NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1594 8.1627 120.2740 54.5514 33.3068 173.9735 2 K 3.8250 8.5256 127.8483 56.5251 32.6650 174.8867 3 G 4.0047 8.4809 115.9971 44.4613 0.0000 171.6997 4 D 4.5293 8.4047 119.3733 53.9671 41.9515 177.2879 5 K 3.9717 8.8812 126.3504 59.7061 32.3352 179.1306 6 I 3.9035 7.6406 121.0841 63.4775 37.0022 178.2904 7 V 3.7079 7.8325 118.7950 66.1756 31.3309 178.0554 8 I 3.7639 7.7778 119.4200 64.3032 36.9576 178.4332 9 Q 3.9370 7.9072 118.9167 59.0148 28.4285 178.5381 10 H 4.1677 8.2240 117.2116 58.8233 28.7429 177.5123 11 L 3.9892 8.0604 120.8770 58.3018 41.5573 179.5811 12 N 4.3301 8.4398 116.2529 56.1636 38.2547 177.0913 13 K 3.8886 7.9970 121.4603 59.5001 32.3203 178.6988 14 I 3.6863 8.3615 113.6784 63.9706 37.3404 177.7281 15 L 4.0060 8.2837 122.4408 58.0837 41.9157 179.2086 16 G 3.6717 8.1375 105.4745 47.7730 0.0000 175.3173 17 N 4.3056 7.8163 118.7339 56.2092 38.6446 177.1658 18 E 3.9194 8.0843 119.7540 59.5850 29.6519 179.2146 19 L 3.9494 7.8805 118.7693 58.0505 41.5816 179.8319 20 I 3.5617 7.5554 118.6269 64.2861 37.0290 177.9942 21 A 3.2715 7.7089 121.4611 55.2192 18.0508 179.2944 22 I 3.5243 7.9118 118.2135 64.9106 37.2184 178.2564 23 N 4.2772 7.8464 116.1448 56.3676 38.4486 177.2328 24 Q 3.8675 8.1146 121.1298 59.6319 29.1137 178.1612 25 Y 4.4431 8.0127 117.7991 60.9541 37.8829 178.0164 26 F 3.9149 8.3899 121.9506 60.8756 39.4953 177.1192 27 L 4.0057 8.1350 120.1651 58.5634 41.9876 178.6220 28 H 3.9615 8.3347 115.9489 58.5434 28.4525 177.7225 29 A 4.1024 8.3744 122.9788 55.4566 18.2535 180.0656 30 R 3.7497 7.8353 116.1942 59.1787 29.9744 179.4079 31 M 3.4855 7.6409 118.9308 58.1247 31.7548 178.2071 32 Y 4.3098 7.4620 116.7312 61.1284 38.1497 177.8740 33 E 3.9115 8.4196 120.5626 59.8073 29.4200 178.6237 34 D 4.3531 7.8992 116.3222 56.8653 41.3324 177.3411 35 W 4.8690 7.9726 116.8159 56.7378 29.3218 177.1301 36 G 3.9761 8.1082 107.4473 46.2665 0.0000 175.6977 37 L 4.4237 8.1650 122.3953 52.6905 38.3141 176.4699 38 E 3.8661 8.1605 122.4398 59.7923 30.0221 179.1793 39 K 3.8326 8.3127 117.8126 59.7534 32.2368 179.0752 40 L 3.9855 7.2460 115.7468 58.0121 41.5396 179.9464 41 G 4.3633 8.1050 106.6508 47.3481 0.0000 175.6043 42 K 3.8803 8.1295 121.9680 59.2996 32.1603 178.4766 43 H 3.8098 8.2733 118.5156 59.4046 29.6188 177.0840 44 E 3.9315 8.2845 119.2472 59.4100 29.5241 178.7458 45 Y 3.9651 7.8864 119.5791 60.9225 38.8484 177.5758 46 H 4.1323 8.0543 116.9915 59.1324 28.9187 177.4713 47 E 3.7788 8.3147 120.5761 59.5336 29.2814 179.7341 48 S 4.1923 7.9445 113.0181 61.4964 62.5897 176.3053 49 I 3.6975 7.3963 121.8027 64.0057 36.7327 178.0744 50 D 4.2364 8.3132 120.4288 57.5670 40.6957 178.6372 51 E 3.9171 7.9802 118.3030 59.5445 29.2582 179.5221 52 M 4.0400 7.7938 118.5821 58.2715 32.0440 178.8834 53 K 3.9927 7.9403 118.6793 59.5322 32.1432 179.2384 54 H 4.2417 8.3340 116.4221 58.9038 28.6248 177.5658 55 A 3.9978 8.1919 122.6700 55.2317 18.1768 179.0891 56 D 4.2548 8.3745 116.6407 57.4395 41.2763 178.6424 57 K 3.9653 8.1284 118.8409 59.5205 32.1084 179.3348 58 L 4.0026 7.9087 119.1217 57.7658 41.4958 179.3433 59 I 3.6650 7.9343 119.8815 64.5658 37.0336 178.3862 60 K 3.9337 8.0529 118.8741 59.5838 31.9183 179.2806 61 R 4.0027 8.1765 118.7672 59.5465 29.9719 178.5699 62 I 3.7155 8.3399 119.7728 64.4338 37.1356 178.2387 63 L 3.9938 8.3121 120.1892 57.9394 41.2533 179.4982 64 F 4.3952 8.3514 119.4621 61.2685 39.7155 176.5682 65 L 4.4378 7.9717 117.0723 53.9018 41.1457 176.8842 66 E 3.8122 7.9254 117.5803 57.6732 27.1951 174.1291 67 G 4.0662 8.0234 107.4575 43.7640 0.0000 173.0719 68 L 4.5855 8.0401 118.8637 51.9821 42.7028 175.2368 69 P 4.4694 0.0000 0.0000 62.6572 31.8018 176.4237 70 N 4.7210 8.8029 121.8822 52.2057 37.9438 173.8789 71 L 4.4694 8.0157 120.4795 54.2525 42.3917 177.7104 72 Q 4.0719 8.1183 121.4312 58.4324 29.3470 175.9815 73 E 4.3913 8.5133 117.0070 55.0069 30.5700 175.5961 74 L 4.5075 8.1965 123.9487 53.1073 44.3642 176.4784 75 G 3.8854 8.4421 115.8818 44.2234 0.0000 172.0738 76 K 3.8686 8.4522 119.9419 56.5792 32.4965 175.7099 77 L 4.5514 8.3117 127.0125 53.4506 43.3796 176.5547 78 L 4.4159 8.2645 126.7953 53.5445 40.4456 174.2403 79 I 4.2779 7.9304 122.7330 59.8351 38.1356 176.6155 80 G 4.0126 8.7166 114.6335 44.9708 0.0000 172.5952 81 E 4.7001 8.6057 117.4344 56.7148 31.5614 176.9290 82 H 5.0568 7.5278 112.8848 53.6327 33.0613 173.2051 83 T 4.0897 8.6600 115.5606 67.6075 68.3664 175.7935 84 K 3.8143 8.3048 120.7069 59.9338 32.2033 178.7337 85 E 4.0709 8.0940 118.8668 59.5622 29.6657 178.4713 86 M 3.9994 8.2522 118.8319 58.3315 31.8930 178.8285 87 L 4.0743 8.3142 119.2754 57.9257 41.8110 179.3840 88 E 3.9833 8.2613 118.5306 59.5936 29.3872 179.2466 89 C 4.2427 8.5057 117.1105 63.0505 28.1356 175.9691 90 D 4.7928 8.3209 120.5495 57.1198 40.4355 178.6636 91 L 3.9917 8.2791 121.1877 58.1225 42.1787 178.8491 92 K 3.9587 8.5282 120.0635 59.3855 32.0076 178.5280 93 L 3.9874 8.0853 120.5883 58.3114 42.1451 178.8114 94 E 4.1555 8.7580 118.2138 58.7329 28.8012 178.8741 95 Q 4.2962 7.9960 117.8245 57.9332 29.1506 177.6392 96 A 4.2636 8.0545 120.6273 54.2088 18.7296 179.0991 97 G 3.8010 7.7148 103.6763 46.6722 0.0000 176.0859 98 L 4.0104 7.5612 120.3501 57.5074 41.6944 177.5631 99 P 4.2555 0.0000 0.0000 65.8853 31.2695 178.2737 100 D 4.3968 8.0772 116.8823 57.3855 40.8157 178.6310 101 L 4.0231 7.8571 119.2331 57.8773 41.5515 179.8586 102 K 4.0547 8.4387 118.4334 59.3828 32.1031 179.3764 103 A 4.0007 8.6411 121.1629 54.6239 18.1221 179.5368 104 A 3.7660 7.9690 119.6255 55.0114 18.7617 179.7731 105 I 3.6316 8.2234 118.5325 64.4620 37.3208 178.3684 106 A 3.9869 8.2730 121.8547 55.3847 18.1975 179.1210 107 Y 3.7003 7.7597 117.3291 61.0186 38.8661 177.6933 108 C 4.0008 8.4155 118.0034 62.9699 28.1818 176.0362 109 E 3.9257 8.1237 120.1939 59.4633 28.8603 179.5977 110 S 4.0496 7.4478 112.5995 60.7773 62.9788 175.9801 111 V 4.0769 6.9866 113.0089 59.9262 31.5560 176.1517 112 G 2.9928 7.0304 105.4724 46.6933 0.0000 175.7739 113 D 4.4734 7.5946 120.5653 52.5151 37.7083 175.8312 114 Y 4.3136 7.1863 121.3485 61.0676 38.4630 178.2673 115 A 4.0743 8.0896 121.1137 55.3943 18.6246 179.7552 116 S 4.1800 8.2638 113.2473 61.5242 62.7366 176.9288 117 R 3.9327 7.9115 121.4590 59.5055 29.9695 178.4588 118 E 4.0091 8.3269 118.4659 59.0256 29.3591 179.1446 119 L 3.9337 7.7079 120.0704 58.1979 42.1696 179.0100 120 L 3.9670 7.9024 118.8691 57.8526 41.4846 179.1306 121 E 3.9185 8.5086 118.8613 59.7015 29.5185 179.3577 122 D 4.3105 7.9884 118.0991 57.5974 41.0077 178.7108 123 I 3.5122 7.6388 120.2308 64.2498 37.0592 178.1503 124 L 3.9292 8.5014 121.6146 58.4459 41.7883 178.9013 125 E 4.0231 8.2145 117.1465 59.5418 29.5404 179.5043 126 S 4.2473 8.0191 115.0090 61.5054 62.9231 176.2436 127 E 4.2186 8.0361 122.5901 59.0214 29.3734 179.3545 128 E 4.1135 8.3637 117.6848 58.7504 29.4578 178.8260 129 D 4.5324 8.2054 119.5208 57.1389 41.1537 178.3930 130 H 4.5846 8.1426 116.3934 59.0093 28.6981 177.7758 131 I 3.8825 8.1667 121.8447 64.1452 36.9231 177.8327 132 D 4.3254 8.0769 118.8482 57.0999 41.1387 177.8387 133 W 4.2012 8.3429 128.6344 60.6750 30.7195 177.6230 134 L 3.6143 8.2119 118.5792 58.1023 41.2479 179.6257 135 E 3.9367 8.4558 118.3549 59.4113 29.1897 179.7017 136 T 3.7300 7.6507 115.9191 66.5827 68.4405 176.5930 137 Q 3.5185 7.2902 119.7694 58.8933 28.2445 178.9383 138 L 3.7193 7.3896 119.6860 58.0235 41.4901 179.4630 139 D 4.3625 7.8009 118.1084 56.9354 40.6475 178.8336 140 L 3.9092 7.8176 119.9459 57.7830 41.7154 179.2953 141 I 3.4820 7.4850 120.0215 64.4843 36.8269 177.5506 142 D 4.5723 7.3861 115.5789 55.4142 40.9435 177.8108 143 K 4.3274 7.4504 118.8419 57.0064 33.1822 177.0489 144 I 4.2189 8.2527 110.2652 59.9943 39.3262 176.6985 145 G 3.9771 8.0039 107.8133 45.7052 0.0000 173.8967 146 L 3.9600 8.6147 122.9695 58.3189 41.9843 179.1748 147 E 3.9169 8.2576 117.6506 59.8201 29.4144 179.2675 148 N 4.3312 8.0814 115.6759 56.4798 38.5108 176.7863 149 Y 4.0682 8.4037 120.2663 60.4353 39.0938 177.7872 150 L 3.9242 8.8122 120.8583 57.6030 41.8016 178.7575 151 Q 3.9288 8.1429 120.0167 59.4589 28.7530 178.8853 152 S 4.2574 7.7528 112.1615 60.2014 63.2731 175.1195 153 Q 4.2099 7.9948 121.6736 56.5816 28.3513 177.3289 154 M 4.1696 7.8638 120.9949 58.3135 31.9107 176.0464 155 D 4.5025 7.8796 121.1814 54.4221 41.2881 176.4434 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 8.16 4.16 0.00 1.48 1.86 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 2 K 8.53 3.83 0.00 1.82 1.66 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.46 7.81 3 G 8.48 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 0.00 0.00 0.00 4 D 8.40 4.53 0.00 2.85 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 5 K 8.88 3.97 0.00 1.85 1.78 0.00 1.75 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.50 7.81 6 I 7.64 3.90 1.62 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 1.09 0.19 0.00 0.00 7 V 7.83 3.71 2.32 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 1.27 0.00 0.00 1.18 0.00 0.00 8 I 7.78 3.76 1.99 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 1.52 0.69 0.90 0.00 0.00 9 Q 7.91 3.94 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.32 2.66 0.00 10 H 8.22 4.17 0.00 3.34 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.06 3.99 0.00 1.98 1.75 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.44 4.33 0.00 2.83 2.85 0.00 0.00 6.72 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 13 K 8.00 3.89 0.00 1.94 1.99 0.00 1.52 0.00 0.00 1.66 0.00 0.00 3.06 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.43 1.50 7.81 14 I 8.36 3.69 1.88 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 1.67 0.56 0.93 0.00 0.00 15 L 8.28 4.01 0.00 1.88 1.84 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.14 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 17 N 7.82 4.31 0.00 2.99 2.88 0.00 0.00 6.98 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 18 E 8.08 3.92 0.00 2.12 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 2.58 2.53 0.00 19 L 7.88 3.95 0.00 1.83 1.69 0.90 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.56 3.56 2.02 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 1.41 0.90 0.87 0.00 0.00 21 A 7.71 3.27 1.04 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 0.00 0.00 22 I 7.91 3.52 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.64 0.85 0.00 0.00 23 N 7.85 4.28 0.00 2.88 2.82 0.00 0.00 6.76 8.01 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 24 Q 8.11 3.87 0.00 2.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.64 2.30 0.00 25 Y 8.01 4.44 0.00 3.00 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 26 F 8.39 3.91 0.00 3.37 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 27 L 8.14 4.01 0.00 1.85 1.77 0.91 1.11 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 28 H 8.33 3.96 0.00 3.44 3.15 0.00 5.69 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.37 4.10 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 30 R 7.84 3.75 0.00 1.95 1.91 0.00 2.98 0.00 0.00 2.64 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 31 M 7.64 3.49 0.00 0.84 1.60 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.18 0.00 32 Y 7.46 4.31 0.00 3.21 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 33 E 8.42 3.91 0.00 2.23 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 0.00 2.25 2.35 0.00 34 D 7.90 4.35 0.00 2.67 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 0.00 0.00 0.00 35 W 7.97 4.87 0.00 3.70 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 36 G 8.11 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 37 L 8.16 4.42 0.00 2.03 1.65 0.94 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.16 3.87 0.00 2.38 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 2.33 2.42 0.00 39 K 8.31 3.83 0.00 1.94 1.92 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.39 7.81 40 L 7.25 3.99 0.00 1.45 0.66 1.01 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.10 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.13 3.88 0.00 1.93 1.76 0.00 1.61 0.00 0.00 1.53 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.31 7.81 43 H 8.27 3.81 0.00 3.05 3.03 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.28 3.93 0.00 2.21 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 2.69 3.12 0.00 45 Y 7.89 3.97 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 46 H 8.05 4.13 0.00 3.19 3.21 0.00 5.70 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.31 3.78 0.00 1.95 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 2.21 2.17 0.00 48 S 7.94 4.19 0.00 4.09 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 49 I 7.40 3.70 1.72 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 1.57 0.36 0.89 0.00 0.00 50 D 8.31 4.24 0.00 2.90 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 51 E 7.98 3.92 0.00 2.06 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 2.76 2.43 0.00 52 M 7.79 4.04 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.52 0.00 53 K 7.94 3.99 0.00 2.00 1.87 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.73 7.81 54 H 8.33 4.24 0.00 3.38 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.19 4.00 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 56 D 8.37 4.25 0.00 2.91 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 57 K 8.13 3.97 0.00 2.05 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.78 7.81 58 L 7.91 4.00 0.00 1.86 1.73 0.96 1.04 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 59 I 7.93 3.67 2.05 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.97 0.92 0.00 0.00 60 K 8.05 3.93 0.00 1.98 1.88 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 3.40 0.00 0.00 0.00 0.00 1.47 1.64 7.81 61 R 8.18 4.00 0.00 2.07 2.13 0.00 3.32 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 62 I 8.34 3.72 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.64 0.94 0.00 0.00 63 L 8.31 3.99 0.00 2.06 1.80 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.35 4.40 0.00 2.92 3.30 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 0.00 65 L 7.97 4.44 0.00 2.02 1.61 0.83 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.93 3.81 0.00 2.05 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 2.18 2.30 0.00 67 G 8.02 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 0.00 0.00 0.00 68 L 8.04 4.59 0.00 1.61 1.60 0.91 0.99 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 69 P 0.00 4.47 0.00 2.03 1.98 0.00 3.64 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 70 N 8.80 4.72 0.00 2.63 2.71 0.00 0.00 7.15 7.85 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 71 L 8.02 4.47 0.00 1.65 1.65 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.12 4.07 0.00 1.98 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 73 E 8.51 4.39 0.00 1.95 1.84 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 2.28 2.22 0.00 74 L 8.20 4.51 0.00 1.50 1.48 0.89 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.44 3.89 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 0.00 0.00 0.00 76 K 8.45 3.87 0.00 1.70 1.74 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.51 7.81 77 L 8.31 4.55 0.00 1.59 1.52 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.26 4.42 0.00 1.91 1.68 1.02 0.91 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 79 I 7.93 4.28 1.91 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 1.36 0.78 0.95 0.00 0.00 80 G 8.72 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 81 E 8.61 4.70 0.00 2.04 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 2.31 2.38 0.00 82 H 7.53 5.06 0.00 3.24 3.29 0.00 5.69 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.66 4.09 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 1.49 0.00 0.00 84 K 8.30 3.81 0.00 1.84 1.93 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.13 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.50 7.81 85 E 8.09 4.07 0.00 1.62 1.88 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 2.35 2.37 0.00 86 M 8.25 4.00 0.00 1.86 2.35 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.23 0.00 87 L 8.31 4.07 0.00 1.91 1.68 1.12 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.26 3.98 0.00 2.20 2.02 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 2.32 2.56 0.00 89 C 8.51 4.24 0.00 3.25 3.38 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 90 D 8.32 4.79 0.00 2.91 2.67 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 91 L 8.28 3.99 0.00 1.87 1.87 0.95 0.31 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 92 K 8.53 3.96 0.00 1.94 2.06 0.00 1.71 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.49 7.81 93 L 8.09 3.99 0.00 2.04 2.06 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.76 4.16 0.00 2.25 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 2.71 2.68 0.00 95 Q 8.00 4.30 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.63 0.00 96 A 8.05 4.26 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 97 G 7.71 3.80 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 0.00 98 L 7.56 4.01 0.00 1.89 1.77 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.26 0.00 2.17 2.13 0.00 3.63 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 100 D 8.08 4.40 0.00 2.93 2.74 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 0.00 101 L 7.86 4.02 0.00 1.94 1.73 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.44 4.05 0.00 1.94 1.87 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.66 7.81 103 A 8.64 4.00 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 0.00 104 A 7.97 3.77 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 0.00 105 I 8.22 3.63 2.01 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.66 0.93 0.00 0.00 106 A 8.27 3.99 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 0.00 107 Y 7.76 3.70 0.00 3.23 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 0.00 108 C 8.42 4.00 0.00 3.12 3.16 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 0.00 109 E 8.12 3.93 0.00 2.27 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 2.51 0.00 110 S 7.45 4.05 0.00 3.85 3.80 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 0.00 111 V 6.99 4.08 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 0.26 0.00 0.00 0.85 0.00 0.00 112 G 7.03 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 0.00 0.00 0.00 113 D 7.59 4.47 0.00 2.61 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 0.00 0.00 0.00 0.00 114 Y 7.19 4.31 0.00 3.09 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 0.00 115 A 8.09 4.07 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.26 4.18 0.00 4.09 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 0.00 117 R 7.91 3.93 0.00 1.96 2.25 0.00 3.17 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 118 E 8.33 4.01 0.00 2.24 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 2.52 2.49 0.00 119 L 7.71 3.93 0.00 1.73 1.84 1.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 120 L 7.90 3.97 0.00 1.88 1.71 0.95 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.51 3.92 0.00 2.16 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 2.35 2.61 0.00 122 D 7.99 4.31 0.00 2.87 2.71 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 0.00 123 I 7.64 3.51 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.00 0.75 0.00 0.00 124 L 8.50 3.93 0.00 1.82 1.83 0.94 0.68 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 0.00 125 E 8.21 4.02 0.00 2.09 2.02 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 2.36 2.59 0.00 126 S 8.02 4.25 0.00 4.11 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 0.00 127 E 8.04 4.22 0.00 2.15 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 0.00 2.61 2.40 0.00 128 E 8.36 4.11 0.00 2.05 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 2.36 2.51 0.00 129 D 8.21 4.53 0.00 2.95 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 0.00 130 H 8.14 4.58 0.00 3.60 3.42 0.00 5.64 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.17 3.88 2.07 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 1.50 1.05 1.00 0.00 0.00 132 D 8.08 4.33 0.00 3.07 2.92 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 0.00 0.00 0.00 0.00 133 W 8.34 4.20 0.00 3.50 3.43 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 0.00 134 L 8.21 3.61 0.00 1.95 1.71 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.46 3.94 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 2.31 2.66 0.00 136 T 7.65 3.73 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 1.13 0.00 0.00 137 Q 7.29 3.52 0.00 1.59 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 138 L 7.39 3.72 0.00 1.71 1.60 0.86 1.02 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 0.00 139 D 7.80 4.36 0.00 2.77 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 0.00 140 L 7.82 3.91 0.00 1.55 1.60 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.48 3.48 1.78 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.03 0.81 0.00 0.00 142 D 7.39 4.57 0.00 2.59 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 0.00 143 K 7.45 4.33 0.00 1.74 1.83 0.00 1.62 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.53 7.81 144 I 8.25 4.22 1.90 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.71 0.93 0.00 0.00 145 G 8.00 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 0.00 0.00 0.00 146 L 8.61 3.96 0.00 1.76 1.69 0.99 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.26 3.92 0.00 2.04 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 2.39 2.41 0.00 148 N 8.08 4.33 0.00 3.11 2.89 0.00 0.00 6.74 7.48 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 0.00 149 Y 8.40 4.07 0.00 2.90 3.18 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 0.00 150 L 8.81 3.92 0.00 1.85 1.66 0.89 0.42 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 Q 8.14 3.93 0.00 2.15 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.84 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 152 S 7.75 4.26 0.00 4.00 3.92 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 0.00 0.00 0.00 0.00 153 Q 7.99 4.21 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.84 0.00 0.00 0.00 0.00 0.00 1.81 1.94 0.00 154 M 7.86 4.17 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.58 0.00 155 D 7.88 4.50 0.00 2.62 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 0.00 0.00 0.00