NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 S 4.5363 8.3349 117.1038 58.1265 64.0833 172.2294 10 I 4.4677 8.0687 116.9782 61.2590 40.5238 173.0302 11 I 4.4445 8.7551 127.5047 60.0994 40.0719 175.7052 12 R 4.4908 8.5029 124.1141 55.1446 30.6380 171.9856 13 F 5.0775 7.5713 113.9487 55.2997 40.9144 173.8980 14 S 4.5705 8.6128 117.8007 57.4220 63.9712 174.0003 15 V 4.4896 8.1447 123.1948 61.1109 33.7914 174.7202 16 S 4.8126 8.3180 122.7502 56.9521 64.6511 173.1403 17 L 4.3408 7.8647 124.5790 54.3673 42.5691 175.3761 18 Q 4.1970 8.2120 121.2405 56.7087 29.8589 176.6087 19 Q 4.1934 8.9096 127.5224 59.6519 29.1564 179.0636 20 N 4.2503 8.2771 119.4691 57.8544 37.6006 178.1072 21 L 4.2338 7.9088 121.6386 58.1221 42.1455 178.9085 22 L 3.9961 8.2217 120.2091 58.1895 41.7157 178.6892 23 D 4.3093 8.0963 118.4237 57.2646 40.8795 178.2581 24 E 4.1135 7.8473 117.8657 59.3520 29.4302 178.8194 25 L 3.9391 7.8329 120.0675 58.2669 42.0601 178.5273 26 D 4.4616 8.6834 118.6240 56.5641 40.9652 177.8860 27 N 4.5615 7.7211 117.2146 55.3807 39.3054 175.9594 28 R 4.6232 8.0884 120.2521 56.5653 30.5129 178.7874 29 I 3.9755 7.6772 124.2977 66.1019 35.5825 183.2141 30 I 4.0777 7.7225 116.9770 62.2372 35.7269 179.5118 31 K 4.1527 8.2740 121.0051 60.2070 32.1438 178.6144 32 N 4.5918 8.0840 113.4405 52.1904 37.4196 178.2594 33 G 3.8005 7.6449 106.3263 46.3334 0.0000 173.7791 34 Y 4.7210 7.4249 117.0981 57.3244 38.9205 175.4208 35 S 4.6843 8.4468 114.6414 58.7046 64.6387 174.5122 36 S 4.7202 7.7695 116.4891 55.8584 65.8707 175.3505 37 R 3.8670 8.6618 123.0370 61.7449 28.6261 179.9367 38 S 4.2475 8.0586 114.6407 62.1414 62.7298 176.8880 39 E 3.7795 7.6520 120.4590 58.8575 29.0557 179.2617 40 L 3.4242 6.8681 120.2153 57.7165 42.1764 178.9810 41 V 3.5319 7.1819 118.0349 65.7539 31.3944 177.8392 42 R 3.8849 9.4212 118.4508 59.7911 29.8227 178.2360 43 D 4.4312 7.8146 118.5282 57.2806 40.8171 178.7006 44 M 4.0715 8.1549 119.4374 58.3386 31.9079 178.8094 45 I 3.7111 8.1818 120.3487 64.3089 37.3299 178.2866 46 R 4.0197 8.3242 119.8748 59.6082 29.9333 178.0068 47 E 3.9442 8.3866 119.0549 59.3047 29.5570 178.7664 48 K 4.0217 8.3206 119.6767 59.4700 32.2907 178.8918 49 L 4.0098 8.2689 119.5179 57.5972 41.4746 179.6527 50 V 3.9480 8.2535 118.3974 66.0948 31.6338 177.8558 51 E 4.0052 8.2810 118.3345 59.6737 29.1135 179.0980 52 D 4.4353 8.1712 117.6899 57.4529 41.0450 178.1193 53 N 4.5328 8.4617 117.5341 56.6024 38.8190 177.0265 54 W 4.0269 8.6171 119.0090 59.1053 29.2214 177.7192 55 A 4.3720 7.9147 119.0801 52.4746 18.2409 176.1006 56 E 4.5379 7.4204 114.5951 54.1109 32.1271 175.1345 57 D 4.1739 8.1643 116.6551 53.8386 39.8243 173.6642 58 N 4.6391 7.4575 126.4541 49.9579 38.5174 173.3002 59 P 4.3583 0.0000 0.0000 63.9826 32.0628 176.9663 60 N 4.6372 7.7847 115.1384 54.0697 39.6450 174.9997 61 D 4.5327 7.7362 116.9700 54.3973 41.8195 175.2746 62 E 4.7437 8.3171 122.4528 56.4567 31.1389 176.1610 63 S 4.5183 8.2137 112.9277 58.3296 63.2785 174.4630 64 K 4.1051 7.6382 119.9869 57.1727 32.5874 175.7083 65 I 5.2087 8.4987 123.1846 59.6136 41.3262 173.7595 66 A 4.7671 8.8199 128.0884 51.1767 23.6058 174.9557 67 V 4.7485 8.6959 118.6957 61.1076 34.6356 173.9111 68 L 4.9043 8.8953 130.3464 53.5731 43.9796 174.8531 69 V 4.8436 8.8582 127.0687 61.3195 33.6495 174.4979 70 V 5.1037 8.8973 127.2389 61.2106 35.1964 173.9333 71 I 5.2829 9.1205 128.2671 59.7886 39.8249 174.2567 72 Y 5.2860 8.8825 124.0626 55.5763 42.3681 173.9787 73 D 4.9073 9.0793 121.0713 53.3498 41.2344 176.5027 74 H 4.6236 8.2416 121.8072 56.9973 29.0864 176.6230 75 H 4.4190 7.9778 117.8275 58.3933 29.0942 175.7203 76 Q 4.0368 8.0502 121.4927 55.7735 29.0740 175.7815 77 R 4.1426 8.4620 124.7896 57.7407 30.7461 177.3068 78 E 3.9621 9.0379 119.2228 57.2587 28.3835 176.4739 79 L 3.9265 7.8489 120.3588 58.1010 42.1703 177.9735 80 N 4.0855 8.3198 116.5196 56.9862 38.8705 176.3477 81 Q 3.9317 8.0296 120.2066 59.0225 29.1360 177.7907 82 R 3.8691 8.5830 120.2548 59.8174 30.0732 178.4687 83 M 3.9811 8.2327 118.6368 58.2279 31.8826 178.8782 84 I 3.5667 7.5640 119.9875 64.3996 37.3153 178.0548 85 D 4.3301 8.4930 119.9751 57.4941 40.4415 178.9860 86 I 3.6762 7.6468 119.0061 64.3756 37.4154 177.8898 87 Q 4.1089 8.1423 120.2678 59.7069 28.6945 178.0192 88 H 4.2583 8.4570 115.8392 58.8031 28.8568 176.9636 89 A 4.3182 7.9336 120.2442 53.3457 18.7298 178.9779 90 S 4.2873 7.9015 112.4572 59.2177 63.4782 175.6318 91 G 3.9740 8.3092 109.8492 45.3352 0.0000 173.5829 92 T 4.1785 7.5959 109.4639 61.5721 69.7954 173.1549 93 H 4.9205 9.1696 122.6761 54.3676 32.1692 172.9545 94 V 4.1750 8.3718 126.4131 62.6250 31.3986 175.5604 95 L 4.2095 8.8904 129.1891 57.4471 42.5986 177.0250 96 C 4.7308 7.4421 114.9486 58.7881 34.8641 172.8437 97 T 5.1627 8.6136 121.0863 62.1205 71.5770 173.2414 98 T 4.8001 8.9591 122.2895 61.6686 71.8001 173.0741 99 A 5.3982 8.5753 126.0923 50.1880 22.3364 175.2240 100 I 4.7271 8.8618 114.1043 58.8805 41.4857 174.5479 101 A 4.5113 8.5771 126.9107 52.1673 19.3412 177.3419 102 M 4.3380 8.5472 122.2130 56.6936 33.8708 175.5757 103 D 4.5377 7.4627 118.0845 53.1865 41.6921 175.4374 104 E 3.8304 9.1053 116.3646 60.0462 30.0371 173.7312 *105 H 4.3227 8.9907 117.6034 55.7877 30.5770 177.1293 106 N 5.1387 7.7553 114.9417 52.1284 40.3171 174.9571 107 S 5.1707 8.5273 119.0192 56.5818 66.7729 172.5646 108 L 5.4180 8.8549 125.0058 53.3457 44.2957 174.9736 109 E 5.3917 9.4754 124.1177 54.6894 33.2672 174.5144 110 T 5.0476 9.0398 112.5322 60.0895 71.4838 172.9438 111 I 4.7939 8.7608 127.1849 59.4878 40.0203 174.6124 112 I 4.5822 8.8272 129.5928 60.4462 38.5730 175.2246 113 L 5.3046 9.0655 126.7094 52.9522 45.7694 175.3685 114 Q 5.0350 9.9709 122.6012 53.6525 33.0495 175.5516 115 G 3.7812 7.7531 111.4324 45.3285 0.0000 171.1488 116 N 4.8295 7.9450 117.5785 51.5176 40.1869 175.9908 117 S 3.7427 7.9892 116.5637 61.5692 62.9053 176.4431 118 F 4.6386 8.0838 120.7557 60.7223 38.7861 177.1539 119 E 4.0649 9.2619 118.2250 59.6424 29.3053 179.7596 120 I 3.8197 8.0069 119.6281 64.5591 37.2791 178.3204 121 Q 4.0776 8.5709 120.5451 59.2028 28.8103 178.2994 122 R 3.9173 8.3056 119.9294 59.0476 30.0889 178.0970 123 L 3.9340 8.0430 120.3137 58.2013 42.0187 178.7633 124 Q 3.9250 8.0638 119.3087 59.2443 28.7964 178.2552 125 L 3.9587 7.7815 118.5748 57.8452 41.9170 179.1624 126 E 4.1060 8.5647 118.8606 59.5088 29.4690 179.5006 127 I 3.8032 7.9787 120.0551 64.2870 36.9653 178.7297 128 G 3.7908 8.2350 105.4520 46.8680 0.0000 174.9466 129 G 3.8720 7.4794 105.4347 44.2485 0.0000 173.9601 130 L 4.2619 7.3872 122.4173 53.7295 42.4967 176.5010 131 R 4.0996 8.3871 123.3957 57.9367 30.5600 176.7391 132 G 3.9606 9.1823 113.4953 45.0373 0.0000 172.6458 133 V 4.4807 7.4084 119.9740 61.9457 31.7264 175.5651 134 K 4.4427 9.0369 127.4926 57.7715 33.1510 177.0472 135 F 4.6725 7.9398 119.4470 57.2091 42.8903 172.8147 136 A 4.8042 7.9339 127.9837 50.7367 21.2202 174.9790 137 K 4.3312 8.9279 123.2841 55.0998 35.8501 174.6512 138 L 4.9952 8.4297 128.4769 53.9445 43.9959 175.3367 139 T 4.4427 9.1573 123.2459 62.0669 70.1404 173.8003 140 K 4.5527 8.3723 125.7528 54.7210 33.8795 175.8621 141 A 5.1325 8.6369 123.7977 50.4062 22.3421 175.7800 142 S 4.8675 9.3324 115.9767 56.2370 66.4740 175.9842 143 S 2.7900 8.4292 118.1026 60.6606 62.7600 176.5301 144 F 4.4917 7.7514 114.8670 59.1794 37.7855 176.2029 145 E 4.0586 7.1674 121.1750 58.3703 29.3158 176.8928 146 Y 4.8120 6.8199 112.4607 55.9646 39.6307 174.9067 147 N 4.5760 8.3554 123.4814 53.5203 38.7400 174.6577 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 9 S 8.33 4.54 0.00 3.65 3.77 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 10 I 8.07 4.47 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 1.44 1.10 0.93 0.00 0.00 11 I 8.76 4.44 1.96 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.51 0.99 0.00 0.00 12 R 8.50 4.49 0.00 1.82 1.70 0.00 3.25 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.17 0.00 13 F 7.57 5.08 0.00 3.06 2.99 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 14 S 8.61 4.57 0.00 3.93 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 V 8.14 4.49 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 0.88 0.00 0.00 1.05 0.00 0.00 16 S 8.32 4.81 0.00 3.90 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.86 4.34 0.00 1.69 1.60 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.21 4.20 0.00 2.08 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.88 0.00 0.00 0.00 0.00 0.00 2.36 1.98 0.00 19 Q 8.91 4.19 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.68 0.00 20 N 8.28 4.25 0.00 2.76 2.83 0.00 0.00 6.48 6.67 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 21 L 7.91 4.23 0.00 1.75 1.83 0.92 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.22 4.00 0.00 1.78 1.80 0.96 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.10 4.31 0.00 2.86 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 24 E 7.85 4.11 0.00 2.08 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 2.33 2.50 0.00 25 L 7.83 3.94 0.00 1.79 1.78 0.90 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 26 D 8.68 4.46 0.00 2.81 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 27 N 7.72 4.56 0.00 2.67 3.06 0.00 0.00 7.05 8.48 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 28 R 8.09 4.62 0.00 1.92 1.95 0.00 3.37 0.00 0.00 3.23 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 29 I 7.68 3.98 1.87 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 1.50 0.73 0.91 0.00 0.00 30 I 7.72 4.08 1.87 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 1.41 1.10 0.91 0.00 0.00 31 K 8.27 4.15 0.00 2.00 1.89 0.00 1.64 0.00 0.00 1.95 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.53 7.81 32 N 8.08 4.59 0.00 2.77 2.69 0.00 0.00 7.27 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 33 G 7.64 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 34 Y 7.42 4.72 0.00 3.18 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 35 S 8.45 4.68 0.00 4.04 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 36 S 7.77 4.72 0.00 3.93 3.93 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 37 R 8.66 3.87 0.00 1.84 2.00 0.00 3.28 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.31 0.00 38 S 8.06 4.25 0.00 3.76 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 39 E 7.65 3.78 0.00 1.38 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 2.31 2.28 0.00 40 L 6.87 3.42 0.00 1.54 1.45 0.99 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 41 V 7.18 3.53 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 0.94 0.00 0.00 0.90 0.00 0.00 42 R 9.42 3.88 0.00 1.99 1.86 0.00 3.17 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 43 D 7.81 4.43 0.00 2.75 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 44 M 8.15 4.07 0.00 2.07 2.22 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 2.75 2.59 0.00 45 I 8.18 3.71 2.09 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.83 0.97 0.00 0.00 46 R 8.32 4.02 0.00 1.94 2.15 0.00 3.15 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 47 E 8.39 3.94 0.00 2.16 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 0.00 2.31 2.31 0.00 48 K 8.32 4.02 0.00 2.00 1.81 0.00 1.60 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.54 7.81 49 L 8.27 4.01 0.00 1.88 1.54 0.80 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 50 V 8.25 3.95 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 0.96 0.00 0.00 1.09 0.00 0.00 51 E 8.28 4.01 0.00 2.27 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 2.29 2.57 0.00 52 D 8.17 4.44 0.00 2.83 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 53 N 8.46 4.53 0.00 3.05 3.38 0.00 0.00 7.25 7.58 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 54 W 8.62 4.03 0.00 3.41 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 55 A 7.91 4.37 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 E 7.42 4.54 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 2.46 2.16 0.00 57 D 8.16 4.17 0.00 2.87 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 58 N 7.46 4.64 0.00 2.59 2.74 0.00 0.00 6.92 8.02 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 59 P 0.00 4.36 0.00 2.24 2.26 0.00 3.66 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 1.98 2.00 0.00 60 N 7.78 4.64 0.00 2.69 2.88 0.00 0.00 6.91 8.06 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 61 D 7.74 4.53 0.00 2.71 2.43 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 62 E 8.32 4.74 0.00 1.90 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 2.33 2.20 0.00 63 S 8.21 4.52 0.00 3.85 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 64 K 7.64 4.11 0.00 1.67 1.28 0.00 1.27 0.00 0.00 1.38 0.00 0.00 2.50 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.44 7.81 65 I 8.50 5.21 1.90 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.73 0.90 0.00 0.00 66 A 8.82 4.77 1.48 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 0.00 0.00 67 V 8.70 4.75 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 0.95 0.00 0.00 0.94 0.00 0.00 68 L 8.90 4.90 0.00 1.81 1.52 0.95 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.86 4.84 2.32 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 1.14 0.00 0.00 1.00 0.00 0.00 70 V 8.90 5.10 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 1.08 0.00 0.00 0.94 0.00 0.00 71 I 9.12 5.28 2.00 0.00 0.00 0.60 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 0.57 0.97 0.00 0.00 72 Y 8.88 5.29 0.00 3.19 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 73 D 9.08 4.91 0.00 2.72 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 H 8.24 4.62 0.00 3.26 2.94 0.00 5.61 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 H 7.98 4.42 0.00 3.32 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.05 4.04 0.00 2.11 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.98 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 77 R 8.46 4.14 0.00 1.86 1.88 0.00 3.53 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 78 E 9.04 3.96 0.00 2.32 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 1.85 0.00 79 L 7.85 3.93 0.00 1.86 1.90 0.92 0.78 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 80 N 8.32 4.09 0.00 2.99 2.89 0.00 0.00 6.75 6.80 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 81 Q 8.03 3.93 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.67 0.00 0.00 0.00 0.00 0.00 2.43 2.62 0.00 82 R 8.58 3.87 0.00 2.03 2.07 0.00 3.19 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 83 M 8.23 3.98 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.44 0.00 84 I 7.56 3.57 1.93 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 1.45 0.59 0.66 0.00 0.00 85 D 8.49 4.33 0.00 2.75 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 7.65 3.68 1.97 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 1.39 0.57 0.95 0.00 0.00 87 Q 8.14 4.11 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 88 H 8.46 4.26 0.00 3.23 3.34 0.00 5.72 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.93 4.32 1.34 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 90 S 7.90 4.29 0.00 4.09 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 91 G 8.31 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 92 T 7.60 4.18 4.29 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 1.26 0.00 0.00 93 H 9.17 4.92 0.00 3.15 3.31 0.00 5.59 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 94 V 8.37 4.17 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 0.87 0.00 0.00 0.99 0.00 0.00 95 L 8.89 4.21 0.00 1.49 1.67 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 96 C 7.44 4.73 0.00 2.93 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 97 T 8.61 5.16 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 1.27 0.00 0.00 98 T 8.96 4.80 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 99 A 8.58 5.40 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 0.00 100 I 8.86 4.73 1.86 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 1.16 1.36 0.91 0.00 0.00 101 A 8.58 4.51 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 0.00 102 M 8.55 4.34 0.00 1.98 2.08 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 2.53 2.42 0.00 103 D 7.46 4.54 0.00 2.75 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 0.00 104 E 9.11 3.83 0.00 2.01 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 2.23 1.88 0.00 *105 H 8.99 4.32 0.00 2.54 3.07 0.00 7.16 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 N 7.76 5.14 0.00 2.84 2.67 0.00 0.00 6.76 7.45 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 0.00 107 S 8.53 5.17 0.00 3.48 3.77 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 0.00 108 L 8.85 5.42 0.00 1.67 1.50 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 109 E 9.48 5.39 0.00 2.16 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 2.29 2.26 0.00 110 T 9.04 5.05 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 0.00 111 I 8.76 4.79 1.88 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 1.23 0.77 0.91 0.00 0.00 112 I 8.83 4.58 1.86 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 1.23 0.61 0.90 0.00 0.00 113 L 9.07 5.30 0.00 1.71 1.57 0.97 0.75 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 0.00 114 Q 9.97 5.04 0.00 2.10 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 115 G 7.75 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 N 7.94 4.83 0.00 2.81 3.14 0.00 0.00 7.17 7.72 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 0.00 117 S 7.99 3.74 0.00 4.16 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 0.00 118 F 8.08 4.64 0.00 3.33 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 0.00 119 E 9.26 4.06 0.00 2.15 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 0.00 2.51 2.60 0.00 120 I 8.01 3.82 2.23 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.81 1.18 0.00 0.00 121 Q 8.57 4.08 0.00 2.47 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 122 R 8.31 3.92 0.00 2.00 2.07 0.00 3.13 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.62 0.00 123 L 8.04 3.93 0.00 1.95 1.91 0.92 0.57 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 0.00 124 Q 8.06 3.93 0.00 2.14 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 125 L 7.78 3.96 0.00 1.80 1.71 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 126 E 8.56 4.11 0.00 2.03 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 2.32 2.45 0.00 127 I 7.98 3.80 1.91 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.95 0.86 0.00 0.00 128 G 8.24 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 0.00 129 G 7.48 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 0.00 130 L 7.39 4.26 0.00 1.76 1.60 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 131 R 8.39 4.10 0.00 1.78 1.86 0.00 3.56 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 132 G 9.18 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 0.00 133 V 7.41 4.48 2.24 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 0.90 0.00 0.00 0.99 0.00 0.00 134 K 9.04 4.44 0.00 1.84 1.94 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.46 1.46 7.81 135 F 7.94 4.67 0.00 3.12 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 A 7.93 4.80 1.11 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 0.00 137 K 8.93 4.33 0.00 1.06 1.40 0.00 1.51 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.22 7.81 138 L 8.43 5.00 0.00 1.58 1.40 0.99 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 139 T 9.16 4.44 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 1.18 0.00 0.00 140 K 8.37 4.55 0.00 1.06 0.74 0.00 1.05 0.00 0.00 0.61 0.00 0.00 2.71 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.30 0.76 7.81 141 A 8.64 5.13 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 S 9.33 4.87 0.00 3.27 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 S 8.43 2.79 0.00 3.70 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 0.00 144 F 7.75 4.49 0.00 3.07 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 0.00 145 E 7.17 4.06 0.00 1.92 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 2.00 1.47 0.00 146 Y 6.82 4.81 0.00 2.96 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 0.00 147 N 8.36 4.58 0.00 2.70 2.73 0.00 0.00 6.79 7.49 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 * Residues marked with a * may have inaccurate shift predictions.