NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 E 4.1568 8.4293 120.2263 59.7695 30.8297 175.8939 4 E 3.6069 7.6555 114.9571 55.1097 29.3104 176.8200 5 K 3.9665 7.9244 120.3649 60.6924 34.1247 180.0151 6 K 4.1308 8.1046 118.8228 59.0893 32.8855 178.8627 7 R 3.7602 7.6939 120.4781 59.6039 29.7451 177.9914 8 R 3.9136 8.1744 117.2249 59.4514 29.8388 178.5986 9 A 3.9867 8.1961 119.2615 54.6828 18.6849 179.3062 10 A 4.0911 7.8267 119.6776 55.5065 18.5218 179.6942 11 T 3.7668 7.9404 107.4149 65.2512 68.6644 175.8082 12 A 4.0121 7.7038 124.3334 54.8628 18.1235 179.6922 13 R 3.9336 7.8299 115.7508 59.5674 30.0758 179.0820 14 R 3.8702 8.1104 117.1113 59.7296 30.0464 178.8783 15 Q 4.2559 8.1425 117.2690 59.3525 28.8845 177.9598 16 H 4.0898 8.7999 119.6558 59.5914 29.7032 177.1483 17 L 3.9253 8.7086 121.0236 57.6498 41.4774 179.2345 18 K 3.8386 8.8783 119.6785 59.9038 32.0723 179.3281 19 S 4.0991 8.5687 112.9733 61.0329 62.1106 175.8954 20 A 4.0110 7.7235 123.1038 54.8522 17.9991 179.4434 21 M 4.0353 8.2971 118.1542 58.3736 32.2041 178.5049 22 L 3.9427 8.2095 119.2548 58.2206 41.8639 179.3038 23 Q 3.9554 8.1479 119.1457 59.3941 28.7806 178.7157 24 L 3.9982 7.6747 120.9425 58.3181 42.1933 178.0785 25 A 3.9235 8.5985 120.9766 55.3427 18.0621 179.5369 26 V 3.5185 8.0726 116.0557 65.5518 30.7980 178.6644 27 T 3.8783 7.6321 112.0211 63.9347 67.1151 175.4744 28 E 4.3095 7.9029 120.8829 58.3708 29.8895 177.9540 29 I 3.6617 8.1924 119.5737 64.1040 38.0890 177.6564 30 E 4.1056 8.0195 118.1093 58.6884 29.4303 179.2352 31 K 3.9249 7.3977 120.4277 59.4992 32.1977 178.6191 32 E 3.8814 8.2009 119.2854 59.3888 29.4733 178.3352 33 A 3.9444 7.9514 120.1004 55.3313 18.3636 179.4185 34 A 3.8815 8.2721 117.9599 55.1956 18.3883 179.4057 35 A 3.9078 7.9510 118.1930 55.3698 18.6577 179.1977 36 K 3.8742 8.4848 118.1178 59.8823 32.2222 178.0456 37 E 3.8798 8.1360 119.1819 59.5385 29.5968 178.8472 38 V 3.6057 7.8746 118.0348 66.4485 31.4156 177.7706 39 E 4.0287 8.1446 117.9245 59.3508 29.2566 179.3139 40 K 3.9688 8.1134 119.6453 59.6382 32.2950 178.7684 41 Q 4.1978 8.0700 117.3371 58.1653 28.6957 178.0590 42 N 4.3740 7.9903 117.6970 56.1616 38.7440 176.4133 43 Y 4.0773 8.3325 121.2623 61.1226 38.7664 178.5734 44 L 4.0952 8.3239 119.1705 57.4021 41.4209 179.1991 45 A 3.9952 7.6544 120.7432 54.8047 18.3269 178.5892 46 E 4.2515 7.5689 113.6615 58.4426 30.7526 177.6688 47 H 4.3163 7.7073 114.9168 56.4461 30.1131 175.5930 48 S 4.7086 7.0446 110.1946 57.3666 64.6008 173.5115 49 P 4.4188 0.0000 0.0000 61.0559 32.2610 174.1948 50 P 4.1024 0.0000 0.0000 62.0378 30.6482 176.0293 51 L 3.9833 8.3618 125.1676 55.4253 42.4077 177.0716 52 S 4.4027 8.1786 117.9033 55.5097 63.1684 172.6032 53 L 3.9362 8.5072 126.2849 55.3616 40.4841 177.2934 54 P 4.5517 0.0000 0.0000 61.9219 32.3604 175.1903 55 G 3.6314 8.7238 109.6876 47.3360 0.0000 173.2293 56 S 4.5081 7.3492 119.5275 57.3010 70.0800 179.5764 57 M 3.1584 7.4530 110.5125 57.6954 32.3712 178.9749 58 Q 4.0662 8.8849 118.4743 58.2905 30.1857 176.1928 59 E 4.2607 8.2396 118.1690 60.0544 29.4087 179.0949 60 L 3.6844 7.9479 120.5122 56.9164 41.5719 179.8401 61 Q 3.9210 7.5875 118.0717 59.1069 28.7955 177.6146 62 E 3.8610 9.0088 121.3404 59.4304 29.5769 178.2822 63 L 3.8947 8.8621 120.9426 58.6498 42.1720 179.3386 64 S 4.1476 7.9353 114.3568 61.6430 62.8172 176.7809 65 K 3.9518 8.2522 122.3850 59.1817 31.9590 178.4274 66 K 3.8073 8.5162 120.2742 60.0305 32.0275 178.1533 67 L 3.9167 8.4848 119.2082 58.1113 41.6911 178.8393 68 H 3.9239 8.5784 117.4607 59.6861 29.8946 177.1275 69 A 4.1249 8.0894 122.1982 54.9888 18.2404 179.4757 70 K 3.9030 7.9530 118.1119 59.5035 32.1749 178.8697 71 I 3.7503 8.1102 120.6177 64.7649 37.1323 178.1275 72 D 4.4902 7.6656 117.9530 57.6043 40.5202 178.2995 73 S 4.1143 7.9406 113.7576 61.0410 62.3217 176.0349 74 V 3.6027 8.9308 121.3829 66.0738 31.3815 177.8210 75 D 4.3400 8.6813 117.8948 57.4120 41.1266 177.6807 76 E 3.9496 8.2095 119.6546 59.5265 29.4745 178.6844 77 E 3.9866 8.2168 118.3476 59.4439 29.4806 179.1734 78 R 3.8817 8.5674 119.2068 59.6200 30.0289 177.7536 79 Y 3.9277 8.4739 119.4555 60.8875 38.8614 177.4931 80 D 4.4622 8.8114 120.0788 57.9205 41.0214 179.2047 81 T 3.8044 8.1421 116.0323 66.8054 68.4412 176.0120 82 E 3.8376 8.2381 121.1867 59.5388 29.4644 179.1739 83 V 3.4272 7.6431 118.1726 65.7281 31.5858 178.2003 84 K 4.1754 8.1022 118.1264 58.6493 31.7301 179.2626 85 L 3.8724 7.8064 121.1310 58.1702 42.0980 178.4749 86 Q 3.9315 8.1248 118.3545 59.0340 28.6270 179.1124 87 K 3.8212 8.3433 120.5726 59.9739 32.1847 178.7103 88 T 3.8215 7.7951 115.5218 66.9217 68.2325 176.1911 89 N 4.2858 8.5308 117.2648 56.3515 38.8192 177.1380 90 K 4.0327 8.1296 120.7902 59.6082 32.3984 178.2082 91 E 3.9299 8.4531 120.1612 59.3866 29.4503 178.5946 92 L 4.2310 8.0762 118.8244 57.8289 40.5974 179.0201 93 E 3.9843 7.8791 119.4683 59.5009 29.6314 178.4265 94 D 4.5292 8.0535 118.4157 57.5239 40.8316 178.8077 95 L 4.0193 7.7649 118.9298 57.4446 41.3768 178.6260 96 S 4.5961 8.2188 110.7278 59.0549 62.4669 173.9655 97 Q 4.5621 7.6120 120.3568 58.4918 30.1120 177.0078 98 K 3.9109 8.0218 118.5682 58.4255 32.4451 176.8649 99 L 4.3635 7.6087 118.7569 57.4309 42.9841 176.9644 100 F 5.2784 8.7411 122.2766 60.6106 40.2960 175.2362 101 D 4.6085 8.0408 118.8733 51.2155 38.0949 175.3929 102 L 4.3772 7.1017 118.6708 56.3219 46.7751 173.7812 103 R 4.6895 8.0637 112.8830 58.7939 37.7400 173.8813 104 G 3.3754 8.6105 104.9684 43.9010 0.0000 174.9597 105 K 4.6840 8.6926 127.8736 55.6232 31.3285 176.5602 106 F 4.8429 8.1808 121.2986 54.8779 39.8138 175.9158 107 K 4.0600 8.5139 120.4003 57.1753 32.9802 177.2007 108 R 3.7808 8.4327 118.0773 56.9262 26.0780 175.0621 109 P 4.4306 0.0000 0.0000 61.5058 32.5933 176.6668 110 P 4.5952 0.0000 0.0000 65.7470 31.4888 177.7172 111 L 3.9340 8.0202 117.8503 55.5291 41.8617 176.2662 112 R 3.2668 7.1364 113.3383 56.9371 27.3458 175.8286 113 R 4.2426 8.1953 122.9657 54.8059 29.4081 175.7043 114 V 4.3514 7.9677 124.4745 59.6746 33.6441 176.2532 115 R 4.3563 8.3413 123.4256 54.6468 31.5312 175.6907 116 M 4.2002 8.2510 116.6779 55.1126 31.8340 177.1682 117 S 4.3077 8.4598 116.4938 58.2776 65.3373 175.3206 118 A 3.9596 8.4704 124.7339 55.3426 18.1945 179.6418 119 D 4.4312 8.1301 116.0227 57.1943 41.2190 178.3055 120 A 3.9133 8.0005 121.4460 55.3304 18.5282 179.0376 121 M 3.8868 8.1057 116.7139 58.8687 32.2524 178.3836 122 L 3.8739 8.2538 119.2449 57.6895 41.7127 179.4842 123 R 3.7914 7.8223 118.2003 59.5238 29.8834 178.1625 124 A 3.9436 8.3464 119.4133 55.1424 18.3238 178.8850 125 L 4.2957 7.8486 115.6524 55.9574 42.3745 178.1346 126 L 4.5851 7.9831 116.3607 51.3098 43.1050 179.2040 127 G 3.8740 8.8475 108.3129 46.1901 0.0000 174.8650 128 S 4.0769 9.1529 114.8762 61.6377 63.2712 176.3229 129 K 4.3073 7.5732 127.7088 55.0883 30.2020 175.7789 130 H 4.9178 7.8729 122.0468 53.9535 30.4828 172.5623 131 K 4.2442 7.6921 123.3346 53.4245 31.3632 174.2935 132 V 4.1624 7.1968 119.6482 61.4098 32.5731 174.8557 133 N 4.6977 8.4183 131.7278 51.3869 36.1982 175.8607 134 M 4.0131 7.7675 114.7691 57.4504 31.8469 174.5593 135 D 4.8570 8.2055 120.3986 53.4417 46.3684 174.4454 136 L 4.2251 7.9055 123.4270 54.7135 46.7677 173.0040 137 R 3.7291 7.8265 116.7424 56.0082 29.6351 176.0397 138 A 4.2691 8.2402 126.2992 51.5471 19.5378 175.5804 139 N 4.8234 8.3852 116.0620 52.0763 41.0849 173.2690 140 L 4.7270 7.9959 126.9949 53.2793 44.7659 175.4951 141 K 4.2726 7.9112 123.6511 55.3438 32.4458 175.1203 142 Q 4.6482 8.5002 121.9439 54.4273 30.5570 175.7037 143 V 3.9761 8.0694 119.8761 63.2173 31.8282 174.4764 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 3 E 8.43 4.16 0.00 1.97 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 2.21 2.25 0.00 4 E 7.66 3.61 0.00 2.35 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 0.00 2.30 2.42 0.00 5 K 7.92 3.97 0.00 1.88 1.99 0.00 1.58 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.38 7.81 6 K 8.10 4.13 0.00 1.97 2.10 0.00 1.56 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.43 7.81 7 R 7.69 3.76 0.00 1.87 2.09 0.00 3.11 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 8 R 8.17 3.91 0.00 1.93 1.98 0.00 3.23 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 1.78 0.00 9 A 8.20 3.99 1.33 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 0.00 0.00 0.00 10 A 7.83 4.09 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 11 T 7.94 3.77 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 12 A 7.70 4.01 1.33 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 0.00 0.00 0.00 13 R 7.83 3.93 0.00 2.13 2.00 0.00 3.36 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 14 R 8.11 3.87 0.00 2.04 2.02 0.00 3.13 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 1.74 1.76 0.00 15 Q 8.14 4.26 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.71 0.00 0.00 0.00 0.00 0.00 2.57 2.52 0.00 16 H 8.80 4.09 0.00 3.27 3.53 0.00 5.78 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 17 L 8.71 3.93 0.00 1.88 1.69 0.93 0.64 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 18 K 8.88 3.84 0.00 1.82 1.87 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.69 7.81 19 S 8.57 4.10 0.00 3.83 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 20 A 7.72 4.01 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 21 M 8.30 4.04 0.00 2.03 2.32 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.57 0.00 22 L 8.21 3.94 0.00 1.65 1.73 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.15 3.96 0.00 2.30 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 24 L 7.67 4.00 0.00 1.92 1.82 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.60 3.92 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 26 V 8.07 3.52 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 27 T 7.63 3.88 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 1.24 0.00 0.00 28 E 7.90 4.31 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 2.28 2.35 0.00 29 I 8.19 3.66 2.09 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 1.58 1.18 0.97 0.00 0.00 30 E 8.02 4.11 0.00 2.19 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 2.48 2.34 0.00 31 K 7.40 3.92 0.00 2.22 1.89 0.00 1.68 0.00 0.00 1.57 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.72 7.81 32 E 8.20 3.88 0.00 2.05 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 2.31 2.34 0.00 33 A 7.95 3.94 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 34 A 8.27 3.88 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 35 A 7.95 3.91 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 36 K 8.48 3.87 0.00 2.10 1.99 0.00 1.55 0.00 0.00 1.56 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.50 7.81 37 E 8.14 3.88 0.00 2.13 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 2.32 2.40 0.00 38 V 7.87 3.61 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 0.99 0.00 0.00 0.99 0.00 0.00 39 E 8.14 4.03 0.00 2.22 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 2.63 0.00 40 K 8.11 3.97 0.00 1.83 2.04 0.00 1.62 0.00 0.00 1.89 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.47 7.81 41 Q 8.07 4.20 0.00 2.13 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.72 0.00 0.00 0.00 0.00 0.00 2.47 2.41 0.00 42 N 7.99 4.37 0.00 3.01 2.88 0.00 0.00 6.44 6.83 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 43 Y 8.33 4.08 0.00 3.11 3.17 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 0.00 0.00 0.00 44 L 8.32 4.10 0.00 1.84 1.78 0.99 0.98 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 45 A 7.65 4.00 1.35 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 0.00 0.00 46 E 7.57 4.25 0.00 1.91 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 2.28 2.03 0.00 47 H 7.71 4.32 0.00 2.85 3.21 0.00 5.69 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 48 S 7.04 4.71 0.00 3.71 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 49 P 0.00 4.42 0.00 2.06 1.97 0.00 3.75 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.17 0.00 50 P 0.00 4.10 0.00 2.03 2.06 0.00 3.68 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 2.03 2.12 0.00 51 L 8.36 3.98 0.00 1.60 1.58 0.92 0.90 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 52 S 8.18 4.40 0.00 3.80 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 53 L 8.51 3.94 0.00 1.79 1.71 0.92 0.72 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 54 P 0.00 4.55 0.00 2.06 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 2.02 2.08 0.00 55 G 8.72 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.35 4.51 0.00 3.91 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 57 M 7.45 3.16 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.74 0.00 58 Q 8.88 4.07 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.86 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 59 E 8.24 4.26 0.00 2.23 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 0.00 2.42 2.46 0.00 60 L 7.95 3.68 0.00 1.83 1.76 0.92 0.90 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 61 Q 7.59 3.92 0.00 2.41 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.73 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 62 E 9.01 3.86 0.00 2.21 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 2.31 2.38 0.00 63 L 8.86 3.89 0.00 1.75 1.74 0.92 0.99 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 64 S 7.94 4.15 0.00 4.17 3.91 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 65 K 8.25 3.95 0.00 1.80 1.96 0.00 1.65 0.00 0.00 1.56 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.43 7.81 66 K 8.52 3.81 0.00 1.85 2.00 0.00 1.59 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.55 7.81 67 L 8.48 3.92 0.00 1.84 1.69 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 68 H 8.58 3.92 0.00 3.29 3.52 0.00 5.58 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 69 A 8.09 4.12 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 70 K 7.95 3.90 0.00 2.00 1.94 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 71 I 8.11 3.75 2.01 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 1.51 0.60 0.87 0.00 0.00 72 D 7.67 4.49 0.00 2.89 2.70 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 73 S 7.94 4.11 0.00 3.93 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 74 V 8.93 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 0.97 0.00 0.00 1.01 0.00 0.00 75 D 8.68 4.34 0.00 2.90 2.77 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 76 E 8.21 3.95 0.00 2.24 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 0.00 2.34 2.32 0.00 77 E 8.22 3.99 0.00 2.27 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 2.36 2.53 0.00 78 R 8.57 3.88 0.00 1.99 2.17 0.00 3.12 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 79 Y 8.47 3.93 0.00 3.09 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 80 D 8.81 4.46 0.00 2.86 2.77 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 81 T 8.14 3.80 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 1.18 0.00 0.00 82 E 8.24 3.84 0.00 1.92 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 2.08 2.21 0.00 83 V 7.64 3.43 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 0.92 0.00 0.00 0.39 0.00 0.00 84 K 8.10 4.18 0.00 1.96 1.82 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.42 7.81 85 L 7.81 3.87 0.00 1.84 1.69 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 8.12 3.93 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.53 0.00 0.00 0.00 0.00 0.00 2.33 2.60 0.00 87 K 8.34 3.82 0.00 1.90 1.96 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.49 7.81 88 T 7.80 3.82 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 1.20 0.00 0.00 89 N 8.53 4.29 0.00 2.75 2.89 0.00 0.00 7.10 8.19 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 90 K 8.13 4.03 0.00 2.01 2.06 0.00 1.54 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 91 E 8.45 3.93 0.00 2.04 2.09 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 2.31 2.34 0.00 92 L 8.08 4.23 0.00 1.99 1.91 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 93 E 7.88 3.98 0.00 2.16 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 2.35 2.59 0.00 94 D 8.05 4.53 0.00 2.86 2.73 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 95 L 7.76 4.02 0.00 1.84 1.70 0.91 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 96 S 8.22 4.60 0.00 4.10 4.11 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 0.00 0.00 0.00 97 Q 7.61 4.56 0.00 2.32 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 98 K 8.02 3.91 0.00 1.79 1.83 0.00 1.82 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.47 7.81 99 L 7.61 4.36 0.00 1.61 1.15 0.70 -0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.74 5.28 0.00 3.41 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 0.00 101 D 8.04 4.61 0.00 2.85 2.86 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 0.00 0.00 0.00 102 L 7.10 4.38 0.00 1.60 1.72 0.94 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 103 R 8.06 4.69 0.00 1.95 1.88 0.00 3.31 0.00 0.00 3.20 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 104 G 8.61 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 0.00 0.00 0.00 105 K 8.69 4.68 0.00 1.91 1.84 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.45 7.81 106 F 8.18 4.84 0.00 3.26 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 0.00 107 K 8.51 4.06 0.00 1.84 1.83 0.00 1.83 0.00 0.00 1.76 0.00 0.00 3.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.53 7.81 108 R 8.43 3.78 0.00 2.01 2.02 0.00 3.38 0.00 0.00 3.23 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 109 P 0.00 4.43 0.00 2.04 1.73 0.00 3.48 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.51 0.00 110 P 0.00 4.60 0.00 2.21 2.25 0.00 3.90 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.09 0.00 111 L 8.02 3.93 0.00 1.64 1.74 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 112 R 7.14 3.27 0.00 2.02 1.91 0.00 3.30 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.67 0.00 113 R 8.20 4.24 0.00 1.72 1.83 0.00 3.14 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 114 V 7.97 4.35 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 0.81 0.00 0.00 0.92 0.00 0.00 115 R 8.34 4.36 0.00 1.81 1.92 0.00 3.20 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 116 M 8.25 4.20 0.00 2.11 2.06 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 2.55 2.52 0.00 117 S 8.46 4.31 0.00 4.07 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 0.00 118 A 8.47 3.96 1.33 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 0.00 0.00 0.00 119 D 8.13 4.43 0.00 2.83 2.70 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 0.00 120 A 8.00 3.91 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 0.00 121 M 8.11 3.89 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 122 L 8.25 3.87 0.00 1.72 1.15 0.88 0.83 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 0.00 123 R 7.82 3.79 0.00 1.94 2.07 0.00 3.14 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 124 A 8.35 3.94 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 0.00 125 L 7.85 4.30 0.00 1.68 1.71 0.90 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 126 L 7.98 4.59 0.00 1.60 1.75 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.85 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 0.00 128 S 9.15 4.08 0.00 3.99 3.98 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 0.00 129 K 7.57 4.31 0.00 1.73 1.80 0.00 1.64 0.00 0.00 1.64 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.50 7.81 130 H 7.87 4.92 0.00 3.04 3.15 0.00 5.94 0.00 0.00 0.00 0.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 K 7.69 4.24 0.00 1.71 1.67 0.00 1.85 0.00 0.00 1.61 0.00 0.00 2.68 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.32 7.81 132 V 7.20 4.16 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 0.81 0.00 0.00 0.93 0.00 0.00 133 N 8.42 4.70 0.00 2.86 2.86 0.00 0.00 6.26 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 0.00 134 M 7.77 4.01 0.00 2.15 2.16 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 2.87 0.00 135 D 8.21 4.86 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 0.00 136 L 7.91 4.23 0.00 1.56 1.64 0.92 0.90 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 0.00 137 R 7.83 3.73 0.00 1.88 1.95 0.00 3.38 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.80 0.00 138 A 8.24 4.27 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 0.00 139 N 8.39 4.82 0.00 2.60 2.66 0.00 0.00 6.59 7.78 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 0.00 140 L 8.00 4.73 0.00 1.57 1.48 0.92 0.69 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 0.00 141 K 7.91 4.27 0.00 1.78 1.71 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.45 1.55 7.81 142 Q 8.50 4.65 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 143 V 8.07 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 0.80 0.00 0.00 0.93 0.00 0.00