NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 G 3.7286 8.2085 109.7375 45.2682 0.0000 172.2008 *23 A 4.1733 8.3217 123.3053 51.5492 19.7170 176.4104 24 Q 4.1188 8.7518 122.4133 56.7844 29.4768 176.0431 25 A 4.7051 8.5082 128.6054 50.6121 22.1164 176.0363 26 E 4.1995 8.5897 118.8541 56.6567 31.2469 175.9658 27 V 4.9332 8.1962 122.8843 62.0336 32.2714 175.4726 28 R 4.8267 8.4407 125.3757 54.0397 34.9317 174.5292 29 I 4.2061 8.4679 122.2831 61.7722 37.7029 175.3863 30 D 4.8322 9.0126 125.9568 53.4236 42.5903 174.8856 31 G 3.9651 7.7127 104.4027 44.3062 0.0000 171.7314 32 P 4.4356 0.0000 0.0000 62.4731 31.8273 176.1332 33 I 4.4528 8.1507 121.5359 60.3371 38.0762 175.1612 34 E 4.5855 8.9465 127.9917 55.5720 30.6570 175.6037 35 Y 5.1538 8.7227 120.8914 55.3762 42.0565 175.1244 36 G 4.2742 8.4192 107.3500 44.4849 0.0000 171.7461 37 V 4.6552 8.0704 123.0531 61.7412 33.1375 176.5100 38 F 4.7424 9.4150 128.3273 56.8060 39.4390 175.1976 39 E 4.0701 8.9419 126.9600 55.6564 29.8939 178.4733 40 S 4.4309 8.4632 122.9045 58.6420 60.5157 173.5352 *55 S 4.4664 7.8468 121.5773 58.8498 65.0308 175.0067 56 E 4.3181 7.9921 117.5786 57.2424 30.3787 176.4778 57 Q 4.0344 7.9211 118.8361 56.3322 29.7199 175.2743 58 N 4.5971 8.5367 121.3848 52.9919 40.2070 173.8629 59 I 4.4898 7.9253 123.5314 59.2778 39.8215 174.8770 60 Q 4.0873 9.0312 130.0925 55.3693 30.0487 174.6423 61 Q 4.5562 8.5567 128.6777 56.3084 29.5482 174.7854 62 T 4.5278 8.1407 118.8055 62.0066 70.5480 173.0789 63 T 4.7635 8.5529 115.2556 61.7656 70.7244 173.2927 64 E 4.8633 8.3128 123.3402 55.5552 30.5670 175.7372 65 V 4.4842 8.5729 125.5995 60.0370 34.0742 173.0173 66 P 4.8050 0.0000 0.0000 62.2919 31.9532 177.3595 67 A 4.4384 8.4631 128.0298 51.1058 17.0600 176.7620 68 K 4.6318 7.7139 120.6889 53.1681 36.3878 176.3661 69 L 4.2739 8.6166 125.0554 57.1536 42.2604 177.2784 70 G 4.0146 9.3464 114.4272 45.3299 0.0000 173.7997 71 T 4.1408 7.8189 117.4062 63.3169 69.8007 173.4769 72 K 4.8416 8.5893 126.4939 54.4743 35.4710 174.6087 73 F 5.4594 8.9476 120.9645 53.8726 42.2503 177.8839 74 G 4.2389 8.7937 111.6898 46.1147 0.0000 175.3913 *76 R 4.7138 8.2446 125.5976 56.2319 31.4199 172.1157 77 Y 5.2476 8.4107 122.6139 56.1911 42.4061 173.1818 78 Q 4.9471 8.8451 117.3897 54.0242 32.4705 174.6869 79 L 5.4179 8.5925 122.5905 53.0252 44.8012 176.2631 80 S 4.5657 9.2782 118.6195 57.9288 65.6101 175.2866 81 G 3.9487 8.7895 107.4626 46.3222 0.0000 173.8257 82 K 4.1728 7.8478 119.4840 56.2978 32.8630 176.4071 83 Q 4.6811 8.5007 121.4720 53.6528 32.6834 175.9220 84 E 3.9623 8.9162 121.2607 59.3102 29.8040 178.3645 85 G 3.7691 7.9532 105.4534 46.9984 0.0000 173.3649 86 D 4.6040 7.6238 119.5836 53.6353 41.5538 176.3982 87 T 3.8676 8.4432 118.2833 63.5626 68.7706 172.5770 88 P 4.6123 0.0000 0.0000 62.6184 32.5263 175.7488 89 L 4.6218 8.7857 120.1574 54.9192 43.3241 176.3328 90 T 4.9356 9.1475 119.3604 62.0377 71.0810 173.5069 91 L 4.7370 9.3705 128.1487 53.3609 43.1541 175.6696 92 L 5.0946 8.5601 127.3478 53.7339 43.4770 175.2058 93 Y 4.8313 9.6045 126.2846 56.8501 39.6174 174.8648 94 L 4.9869 9.2444 126.3296 53.6757 43.4636 176.3079 95 T 3.9919 8.3639 113.8373 58.6829 71.5822 172.4108 96 P 4.1286 0.0000 0.0000 62.4403 31.4764 177.0303 97 G 3.9542 7.4085 108.9620 44.8582 0.0000 172.7102 98 V 3.9844 8.6959 126.3626 61.3680 32.1907 175.2616 99 V 4.6632 8.3151 127.9343 61.2132 31.9867 175.4544 100 T 4.0650 8.5575 118.2142 60.3987 69.4931 173.9220 101 P 4.2348 0.0000 0.0000 65.4747 31.3379 177.5213 102 D 4.4264 7.9683 115.6173 54.2861 39.4890 177.0757 103 G 3.9473 8.3443 109.5283 44.9639 0.0000 173.5434 104 Q 4.1321 8.5266 122.4921 55.8711 30.2698 174.5767 105 R 4.7551 8.4081 126.5399 55.6342 31.7135 175.1643 106 H 4.5350 9.3293 123.8147 54.3469 30.4828 173.9825 107 D 4.4763 8.4387 124.2818 55.2166 42.1632 176.5848 108 K 4.9407 7.5412 115.6618 54.9898 36.1952 175.6187 109 F 5.0764 9.2581 120.3942 55.8632 42.2124 174.2039 110 E 5.2288 9.1221 123.3610 54.8673 31.9404 174.0646 111 V 4.5481 8.9502 127.5735 61.0421 34.2431 174.2935 112 V 4.8170 8.4530 127.1968 61.4725 33.3813 174.5409 113 Q 4.5647 9.0568 128.4560 53.8988 31.8168 174.3322 114 K 4.4336 8.7999 128.0685 56.2554 33.2070 176.3335 115 L 4.1093 8.4976 126.3774 54.4964 42.4762 176.8657 116 V 4.2370 8.1128 122.6814 60.3284 32.2181 173.8536 117 P 4.2468 0.0000 0.0000 65.6300 31.2422 178.1572 118 G 3.6675 7.9489 103.7019 46.2536 0.0000 173.1623 119 A 4.2078 7.8025 124.5961 50.7476 18.5649 175.8881 120 P 4.3943 0.0000 0.0000 65.3020 31.6973 176.6195 121 T 4.8360 7.5515 106.4879 59.6463 71.9186 173.1348 122 D 4.8514 8.5228 122.2016 52.7573 44.4899 175.7060 123 V 4.8559 7.6957 119.6881 61.3869 34.8463 174.0131 *125 A 4.1245 8.4769 120.0276 52.1813 19.8439 175.8586 126 Y 4.2104 7.8844 119.5527 55.4907 42.2579 173.7017 127 E 4.5944 7.5038 126.3070 54.0835 32.5240 176.5743 128 F 4.8772 8.4042 126.2995 57.5833 36.6770 176.3220 129 T 3.9892 8.1509 118.5355 65.3344 69.2977 175.1134 130 E 4.7934 8.3341 119.3944 53.4480 33.1665 174.8757 131 P 4.2262 0.0000 0.0000 66.1675 31.4583 178.4579 132 H 4.4435 8.0602 111.1927 57.7709 28.6541 176.1253 133 E 4.3746 8.0743 119.4395 58.4562 29.5258 177.5708 134 V 2.5403 7.2393 119.0108 60.8948 29.8318 173.4509 135 V 4.3914 7.5985 122.9141 60.0089 33.5912 175.5708 136 K 4.3718 8.5735 127.1315 57.1429 33.1619 176.3994 137 G 3.7772 8.0836 107.7615 44.3891 0.0000 171.3687 138 E 5.0744 8.7000 122.5032 55.2154 30.8666 176.9109 139 W 5.0240 9.6523 127.2283 54.9285 32.3412 174.5743 140 R 5.1978 9.2184 125.0292 54.7476 32.0778 174.6028 141 L 5.0502 9.1254 126.3012 52.9197 45.6303 175.7034 *143 V 4.2147 8.0209 119.0270 63.0644 32.7649 174.1286 144 F 5.3278 9.3434 126.4193 55.6600 42.9751 174.6346 145 Q 4.8104 9.0361 122.5632 54.9303 31.0003 175.5519 146 G 3.7923 8.3915 116.8679 47.3559 0.0000 174.4810 147 D 4.4653 8.8438 123.7443 54.8609 41.2811 175.7412 148 R 4.4214 7.9877 121.5538 54.5920 30.9290 174.8172 149 L 3.9119 8.4800 127.7288 54.5461 42.6367 176.0028 150 L 4.1636 8.5039 126.8389 56.8308 42.3134 176.9196 151 A 4.6273 7.0196 116.4182 50.8521 21.7640 175.3701 152 E 4.8661 8.3342 117.1314 55.1634 32.9859 174.3549 153 K 4.3651 8.9805 121.2933 55.3060 36.1317 174.5818 154 S 5.3417 8.2478 122.5004 56.9704 64.9720 173.4487 155 F 5.0370 9.5847 122.1932 55.7989 43.0012 173.8936 156 D 5.2749 9.1938 122.7421 52.8433 42.8789 175.5219 157 V 4.5999 9.0398 125.8802 61.6299 33.2122 176.1182 158 R 4.3215 8.8995 123.9744 56.6887 29.5479 174.8302 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 0 G 8.21 3.73 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 0.00 0.00 0.00 *23 A 8.32 4.17 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 Q 8.75 4.12 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.69 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 25 A 8.51 4.71 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 26 E 8.59 4.20 0.00 1.67 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 2.31 1.88 0.00 27 V 8.20 4.93 2.28 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 0.89 0.00 0.00 0.98 0.00 0.00 28 R 8.44 4.83 0.00 1.76 1.74 0.00 3.20 0.00 0.00 3.34 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 29 I 8.47 4.21 1.87 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 1.20 0.78 0.96 0.00 0.00 30 D 9.01 4.83 0.00 2.66 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 31 G 7.71 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 32 P 0.00 4.44 0.00 2.08 2.02 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 2.03 2.12 0.00 33 I 8.15 4.45 1.99 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 1.39 0.80 1.07 0.00 0.00 34 E 8.95 4.59 0.00 1.84 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 2.22 2.22 0.00 35 Y 8.72 5.15 0.00 3.37 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 36 G 8.42 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 8.07 4.66 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 0.99 0.00 0.00 0.99 0.00 0.00 38 F 9.41 4.74 0.00 2.84 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 39 E 8.94 4.07 0.00 1.96 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 2.32 2.26 0.00 40 S 8.46 4.43 0.00 4.01 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 *55 S 7.85 4.47 0.00 3.89 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 56 E 7.99 4.32 0.00 1.93 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 2.23 2.26 0.00 57 Q 7.92 4.03 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 58 N 8.54 4.60 0.00 2.77 2.64 0.00 0.00 6.87 7.23 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 59 I 7.93 4.49 1.72 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.03 0.63 0.00 0.00 60 Q 9.03 4.09 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 61 Q 8.56 4.56 0.00 1.84 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.64 0.00 0.00 0.00 0.00 0.00 2.07 1.16 0.00 62 T 8.14 4.53 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 1.43 0.00 0.00 63 T 8.55 4.76 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 0.94 0.00 0.00 64 E 8.31 4.86 0.00 2.21 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 2.30 2.12 0.00 65 V 8.57 4.48 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.62 0.00 0.00 66 P 0.00 4.80 0.00 2.17 2.07 0.00 3.81 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 2.03 2.00 0.00 67 A 8.46 4.44 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 68 K 7.71 4.63 0.00 1.82 1.71 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.37 7.81 69 L 8.62 4.27 0.00 1.61 1.63 1.06 1.16 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 70 G 9.35 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 71 T 7.82 4.14 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 1.16 0.00 0.00 72 K 8.59 4.84 0.00 1.59 1.51 0.00 1.48 0.00 0.00 1.31 0.00 0.00 2.43 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.78 0.95 7.81 73 F 8.95 5.46 0.00 2.71 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.79 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 0.00 0.00 0.00 0.00 *76 R 8.24 4.71 0.00 2.06 1.87 0.00 3.16 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 77 Y 8.41 5.25 0.00 3.04 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.85 4.95 0.00 2.03 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.89 0.00 0.00 0.00 0.00 0.00 2.52 2.35 0.00 79 L 8.59 5.42 0.00 1.53 1.60 1.11 1.05 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 80 S 9.28 4.57 0.00 3.87 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 81 G 8.79 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 82 K 7.85 4.17 0.00 1.77 1.79 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.48 1.49 7.81 83 Q 8.50 4.68 0.00 2.39 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.90 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 84 E 8.92 3.96 0.00 1.93 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 2.30 2.32 0.00 85 G 7.95 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 0.00 0.00 0.00 86 D 7.62 4.60 0.00 2.87 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 87 T 8.44 3.87 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 88 P 0.00 4.61 0.00 2.16 2.10 0.00 3.79 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 2.03 0.00 89 L 8.79 4.62 0.00 1.72 1.72 1.09 0.80 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 90 T 9.15 4.94 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 1.30 0.00 0.00 91 L 9.37 4.74 0.00 1.71 1.49 1.11 0.35 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 92 L 8.56 5.09 0.00 1.76 1.85 1.00 1.07 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 93 Y 9.60 4.83 0.00 3.25 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 94 L 9.24 4.99 0.00 1.69 1.56 0.96 0.36 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 95 T 8.36 3.99 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 0.84 0.00 0.00 96 P 0.00 4.13 0.00 1.96 2.03 0.00 2.71 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 2.07 2.10 0.00 97 G 7.41 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 98 V 8.70 3.98 2.33 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 1.34 0.00 0.00 1.22 0.00 0.00 99 V 8.32 4.66 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 0.95 0.00 0.00 0.94 0.00 0.00 100 T 8.56 4.06 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 0.00 101 P 0.00 4.23 0.00 2.04 2.16 0.00 3.56 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 102 D 7.97 4.43 0.00 2.77 2.80 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 0.00 103 G 8.34 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 0.00 104 Q 8.53 4.13 0.00 2.17 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.82 0.00 0.00 0.00 0.00 0.00 2.28 1.97 0.00 105 R 8.41 4.76 0.00 1.81 1.73 0.00 3.19 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 106 H 9.33 4.54 0.00 2.67 2.39 0.00 5.66 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 D 8.44 4.48 0.00 2.46 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 7.54 4.94 0.00 1.79 1.64 0.00 1.51 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.21 1.43 7.81 109 F 9.26 5.08 0.00 3.06 2.95 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 0.00 110 E 9.12 5.23 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 2.24 2.37 0.00 111 V 8.95 4.55 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 0.98 0.00 0.00 1.08 0.00 0.00 112 V 8.45 4.82 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 0.86 0.00 0.00 0.98 0.00 0.00 113 Q 9.06 4.56 0.00 2.17 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 114 K 8.80 4.43 0.00 1.83 1.71 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.44 1.49 7.81 115 L 8.50 4.11 0.00 1.70 1.61 1.02 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.11 4.24 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 1.04 0.00 0.00 0.93 0.00 0.00 117 P 0.00 4.25 0.00 2.08 2.27 0.00 3.73 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 118 G 7.95 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 7.80 4.21 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.39 0.00 2.17 2.18 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 121 T 7.55 4.84 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 122 D 8.52 4.85 0.00 1.58 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 0.00 0.00 0.00 0.00 123 V 7.70 4.86 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 0.80 0.00 0.00 1.03 0.00 0.00 *125 A 8.48 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 Y 7.88 4.21 0.00 2.80 1.72 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 0.00 127 E 7.50 4.59 0.00 1.62 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 2.01 2.19 0.00 128 F 8.40 4.88 0.00 2.99 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 0.00 129 T 8.15 3.99 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 1.14 0.00 0.00 130 E 8.33 4.79 0.00 1.82 1.75 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 2.20 2.19 0.00 131 P 0.00 4.23 0.00 2.20 2.13 0.00 3.62 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 132 H 8.06 4.44 0.00 3.50 3.49 0.00 5.52 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 E 8.07 4.37 0.00 2.28 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.15 0.00 134 V 7.24 2.54 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 0.44 0.00 0.00 0.79 0.00 0.00 135 V 7.60 4.39 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 0.99 0.00 0.00 1.08 0.00 0.00 136 K 8.57 4.37 0.00 1.83 1.78 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.45 7.81 137 G 8.08 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 0.00 138 E 8.70 5.07 0.00 2.05 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 2.34 2.43 0.00 139 W 9.65 5.02 0.00 3.54 3.48 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 0.00 140 R 9.22 5.20 0.00 1.94 1.85 0.00 3.07 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 141 L 9.13 5.05 0.00 1.92 1.55 1.48 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 *143 V 8.02 4.21 1.72 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 1.01 0.00 0.00 0.74 0.00 0.00 144 F 9.34 5.33 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 0.00 145 Q 9.04 4.81 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.83 0.00 0.00 0.00 0.00 0.00 2.28 2.56 0.00 146 G 8.39 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 0.00 147 D 8.84 4.47 0.00 2.71 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 0.00 148 R 7.99 4.42 0.00 1.92 1.97 0.00 3.09 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 149 L 8.48 3.91 0.00 1.38 1.41 -0.06 0.86 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 0.00 150 L 8.50 4.16 0.00 1.53 1.56 0.95 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 151 A 7.02 4.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 E 8.33 4.87 0.00 1.91 1.67 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 0.00 2.04 2.19 0.00 153 K 8.98 4.37 0.00 1.76 1.48 0.00 1.07 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.63 0.62 7.81 154 S 8.25 5.34 0.00 3.66 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 0.00 155 F 9.58 5.04 0.00 2.91 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 0.00 156 D 9.19 5.27 0.00 2.61 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 0.00 157 V 9.04 4.60 2.51 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 1.09 0.00 0.00 0.54 0.00 0.00 158 R 8.90 4.32 0.00 1.91 1.98 0.00 2.85 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 * Residues marked with a * may have inaccurate shift predictions.