NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8623 8.3549 109.7381 45.3635 0.0000 173.2050 2 S 4.3584 8.3941 116.6788 56.4418 63.2419 172.5734 3 S 4.6744 8.5361 118.9794 57.1835 67.6697 171.1236 4 G 3.8589 8.9571 113.7351 45.6747 0.0000 175.7219 5 S 4.7210 8.9039 115.2970 56.7130 65.2887 173.1754 6 S 4.4596 8.1034 119.3103 57.5193 66.4739 174.3463 7 G 3.8439 8.3314 111.2342 44.9492 0.0000 173.4153 8 I 3.6276 7.9929 120.4738 60.3628 37.3964 174.6188 9 P 4.2866 0.0000 0.0000 62.8904 31.0194 175.3262 10 E 4.5929 8.3188 122.0273 54.2424 33.2340 175.2834 11 L 4.5946 7.9929 122.3323 53.2401 44.2891 176.0955 12 K 4.5424 8.2040 120.8747 55.5997 35.0235 175.3754 13 D 4.5945 8.0233 121.0574 53.8072 45.6975 175.6181 14 H 4.6514 9.2031 123.2789 55.1795 30.5682 174.7870 15 L 4.1563 7.8581 126.8059 53.4358 43.6913 175.8744 16 R 4.1581 7.7175 117.9025 56.2694 30.8025 176.1916 17 I 5.5041 8.7444 124.7921 58.5421 39.8897 174.9499 18 F 4.7104 8.9665 128.4101 56.5861 42.0990 174.8418 19 R 4.0656 7.6899 123.8631 53.2883 30.9249 173.7824 20 P 4.0287 0.0000 0.0000 64.3845 31.8205 177.5668 21 R 4.4817 6.6280 118.6374 55.5870 30.5133 175.7949 22 K 4.1827 7.4805 115.0762 55.2259 34.8180 173.9878 23 L 3.9417 8.5453 122.9816 55.7932 41.6979 176.8561 24 T 4.7370 8.0677 116.5575 60.6672 70.4287 172.5439 25 L 4.8253 7.7897 124.8307 53.9765 45.6049 176.1988 26 K 3.8716 9.4074 118.6226 57.6120 31.2356 179.2023 27 G 3.9127 8.8681 109.4337 46.9169 0.0000 176.5154 28 Y 4.4321 9.2256 113.0134 57.3415 39.5283 174.7217 29 R 4.6160 8.3337 121.4477 54.1163 32.9173 175.0500 30 Q 3.9749 8.8894 124.0324 57.1188 28.9952 175.4492 31 H 5.4641 7.7083 118.3760 54.2007 33.9880 172.1061 32 W 5.2801 9.3869 129.6272 56.0704 32.0527 174.7220 33 V 4.8480 7.9264 126.2986 61.2494 34.7329 174.3429 34 V 4.7126 8.3914 124.9103 61.5988 35.0890 173.0078 35 F 4.9829 8.7168 130.8568 56.8388 40.7553 174.4543 36 K 3.8509 8.3480 127.3370 54.5791 34.7529 176.1089 37 E 3.3848 8.0682 121.0572 58.2365 29.9398 178.1604 38 T 4.7156 7.6275 105.2146 61.5949 70.7865 172.4121 39 T 5.0205 7.5034 118.0911 62.6250 73.6965 172.6122 40 L 5.0009 8.2828 122.6920 54.5938 45.6499 174.0827 41 S 5.0906 8.9038 121.5584 57.3935 68.0644 172.4731 42 Y 5.1061 8.2882 119.5569 55.8287 42.2006 172.9817 43 Y 4.9499 9.6392 116.0702 56.3195 42.4625 177.0072 44 K 3.6985 8.8094 119.9988 59.4297 33.4949 177.7186 45 S 4.6204 8.0575 112.9341 56.7804 65.1180 174.4693 46 Q 3.4313 8.7283 128.5401 59.3671 29.1952 178.6030 47 D 4.1737 8.1949 116.6586 57.7483 40.8870 177.6222 48 E 3.8561 8.3447 117.4255 59.9383 29.8178 178.1916 49 A 4.3463 7.1840 120.8217 51.0755 18.8921 175.9057 50 P 4.4210 0.0000 0.0000 63.9363 31.6842 178.1931 51 G 3.3732 7.1784 100.7407 48.9253 0.0000 173.4128 52 D 4.6769 8.2103 116.3449 51.7205 44.9795 173.2838 53 P 3.8470 0.0000 0.0000 61.9374 32.1409 176.4454 54 I 3.5395 7.3620 120.0426 64.2967 36.9176 177.1808 55 Q 4.2482 6.9778 116.2852 55.0627 31.3541 173.1736 56 Q 4.6389 8.7957 122.2958 54.4324 29.9377 175.2190 57 L 4.8863 8.5040 121.2429 54.0532 44.5483 175.3669 58 N 4.7786 8.7944 119.2333 51.8340 37.1824 174.3665 59 L 4.0063 8.8373 125.8330 57.8759 41.8622 176.2695 60 K 4.1869 7.2657 121.3123 58.5164 31.0654 174.0770 61 G 3.5566 8.0766 117.9693 45.4651 0.0000 171.8566 62 C 4.3944 8.0665 115.6460 58.3901 30.5734 172.6918 63 E 4.7472 9.3566 119.6256 54.4400 32.0811 174.9550 64 V 4.7136 8.2950 124.2209 61.3795 34.4202 174.4621 65 V 4.4979 8.5654 129.3449 60.2141 33.4546 173.0026 66 P 4.8349 0.0000 0.0000 62.4537 31.6115 176.2869 67 D 5.0343 8.7942 125.5551 53.7359 41.2862 175.9334 68 V 4.0418 7.8257 110.6468 60.2857 33.4343 176.7951 69 N 4.6872 8.0155 120.2325 50.6390 39.7192 174.9283 70 V 3.2677 8.1804 123.6130 65.8117 31.8730 178.3989 71 S 4.0514 7.9753 114.7146 61.1648 62.9001 175.0716 72 G 4.0366 7.8159 108.0436 47.2824 0.0000 172.1694 73 Q 2.9741 7.7730 112.9286 56.4314 27.5023 174.5109 74 K 4.3005 6.7388 117.6400 54.7546 35.7476 175.6218 75 F 4.6497 8.2541 124.4285 56.8408 42.3474 172.6514 76 C 5.3359 8.5313 123.5268 57.5467 34.9793 172.8969 77 I 4.7587 8.9495 123.7197 59.4964 40.6434 174.7995 78 K 4.7027 8.9022 130.5070 55.4904 33.0219 175.4534 79 L 4.8847 8.4381 131.7132 53.7456 43.5455 174.8842 80 L 4.7320 8.9638 130.3757 53.5370 43.8541 175.1833 81 V 4.8191 8.1663 126.4092 60.1028 34.6379 172.9476 82 P 4.8231 0.0000 0.0000 62.9932 31.9118 175.8681 83 S 4.7652 8.4406 117.4093 56.0226 66.4951 173.1233 84 P 4.5838 0.0000 0.0000 64.2021 31.3423 176.5744 85 E 4.5599 7.3251 116.7763 57.2268 32.4646 175.9686 86 G 3.7913 8.0214 112.1637 45.3699 0.0000 173.7411 87 M 4.6598 8.5310 117.7017 54.2146 37.4967 176.2762 88 S 4.5556 8.6539 114.5461 56.7976 63.4425 171.9912 89 E 4.5991 8.0562 120.4941 54.9167 30.5501 175.0771 90 I 4.2473 7.9892 128.1815 59.5312 40.7805 174.3577 91 Y 5.0480 8.2446 124.0653 56.6858 39.9196 174.4381 92 L 5.5987 8.5037 125.1099 52.2061 44.7229 175.4468 93 R 5.0157 8.5523 124.6086 54.7795 32.3211 174.4808 94 C 4.8659 9.1157 124.6501 58.3434 29.4984 174.2271 95 Q 4.1179 8.2272 121.3592 58.6185 28.8218 175.3967 96 D 5.1617 7.6596 116.3470 50.3911 42.9056 175.3703 97 E 2.6759 8.2356 115.9903 59.0478 29.4470 178.3082 98 Q 3.8907 7.9351 118.7500 59.2249 28.8361 178.4057 99 Q 4.1478 8.4237 119.7635 59.7546 29.0130 177.7330 100 Y 4.1207 7.6609 119.2448 60.2285 38.8331 177.3579 101 A 3.6071 8.6775 121.7188 55.8386 18.2872 179.3837 102 R 3.8773 7.7517 115.0212 59.5384 30.3367 178.9102 103 W 3.7538 8.7589 118.3357 59.9561 29.2086 178.0203 104 M 3.6218 8.5138 117.1607 59.1449 31.7441 178.2392 105 A 4.0151 8.0345 120.4933 55.4867 18.5874 179.9507 106 G 3.3840 8.2644 104.2344 47.9541 0.0000 175.7606 107 C 4.1469 7.6923 119.1802 62.6290 28.1935 176.3254 108 R 3.9301 7.9411 118.9955 59.4514 29.5798 178.8581 109 L 4.0356 7.9547 118.2608 57.8686 41.5174 179.5851 110 A 4.6213 8.0138 121.8858 54.5773 18.1100 179.5276 111 S 4.2427 8.4171 112.1039 61.3566 62.2243 175.6593 112 K 4.4388 7.8484 118.1838 56.4857 31.9121 176.4489 113 G 4.1202 8.2679 109.6117 45.6459 0.0000 174.4943 114 R 4.1638 7.4453 118.3189 56.4231 30.8412 175.1812 115 T 4.9334 7.8882 106.9703 59.9607 71.7755 174.3995 116 M 3.7918 8.7244 121.9531 58.6075 32.3036 177.1777 117 A 3.9854 7.2642 120.6303 55.1284 18.3607 177.6621 118 D 4.5717 8.0313 114.3957 54.1880 42.3045 177.3811 119 S 4.2819 8.7178 119.6622 61.6393 63.3681 176.8001 120 S 4.1136 8.6417 116.7298 62.1728 62.4158 175.8613 121 Y 4.1939 7.7443 120.2624 61.7084 38.4656 178.4498 122 T 3.3222 8.0648 113.0550 64.9903 67.5628 176.0675 123 S 4.1018 8.1540 115.0804 60.8310 62.2502 175.9812 124 E 4.0677 7.9551 121.3187 58.9314 29.5851 178.5705 125 V 3.4443 7.4113 117.6843 66.5663 31.3393 177.5468 126 Q 3.9251 8.1567 117.4945 58.3068 28.5113 178.1492 127 A 3.9986 7.7871 120.0704 56.1060 18.3958 179.3907 128 I 3.8894 8.1705 118.1550 63.9752 36.9680 178.5988 129 L 3.8882 7.9738 120.2499 58.0000 41.9676 179.6479 130 A 4.1120 8.2164 120.4922 55.1014 18.4788 179.1374 131 F 4.1105 8.5009 119.4849 61.6723 39.2021 177.3401 132 L 3.7320 8.0011 116.9866 58.0681 41.2766 179.0876 133 S 4.2022 7.9951 112.6212 61.4675 61.9938 176.2239 134 L 3.9315 7.6309 119.8591 57.9153 41.5129 178.6760 135 Q 3.9200 7.3242 116.6063 58.2430 28.9069 178.2293 136 R 3.9301 6.6103 115.8404 56.2316 31.0694 176.6674 137 T 4.0737 8.2258 114.4202 64.0783 68.5010 174.9302 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 G 8.35 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 0.00 0.00 0.00 0.00 2 S 8.39 4.36 0.00 3.95 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 3 S 8.54 4.67 0.00 3.78 3.68 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 4 G 8.96 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 0.00 0.00 0.00 0.00 5 S 8.90 4.72 0.00 3.83 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 6 S 8.10 4.46 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 7 G 8.33 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 0.00 0.00 0.00 8 I 7.99 3.63 1.81 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 1.42 0.53 0.80 0.00 0.00 9 P 0.00 4.29 0.00 1.98 1.97 0.00 3.60 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.86 0.00 10 E 8.32 4.59 0.00 1.75 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 1.99 2.18 0.00 11 L 7.99 4.59 0.00 1.18 1.02 0.37 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.20 4.54 0.00 1.76 1.99 0.00 2.00 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.39 1.56 7.81 13 D 8.02 4.59 0.00 2.78 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 H 9.20 4.65 0.00 3.51 3.41 0.00 5.72 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.86 4.16 0.00 1.31 1.31 -0.67 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 16 R 7.72 4.16 0.00 1.99 1.72 0.00 2.74 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.35 0.00 17 I 8.74 5.50 2.01 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.72 0.91 0.00 0.00 18 F 8.97 4.71 0.00 1.76 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 19 R 7.69 4.07 0.00 1.64 1.57 0.00 3.09 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.38 0.00 20 P 0.00 4.03 0.00 2.14 2.19 0.00 3.33 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 1.89 2.03 0.00 21 R 6.63 4.48 0.00 1.85 1.92 0.00 3.33 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 22 K 7.48 4.18 0.00 1.55 1.53 0.00 1.66 0.00 0.00 1.67 0.00 0.00 3.10 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.21 1.40 7.81 23 L 8.55 3.94 0.00 1.67 1.65 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.07 4.74 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 1.28 0.00 0.00 25 L 7.79 4.83 0.00 1.62 1.52 0.94 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 26 K 9.41 3.87 0.00 1.92 1.94 0.00 1.82 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.38 1.51 7.81 27 G 8.87 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 28 Y 9.23 4.43 0.00 2.99 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 29 R 8.33 4.62 0.00 1.72 1.71 0.00 3.34 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 30 Q 8.89 3.97 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.61 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 31 H 7.71 5.46 0.00 3.17 3.53 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 W 9.39 5.28 0.00 3.42 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 33 V 7.93 4.85 2.26 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 0.97 0.00 0.00 1.00 0.00 0.00 34 V 8.39 4.71 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 0.90 0.00 0.00 0.73 0.00 0.00 35 F 8.72 4.98 0.00 2.68 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 0.00 0.00 0.00 0.00 36 K 8.35 3.85 0.00 1.73 1.58 0.00 1.41 0.00 0.00 1.68 0.00 0.00 2.79 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.22 1.23 7.81 37 E 8.07 3.38 0.00 1.85 1.79 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 2.12 2.18 0.00 38 T 7.63 4.72 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 1.26 0.00 0.00 39 T 7.50 5.02 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 1.21 0.00 0.00 40 L 8.28 5.00 0.00 1.86 1.57 1.19 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.90 5.09 0.00 3.68 3.44 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 42 Y 8.29 5.11 0.00 3.21 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 43 Y 9.64 4.95 0.00 2.97 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 44 K 8.81 3.70 0.00 1.92 1.89 0.00 1.59 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.47 7.81 45 S 8.06 4.62 0.00 3.88 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 46 Q 8.73 3.43 0.00 1.81 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.39 0.00 0.00 0.00 0.00 0.00 1.93 1.41 0.00 47 D 8.19 4.17 0.00 2.68 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 48 E 8.34 3.86 0.00 2.26 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 0.00 2.39 2.52 0.00 49 A 7.18 4.35 0.26 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 50 P 0.00 4.42 0.00 2.22 2.19 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 51 G 7.18 3.37 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 0.00 52 D 8.21 4.68 0.00 2.62 2.53 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 53 P 0.00 3.85 0.00 1.63 0.78 0.00 3.80 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 1.79 1.79 0.00 54 I 7.36 3.54 0.80 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.27 0.78 0.00 0.00 55 Q 6.98 4.25 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.86 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 56 Q 8.80 4.64 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.18 0.00 57 L 8.50 4.89 0.00 1.70 1.76 0.94 0.92 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 58 N 8.79 4.78 0.00 2.75 2.92 0.00 0.00 6.14 7.77 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 59 L 8.84 4.01 0.00 1.81 1.89 1.32 0.91 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 60 K 7.27 4.19 0.00 1.83 1.80 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.75 1.56 7.81 61 G 8.08 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 62 C 8.07 4.39 0.00 3.16 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 63 E 9.36 4.75 0.00 1.97 1.94 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 2.22 2.38 0.00 64 V 8.30 4.71 2.10 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 0.96 0.00 0.00 0.96 0.00 0.00 65 V 8.57 4.50 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 0.98 0.00 0.00 1.04 0.00 0.00 66 P 0.00 4.83 0.00 2.24 2.21 0.00 3.81 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.06 0.00 67 D 8.79 5.03 0.00 2.60 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 68 V 7.83 4.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.91 0.00 0.00 69 N 8.02 4.69 0.00 2.59 2.54 0.00 0.00 6.49 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 8.18 3.27 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 1.03 0.00 0.00 0.89 0.00 0.00 71 S 7.98 4.05 0.00 3.79 3.87 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 72 G 7.82 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 0.00 0.00 0.00 73 Q 7.77 2.97 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.55 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 74 K 6.74 4.30 0.00 1.68 1.42 0.00 1.56 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.20 1.29 7.81 75 F 8.25 4.65 0.00 2.87 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 0.00 0.00 0.00 76 C 8.53 5.34 0.00 2.99 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 77 I 8.95 4.76 1.95 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.95 0.98 0.00 0.00 78 K 8.90 4.70 0.00 2.19 1.95 0.00 1.76 0.00 0.00 1.66 0.00 0.00 3.08 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.67 7.81 79 L 8.44 4.88 0.00 1.77 1.52 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.96 4.73 0.00 1.91 1.53 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.17 4.82 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.94 0.00 0.00 82 P 0.00 4.82 0.00 2.11 2.03 0.00 3.76 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 1.99 2.00 0.00 83 S 8.44 4.77 0.00 3.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 P 0.00 4.58 0.00 2.17 2.16 0.00 3.71 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 1.98 1.98 0.00 85 E 7.33 4.56 0.00 1.98 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 2.22 2.20 0.00 86 G 8.02 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 87 M 8.53 4.66 0.00 1.83 1.92 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 88 S 8.65 4.56 0.00 3.84 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 89 E 8.06 4.60 0.00 1.85 1.63 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 1.81 2.23 0.00 90 I 7.99 4.25 1.71 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.01 0.74 0.00 0.00 91 Y 8.24 5.05 0.00 2.99 2.86 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 0.00 92 L 8.50 5.60 0.00 1.48 1.37 0.84 0.48 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 93 R 8.55 5.02 0.00 1.86 1.72 0.00 3.23 0.00 0.00 3.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 94 C 9.12 4.87 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 95 Q 8.23 4.12 0.00 2.35 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.67 0.00 0.00 0.00 0.00 0.00 2.38 2.33 0.00 96 D 7.66 5.16 0.00 2.85 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 97 E 8.24 2.68 0.00 1.68 1.50 0.00 0.00 0.00 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 2.25 0.00 98 Q 7.94 3.89 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.37 0.00 99 Q 8.42 4.15 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.86 0.00 0.00 0.00 0.00 0.00 2.47 2.66 0.00 100 Y 7.66 4.12 0.00 3.09 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 0.00 101 A 8.68 3.61 1.30 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 0.00 0.00 102 R 7.75 3.88 0.00 2.08 1.97 0.00 3.26 0.00 0.00 3.28 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 103 W 8.76 3.75 0.00 3.39 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 0.00 104 M 8.51 3.62 0.00 1.35 1.38 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.29 0.00 105 A 8.03 4.02 1.36 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 0.00 106 G 8.26 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 0.00 0.00 0.00 107 C 7.69 4.15 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.94 3.93 0.00 1.98 1.98 0.00 3.11 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.72 0.00 109 L 7.95 4.04 0.00 2.02 1.80 1.15 0.77 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 0.00 110 A 8.01 4.62 1.64 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 0.00 0.00 111 S 8.42 4.24 0.00 3.91 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 0.00 112 K 7.85 4.44 0.00 1.80 1.83 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.57 1.60 7.81 113 G 8.27 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 0.00 0.00 0.00 0.00 114 R 7.45 4.16 0.00 1.95 1.93 0.00 3.09 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 115 T 7.89 4.93 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 1.17 0.00 0.00 116 M 8.72 3.79 0.00 1.69 2.01 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.35 0.00 117 A 7.26 3.99 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 8.03 4.57 0.00 2.74 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 0.00 119 S 8.72 4.28 0.00 3.94 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 0.00 120 S 8.64 4.11 0.00 3.97 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 0.00 121 Y 7.74 4.19 0.00 3.13 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 T 8.06 3.32 4.22 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 1.25 0.00 0.00 123 S 8.15 4.10 0.00 3.88 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 0.00 124 E 7.96 4.07 0.00 2.09 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 2.25 2.42 0.00 125 V 7.41 3.44 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.37 0.00 0.00 126 Q 8.16 3.93 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.38 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 127 A 7.79 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 0.00 128 I 8.17 3.89 2.06 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.75 1.18 0.00 0.00 129 L 7.97 3.89 0.00 1.82 1.76 0.90 0.87 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 0.00 130 A 8.22 4.11 1.36 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 0.00 131 F 8.50 4.11 0.00 3.19 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 0.00 132 L 8.00 3.73 0.00 1.83 1.80 1.06 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 133 S 8.00 4.20 0.00 3.90 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 0.00 134 L 7.63 3.93 0.00 1.61 1.66 1.02 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 7.32 3.92 0.00 1.96 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.90 0.00 0.00 0.00 0.00 0.00 1.62 1.95 0.00 136 R 6.61 3.93 0.00 1.90 1.88 0.00 3.14 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.82 0.00 137 T 8.23 4.07 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00