NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 D 4.5856 8.3649 120.1882 53.8132 42.8879 176.1978 3 K 4.3098 7.8071 114.0600 55.4136 33.6815 174.6219 4 I 4.2189 8.3755 122.3676 60.7780 38.8505 175.5013 5 I 3.9019 8.5246 129.0107 61.4683 38.2770 174.6329 6 H 4.9365 8.8185 127.3340 55.1763 30.2171 174.6066 7 L 4.7282 8.5042 126.7554 54.1195 43.4336 175.9390 8 T 4.9168 8.8482 109.7617 59.0892 72.0932 174.6125 9 D 4.4930 8.5901 123.1012 57.0994 40.7745 178.7725 10 D 4.6007 8.0865 117.5364 56.1746 41.3614 177.9237 11 S 4.4817 8.1598 113.8934 59.1918 63.5262 175.8746 12 F 3.9175 8.1156 127.4880 62.1984 39.1112 176.9705 13 D 4.4471 8.3696 120.1657 58.9950 39.3451 180.6344 14 T 4.1303 7.7109 109.4510 64.6001 69.1301 176.0819 15 D 4.3669 8.2250 121.2171 55.9523 40.6461 177.1968 16 V 3.7445 7.6067 116.5975 64.4207 32.6227 177.8164 17 L 3.9169 7.3670 117.1361 57.0371 41.7317 178.1498 18 K 4.3241 7.8275 114.9330 55.8922 32.4494 176.4108 19 A 4.2584 7.2794 121.9358 51.7680 19.1157 176.7224 20 D 4.6470 8.4296 119.4898 53.8438 42.2906 178.1497 21 G 3.8666 8.6932 110.8726 44.2191 0.0000 172.4799 22 A 4.4196 8.2400 119.8754 52.2972 19.6962 176.8288 23 I 5.0043 8.9380 122.5425 59.4353 41.1698 174.2365 24 L 4.8780 8.7371 130.1990 54.1299 43.5860 175.2528 25 V 4.7938 9.0417 126.7735 61.1582 34.3033 173.5016 26 D 5.1502 9.0416 128.6693 52.9537 42.7068 174.9475 27 F 5.0791 9.5338 126.8315 56.4970 40.5253 175.2919 28 W 5.4473 8.6983 119.2184 56.0143 32.2761 172.9386 29 A 3.7252 8.1515 118.9388 50.3095 21.0223 177.2046 30 E 4.0824 8.4537 121.7151 58.8356 29.8065 177.7980 31 W 4.5699 7.2080 113.0856 56.5393 28.8755 176.8739 32 C 4.8045 7.8986 120.7547 55.0845 41.5082 173.9717 33 G 3.7065 8.6634 115.4007 47.7639 0.0000 172.1180 34 P 4.3236 0.0000 0.0000 64.9996 31.6099 179.1934 35 C 4.4393 8.1322 114.9692 60.0985 37.5005 176.0931 36 K 3.8097 7.9191 119.5018 59.6778 31.3642 179.2019 37 M 4.0224 7.9004 118.4683 57.7957 32.0479 177.8787 38 I 4.1366 7.4503 110.6411 61.0454 38.0723 177.3607 39 A 3.7822 7.3858 123.5247 55.2295 17.9392 177.9552 40 P 4.6943 0.0000 0.0000 64.9954 31.3382 178.9501 41 I 3.7185 7.5106 119.0832 64.1249 36.8637 178.3888 42 L 3.9256 7.5742 119.6479 57.7077 41.2581 179.1170 43 D 4.3222 7.9620 118.3832 57.4716 40.8322 178.6451 44 E 3.9910 7.9107 118.9070 59.4410 29.4014 179.3557 45 I 3.8357 8.0881 119.9208 64.2749 36.8945 178.2647 46 A 4.0053 7.9478 120.6439 55.3057 18.3775 179.1412 47 D 4.4679 7.8608 117.3130 57.7276 40.7257 179.0062 48 E 4.0324 8.2105 117.6680 58.9285 29.6405 178.0481 49 Y 4.4450 8.2887 115.0169 56.4350 38.2082 175.0300 50 Q 4.0620 7.1703 121.9469 58.1351 29.4408 175.7201 51 G 4.1220 9.3964 115.0354 45.8085 0.0000 174.7616 52 K 4.4379 7.9628 119.2347 55.0910 33.1356 179.5400 53 L 5.0086 7.6486 117.0750 54.2618 45.4985 175.0910 54 T 4.6713 8.7616 121.1673 61.7798 71.5240 173.2674 55 V 4.8499 8.2995 125.0791 61.4355 34.1031 174.1728 56 A 5.2098 8.8449 127.3629 50.5029 23.1212 175.0098 57 K 5.0168 8.9239 119.5153 54.3997 36.1756 175.1350 58 L 4.7769 8.7504 125.9191 53.0807 44.7831 174.7372 59 N 4.0598 8.5509 126.3812 52.8890 39.3708 175.4971 60 I 4.0422 8.2070 120.7773 63.3641 37.9835 177.4922 61 D 4.5088 8.1170 122.5415 57.5542 40.8921 177.7217 62 Q 4.2024 8.1659 115.9162 57.9837 29.0901 176.6018 63 N 5.0811 7.5318 114.8487 51.1386 39.3038 172.3772 64 P 4.5864 0.0000 0.0000 63.6435 32.6658 178.9398 65 G 3.6947 8.8806 109.3662 49.1553 0.0000 175.5791 66 T 3.8856 8.3458 117.1537 66.2852 68.9687 176.5184 67 A 3.7193 8.3975 124.0088 54.8754 18.5733 177.7118 68 P 4.1900 0.0000 0.0000 65.6284 31.4694 178.8087 69 K 3.8149 7.6427 115.9388 58.5998 31.8507 177.0034 70 Y 4.4977 7.9168 115.3965 56.6502 38.6746 175.9810 71 G 4.0311 7.9616 107.4547 46.3846 0.0000 174.2837 72 I 3.8528 7.0376 117.7502 60.9469 37.4948 176.4566 73 R 4.3806 8.5752 124.1437 57.1092 31.3253 175.9440 74 S 4.7865 7.6173 109.8552 56.7220 66.2431 172.5656 75 I 4.8036 7.9090 112.7675 58.1396 40.4147 173.2941 76 P 5.1188 0.0000 0.0000 62.6673 33.2052 174.9437 77 T 5.0854 8.4920 116.4890 61.9040 72.6365 172.5647 78 L 5.3118 9.0818 126.3842 53.0952 44.1756 175.2582 79 L 5.0156 9.0327 124.1512 52.8369 44.6170 175.1625 80 L 4.9879 8.9844 126.6416 53.8405 43.6042 174.9095 81 F 5.1883 9.5560 126.2163 56.0937 41.3271 175.2090 82 K 4.7377 8.7544 122.0664 55.1512 35.6795 176.3834 83 N 3.9632 10.1329 122.6574 54.3982 36.2178 175.2864 84 G 4.0908 8.7321 103.4622 45.5031 0.0000 173.6167 85 E 4.8992 8.0576 118.7593 53.9103 32.6949 175.5162 86 V 3.6142 8.3752 121.6938 62.9264 32.1211 175.3881 87 A 4.5385 8.8647 129.0983 53.7211 20.3179 176.8610 88 A 4.7386 7.4361 114.1544 51.3141 22.5475 175.5191 89 T 5.2644 8.5748 108.9827 59.9561 72.7553 173.1727 90 K 4.3620 8.9025 123.1407 54.8676 35.5894 174.7697 91 V 4.4444 8.5670 127.5546 62.5448 32.7897 176.5409 92 G 3.9456 9.1254 113.1403 44.8779 0.0000 172.7468 93 A 4.1811 8.0013 121.4586 52.1424 18.9206 176.5673 94 L 4.5029 7.7152 118.8031 53.5096 43.2648 175.5795 95 S 4.4776 8.8307 115.4199 57.1332 65.2949 175.1454 96 K 3.9349 8.5552 122.2547 59.7050 31.8253 178.5466 97 G 3.7133 8.1131 105.2500 48.1819 0.0000 175.4018 98 Q 4.2159 8.1271 120.8221 58.4745 28.6959 178.6561 99 L 3.9937 8.1625 121.4823 58.0077 42.0174 179.1138 100 K 4.0339 8.3455 118.6218 59.5384 32.0137 179.0262 101 E 3.9926 8.2355 118.7747 59.5323 29.2089 179.2064 102 F 4.1600 8.3491 119.5751 61.2696 39.7181 176.8732 103 L 3.9486 8.0893 118.6041 57.7501 41.1725 179.0312 104 D 4.4417 8.5075 118.8988 57.3208 40.4990 178.7015 105 A 3.8896 7.8540 120.2312 53.9622 18.4233 178.1510 106 N 4.7906 7.7907 111.8700 52.6997 40.2347 174.5643 107 L 4.3063 7.3208 125.3510 54.7308 42.0587 176.1018 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 2 D 8.36 4.59 0.00 2.64 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 3 K 7.81 4.31 0.00 1.82 1.78 0.00 2.03 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.52 7.81 4 I 8.38 4.22 1.84 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.43 0.87 0.00 0.00 5 I 8.52 3.90 1.83 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 1.09 0.85 0.88 0.00 0.00 6 H 8.82 4.94 0.00 3.19 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.50 4.73 0.00 1.66 1.67 0.93 0.75 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 8 T 8.85 4.92 4.33 0.00 0.00 0.00 0.00 0.00 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 9 D 8.59 4.49 0.00 2.73 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 10 D 8.09 4.60 0.00 2.68 2.75 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 0.00 0.00 0.00 11 S 8.16 4.48 0.00 4.25 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 12 F 8.12 3.92 0.00 3.35 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 13 D 8.37 4.45 0.00 2.72 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 14 T 7.71 4.13 4.22 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 1.21 0.00 0.00 15 D 8.22 4.37 0.00 2.59 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 7.61 3.74 0.67 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 -0.25 0.00 0.00 0.01 0.00 0.00 17 L 7.37 3.92 0.00 1.81 1.74 1.11 0.97 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 18 K 7.83 4.32 0.00 1.71 1.80 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.35 7.81 19 A 7.28 4.26 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 8.43 4.65 0.00 2.66 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 21 G 8.69 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 0.00 0.00 0.00 22 A 8.24 4.42 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 23 I 8.94 5.00 1.89 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.86 0.87 0.00 0.00 24 L 8.74 4.88 0.00 1.80 1.53 1.06 0.47 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 25 V 9.04 4.79 2.36 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 0.70 0.00 0.00 0.95 0.00 0.00 26 D 9.04 5.15 0.00 2.72 2.48 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 27 F 9.53 5.08 0.00 3.13 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 28 W 8.70 5.45 0.00 3.39 3.37 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 29 A 8.15 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.45 4.08 0.00 1.97 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 2.47 2.38 0.00 31 W 7.21 4.57 0.00 3.56 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 32 C 7.90 4.80 0.00 2.46 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 33 G 8.66 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 34 P 0.00 4.32 0.00 2.04 2.14 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 35 C 8.13 4.44 0.00 3.25 3.25 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 36 K 7.92 3.81 0.00 1.97 1.84 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.67 7.81 37 M 7.90 4.02 0.00 1.98 2.28 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.82 0.00 38 I 7.45 4.14 1.80 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 1.53 0.78 0.92 0.00 0.00 39 A 7.39 3.78 1.12 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 40 P 0.00 4.69 0.00 2.13 2.06 0.00 3.88 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 2.06 1.96 0.00 41 I 7.51 3.72 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.63 0.88 0.00 0.00 42 L 7.57 3.93 0.00 1.71 1.62 0.78 0.85 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 43 D 7.96 4.32 0.00 2.77 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 44 E 7.91 3.99 0.00 2.14 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 2.34 0.00 45 I 8.09 3.84 1.88 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 1.64 0.90 0.68 0.00 0.00 46 A 7.95 4.01 1.37 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 47 D 7.86 4.47 0.00 2.80 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 48 E 8.21 4.03 0.00 2.20 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 2.36 2.51 0.00 49 Y 8.29 4.45 0.00 3.12 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 50 Q 7.17 4.06 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.46 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 51 G 9.40 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 52 K 7.96 4.44 0.00 1.77 1.72 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.71 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.31 1.22 7.81 53 L 7.65 5.01 0.00 1.65 1.62 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.76 4.67 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 1.18 0.00 0.00 55 V 8.30 4.85 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 0.93 0.00 0.00 0.89 0.00 0.00 56 A 8.84 5.21 1.12 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 57 K 8.92 5.02 0.00 1.75 1.85 0.00 1.40 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.16 1.24 7.81 58 L 8.75 4.78 0.00 1.51 1.00 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 59 N 8.55 4.06 0.00 2.25 2.41 0.00 0.00 6.93 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 60 I 8.21 4.04 1.90 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 1.23 0.68 1.02 0.00 0.00 61 D 8.12 4.51 0.00 2.78 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 62 Q 8.17 4.20 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 7.17 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 63 N 7.53 5.08 0.00 2.70 2.90 0.00 0.00 7.00 8.60 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 64 P 0.00 4.59 0.00 2.18 2.17 0.00 3.90 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 65 G 8.88 3.69 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 0.00 0.00 0.00 66 T 8.35 3.89 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 0.44 0.00 0.00 67 A 8.40 3.72 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 68 P 0.00 4.19 0.00 2.14 2.08 0.00 3.68 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 2.09 2.09 0.00 69 K 7.64 3.81 0.00 1.48 1.40 0.00 1.57 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.47 7.81 70 Y 7.92 4.50 0.00 2.92 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 71 G 7.96 4.03 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 0.00 0.00 0.00 72 I 7.04 3.85 1.63 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.39 0.80 0.00 0.00 73 R 8.58 4.38 0.00 1.78 1.97 0.00 3.17 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 74 S 7.62 4.79 0.00 3.95 3.83 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 75 I 7.91 4.80 1.87 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.67 0.99 0.00 0.00 76 P 0.00 5.12 0.00 2.16 2.25 0.00 3.80 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 2.05 1.83 0.00 77 T 8.49 5.09 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 1.20 0.00 0.00 78 L 9.08 5.31 0.00 1.41 1.57 0.75 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 79 L 9.03 5.02 0.00 1.84 1.23 0.93 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.98 4.99 0.00 1.83 1.52 0.99 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.56 5.19 0.00 2.89 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 82 K 8.75 4.74 0.00 1.68 1.68 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.41 7.81 83 N 10.13 3.96 0.00 2.86 2.89 0.00 0.00 7.22 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 84 G 8.73 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 0.00 0.00 0.00 85 E 8.06 4.90 0.00 2.06 1.87 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 2.28 2.40 0.00 86 V 8.38 3.61 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 0.61 0.00 0.00 0.59 0.00 0.00 87 A 8.86 4.54 1.19 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 88 A 7.44 4.74 1.18 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 0.00 0.00 89 T 8.57 5.26 4.33 0.00 0.00 0.00 0.00 0.00 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 90 K 8.90 4.36 0.00 0.79 1.05 0.00 1.38 0.00 0.00 1.39 0.00 0.00 2.66 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.04 0.94 7.81 91 V 8.57 4.44 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 0.83 0.00 0.00 0.91 0.00 0.00 92 G 9.13 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 0.00 0.00 0.00 93 A 8.00 4.18 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 94 L 7.72 4.50 0.00 1.88 1.55 0.77 0.51 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 95 S 8.83 4.48 0.00 4.07 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 96 K 8.56 3.93 0.00 1.84 1.86 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.54 1.54 7.81 97 G 8.11 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 98 Q 8.13 4.22 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 99 L 8.16 3.99 0.00 1.83 1.81 0.94 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 0.00 100 K 8.35 4.03 0.00 2.11 2.00 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.20 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.72 1.77 7.81 101 E 8.24 3.99 0.00 2.29 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 2.37 2.57 0.00 102 F 8.35 4.16 0.00 2.99 3.27 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 0.00 103 L 8.09 3.95 0.00 1.62 1.53 0.32 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 104 D 8.51 4.44 0.00 2.70 2.75 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 0.00 0.00 0.00 105 A 7.85 3.89 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 0.00 106 N 7.79 4.79 0.00 2.39 2.65 0.00 0.00 6.85 7.13 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 0.00 107 L 7.32 4.31 0.00 1.49 1.57 1.03 0.77 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