NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.1904 8.4331 121.4842 57.8251 30.3595 175.4955 3 G 3.5807 9.3488 115.4216 44.3669 0.0000 171.8421 4 F 4.7930 7.4937 118.9523 54.7701 42.4996 172.0957 5 P 4.4529 0.0000 0.0000 64.6652 31.9291 176.4959 6 V 4.7182 7.6702 119.2614 61.0131 34.6653 174.5566 7 R 5.3031 8.4863 122.1274 55.1489 32.4976 174.3208 8 V 4.7666 9.0762 113.5337 59.7964 36.4348 174.4658 9 R 4.8204 8.5522 118.6516 54.7351 31.4248 175.6396 10 V 4.2312 8.0139 120.7062 61.1402 34.4834 174.3283 11 D 4.6499 8.2653 126.6088 52.1847 42.3107 176.4268 12 V 3.8250 8.1844 124.6061 62.8298 32.3588 175.4126 13 R 4.6741 9.0136 126.4052 54.2537 32.3941 177.2143 14 F 4.1085 8.7751 122.1608 61.3818 39.5688 177.4635 15 R 3.9792 8.0602 119.2157 58.9487 30.1318 176.7864 16 D 4.4805 8.0443 116.9598 55.6533 41.1922 176.0378 17 L 4.7380 7.1369 119.3542 53.6100 42.3770 176.4519 18 D 4.5817 8.7909 122.3169 52.9292 41.7078 175.7424 19 P 4.1683 0.0000 0.0000 66.0260 31.2458 178.0006 20 L 4.0111 7.5988 115.3331 56.0028 41.6518 177.6712 21 G 3.9388 8.4519 108.0051 44.9642 0.0000 172.5461 22 H 5.2096 7.3551 114.0762 52.8208 32.2455 173.1550 23 V 4.0546 8.5600 120.2571 62.8889 31.8849 175.4411 24 N 4.8295 9.3520 127.0326 52.9440 39.4178 175.3445 25 N 4.0957 9.0674 122.3995 56.0357 37.6081 177.0554 26 A 3.9090 8.6121 121.9150 54.6125 18.9938 179.6326 27 V 3.5073 7.8513 115.4583 66.0188 31.0711 178.0569 28 F 3.5371 7.8284 117.3505 60.5814 38.5344 177.6279 29 L 4.0492 7.8472 117.3187 57.6105 41.7002 179.3638 30 S 4.4099 8.0612 115.4870 61.3668 62.7718 176.1518 31 Y 4.5226 7.3751 116.2243 58.8819 37.2701 177.3201 *33 E 4.2478 8.1143 123.3736 56.1465 31.8374 177.4232 34 L 3.9688 7.8824 119.3204 58.1695 41.9487 178.9521 35 A 3.9489 7.5973 119.7962 55.1778 18.2683 179.5616 36 R 3.4862 7.8507 116.7435 59.5496 30.0678 178.6757 37 I 3.8684 8.2366 120.0285 64.3570 36.8519 178.6595 38 R 4.0165 7.7160 118.1864 59.2572 30.1166 178.1146 39 Y 4.1263 8.1210 119.5893 60.7349 38.4221 178.0640 40 F 4.9267 8.6261 119.1762 60.7451 38.8465 177.5162 41 Q 4.2910 8.3906 116.9902 58.3841 28.9286 177.8649 42 R 4.3444 7.5838 119.3362 57.5210 30.6599 178.3069 43 I 4.0330 7.4631 120.2939 60.4769 38.0681 173.6530 *46 D 4.4848 8.4270 117.5984 53.3236 42.1378 176.8191 47 W 4.4201 8.5139 118.0837 59.2424 28.3615 178.4853 48 L 3.5565 7.1229 118.5891 57.0049 41.1509 177.4803 49 E 4.3862 7.9596 116.8778 55.5470 29.6395 175.7885 50 E 4.2144 9.1439 117.5681 57.6353 27.5705 175.6441 51 G 3.9404 9.0338 103.2553 46.8262 0.0000 174.9125 52 H 3.7667 7.8957 113.9279 55.6181 26.5502 174.3152 53 F 5.3295 7.7226 117.8916 56.0079 40.7396 175.5581 54 V 4.6801 8.4484 116.4597 59.3702 35.5842 175.0524 55 V 4.1497 8.5272 123.3077 63.0075 31.2622 175.3690 56 A 4.5227 9.0847 130.5536 53.7223 20.4854 175.9715 57 R 4.3316 7.4728 113.4914 55.7573 34.0643 173.1252 *59 E 4.3474 8.6072 118.0157 56.3467 30.9156 175.3059 60 V 4.6271 8.3230 124.2894 60.9386 34.3591 174.1191 61 D 4.7463 8.7483 127.9817 52.8634 42.9801 175.0504 62 Y 4.3042 8.5262 122.1287 56.9082 37.8467 175.2413 63 L 4.3799 8.7665 126.0436 56.3550 42.8123 177.9540 64 R 4.6801 7.7442 116.3699 53.5332 33.2613 172.4436 65 P 4.7024 0.0000 0.0000 63.0360 32.5287 175.2626 66 I 4.7098 8.5601 121.9052 59.8089 39.7722 174.7182 67 L 5.0618 9.1067 126.2999 52.2348 45.1732 175.8688 68 L 4.1559 8.3592 122.7167 56.8258 42.4335 177.3810 69 G 4.0140 8.8438 114.0069 45.3235 0.0000 173.5762 70 D 4.3535 7.4997 119.4761 54.1679 41.5286 175.5215 71 E 4.0872 8.6082 124.1625 55.7000 30.7709 175.0070 72 V 4.8187 7.9041 126.9957 61.0778 34.3551 174.1956 73 F 5.3387 8.8119 125.0633 55.7326 43.5278 174.0217 74 V 4.7645 9.1235 121.1873 61.2363 34.6721 174.4976 75 G 4.3628 8.7014 114.7867 44.3383 0.0000 172.1749 76 V 5.2357 8.5996 120.1075 60.2230 35.2206 174.1976 77 R 4.8844 8.3128 116.5992 55.7900 32.4817 174.4151 78 T 4.2983 9.1410 118.7631 63.2541 69.2651 175.3173 79 V 4.3308 8.6346 118.4994 61.2314 33.4323 176.0722 80 G 4.1856 7.7256 106.0449 45.1170 0.0000 172.1380 81 L 4.9243 8.7035 123.6628 53.0062 43.4982 176.4194 82 G 4.2572 8.9074 115.8736 44.6147 0.0000 172.6233 83 R 4.0662 8.6756 118.6567 58.8406 30.5648 179.0449 84 S 5.1037 8.0965 109.3666 57.7273 64.1013 172.7881 85 S 5.5469 7.8230 115.3002 56.8604 66.7594 172.6104 86 L 5.2737 9.0934 119.6105 53.1737 45.7356 176.1420 87 R 5.4742 8.6210 120.3529 53.6085 34.1576 174.6882 *89 E 4.5680 8.4108 118.5464 56.7970 31.3018 174.7417 90 H 5.2669 9.5071 120.5407 53.8459 32.7778 172.5710 91 L 4.9313 8.4762 123.6320 53.3612 45.2139 174.9402 92 V 4.8145 8.7783 127.2320 61.4839 33.5558 174.4787 93 T 5.2226 9.0448 118.0761 59.8633 72.1081 173.0389 94 A 4.8154 8.8700 125.0726 50.5539 22.0436 176.0101 95 N 3.9144 10.1665 121.5026 54.7679 36.6865 175.8101 96 G 4.0050 8.6950 103.6034 45.6747 0.0000 173.7795 97 E 4.7154 7.7731 118.9466 53.8903 32.2141 175.7133 98 S 4.4823 8.6812 118.1153 59.0304 63.1285 173.7750 99 A 4.6377 9.1338 128.3225 53.6982 20.6763 176.5617 100 A 4.8121 7.5384 113.4676 51.0764 22.7047 175.5844 101 K 4.8948 8.7323 119.9018 54.4457 36.0273 175.5939 102 G 4.2574 9.1778 111.6162 44.2067 0.0000 171.0373 103 L 5.0219 9.0099 128.1893 53.3058 43.6466 175.7215 104 G 4.3271 8.7364 112.8463 44.3230 0.0000 171.4692 105 V 4.9475 8.7871 121.5291 60.8619 34.1840 174.2270 106 L 5.3408 9.0992 128.2865 52.9474 44.8441 175.5188 107 V 5.0445 8.8836 123.3138 60.7564 34.3918 174.3169 108 W 4.4416 10.0689 135.0000 57.2353 31.5940 174.6687 109 L 5.2117 7.8793 127.3568 52.9628 44.1307 176.2997 110 E 4.2027 9.0676 121.6711 55.7358 32.3292 176.0144 111 G 3.8978 9.1655 112.8124 46.5029 0.0000 173.6655 112 G 3.8558 8.3574 104.8850 45.3421 0.0000 174.0449 113 R 4.6399 7.3537 118.7537 53.0045 32.9557 173.1089 114 P 4.7842 0.0000 0.0000 63.1399 31.8598 175.5434 115 A 4.9461 8.6481 123.4245 49.2285 22.5241 174.0291 116 P 4.5229 0.0000 0.0000 62.6092 32.1442 176.5778 117 L 3.2785 8.9040 125.0323 53.9216 42.2664 175.7622 118 P 4.0998 0.0000 0.0000 62.1586 32.2407 176.9063 119 E 3.8487 8.8308 121.8873 59.4423 29.3519 179.2612 120 A 3.9434 7.8035 120.2031 55.2560 18.5566 179.5345 121 I 3.6901 7.4834 117.7907 64.3944 37.2155 178.5820 122 R 3.9469 7.7898 118.7526 59.5782 29.8701 179.0439 123 E 4.0405 8.1322 118.0032 59.3475 29.3256 179.6764 124 R 3.9412 7.9287 117.8907 59.0853 30.0190 179.1741 125 I 3.7774 7.9195 119.6874 64.4357 37.1912 178.6037 126 R 3.9236 8.0748 118.6545 59.2781 29.6996 179.0001 127 A 3.9929 8.0525 119.4920 54.9786 18.4479 179.1081 128 L 4.0050 7.8615 117.8372 58.3714 42.0949 178.8440 129 E 4.1901 8.7175 119.0383 58.2427 29.1792 178.8008 130 G 4.0952 8.0399 104.3882 46.1237 0.0000 173.0648 131 R 4.6166 7.3180 117.9629 53.0550 33.2998 173.2910 132 P 4.4218 0.0000 0.0000 63.1754 31.2910 176.2352 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 8.43 4.19 0.00 1.96 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 2.20 2.31 0.00 3 G 9.35 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 4 F 7.49 4.79 0.00 3.02 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 5 P 0.00 4.45 0.00 2.22 2.23 0.00 4.05 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 2.28 2.45 0.00 6 V 7.67 4.72 2.35 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 1.05 0.00 0.00 0.95 0.00 0.00 7 R 8.49 5.30 0.00 1.88 1.84 0.00 2.86 0.00 0.00 3.09 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.68 0.00 8 V 9.08 4.77 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 0.76 0.00 0.00 0.98 0.00 0.00 9 R 8.55 4.82 0.00 1.39 1.89 0.00 2.95 0.00 0.00 3.06 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 10 V 8.01 4.23 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 -0.24 0.00 0.00 0.62 0.00 0.00 11 D 8.27 4.65 0.00 2.59 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 12 V 8.18 3.82 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 0.81 0.00 0.00 0.85 0.00 0.00 13 R 9.01 4.67 0.00 2.08 1.87 0.00 3.22 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 14 F 8.78 4.11 0.00 3.03 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 15 R 8.06 3.98 0.00 1.87 1.99 0.00 3.39 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 16 D 8.04 4.48 0.00 2.88 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 17 L 7.14 4.74 0.00 1.30 1.38 0.74 0.98 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 18 D 8.79 4.58 0.00 2.50 2.46 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 19 P 0.00 4.17 0.00 1.98 2.10 0.00 3.60 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.08 0.00 20 L 7.60 4.01 0.00 1.49 1.70 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.45 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 0.00 0.00 0.00 22 H 7.36 5.21 0.00 3.27 3.41 0.00 5.47 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.56 4.05 1.79 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 0.13 0.00 0.00 0.92 0.00 0.00 24 N 9.35 4.83 0.00 2.86 2.69 0.00 0.00 6.81 6.63 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 25 N 9.07 4.10 0.00 2.31 2.61 0.00 0.00 6.08 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 26 A 8.61 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.85 3.51 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.85 0.00 0.00 28 F 7.83 3.54 0.00 3.35 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 29 L 7.85 4.05 0.00 1.84 1.74 1.02 0.95 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 30 S 8.06 4.41 0.00 4.06 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 31 Y 7.38 4.52 0.00 3.15 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 *33 E 8.11 4.25 0.00 2.09 2.25 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 2.33 2.37 0.00 34 L 7.88 3.97 0.00 1.82 1.79 0.87 1.33 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 35 A 7.60 3.95 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 36 R 7.85 3.49 0.00 1.74 1.91 0.00 3.00 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.88 0.00 37 I 8.24 3.87 1.89 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.83 1.00 0.00 0.00 38 R 7.72 4.02 0.00 1.98 1.96 0.00 3.23 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.72 0.00 39 Y 8.12 4.13 0.00 3.03 2.90 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 40 F 8.63 4.93 0.00 3.45 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 Q 8.39 4.29 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 7.67 0.00 0.00 0.00 0.00 0.00 2.15 2.47 0.00 42 R 7.58 4.34 0.00 1.76 1.85 0.00 3.25 0.00 0.00 3.11 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.55 0.00 43 I 7.46 4.03 2.14 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.74 1.06 0.00 0.00 *46 D 8.43 4.48 0.00 2.74 2.39 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 47 W 8.51 4.42 0.00 3.72 3.45 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 48 L 7.12 3.56 0.00 1.25 1.43 0.56 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.96 4.39 0.00 1.86 1.76 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 2.21 2.14 0.00 50 E 9.14 4.21 0.00 2.37 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 0.00 2.42 2.34 0.00 51 G 9.03 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 0.00 0.00 0.00 52 H 7.90 3.77 0.00 1.61 2.41 0.00 5.60 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 F 7.72 5.33 0.00 3.17 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 54 V 8.45 4.68 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 0.74 0.00 0.00 1.03 0.00 0.00 55 V 8.53 4.15 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 0.81 0.00 0.00 1.01 0.00 0.00 56 A 9.08 4.52 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 57 R 7.47 4.33 0.00 1.88 1.79 0.00 3.22 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 *59 E 8.61 4.35 0.00 1.97 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 2.29 2.31 0.00 60 V 8.32 4.63 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 -0.24 0.00 0.00 0.78 0.00 0.00 61 D 8.75 4.75 0.00 2.49 2.48 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 62 Y 8.53 4.30 0.00 2.65 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 63 L 8.77 4.38 0.00 1.75 1.72 0.97 0.71 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 64 R 7.74 4.68 0.00 1.72 1.80 0.00 3.32 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 65 P 0.00 4.70 0.00 2.16 2.01 0.00 3.82 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 66 I 8.56 4.71 1.81 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.99 0.92 0.00 0.00 67 L 9.11 5.06 0.00 1.56 1.56 0.95 0.32 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 68 L 8.36 4.16 0.00 1.61 1.61 1.03 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.84 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 70 D 7.50 4.35 0.00 2.76 2.59 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 71 E 8.61 4.09 0.00 1.99 1.81 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 2.21 1.95 0.00 72 V 7.90 4.82 1.89 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 0.84 0.00 0.00 0.83 0.00 0.00 73 F 8.81 5.34 0.00 2.97 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 74 V 9.12 4.76 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 1.08 0.00 0.00 0.95 0.00 0.00 75 G 8.70 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 0.00 0.00 0.00 0.00 76 V 8.60 5.24 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.54 0.00 0.00 77 R 8.31 4.88 0.00 2.09 1.95 0.00 2.83 0.00 0.00 2.91 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.53 0.00 78 T 9.14 4.30 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 79 V 8.63 4.33 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 0.65 0.00 0.00 0.96 0.00 0.00 80 G 7.73 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 L 8.70 4.92 0.00 1.53 1.61 0.94 0.92 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 82 G 8.91 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 0.00 0.00 0.00 0.00 83 R 8.68 4.07 0.00 1.88 1.95 0.00 3.14 0.00 0.00 3.40 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 84 S 8.10 5.10 0.00 4.29 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 85 S 7.82 5.55 0.00 4.03 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 86 L 9.09 5.27 0.00 1.47 1.50 0.71 0.99 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 87 R 8.62 5.47 0.00 1.72 1.80 0.00 3.18 0.00 0.00 3.28 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.42 0.00 *89 E 8.41 4.57 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 90 H 9.51 5.27 0.00 2.90 3.08 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 8.48 4.93 0.00 1.57 0.69 0.99 0.90 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 92 V 8.78 4.81 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 1.16 0.00 0.00 1.05 0.00 0.00 93 T 9.04 5.22 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 1.23 0.00 0.00 94 A 8.87 4.82 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 95 N 10.17 3.91 0.00 2.85 2.93 0.00 0.00 7.13 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 96 G 8.69 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 0.00 0.00 0.00 97 E 7.77 4.72 0.00 2.14 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 0.00 2.24 2.40 0.00 98 S 8.68 4.48 0.00 3.88 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 99 A 9.13 4.64 1.53 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 0.00 0.00 100 A 7.54 4.81 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 0.00 101 K 8.73 4.89 0.00 1.64 1.66 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.34 7.81 102 G 9.18 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 0.00 0.00 0.00 0.00 103 L 9.01 5.02 0.00 1.61 1.55 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 104 G 8.74 4.33 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 0.00 105 V 8.79 4.95 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.95 0.00 0.00 106 L 9.10 5.34 0.00 1.54 1.56 0.92 0.67 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 0.00 107 V 8.88 5.04 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 1.09 0.00 0.00 1.03 0.00 0.00 108 W 10.07 4.44 0.00 3.37 3.18 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 0.00 109 L 7.88 5.21 0.00 1.21 1.36 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 110 E 9.07 4.20 0.00 1.94 1.81 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 2.24 2.34 0.00 111 G 9.17 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 0.00 112 G 8.36 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 0.00 113 R 7.35 4.64 0.00 1.78 1.86 0.00 3.12 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 114 P 0.00 4.78 0.00 2.13 2.05 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 115 A 8.65 4.95 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.52 0.00 1.91 1.98 0.00 3.73 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 117 L 8.90 3.28 0.00 1.37 1.39 1.06 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 118 P 0.00 4.10 0.00 1.79 1.75 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 1.28 1.60 0.00 119 E 8.83 3.85 0.00 2.02 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 2.35 2.42 0.00 120 A 7.80 3.94 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 0.00 121 I 7.48 3.69 1.70 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.76 1.02 0.00 0.00 122 R 7.79 3.95 0.00 2.01 1.98 0.00 3.07 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.82 0.00 123 E 8.13 4.04 0.00 2.00 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 2.57 2.48 0.00 124 R 7.93 3.94 0.00 2.08 2.00 0.00 3.19 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.72 0.00 125 I 7.92 3.78 2.10 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.87 1.05 0.00 0.00 126 R 8.07 3.92 0.00 2.02 1.99 0.00 3.29 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 127 A 8.05 3.99 1.30 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 0.00 0.00 0.00 128 L 7.86 4.00 0.00 1.66 1.92 0.21 0.96 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 0.00 129 E 8.72 4.19 0.00 2.03 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 2.63 2.55 0.00 130 G 8.04 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 7.32 4.62 0.00 1.82 1.72 0.00 3.22 0.00 0.00 3.14 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.53 0.00 132 P 0.00 4.42 0.00 2.06 1.96 0.00 3.74 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 * Residues marked with a * may have inaccurate shift predictions.