 0.00 0.00 13 V 7.98 4.41 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 0.69 0.00 0.00 0.70 0.00 0.00 14 G 8.81 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 15 P 0.00 4.62 0.00 2.30 2.19 0.00 4.01 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.13 0.00 16 E 9.04 4.26 0.00 2.06 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 0.00 2.40 2.33 0.00 17 K 7.76 4.56 0.00 1.84 1.80 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.36 7.81 18 V 8.17 3.61 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 0.51 0.00 0.00 0.12 0.00 0.00 19 Q 8.33 4.63 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.24 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.54 0.00 20 S 8.59 4.19 0.00 3.79 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 21 P 0.00 4.19 0.00 1.29 1.81 0.00 3.08 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.88 0.00 22 Y 7.14 4.72 0.00 2.87 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 23 P 0.00 4.85 0.00 1.79 1.36 0.00 3.68 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 1.89 1.94 0.00 24 I 8.38 4.47 1.93 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.87 1.01 0.00 0.00 25 R 8.32 4.88 0.00 1.02 0.66 0.00 2.80 0.00 0.00 2.40 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.29 0.00 26 F 8.47 5.06 0.00 3.23 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 27 E 9.29 5.30 0.00 2.11 2.01 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 2.26 2.46 0.00 28 G 9.13 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 0.00 0.00 0.00 0.00 29 K 8.55 4.96 0.00 1.73 1.73 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.52 1.46 7.81 30 V 9.00 4.41 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.87 0.00 0.00 31 V 8.54 4.02 1.99 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 0.74 0.00 0.00 0.61 0.00 0.00 32 H 9.00 4.08 0.00 3.33 3.46 0.00 5.85 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 33 G 7.76 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 34 F 8.25 4.65 0.00 3.12 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 35 G 8.49 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 0.00 0.00 0.00 36 R 8.70 4.14 0.00 1.87 2.03 0.00 3.36 0.00 0.00 3.38 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.67 0.00 37 G 8.08 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 38 S 8.06 4.21 0.00 4.33 4.18 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 39 K 7.98 3.98 0.00 2.04 2.10 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.52 7.81 40 E 8.31 4.05 0.00 2.17 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 0.00 2.34 2.41 0.00 41 L 7.54 4.45 0.00 1.78 1.72 0.93 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.98 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 43 I 7.81 4.65 1.86 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.89 0.86 0.00 0.00 44 P 0.00 4.39 0.00 1.58 2.20 0.00 3.73 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 1.76 1.94 0.00 45 T 8.91 5.26 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 1.29 0.00 0.00 46 A 9.20 4.47 0.79 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 0.00 0.00 47 N 8.42 5.09 0.00 2.68 2.72 0.00 0.00 7.18 7.27 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 48 I 8.37 4.49 1.89 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.00 1.02 0.00 0.00 49 S 8.51 4.08 0.00 3.87 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 50 E 9.20 3.95 0.00 2.04 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 2.35 2.34 0.00 51 D 7.69 4.39 0.00 2.80 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 52 A 8.73 3.89 1.49 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 0.00 0.00 53 I 6.97 4.03 1.34 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.72 0.22 0.00 0.00 54 Q 8.17 3.87 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.11 0.00 0.00 0.00 0.00 0.00 2.45 2.27 0.00 55 E 8.09 4.02 0.00 2.01 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 2.35 2.32 0.00 56 L 7.77 3.97 0.00 1.48 1.69 0.90 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 57 L 7.55 4.46 0.00 1.59 1.47 0.67 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 58 R 6.93 3.36 0.00 1.56 1.18 0.00 3.00 0.00 0.00 2.94 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.82 0.00 59 Y 7.51 4.63 0.00 2.91 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 60 R 7.82 4.41 0.00 1.81 1.87 0.00 3.15 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 61 D 8.37 4.65 0.00 2.50 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 62 S 8.34 4.53 0.00 4.24 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 63 G 7.98 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 0.00 0.00 0.00 64 V 8.24 4.83 1.91 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 1.01 0.00 0.00 0.91 0.00 0.00 65 Y 9.56 5.19 0.00 3.06 2.98 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 66 F 9.14 5.36 0.00 3.11 2.98 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 67 G 7.63 4.61 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 0.00 0.00 0.00 68 Y 8.52 5.56 0.00 3.43 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 69 A 9.37 5.14 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 70 M 9.41 5.10 0.00 1.94 1.11 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.39 0.00 71 V 8.83 4.73 2.27 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 1.09 0.00 0.00 0.99 0.00 0.00 72 Q 9.55 3.55 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.60 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 73 K 8.26 3.93 0.00 1.89 1.86 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.43 7.81 74 R 8.03 4.56 0.00 1.84 1.34 0.00 3.09 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.74 0.00 75 V 7.81 4.51 1.73 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 0.38 0.00 0.00 0.24 0.00 0.00 76 F 9.22 5.17 0.00 2.99 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 77 P 0.00 5.16 0.00 2.16 2.36 0.00 4.11 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.12 0.00 78 M 8.64 5.22 0.00 2.20 2.33 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.63 0.00 79 V 8.59 5.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.01 0.00 0.00 80 M 9.29 5.27 0.00 2.15 1.94 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.63 0.00 81 S 9.20 5.22 0.00 3.84 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 82 V 9.36 5.62 2.37 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 1.01 0.00 0.00 0.93 0.00 0.00 *94 S 8.48 4.52 0.00 4.05 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 95 A 8.11 5.06 1.20 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 96 E 9.54 4.83 0.00 1.96 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.14 0.00 97 V 9.01 4.56 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 0.91 0.00 0.00 1.02 0.00 0.00 98 H 9.03 5.33 0.00 3.09 3.17 0.00 5.67 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.92 4.39 0.00 1.08 1.20 -0.30 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.29 4.54 2.08 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 1.31 0.60 0.97 0.00 0.00 101 E 8.44 4.94 0.00 2.24 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 0.00 2.20 2.41 0.00 102 R 8.60 4.76 0.00 1.81 1.95 0.00 3.34 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 103 Q 8.70 4.47 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.61 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 104 G 8.38 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 0.00 0.00 0.00 105 E 8.43 3.80 0.00 1.28 1.17 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 2.29 2.51 0.00 106 D 7.93 4.39 0.00 2.53 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 0.00 107 F 7.96 4.57 0.00 2.03 1.45 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 0.00 108 Y 9.18 5.14 0.00 3.06 3.06 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 0.00 109 E 7.89 4.18 0.00 1.99 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 2.39 2.09 0.00 110 E 8.73 4.66 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 111 I 7.76 4.99 1.90 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 1.26 0.63 0.94 0.00 0.00 112 M 9.06 5.05 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 113 R 8.76 5.17 0.00 1.90 1.80 0.00 2.77 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.44 0.00 114 V 8.76 4.90 0.67 0.00 0.00 0.00 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 0.82 0.00 0.00 115 I 8.99 4.82 2.08 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.79 0.79 0.00 0.00 116 V 8.81 4.22 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 1.00 0.00 0.00 1.04 0.00 0.00 117 L 8.37 4.20 0.00 1.21 1.56 1.19 0.16 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 0.00 118 G 6.12 2.65 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 0.00 0.00 0.00 119 Y 7.98 4.90 0.00 3.00 2.81 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 0.00 120 I 7.86 4.07 1.76 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.92 0.73 0.00 0.00 121 R 6.03 4.17 0.00 1.68 1.78 0.00 2.88 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.34 0.00 122 P 0.00 5.39 0.00 2.28 2.27 0.00 3.34 0.00 0.00 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 123 E 8.56 4.15 0.00 2.03 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 2.37 2.41 0.00 124 L 7.99 4.83 0.00 1.62 1.56 0.93 1.03 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 0.00 125 N 8.50 4.49 0.00 2.73 2.80 0.00 0.00 6.89 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 0.00 126 Y 8.74 4.21 0.00 2.86 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 0.00 127 A 7.90 4.42 1.09 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 0.00 128 G 6.03 3.72 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 0.00 0.00 0.00 129 L 8.60 4.02 0.00 1.87 1.71 0.98 1.21 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 0.00 130 D 8.00 4.33 0.00 2.77 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 0.00 131 K 7.86 3.88 0.00 1.76 1.65 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.34 7.81 132 L 7.82 3.94 0.00 1.98 1.95 1.11 1.00 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 0.00 133 I 7.96 3.71 2.00 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 1.52 0.72 0.93 0.00 0.00 134 E 8.58 4.07 0.00 2.02 1.99 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 2.33 2.41 0.00 135 D 8.41 4.37 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 0.00 136 I 7.58 3.68 1.87 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.67 0.69 0.00 0.00 137 H 8.07 4.19 0.00 3.32 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 8.00 3.80 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 1.16 0.00 0.00 139 D 8.43 4.30 0.00 2.79 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 0.00 140 I 7.89 3.65 2.04 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.72 0.92 0.00 0.00 141 R 7.86 3.81 0.00 1.87 2.03 0.00 3.04 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.61 0.00 142 V 7.89 3.59 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 0.70 0.00 0.00 0.90 0.00 0.00 143 A 8.10 3.22 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 0.00 144 L 7.61 3.88 0.00 1.82 1.72 0.94 1.01 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 0.00 145 N 7.94 4.39 0.00 2.86 2.75 0.00 0.00 7.09 7.52 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 0.00 146 S 7.89 3.87 0.00 2.83 3.29 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 0.00 147 M 7.69 4.38 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.77 0.00 148 D 7.75 4.54 0.00 2.84 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 0.00 149 R 7.08 4.25 0.00 2.17 2.05 0.00 3.33 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.59 0.00 150 P 0.00 4.39 0.00 2.31 2.38 0.00 3.98 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 2.17 1.96 0.00 151 S 8.24 4.13 0.00 3.94 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 0.00 152 Y 8.23 4.51 0.00 3.53 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 0.00 153 S 8.95 4.77 0.00 4.17 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 8.07 4.26 0.00 3.92 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 0.00 155 Y 8.29 4.15 0.00 3.62 3.28 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 0.00 156 K 7.82 3.59 0.00 1.20 1.61 0.00 1.56 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.18 0.87 7.81 157 K 7.41 4.56 0.00 1.76 1.76 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.29 7.81 158 D 7.92 4.39 0.00 2.97 2.26 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 0.00 159 P 0.00 4.42 0.00 2.24 2.11 0.00 3.63 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 2.10 2.07 0.00 160 F 8.48 4.26 0.00 2.77 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 0.00 161 F 8.11 4.96 0.00 3.21 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 K 8.05 4.08 0.00 1.91 1.72 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.41 7.81 * Residues marked with a * may have inaccurate shift predictions.