NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.4900 8.4449 117.8354 53.3907 31.2557 172.3363 3 W 4.8172 7.8057 123.9182 53.5178 30.7323 175.6572 4 S 4.5035 9.2892 121.4915 57.5043 65.7494 174.7554 5 A 3.9746 8.4694 124.2046 55.3586 18.1447 179.4731 6 E 3.9913 8.2134 117.2327 59.5970 29.7086 178.7985 7 E 3.9724 8.0973 117.9169 59.4373 29.5095 179.4531 8 K 3.7069 8.0390 118.4491 59.6107 32.0794 179.4766 9 Q 3.9740 8.0952 118.2544 58.7970 28.3857 178.8173 10 L 4.0294 7.9561 120.1782 57.6756 41.6099 179.6205 11 I 3.4263 7.5883 119.6452 64.7212 37.1550 178.7232 12 T 3.9871 8.0804 117.0980 66.4741 67.9925 177.0515 13 S 4.1925 7.9536 115.5113 61.5248 63.3345 176.3951 14 I 3.6005 7.6471 123.6658 63.7422 36.8883 178.2494 15 W 4.4442 8.9485 129.4170 60.4577 30.2900 178.0435 16 G 3.7806 8.1850 104.3385 46.6101 0.0000 174.6219 17 K 4.6328 7.8884 118.3976 55.1523 33.2249 176.3594 18 V 3.5266 6.8536 119.8910 61.9147 31.4461 175.7357 19 N 4.2684 8.3937 126.2267 53.3578 39.0388 175.0043 20 V 3.4161 8.0739 128.2736 65.8147 31.7601 177.5252 21 A 3.9717 7.8870 119.8989 55.2972 18.3708 179.2567 22 D 4.2485 8.1233 117.1612 57.8306 40.9598 178.8963 23 C 4.2105 8.2507 117.3600 62.3096 28.0532 176.4600 24 G 3.6115 8.2527 107.4821 47.5977 0.0000 175.7278 25 A 3.9725 8.0425 123.3558 54.9111 18.4027 179.3566 26 E 3.8328 8.1793 117.6785 59.1670 29.6561 178.8680 27 A 3.9436 8.0357 120.8184 55.1938 18.5162 179.4541 28 L 3.8897 7.9518 118.6637 58.0553 42.1503 178.8483 29 A 3.9513 8.1186 120.8317 55.3866 18.3501 179.8800 30 R 3.8126 8.1579 116.5941 59.0246 30.0402 178.9638 31 L 3.9896 7.9106 120.2197 58.4040 42.0138 179.2220 32 L 4.0600 7.7922 120.0652 56.9446 41.2330 179.6326 33 I 3.7433 7.3660 119.0755 64.2181 37.3972 178.2450 34 V 3.5956 7.9017 117.9409 64.3051 32.4947 175.4534 35 Y 4.0708 7.3507 117.0894 54.4120 38.0371 174.1524 36 P 4.6701 0.0000 0.0000 63.9418 31.5779 177.6925 37 W 4.4058 7.9882 115.6374 59.3274 27.7809 178.0704 38 T 4.3260 7.4799 110.6678 64.4434 68.1605 176.4055 39 Q 4.1551 8.0267 121.3321 58.8837 28.3998 178.4356 40 R 3.8256 7.5860 119.3997 59.5265 30.0938 178.2619 41 F 4.1729 7.7849 115.9128 58.7702 39.3820 175.7578 42 F 4.5178 7.7570 118.3772 56.7422 39.6514 178.0560 43 S 4.1919 8.1642 119.0937 61.7929 62.8961 176.5963 44 S 4.5788 8.0227 111.4121 59.3842 62.9786 174.7957 45 F 4.6192 8.1500 120.1900 59.0268 40.1174 175.6460 46 G 4.0713 7.4063 104.0471 44.0459 0.0000 176.7626 47 N 4.5362 8.9349 128.6466 53.4678 37.6276 173.8203 48 L 4.8527 8.1232 127.5154 54.4341 42.9224 178.5885 49 S 4.2216 8.2791 116.2112 60.4349 62.6703 174.1630 50 S 4.8290 7.6226 113.0700 55.6468 67.1734 174.5482 51 A 3.9822 8.3391 122.7626 55.5360 18.0233 179.9471 52 T 3.7861 7.8625 113.5926 66.7235 68.7487 176.6080 53 A 4.0238 8.0660 122.6923 55.1056 18.1349 179.8671 54 I 3.6877 7.5317 117.3997 64.7726 37.3412 178.5002 55 S 4.3387 7.9239 114.7506 61.2861 62.7359 176.4041 56 G 3.9105 7.8916 106.3092 44.5124 0.0000 173.4962 57 N 4.3582 7.5250 120.9518 53.0418 39.5093 173.6612 58 P 4.2511 0.0000 0.0000 66.1819 31.3709 178.3106 59 N 4.0145 8.2800 116.2494 55.6828 38.2685 177.5852 60 V 3.7597 7.8478 119.3046 65.9831 31.7733 178.1158 61 K 3.9668 7.9797 117.7767 59.3208 31.7472 179.3148 62 A 3.9745 7.9104 121.0832 55.4584 18.2891 179.2460 63 H 4.3512 8.4342 116.9950 59.1996 30.0170 177.6650 64 G 3.6498 8.2241 107.8030 47.6337 0.0000 175.4879 65 K 3.9835 7.9514 121.5837 59.2392 32.0897 178.9899 66 K 4.0999 7.8469 119.8739 58.9010 31.4471 179.4077 67 V 3.7049 8.0254 118.5963 66.2304 31.4794 178.1297 68 L 4.6012 8.2047 118.7008 57.8488 41.1263 179.4227 69 T 4.2106 8.3460 110.3293 64.8624 68.4035 176.5911 70 S 4.1579 8.1088 117.0120 60.9624 63.2299 176.4704 71 F 4.3570 8.1765 120.9276 60.2086 38.6180 177.7604 72 G 3.3137 8.1968 105.5913 47.6595 0.0000 175.5278 73 D 4.3378 7.7797 120.4051 56.9377 40.5001 178.6637 74 A 4.0972 7.3617 119.5801 55.0239 18.4775 179.4851 75 V 3.2815 7.1440 115.7697 65.9558 31.5747 178.1573 76 K 4.1046 7.7426 117.1299 57.8236 33.1688 177.2267 77 N 5.0597 7.6363 115.8256 52.0159 38.7757 175.9612 78 L 3.8649 7.7339 118.7778 57.5739 42.1999 178.6980 79 D 4.8519 7.9631 115.4579 54.7238 42.1848 175.5572 80 N 5.1451 7.9833 117.4929 52.1105 39.2771 175.2589 81 I 4.0286 7.7152 122.4057 64.2581 37.6304 178.1850 82 K 4.0909 8.2462 118.4495 59.7022 32.3013 179.0611 83 G 3.7426 8.0767 105.2597 48.0753 0.0000 175.8169 84 T 3.9463 7.7525 116.8128 65.4489 68.6958 175.8322 85 F 4.5947 7.8697 116.9823 57.1100 38.8059 177.4798 86 A 4.0140 7.5810 122.5698 55.3063 18.2944 180.3818 87 Q 3.9166 7.9364 117.5747 59.4207 29.3127 178.2733 88 L 4.1244 7.8693 119.4155 57.5193 41.7826 179.2699 89 S 4.3051 8.0850 113.3753 61.3804 62.2497 176.0340 90 E 3.8771 7.8636 120.2982 59.1835 29.3325 178.8894 91 L 3.9001 7.7475 119.9248 58.8228 42.1636 178.9469 92 H 4.3048 8.4303 115.7720 58.6983 28.3223 176.9118 93 C 3.7632 7.8582 120.4570 61.9541 31.1706 175.3302 94 D 4.2951 8.1405 120.5744 57.1185 40.6685 177.9955 95 K 4.1633 7.7745 116.7214 58.1575 32.7610 177.7111 96 L 4.3939 7.5794 116.2714 54.3423 42.6755 176.0993 97 H 4.1095 7.3412 113.0635 56.6577 26.6013 174.9470 98 V 3.8920 7.7181 118.7591 61.2903 32.4063 174.8970 99 D 4.3231 8.5638 127.2161 53.3926 41.8806 175.0636 100 P 2.9700 0.0000 0.0000 65.0068 31.0072 178.2377 101 E 3.8771 8.0479 118.2032 59.2749 29.4104 178.5845 102 N 4.4099 7.9578 116.4186 55.8856 38.4947 177.3407 103 F 4.5503 7.5092 119.6897 60.6223 38.9397 177.8043 104 R 4.0195 8.0205 117.2564 59.3211 29.9892 178.9314 105 L 3.9765 7.7185 118.8857 57.6247 41.4622 179.3834 106 L 4.1893 8.1789 120.5073 57.9425 42.0656 179.0137 107 G 3.8513 8.2668 105.7990 48.1858 0.0000 175.1979 108 D 4.4649 8.3171 121.7308 57.1000 40.8739 179.0657 109 I 3.7498 7.9636 120.1791 64.2855 37.0591 178.2041 110 L 3.8528 8.2886 121.5462 58.1189 41.9069 179.0355 111 V 3.5127 7.7550 118.1257 66.2286 31.3803 178.1188 112 I 3.6605 7.6622 119.0804 64.2880 36.9104 178.5041 113 I 3.6318 7.6750 120.7056 64.2855 36.9082 178.4468 114 L 3.8668 7.7956 119.6987 57.5476 41.2309 179.3965 115 A 3.4468 7.1858 120.3065 54.9757 18.0666 179.5776 116 A 3.8340 7.7111 118.0538 55.5845 18.5082 179.2442 117 H 4.0636 8.0440 113.5115 57.6120 29.1587 176.9060 118 F 4.7237 8.2365 118.2325 54.4904 40.7955 177.8340 119 G 3.9547 9.0505 106.9794 46.2295 0.0000 177.2485 120 K 4.0875 9.1308 125.7062 58.9507 32.1974 177.0893 121 D 4.5321 7.9575 117.7317 56.8310 41.1937 177.0148 122 F 4.4180 7.8530 123.1114 57.0671 37.6975 175.2073 123 T 4.1904 7.3638 115.7204 60.3148 71.2904 173.4324 124 P 4.2101 0.0000 0.0000 66.0215 31.3416 178.8017 125 E 3.9340 8.0469 116.7190 59.4056 29.4453 178.7926 126 C 4.0197 7.7434 118.4131 62.3410 31.6115 175.2608 127 Q 3.7145 7.8440 121.2653 59.1673 28.7449 178.1299 128 A 4.0555 8.1443 121.4883 55.1992 18.3514 179.5196 129 A 4.0284 7.9647 118.9603 55.2938 18.5064 179.9992 130 W 4.0974 8.4238 117.4637 59.7675 29.1607 178.9741 131 Q 4.1656 8.9283 118.7276 58.7692 28.1686 178.5780 132 K 3.9175 8.1105 120.4177 59.3143 32.1675 178.5782 133 L 4.2369 8.1173 120.5247 58.5918 42.1144 179.5323 134 V 3.9439 8.1947 112.0900 64.0601 31.3346 178.7412 135 R 3.9151 8.0982 119.0140 59.4200 30.0141 178.6484 136 V 3.5505 7.8984 118.1226 65.9378 31.5634 178.1679 137 V 3.0465 8.0665 117.9778 65.5957 31.3089 177.8953 138 A 3.8366 7.9381 120.5651 55.3620 17.7620 178.9890 139 H 4.0254 8.4338 116.6673 59.5148 29.7126 177.3535 140 A 4.0662 7.8006 121.2154 54.9822 18.2225 179.1634 141 L 4.0237 7.3849 116.1161 56.7306 42.0441 178.3289 142 A 4.6297 7.8289 119.2907 52.4424 18.8367 178.8833 143 R 3.8341 7.5688 117.7432 59.1478 30.2184 177.9326 144 K 4.5169 8.0659 113.8843 56.7610 32.1737 177.1929 145 Y 4.1348 8.0557 117.2680 59.7344 38.1588 175.5224 146 H 4.5748 7.9069 122.0597 55.8709 29.4911 173.2138 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 2 H 8.44 4.49 0.00 3.03 3.01 0.00 5.66 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 W 7.81 4.82 0.00 3.31 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 4 S 9.29 4.50 0.00 4.10 4.02 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 5 A 8.47 3.97 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 6 E 8.21 3.99 0.00 2.05 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 2.38 2.41 0.00 7 E 8.10 3.97 0.00 2.46 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 8 K 8.04 3.71 0.00 1.90 1.74 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.23 1.70 7.81 9 Q 8.10 3.97 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 10 L 7.96 4.03 0.00 1.83 1.73 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.59 3.43 1.39 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.09 0.16 0.00 0.00 12 T 8.08 3.99 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 1.25 0.00 0.00 13 S 7.95 4.19 0.00 4.08 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 I 7.65 3.60 2.36 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 0.95 0.69 0.26 0.00 0.00 15 W 8.95 4.44 0.00 3.86 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.18 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 7.89 4.63 0.00 2.19 2.07 0.00 1.91 0.00 0.00 1.89 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.51 7.81 18 V 6.85 3.53 1.34 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 0.35 0.00 0.00 1.00 0.00 0.00 19 N 8.39 4.27 0.00 2.67 2.57 0.00 0.00 6.79 7.71 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 20 V 8.07 3.42 2.04 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 1.11 0.00 0.00 0.77 0.00 0.00 21 A 7.89 3.97 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 22 D 8.12 4.25 0.00 2.64 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 23 C 8.25 4.21 0.00 2.93 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 24 G 8.25 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.04 3.97 1.39 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 26 E 8.18 3.83 0.00 2.12 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 2.27 2.30 0.00 27 A 8.04 3.94 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 28 L 7.95 3.89 0.00 1.80 1.65 0.82 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.12 3.95 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 30 R 8.16 3.81 0.00 2.05 1.94 0.00 3.10 0.00 0.00 3.04 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 31 L 7.91 3.99 0.00 1.93 1.88 1.07 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.79 4.06 0.00 1.84 1.69 0.82 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.37 3.74 1.84 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.50 0.83 0.00 0.00 34 V 7.90 3.60 1.48 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 -0.03 0.00 0.00 0.73 0.00 0.00 35 Y 7.35 4.07 0.00 2.49 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.67 0.00 2.23 2.11 0.00 3.89 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.10 0.00 37 W 7.99 4.41 0.00 3.59 3.55 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 38 T 7.48 4.33 4.46 0.00 0.00 0.00 0.00 0.00 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 39 Q 8.03 4.16 0.00 2.33 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 40 R 7.59 3.83 0.00 1.71 1.67 0.00 3.11 0.00 0.00 2.86 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.54 0.00 41 F 7.78 4.17 0.00 2.61 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 0.00 0.00 0.00 0.00 42 F 7.76 4.52 0.00 2.84 2.04 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 43 S 8.16 4.19 0.00 3.88 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 44 S 8.02 4.58 0.00 4.11 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 45 F 8.15 4.62 0.00 3.26 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 46 G 7.41 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 47 N 8.93 4.54 0.00 2.70 2.82 0.00 0.00 6.62 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 48 L 8.12 4.85 0.00 1.67 1.65 1.05 1.05 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 49 S 8.28 4.22 0.00 3.92 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 50 S 7.62 4.83 0.00 4.03 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 51 A 8.34 3.98 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 T 7.86 3.79 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 1.20 0.00 0.00 53 A 8.07 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 I 7.53 3.69 1.86 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 1.54 0.69 0.90 0.00 0.00 55 S 7.92 4.34 0.00 3.84 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 56 G 7.89 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 57 N 7.52 4.36 0.00 3.02 2.87 0.00 0.00 6.77 7.04 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 58 P 0.00 4.25 0.00 2.24 2.26 0.00 3.73 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 2.02 2.03 0.00 59 N 8.28 4.01 0.00 2.44 1.54 0.00 0.00 6.62 7.62 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 60 V 7.85 3.76 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 1.10 0.00 0.00 1.07 0.00 0.00 61 K 7.98 3.97 0.00 2.01 1.82 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.60 7.81 62 A 7.91 3.97 1.32 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 0.00 0.00 0.00 63 H 8.43 4.35 0.00 3.52 3.57 0.00 5.79 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 64 G 8.22 3.65 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 0.00 0.00 0.00 65 K 7.95 3.98 0.00 1.86 2.01 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.51 7.81 66 K 7.85 4.10 0.00 2.01 1.88 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.53 7.81 67 V 8.03 3.70 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 1.28 0.00 0.00 1.01 0.00 0.00 68 L 8.20 4.60 0.00 2.14 2.00 1.04 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 69 T 8.35 4.21 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 1.35 0.00 0.00 70 S 8.11 4.16 0.00 3.93 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 0.00 71 F 8.18 4.36 0.00 3.43 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 G 8.20 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 D 7.78 4.34 0.00 2.70 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 74 A 7.36 4.10 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.14 3.28 1.60 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 0.64 0.00 0.00 0.27 0.00 0.00 76 K 7.74 4.10 0.00 1.74 1.81 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.58 7.81 77 N 7.64 5.06 0.00 2.79 2.71 0.00 0.00 6.90 7.03 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 78 L 7.73 3.86 0.00 1.33 1.05 0.33 0.27 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 79 D 7.96 4.85 0.00 2.71 2.78 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 0.00 0.00 0.00 0.00 80 N 7.98 5.15 0.00 2.79 2.67 0.00 0.00 7.10 7.42 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 81 I 7.72 4.03 1.98 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.03 0.92 0.00 0.00 82 K 8.25 4.09 0.00 1.78 1.94 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.08 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.59 7.81 83 G 8.08 3.74 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 0.00 0.00 0.00 84 T 7.75 3.95 4.16 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 0.80 0.00 0.00 85 F 7.87 4.59 0.00 3.10 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.58 4.01 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 87 Q 7.94 3.92 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 88 L 7.87 4.12 0.00 1.81 1.79 0.86 0.86 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 89 S 8.08 4.31 0.00 4.21 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 7.86 3.88 0.00 2.21 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 2.30 2.52 0.00 91 L 7.75 3.90 0.00 1.79 1.89 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.43 4.30 0.00 3.47 3.75 0.00 5.66 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 93 C 7.86 3.76 0.00 1.47 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 94 D 8.14 4.30 0.00 2.72 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 95 K 7.77 4.16 0.00 1.93 1.82 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.42 7.81 96 L 7.58 4.39 0.00 1.83 1.68 0.71 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 97 H 7.34 4.11 0.00 3.52 3.48 0.00 5.64 0.00 0.00 0.00 0.00 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.72 3.89 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 0.32 0.00 0.00 0.41 0.00 0.00 99 D 8.56 4.32 0.00 2.70 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 0.00 100 P 0.00 2.97 0.00 1.86 1.72 0.00 3.31 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.51 0.00 101 E 8.05 3.88 0.00 2.05 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 0.00 2.24 2.36 0.00 102 N 7.96 4.41 0.00 2.70 2.85 0.00 0.00 6.91 7.93 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 0.00 103 F 7.51 4.55 0.00 3.13 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 0.00 104 R 8.02 4.02 0.00 2.06 2.01 0.00 3.18 0.00 0.00 3.43 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.77 0.00 105 L 7.72 3.98 0.00 1.67 1.38 0.62 0.19 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 0.00 106 L 8.18 4.19 0.00 1.94 2.00 1.04 1.26 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 0.00 107 G 8.27 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 0.00 0.00 0.00 108 D 8.32 4.46 0.00 2.98 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 0.00 109 I 7.96 3.75 2.16 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.99 0.98 0.00 0.00 110 L 8.29 3.85 0.00 1.63 1.73 0.78 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.75 3.51 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 1.19 0.00 0.00 1.22 0.00 0.00 112 I 7.66 3.66 1.99 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.52 0.86 0.00 0.00 113 I 7.68 3.63 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.62 0.82 0.00 0.00 114 L 7.80 3.87 0.00 1.02 1.03 -0.20 0.62 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 0.00 115 A 7.19 3.45 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.71 3.83 1.24 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 0.00 0.00 0.00 117 H 8.04 4.06 0.00 2.95 2.72 0.00 5.81 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.24 4.72 0.00 3.23 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 0.00 119 G 9.05 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 0.00 0.00 0.00 120 K 9.13 4.09 0.00 1.77 1.91 0.00 1.81 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.50 7.81 121 D 7.96 4.53 0.00 3.09 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 0.00 122 F 7.85 4.42 0.00 3.05 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 0.00 123 T 7.36 4.19 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 1.30 0.00 0.00 124 P 0.00 4.21 0.00 2.17 2.16 0.00 3.59 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 E 8.05 3.93 0.00 2.02 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 0.00 2.39 2.41 0.00 126 C 7.74 4.02 0.00 2.82 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 0.00 127 Q 7.84 3.71 0.00 1.94 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.49 2.71 0.00 128 A 8.14 4.06 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.96 4.03 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 0.00 130 W 8.42 4.10 0.00 3.70 3.47 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 0.00 0.00 0.00 0.00 131 Q 8.93 4.17 0.00 2.11 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.65 2.65 0.00 132 K 8.11 3.92 0.00 1.99 2.15 0.00 1.43 0.00 0.00 1.45 0.00 0.00 2.13 0.00 0.00 2.34 0.00 0.00 0.00 0.00 1.00 1.20 7.81 133 L 8.12 4.24 0.00 1.80 1.80 0.72 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 134 V 8.19 3.94 2.28 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 0.81 0.00 0.00 1.18 0.00 0.00 135 R 8.10 3.92 0.00 2.18 2.04 0.00 3.07 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 136 V 7.90 3.55 2.34 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 1.00 0.00 0.00 0.88 0.00 0.00 137 V 8.07 3.05 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 -0.17 0.00 0.00 0.73 0.00 0.00 138 A 7.94 3.84 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 0.00 0.00 0.00 0.00 0.00 139 H 8.43 4.03 0.00 3.19 3.46 0.00 5.60 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 0.00 140 A 7.80 4.07 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 0.00 141 L 7.38 4.02 0.00 1.01 0.66 0.22 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.83 4.63 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 0.00 143 R 7.57 3.83 0.00 2.14 1.99 0.00 3.13 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 144 K 8.07 4.52 0.00 1.80 1.78 0.00 1.89 0.00 0.00 1.80 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.43 7.81 145 Y 8.06 4.13 0.00 2.96 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 0.00 146 H 7.91 4.57 0.00 3.06 3.19 0.00 5.88 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00