NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3993 8.3049 120.3494 54.8357 33.5520 175.6796 2 D 4.2199 8.5639 125.8303 53.7669 42.0980 175.6834 3 Q 3.9137 9.0247 125.5296 59.3439 29.4882 178.0489 4 F 3.5487 8.1109 120.8430 61.2954 39.2425 176.9078 5 L 2.9326 7.5423 117.7674 57.3585 41.3459 179.4777 6 V 3.4685 7.6238 118.2146 65.9627 31.4593 178.1451 7 Q 3.9783 8.0554 117.9813 58.9345 28.6962 178.7101 8 I 3.6706 7.2363 113.9821 64.0549 37.6393 178.1422 9 F 4.3234 8.1715 119.7025 60.1769 38.5250 177.2200 10 A 4.1129 7.9732 119.1687 55.3930 18.3298 179.6048 11 V 3.7491 7.7006 115.9005 66.3634 31.6176 178.2146 12 I 3.3067 7.7576 119.4423 64.6677 36.6630 177.9055 13 H 4.0816 7.7739 115.3831 58.0714 28.5577 176.8453 14 Q 4.3871 7.7252 118.5386 55.6576 28.8942 175.7825 15 I 2.8601 6.5328 122.3710 59.4567 37.1768 174.3038 16 P 4.4485 0.0000 0.0000 61.3356 32.1076 175.5768 17 K 4.4800 7.7447 120.6001 57.8921 32.1183 176.6185 18 G 4.0157 9.5008 114.3293 45.1442 0.0000 172.3381 19 K 5.0488 7.5572 117.5531 54.3646 35.2269 176.1603 20 V 4.8915 9.1598 116.3695 59.6618 35.7243 174.8724 21 S 5.3808 9.0402 118.5870 56.6921 67.0338 172.6526 22 T 5.3430 8.6527 109.8710 59.9280 70.2803 175.6392 23 Y 4.4381 8.4936 121.3457 61.4775 37.7830 179.5524 24 G 3.7194 8.2478 106.1187 47.8590 0.0000 175.5058 25 E 4.0593 8.0547 121.2443 59.1141 29.4889 179.4796 26 I 3.8456 7.9156 119.5003 64.4623 37.1611 178.2307 27 A 4.1936 8.3784 121.6409 55.1380 18.3401 179.4909 28 K 3.9269 8.4066 118.1036 60.2104 32.1194 179.0288 29 M 4.1817 8.1867 117.1460 58.1069 31.9153 178.1997 30 A 4.3416 8.1349 120.1368 53.0741 18.6819 178.2952 31 G 3.7669 8.1115 104.6124 45.9083 0.0000 173.8539 32 Y 4.4998 8.1929 118.8568 54.3795 38.0241 172.1408 33 P 4.4609 0.0000 0.0000 63.8135 32.1432 177.2284 34 G 4.0540 9.2538 111.5344 46.1039 0.0000 173.5146 35 Y 4.4809 8.1236 117.1939 58.0594 38.3060 177.1860 36 A 4.2034 8.2156 123.4210 55.7722 18.5540 180.3880 37 R 3.6746 8.0189 116.1752 59.7578 30.0735 178.3293 38 H 4.1745 8.1071 115.7041 58.7822 28.8748 177.5924 39 V 3.8740 8.3869 120.2811 66.0941 31.3162 178.3328 40 G 3.2146 7.5683 104.9794 47.3679 0.0000 175.8738 41 K 3.9105 8.0444 120.5402 59.1299 31.8818 179.0379 42 A 4.1191 7.7872 119.6110 55.4509 18.5994 179.3900 43 L 4.2057 8.0855 117.2265 57.9965 41.5579 180.1189 44 G 3.5414 7.9309 104.2145 47.2363 0.0000 174.7717 45 N 4.4543 8.0021 118.2526 54.8074 39.2962 175.3067 46 L 4.1464 6.6059 119.4907 53.2260 41.0103 174.8304 47 P 4.3790 0.0000 0.0000 62.2837 31.8802 177.2637 48 E 4.1904 8.6620 116.9097 58.6863 30.1531 177.4957 49 G 4.2789 7.3452 106.1188 44.0120 0.0000 171.1687 50 S 4.5357 7.9801 114.6924 57.0873 64.0851 173.8691 51 K 4.0848 8.4585 121.3619 59.0373 32.5279 177.0852 52 L 4.0587 7.6403 121.8993 52.8982 42.4517 174.4677 53 P 3.6779 0.0000 0.0000 62.3986 29.5827 175.6687 54 W 4.1935 7.6977 123.8321 58.8289 28.8021 178.7421 55 F 3.8751 5.7202 112.2667 58.4095 37.4097 175.7151 56 R 4.1377 7.0006 120.0963 56.1845 29.9909 175.2048 57 V 4.6424 7.2687 117.5985 61.1548 33.8931 174.4264 58 I 4.6769 8.2728 122.7085 58.7286 41.3103 174.3963 59 N 5.1580 8.3800 119.5984 52.2355 38.7823 176.2756 60 S 4.3132 8.8437 112.8867 60.3210 62.5292 174.3174 61 Q 4.2740 8.2704 117.2212 56.0014 29.2062 175.3105 62 G 3.9267 8.3136 106.7361 46.4159 0.0000 173.6255 63 K 5.0305 8.4622 116.6372 54.0640 36.5926 176.3300 64 I 4.1712 8.4383 123.1830 61.2425 37.4483 177.0843 65 S 4.3822 8.8843 120.3507 60.9110 63.4891 174.9977 66 L 4.2928 7.8493 119.4974 54.3437 42.1456 175.6276 67 K 4.7433 7.9945 119.3190 54.8145 37.0686 178.5672 68 G 3.8794 8.2587 109.1010 46.8833 0.0000 176.5877 69 R 3.9413 8.7007 121.7152 59.2242 29.7988 177.9373 70 D 4.4660 7.9934 118.6559 56.7886 40.6021 178.5861 71 L 3.9907 7.5908 121.2319 58.3930 42.2413 178.6273 72 D 4.3031 8.0951 117.2988 56.8312 41.0265 177.8374 73 R 4.2129 8.2831 121.4186 59.0338 30.0658 178.2606 74 Q 3.8198 8.4858 119.1898 58.8490 29.0712 177.7712 75 K 3.7757 8.3420 121.2358 59.7336 31.9111 178.5905 76 Q 4.3278 8.4799 119.2967 58.7157 28.1032 178.7899 77 K 3.4950 7.3330 119.4195 59.0495 32.2530 179.0835 78 L 3.8959 7.6744 119.3163 57.5567 41.3299 179.3878 79 E 3.9204 8.5105 118.9069 58.9890 29.1408 178.6650 80 A 4.0868 7.4220 118.5967 53.6126 18.9693 178.2616 81 E 4.3151 8.0526 116.4163 55.3106 30.7028 175.5233 82 G 4.0445 7.6939 106.3447 46.6728 0.0000 173.9445 83 I 4.2009 7.1745 117.3549 58.9944 39.9492 176.8761 84 E 4.1253 8.8914 125.8607 55.9488 27.7053 175.1246 85 V 4.2433 7.7618 122.7470 60.7821 32.8581 176.1026 86 S 4.3962 8.8945 123.0675 57.5914 63.8519 174.8005 87 E 3.8818 8.9916 121.0676 59.8485 28.9186 178.2415 88 I 4.0293 7.7120 109.3719 60.4905 38.0777 175.3950 89 G 3.7071 8.7244 108.9855 46.9081 0.0000 173.3941 90 K 4.9210 7.7524 118.5702 54.1466 34.5622 174.5802 91 I 4.6928 8.6655 126.3073 58.9643 40.3984 176.4672 92 A 4.3751 8.6227 126.3832 50.9368 17.7485 178.1669 93 L 4.0262 8.4213 123.2267 58.9053 41.8246 179.5320 94 R 3.9425 8.1035 115.2138 58.3050 30.0242 177.5795 95 K 4.2733 7.8977 117.4073 56.9700 34.1632 176.2548 96 Y 4.6015 7.7446 114.5599 56.6556 38.4253 175.4428 97 K 4.5469 7.8269 120.8720 56.3069 32.9850 176.6032 98 W 4.3569 9.1541 134.7980 58.3114 31.1327 175.6917 99 Q 4.2885 8.6545 128.2516 52.6260 29.9183 175.5427 100 P 4.7549 0.0000 0.0000 62.8451 30.7112 177.2992 101 L 4.4733 8.0798 118.4961 55.4731 42.4769 176.7179 102 E 4.2493 7.9836 122.0637 56.2942 29.8369 175.7683 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 4.40 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.66 0.00 2 D 8.56 4.22 0.00 2.83 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 3 Q 9.02 3.91 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.88 0.00 0.00 0.00 0.00 0.00 2.51 2.62 0.00 4 F 8.11 3.55 0.00 2.58 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 5 L 7.54 2.93 0.00 1.46 0.65 0.92 0.64 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 6 V 7.62 3.47 2.17 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 1.12 0.00 0.00 0.94 0.00 0.00 7 Q 8.06 3.98 0.00 2.24 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.61 0.00 0.00 0.00 0.00 0.00 2.74 2.84 0.00 8 I 7.24 3.67 1.77 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.49 0.44 0.00 0.00 9 F 8.17 4.32 0.00 2.99 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 10 A 7.97 4.11 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 11 V 7.70 3.75 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 1.27 0.00 0.00 1.14 0.00 0.00 12 I 7.76 3.31 1.81 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.71 0.62 0.00 0.00 13 H 7.77 4.08 0.00 3.32 3.29 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 Q 7.73 4.39 0.00 2.27 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 7.14 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 15 I 6.53 2.86 1.39 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.56 0.00 0.00 16 P 0.00 4.45 0.00 2.23 2.03 0.00 3.68 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.19 0.00 17 K 7.74 4.48 0.00 1.72 1.75 0.00 1.60 0.00 0.00 2.37 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.43 1.82 7.81 18 G 9.50 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 19 K 7.56 5.05 0.00 1.74 1.86 0.00 1.99 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.71 7.81 20 V 9.16 4.89 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 0.78 0.00 0.00 1.03 0.00 0.00 21 S 9.04 5.38 0.00 4.09 4.35 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 22 T 8.65 5.34 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 1.32 0.00 0.00 23 Y 8.49 4.44 0.00 3.13 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 24 G 8.25 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 25 E 8.05 4.06 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 26 I 7.92 3.85 2.02 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.91 0.99 0.00 0.00 27 A 8.38 4.19 1.72 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 28 K 8.41 3.93 0.00 2.04 2.08 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.53 7.81 29 M 8.19 4.18 0.00 2.16 2.38 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.61 0.00 30 A 8.13 4.34 1.53 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 0.00 0.00 31 G 8.11 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 0.00 0.00 0.00 32 Y 8.19 4.50 0.00 3.10 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 0.00 0.00 0.00 0.00 33 P 0.00 4.46 0.00 2.13 2.07 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 34 G 9.25 4.05 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 0.00 0.00 0.00 35 Y 8.12 4.48 0.00 3.40 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 36 A 8.22 4.20 1.47 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 0.00 0.00 37 R 8.02 3.67 0.00 1.80 1.82 0.00 3.09 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.59 0.00 38 H 8.11 4.17 0.00 3.62 3.42 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 V 8.39 3.87 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 1.27 0.00 0.00 1.25 0.00 0.00 40 G 7.57 3.21 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 0.00 41 K 8.04 3.91 0.00 2.00 1.87 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.63 7.81 42 A 7.79 4.12 1.59 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 0.00 0.00 43 L 8.09 4.21 0.00 1.94 1.99 1.29 0.92 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 44 G 7.93 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 45 N 8.00 4.45 0.00 2.83 3.07 0.00 0.00 7.25 7.37 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 46 L 6.61 4.15 0.00 1.47 1.36 0.53 1.42 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 47 P 0.00 4.38 0.00 2.19 2.14 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 48 E 8.66 4.19 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 49 G 7.35 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 0.00 0.00 0.00 0.00 50 S 7.98 4.54 0.00 3.84 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.46 4.08 0.00 1.92 1.95 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.41 1.43 7.81 52 L 7.64 4.06 0.00 1.36 1.34 0.41 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 3.68 0.00 1.46 1.63 0.00 3.51 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 54 W 7.70 4.19 0.00 3.53 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 55 F 5.72 3.88 0.00 2.59 1.74 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 56 R 7.00 4.14 0.00 1.48 1.82 0.00 2.68 0.00 0.00 3.12 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.90 0.00 57 V 7.27 4.64 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 0.35 0.00 0.00 0.79 0.00 0.00 58 I 8.27 4.68 2.13 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 1.21 0.69 0.89 0.00 0.00 59 N 8.38 5.16 0.00 2.98 3.26 0.00 0.00 7.18 8.85 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 60 S 8.84 4.31 0.00 3.93 3.99 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 61 Q 8.27 4.27 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 62 G 8.31 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 0.00 0.00 0.00 63 K 8.46 5.03 0.00 1.92 1.68 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.62 7.81 64 I 8.44 4.17 1.93 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.62 1.20 0.00 0.00 65 S 8.88 4.38 0.00 4.06 4.29 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 66 L 7.85 4.29 0.00 1.79 1.71 1.07 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 67 K 7.99 4.74 0.00 1.77 1.68 0.00 1.84 0.00 0.00 1.83 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.42 7.81 68 G 8.26 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.70 3.94 0.00 1.87 2.01 0.00 3.14 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 70 D 7.99 4.47 0.00 2.83 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 71 L 7.59 3.99 0.00 1.72 1.86 1.01 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.10 4.30 0.00 2.84 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 R 8.28 4.21 0.00 2.07 2.22 0.00 3.18 0.00 0.00 3.27 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.71 0.00 74 Q 8.49 3.82 0.00 2.59 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.16 0.00 75 K 8.34 3.78 0.00 1.88 1.91 0.00 1.68 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.59 1.41 7.81 76 Q 8.48 4.33 0.00 2.20 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.58 0.00 0.00 0.00 0.00 0.00 2.59 2.19 0.00 77 K 7.33 3.50 0.00 1.12 0.74 0.00 1.29 0.00 0.00 1.39 0.00 0.00 3.49 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.36 7.81 78 L 7.67 3.90 0.00 1.66 1.53 0.83 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.51 3.92 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.48 0.00 80 A 7.42 4.09 1.20 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 0.00 0.00 81 E 8.05 4.32 0.00 2.09 2.06 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 2.23 2.46 0.00 82 G 7.69 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 83 I 7.17 4.20 1.67 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 1.17 0.61 -0.18 0.00 0.00 84 E 8.89 4.13 0.00 2.12 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 2.52 2.49 0.00 85 V 7.76 4.24 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.85 0.00 0.00 86 S 8.89 4.40 0.00 4.03 3.99 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 87 E 8.99 3.88 0.00 2.09 2.17 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 2.30 2.35 0.00 88 I 7.71 4.03 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.48 0.92 0.00 0.00 89 G 8.72 3.71 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 0.00 0.00 0.00 90 K 7.75 4.92 0.00 1.78 1.65 0.00 1.62 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.53 7.81 91 I 8.67 4.69 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.76 0.78 0.00 0.00 92 A 8.62 4.38 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 93 L 8.42 4.03 0.00 1.74 1.79 1.02 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 94 R 8.10 3.94 0.00 1.77 2.00 0.00 3.17 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 95 K 7.90 4.27 0.00 1.52 1.36 0.00 1.56 0.00 0.00 1.31 0.00 0.00 2.91 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.65 1.22 7.81 96 Y 7.74 4.60 0.00 3.18 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 97 K 7.83 4.55 0.00 1.65 1.80 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.54 1.60 7.81 98 W 9.15 4.36 0.00 3.21 3.21 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 99 Q 8.65 4.29 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.99 0.00 0.00 0.00 0.00 0.00 2.26 2.52 0.00 100 P 0.00 4.75 0.00 2.08 2.07 0.00 3.17 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.18 0.00 101 L 8.08 4.47 0.00 1.57 1.69 0.86 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 102 E 7.98 4.25 0.00 2.09 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 2.46 2.34 0.00