NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 D 4.5921 8.3649 120.2073 54.2342 42.0427 178.3168 5 H 4.6416 8.7092 108.1583 53.1645 29.5373 170.8022 6 F 4.8567 8.3894 120.6831 55.9710 42.0809 174.6064 7 Y 4.7766 8.3996 123.2355 56.4097 41.6306 174.1488 8 T 4.3711 7.1903 115.9048 59.7304 69.9021 174.0632 9 L 4.3553 8.2308 126.5246 53.7941 42.5141 176.5504 10 N 4.6013 8.4841 119.9342 53.1628 39.9943 176.2047 11 I 3.7999 8.3223 129.0552 63.9071 37.4027 177.8889 12 A 3.8621 7.8802 121.4682 55.3834 17.7217 179.3571 13 E 3.8955 8.2850 117.0394 59.4366 29.6765 178.9417 14 I 3.8097 7.5453 118.7869 64.0160 37.0808 177.9383 15 A 3.8037 8.2697 122.3556 55.2442 18.2567 179.3879 16 E 3.7211 8.0741 115.7160 59.7573 29.2242 179.6104 17 R 3.9912 7.5300 117.3161 59.1192 30.4463 178.8376 18 I 4.2620 8.2505 119.9679 64.4954 36.9909 178.5365 19 G 4.2067 9.2175 106.6293 47.8259 0.0000 174.1332 20 N 5.1200 7.8273 116.0398 51.9635 39.1286 174.3300 21 D 4.7773 8.4040 121.3524 51.8014 43.2320 175.5258 22 D 4.3689 9.0450 126.6079 57.7278 41.2280 177.6027 23 C 4.0700 8.2339 118.1728 62.4029 31.6696 174.9680 24 A 3.9686 9.1069 122.6049 55.4514 18.0858 178.5286 25 Y 4.0362 8.1093 117.7505 61.3427 38.7072 178.8344 26 Q 3.8674 7.9883 118.4816 58.7735 28.5831 178.8585 27 V 3.3536 7.4536 118.1577 65.9824 31.8061 177.2770 28 L 4.5398 8.5220 120.2516 59.0474 41.9145 178.9249 29 M 3.9648 8.4007 118.5137 57.9852 31.6338 178.4646 30 A 3.8733 7.8525 120.3635 54.4679 18.6052 178.0173 31 F 4.4388 8.2537 114.7367 57.7344 39.4763 174.9682 32 I 4.7160 7.7244 123.1401 59.3917 38.6949 175.7002 33 N 4.7329 9.0616 123.6838 51.4591 39.2787 175.2075 34 E 3.8862 8.8101 118.0683 59.8681 29.4795 177.6107 35 N 4.5628 8.1718 111.9904 53.4498 38.4453 176.1890 36 G 4.0219 8.1405 107.3928 45.5374 0.0000 174.4156 37 E 4.1443 8.0557 119.7148 55.7988 30.1676 176.0970 38 A 4.7075 8.4084 125.4403 52.0388 19.3309 176.9444 39 Q 4.8659 9.1976 120.6844 54.5092 31.6062 174.1185 40 M 5.3765 8.4295 113.3238 54.3583 34.2980 174.5703 41 L 4.8613 9.1380 119.3593 53.7230 47.3023 174.9843 42 N 5.0369 8.6147 118.7375 51.6530 40.0203 175.8749 43 K 3.9937 9.1827 117.5271 60.2662 31.9702 179.4517 44 T 4.0567 8.1557 114.8226 66.7519 68.6068 176.3753 45 A 3.9891 8.6107 122.8779 55.0157 18.3453 179.7150 46 V 3.2625 7.6419 115.9982 66.2005 31.4138 177.8013 47 A 3.7803 7.7264 118.9672 55.6194 18.1203 179.2085 48 E 4.0185 7.9001 115.7822 59.7023 29.6031 179.1236 49 M 4.1851 7.5374 117.5300 56.9096 32.3254 177.2292 50 I 3.8921 7.0749 120.1775 60.9170 38.2434 176.4881 51 Q 4.3274 8.3574 128.9840 55.3896 28.3499 175.1230 52 L 4.6854 7.0924 116.2792 52.1398 46.3572 177.1257 53 S 3.7924 8.2050 114.2847 57.3534 62.8379 174.6670 54 K 3.2661 8.7815 130.8699 59.4736 31.7945 175.9858 55 P 4.2525 0.0000 0.0000 66.3083 30.9410 178.0359 56 T 3.8817 7.8998 113.3767 67.1396 68.3988 176.5916 57 V 3.4637 7.7803 119.8136 65.8126 31.3473 178.1206 58 F 4.5426 7.9169 117.4685 60.5811 38.7009 177.3436 59 A 4.1297 8.2017 120.4484 55.5527 18.1145 179.9728 60 T 3.4907 7.6938 114.0449 66.6238 68.3826 177.3858 61 V 3.3561 7.4611 119.7606 65.0579 31.4166 177.6010 62 N 4.4378 8.5012 117.4593 56.1398 38.4879 177.3812 63 W 4.4296 8.8606 118.2789 59.5621 28.3463 178.2362 64 F 3.8256 8.3966 119.2785 60.3647 38.1459 177.0183 65 Y 4.0697 8.1242 119.1354 60.9262 38.4997 177.2399 66 C 3.8434 8.3020 115.5309 63.0558 28.3356 175.7424 67 A 3.9648 8.1154 121.2781 53.3587 17.8041 178.4953 68 G 3.8544 7.1114 103.7141 45.3882 0.0000 174.0302 69 Y 4.6142 7.6813 119.6337 59.8098 38.7995 175.6827 70 I 5.0829 7.6462 110.4532 59.1519 40.9658 174.5892 71 D 5.2733 9.3904 123.2990 52.7748 44.4310 174.5757 72 E 4.8502 8.8619 119.9237 54.7836 32.3050 174.7719 73 T 4.5921 9.0387 124.2545 61.2355 71.5891 173.6282 74 R 4.1598 8.5551 127.0511 56.7554 31.3704 176.4008 75 V 4.0178 8.7457 124.6982 62.7048 33.9107 172.3405 76 G 4.1162 8.6954 117.9459 45.8476 0.0000 173.6514 77 R 4.5633 7.6878 120.0708 53.2018 31.3285 176.5889 78 S 4.2435 8.0746 112.3468 57.3192 65.3827 174.8716 79 K 4.1732 8.6118 126.2963 56.3259 32.2401 176.6320 80 I 4.4427 8.5230 126.5946 59.5654 40.4440 174.3717 81 Y 5.4183 9.3069 123.5242 56.7190 40.9897 174.9366 82 T 5.0932 8.6316 111.4747 59.6928 72.8731 173.1280 83 L 4.3444 8.4150 123.3545 55.0575 42.4455 177.3558 84 S 4.8122 8.7816 118.5953 57.4387 64.4713 175.0093 85 D 4.3402 8.8575 119.3533 57.4363 40.3607 178.5852 86 L 4.0381 8.1364 120.3929 58.3704 41.9927 179.1991 87 G 3.4788 8.0337 105.3421 47.8274 0.0000 175.8084 88 V 3.6391 7.8001 120.7924 65.5060 31.3197 177.7004 89 E 3.9232 8.3712 118.7771 59.7665 29.4221 179.4514 90 I 3.5921 7.8089 119.5360 64.2939 37.1225 178.7011 91 V 3.7642 7.8743 118.9074 66.1613 31.1735 177.7542 92 E 4.1730 8.6054 117.6108 58.2915 29.2818 178.3065 93 C 4.0903 7.6176 119.3819 61.5382 32.0576 175.3666 94 F 4.1762 7.8412 118.9198 60.4112 38.5394 177.2488 95 K 3.9151 8.7536 119.6847 60.0263 31.8095 178.7453 96 Q 4.0674 7.6261 117.6985 58.8550 28.4073 178.7743 97 K 3.9705 7.9057 118.3923 59.3062 32.4383 179.0053 98 A 4.1826 8.3633 121.1745 55.3366 18.0593 179.3163 99 M 3.9813 8.3966 117.6706 58.9553 31.9599 178.9838 100 E 3.8888 8.2780 116.4437 58.6824 29.6091 178.9138 101 M 4.1630 7.6177 118.1787 58.5625 32.5163 175.9955 102 R 4.1660 7.3570 120.7052 56.3920 30.3724 176.2316 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 4 D 8.36 4.59 0.00 2.67 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 0.00 0.00 0.00 5 H 8.71 4.64 0.00 3.03 3.10 0.00 5.93 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 8.39 4.86 0.00 3.06 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 7 Y 8.40 4.78 0.00 2.90 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 8 T 7.19 4.37 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 1.09 0.00 0.00 9 L 8.23 4.36 0.00 1.69 1.69 1.22 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.48 4.60 0.00 2.74 2.69 0.00 0.00 7.07 7.82 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 11 I 8.32 3.80 1.82 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.64 0.81 0.00 0.00 12 A 7.88 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.28 3.90 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 14 I 7.55 3.81 1.83 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 1.54 0.61 0.92 0.00 0.00 15 A 8.27 3.80 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 8.07 3.72 0.00 2.24 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 0.00 2.48 2.44 0.00 17 R 7.53 3.99 0.00 2.16 2.13 0.00 3.22 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.71 0.00 18 I 8.25 4.26 2.34 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.94 1.29 0.00 0.00 19 G 9.22 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 N 7.83 5.12 0.00 2.91 2.88 0.00 0.00 6.71 7.88 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 21 D 8.40 4.78 0.00 2.74 2.88 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 22 D 9.04 4.37 0.00 2.85 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 8.23 4.07 0.00 3.07 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 24 A 9.11 3.97 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 0.00 0.00 25 Y 8.11 4.04 0.00 3.08 3.16 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 0.00 26 Q 7.99 3.87 0.00 2.30 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 27 V 7.45 3.35 1.57 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 0.17 0.00 0.00 0.74 0.00 0.00 28 L 8.52 4.54 0.00 2.14 1.82 0.82 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 29 M 8.40 3.96 0.00 1.76 1.67 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 30 A 7.85 3.87 1.05 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 31 F 8.25 4.44 0.00 3.16 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 32 I 7.72 4.72 1.98 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 1.41 0.86 0.96 0.00 0.00 33 N 9.06 4.73 0.00 2.82 3.11 0.00 0.00 6.21 7.53 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 34 E 8.81 3.89 0.00 1.94 2.03 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 0.00 2.29 2.34 0.00 35 N 8.17 4.56 0.00 2.88 2.84 0.00 0.00 6.95 7.65 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 36 G 8.14 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 37 E 8.06 4.14 0.00 2.21 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 2.34 2.27 0.00 38 A 8.41 4.71 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 39 Q 9.20 4.87 0.00 2.13 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.59 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 40 M 8.43 5.38 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.58 0.00 41 L 9.14 4.86 0.00 1.55 1.50 0.37 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.61 5.04 0.00 2.92 3.00 0.00 0.00 5.94 6.44 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 43 K 9.18 3.99 0.00 1.84 2.04 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.45 1.76 7.81 44 T 8.16 4.06 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 1.26 0.00 0.00 45 A 8.61 3.99 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 46 V 7.64 3.26 2.16 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 0.79 0.00 0.00 0.71 0.00 0.00 47 A 7.73 3.78 1.16 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 0.00 0.00 0.00 48 E 7.90 4.02 0.00 2.09 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 2.32 2.51 0.00 49 M 7.54 4.19 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.50 0.00 50 I 7.07 3.89 1.74 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 1.06 0.25 0.86 0.00 0.00 51 Q 8.36 4.33 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.77 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 52 L 7.09 4.69 0.00 1.52 1.42 0.90 0.92 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 53 S 8.21 3.79 0.00 3.86 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 54 K 8.78 3.27 0.00 1.72 1.63 0.00 1.63 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.40 0.57 7.81 55 P 0.00 4.25 0.00 2.18 2.14 0.00 3.53 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 56 T 7.90 3.88 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 1.22 0.00 0.00 57 V 7.78 3.46 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 0.95 0.00 0.00 0.84 0.00 0.00 58 F 7.92 4.54 0.00 3.27 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.20 4.13 1.46 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 0.00 0.00 0.00 60 T 7.69 3.49 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 0.37 0.00 0.00 61 V 7.46 3.36 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 0.70 0.00 0.00 0.62 0.00 0.00 62 N 8.50 4.44 0.00 3.07 3.00 0.00 0.00 6.76 7.84 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 63 W 8.86 4.43 0.00 3.54 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 64 F 8.40 3.83 0.00 2.95 3.02 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 65 Y 8.12 4.07 0.00 3.07 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 66 C 8.30 3.84 0.00 3.23 3.03 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 0.00 0.00 0.00 0.00 67 A 8.12 3.96 0.55 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 68 G 7.11 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 69 Y 7.68 4.61 0.00 2.54 2.54 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 70 I 7.65 5.08 1.87 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 1.61 0.93 0.61 0.00 0.00 71 D 9.39 5.27 0.00 2.61 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.86 4.85 0.00 1.77 1.70 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 1.89 1.55 0.00 73 T 9.04 4.59 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 74 R 8.56 4.16 0.00 1.74 1.79 0.00 3.24 0.00 0.00 3.10 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 75 V 8.75 4.02 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 0.79 0.00 0.00 0.91 0.00 0.00 76 G 8.70 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 R 7.69 4.56 0.00 1.71 1.79 0.00 3.26 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.59 0.00 78 S 8.07 4.24 0.00 3.99 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 79 K 8.61 4.17 0.00 1.45 1.40 0.00 1.59 0.00 0.00 1.97 0.00 0.00 2.65 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.37 7.81 80 I 8.52 4.44 1.92 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 1.17 1.29 0.92 0.00 0.00 81 Y 9.31 5.42 0.00 3.23 2.91 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 82 T 8.63 5.09 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 83 L 8.41 4.34 0.00 1.52 1.60 0.97 0.64 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 84 S 8.78 4.81 0.00 3.89 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 85 D 8.86 4.34 0.00 2.76 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 86 L 8.14 4.04 0.00 1.81 1.89 0.96 1.26 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 87 G 8.03 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 0.00 0.00 0.00 0.00 88 V 7.80 3.64 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 1.08 0.00 0.00 0.94 0.00 0.00 89 E 8.37 3.92 0.00 2.15 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 2.54 2.51 0.00 90 I 7.81 3.59 1.83 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.98 0.84 0.00 0.00 91 V 7.87 3.76 2.12 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 0.96 0.00 0.00 1.03 0.00 0.00 92 E 8.61 4.17 0.00 2.07 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 2.44 2.48 0.00 93 C 7.62 4.09 0.00 2.92 2.98 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 94 F 7.84 4.18 0.00 3.44 3.15 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 95 K 8.75 3.92 0.00 1.99 1.88 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.55 7.81 96 Q 7.63 4.07 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 97 K 7.91 3.97 0.00 1.98 1.92 0.00 1.60 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.46 1.56 7.81 98 A 8.36 4.18 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 99 M 8.40 3.98 0.00 2.01 2.34 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.95 0.00 100 E 8.28 3.89 0.00 1.94 2.02 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 2.35 2.39 0.00 101 M 7.62 4.16 0.00 2.11 2.33 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 2.63 2.59 0.00 102 R 7.36 4.17 0.00 1.91 1.83 0.00 3.26 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00