NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4127 8.1927 115.2908 58.2784 63.4494 175.5329 2 N 4.2495 5.7700 116.3954 55.6984 40.3548 173.9013 3 I 3.8037 8.6336 119.2411 64.0296 39.3757 175.5304 4 I 4.3420 6.8167 116.0137 61.5198 38.9272 174.4331 5 K 4.1826 8.8427 125.5992 58.7663 31.6128 178.4058 6 Q 4.0325 7.7227 118.2121 58.8517 28.9270 177.1122 7 L 4.1163 7.5778 119.1140 56.8755 42.3950 178.1606 8 E 4.2269 7.8775 118.4171 59.1581 29.8656 178.1728 9 Q 4.1785 8.5849 117.6572 58.5580 28.2725 177.7130 10 E 3.9419 7.9084 120.3668 58.1380 29.7240 176.7025 11 Q 4.4572 8.2037 116.2902 56.9472 31.0885 176.1279 12 M 3.7151 6.9968 116.6223 55.5463 32.5244 175.8544 13 K 4.5547 8.0727 119.9804 55.6124 35.1362 176.0461 14 Q 4.5059 8.2450 116.1418 55.8772 29.5699 176.4838 15 D 4.3799 7.8933 116.4631 54.7657 41.4670 176.2300 16 V 3.7800 7.0881 112.4546 60.7121 31.2601 174.3870 17 P 4.5659 0.0000 0.0000 61.4233 33.2787 175.7889 18 S 4.2929 8.3552 112.0511 59.0757 62.7528 173.4241 19 F 5.3363 7.9811 121.2469 56.5284 42.6283 173.6524 20 R 4.3440 7.2857 119.2333 55.9727 31.9621 173.1108 21 P 4.4558 0.0000 0.0000 63.6432 31.4749 176.7972 22 G 3.9278 7.5494 106.3781 45.5708 0.0000 173.1794 23 D 4.5469 7.2362 118.9319 55.3128 41.4538 177.1719 24 T 4.2033 8.5806 115.4572 64.7242 69.1397 176.4958 25 V 3.5744 7.5732 116.0728 61.3184 31.1043 171.8941 26 E 5.1211 8.2004 120.0026 54.8608 30.0063 173.4390 27 V 3.6208 8.2970 123.1660 62.6370 33.2116 174.4858 28 K 4.8760 8.5172 127.4326 55.0728 33.5720 176.0706 29 V 4.9112 8.4182 119.1188 58.8834 34.6829 175.7859 30 W 5.0479 8.3215 121.2756 57.3894 30.2632 175.1979 31 V 4.5212 8.6793 116.0666 61.9895 37.3553 174.5079 32 V 3.6037 8.2850 124.4491 63.0768 31.4379 170.8831 33 E 3.7307 7.9820 119.4267 56.8223 28.5907 172.7910 34 G 3.5967 8.4543 104.4012 46.1180 0.0000 173.2315 35 S 4.7289 8.3015 113.3572 57.6145 64.6496 174.9652 36 K 4.6107 6.9713 121.2375 57.0969 33.3420 177.2671 37 K 4.1659 8.5352 123.3818 57.5706 33.9651 174.7536 38 R 4.0012 7.9180 116.5313 56.6114 30.2291 175.3384 39 L 4.9312 8.3919 119.3967 53.2718 43.5227 175.7160 40 Q 4.5371 9.4988 126.4437 54.9575 30.4104 175.0204 41 A 4.7715 8.6525 128.0086 51.6717 20.0103 177.4082 42 F 4.7878 8.6143 120.6092 57.3237 39.9126 172.8192 43 E 4.3652 8.2607 121.3788 55.7185 30.3305 175.4005 44 G 4.0846 8.8833 117.8476 45.2407 0.0000 173.8327 45 V 4.5892 9.0704 126.4319 61.4048 34.0960 174.6234 46 V 4.0138 7.6875 120.6625 62.5535 31.6489 175.3848 47 I 4.2339 8.7919 116.9777 62.2266 39.8820 175.6595 48 A 4.7365 7.5181 123.5640 50.3978 21.4598 175.0394 49 I 4.4388 8.0324 114.4006 60.0355 41.9978 172.8118 50 R 4.0023 8.3713 117.8227 57.0569 28.6989 177.4447 51 N 4.2394 10.3262 106.6514 52.8852 34.4456 174.8788 52 R 4.5883 7.7840 114.1139 54.6907 32.7665 177.4990 53 G 3.6409 8.1569 108.4558 46.0773 0.0000 174.8131 54 L 3.8571 8.8620 121.8075 58.4863 41.9192 177.5590 55 H 4.5505 7.7994 116.6073 55.8024 28.2647 174.6259 56 S 4.8657 8.3944 119.6176 56.8993 67.6709 173.1979 57 A 5.9400 8.6899 123.4380 50.0385 22.4864 174.9774 58 F 4.7272 8.9842 113.4660 58.9398 41.4056 174.6066 59 T 3.2639 8.2260 126.2933 63.1976 65.1746 169.7984 60 V 4.7904 8.6777 125.2936 60.8297 34.6494 174.4806 61 R 4.7044 8.6061 127.0262 56.1857 31.0159 176.3437 62 K 4.0185 8.4514 122.2503 57.7781 34.3562 175.2004 63 I 3.2575 7.9585 119.7919 61.7923 33.8382 175.6124 64 S 4.5412 7.9698 126.5372 57.7110 62.6115 176.8312 65 N 4.4316 8.5443 118.8050 54.8361 36.3936 173.8574 66 G 4.2571 8.5312 114.6746 45.3333 0.0000 171.4223 67 E 4.4312 7.6906 119.7795 54.4114 31.0290 175.5676 68 G 4.0165 8.3661 110.1924 44.6321 0.0000 173.6374 69 V 4.5960 8.1850 116.1624 59.5698 35.3458 174.4059 70 E 5.1010 8.5848 122.7221 54.8740 32.5526 174.1497 71 R 4.1895 8.5161 126.8153 54.4284 32.8305 175.3840 72 V 4.4866 7.7830 120.5049 59.2178 30.2230 175.4517 73 F 4.2434 7.6819 122.7410 57.5570 40.8265 174.7147 74 Q 5.2821 7.6750 118.1964 58.6268 27.2670 178.5854 75 T 2.8360 6.5375 117.7190 65.2632 69.8066 175.9418 76 H 4.6703 7.2749 116.4435 55.7026 28.6219 175.7321 77 S 4.6277 7.3023 113.7478 55.5182 64.6867 172.4256 78 P 3.4820 0.0000 0.0000 65.6252 31.3858 178.6921 79 V 2.6181 7.2806 110.7210 63.1482 31.9230 178.6858 80 V 3.2216 8.0469 120.3730 62.9638 32.2675 177.8195 81 D 3.7895 6.6358 119.4787 54.6559 41.7881 175.2875 82 S 4.2260 8.2985 110.5587 58.2250 63.4737 173.4315 83 I 3.9821 7.5176 118.0039 60.5533 38.5450 174.3481 84 S 4.5588 8.3947 124.9307 57.7822 63.5950 173.1287 85 V 4.5331 8.0020 113.8504 60.2232 34.9308 178.9555 86 K 3.5942 8.2349 117.3429 57.0227 31.9087 176.0205 87 R 4.7311 8.9475 123.4377 55.0561 33.3606 174.3670 88 R 4.9776 8.0396 122.6133 54.1015 31.6922 175.4157 89 G 4.5039 8.4838 108.0248 44.2673 0.0000 171.3233 90 A 4.5422 8.9280 123.2214 51.0391 19.1992 176.6531 91 V 3.9817 8.3653 120.5682 64.2796 34.0988 175.3633 92 R 3.6651 8.4655 114.7416 55.4931 27.0660 174.7638 93 K 4.1694 7.1142 115.4640 56.1906 35.4307 174.1807 94 A 4.1718 8.8143 127.0143 54.1778 19.0633 177.9996 95 K 4.5244 7.6611 113.2549 54.6831 34.6448 176.8066 96 L 4.8844 7.8747 125.2509 54.5871 42.2982 178.3827 97 Y 4.5737 7.6131 118.0505 60.9164 38.3098 178.6555 98 Y 4.2319 8.1327 117.1465 59.4931 38.3536 176.3771 99 L 3.8168 7.0280 120.2899 55.2554 43.6624 177.4394 100 R 4.0501 7.8746 119.2365 57.1826 28.5921 177.9339 101 E 4.0755 9.3720 118.2307 56.9480 28.2525 176.4550 102 R 4.4270 7.4906 122.1542 55.3980 36.0715 177.3440 103 T 3.5304 7.6067 110.3600 62.6138 67.5486 171.3451 104 G 4.1207 8.2563 110.8298 46.4946 0.0000 173.2791 105 K 4.0958 8.9304 123.9019 57.6264 30.5336 178.2282 106 A 3.8668 7.9034 117.9656 53.7595 18.7232 177.7981 107 A 4.3187 7.8574 117.7467 53.9565 20.1456 177.5734 108 R 3.5623 6.8180 113.8511 53.4290 28.0228 175.7919 109 I 4.3550 8.0407 125.4470 59.0951 38.5770 176.0960 110 K 4.0406 8.7093 127.7298 56.5197 32.7480 176.8483 111 E 4.0238 8.9525 123.2882 56.7177 29.6842 176.3365 112 R 3.7395 8.9974 120.9574 54.8465 30.6065 173.1096 113 L 3.4606 7.6678 135.0000 54.7611 40.3946 174.2155 114 N 4.5184 8.5155 122.6177 53.4640 38.9368 174.5365 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 S 8.19 4.41 0.00 3.87 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 2 N 5.77 4.25 0.00 2.70 2.82 0.00 0.00 7.25 7.07 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 3 I 8.63 3.80 1.87 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 1.41 1.45 0.91 0.00 0.00 4 I 6.82 4.34 1.97 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.66 0.92 0.00 0.00 5 K 8.84 4.18 0.00 2.02 1.94 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.39 1.35 7.81 6 Q 7.72 4.03 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 7 L 7.58 4.12 0.00 1.83 1.70 0.91 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.88 4.23 0.00 2.12 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 2.28 2.33 0.00 9 Q 8.58 4.18 0.00 2.20 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.83 0.00 0.00 0.00 0.00 0.00 2.49 2.35 0.00 10 E 7.91 3.94 0.00 2.21 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 2.33 0.00 11 Q 8.20 4.46 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.53 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 12 M 7.00 3.72 0.00 1.77 2.05 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.25 0.00 13 K 8.07 4.55 0.00 1.80 1.74 0.00 1.51 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.43 7.81 14 Q 8.25 4.51 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 7.06 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 15 D 7.89 4.38 0.00 2.58 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 16 V 7.09 3.78 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 0.67 0.00 0.00 0.97 0.00 0.00 17 P 0.00 4.57 0.00 2.17 2.07 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.92 0.00 18 S 8.36 4.29 0.00 3.88 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 19 F 7.98 5.34 0.00 2.82 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 R 7.29 4.34 0.00 1.95 1.74 0.00 3.21 0.00 0.00 3.38 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.43 0.00 21 P 0.00 4.46 0.00 2.15 2.17 0.00 3.70 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.01 0.00 22 G 7.55 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 23 D 7.24 4.55 0.00 2.52 2.49 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 24 T 8.58 4.20 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 1.37 0.00 0.00 25 V 7.57 3.57 2.49 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 0.67 0.00 0.00 1.09 0.00 0.00 26 E 8.20 5.12 0.00 1.99 1.86 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 2.27 2.38 0.00 27 V 8.30 3.62 1.65 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 0.05 0.00 0.00 1.05 0.00 0.00 28 K 8.52 4.88 0.00 1.65 1.76 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.24 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.53 7.81 29 V 8.42 4.91 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 0.68 0.00 0.00 1.11 0.00 0.00 30 W 8.32 5.05 0.00 3.26 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 31 V 8.68 4.52 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 0.65 0.00 0.00 1.04 0.00 0.00 32 V 8.28 3.60 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 0.89 0.00 0.00 0.91 0.00 0.00 33 E 7.98 3.73 0.00 2.09 1.79 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 2.20 2.35 0.00 34 G 8.45 3.60 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 0.00 35 S 8.30 4.73 0.00 3.82 3.82 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 36 K 6.97 4.61 0.00 1.86 1.70 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.48 7.81 37 K 8.54 4.17 0.00 1.42 1.60 0.00 1.51 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.10 1.16 7.81 38 R 7.92 4.00 0.00 1.85 2.04 0.00 3.00 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 39 L 8.39 4.93 0.00 1.60 1.73 1.17 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 9.50 4.54 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 41 A 8.65 4.77 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 42 F 8.61 4.79 0.00 3.24 3.18 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 0.00 0.00 0.00 43 E 8.26 4.37 0.00 2.07 1.88 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 2.53 2.30 0.00 44 G 8.88 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 45 V 9.07 4.59 2.07 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 0.90 0.00 0.00 0.92 0.00 0.00 46 V 7.69 4.01 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 0.02 0.00 0.00 0.61 0.00 0.00 47 I 8.79 4.23 1.87 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.01 0.88 0.00 0.00 48 A 7.52 4.74 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 49 I 8.03 4.44 1.84 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.73 0.92 0.00 0.00 50 R 8.37 4.00 0.00 2.07 1.54 0.00 3.27 0.00 0.00 3.39 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.76 0.00 51 N 10.33 4.24 0.00 2.94 3.01 0.00 0.00 6.60 7.66 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 52 R 7.78 4.59 0.00 2.12 1.89 0.00 3.56 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 53 G 8.16 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 54 L 8.86 3.86 0.00 1.47 1.54 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 55 H 7.80 4.55 0.00 3.35 3.27 0.00 5.73 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 S 8.39 4.87 0.00 3.65 3.73 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 0.00 0.00 0.00 57 A 8.69 5.94 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 58 F 8.98 4.73 0.00 3.15 3.29 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 59 T 8.23 3.26 4.38 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 1.29 0.00 0.00 60 V 8.68 4.79 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 1.19 0.00 0.00 1.22 0.00 0.00 61 R 8.61 4.70 0.00 1.82 1.83 0.00 3.30 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 62 K 8.45 4.02 0.00 1.87 1.77 0.00 1.37 0.00 0.00 1.01 0.00 0.00 2.56 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.22 1.39 7.81 63 I 7.96 3.26 1.86 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 1.41 0.53 0.90 0.00 0.00 64 S 7.97 4.54 0.00 3.77 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 65 N 8.54 4.43 0.00 2.68 2.80 0.00 0.00 6.85 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 66 G 8.53 4.26 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 0.00 0.00 0.00 67 E 7.69 4.43 0.00 2.00 1.86 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 2.35 2.24 0.00 68 G 8.37 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 69 V 8.19 4.60 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 0.85 0.00 0.00 1.00 0.00 0.00 70 E 8.58 5.10 0.00 1.92 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.31 0.00 71 R 8.52 4.19 0.00 1.24 0.66 0.00 2.84 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.05 0.00 72 V 7.78 4.49 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 0.74 0.00 0.00 0.84 0.00 0.00 73 F 7.68 4.24 0.00 2.57 2.40 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 74 Q 7.68 5.28 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.32 0.00 0.00 0.00 0.00 0.00 2.32 2.12 0.00 75 T 6.54 2.84 3.92 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 1.12 0.00 0.00 76 H 7.27 4.67 0.00 3.24 3.20 0.00 5.59 0.00 0.00 0.00 0.00 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.30 4.63 0.00 3.76 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 78 P 0.00 3.48 0.00 1.97 1.89 0.00 3.53 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 2.05 2.03 0.00 79 V 7.28 2.62 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 0.73 0.00 0.00 0.82 0.00 0.00 80 V 8.05 3.22 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.40 0.00 0.00 81 D 6.64 3.79 0.00 2.28 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 0.00 0.00 0.00 82 S 8.30 4.23 0.00 4.03 3.97 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 83 I 7.52 3.98 1.79 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 1.48 1.19 0.86 0.00 0.00 84 S 8.39 4.56 0.00 3.91 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 85 V 8.00 4.53 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 0.86 0.00 0.00 1.00 0.00 0.00 86 K 8.23 3.59 0.00 1.89 1.64 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.42 7.81 87 R 8.95 4.73 0.00 1.87 1.76 0.00 3.16 0.00 0.00 3.39 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 88 R 8.04 4.98 0.00 1.99 2.02 0.00 3.12 0.00 0.00 3.31 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 0.00 89 G 8.48 4.50 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 0.00 90 A 8.93 4.54 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 91 V 8.37 3.98 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 0.96 0.00 0.00 0.93 0.00 0.00 92 R 8.47 3.67 0.00 1.97 1.97 0.00 3.31 0.00 0.00 3.11 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.57 0.00 93 K 7.11 4.17 0.00 1.66 1.64 0.00 1.62 0.00 0.00 1.52 0.00 0.00 2.83 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.27 1.32 7.81 94 A 8.81 4.17 1.23 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 0.00 0.00 95 K 7.66 4.52 0.00 1.29 0.74 0.00 1.47 0.00 0.00 1.58 0.00 0.00 3.10 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.85 0.90 7.81 96 L 7.87 4.88 0.00 1.61 1.28 0.97 0.52 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 97 Y 7.61 4.57 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 98 Y 8.13 4.23 0.00 3.12 3.10 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 0.00 0.00 0.00 99 L 7.03 3.82 0.00 1.01 1.41 0.79 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.87 4.05 0.00 2.16 1.41 0.00 3.40 0.00 0.00 3.50 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 101 E 9.37 4.08 0.00 2.10 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 2.30 2.43 0.00 102 R 7.49 4.43 0.00 1.81 1.83 0.00 3.68 0.00 0.00 3.25 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 103 T 7.61 3.53 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 1.21 0.00 0.00 104 G 8.26 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 0.00 105 K 8.93 4.10 0.00 1.97 1.95 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.36 7.81 106 A 7.90 3.87 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 0.00 107 A 7.86 4.32 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 0.00 108 R 6.82 3.56 0.00 1.78 1.87 0.00 3.14 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 109 I 8.04 4.35 1.85 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 1.31 0.74 0.91 0.00 0.00 110 K 8.71 4.04 0.00 1.76 1.77 0.00 1.59 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.52 7.81 111 E 8.95 4.02 0.00 1.94 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 2.28 2.39 0.00 112 R 9.00 3.74 0.00 1.64 1.87 0.00 3.41 0.00 0.00 3.33 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 113 L 7.67 3.46 0.00 1.88 1.83 0.92 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.52 4.52 0.00 2.71 2.66 0.00 0.00 7.08 7.56 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