NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9375 8.3549 109.7364 44.9356 0.0000 173.6398 3 K 3.9086 8.4471 123.2276 55.2099 32.7361 175.5971 4 A 4.2743 8.2357 126.5271 52.3591 20.0461 176.6865 5 V 4.4993 7.7102 117.9150 60.5847 34.0377 173.2179 6 I 4.5817 8.1332 120.4667 59.1144 40.9589 174.3393 7 A 4.8212 8.3942 127.9621 50.2518 21.9660 175.2345 8 I 4.7250 8.0336 112.9251 59.2793 40.9098 174.2053 9 H 4.9198 8.2427 115.2486 54.1360 31.3298 173.0836 10 G 3.4685 8.7058 108.3797 45.1438 0.0000 173.8027 11 G 3.9720 8.7061 105.5776 45.1396 0.0000 173.5164 12 A 4.7489 8.4041 123.7081 49.3891 21.6338 177.2528 13 G 3.7352 7.7318 105.9461 46.0112 0.0000 172.3911 14 A 4.0897 8.4279 124.1640 51.8082 17.2740 177.1394 15 I 4.1883 8.0534 122.4441 60.4086 38.6623 175.9153 16 S 4.5405 8.3161 121.3893 56.3265 62.8438 174.5551 17 R 3.8684 8.6078 129.1390 59.2389 30.1699 178.3618 18 A 4.0284 8.0077 119.6547 54.8715 18.4563 177.7665 19 Q 4.4586 7.7591 112.4001 56.0428 28.9830 175.2601 20 M 5.0143 7.7832 117.6692 53.2365 35.4720 175.6519 21 S 4.8142 8.9100 116.3118 56.5358 66.7322 175.2179 22 L 4.6222 8.1688 125.0034 58.1471 41.5672 179.1521 23 Q 4.0674 8.0902 117.4344 59.0332 27.7872 178.7107 24 Q 4.0746 8.1669 119.1703 59.0397 28.8778 178.6274 25 E 4.3835 8.3403 119.6269 59.4949 29.5326 179.4459 26 L 4.1337 8.4808 119.3465 57.6691 41.6844 179.7673 27 R 3.9864 7.8038 118.0882 59.3135 29.8557 178.6948 28 Y 4.0471 7.6720 117.0080 60.9987 37.8495 178.1687 29 I 3.8048 8.0753 120.7733 64.6200 37.2464 178.3355 30 E 3.9760 8.8425 119.3915 59.2866 29.1321 179.3521 31 A 4.0416 7.9572 120.2954 55.2169 18.4556 179.7083 32 L 3.9893 8.4925 117.9888 57.9586 41.6157 179.7298 33 S 4.0660 8.5136 113.1958 61.2908 62.3555 175.9373 34 A 4.0059 8.1694 123.4982 55.3541 18.1032 179.7821 35 I 3.7221 7.6368 118.3794 64.4018 37.1685 179.0557 36 V 3.6419 8.0046 120.2148 64.9048 31.1800 178.2812 37 E 4.2969 8.4769 120.9522 58.8645 29.2732 179.4183 38 T 3.9759 8.0149 115.9688 66.5688 68.4398 176.9238 39 G 3.5950 8.1158 107.6039 47.7993 0.0000 175.6716 40 Q 4.0042 8.3934 121.0000 58.7218 28.7956 179.1813 41 K 3.9735 8.1556 119.3132 59.7720 32.0620 179.2660 42 M 4.0698 8.0709 118.8166 58.3570 31.8100 178.8390 43 L 3.9582 8.1350 119.2105 57.8657 41.6223 179.0853 44 E 3.8981 8.3385 118.0584 59.1926 29.6298 178.0102 45 A 4.3123 7.8758 117.9077 52.5082 18.6637 178.0136 46 G 3.8802 8.0061 106.0033 45.2216 0.0000 174.0303 47 E 4.2151 7.9286 118.7713 55.5142 30.2333 177.6648 48 S 4.3601 8.3468 115.7778 58.0166 65.2464 175.0470 49 A 3.9515 8.5591 125.3535 55.4147 18.1178 179.9420 50 L 3.8783 7.8412 118.1349 58.5478 42.2825 178.8699 51 D 4.3830 8.2250 118.8109 57.1167 40.6171 178.9936 52 V 3.5746 8.0041 118.9568 66.2349 31.6440 178.6509 53 V 3.6199 8.0753 112.3946 64.4807 31.2564 178.8242 54 T 3.8635 7.9349 115.7039 66.6138 68.2628 176.3955 55 E 3.9076 8.3371 121.0198 59.0640 29.6865 178.5822 56 A 3.9519 8.1968 121.0630 55.3171 18.4554 179.8658 57 V 3.5288 7.8803 116.7224 65.8710 31.4917 178.1536 58 R 4.0715 8.2007 118.7290 59.5674 29.7078 178.5714 59 L 4.0322 7.9526 117.7013 57.7614 41.6498 179.2097 60 L 4.2723 7.8197 118.2921 57.5765 41.6690 179.0472 61 E 4.4198 8.5774 120.4536 58.5949 30.2681 178.7469 62 E 4.3749 8.0623 118.4180 55.7231 26.3511 175.8304 *64 P 4.9716 0.0000 0.0000 62.4443 33.7081 179.0010 65 L 3.9020 7.6664 118.1933 56.4862 41.6494 176.9237 66 F 5.1721 6.9374 116.0095 55.5194 41.3616 175.9858 67 N 4.7820 9.0408 122.8839 50.8825 36.8219 173.1464 68 A 4.2862 8.2238 120.8905 52.0239 23.2620 177.0719 69 G 3.7962 8.0502 110.3288 46.0992 0.0000 174.8694 70 I 4.0576 8.3975 125.7854 63.2940 37.0952 176.6157 71 G 4.0021 9.2206 113.6345 44.8782 0.0000 173.0061 72 A 4.2386 7.4430 122.1667 51.9092 18.7881 178.4868 73 V 3.9750 8.4137 114.6353 61.3880 32.3672 175.8010 74 F 4.8797 8.5163 119.7988 56.1066 40.7281 176.4506 75 T 4.3612 8.7819 115.1191 60.5543 69.8696 175.4032 76 R 3.9223 8.5926 120.9847 59.2384 30.3468 176.4519 77 D 4.7959 8.1776 115.8899 53.4985 40.8524 176.2492 78 E 4.3870 8.2787 117.3083 58.0209 27.5394 174.0646 79 T 4.7551 7.3691 105.2048 60.0931 71.7843 172.0116 80 H 5.0839 8.5455 117.8571 53.9198 31.0750 173.6463 81 E 4.6239 8.6181 122.3604 54.7460 32.6337 174.8408 82 L 4.7498 8.9301 125.1637 53.0424 44.5947 175.5307 83 D 5.4627 8.3234 120.1408 53.0275 45.0224 174.5190 84 A 4.6331 8.7907 121.1056 51.5796 23.1414 174.8148 85 C 5.3207 8.4191 118.5399 57.9491 35.1559 173.5444 86 V 4.6286 8.9061 123.1699 60.2580 34.7509 173.9067 87 M 5.0998 8.4872 121.5824 54.0365 35.6192 173.4810 88 D 4.7131 9.0490 126.3970 52.6623 42.0363 177.3498 89 G 3.6695 8.8347 115.8904 47.8445 0.0000 173.7052 90 N 4.4306 8.7268 119.0695 56.4049 38.9939 175.8805 91 T 4.2416 7.9382 104.7856 60.8718 69.8987 175.0023 92 L 3.7361 8.0699 120.5588 55.3594 39.9156 174.6012 93 K 4.4365 7.7696 118.3865 56.6084 33.3445 175.8847 94 A 5.0526 8.3161 122.4169 50.8747 23.0285 175.3090 95 G 4.3142 9.0821 105.6623 44.7206 0.0000 171.6318 96 A 5.2206 8.9848 123.7427 50.4970 23.2258 175.5901 97 V 5.5952 9.0488 112.8163 58.5043 35.9446 174.7659 98 A 4.8018 8.0380 124.0473 50.6845 22.6496 176.2332 99 G 3.9364 9.2695 108.5703 46.8019 0.0000 173.6813 100 V 4.4739 7.6666 112.3951 59.8534 33.0286 177.2067 101 S 4.7654 9.6627 117.5798 58.3991 64.9665 174.6189 102 H 5.3402 8.5374 116.3762 54.3312 29.3633 172.6127 103 L 5.1673 8.0661 119.2429 52.7508 44.0274 176.5739 104 R 4.3125 9.1157 124.4388 58.8732 30.4272 175.9788 105 N 5.4022 7.7602 115.4420 48.6176 39.5064 172.4234 106 P 4.2685 0.0000 0.0000 65.6573 31.5517 178.2562 107 V 3.7576 8.4530 117.9795 64.8115 31.2002 178.5345 108 L 4.0225 8.0574 119.4711 57.3957 41.4558 179.2258 109 A 4.0512 7.9510 120.1961 54.9919 18.4701 179.3034 110 A 3.9323 8.4822 119.7542 55.4124 18.5080 179.8598 111 R 3.8657 8.1650 117.2262 59.4070 30.0292 178.4580 112 L 4.0334 8.0819 120.2824 58.0439 41.8653 179.0432 113 V 3.5293 7.8167 117.2781 66.3065 31.5263 177.3862 114 M 4.1549 7.7938 116.3647 58.5542 32.1779 177.4368 115 E 4.3889 8.2515 117.1218 57.3947 30.0204 177.1199 116 Q 4.7509 8.1632 117.1455 54.9004 29.5888 175.0123 117 S 4.6653 7.7845 110.5940 56.9689 65.3599 172.2431 118 P 4.4583 0.0000 0.0000 63.4899 31.4191 175.6182 119 H 4.8364 7.8498 116.8885 55.0838 30.7007 174.5762 120 V 4.5253 8.1681 118.6689 63.4705 33.5322 175.0254 121 M 5.1846 7.8598 118.0511 53.9000 35.0061 174.3884 122 M 4.9414 8.9028 124.7789 53.3890 36.3013 174.5116 123 I 4.8666 8.0092 114.5986 59.0954 41.5157 176.3063 124 G 3.7609 9.0504 112.3034 45.7088 0.0000 175.7403 125 E 4.1938 8.9635 119.5459 59.3500 29.5217 179.0638 126 G 3.6221 8.0707 104.9796 47.6823 0.0000 175.3338 127 A 3.9866 7.9756 123.2384 54.8735 18.3371 179.6150 128 E 3.3860 8.0772 116.9749 59.5082 29.5488 179.3420 129 N 4.3569 8.4146 116.8399 56.1595 38.3459 177.1166 130 F 4.0994 8.0890 120.8892 61.3258 39.7780 176.8296 131 A 3.9300 7.9482 120.2224 55.1697 18.3298 179.5872 132 F 4.8687 8.3734 117.8758 60.2373 38.7795 177.5625 133 A 4.2652 8.1170 118.7957 53.7715 18.0976 178.1376 134 R 4.3497 7.7722 115.7673 55.7701 30.6061 177.2220 135 G 3.9523 8.0724 106.7345 45.2875 0.0000 174.3100 136 M 4.2628 7.7122 120.2624 55.1270 32.9952 175.1612 137 E 4.2225 8.6119 125.3784 56.1087 30.5403 176.0644 138 R 4.5697 8.0545 122.8713 55.9396 30.9654 175.6898 139 V 4.5621 8.7132 118.4118 59.5095 36.3963 174.1672 140 S 4.7102 8.2280 116.1578 56.7932 63.6865 173.3330 141 P 4.4505 0.0000 0.0000 64.6444 31.2119 178.3174 142 E 4.2114 8.1141 116.5445 58.4542 29.3199 178.6814 143 I 3.6228 7.0840 113.4399 63.6148 37.7709 177.4907 144 F 4.4790 7.5633 118.7244 58.0462 39.0118 175.7189 145 S 4.7264 7.4617 115.8873 58.4162 63.5484 174.2365 146 T 4.8512 8.4247 114.1997 59.1827 73.0305 175.2672 147 S 4.2724 8.6965 117.8983 61.4868 62.9642 176.3054 148 L 3.9688 8.0285 123.4470 58.3935 41.9655 179.2370 149 R 4.1786 7.9383 116.6903 59.0938 29.9177 178.5156 150 Y 3.7612 8.2673 119.7895 60.6445 38.7392 177.6061 151 E 3.8219 8.7261 119.9723 59.5383 29.5311 179.4269 152 Q 4.0158 7.9759 117.8882 58.5741 28.6840 178.6416 153 L 3.8813 7.6918 121.2462 58.2146 42.0035 178.7858 154 L 3.7303 7.4564 117.5883 57.9015 41.5593 179.2504 155 A 4.0739 8.1044 119.8030 54.8996 18.4439 179.3159 156 A 4.0602 7.8190 118.1396 54.6318 18.4557 178.3056 157 R 4.1686 7.4395 120.5200 56.5504 30.3660 176.2310 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 G 8.35 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 3 K 8.45 3.91 0.00 1.84 1.76 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.50 7.81 4 A 8.24 4.27 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 5 V 7.71 4.50 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 0.65 0.00 0.00 0.93 0.00 0.00 6 I 8.13 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 1.33 0.94 0.91 0.00 0.00 7 A 8.39 4.82 1.19 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 8 I 8.03 4.72 1.76 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 1.43 0.69 0.86 0.00 0.00 9 H 8.24 4.92 0.00 3.11 3.22 0.00 5.66 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 10 G 8.71 3.47 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 0.00 11 G 8.71 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 12 A 8.40 4.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 G 7.73 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 14 A 8.43 4.09 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 15 I 8.05 4.19 1.82 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 1.23 0.82 0.79 0.00 0.00 16 S 8.32 4.54 0.00 3.83 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 17 R 8.61 3.87 0.00 1.87 1.90 0.00 3.24 0.00 0.00 3.34 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 18 A 8.01 4.03 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Q 7.76 4.46 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.63 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 20 M 7.78 5.01 0.00 1.99 2.03 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 2.78 2.43 0.00 21 S 8.91 4.81 0.00 4.00 3.98 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 22 L 8.17 4.62 0.00 1.79 1.72 0.94 0.99 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 23 Q 8.09 4.07 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.41 0.00 24 Q 8.17 4.07 0.00 2.37 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 25 E 8.34 4.38 0.00 2.24 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 2.34 2.49 0.00 26 L 8.48 4.13 0.00 1.85 1.75 0.94 0.81 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 27 R 7.80 3.99 0.00 1.81 1.79 0.00 3.25 0.00 0.00 3.11 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.75 0.00 28 Y 7.67 4.05 0.00 3.41 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 I 8.08 3.80 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.05 0.96 0.00 0.00 30 E 8.84 3.98 0.00 2.01 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 2.35 2.46 0.00 31 A 7.96 4.04 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 3.99 0.00 1.90 1.76 1.05 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.51 4.07 0.00 4.03 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 34 A 8.17 4.01 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 35 I 7.64 3.72 1.88 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.66 0.90 0.00 0.00 36 V 8.00 3.64 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 1.05 0.00 0.00 0.92 0.00 0.00 37 E 8.48 4.30 0.00 2.20 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 2.34 2.41 0.00 38 T 8.01 3.98 4.42 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 1.22 0.00 0.00 39 G 8.12 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.39 4.00 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.60 0.00 41 K 8.16 3.97 0.00 1.97 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.66 7.81 42 M 8.07 4.07 0.00 2.08 2.26 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.59 0.00 43 L 8.14 3.96 0.00 1.85 1.71 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.34 3.90 0.00 2.08 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 2.33 2.34 0.00 45 A 7.88 4.31 1.37 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 0.00 0.00 46 G 8.01 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 47 E 7.93 4.22 0.00 2.04 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 2.49 2.39 0.00 48 S 8.35 4.36 0.00 4.05 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 49 A 8.56 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 50 L 7.84 3.88 0.00 1.77 1.67 0.92 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 51 D 8.23 4.38 0.00 2.87 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 52 V 8.00 3.57 2.21 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 1.10 0.00 0.00 1.01 0.00 0.00 53 V 8.08 3.62 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 0.85 0.00 0.00 1.01 0.00 0.00 54 T 7.93 3.86 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 55 E 8.34 3.91 0.00 2.09 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 2.31 2.37 0.00 56 A 8.20 3.95 1.31 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 T 8.78 4.36 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 1.27 0.00 0.00 76 R 8.59 3.92 0.00 1.81 2.05 0.00 3.23 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 77 D 8.18 4.80 0.00 2.82 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 78 E 8.28 4.39 0.00 2.22 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 2.31 2.29 0.00 79 T 7.37 4.76 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 1.34 0.00 0.00 80 H 8.55 5.08 0.00 3.19 3.05 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.62 4.62 0.00 1.78 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 2.32 0.00 82 L 8.93 4.75 0.00 1.38 1.35 -0.16 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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7.94 4.24 4.24 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 1.21 0.00 0.00 92 L 8.07 3.74 0.00 1.83 1.82 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.77 4.44 0.00 1.71 1.72 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.54 7.81 94 A 8.32 5.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 9.08 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 0.00 0.00 0.00 0.00 96 A 8.98 5.22 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 0.00 0.00 0.00 0.00 0.00 97 V 9.05 5.60 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 0.60 0.00 0.00 0.95 0.00 0.00 98 A 8.04 4.80 1.16 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 0.00 0.00 99 G 9.27 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.96 4.19 0.00 2.07 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 2.40 2.43 0.00 126 G 8.07 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 0.00 127 A 7.98 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 8.08 3.39 0.00 2.05 1.44 0.00 0.00 0.00 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 0.00 129 N 8.41 4.36 0.00 2.71 2.92 0.00 0.00 6.71 8.11 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 0.00 130 F 8.09 4.10 0.00 3.04 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 0.00 131 A 7.95 3.93 1.31 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 0.00 0.00 0.00 132 F 8.37 4.87 0.00 3.03 2.94 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 0.00 133 A 8.12 4.27 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 0.00 134 R 7.77 4.35 0.00 1.60 1.73 0.00 2.21 0.00 0.00 2.73 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.24 0.00 135 G 8.07 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 0.00 136 M 7.71 4.26 0.00 2.25 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.69 0.00 137 E 8.61 4.22 0.00 2.03 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 2.30 2.31 0.00 138 R 8.05 4.57 0.00 0.67 1.43 0.00 2.64 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 139 V 8.71 4.56 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.97 0.00 0.00 140 S 8.23 4.71 0.00 3.88 3.68 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 0.00 141 P 0.00 4.45 0.00 2.32 2.33 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.04 0.00 142 E 8.11 4.21 0.00 2.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.29 0.00 143 I 7.08 3.62 1.60 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.36 0.77 0.00 0.00 144 F 7.56 4.48 0.00 2.67 2.91 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 0.00 145 S 7.46 4.73 0.00 4.10 4.17 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 0.00 146 T 8.42 4.85 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 1.30 0.00 0.00 147 S 8.70 4.27 0.00 4.15 4.23 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 0.00 148 L 8.03 3.97 0.00 1.83 1.78 0.97 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 149 R 7.94 4.18 0.00 2.25 2.27 0.00 3.49 0.00 0.00 3.24 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.15 0.00 150 Y 8.27 3.76 0.00 3.00 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 0.00 151 E 8.73 3.82 0.00 2.14 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 2.59 2.53 0.00 152 Q 7.98 4.02 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 153 L 7.69 3.88 0.00 1.80 1.51 0.99 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 154 L 7.46 3.73 0.00 1.50 1.53 0.17 0.43 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 0.00 155 A 8.10 4.07 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 0.00 156 A 7.82 4.06 1.38 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 0.00 0.00 0.00 157 R 7.44 4.17 0.00 1.92 1.81 0.00 3.08 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 * Residues marked with a * may have inaccurate shift predictions.