NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.3657 8.3044 120.3526 54.9327 33.3718 174.5105 1 L 4.0108 8.5221 129.0201 54.6989 43.2828 173.7531 2 K 5.0642 9.5614 127.3216 54.8377 34.4840 175.1406 3 I 4.6327 9.7489 126.5541 59.5616 40.1812 174.7706 4 Q 5.1491 8.6578 123.6164 54.2570 31.9889 174.3118 5 A 4.9030 9.0594 124.6421 50.8836 23.7575 173.8289 6 Y 4.9872 8.5071 115.2938 55.7540 41.2529 175.7639 7 F 4.2983 9.2252 123.7730 60.2832 39.8007 174.8068 8 N 3.8181 8.3213 123.6925 54.0851 38.5380 174.0021 9 E 4.9220 7.7339 117.4215 55.8934 32.7547 174.7412 10 T 5.1808 8.4927 118.1938 62.9240 72.9709 173.3363 11 A 4.6614 8.5956 123.3973 50.6080 23.1832 175.0273 12 D 5.0610 8.5963 120.6172 52.5595 42.8141 176.2601 13 L 4.4763 8.8991 126.1650 52.8473 42.6133 174.7276 14 P 4.8525 0.0000 0.0000 63.1017 31.5639 177.0629 15 C 4.5617 9.5371 123.6655 56.0502 44.4795 173.0995 16 Q 3.2810 8.0865 116.4003 57.3588 24.9120 174.4805 17 F 4.6158 7.7762 119.3600 56.0971 40.1814 175.2906 18 A 3.8474 8.1950 132.0998 53.0280 18.8076 176.2963 19 N 3.1400 5.7782 110.3627 54.1481 37.2305 176.2672 20 S 4.1624 7.6496 114.0814 61.3214 63.3467 176.3445 21 Q 3.9715 7.8919 117.9356 56.7480 28.8981 175.2595 22 N 4.0484 7.8555 116.2082 54.4420 37.7657 173.4562 23 Q 4.4593 8.0608 115.1419 55.0589 30.6015 175.7675 24 S 4.9720 8.1394 113.0044 56.1235 65.6002 174.9017 25 L 4.1073 8.7648 124.3285 58.4193 41.8504 179.1186 26 S 4.4343 8.0428 110.7171 59.6954 63.2220 174.1282 27 E 4.6119 8.5270 120.2084 56.1323 30.9426 175.3032 28 L 5.2440 7.9949 119.9136 52.7375 45.9358 175.6225 29 V 4.2514 8.4477 120.2806 61.2325 34.2100 174.2623 30 V 4.4781 8.0235 128.7083 61.1982 33.2684 174.5761 31 F 5.5312 8.9456 126.1982 55.5899 43.1502 174.3941 32 W 6.0283 9.1506 120.2681 54.2825 33.0220 174.3760 33 Q 5.7968 9.0366 121.8761 53.5171 32.3060 175.2148 34 D 4.6610 8.4161 119.9481 52.1691 41.6665 176.6763 35 Q 3.9250 7.5155 115.9833 58.9084 28.5919 177.5151 36 E 4.4934 8.2300 115.5483 55.8438 29.6724 175.2917 37 N 4.2231 8.0244 113.7095 54.1550 36.9605 174.2221 38 L 4.5248 8.4407 117.9056 53.6103 43.1462 176.5603 39 V 4.2711 8.3383 122.4292 63.0143 32.4371 175.9320 40 L 4.0586 9.2376 127.6264 56.3857 42.5108 176.3418 41 N 4.9921 7.9160 115.2624 52.3461 42.9143 172.4007 42 E 4.6142 8.3911 123.5594 54.7223 33.5860 173.9205 43 V 4.4352 8.3110 127.2444 61.0079 33.2017 172.6964 44 Y 3.9333 8.8765 128.9522 56.6457 39.3753 175.3022 45 L 3.8160 9.0399 129.1711 55.7116 40.0485 176.6072 46 G 4.0059 8.5711 106.7844 44.7082 0.0000 173.7866 47 K 4.6121 8.0964 121.5691 54.0889 34.2775 175.0758 48 E 4.4041 8.7780 125.6613 56.1124 29.9846 176.2647 49 K 4.4364 8.5171 124.7388 55.0016 33.6772 175.4939 50 F 4.6388 8.9235 124.7054 57.6201 39.3085 176.6519 51 D 4.8459 8.0946 119.5513 53.5317 39.3779 176.5724 52 S 4.6457 7.7954 113.0666 58.2546 64.4519 174.3309 53 V 3.9976 7.3298 119.1967 63.0641 31.9508 175.0745 54 H 4.4949 9.0407 127.3150 55.6054 30.8203 176.0926 55 S 4.2646 8.7213 120.2115 61.3972 62.7209 176.3792 56 K 3.7612 8.6449 120.6850 58.5554 31.8772 176.2385 57 Y 4.7962 8.2389 114.4226 57.5726 39.7497 175.2797 58 M 4.2076 7.7119 119.8397 57.4235 32.2124 176.8992 59 G 4.0123 9.3017 112.4838 45.3125 0.0000 173.5162 60 R 4.7151 8.3938 117.9921 56.1456 31.3617 175.7239 61 T 5.3944 7.6617 108.5122 59.4024 72.2969 173.7363 62 S 4.4833 8.1756 114.6098 57.7058 65.6898 172.8860 63 F 5.1257 8.6714 129.5326 56.9126 40.7477 174.4228 64 D 4.4935 8.0839 126.6441 52.1303 42.0253 176.7729 65 S 2.9547 8.0956 121.8808 60.7761 63.4051 175.5239 66 D 4.3123 8.0438 120.3540 56.7786 40.4900 177.3204 67 S 4.5294 7.6757 109.9450 56.9619 64.7551 173.5833 68 W 3.5542 7.6676 121.6119 58.1006 26.6970 173.6905 69 T 5.3105 6.8232 113.7307 61.8864 73.2303 174.3210 70 L 4.8198 8.4386 127.8194 53.3467 44.5095 174.7875 71 R 4.7308 8.7712 126.9952 54.5915 32.2154 174.2600 72 L 4.7962 8.7025 129.6975 54.1217 43.3925 175.5045 73 H 4.7532 9.5667 124.8545 53.9754 30.6146 174.5803 74 N 4.0178 8.4743 115.9443 54.3655 37.0205 174.2615 75 L 4.3140 8.2194 119.7196 55.3781 43.1569 177.2222 76 Q 5.2532 9.2225 120.9117 53.8927 31.3773 177.1208 77 I 4.0314 8.5027 121.1368 64.3873 37.3157 178.4131 78 K 4.2088 7.9980 117.9015 58.4188 32.1101 177.5623 79 D 4.7381 8.4053 118.6184 55.4462 41.0783 176.9980 80 K 4.2753 7.5896 118.2919 56.9291 33.2723 177.8430 81 G 3.7687 7.6514 106.9122 44.6662 0.0000 170.7791 82 L 5.1839 7.9148 121.8485 53.7614 44.1265 176.0191 83 Y 5.0675 9.3555 123.0795 56.2926 42.2835 174.2878 84 Q 5.0563 9.0597 121.5648 54.7044 33.1028 172.6902 85 C 3.9346 8.9479 126.5120 54.6264 44.7217 172.2697 86 I 4.8357 8.2850 126.4731 59.6068 40.5267 174.2426 87 I 4.6892 8.1436 128.0600 59.7435 39.6092 174.5480 88 H 5.2373 9.0713 124.5144 54.3313 31.8721 173.3419 89 H 4.9646 9.2657 122.4005 54.5146 31.2485 173.7487 90 K 4.4717 8.6321 128.9036 55.8842 32.3375 176.7730 91 K 4.3938 8.4600 127.7062 53.9361 33.7880 174.9832 92 P 4.3591 0.0000 0.0000 66.2835 31.1491 177.6783 93 T 3.9999 7.8029 114.0971 64.9645 69.6772 175.7120 94 G 4.4155 8.1868 110.1791 46.9246 0.0000 175.5282 95 M 5.4930 9.1686 119.5266 53.2986 36.3637 173.6390 96 I 4.6441 8.3594 120.6419 59.5167 41.5009 174.6636 97 R 4.2990 8.7741 128.0891 56.1086 30.2573 175.7639 98 I 4.4821 8.4890 119.1139 60.8201 38.9508 174.6175 99 H 4.6336 7.6533 120.8469 56.0587 33.0261 172.0421 100 Q 5.3669 7.6212 119.6310 56.2162 32.7884 173.3244 101 M 4.6438 8.1587 119.8778 54.7733 35.6614 172.8271 102 N 5.7162 8.8175 121.4669 51.7427 42.0806 174.0857 103 S 4.9581 9.3686 117.0925 56.8709 67.2451 172.7050 104 E 5.0374 9.7561 125.9383 54.6874 31.2988 174.1069 105 L 4.9953 9.2555 130.7837 53.7926 44.1176 175.0220 106 S 4.9890 9.6129 123.8228 56.7529 65.3912 173.1503 107 V 4.6369 8.4367 124.7363 61.2576 33.0016 174.6384 108 L 4.5644 8.3247 128.1835 53.1252 43.9258 177.1214 109 A 4.2983 8.3910 123.5007 52.5487 18.7714 177.4468 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 M 8.30 4.37 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.62 0.00 1 L 8.52 4.01 0.00 1.97 1.62 0.98 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 2 K 9.56 5.06 0.00 1.68 1.73 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.09 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.50 1.68 7.81 3 I 9.75 4.63 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.36 0.92 0.00 0.00 4 Q 8.66 5.15 0.00 1.89 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 5 A 9.06 4.90 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 6 Y 8.51 4.99 0.00 2.99 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 7 F 9.23 4.30 0.00 2.92 3.12 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 0.00 8 N 8.32 3.82 0.00 1.44 2.31 0.00 0.00 7.07 7.26 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 9 E 7.73 4.92 0.00 2.09 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 2.57 2.51 0.00 10 T 8.49 5.18 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 1.03 0.00 0.00 11 A 8.60 4.66 1.12 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 0.00 0.00 0.00 12 D 8.60 5.06 0.00 2.51 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.90 4.48 0.00 1.22 1.41 0.76 0.36 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 14 P 0.00 4.85 0.00 2.22 2.17 0.00 3.88 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 2.15 2.06 0.00 15 C 9.54 4.56 0.00 3.79 3.72 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 16 Q 8.09 3.28 0.00 2.31 2.21 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 2.36 2.45 0.00 17 F 7.78 4.62 0.00 2.40 2.44 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 0.00 0.00 0.00 18 A 8.20 3.85 1.13 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 0.00 0.00 19 N 5.78 3.14 0.00 1.82 2.44 0.00 0.00 7.07 7.51 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 20 S 7.65 4.16 0.00 3.81 3.84 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 21 Q 7.89 3.97 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 22 N 7.86 4.05 0.00 2.72 2.80 0.00 0.00 7.17 6.69 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 23 Q 8.06 4.46 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.42 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 24 S 8.14 4.97 0.00 4.02 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 25 L 8.76 4.11 0.00 1.78 1.76 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.04 4.43 0.00 4.03 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 27 E 8.53 4.61 0.00 2.00 2.03 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 2.25 2.39 0.00 28 L 7.99 5.24 0.00 1.65 1.58 1.07 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 29 V 8.45 4.25 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 0.62 0.00 0.00 0.46 0.00 0.00 30 V 8.02 4.48 1.65 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 0.58 0.00 0.00 0.97 0.00 0.00 31 F 8.95 5.53 0.00 2.90 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 32 W 9.15 6.03 0.00 3.19 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 33 Q 9.04 5.80 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.16 0.00 34 D 8.42 4.66 0.00 2.57 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 35 Q 7.52 3.93 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 7.43 0.00 0.00 0.00 0.00 0.00 2.36 2.14 0.00 36 E 8.23 4.49 0.00 2.08 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 2.23 2.29 0.00 37 N 8.02 4.22 0.00 2.85 2.85 0.00 0.00 6.84 7.47 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 38 L 8.44 4.52 0.00 2.15 1.82 0.97 0.81 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 39 V 8.34 4.27 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 1.18 0.00 0.00 0.94 0.00 0.00 40 L 9.24 4.06 0.00 1.57 1.46 -0.10 0.91 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 41 N 7.92 4.99 0.00 2.74 2.60 0.00 0.00 6.49 7.65 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 42 E 8.39 4.61 0.00 2.15 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 2.12 1.72 0.00 43 V 8.31 4.44 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 0.92 0.00 0.00 0.74 0.00 0.00 44 Y 8.88 3.93 0.00 3.08 2.83 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 0.00 0.00 0.00 45 L 9.04 3.82 0.00 1.83 1.74 0.91 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.57 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 47 K 8.10 4.61 0.00 1.79 1.84 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.44 7.81 48 E 8.78 4.40 0.00 2.13 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 2.20 2.32 0.00 49 K 8.52 4.44 0.00 1.62 1.71 0.00 1.64 0.00 0.00 2.19 0.00 0.00 3.10 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.39 7.81 50 F 8.92 4.64 0.00 3.20 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 51 D 8.09 4.85 0.00 2.80 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.80 4.65 0.00 3.95 4.04 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 53 V 7.33 4.00 2.42 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 1.01 0.00 0.00 1.02 0.00 0.00 54 H 9.04 4.49 0.00 3.40 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.72 4.26 0.00 4.06 4.13 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 56 K 8.64 3.76 0.00 1.40 1.34 0.00 1.10 0.00 0.00 1.29 0.00 0.00 2.81 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.30 1.06 7.81 57 Y 8.24 4.80 0.00 3.19 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 58 M 7.71 4.21 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.94 0.00 59 G 9.30 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 60 R 8.39 4.72 0.00 2.00 2.18 0.00 3.35 0.00 0.00 3.25 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 61 T 7.66 5.39 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 1.25 0.00 0.00 62 S 8.18 4.48 0.00 3.95 3.75 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 63 F 8.67 5.13 0.00 3.07 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 64 D 8.08 4.49 0.00 2.56 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 0.00 0.00 0.00 65 S 8.10 2.95 0.00 3.44 3.60 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 66 D 8.04 4.31 0.00 2.90 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 67 S 7.68 4.53 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 68 W 7.67 3.55 0.00 3.75 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 T 6.82 5.31 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 1.23 0.00 0.00 70 L 8.44 4.82 0.00 0.27 0.13 0.79 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.77 4.73 0.00 1.84 1.77 0.00 3.08 0.00 0.00 2.94 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.54 0.00 72 L 8.70 4.80 0.00 1.49 1.33 1.04 0.69 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 73 H 9.57 4.75 0.00 3.07 3.21 0.00 6.05 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 74 N 8.47 4.02 0.00 2.79 2.80 0.00 0.00 7.01 7.78 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 75 L 8.22 4.31 0.00 1.85 1.63 0.97 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 9.22 5.25 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.78 0.00 0.00 0.00 0.00 0.00 2.55 2.48 0.00 77 I 8.50 4.03 1.86 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 1.34 1.13 0.90 0.00 0.00 78 K 8.00 4.21 0.00 1.78 1.89 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.49 7.81 79 D 8.41 4.74 0.00 2.88 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 80 K 7.59 4.28 0.00 2.04 1.88 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.64 1.44 7.81 81 G 7.65 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 0.00 0.00 0.00 82 L 7.91 5.18 0.00 1.75 1.45 1.04 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 9.36 5.07 0.00 3.12 3.08 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 0.00 0.00 0.00 0.00 84 Q 9.06 5.06 0.00 2.23 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.14 2.31 0.00 85 C 8.95 3.93 0.00 1.87 2.44 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 0.00 0.00 0.00 86 I 8.29 4.84 1.89 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 1.11 0.55 0.88 0.00 0.00 87 I 8.14 4.69 1.31 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.28 0.47 0.00 0.00 88 H 9.07 5.24 0.00 3.07 3.18 0.00 5.79 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 H 9.27 4.96 0.00 3.13 3.16 0.00 5.59 0.00 0.00 0.00 0.00 6.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 8.63 4.47 0.00 1.69 1.60 0.00 1.76 0.00 0.00 1.51 0.00 0.00 3.14 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.64 7.81 91 K 8.46 4.39 0.00 1.72 1.67 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.07 1.23 7.81 92 P 0.00 4.36 0.00 2.17 2.21 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 93 T 7.80 4.00 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 1.21 0.00 0.00 94 G 8.19 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 0.00 0.00 0.00 0.00 95 M 9.17 5.49 0.00 1.89 1.92 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 2.49 2.51 0.00 96 I 8.36 4.64 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 1.11 0.80 0.91 0.00 0.00 97 R 8.77 4.30 0.00 1.67 1.75 0.00 3.05 0.00 0.00 3.17 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.37 0.00 98 I 8.49 4.48 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.66 0.97 0.00 0.00 99 H 7.65 4.63 0.00 2.93 2.63 0.00 5.71 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 7.62 5.37 0.00 1.79 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.45 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 101 M 8.16 4.64 0.00 2.13 1.95 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 2.68 2.74 0.00 102 N 8.82 5.72 0.00 2.64 2.72 0.00 0.00 6.74 7.57 0.00 0.00 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 S 9.37 4.96 0.00 3.93 3.83 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 0.00 0.00 0.00 104 E 9.76 5.04 0.00 2.03 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 2.26 2.27 0.00 105 L 9.26 5.00 0.00 1.86 1.77 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 106 S 9.61 4.99 0.00 3.69 3.70 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 0.00 107 V 8.44 4.64 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 0.92 0.00 0.00 1.04 0.00 0.00 108 L 8.32 4.56 0.00 0.82 1.33 0.63 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.39 4.30 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