NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4245 8.2893 120.3524 55.3827 33.4832 175.5014 2 N 4.6076 8.4078 124.2485 51.7946 40.1875 174.3427 3 T 3.9033 9.3338 120.0240 67.2024 68.9699 177.7645 4 E 3.9719 8.0980 119.8307 59.4692 29.6453 179.1485 5 E 4.0849 7.9568 117.1551 59.1259 29.6974 179.1065 6 L 4.0068 8.0713 120.2959 57.9021 41.6576 179.4272 7 Q 4.1369 8.4308 118.2128 58.7116 28.5820 178.9254 8 V 3.6200 7.8859 119.0909 65.9352 31.6682 177.5361 9 A 3.9838 8.1395 120.3923 55.4450 18.1796 178.9795 10 A 3.8858 7.8845 118.6011 55.9418 18.3308 180.0412 11 F 4.1308 8.5808 115.6118 60.3981 38.9392 177.5586 12 E 3.9725 9.0437 119.5812 59.1972 29.2582 179.0901 13 I 3.7588 7.7495 119.7313 64.2516 37.3862 178.2424 14 I 3.5253 8.0117 120.8474 64.3411 37.0718 178.1418 15 L 3.9667 8.1082 119.8645 58.3285 41.4927 179.6223 16 N 4.3973 8.0246 115.5071 56.3168 38.3315 177.7909 17 S 4.2285 8.4788 117.0497 61.5090 62.9647 176.7076 18 G 3.7646 8.4819 108.7847 47.9501 0.0000 175.0151 19 N 4.2654 8.0859 118.9486 56.3326 38.9333 176.6470 20 A 3.9872 8.3031 122.4601 55.3269 18.6102 179.5155 21 R 3.8906 8.8981 118.4452 59.5480 30.0377 178.6770 22 S 4.3938 8.1179 113.7445 60.8451 63.3089 176.5807 23 I 4.0678 8.1502 125.6358 63.8519 36.8307 178.4505 24 V 3.4978 8.1889 119.4685 66.2030 31.2922 177.8436 25 H 4.4717 8.1779 115.8117 58.6344 28.4328 177.2873 26 E 3.9934 8.6126 120.6935 59.4941 29.2501 179.4353 27 A 3.9007 7.9376 120.4600 55.2792 18.5105 179.5082 28 F 4.2391 7.8994 116.2842 61.0684 38.9858 177.8406 29 D 4.4049 8.3233 118.1988 57.2812 40.7539 178.5970 30 A 3.9864 8.2448 121.7482 55.2811 18.3611 179.5990 31 M 3.9030 8.1817 115.6595 58.4342 30.9350 179.0311 32 R 4.2022 7.7159 119.7013 58.3279 30.3310 177.9691 33 E 4.1802 7.7136 115.1712 56.0428 29.7972 177.5961 34 K 3.3200 7.5647 117.5370 56.9101 30.8362 177.4051 35 N 4.4048 7.3433 119.2938 52.7589 35.9960 174.6211 36 Y 4.3909 7.0998 122.5709 60.3198 38.3954 177.3489 37 I 3.6610 7.7114 119.3169 64.1137 38.2167 177.5277 38 L 4.2516 8.3084 121.9796 57.4019 41.7967 178.4663 39 A 3.8788 7.9455 120.8188 55.2796 18.1725 178.9275 40 E 3.8205 8.4335 117.8783 59.7755 29.5187 179.1363 41 Q 3.9803 8.2815 118.0546 58.8765 28.6924 178.9195 42 K 3.9111 8.5288 119.7246 59.6478 32.1797 179.1873 43 L 3.6611 8.0655 119.2303 57.6770 41.3910 179.5681 44 Q 3.8664 7.7581 119.3484 58.9044 29.1176 177.0146 45 E 3.8206 8.1887 120.3115 59.5563 29.4849 178.6514 46 A 3.9522 8.6853 120.8607 55.2510 18.5293 178.8812 47 N 4.1628 8.0112 115.2088 57.1612 38.7831 176.3412 48 D 4.4160 8.1558 119.0525 57.8412 41.2698 178.8913 49 E 4.1520 8.0207 118.2091 59.1448 29.6778 178.8509 50 L 4.0010 8.2405 120.6284 58.0534 41.9778 178.8712 51 L 4.1026 7.9069 120.2806 57.7252 41.8428 178.9995 52 K 3.9292 8.1042 118.3933 59.3396 32.0758 179.0135 53 A 4.0033 7.9641 120.3950 55.4452 18.2981 178.7710 54 H 3.9596 8.6437 117.0831 59.6332 29.9389 177.0833 55 Q 3.8441 8.1884 120.9499 59.2158 28.8491 178.1625 56 A 4.0622 7.8186 121.9449 55.1320 18.3073 179.4411 57 Q 3.8741 7.9649 118.0628 59.5050 29.1373 178.5391 58 T 3.8029 8.4792 117.5841 66.6779 68.5211 176.0680 59 D 4.4061 8.5749 121.1353 57.5687 40.8270 179.1566 60 L 3.9834 7.8579 118.9649 57.8397 41.6702 179.5135 61 L 4.0197 8.1034 118.9806 58.1632 41.3813 179.7923 62 Q 4.0753 8.4867 116.8979 58.6766 29.0059 178.1672 63 E 4.0806 8.7753 120.9237 59.5417 29.8802 178.2667 64 Y 4.3804 8.5917 120.8155 60.1445 38.5724 177.8820 65 A 3.9484 8.0632 121.2797 54.5740 18.5204 178.9252 66 S 4.3358 7.5119 109.7617 59.0563 63.1730 175.3444 67 G 3.8059 7.6735 111.4075 45.5382 0.0000 174.1474 68 T 4.0875 7.4545 114.6342 61.6395 68.1594 173.0795 69 E 4.3832 8.5023 127.2266 55.8459 30.4868 176.6333 70 I 4.4083 8.3059 122.9899 59.1119 39.1911 175.0203 71 K 4.0883 8.5419 127.3305 55.8638 32.4521 176.4795 72 I 3.9909 8.3207 127.9133 61.0660 37.9112 175.7679 73 E 4.7044 8.3960 124.4833 54.4037 33.0564 176.7660 74 I 3.6694 8.2511 120.8107 64.3890 37.8328 178.1156 75 I 3.6119 7.6829 119.0865 64.0434 37.8897 177.3812 76 M 3.9254 7.9277 118.5856 58.5552 32.1508 177.8168 77 V 3.5169 7.6053 118.4432 66.5005 31.5269 177.2700 78 H 4.0715 8.5307 117.6875 59.2361 29.6329 176.7629 79 A 3.8722 8.1277 122.5783 55.5507 18.2514 179.7383 80 Q 3.9332 8.5183 116.7075 59.1545 28.7197 178.7825 81 D 4.3554 8.5333 120.5058 57.3743 40.7667 178.3143 82 H 3.8781 8.2518 119.0923 59.0387 29.8785 177.1881 83 L 4.1922 7.9627 123.5395 57.9903 41.9877 178.8269 84 M 4.1884 8.0431 118.8880 58.3294 31.9471 178.8780 85 T 3.9111 7.9000 110.1222 64.9975 68.9144 176.8596 86 T 3.8308 7.8804 118.5984 66.6272 68.4694 176.2342 87 M 4.0304 8.4470 120.9750 58.9297 31.9365 179.0330 88 T 3.8597 8.0117 115.5178 66.5440 68.6509 176.4294 89 L 3.9992 8.5733 122.5880 58.2375 42.0223 179.0483 90 R 3.8786 8.3722 119.0647 59.3185 30.0977 178.2926 91 E 3.9382 8.2671 118.4965 59.6528 29.4191 179.8450 92 V 3.7222 8.1777 112.2956 63.9547 31.5865 178.2427 93 A 3.9047 8.4601 121.1930 55.3326 18.0614 179.5702 94 I 3.5775 7.8473 118.0814 64.8060 37.2443 178.4983 95 E 4.0107 8.0785 118.9045 59.7814 29.2730 179.4767 96 M 4.1893 8.4469 118.9775 57.9890 31.7954 178.2679 97 L 3.9066 7.8772 119.9791 58.2537 42.5232 178.2952 98 E 4.0117 7.9179 118.4845 59.3937 29.3388 178.5556 99 L 3.9235 7.6923 118.7072 58.4179 42.5567 178.2955 100 Y 4.0172 8.6116 116.6116 60.2194 37.4235 177.6578 101 K 4.0854 7.3626 117.9754 56.1375 32.2111 176.9435 102 K 4.1901 7.4986 124.5788 56.5187 32.3083 176.0087 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 8.29 4.42 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.63 0.00 2 N 8.41 4.61 0.00 3.04 2.93 0.00 0.00 6.22 6.34 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 3 T 9.33 3.90 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 1.26 0.00 0.00 4 E 8.10 3.97 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 5 E 7.96 4.08 0.00 2.18 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 2.63 2.37 0.00 6 L 8.07 4.01 0.00 1.91 1.78 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.43 4.14 0.00 2.30 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.57 0.00 8 V 7.89 3.62 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 9 A 8.14 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 10 A 7.88 3.89 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 11 F 8.58 4.13 0.00 3.09 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 12 E 9.04 3.97 0.00 2.24 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 2.33 2.39 0.00 13 I 7.75 3.76 1.98 0.00 0.00 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 1.70 0.62 0.90 0.00 0.00 14 I 8.01 3.53 1.60 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.47 0.69 0.00 0.00 15 L 8.11 3.97 0.00 2.11 1.78 1.05 1.08 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 16 N 8.02 4.40 0.00 2.83 3.05 0.00 0.00 7.14 8.39 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 17 S 8.48 4.23 0.00 4.02 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 18 G 8.48 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.09 4.27 0.00 3.01 2.98 0.00 0.00 7.14 7.85 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 20 A 8.30 3.99 1.38 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 21 R 8.90 3.89 0.00 2.00 2.02 0.00 3.08 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.70 0.00 22 S 8.12 4.39 0.00 4.15 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 0.00 23 I 8.15 4.07 1.99 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 1.39 1.79 0.97 0.00 0.00 24 V 8.19 3.50 2.24 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 0.83 0.00 0.00 0.93 0.00 0.00 25 H 8.18 4.47 0.00 3.61 3.43 0.00 5.89 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.61 3.99 0.00 2.18 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 2.35 2.54 0.00 27 A 7.94 3.90 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 28 F 7.90 4.24 0.00 3.30 3.06 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 29 D 8.32 4.40 0.00 2.90 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 30 A 8.24 3.99 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 31 M 8.18 3.90 0.00 1.83 0.80 0.00 0.00 0.00 0.00 0.00 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.70 0.00 32 R 7.72 4.20 0.00 2.06 2.11 0.00 3.18 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 33 E 7.71 4.18 0.00 2.06 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 2.31 2.33 0.00 34 K 7.56 3.32 0.00 1.77 1.63 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.40 7.81 35 N 7.34 4.40 0.00 2.67 2.59 0.00 0.00 7.19 7.27 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 36 Y 7.10 4.39 0.00 3.09 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 37 I 7.71 3.66 1.89 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 1.52 1.48 0.94 0.00 0.00 38 L 8.31 4.25 0.00 1.80 1.73 0.90 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 39 A 7.95 3.88 1.45 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 0.00 0.00 0.00 40 E 8.43 3.82 0.00 2.22 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 0.00 2.30 2.35 0.00 41 Q 8.28 3.98 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 42 K 8.53 3.91 0.00 1.82 1.96 0.00 1.68 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.61 7.81 43 L 8.07 3.66 0.00 1.83 1.68 0.71 0.93 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 44 Q 7.76 3.87 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.66 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 45 E 8.19 3.82 0.00 2.17 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 0.00 2.31 2.36 0.00 46 A 8.69 3.95 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 47 N 8.01 4.16 0.00 3.01 2.97 0.00 0.00 7.25 8.49 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 48 D 8.16 4.42 0.00 2.88 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 49 E 8.02 4.15 0.00 2.06 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 2.50 2.46 0.00 50 L 8.24 4.00 0.00 1.93 1.79 0.94 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.91 4.10 0.00 2.12 1.73 0.90 0.40 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 52 K 8.10 3.93 0.00 2.13 1.86 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.25 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.52 7.81 53 A 7.96 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.64 3.96 0.00 3.33 3.34 0.00 5.79 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.19 3.84 0.00 2.35 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 56 A 7.82 4.06 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 57 Q 7.96 3.87 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.34 0.00 58 T 8.48 3.80 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 1.22 0.00 0.00 59 D 8.57 4.41 0.00 2.76 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 60 L 7.86 3.98 0.00 1.91 1.71 0.91 0.67 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 61 L 8.10 4.02 0.00 1.81 1.75 0.89 1.11 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 62 Q 8.49 4.08 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 63 E 8.78 4.08 0.00 2.23 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 2.34 2.39 0.00 64 Y 8.59 4.38 0.00 3.10 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 65 A 8.06 3.95 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 66 S 7.51 4.34 0.00 4.06 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 67 G 7.67 3.81 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 0.00 68 T 7.45 4.09 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 1.32 0.00 0.00 69 E 8.50 4.38 0.00 2.02 1.89 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 2.31 2.31 0.00 70 I 8.31 4.41 1.93 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.92 0.00 0.00 71 K 8.54 4.09 0.00 1.73 1.74 0.00 2.05 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.47 7.81 72 I 8.32 3.99 1.85 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 1.36 0.85 0.88 0.00 0.00 73 E 8.40 4.70 0.00 1.96 1.84 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 2.32 2.29 0.00 74 I 8.25 3.67 1.86 0.00 0.00 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 1.50 1.59 0.90 0.00 0.00 75 I 7.68 3.61 1.88 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.72 0.92 0.00 0.00 76 M 7.93 3.93 0.00 2.26 2.03 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 77 V 7.61 3.52 2.21 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 0.97 0.00 0.00 0.96 0.00 0.00 78 H 8.53 4.07 0.00 3.31 3.41 0.00 5.85 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 79 A 8.13 3.87 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 80 Q 8.52 3.93 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 81 D 8.53 4.36 0.00 2.75 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 82 H 8.25 3.88 0.00 3.28 3.26 0.00 5.59 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 83 L 7.96 4.19 0.00 1.80 1.63 0.98 0.75 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 84 M 8.04 4.19 0.00 2.09 2.07 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 2.60 2.78 0.00 85 T 7.90 3.91 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 1.20 0.00 0.00 86 T 7.88 3.83 4.41 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 1.26 0.00 0.00 87 M 8.45 4.03 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.61 0.00 88 T 8.01 3.86 4.39 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 1.22 0.00 0.00 89 L 8.57 4.00 0.00 1.84 1.86 1.05 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 90 R 8.37 3.88 0.00 1.85 2.05 0.00 3.11 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 91 E 8.27 3.94 0.00 2.26 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 2.49 0.00 92 V 8.18 3.72 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 0.86 0.00 0.00 1.10 0.00 0.00 93 A 8.46 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.85 3.58 2.02 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 1.48 1.10 0.89 0.00 0.00 95 E 8.08 4.01 0.00 2.16 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 2.54 2.51 0.00 96 M 8.45 4.19 0.00 2.32 2.48 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.01 2.60 0.00 97 L 7.88 3.91 0.00 1.67 1.88 0.85 0.78 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 98 E 7.92 4.01 0.00 2.14 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 2.29 2.35 0.00 99 L 7.69 3.92 0.00 1.67 1.90 0.87 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 Y 8.61 4.02 0.00 3.13 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 0.00 101 K 7.36 4.09 0.00 1.80 1.72 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.14 0.95 7.81 102 K 7.50 4.19 0.00 1.70 1.67 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.35 1.40 7.81