NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 3.3069 8.3001 120.2959 55.5399 33.2104 174.8139 2 A 3.5314 8.3145 111.8602 52.7751 15.3847 174.4352 3 Y 4.9571 7.4279 118.7777 55.4172 41.7294 175.5599 4 S 4.5980 8.4994 117.8536 58.3825 65.2712 175.5886 5 T 3.8146 8.8840 120.2027 67.0420 68.2320 176.3733 6 R 3.8417 8.2020 119.8163 59.9928 29.8400 178.0302 7 E 3.8809 8.0240 117.3953 59.3128 29.3884 179.3639 8 I 3.3436 7.5355 118.6505 63.7721 37.9746 177.6085 9 L 3.6790 8.1291 121.5289 58.1241 41.8805 178.8003 10 L 3.8694 8.2154 120.3677 57.8066 41.9458 178.7826 11 A 3.9061 8.0193 121.2623 54.8974 18.1949 179.5191 12 L 3.9049 8.0209 117.8501 58.2348 41.6980 179.6408 13 C 4.0583 7.9536 116.6043 62.5479 27.9527 176.1811 14 I 3.5891 7.7032 121.4561 64.2747 36.7690 178.0291 15 R 3.7747 8.1911 119.9645 59.7523 29.5700 177.7594 16 D 4.2395 8.0096 116.1839 57.5214 41.5359 178.0204 17 S 4.2237 8.0354 115.5298 61.5939 62.6754 176.6816 18 R 4.3054 8.0443 122.2101 58.7072 29.7266 178.7320 19 V 3.8639 7.5519 114.2566 63.4026 32.1344 175.2192 20 H 4.6084 7.8114 115.4648 56.4003 32.1098 174.1212 21 G 3.5436 9.2004 107.9801 47.2014 0.0000 174.1513 22 N 4.3214 8.0980 118.7314 52.9895 36.6258 176.0804 23 G 4.1412 8.3924 106.0305 45.9988 0.0000 174.3179 24 T 4.2677 7.4695 115.3821 63.1562 69.1051 173.8560 25 L 4.5444 8.0267 123.6000 53.3197 43.4347 176.3330 26 H 4.3094 8.7383 122.7430 55.5250 30.9066 174.4454 27 P 4.2370 0.0000 0.0000 66.0361 31.2449 179.0707 28 V 3.7478 8.1111 110.5204 64.0350 31.5369 178.3931 29 L 4.0258 8.3757 119.4576 57.2579 41.5536 179.1763 30 E 3.9319 8.1027 118.3655 59.2002 29.5240 178.7633 31 L 3.9121 8.0140 119.9749 58.2532 42.2148 178.7607 32 A 3.9773 8.3211 120.7569 55.1974 18.2848 179.3445 33 A 3.9455 7.8292 118.6886 55.2293 18.1731 179.9464 34 R 3.8067 7.5742 115.8326 59.6664 30.3252 178.3003 35 E 4.2935 8.4299 117.2041 58.2384 29.7593 177.5739 36 T 4.0442 7.8514 117.0121 62.5612 68.5376 174.0089 37 P 4.4312 0.0000 0.0000 61.9087 28.8970 173.5613 38 L 3.8894 8.6177 128.2798 57.2131 41.3794 177.3209 39 R 4.3533 8.5099 124.5807 56.5177 30.3319 174.3005 40 L 4.0927 7.5384 117.8277 54.4455 43.0699 176.0335 41 S 4.2834 8.2781 120.4805 57.3392 63.0055 173.0021 42 P 4.3397 0.0000 0.0000 64.6554 31.4615 176.6493 43 E 4.4829 7.7237 117.3216 56.0608 29.9109 176.1827 44 D 4.5290 7.5634 118.9981 54.4088 43.1791 177.1899 45 T 3.8968 8.4236 121.3598 66.6252 68.5081 177.1188 46 V 3.7379 8.3244 120.3239 66.0499 31.5089 178.3228 47 V 3.6037 7.7447 117.2913 66.1434 31.3188 177.8156 48 L 3.9952 8.0216 117.6385 57.7665 41.7124 179.6525 49 R 4.0636 8.2507 118.0109 59.5464 30.0292 178.5784 50 Y 4.0254 8.4130 116.9276 61.3818 37.8092 177.9565 51 H 4.0136 9.0631 119.5229 59.5533 29.7539 177.2516 52 V 3.5314 7.8122 119.5331 66.0269 31.4868 177.8530 53 L 3.9916 7.9175 118.1768 57.9760 41.4493 179.5508 54 L 4.0731 8.2917 119.0098 57.7951 41.7154 179.0900 55 E 3.8575 8.3310 119.4126 59.1404 29.3758 178.7462 56 E 3.8948 8.3112 118.6393 59.5243 29.3879 179.1218 57 I 3.6013 7.7042 119.6679 64.7335 37.2697 178.5293 58 I 2.9326 7.7745 120.3632 63.9291 36.8253 178.4582 59 E 3.8433 7.8438 119.0938 59.5724 29.3163 179.2473 60 R 3.9869 7.7524 116.8124 58.6541 30.3346 176.9240 61 N 4.9805 7.4384 114.8589 52.2203 40.4092 176.2608 62 S 4.3807 8.0860 116.8107 61.1737 62.2186 175.6913 63 E 4.0588 8.0968 120.9797 59.2454 29.5717 178.4121 64 T 3.9550 7.9367 115.3043 66.7734 68.5747 176.0110 65 F 4.3451 8.5826 119.5686 61.2263 38.9341 177.7434 66 T 4.0982 7.9476 114.6011 66.9271 68.3101 176.3348 67 E 4.0438 8.7165 120.6963 59.7430 29.6310 179.5444 68 T 3.9808 8.6650 110.0820 64.6281 68.7501 176.0876 69 W 4.3808 8.8624 131.6243 60.3848 30.7985 177.3529 70 N 4.0867 8.4350 116.4781 56.7389 37.5556 177.5721 71 R 3.7881 8.2121 119.0946 58.9143 30.1787 178.8092 72 F 3.7815 8.0431 120.3990 61.4629 39.2406 177.1214 73 I 3.4817 7.0612 116.7150 63.4103 37.8112 177.1264 74 T 4.1481 7.6991 108.8023 63.1210 69.0780 174.6573 75 H 4.6864 7.3120 116.4676 55.6914 30.7501 174.1157 76 T 4.0161 7.3318 114.2428 61.6979 67.6975 174.4907 77 E 4.3702 7.9958 125.4746 56.8128 31.5299 176.5288 78 H 4.8133 7.4373 113.7748 52.5446 29.7613 173.5024 79 V 3.7213 8.4026 129.4277 65.9356 31.2572 176.2593 80 D 4.5286 8.4707 115.7923 58.2615 41.3427 178.3547 81 L 4.2819 8.0024 118.3877 57.8742 41.7244 179.1423 82 D 4.5808 8.4201 118.8916 57.3590 40.6253 178.6568 83 F 4.3784 8.8806 118.5898 60.8479 38.8400 177.1676 84 N 4.6065 8.4864 116.0908 56.4018 38.7004 177.3788 85 S 4.2210 8.2246 116.7888 61.5299 63.1584 176.7115 86 V 3.6146 7.8200 121.8968 64.5335 31.0875 177.9383 87 F 3.2546 8.0681 121.0271 61.0868 39.1183 177.2461 88 L 4.1873 7.9170 118.1718 57.9303 41.2236 179.4045 89 E 3.9498 7.9563 117.4534 58.9561 29.3240 179.3853 90 I 3.4863 7.0284 119.3888 64.0931 37.3382 177.7301 91 F 4.1045 7.4448 116.1909 58.3274 39.7317 176.2643 92 H 4.9160 8.0764 116.0079 55.6041 29.0417 174.9865 93 R 4.6113 7.7014 112.8980 56.0287 31.1839 175.7577 94 G 4.0156 9.0188 103.8090 46.9959 0.0000 174.7321 95 D 4.5204 8.0297 118.7510 51.3412 39.2634 173.3627 96 P 4.6181 0.0000 0.0000 62.9252 33.0268 175.4542 97 S 4.8633 7.5801 113.3653 55.4513 67.5141 174.5520 98 L 4.3208 8.9085 123.0883 58.7763 41.6070 179.1583 99 G 3.7612 8.2395 104.7443 47.9687 0.0000 175.6023 100 R 3.8556 7.5925 120.5035 58.8256 30.0104 178.7344 101 A 4.4924 8.0169 120.1707 55.7333 18.3772 179.8176 102 L 4.2426 8.6715 117.3915 57.8983 41.7540 179.6025 103 A 4.3360 9.1497 121.9143 54.6235 18.2586 179.6475 104 W 4.3556 8.7358 127.2416 61.0619 30.8655 177.8806 105 M 3.7773 8.5776 118.6005 58.5094 31.4564 178.4326 106 A 4.0951 8.5003 120.8967 55.1712 18.5132 179.4168 107 W 3.4968 8.2578 126.5117 60.6002 30.6809 177.9133 108 C 3.6043 8.2109 116.7981 62.7567 27.4653 175.6969 109 M 3.7252 7.9051 119.8522 58.7871 31.8369 177.3584 110 H 3.8116 8.3628 118.4554 59.2759 29.9494 176.5035 111 A 2.5800 7.1469 122.4300 54.7893 17.8346 178.9743 112 C 3.5866 7.6409 117.0805 62.4903 31.5354 175.4511 113 R 3.6875 7.8313 120.4989 59.9715 29.6197 178.4580 114 T 3.7378 7.3992 114.9974 66.4305 68.1594 176.6603 115 L 3.9604 7.3352 119.6667 58.1974 41.8196 179.2388 116 C 4.2896 7.8138 114.5190 62.1373 28.1077 175.8797 117 C 4.4859 7.8847 118.2397 61.8006 28.4626 173.4415 118 N 4.2982 7.9666 125.8531 54.4108 37.6850 175.8944 119 Q 4.1904 8.6579 125.0930 56.9085 28.3474 174.7636 120 S 4.6954 7.7713 108.2831 58.8095 64.0628 174.5318 121 T 3.9066 7.6245 119.3230 62.8375 68.7393 172.4011 122 P 4.3614 0.0000 0.0000 62.7692 32.2462 176.1569 123 Y 4.1863 9.1438 122.8374 61.4905 38.5948 178.4616 124 Y 4.4270 8.3726 117.6231 60.0806 37.8749 178.5325 125 V 3.5139 7.1602 120.2023 65.6045 31.6413 178.2054 126 V 3.4228 7.4090 117.5246 65.8137 31.4104 177.1048 127 D 4.0790 7.9873 118.1069 57.5621 40.9334 178.4728 128 L 4.0924 8.0053 119.2233 57.6007 41.6324 179.6930 129 S 4.4296 8.1637 115.2605 61.6205 62.8535 176.6374 130 V 3.2490 7.5542 120.6439 66.0637 31.2586 177.8783 131 R 3.9288 7.8389 117.7245 59.3449 30.0311 178.9296 132 G 3.6679 8.6738 106.5146 48.1595 0.0000 175.5230 133 M 3.9824 7.5388 120.1522 57.8405 31.0527 178.4974 134 L 3.9493 7.5876 119.1521 57.3232 41.8799 179.2516 135 E 4.2207 8.1934 118.1758 59.2765 29.4866 178.6824 136 A 3.7031 7.8364 120.7481 55.6409 18.4858 179.9848 137 S 4.3617 8.2522 112.6685 61.3448 62.9106 176.4523 138 E 4.1371 7.9997 121.8323 59.3844 28.9004 179.4198 139 G 3.6277 7.7535 104.9019 47.1354 0.0000 175.3888 140 L 4.2106 8.3276 121.0124 57.0223 41.6277 178.5269 141 D 4.6465 8.0939 119.1466 57.9205 40.8426 179.4304 142 G 3.6993 8.1611 105.1236 47.6940 0.0000 175.1568 143 W 4.1743 8.2075 130.3794 59.8780 30.9413 178.0067 144 I 3.3662 8.3223 113.1538 63.3009 36.9567 177.8641 145 H 3.9859 8.0249 120.7195 59.4666 29.5532 176.9198 146 Q 3.9770 7.4135 118.3658 58.7059 28.5216 178.7224 147 Q 4.2010 6.8347 115.3708 55.1162 29.1287 176.5322 148 G 3.6436 7.6355 109.4424 44.7822 0.0000 173.7222 149 G 3.8081 7.7112 105.5964 44.1889 0.0000 175.0986 150 W 4.3350 8.7243 117.7208 59.7865 28.7166 179.2074 151 S 4.3817 8.2961 113.7842 61.9488 62.7581 176.1358 152 T 4.0408 8.0588 117.8883 66.9521 67.6546 175.9944 153 L 3.9972 8.0344 120.4792 58.1285 41.5516 179.2722 154 I 3.9047 7.6392 115.8513 62.6891 38.0772 176.9691 155 E 4.1500 8.0437 119.7896 59.1315 29.5476 175.6787 156 D 4.2076 7.6000 122.6751 54.5779 41.6002 174.3345 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 8.30 3.31 0.00 1.91 1.95 0.00 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.65 0.00 2 A 8.31 3.53 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 3 Y 7.43 4.96 0.00 3.12 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 4 S 8.50 4.60 0.00 4.18 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 5 T 8.88 3.81 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 6 R 8.20 3.84 0.00 1.89 1.96 0.00 3.19 0.00 0.00 3.33 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.92 0.00 7 E 8.02 3.88 0.00 2.19 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 2.30 2.33 0.00 8 I 7.54 3.34 1.44 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.96 -0.09 0.00 0.00 9 L 8.13 3.68 0.00 1.75 1.51 0.75 0.38 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 10 L 8.22 3.87 0.00 1.75 1.58 0.83 0.89 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 11 A 8.02 3.91 1.21 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 0.00 0.00 0.00 12 L 8.02 3.90 0.00 1.72 1.67 0.72 1.20 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 13 C 7.95 4.06 0.00 2.85 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 14 I 7.70 3.59 1.99 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 1.35 0.59 0.85 0.00 0.00 15 R 8.19 3.77 0.00 2.00 2.10 0.00 3.28 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.43 0.00 16 D 8.01 4.24 0.00 2.83 2.72 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 17 S 8.04 4.22 0.00 4.00 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 18 R 8.04 4.31 0.00 1.99 1.96 0.00 3.27 0.00 0.00 3.46 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.77 0.00 19 V 7.55 3.86 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 0.80 0.00 0.00 0.89 0.00 0.00 20 H 7.81 4.61 0.00 3.33 3.12 0.00 5.89 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 21 G 9.20 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.10 4.32 0.00 3.03 3.00 0.00 0.00 6.86 7.70 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 23 G 8.39 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 24 T 7.47 4.27 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 25 L 8.03 4.54 0.00 1.59 1.57 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 26 H 8.74 4.31 0.00 3.20 3.12 0.00 5.90 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.24 0.00 2.45 2.20 0.00 3.26 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 28 V 8.11 3.75 1.93 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 0.54 0.00 0.00 0.83 0.00 0.00 29 L 8.38 4.03 0.00 1.75 1.66 0.85 0.75 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 30 E 8.10 3.93 0.00 2.15 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 2.55 2.32 0.00 31 L 8.01 3.91 0.00 1.81 1.95 0.94 0.92 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 32 A 8.32 3.98 1.28 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 33 A 7.83 3.95 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 34 R 7.57 3.81 0.00 1.86 2.09 0.00 3.26 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 35 E 8.43 4.29 0.00 1.92 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 2.48 2.49 0.00 36 T 7.85 4.04 4.37 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 1.19 0.00 0.00 37 P 0.00 4.43 0.00 2.19 2.10 0.00 3.78 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 2.00 1.96 0.00 38 L 8.62 3.89 0.00 1.77 1.65 0.91 0.78 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 39 R 8.51 4.35 0.00 1.90 1.82 0.00 3.31 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.42 0.00 40 L 7.54 4.09 0.00 0.80 1.24 0.44 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.28 4.28 0.00 3.87 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 42 P 0.00 4.34 0.00 2.15 2.09 0.00 3.74 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 1.94 1.93 0.00 43 E 7.72 4.48 0.00 1.95 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 2.23 2.22 0.00 44 D 7.56 4.53 0.00 2.69 2.60 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 45 T 8.42 3.90 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 1.26 0.00 0.00 46 V 8.32 3.74 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 1.12 0.00 0.00 47 V 7.74 3.60 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.85 0.00 0.00 48 L 8.02 4.00 0.00 1.82 1.74 0.92 0.96 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 49 R 8.25 4.06 0.00 1.95 1.88 0.00 3.14 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.73 0.00 50 Y 8.41 4.03 0.00 3.18 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 51 H 9.06 4.01 0.00 3.28 3.51 0.00 5.59 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.81 3.53 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 1.00 0.00 0.00 1.02 0.00 0.00 53 L 7.92 3.99 0.00 1.92 1.77 0.79 0.61 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 54 L 8.29 4.07 0.00 1.68 1.77 0.92 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.33 3.86 0.00 1.90 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 0.00 2.28 2.44 0.00 56 E 8.31 3.89 0.00 2.22 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 2.31 2.41 0.00 57 I 7.70 3.60 2.03 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.73 1.02 0.00 0.00 58 I 7.77 2.93 1.92 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 1.62 1.21 0.89 0.00 0.00 59 E 7.84 3.84 0.00 2.10 1.93 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 2.28 2.56 0.00 60 R 7.75 3.99 0.00 1.81 1.98 0.00 3.07 0.00 0.00 3.20 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 61 N 7.44 4.98 0.00 2.15 2.67 0.00 0.00 6.44 7.38 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 62 S 8.09 4.38 0.00 3.85 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 63 E 8.10 4.06 0.00 2.15 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 2.41 2.50 0.00 64 T 7.94 3.95 4.44 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 1.36 0.00 0.00 65 F 8.58 4.35 0.00 3.02 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 66 T 7.95 4.10 4.49 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 1.32 0.00 0.00 67 E 8.72 4.04 0.00 2.37 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 0.00 2.38 2.53 0.00 68 T 8.67 3.98 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 1.35 0.00 0.00 69 W 8.86 4.38 0.00 3.16 3.23 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 0.00 70 N 8.43 4.09 0.00 2.79 2.86 0.00 0.00 7.13 7.31 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 71 R 8.21 3.79 0.00 1.85 1.84 0.00 3.06 0.00 0.00 3.02 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 72 F 8.04 3.78 0.00 3.22 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 73 I 7.06 3.48 0.66 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.69 0.66 0.00 0.00 74 T 7.70 4.15 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 1.19 0.00 0.00 75 H 7.31 4.69 0.00 2.91 3.23 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 7.33 4.02 3.48 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 0.00 0.00 0.00 0.96 0.00 0.00 77 E 8.00 4.37 0.00 1.54 1.73 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 2.17 2.12 0.00 78 H 7.44 4.81 0.00 3.35 3.44 0.00 5.49 0.00 0.00 0.00 0.00 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 8.40 3.72 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 1.82 0.00 0.00 1.07 0.00 0.00 80 D 8.47 4.53 0.00 2.84 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 81 L 8.00 4.28 0.00 1.78 1.73 0.68 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 82 D 8.42 4.58 0.00 2.73 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 83 F 8.88 4.38 0.00 3.63 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.49 4.61 0.00 3.00 3.08 0.00 0.00 7.20 6.76 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 85 S 8.22 4.22 0.00 4.13 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 86 V 7.82 3.61 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 0.93 0.00 0.00 0.70 0.00 0.00 87 F 8.07 3.25 0.00 2.68 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 88 L 7.92 4.19 0.00 1.89 1.76 1.00 1.49 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 89 E 7.96 3.95 0.00 1.98 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 2.55 2.47 0.00 90 I 7.03 3.49 0.96 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.37 0.01 0.00 0.00 91 F 7.44 4.10 0.00 2.53 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 92 H 8.08 4.92 0.00 3.14 3.30 0.00 5.60 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 7.70 4.61 0.00 1.59 1.75 0.00 3.30 0.00 0.00 3.19 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.66 0.00 94 G 9.02 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 0.00 0.00 0.00 95 D 8.03 4.52 0.00 2.88 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 96 P 0.00 4.62 0.00 0.49 1.62 0.00 3.14 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.66 0.00 97 S 7.58 4.86 0.00 4.07 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 8.91 4.32 0.00 2.01 1.88 1.18 1.04 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 99 G 8.24 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 0.00 0.00 0.00 100 R 7.59 3.86 0.00 2.03 1.40 0.00 2.90 0.00 0.00 2.70 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.50 0.00 101 A 8.02 4.49 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 0.00 102 L 8.67 4.24 0.00 1.90 1.94 1.13 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 103 A 9.15 4.34 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 0.00 104 W 8.74 4.36 0.00 3.60 3.66 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 0.00 105 M 8.58 3.78 0.00 2.00 2.36 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 3.35 0.00 106 A 8.50 4.10 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 W 8.26 3.50 0.00 3.15 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 0.00 108 C 8.21 3.60 0.00 2.49 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 0.00 109 M 7.91 3.73 0.00 2.09 1.93 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 110 H 8.36 3.81 0.00 3.34 3.38 0.00 5.86 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 0.00 111 A 7.15 2.58 -0.37 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 0.00 112 C 7.64 3.59 0.00 2.64 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 0.00 113 R 7.83 3.69 0.00 1.81 1.87 0.00 2.77 0.00 0.00 3.03 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.51 0.00 114 T 7.40 3.74 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 1.27 0.00 0.00 115 L 7.34 3.96 0.00 1.60 1.64 0.89 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 116 C 7.81 4.29 0.00 2.86 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 0.00 117 C 7.88 4.49 0.00 2.99 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 7.97 4.30 0.00 2.90 2.76 0.00 0.00 7.42 6.50 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 0.00 119 Q 8.66 4.19 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.60 0.00 0.00 0.00 0.00 0.00 2.28 1.92 0.00 120 S 7.77 4.70 0.00 3.96 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 0.00 121 T 7.62 3.91 4.37 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 1.17 0.00 0.00 122 P 0.00 4.36 0.00 1.91 2.20 0.00 3.63 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 1.62 1.83 0.00 123 Y 9.14 4.19 0.00 3.16 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 0.00 124 Y 8.37 4.43 0.00 3.25 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 0.00 125 V 7.16 3.51 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 1.01 0.00 0.00 0.25 0.00 0.00 126 V 7.41 3.42 1.78 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 0.59 0.00 0.00 0.83 0.00 0.00 127 D 7.99 4.08 0.00 2.12 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 0.00 128 L 8.01 4.09 0.00 1.95 1.84 1.09 0.84 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 0.00 129 S 8.16 4.43 0.00 4.07 4.11 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 0.00 130 V 7.55 3.25 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 0.89 0.00 0.00 0.77 0.00 0.00 131 R 7.84 3.93 0.00 2.09 1.96 0.00 3.21 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 132 G 8.67 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 0.00 133 M 7.54 3.98 0.00 1.51 1.98 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 134 L 7.59 3.95 0.00 1.56 1.72 0.83 0.76 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 0.00 135 E 8.19 4.22 0.00 2.11 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 2.31 2.37 0.00 136 A 7.84 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 137 S 8.25 4.36 0.00 4.18 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 0.00 138 E 8.00 4.14 0.00 2.00 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 2.34 2.61 0.00 139 G 7.75 3.63 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 0.00 0.00 0.00 140 L 8.33 4.21 0.00 2.16 1.98 1.35 0.11 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 0.00 141 D 8.09 4.65 0.00 2.90 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 0.00 142 G 8.16 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 0.00 0.00 0.00 143 W 8.21 4.17 0.00 3.40 3.28 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 0.00 144 I 8.32 3.37 0.91 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.59 0.64 0.00 0.00 145 H 8.02 3.99 0.00 3.36 3.46 0.00 5.82 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 0.00 146 Q 7.41 3.98 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 147 Q 6.83 4.20 0.00 1.73 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.54 0.00 0.00 0.00 0.00 0.00 1.46 1.22 0.00 148 G 7.64 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 0.00 0.00 0.00 149 G 7.71 3.81 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 0.00 0.00 0.00 150 W 8.72 4.34 0.00 3.54 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 S 8.30 4.38 0.00 3.96 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 0.00 152 T 8.06 4.04 4.40 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 1.18 0.00 0.00 153 L 8.03 4.00 0.00 2.09 1.95 0.83 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 154 I 7.64 3.90 1.54 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.52 1.13 0.00 0.00 155 E 8.04 4.15 0.00 2.15 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 2.33 2.47 0.00 156 D 7.60 4.21 0.00 2.79 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