NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1520 8.0549 120.3918 62.9358 32.7256 173.8515 2 L 4.5503 7.9931 120.1783 50.4773 45.5171 175.1166 3 S 4.7177 9.1216 117.2570 57.2574 66.9296 174.7706 4 E 4.2726 8.7334 121.9174 59.2511 29.3408 178.8365 5 G 3.6189 8.0686 105.3553 48.0383 0.0000 175.4715 6 E 3.9613 8.4032 121.6215 58.6132 28.9252 179.3475 7 W 4.4637 8.1985 118.7064 59.1241 29.1434 178.5083 8 Q 4.2541 8.1872 118.4800 58.4491 28.3377 178.3260 9 L 4.0229 8.1248 120.1221 57.7507 41.8142 179.3326 10 V 3.6820 7.8529 118.2008 66.3912 31.4860 178.0518 11 L 4.3412 7.9016 116.8957 57.4299 41.2480 179.0000 12 H 4.2566 8.0229 118.3072 59.3200 30.3249 177.4594 13 V 3.7719 8.4808 121.3966 64.3884 31.1544 177.7889 14 W 4.1120 8.3582 128.0115 59.2486 30.1322 177.9153 15 A 4.0516 7.9045 121.0724 55.2022 17.3593 179.4917 16 K 3.9930 7.5826 115.4703 58.6539 31.9250 179.7400 17 V 2.8610 6.9841 119.6243 65.3583 31.4422 176.9445 18 E 4.2488 7.3355 115.3513 56.4205 29.1577 177.0088 19 A 4.2931 7.2103 123.4591 53.9675 19.8272 178.3716 20 D 4.7074 7.5312 114.8938 51.8969 41.8786 175.7366 21 V 3.4928 7.9030 117.4134 63.9959 32.0538 177.0963 22 A 4.3279 8.1216 119.9480 55.5433 18.1619 179.4634 23 G 4.0664 7.9935 104.1895 45.6073 0.0000 175.2927 24 H 4.1872 8.3182 118.8864 58.1088 28.6666 178.1988 25 G 3.5543 8.8568 108.8288 47.8870 0.0000 175.4838 26 Q 3.9176 8.2444 121.2178 58.7828 28.7934 178.5863 27 D 4.3571 7.7763 119.0028 57.6629 40.9169 179.3171 28 I 3.6237 7.5969 119.7006 64.4640 37.0861 178.5147 29 L 3.4789 7.7762 119.5670 57.6999 41.4197 179.6376 30 I 3.7286 8.1033 120.0502 64.3776 37.0181 178.4949 31 R 3.8044 7.9802 119.5045 59.0739 29.8210 178.1918 32 L 3.8098 7.6270 120.1311 58.3967 41.9398 179.1366 33 F 4.6950 7.6530 119.0928 59.8649 38.5630 177.7401 34 K 3.9670 7.9771 118.7004 59.5092 32.1729 178.7132 35 S 4.3243 8.2769 113.6981 59.7524 64.3065 174.9014 36 H 4.7408 8.0456 118.9348 52.3377 30.6381 171.7683 37 P 4.6155 0.0000 0.0000 64.5816 31.3122 177.0668 38 E 4.1490 8.1831 114.4173 58.4554 29.7460 178.0578 39 T 4.1751 8.1544 110.8272 63.1680 69.5073 175.8210 40 L 4.3882 8.1480 121.1027 55.4065 41.6522 177.6741 41 E 4.1910 8.0309 119.0019 57.9939 29.8390 177.5896 42 K 4.0484 7.5886 117.6273 57.1353 32.8537 176.8450 43 F 4.4436 6.8901 116.2284 55.8183 40.3993 175.2014 44 D 4.6700 8.1615 123.2333 54.4324 40.9073 178.0281 45 R 4.1044 7.5013 115.9142 56.9307 30.3289 175.3351 46 F 5.0829 7.0449 115.3923 55.4390 42.7203 173.7209 47 K 4.1909 8.9037 120.8599 57.4449 30.3668 176.0416 48 H 4.3367 8.0483 116.4032 56.1475 29.6797 174.3032 49 L 4.5344 7.6486 118.8538 52.4277 41.4987 176.0359 50 K 3.9877 8.3262 126.5460 58.3998 32.3497 179.9940 51 T 4.2549 7.6856 110.6567 61.5244 71.8286 175.3726 52 E 3.9900 8.5897 119.4902 58.9290 29.2832 179.4570 53 A 3.9486 7.8574 120.8720 55.2165 18.6840 179.3756 54 E 3.9303 8.3204 117.3579 59.7988 29.2981 179.5448 55 M 4.0192 7.9748 117.9600 58.1223 32.1144 178.6191 56 K 4.0762 8.2258 117.4494 58.4522 32.3041 178.6278 57 A 4.3877 7.4008 120.4065 52.9928 19.0865 176.9571 58 S 3.9442 7.5830 112.3848 58.8619 62.6352 174.6972 59 E 3.9677 8.8057 129.1436 58.9653 29.2809 178.0624 60 D 4.3437 8.0106 117.9469 57.3999 41.6496 177.8430 61 L 3.5952 8.4705 121.2706 57.6910 41.9533 178.7551 62 K 3.8851 8.1427 119.8553 59.2702 32.1990 178.6551 63 K 3.9389 7.9937 119.9369 59.9802 32.1405 178.5694 64 H 4.3859 8.2966 116.3580 58.4699 28.6666 178.1328 65 G 3.5585 7.9413 107.7330 47.7727 0.0000 176.0844 66 V 3.6877 7.8130 120.7149 65.8361 31.4730 178.3811 67 T 3.9463 7.8372 115.5499 66.5595 68.2680 177.0508 68 V 3.6819 7.8311 114.2388 64.6133 31.6497 178.5445 69 L 4.4134 7.9383 118.1794 58.3178 41.5205 179.6454 70 T 3.9705 8.1401 115.3263 66.7683 68.4927 176.3710 71 A 3.9962 8.1091 122.2996 55.1670 18.4819 179.4245 72 L 3.6796 8.1841 119.0591 58.1402 42.1208 179.2949 73 G 3.3768 8.7406 105.7772 47.5903 0.0000 175.5113 74 A 3.9706 7.5854 121.9606 55.0359 18.7318 179.5190 75 I 3.8043 7.6033 118.2720 64.4912 37.1376 178.6306 76 L 4.0779 8.0080 120.1721 57.8608 41.2459 179.7683 77 K 3.9724 7.7103 116.6343 58.7565 31.8079 179.0591 78 K 3.9113 7.9202 118.8649 56.4436 32.6870 176.6308 79 K 2.0000 8.2746 117.5474 56.3799 29.3468 174.7387 80 G 3.9972 7.8913 106.7112 45.9702 0.0000 173.5233 81 H 5.2717 7.2456 117.0218 54.9871 27.7091 175.6285 82 H 5.4532 7.1945 114.8383 54.8316 29.4195 175.7516 83 E 3.8826 8.1058 121.6783 60.1976 28.9249 178.9576 84 A 4.0228 7.8663 119.2749 55.4466 18.1094 179.4446 85 E 3.8081 8.3429 116.6719 59.0401 29.5799 179.2653 86 L 3.8963 7.8371 119.3149 57.3739 41.5476 178.7941 87 K 3.9306 7.6501 118.8835 59.1555 31.9711 177.2212 88 P 4.2371 0.0000 0.0000 65.8422 31.4463 178.0805 89 L 3.9663 7.5749 119.5835 58.0422 42.0883 178.9710 90 A 4.2335 8.6864 120.9259 55.0626 18.2774 179.4185 91 Q 3.7926 8.3582 118.7208 59.2999 29.1668 178.6463 92 S 4.1130 8.1318 115.3974 61.7726 63.1387 176.1771 93 H 4.2766 8.3707 119.2070 57.9942 28.2587 177.6146 94 A 3.3194 7.6637 122.4598 54.7849 18.1622 179.8143 95 T 4.4367 6.9030 111.9464 65.6219 69.0161 176.2608 96 K 4.0414 7.8617 120.4944 58.9286 32.5573 176.8860 97 H 4.5541 7.8674 112.1205 54.9390 29.3081 175.2135 98 K 3.9596 7.5380 117.7233 56.0488 29.4753 175.0980 99 I 4.1301 8.2444 119.1219 59.4294 38.4815 175.1624 100 P 4.4082 0.0000 0.0000 62.0869 31.4931 177.5123 101 I 3.5494 8.0625 121.6230 63.1357 37.0172 178.3775 102 K 3.7271 7.5751 120.8123 59.0990 32.0153 177.8570 103 Y 4.3997 7.8129 117.1454 60.4422 37.4357 177.6786 104 L 4.2057 7.7998 119.6153 57.6475 41.6541 179.1845 105 E 4.0801 7.7490 117.5247 59.1365 29.6789 178.9548 106 F 4.5462 7.6957 117.3900 60.9234 38.9367 177.6349 107 I 3.8990 8.7508 118.2843 63.8212 37.7387 178.1684 108 S 4.2244 7.8509 115.8326 61.5031 62.6134 176.3776 109 E 4.0707 8.4155 120.2152 59.3202 29.3109 179.0665 110 A 3.9816 7.9525 121.4300 54.9801 18.3532 179.7472 111 I 3.6996 8.1052 118.6948 64.6971 37.2437 178.8343 112 I 3.8308 8.0389 120.6884 64.4790 36.7581 178.0312 113 H 4.1710 8.5628 119.6385 59.0423 29.5882 177.6001 114 V 3.4570 7.8181 120.1821 65.8982 31.4232 178.1524 115 L 3.6594 7.9075 119.0548 57.6031 40.9867 178.9684 116 H 4.1911 7.5127 118.0283 58.7714 29.9065 176.8573 117 S 4.3579 7.5528 114.8831 59.9498 63.4330 175.5136 118 R 4.2115 7.7909 120.4826 56.6367 31.1926 176.2249 119 H 4.9930 7.7884 115.2360 54.3012 30.3094 172.0243 120 P 4.2736 0.0000 0.0000 65.4469 32.0255 179.4774 121 G 3.7241 8.2834 105.7411 47.9055 0.0000 173.6331 122 D 4.9288 7.6578 114.0094 52.5198 39.7140 174.7220 123 F 4.8336 7.9480 120.8534 56.2154 42.5567 171.5288 124 G 3.6475 8.2232 104.3948 43.9548 0.0000 173.0131 125 A 3.8549 8.7504 120.3083 55.6957 18.2589 179.7787 126 D 4.4497 8.0244 113.2966 55.2602 39.6022 177.1233 127 A 4.3516 7.5228 119.8742 52.0251 21.4260 177.7084 128 Q 3.6285 9.8779 116.6424 59.4661 28.7630 179.1409 129 G 3.4946 7.8027 104.6218 47.4621 0.0000 175.0998 130 A 3.9570 7.6525 122.4809 55.3448 18.5814 179.3787 131 M 3.9551 8.6154 117.3272 58.5204 31.7557 177.8286 132 N 4.4459 8.3236 117.5133 55.9891 39.0465 177.1781 133 K 3.8849 7.9966 120.1573 59.3412 32.2712 179.0190 134 A 3.8602 7.6292 120.3881 55.2626 18.2117 179.5443 135 L 4.0503 7.7959 117.0885 57.7706 41.6822 179.3159 136 E 3.9301 7.9404 118.6891 59.2308 29.5483 178.6880 137 L 4.0137 8.1273 120.4368 57.8638 42.1436 178.5572 138 F 4.1461 8.3719 120.7487 61.5695 39.3665 177.3154 139 R 3.4718 8.2786 117.7281 58.8025 29.9189 178.9239 140 K 3.7965 7.9607 119.2992 59.8583 32.3666 178.7392 141 D 4.3797 8.1969 118.9554 57.0513 40.6076 179.0189 142 I 3.4515 7.4394 120.3935 64.1329 37.0132 178.0811 143 A 3.7043 7.7872 121.4149 54.9603 18.0385 179.4024 144 A 3.9336 7.7282 118.6062 55.3678 18.2670 180.0118 145 K 4.1248 7.6031 116.4830 59.4725 32.4044 178.5370 146 Y 4.2142 8.4656 117.1594 61.6732 37.8434 178.9820 147 K 3.8846 8.5882 119.9362 59.6370 31.9493 178.5201 148 E 4.0773 8.6265 119.5692 58.2191 29.2712 177.6382 149 L 4.7392 7.6623 116.7265 53.9760 42.2244 176.5972 150 G 4.1920 7.9706 108.5236 45.7084 0.0000 173.8711 151 Y 4.0971 8.1642 123.0724 57.7743 38.7940 175.4624 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 V 8.05 4.15 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 1.05 0.00 0.00 0.95 0.00 0.00 2 L 7.99 4.55 0.00 1.22 0.79 0.69 -0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.12 4.72 0.00 4.05 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 4 E 8.73 4.27 0.00 2.18 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 2.42 2.50 0.00 5 G 8.07 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.40 3.96 0.00 1.77 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 7 W 8.20 4.46 0.00 3.56 3.14 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 8 Q 8.19 4.25 0.00 2.33 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.83 0.00 0.00 0.00 0.00 0.00 2.44 2.75 0.00 9 L 8.12 4.02 0.00 1.69 1.72 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.85 3.68 2.20 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 1.10 0.00 0.00 0.86 0.00 0.00 11 L 7.90 4.34 0.00 1.92 1.83 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 12 H 8.02 4.26 0.00 3.35 3.54 0.00 5.95 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 8.48 3.77 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 1.08 0.00 0.00 1.20 0.00 0.00 14 W 8.36 4.11 0.00 3.73 3.20 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 0.00 15 A 7.90 4.05 1.44 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 0.00 0.00 16 K 7.58 3.99 0.00 1.88 1.66 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.32 7.81 17 V 6.98 2.86 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 0.00 0.00 -0.06 0.00 0.00 0.38 0.00 0.00 18 E 7.34 4.25 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 2.30 2.16 0.00 19 A 7.21 4.29 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 20 D 7.53 4.71 0.00 2.66 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 V 7.90 3.49 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 0.82 0.00 0.00 0.90 0.00 0.00 22 A 8.12 4.33 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 23 G 7.99 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 24 H 8.32 4.19 0.00 3.30 3.20 0.00 5.82 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 25 G 8.86 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 0.00 0.00 0.00 26 Q 8.24 3.92 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.66 0.00 0.00 0.00 0.00 0.00 2.31 2.58 0.00 27 D 7.78 4.36 0.00 2.71 2.64 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 28 I 7.60 3.62 1.96 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 1.48 0.77 0.89 0.00 0.00 29 L 7.78 3.48 0.00 1.66 1.35 0.90 0.42 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 30 I 8.10 3.73 1.99 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 1.41 0.96 0.89 0.00 0.00 31 R 7.98 3.80 0.00 1.94 2.09 0.00 3.01 0.00 0.00 2.92 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 32 L 7.63 3.81 0.00 1.60 1.29 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 33 F 7.65 4.69 0.00 3.11 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 34 K 7.98 3.97 0.00 1.74 2.05 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.46 7.81 35 S 8.28 4.32 0.00 3.59 3.51 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 36 H 8.05 4.74 0.00 3.02 2.75 0.00 5.64 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 37 P 0.00 4.62 0.00 2.15 2.13 0.00 3.84 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.13 0.00 38 E 8.18 4.15 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 39 T 8.15 4.18 4.45 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 0.69 0.00 0.00 40 L 8.15 4.39 0.00 1.79 1.60 0.73 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.03 4.19 0.00 1.99 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 0.00 2.31 2.41 0.00 42 K 7.59 4.05 0.00 1.39 1.41 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.27 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.76 7.81 43 F 6.89 4.44 0.00 2.84 1.81 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 44 D 8.16 4.67 0.00 2.74 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 45 R 7.50 4.10 0.00 1.73 2.11 0.00 3.23 0.00 0.00 3.36 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 46 F 7.04 5.08 0.00 2.96 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 K 8.90 4.19 0.00 1.81 2.19 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.26 7.81 48 H 8.05 4.34 0.00 3.17 3.31 0.00 5.95 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.65 4.53 0.00 1.77 1.56 0.75 0.71 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 50 K 8.33 3.99 0.00 1.90 1.65 0.00 1.67 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.60 1.51 7.81 51 T 7.69 4.25 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 52 E 8.59 3.99 0.00 2.01 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 2.38 2.35 0.00 53 A 7.86 3.95 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.32 3.93 0.00 2.15 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 2.32 2.34 0.00 55 M 7.97 4.02 0.00 1.93 2.08 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.52 0.00 56 K 8.23 4.08 0.00 1.71 1.82 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.53 7.81 57 A 7.40 4.39 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 58 S 7.58 3.94 0.00 3.80 3.77 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 59 E 8.81 3.97 0.00 2.12 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 2.38 2.43 0.00 60 D 8.01 4.34 0.00 2.87 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 61 L 8.47 3.60 0.00 0.89 1.49 0.67 0.44 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 62 K 8.14 3.89 0.00 1.95 1.90 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.42 7.81 63 K 7.99 3.94 0.00 2.22 1.79 0.00 1.59 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.54 7.81 64 H 8.30 4.39 0.00 3.41 3.33 0.00 5.87 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 65 G 7.94 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 66 V 7.81 3.69 2.23 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 1.04 0.00 0.00 0.99 0.00 0.00 67 T 7.84 3.95 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 1.30 0.00 0.00 68 V 7.83 3.68 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 0.90 0.00 0.00 1.12 0.00 0.00 69 L 7.94 4.41 0.00 1.80 1.84 0.81 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.14 3.97 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 71 A 8.11 4.00 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 72 L 8.18 3.68 0.00 1.66 1.63 0.12 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.74 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 74 A 7.59 3.97 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 75 I 7.60 3.80 1.82 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.70 1.01 0.00 0.00 76 L 8.01 4.08 0.00 1.26 1.66 -0.11 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.71 3.97 0.00 1.83 1.83 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.26 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.70 7.81 78 K 7.92 3.91 0.00 1.90 1.84 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.69 1.74 7.81 79 K 8.27 2.00 0.00 1.23 0.74 0.00 1.42 0.00 0.00 1.34 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 0.35 0.90 7.81 80 G 7.89 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 81 H 7.25 5.27 0.00 3.15 3.23 0.00 5.78 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 82 H 7.19 5.45 0.00 3.36 3.51 0.00 5.68 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.11 3.88 0.00 2.10 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 2.43 2.52 0.00 84 A 7.87 4.02 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 85 E 8.34 3.81 0.00 2.25 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 2.35 2.41 0.00 86 L 7.84 3.90 0.00 1.77 1.68 0.74 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.65 3.93 0.00 1.77 1.84 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.64 7.81 88 P 0.00 4.24 0.00 2.29 2.33 0.00 3.83 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.05 0.00 89 L 7.57 3.97 0.00 1.85 1.91 0.96 1.46 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 90 A 8.69 4.23 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.36 3.79 0.00 2.18 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 92 S 8.13 4.11 0.00 4.14 4.13 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 93 H 8.37 4.28 0.00 3.50 3.55 0.00 5.80 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 94 A 7.66 3.32 -0.48 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 0.00 0.00 0.00 95 T 6.90 4.44 4.27 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 1.28 0.00 0.00 96 K 7.86 4.04 0.00 1.58 1.83 0.00 1.67 0.00 0.00 1.50 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.96 1.30 7.81 97 H 7.87 4.55 0.00 3.14 3.23 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.54 3.96 0.00 1.82 1.82 0.00 1.90 0.00 0.00 0.61 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.36 7.81 99 I 8.24 4.13 2.09 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 0.90 1.05 0.00 0.00 100 P 0.00 4.41 0.00 1.53 1.73 0.00 2.20 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 1.64 1.89 0.00 101 I 8.06 3.55 1.67 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.07 0.66 0.00 0.00 102 K 7.58 3.73 0.00 1.61 1.52 0.00 1.67 0.00 0.00 1.87 0.00 0.00 3.27 0.00 0.00 3.11 0.00 0.00 0.00 0.00 0.78 1.22 7.81 103 Y 7.81 4.40 0.00 3.10 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.80 4.21 0.00 1.79 1.71 1.06 0.98 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 0.00 105 E 7.75 4.08 0.00 2.00 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 2.26 2.44 0.00 106 F 7.70 4.55 0.00 3.26 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 0.00 107 I 8.75 3.90 2.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 1.11 0.00 0.00 108 S 7.85 4.22 0.00 4.21 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 0.00 109 E 8.42 4.07 0.00 2.34 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 0.00 2.45 2.78 0.00 110 A 7.95 3.98 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 0.00 111 I 8.11 3.70 2.11 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 1.60 1.01 1.08 0.00 0.00 112 I 8.04 3.83 2.00 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 1.74 0.90 1.22 0.00 0.00 113 H 8.56 4.17 0.00 3.30 3.54 0.00 5.78 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 0.00 114 V 7.82 3.46 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.99 0.00 0.00 115 L 7.91 3.66 0.00 0.48 0.19 1.02 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.51 4.19 0.00 3.44 3.24 0.00 5.74 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 0.00 117 S 7.55 4.36 0.00 3.91 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 0.00 118 R 7.79 4.21 0.00 1.77 1.56 0.00 2.99 0.00 0.00 2.72 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.43 0.00 119 H 7.79 4.99 0.00 3.34 3.48 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.27 0.00 2.19 2.10 0.00 3.61 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.24 0.00 121 G 8.28 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 0.00 0.00 0.00 122 D 7.66 4.93 0.00 2.87 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 0.00 123 F 7.95 4.83 0.00 3.02 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 0.00 124 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 0.00 125 A 8.75 3.85 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 0.00 126 D 8.02 4.45 0.00 2.74 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 0.00 127 A 7.52 4.35 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 Q 9.88 3.63 0.00 1.89 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 129 G 7.80 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.65 3.96 1.22 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 0.00 0.00 131 M 8.62 3.96 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.94 0.00 132 N 8.32 4.45 0.00 3.07 2.93 0.00 0.00 7.08 7.21 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 0.00 133 K 8.00 3.88 0.00 1.83 1.61 0.00 1.65 0.00 0.00 1.47 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.56 7.81 134 A 7.63 3.86 1.06 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 0.00 0.00 135 L 7.80 4.05 0.00 1.74 1.82 1.01 1.12 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 0.00 136 E 7.94 3.93 0.00 2.29 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 0.00 2.30 2.32 0.00 137 L 8.13 4.01 0.00 1.86 1.95 1.03 0.91 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 0.00 138 F 8.37 4.15 0.00 3.22 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 0.00 139 R 8.28 3.47 0.00 1.82 1.83 0.00 3.16 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.97 0.00 140 K 7.96 3.80 0.00 1.87 1.96 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.45 7.81 141 D 8.20 4.38 0.00 2.64 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 0.00 142 I 7.44 3.45 1.42 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 -0.22 0.32 0.00 0.00 143 A 7.79 3.70 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.73 3.93 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 0.00 145 K 7.60 4.12 0.00 1.98 1.93 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.57 1.49 7.81 146 Y 8.47 4.21 0.00 3.06 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 K 8.59 3.88 0.00 1.89 2.11 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.48 7.81 148 E 8.63 4.08 0.00 2.30 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 2.32 2.37 0.00 149 L 7.66 4.74 0.00 1.79 1.71 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.97 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.16 4.10 0.00 3.02 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00