NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5171 8.1476 118.1969 55.2390 32.7745 174.4620 2 T 4.1464 8.6279 110.9313 60.0910 71.3493 174.0245 3 M 4.0526 8.6933 120.7448 58.8654 32.6365 179.0237 4 E 3.9587 8.1730 118.8326 59.5510 29.8587 178.7331 5 Q 4.0347 8.0830 117.8123 58.6615 28.6099 178.5202 6 F 4.1200 8.4628 121.8209 61.3712 38.2299 177.1112 7 L 3.7800 8.1048 118.5851 58.1706 41.5117 179.7809 8 T 4.0891 7.8626 115.7373 66.5231 68.2838 176.8522 9 S 4.0780 8.0640 116.3040 61.2781 62.7845 176.5594 10 L 3.6988 7.2548 122.2834 57.8361 41.2564 179.2748 11 D 4.3684 7.4717 118.7486 57.5077 40.5904 178.7128 12 M 4.0395 7.8685 118.8344 58.3635 32.0047 178.9660 13 I 3.6986 7.9815 120.2065 64.3322 37.2575 178.4082 14 R 4.1460 8.0147 119.5949 59.6315 29.7020 178.2755 15 S 4.2370 8.2775 112.2729 61.5041 62.3509 176.0865 16 G 3.7866 7.8421 107.4277 47.0036 0.0000 174.4888 17 C 4.7445 8.2813 117.7071 58.8263 42.1888 175.6985 18 A 4.2565 8.6591 122.8655 55.1666 17.8004 177.7842 19 P 4.2206 0.0000 0.0000 65.6603 31.4069 178.1510 20 K 3.9921 7.7762 115.0227 56.6634 32.2238 176.4729 21 F 4.9508 7.5079 116.7063 55.2839 42.7178 174.4697 22 K 4.3925 9.3162 124.4799 55.2455 31.6545 175.9041 23 L 4.8627 8.1464 125.3310 52.2702 45.6216 176.7273 24 K 4.4736 8.1858 120.2935 55.0916 34.6557 177.6996 25 T 3.8264 8.5303 121.1233 67.0647 68.6231 176.4560 26 E 3.9455 8.0346 118.2199 58.9270 29.5972 178.7944 27 D 4.0261 7.6845 119.8008 57.1136 41.1337 178.2905 28 L 3.9404 7.7148 119.4363 58.0327 41.3516 179.4639 29 D 4.3462 8.1878 118.7475 57.2441 40.6932 179.0028 30 R 3.9405 7.5146 117.4154 59.1502 30.0024 179.0518 31 L 3.6474 7.9436 118.8178 57.6866 41.7285 179.2074 32 R 4.8487 8.2065 120.2334 58.5602 29.6956 177.8860 33 V 4.1166 7.4814 108.4069 61.1446 31.7998 176.7864 34 G 4.3761 8.6003 108.4858 45.7453 0.0000 174.5005 35 D 4.8223 8.1154 120.5813 53.5556 39.2991 175.6419 36 F 4.5994 8.7553 122.7416 57.3224 39.4159 175.9493 37 N 5.0225 8.2344 116.8035 52.2265 37.8621 174.3568 38 F 4.9392 7.3553 111.1851 55.7551 40.9441 171.8682 39 P 4.2105 0.0000 0.0000 61.8462 31.3983 174.8387 40 P 4.2796 0.0000 0.0000 61.7967 32.5627 176.7347 41 S 4.3607 8.1307 115.5300 57.7433 65.3664 175.1214 42 Q 3.8560 8.4022 122.3299 59.3930 28.6783 177.7093 43 D 4.4462 8.1348 119.4039 57.5686 41.0030 178.6275 44 L 3.8494 7.9409 120.5208 58.2616 42.1505 178.9227 45 M 4.0119 7.6736 118.2305 58.6698 31.8214 178.1970 46 C 4.3448 8.1852 116.5254 59.6698 39.9183 175.3923 47 Y 3.3836 7.4897 121.9362 60.7622 38.0755 178.4510 48 T 4.2004 7.8721 110.1108 64.5980 68.7383 176.3099 49 K 4.0434 7.8925 122.0086 59.4933 32.3635 177.6423 50 C 4.2225 8.4901 119.1313 59.9881 39.0600 175.8977 51 V 3.4395 7.7362 119.4551 66.1868 31.1035 178.2491 52 S 4.3052 8.4548 114.9098 61.3706 62.6871 176.4762 53 L 4.0412 8.5429 122.3705 58.1618 41.1498 179.2254 54 M 4.0460 7.7177 116.3277 58.4807 32.2481 177.6912 55 A 4.2360 7.6627 119.6189 52.4946 18.6834 178.0061 56 G 3.7869 7.7742 104.7614 46.4453 0.0000 174.5158 57 A 4.4169 8.0566 123.5846 52.3245 19.7648 178.3770 58 V 5.1735 7.7385 106.8443 58.3327 35.7050 174.7663 59 N 4.7930 8.4188 121.7420 51.8192 39.2281 176.5827 60 K 3.9988 8.5386 118.6798 57.2728 31.3615 174.3056 61 K 4.3046 8.3112 114.9910 56.6648 32.3509 177.9281 62 G 3.9846 8.3633 107.3318 45.7873 0.0000 173.5062 63 E 4.0215 8.4602 120.6194 55.3885 29.5968 176.0510 64 F 4.5879 8.2924 126.9843 57.6774 40.2622 174.2486 65 N 4.5058 7.9281 126.4949 51.3560 39.2282 174.7381 66 A 3.5821 8.1455 128.1477 54.3573 18.6311 176.7419 67 P 4.1155 0.0000 0.0000 65.9310 31.1789 178.6734 68 K 3.8937 7.7285 116.1544 59.1363 32.3755 178.2164 69 A 4.1318 8.0283 121.5224 55.3926 18.0846 179.4414 70 L 3.8957 8.3905 117.3003 58.1238 41.5265 179.8166 71 A 4.1359 7.8555 119.0451 54.7329 18.6003 179.0935 72 Q 4.1445 7.9591 116.7050 58.3000 29.0419 177.9524 73 L 3.9096 7.4711 118.8458 57.6542 41.4229 177.6247 74 P 4.3211 0.0000 0.0000 64.9477 31.2332 176.6271 75 H 4.9115 7.7424 110.0136 55.0744 28.7424 174.8492 76 L 4.6397 7.7547 120.5896 55.2175 43.6448 176.9596 77 V 4.2244 7.2676 109.1615 58.4535 35.4551 173.4601 78 P 4.7554 0.0000 0.0000 60.7945 32.4388 175.7642 79 P 4.1874 0.0000 0.0000 66.1019 31.2305 178.8079 80 E 4.0362 8.1400 115.1609 58.7349 29.6349 177.4457 81 M 4.5539 7.9070 116.9843 55.1443 33.0750 177.5178 82 M 3.9531 8.0634 121.0070 58.4562 32.0936 178.4198 83 E 3.9366 8.0506 117.2050 59.6295 29.8001 178.5386 84 M 3.9889 7.9452 118.6974 58.4628 32.3908 178.2900 85 S 4.0452 8.0215 115.2705 61.4898 63.0248 176.5448 86 R 3.8603 8.2643 121.8384 59.2867 29.7224 178.4618 87 K 3.9308 8.1591 119.3667 59.6586 32.2121 179.0165 88 S 4.0588 8.0411 115.4266 61.4582 62.4820 176.7442 89 V 3.7672 7.4532 119.8259 66.1266 31.0579 177.6868 90 E 4.1731 8.4027 117.9673 59.5051 29.1483 179.1385 91 A 4.1109 8.1190 119.6082 54.6136 18.4845 178.1042 92 C 4.8793 8.2967 114.6052 56.1160 40.6172 176.1333 93 R 4.2877 7.8103 120.2237 58.7922 29.1619 177.3540 94 D 4.9105 7.8465 116.4793 53.8734 41.4652 177.4830 95 T 3.9133 7.6955 119.1923 67.0809 68.4013 175.8575 96 H 4.4649 8.3514 115.3159 58.2226 28.7111 177.4365 97 K 3.9614 7.5212 119.0632 58.9813 31.8912 177.9126 98 Q 3.9410 7.9393 116.0573 56.5679 28.8553 175.5645 99 F 4.9660 7.5937 116.0388 55.6406 42.4235 174.9316 100 K 4.6033 8.8076 119.3216 55.8703 33.6078 176.4459 101 E 4.7784 7.8550 119.6413 53.4819 33.6556 176.0583 102 S 4.3887 8.5703 121.8905 61.3391 63.0502 177.6075 103 C 4.3197 8.9126 120.3109 59.7013 40.2724 175.4793 104 E 3.7662 8.3823 120.9282 59.3708 28.9921 179.0283 105 R 3.9452 8.3072 118.2806 59.3787 30.0904 179.2515 106 V 3.5425 7.5519 117.9513 65.8462 31.4855 177.3800 107 Y 3.8896 7.9175 120.6793 60.2936 38.6049 178.2877 108 Q 3.4172 8.0085 118.9687 58.7531 28.4868 178.9306 109 T 3.2606 7.0994 116.7842 66.2605 68.3830 176.5736 110 A 3.0508 7.1962 122.7383 54.4555 18.3094 179.5156 111 K 2.4800 6.8879 118.2957 59.2118 32.1453 178.1549 112 C 3.9893 7.5680 118.6535 59.4114 39.9078 175.2251 113 F 4.1305 7.5207 119.9370 60.8630 38.2750 178.0145 114 S 3.5304 6.8659 111.7933 61.1215 62.7824 175.8939 115 E 4.0969 7.5433 120.7881 57.9848 29.3616 177.6537 116 N 4.7941 7.5497 113.8576 51.6222 39.2349 174.4955 117 A 4.2223 7.0266 125.5209 51.5142 18.9300 177.8823 118 D 4.6016 8.8021 123.0113 54.8224 40.7404 176.7732 119 G 4.1380 7.5578 109.9525 44.6652 0.0000 173.1610 120 Q 4.1607 8.7580 123.1309 56.0084 28.1043 175.2018 121 F 4.8791 8.6455 125.6908 57.8636 40.6739 174.6667 122 M 5.4473 7.3919 122.8240 52.2335 36.0021 174.2059 123 W 4.6533 8.6030 131.8897 54.4748 34.2858 173.5654 124 P 4.3175 0.0000 0.0000 63.1785 30.7557 176.0395 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 1 M 8.15 4.52 0.00 2.26 2.42 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 2 T 8.63 4.15 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 1.26 0.00 0.00 3 M 8.69 4.05 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.70 0.00 4 E 8.17 3.96 0.00 2.09 1.95 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 2.39 2.41 0.00 5 Q 8.08 4.03 0.00 2.37 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 6 F 8.46 4.12 0.00 3.11 3.23 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 7 L 8.10 3.78 0.00 1.74 1.68 0.96 0.70 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 8 T 7.86 4.09 4.35 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 0.00 0.00 0.00 1.18 0.00 0.00 9 S 8.06 4.08 0.00 3.94 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 10 L 7.25 3.70 0.00 1.59 1.58 0.68 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 11 D 7.47 4.37 0.00 2.93 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 12 M 7.87 4.04 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.56 0.00 13 I 7.98 3.70 1.74 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 1.32 1.04 0.77 0.00 0.00 14 R 8.01 4.15 0.00 2.23 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 15 S 8.28 4.24 0.00 3.99 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 16 G 7.84 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 17 C 8.28 4.74 0.00 3.26 3.35 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 0.00 0.00 0.00 0.00 18 A 8.66 4.26 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 19 P 0.00 4.22 0.00 2.04 2.17 0.00 3.70 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 2.19 2.24 0.00 20 K 7.78 3.99 0.00 0.88 1.08 0.00 1.64 0.00 0.00 1.54 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.39 7.81 21 F 7.51 4.95 0.00 3.07 3.10 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 22 K 9.32 4.39 0.00 1.72 1.79 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.41 7.81 23 L 8.15 4.86 0.00 1.56 1.38 0.76 0.85 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 24 K 8.19 4.47 0.00 1.73 1.85 0.00 1.82 0.00 0.00 1.93 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.48 7.81 25 T 8.53 3.83 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 1.22 0.00 0.00 26 E 8.03 3.95 0.00 2.01 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 2.22 2.22 0.00 27 D 7.68 4.03 0.00 2.79 2.89 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 0.00 0.00 0.00 0.00 28 L 7.71 3.94 0.00 1.75 1.65 0.75 0.38 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 29 D 8.19 4.35 0.00 2.63 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 30 R 7.51 3.94 0.00 1.81 2.20 0.00 2.63 0.00 0.00 2.87 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 31 L 7.94 3.65 0.00 1.94 1.66 0.80 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.21 4.85 0.00 2.05 2.23 0.00 3.15 0.00 0.00 3.38 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 33 V 7.48 4.12 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 0.78 0.00 0.00 1.10 0.00 0.00 34 G 8.60 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 0.00 0.00 0.00 0.00 35 D 8.12 4.82 0.00 2.93 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 36 F 8.76 4.60 0.00 2.82 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 37 N 8.23 5.02 0.00 2.91 2.99 0.00 0.00 6.01 7.43 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 38 F 7.36 4.94 0.00 3.10 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 39 P 0.00 4.21 0.00 2.08 2.02 0.00 3.88 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 2.07 2.09 0.00 40 P 0.00 4.28 0.00 1.48 1.09 0.00 3.49 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.55 0.00 41 S 8.13 4.36 0.00 4.04 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 42 Q 8.40 3.86 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.89 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 43 D 8.13 4.45 0.00 2.85 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 44 L 7.94 3.85 0.00 1.68 1.64 0.84 0.85 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 45 M 7.67 4.01 0.00 2.18 2.05 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.64 0.00 46 C 8.19 4.34 0.00 2.84 3.26 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 47 Y 7.49 3.38 0.00 2.55 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 48 T 7.87 4.20 4.06 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 1.21 0.00 0.00 49 K 7.89 4.04 0.00 1.92 2.11 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.52 1.52 7.81 50 C 8.49 4.22 0.00 3.31 3.35 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 0.00 0.00 0.00 0.00 51 V 7.74 3.44 2.30 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 0.37 0.00 0.00 0.47 0.00 0.00 52 S 8.45 4.31 0.00 4.12 4.15 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 0.00 0.00 0.00 53 L 8.54 4.04 0.00 1.94 1.77 0.99 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 54 M 7.72 4.05 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 55 A 7.66 4.24 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 56 G 7.77 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 57 A 8.06 4.42 1.55 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 0.00 0.00 0.00 0.00 0.00 58 V 7.74 5.17 2.18 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 1.27 0.00 0.00 1.02 0.00 0.00 59 N 8.42 4.79 0.00 2.96 2.99 0.00 0.00 6.08 7.54 0.00 0.00 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 K 8.54 4.00 0.00 1.80 1.78 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.04 7.81 61 K 8.31 4.30 0.00 1.94 1.89 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.52 1.40 7.81 62 G 8.36 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 0.00 0.00 0.00 63 E 8.46 4.02 0.00 2.17 1.86 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 2.42 2.29 0.00 64 F 8.29 4.59 0.00 2.91 2.97 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 65 N 7.93 4.51 0.00 2.69 2.47 0.00 0.00 6.78 8.19 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 66 A 8.15 3.58 1.43 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 0.00 0.00 67 P 0.00 4.12 0.00 2.24 2.11 0.00 3.63 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 68 K 7.73 3.89 0.00 1.65 1.72 0.00 1.79 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.42 7.81 69 A 8.03 4.13 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 70 L 8.39 3.90 0.00 1.80 1.73 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.86 4.14 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 72 Q 7.96 4.14 0.00 2.23 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.66 0.00 0.00 0.00 0.00 0.00 2.57 2.71 0.00 73 L 7.47 3.91 0.00 1.82 1.69 0.88 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.32 0.00 2.04 2.14 0.00 3.72 0.00 0.00 3.83 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 75 H 7.74 4.91 0.00 3.29 3.36 0.00 5.51 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.75 4.64 0.00 1.59 1.72 0.87 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.27 4.22 1.59 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 0.60 0.00 0.00 0.85 0.00 0.00 78 P 0.00 4.76 0.00 2.20 2.03 0.00 3.33 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.01 0.00 79 P 0.00 4.19 0.00 2.14 2.11 0.00 3.63 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 2.10 2.13 0.00 80 E 8.14 4.04 0.00 1.88 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 2.38 0.00 81 M 7.91 4.55 0.00 1.84 1.69 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 2.32 2.35 0.00 82 M 8.06 3.95 0.00 2.01 2.18 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 2.57 2.80 0.00 83 E 8.05 3.94 0.00 2.22 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 0.00 2.35 2.41 0.00 84 M 7.95 3.99 0.00 2.11 2.17 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.69 0.00 85 S 8.02 4.05 0.00 4.00 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 86 R 8.26 3.86 0.00 1.82 1.98 0.00 3.09 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 87 K 8.16 3.93 0.00 1.90 1.96 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.47 7.81 88 S 8.04 4.06 0.00 3.66 3.71 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 89 V 7.45 3.77 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 1.11 0.00 0.00 0.88 0.00 0.00 90 E 8.40 4.17 0.00 2.29 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 2.37 2.47 0.00 91 A 8.12 4.11 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 92 C 8.30 4.88 0.00 3.09 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 93 R 7.81 4.29 0.00 2.18 2.41 0.00 3.08 0.00 0.00 3.46 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.76 0.00 94 D 7.85 4.91 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.70 3.91 4.12 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 1.25 0.00 0.00 96 H 8.35 4.46 0.00 3.46 3.66 0.00 5.65 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.52 3.96 0.00 1.81 1.83 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.06 7.81 98 Q 7.94 3.94 0.00 1.25 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.70 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 99 F 7.59 4.97 0.00 2.95 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 0.00 100 K 8.81 4.60 0.00 1.75 1.82 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.33 7.81 101 E 7.86 4.78 0.00 1.98 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 2.28 2.28 0.00 102 S 8.57 4.39 0.00 4.18 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 0.00 103 C 8.91 4.32 0.00 3.30 3.20 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 0.00 104 E 8.38 3.77 0.00 2.06 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 2.02 0.00 105 R 8.31 3.95 0.00 2.14 2.20 0.00 3.50 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 106 V 7.55 3.54 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 1.18 0.00 0.00 1.04 0.00 0.00 107 Y 7.92 3.89 0.00 3.00 2.79 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 0.00 108 Q 8.01 3.42 0.00 1.47 1.59 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 1.92 1.16 0.00 109 T 7.10 3.26 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 -0.09 0.00 0.00 110 A 7.20 3.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 K 6.89 2.48 0.00 0.93 1.30 0.00 1.49 0.00 0.00 1.46 0.00 0.00 2.84 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.13 1.25 7.81 112 C 7.57 3.99 0.00 2.83 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 0.00 113 F 7.52 4.13 0.00 2.58 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 0.00 0.00 0.00 114 S 6.87 3.53 0.00 4.23 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 0.00 115 E 7.54 4.10 0.00 1.97 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 0.00 2.27 2.34 0.00 116 N 7.55 4.79 0.00 2.68 2.78 0.00 0.00 6.97 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 0.00 117 A 7.03 4.22 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 0.00 118 D 8.80 4.60 0.00 2.80 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 0.00 119 G 7.56 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 0.00 0.00 0.00 120 Q 8.76 4.16 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.86 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 121 F 8.65 4.88 0.00 3.10 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 0.00 122 M 7.39 5.45 0.00 1.86 1.96 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 2.55 2.52 0.00 123 W 8.60 4.65 0.00 3.68 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 0.00 124 P 0.00 4.32 0.00 1.82 1.92 0.00 2.20 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.73 0.00