NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.5631 8.3033 117.8196 56.1990 30.2499 173.3829 1D H 3.8810 8.3343 111.0104 56.6105 26.1569 173.3529 1E H 5.1949 7.4235 112.9652 53.8506 33.5155 172.7507 1F H 4.5892 8.9502 117.0107 56.0645 28.8827 174.3664 1G F 4.9237 8.4325 119.7643 57.8608 39.9647 174.3959 2 N 4.6242 8.4568 117.2368 52.3751 38.9986 174.4770 3 L 4.7877 8.0966 123.3388 52.0463 44.0853 174.6059 4 P 4.5250 0.0000 0.0000 61.4339 32.3510 174.2900 5 P 4.3713 0.0000 0.0000 62.6378 32.2307 175.6099 6 G 3.9696 8.4091 106.0205 44.6216 0.0000 172.6392 7 N 4.5964 8.1545 116.9208 51.1727 39.1862 173.9913 8 Y 4.8165 7.9540 112.5372 57.8754 38.4203 178.1522 9 K 4.2318 8.6844 122.3343 58.5547 32.2978 177.2691 10 K 4.7357 7.2184 113.2502 53.3453 35.6113 173.9904 11 P 4.7634 0.0000 0.0000 63.0948 32.4428 175.0681 12 K 4.9161 9.3771 119.0060 55.0837 37.4317 175.0181 13 L 5.0668 9.1908 121.4999 53.2853 44.3308 176.0573 14 L 5.0724 8.7371 123.4528 53.4530 43.5920 174.3920 15 Y 4.4562 8.9406 126.9012 56.4819 40.3198 174.0918 16 C 4.0000 7.9391 127.5714 58.6547 32.6038 174.2079 17 T 4.4194 8.1567 116.3448 63.7572 68.4815 175.1393 18 T 3.8493 6.9929 110.3035 62.8857 68.8874 175.4725 17 G 4.0294 8.3367 111.5448 47.0572 0.0000 175.3393 18 H 4.2293 7.2629 114.9035 56.0857 28.0874 174.8726 22 F 4.8518 9.3288 120.0265 56.4865 40.4186 175.1322 23 L 4.5476 9.0643 125.6595 55.2579 43.2131 175.6110 24 R 4.9849 9.3437 126.3593 54.6160 33.5611 173.7156 25 I 4.7370 8.2407 126.7757 59.5884 38.7331 175.6663 26 L 4.2059 8.9418 128.2430 53.1019 42.5909 176.4556 27 P 4.1668 0.0000 0.0000 65.9478 31.2762 177.2299 28 D 4.5216 7.9686 114.1779 53.6721 39.6070 177.0037 29 G 4.0857 8.5061 109.7553 45.3917 0.0000 173.9656 30 T 4.3529 8.3415 117.3653 63.1864 69.1611 173.7397 31 V 4.9215 8.0403 123.7691 61.2265 34.7655 174.5177 32 D 4.5594 8.7679 126.0160 52.9860 42.8138 174.0800 33 G 4.5962 8.5847 104.6339 45.3611 0.0000 172.2443 34 T 5.0393 8.8700 115.1259 60.4496 71.0014 174.7266 35 R 4.3925 8.8770 124.1164 56.8250 31.1601 176.1958 36 D 4.6251 8.1580 119.3771 53.3227 40.6679 177.0125 37 R 3.6290 8.5849 126.8203 58.2685 30.2445 177.8190 38 S 4.3790 8.2039 111.2371 58.2460 63.6110 174.1214 39 D 4.3732 7.6353 121.5348 55.0618 41.3115 175.6812 40 Q 4.5286 8.3910 122.7475 55.6459 29.2724 175.6870 41 H 4.9103 9.2365 115.3258 55.4742 29.2961 175.0187 42 I 4.5895 7.4808 110.6375 59.8528 38.0678 175.2027 43 Q 4.2717 7.8433 121.9904 55.6693 29.8182 174.6357 44 L 5.0343 8.9517 124.7613 52.8117 45.3583 175.3458 45 Q 4.7852 9.3637 125.3737 54.6425 30.4946 174.4444 46 L 5.2712 8.6138 126.6385 53.8559 43.8716 176.1437 47 S 4.3969 8.4505 114.4920 56.7738 66.9687 172.5862 48 A 4.6798 7.8918 123.6658 50.5424 19.3176 176.6924 49 E 4.0302 8.7549 124.7398 58.7081 30.2302 176.6777 50 S 4.6564 7.4435 112.3422 56.2499 67.1374 173.2039 51 V 3.7423 8.3540 122.0425 64.7992 31.5847 176.5594 52 G 3.9111 9.2198 114.7564 45.3308 0.0000 171.7397 53 E 5.1963 8.4563 120.2463 54.6217 32.1003 175.6362 54 V 4.8924 9.1165 117.6044 59.7546 36.1762 174.3094 55 Y 5.4332 8.4804 119.3638 56.7700 41.0986 175.4146 56 I 4.6278 8.5430 121.6539 59.6650 40.5874 174.0814 57 K 4.8044 8.6474 128.7853 54.0285 35.4141 175.0959 58 S 4.6004 8.7472 122.6710 58.5865 62.6818 174.9936 59 T 3.9129 8.5472 118.2408 64.4631 68.8507 175.9665 60 E 4.0545 8.3652 122.7192 58.4986 29.8386 177.0308 61 T 4.3440 8.1323 105.9610 60.5672 70.0421 175.3227 62 G 3.8210 8.1824 110.0643 45.4817 0.0000 173.9347 63 Q 4.3859 7.5228 119.4902 56.1406 30.1813 174.6871 64 Y 4.6832 9.1014 120.3081 56.1451 40.3291 175.0814 65 L 4.3986 9.1048 126.2543 55.3290 43.4445 175.5412 66 A 5.1025 8.6205 125.9049 50.9138 23.2900 174.3637 67 M 5.3567 8.6611 119.3637 53.8744 34.8460 175.7472 68 D 5.2646 9.6271 126.5259 52.6263 41.2183 176.8113 69 T 4.0363 8.5929 112.6877 64.7973 67.2658 174.2061 70 D 4.8312 8.7410 119.4429 53.9686 41.1190 177.1925 71 G 3.4902 8.6575 108.1622 44.9498 0.0000 173.2025 72 L 4.6966 7.7757 119.9358 53.7753 43.2154 176.2136 73 L 5.0308 8.5747 123.3337 55.1312 42.8309 175.5313 74 Y 4.9680 8.9314 119.4195 56.1633 42.0322 173.3730 75 G 4.2798 8.8142 108.2964 45.0317 0.0000 173.1355 76 S 5.0916 9.0441 121.0708 56.7946 63.9850 175.3133 77 Q 4.4281 9.0357 125.6087 58.1223 28.9920 176.3474 78 T 4.6996 7.5056 106.0998 58.5683 71.8207 171.5256 79 P 3.6272 0.0000 0.0000 62.2259 32.1770 175.1853 80 N 4.9829 8.0340 118.1067 51.1292 40.3831 174.4566 81 E 4.0306 8.6670 114.9896 58.9677 29.8567 177.6156 82 E 4.1416 8.6557 118.8225 57.8902 29.8058 177.5314 83 C 4.9133 7.7540 114.8498 59.3129 29.0113 173.3587 84 L 4.5903 7.3726 121.0119 53.6531 43.0316 175.6404 85 F 5.1541 8.9848 121.4350 55.5917 43.5001 174.4009 86 L 4.8934 9.3281 123.1001 53.8080 42.5110 175.6016 87 E 4.5265 8.8880 126.9289 55.5577 30.1302 175.8478 88 R 4.8533 8.6544 125.3088 54.1496 34.9658 174.5021 89 L 4.8012 8.6376 123.2036 55.0275 43.2867 175.7148 90 E 4.6806 8.8936 124.1491 55.2455 33.5383 174.9879 91 E 3.9951 9.6964 123.8712 57.5788 27.2743 174.1708 92 N 4.3047 8.5101 111.1336 54.1682 36.4980 174.0637 93 H 4.8889 8.3967 116.3752 57.7081 37.0508 173.5170 94 Y 4.5356 7.5883 116.0964 57.5424 39.9338 173.6276 95 N 5.4697 9.3498 118.9714 52.0697 40.9118 174.5824 96 T 5.1456 8.8479 112.9452 60.1410 73.0925 172.6300 97 Y 5.0897 8.6268 118.7642 56.7218 41.9021 174.0972 98 I 4.6684 8.5741 126.0560 59.1739 39.5384 175.3891 99 S 4.0240 9.1287 122.7163 58.6521 62.3429 174.0402 100 K 3.9526 8.7871 129.4143 59.3267 32.2174 178.7993 101 K 3.8374 7.8542 118.3076 58.8331 32.3948 176.4979 102 H 4.6885 8.1003 115.1931 54.0637 29.6046 176.0369 103 A 4.0567 7.6967 125.3580 54.9870 18.2144 180.8059 104 E 3.9798 8.0984 113.6528 58.6216 29.7468 178.3218 105 K 4.4016 7.6288 116.7011 55.1429 32.8313 175.7762 106 N 3.7994 7.5643 115.1478 53.9562 36.5229 175.0666 107 W 4.9804 7.7145 117.6203 56.2639 30.7219 177.6231 108 F 5.4066 9.1068 124.0592 55.6562 41.3397 175.7807 109 V 4.0202 9.0162 121.5470 62.9159 32.5019 175.2158 110 G 4.5310 8.6596 113.0970 45.1064 0.0000 171.3555 111 L 5.3017 8.4752 121.8570 52.5399 45.1830 176.9105 112 K 4.1658 9.0786 122.8451 55.2659 33.1013 178.3398 113 K 4.0148 8.4430 120.0984 59.5154 31.9817 177.9169 114 N 4.5185 8.0165 113.6174 52.9712 37.7167 175.8400 115 G 3.5615 8.3748 108.9608 45.0990 0.0000 173.3087 116 S 4.9633 8.1239 114.8640 57.0479 65.3088 173.7579 117 C 4.7583 8.4868 118.6896 59.8114 28.8595 173.3166 118 K 4.4244 8.7378 121.5819 55.3103 33.3518 176.8430 119 R 4.1833 8.4499 123.3511 55.4152 31.2787 177.1023 120 G 3.3903 8.3551 114.9005 48.3078 0.0000 174.1326 121 P 4.1409 0.0000 0.0000 64.5879 31.3600 177.7013 122 R 4.1893 7.6894 115.2853 56.9479 30.3815 176.5605 123 T 4.9533 7.5155 108.1266 60.0161 70.3826 173.4771 124 H 4.6719 7.8394 115.3502 55.0839 30.3237 173.2613 125 Y 3.9601 8.7037 118.4509 59.9930 38.0938 177.0980 126 G 4.0760 9.0597 111.2932 45.3948 0.0000 173.7639 127 Q 4.3219 7.4249 118.9200 54.6412 30.0632 177.2677 128 K 3.8075 8.3618 120.3516 59.1216 32.6348 179.2935 129 A 3.9602 8.0835 121.0520 53.7406 18.2884 178.3687 130 I 4.3763 6.7127 105.1325 60.1943 38.2432 175.4336 131 L 4.3713 7.2544 122.5940 53.9255 42.2103 176.1379 132 F 5.0494 9.2802 122.5826 55.5474 42.9893 174.6144 133 L 5.2097 9.4434 122.6979 52.2206 44.0639 174.0748 134 P 5.1430 0.0000 0.0000 62.7515 32.3004 175.7975 135 L 5.0245 9.1940 122.7268 52.0708 45.7410 174.4546 136 P 4.6434 0.0000 0.0000 62.6828 32.3932 177.0896 137 V 3.8309 8.1628 113.9413 61.7437 31.6793 176.3416 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 1C H 8.30 4.56 0.00 3.27 3.31 0.00 5.91 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.33 3.88 0.00 3.29 3.36 0.00 5.64 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.42 5.19 0.00 3.15 3.22 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.95 4.59 0.00 3.36 3.40 0.00 5.47 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.43 4.92 0.00 2.85 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 2 N 8.46 4.62 0.00 2.95 2.79 0.00 0.00 6.87 6.74 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 3 L 8.10 4.79 0.00 1.47 1.41 0.56 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.52 0.00 2.24 2.03 0.00 3.71 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 5 P 0.00 4.37 0.00 2.17 2.07 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 6 G 8.41 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 7 N 8.15 4.60 0.00 2.71 2.73 0.00 0.00 5.93 7.55 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 8 Y 7.95 4.82 0.00 3.08 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 9 K 8.68 4.23 0.00 1.87 1.90 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.52 1.52 7.81 10 K 7.22 4.74 0.00 1.70 1.67 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.35 7.81 11 P 0.00 4.76 0.00 2.07 2.05 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 12 K 9.38 4.92 0.00 1.64 1.84 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.62 7.81 13 L 9.19 5.07 0.00 1.71 1.64 0.68 0.61 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 14 L 8.74 5.07 0.00 1.60 1.65 0.41 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.94 4.46 0.00 2.97 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 C 7.94 4.00 0.00 2.57 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 0.00 0.00 0.00 0.00 17 T 8.16 4.42 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 0.97 0.00 0.00 18 T 6.99 3.85 4.09 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 1.07 0.00 0.00 17 G 8.34 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 18 H 7.26 4.23 0.00 3.54 3.18 0.00 7.86 0.00 0.00 0.00 0.00 5.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 F 9.33 4.85 0.00 3.17 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 23 L 9.06 4.55 0.00 1.87 1.55 0.92 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.34 4.98 0.00 1.92 2.04 0.00 3.29 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.80 0.00 25 I 8.24 4.74 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.73 0.89 0.00 0.00 26 L 8.94 4.21 0.00 1.84 1.51 0.91 0.81 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 27 P 0.00 4.17 0.00 2.00 2.13 0.00 3.53 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.02 0.00 28 D 7.97 4.52 0.00 2.79 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 29 G 8.51 4.09 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 0.00 30 T 8.34 4.35 4.34 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 1.22 0.00 0.00 31 V 8.04 4.92 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 0.90 0.00 0.00 0.95 0.00 0.00 32 D 8.77 4.56 0.00 2.87 2.73 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 33 G 8.58 4.60 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 0.00 34 T 8.87 5.04 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 1.39 0.00 0.00 35 R 8.88 4.39 0.00 1.88 2.02 0.00 3.23 0.00 0.00 3.11 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.36 0.00 36 D 8.16 4.63 0.00 2.82 2.62 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 37 R 8.58 3.63 0.00 1.81 1.85 0.00 3.19 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.65 0.00 38 S 8.20 4.38 0.00 3.94 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 39 D 7.64 4.37 0.00 2.80 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 40 Q 8.39 4.53 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.06 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 41 H 9.24 4.91 0.00 3.32 3.45 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.48 4.59 1.88 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 1.52 0.92 1.01 0.00 0.00 43 Q 7.84 4.27 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.89 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 44 L 8.95 5.03 0.00 1.50 1.45 0.83 0.87 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 45 Q 9.36 4.79 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 46 L 8.61 5.27 0.00 1.81 1.69 0.92 1.08 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 47 S 8.45 4.40 0.00 3.79 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 48 A 7.89 4.68 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 49 E 8.75 4.03 0.00 1.48 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 2.14 2.24 0.00 50 S 7.44 4.66 0.00 3.86 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 51 V 8.35 3.74 2.31 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 0.95 0.00 0.00 1.03 0.00 0.00 52 G 9.22 3.91 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 0.00 0.00 0.00 53 E 8.46 5.20 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 2.24 2.32 0.00 54 V 9.12 4.89 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 0.71 0.00 0.00 1.22 0.00 0.00 55 Y 8.48 5.43 0.00 3.03 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 56 I 8.54 4.63 1.73 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.58 0.68 0.00 0.00 57 K 8.65 4.80 0.00 1.32 1.36 0.00 1.26 0.00 0.00 0.76 0.00 0.00 2.62 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.98 0.73 7.81 58 S 8.75 4.60 0.00 3.88 3.64 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.55 3.91 4.20 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 1.22 0.00 0.00 60 E 8.37 4.05 0.00 1.97 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 2.25 2.35 0.00 61 T 8.13 4.34 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 1.24 0.00 0.00 62 G 8.18 3.82 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 0.00 0.00 0.00 63 Q 7.52 4.39 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.74 0.00 0.00 0.00 0.00 0.00 2.53 2.33 0.00 64 Y 9.10 4.68 0.00 2.79 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 65 L 9.10 4.40 0.00 1.61 1.55 0.80 0.14 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 66 A 8.62 5.10 0.59 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 67 M 8.66 5.36 0.00 2.28 2.27 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.74 0.00 68 D 9.63 5.26 0.00 2.92 2.85 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 69 T 8.59 4.04 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 1.27 0.00 0.00 70 D 8.74 4.83 0.00 2.70 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 71 G 8.66 3.49 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 0.00 0.00 0.00 72 L 7.78 4.70 0.00 1.88 1.64 0.91 0.62 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 73 L 8.57 5.03 0.00 1.58 1.63 0.92 0.95 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 74 Y 8.93 4.97 0.00 3.00 3.01 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 75 G 8.81 4.28 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 0.00 76 S 9.04 5.09 0.00 3.77 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 77 Q 9.04 4.43 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 78 T 7.51 4.70 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 1.22 0.00 0.00 79 P 0.00 3.63 0.00 1.53 0.49 0.00 3.49 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 80 N 8.03 4.98 0.00 2.90 2.91 0.00 0.00 6.02 7.66 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 81 E 8.67 4.03 0.00 2.03 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 2.26 2.30 0.00 82 E 8.66 4.14 0.00 2.36 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 0.00 2.39 2.34 0.00 83 C 7.75 4.91 0.00 3.24 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 84 L 7.37 4.59 0.00 1.39 1.37 0.78 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 85 F 8.98 5.15 0.00 3.08 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 86 L 9.33 4.89 0.00 1.61 1.70 1.03 0.83 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 87 E 8.89 4.53 0.00 2.24 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 2.25 2.14 0.00 88 R 8.65 4.85 0.00 1.80 1.83 0.00 3.15 0.00 0.00 2.97 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 89 L 8.64 4.80 0.00 1.53 1.60 0.97 1.10 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 90 E 8.89 4.68 0.00 2.25 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 2.30 2.47 0.00 91 E 9.70 4.00 0.00 2.44 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 0.00 2.30 2.42 0.00 92 N 8.51 4.30 0.00 2.82 2.87 0.00 0.00 6.85 8.16 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 93 H 8.40 4.89 0.00 2.77 2.75 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.59 4.54 0.00 3.04 2.85 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 95 N 9.35 5.47 0.00 3.03 2.65 0.00 0.00 6.90 6.61 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 96 T 8.85 5.15 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 97 Y 8.63 5.09 0.00 2.81 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 98 I 8.57 4.67 1.80 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.21 0.45 0.72 0.00 0.00 99 S 9.13 4.02 0.00 4.07 4.09 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 0.00 100 K 8.79 3.95 0.00 1.70 1.63 0.00 1.67 0.00 0.00 1.43 0.00 0.00 2.70 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.23 1.15 7.81 101 K 7.85 3.84 0.00 1.77 1.65 0.00 1.81 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.09 1.30 7.81 102 H 8.10 4.69 0.00 2.97 2.04 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.70 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 0.00 104 E 8.10 3.98 0.00 2.05 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 0.00 2.21 2.16 0.00 105 K 7.63 4.40 0.00 1.13 1.91 0.00 1.68 0.00 0.00 1.53 0.00 0.00 2.44 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.21 7.81 106 N 7.56 3.80 0.00 2.99 2.78 0.00 0.00 6.89 7.40 0.00 0.00 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 W 7.71 4.98 0.00 3.30 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 0.00 108 F 9.11 5.41 0.00 2.88 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 0.00 109 V 9.02 4.02 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 0.68 0.00 0.00 0.47 0.00 0.00 110 G 8.66 4.53 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 0.00 111 L 8.48 5.30 0.00 1.45 1.44 0.99 1.01 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 0.00 112 K 9.08 4.17 0.00 1.91 1.65 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.34 7.81 113 K 8.44 4.01 0.00 1.70 1.85 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.35 7.81 114 N 8.02 4.52 0.00 2.78 2.89 0.00 0.00 6.21 7.00 0.00 0.00 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 G 8.37 3.56 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 0.00 0.00 0.00 116 S 8.12 4.96 0.00 3.87 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 0.00 117 C 8.49 4.76 0.00 2.88 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 0.00 118 K 8.74 4.42 0.00 1.68 1.67 0.00 1.60 0.00 0.00 1.54 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.31 7.81 119 R 8.45 4.18 0.00 1.73 1.62 0.00 3.21 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.47 0.00 120 G 8.36 3.39 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 0.00 121 P 0.00 4.14 0.00 1.85 2.11 0.00 2.96 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 1.61 1.40 0.00 122 R 7.69 4.19 0.00 1.84 1.92 0.00 3.28 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 123 T 7.52 4.95 4.32 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 1.26 0.00 0.00 124 H 7.84 4.67 0.00 3.37 3.51 0.00 5.47 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 0.00 125 Y 8.70 3.96 0.00 3.12 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 0.00 126 G 9.06 4.08 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 0.00 0.00 0.00 127 Q 7.42 4.32 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.75 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 128 K 8.36 3.81 0.00 1.61 1.64 0.00 1.49 0.00 0.00 1.59 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.26 7.81 129 A 8.08 3.96 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 0.00 130 I 6.71 4.38 1.51 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.78 0.49 0.00 0.00 131 L 7.25 4.37 0.00 1.09 0.92 0.13 0.34 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 0.00 132 F 9.28 5.05 0.00 3.39 3.11 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 0.00 133 L 9.44 5.21 0.00 1.96 1.77 1.03 1.41 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 0.00 134 P 0.00 5.14 0.00 2.17 2.21 0.00 3.82 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 135 L 9.19 5.02 0.00 1.68 1.63 1.10 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 136 P 0.00 4.64 0.00 1.94 1.99 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 137 V 8.16 3.83 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 0.68 0.00 0.00 0.92 0.00 0.00