NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3156 8.1593 110.9358 60.4528 69.3898 173.4616 4 P 4.0714 0.0000 0.0000 61.5285 31.7388 174.3168 5 K 4.1102 9.2464 124.8101 55.0479 33.6988 175.9780 6 P 4.5285 0.0000 0.0000 62.5373 32.3905 176.6137 7 R 4.5534 8.4262 120.5942 55.2460 32.5318 177.8130 8 I 3.5453 8.3143 122.2571 64.1701 38.0142 178.4187 9 L 3.9332 7.7576 119.3424 57.3787 41.5585 177.6058 10 P 4.4115 0.0000 0.0000 65.1845 31.3958 178.5021 11 W 4.1455 8.3336 127.0213 60.3491 30.6926 177.8677 12 L 3.5673 8.6155 120.8255 58.0285 41.4928 179.0970 13 V 3.5521 7.9088 118.2470 65.9504 31.3839 177.9652 14 S 4.0694 8.0100 112.9958 61.4604 62.1380 176.1730 15 Q 3.6483 7.4137 120.6061 58.7033 28.0658 178.7894 16 L 3.5020 7.2245 119.0978 57.6572 41.5022 179.0291 17 D 4.7897 8.1537 117.9129 57.4746 40.8915 178.5303 18 L 4.1189 8.1210 118.9463 55.4569 42.3795 177.5612 19 G 3.8252 8.0785 105.8172 46.6116 0.0000 174.1293 20 Q 4.0284 7.8966 119.4087 57.2604 29.9779 175.1081 21 L 4.5435 7.3440 118.1581 52.7996 43.8020 175.3943 22 E 3.9669 8.5377 123.9319 57.3518 29.7314 177.1408 23 G 3.7942 8.7022 113.7234 47.2810 0.0000 174.3489 24 V 4.3441 7.8644 112.0593 61.4062 33.7326 176.6108 25 A 3.8743 7.8293 119.9466 51.8727 18.5382 177.1388 26 W 4.6997 8.5151 121.6904 57.4546 29.9399 176.7567 27 V 4.0702 8.6715 112.8036 63.6102 31.9360 176.9212 28 N 4.7155 7.9712 118.0742 52.5218 39.6995 175.9256 29 K 4.0090 8.6039 124.6064 59.3724 32.3434 178.4461 30 S 4.0371 8.3094 112.0533 58.8857 62.9052 174.3564 31 R 3.6315 7.3657 119.1363 57.7670 27.5382 176.4134 32 T 4.6009 7.8371 110.4862 62.6073 68.6330 173.7301 33 R 5.3920 8.1627 118.2963 56.0840 35.0061 173.7280 34 F 5.4346 8.1326 116.0756 55.9576 42.0109 172.7979 35 R 5.6778 8.4197 117.5036 53.8997 32.9052 175.4555 36 I 4.7255 8.3648 122.1197 58.2266 41.0262 176.0052 37 P 4.4282 0.0000 0.0000 61.7071 30.6674 176.7907 38 W 4.2612 9.9277 129.5871 57.7347 30.6228 175.6595 39 K 4.6845 7.7700 129.4205 56.4782 31.6281 176.9796 40 H 4.9983 8.7701 114.5891 54.4011 32.7663 172.4572 41 G 4.1069 8.8769 111.3850 46.8947 0.0000 174.6359 42 L 4.5728 8.1770 117.4676 55.0387 42.6942 176.9853 43 R 4.7891 7.3927 127.0348 56.1068 28.2241 176.4586 44 Q 4.4784 8.2915 122.9769 57.8183 31.5418 174.4549 45 D 4.6478 8.1859 120.2439 53.8800 40.4841 176.8557 46 A 4.5268 8.0356 123.4837 53.1352 18.8447 177.2901 47 Q 4.3277 8.4978 125.1196 55.4729 30.8382 176.2157 48 Q 4.4862 8.8235 120.9651 57.5141 29.4079 176.1187 49 E 4.2591 8.1446 119.6013 58.2538 30.1951 176.2545 50 D 4.7510 8.2472 115.5326 54.7045 41.5384 176.2084 51 F 4.7670 7.8976 116.2042 56.5599 40.5430 177.7978 52 G 3.5497 8.1959 109.4442 48.0472 0.0000 175.8728 53 I 3.6556 7.0067 121.8489 63.9084 37.2301 178.3744 54 F 4.1833 6.8890 118.1440 60.6300 38.7193 177.3804 55 Q 2.9506 8.5828 119.3643 58.6653 28.7490 177.9871 56 A 4.0541 8.3327 122.3641 54.9330 18.4281 179.4474 57 W 3.4849 8.6845 126.9675 60.2981 30.8137 178.1458 58 A 3.5833 7.5828 120.3261 55.0327 17.7477 179.5276 59 E 4.5911 8.4409 118.5481 59.0016 29.2682 179.4126 60 A 3.8325 7.7256 120.6200 54.7456 18.4998 178.8065 61 T 3.7683 7.1789 106.2708 61.0775 68.8846 176.9597 62 G 3.8024 7.4924 108.7389 45.8834 0.0000 174.8516 63 A 4.0839 7.2939 122.3423 54.8122 18.7793 177.3647 64 Y 4.9625 8.0408 114.9812 55.8851 42.1727 174.0548 65 V 4.1013 7.2753 123.9984 60.1223 34.3677 175.7050 66 P 5.2152 0.0000 0.0000 62.0972 30.2649 177.0739 67 G 4.0902 8.6659 105.1506 46.0646 0.0000 172.9786 68 R 4.2607 7.2883 124.1528 56.3967 36.6686 174.0451 69 D 4.4243 8.2365 118.5494 54.7409 41.5441 177.1913 70 K 4.2318 8.8620 123.2540 55.5676 31.8411 174.2564 71 P 3.2244 0.0000 0.0000 61.9545 30.9232 176.2796 72 D 4.1602 6.7076 123.0701 51.5345 42.0815 175.7667 73 L 3.4630 7.1974 127.1931 56.7552 41.3356 177.3636 74 P 4.2083 0.0000 0.0000 65.8568 31.3681 178.8210 75 T 3.9797 8.8107 115.1818 66.3155 68.4402 176.8879 76 W 4.5544 7.7798 120.9919 59.7490 29.0544 178.4811 77 K 3.2422 7.9454 119.7691 59.1460 31.3876 179.1882 78 R 3.9792 7.6060 117.2015 59.3756 30.0429 178.8207 79 N 4.4869 8.3159 116.2571 56.3243 38.7320 177.3521 80 F 4.0094 8.4060 121.8389 61.0806 39.1218 177.2342 81 R 4.3889 8.2993 118.6121 59.5717 29.9988 178.4844 82 S 4.1765 8.0520 112.8492 61.2809 62.1736 175.9659 83 A 3.9437 7.3165 121.1127 55.1760 18.1762 179.3551 84 L 3.8516 7.2975 116.3981 57.6931 41.3695 179.1747 85 N 4.4375 7.6191 115.1631 56.6919 38.9734 176.1710 86 R 4.0799 7.4326 117.0508 57.7319 30.5980 176.8553 87 K 4.0400 7.4551 117.1865 56.0606 32.1554 176.4169 88 E 4.0539 9.1148 123.1328 59.4220 29.7812 178.9886 89 G 4.0331 7.6399 107.4834 42.6384 0.0000 174.6590 90 L 4.4827 7.3377 119.3955 54.3575 44.4637 174.5417 91 R 4.7834 8.2629 123.9139 54.0460 33.0748 174.7371 92 L 3.5844 8.3969 122.8940 54.7466 41.8769 175.5504 93 A 3.9797 8.6578 131.3900 52.7584 17.8171 176.7540 94 E 4.4859 8.0622 111.4219 53.2414 34.6022 175.3660 95 D 4.6679 7.9274 121.8206 52.7423 39.8407 176.6225 96 R 4.0552 7.4273 116.3171 56.5511 30.7901 179.0564 97 S 4.5480 8.0300 114.1166 59.4517 62.5625 174.1684 98 K 4.4796 7.7236 118.6782 57.5721 32.1860 176.1586 99 D 5.0568 7.8163 117.3268 51.4924 45.1516 172.7126 100 P 4.3194 0.0000 0.0000 65.2165 30.4959 178.1232 101 H 4.2120 9.6656 121.7898 58.9097 29.7840 175.6997 102 D 4.8853 7.3105 116.9231 51.7852 39.8159 172.8761 103 P 5.0193 0.0000 0.0000 61.6395 33.7140 176.4870 104 H 5.1113 8.2335 114.2871 56.9214 34.2236 172.6196 105 K 4.5203 8.3272 114.6159 55.9213 36.9833 175.0599 106 I 5.1879 8.0799 123.9813 59.2492 39.5399 174.9234 107 Y 4.4614 7.8558 124.7952 56.5430 40.1315 174.1173 108 E 4.9238 9.0835 121.2380 54.1938 33.0434 175.3779 109 F 4.9365 8.5437 126.5132 58.2386 40.0211 176.1840 110 V 3.9549 8.0046 110.3696 61.2132 32.3061 174.4984 111 N 4.5112 8.1741 118.3758 54.3364 41.3387 175.0201 112 S 4.2532 8.5066 117.9217 58.4450 63.4412 174.9533 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 T 8.16 4.32 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 1.19 0.00 0.00 4 P 0.00 4.07 0.00 2.29 2.11 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 5 K 9.25 4.11 0.00 1.69 1.73 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.78 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.30 7.81 6 P 0.00 4.53 0.00 2.05 2.16 0.00 3.54 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 7 R 8.43 4.55 0.00 1.99 1.91 0.00 3.25 0.00 0.00 3.32 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 8 I 8.31 3.55 1.07 0.00 0.00 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.21 0.59 0.00 0.00 9 L 7.76 3.93 0.00 1.73 1.67 0.81 0.89 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 10 P 0.00 4.41 0.00 2.29 2.20 0.00 3.82 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.23 0.00 11 W 8.33 4.15 0.00 3.67 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 12 L 8.62 3.57 0.00 2.06 1.52 0.64 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.91 3.55 2.41 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 1.56 0.00 0.00 1.42 0.00 0.00 14 S 8.01 4.07 0.00 4.00 3.80 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 15 Q 7.41 3.65 0.00 1.67 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 1.21 1.16 0.00 16 L 7.22 3.50 0.00 0.94 0.13 -0.98 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.15 4.79 0.00 2.86 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 18 L 8.12 4.12 0.00 1.64 1.66 0.90 1.26 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 19 G 8.08 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 0.00 0.00 0.00 20 Q 7.90 4.03 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 21 L 7.34 4.54 0.00 1.51 1.39 0.71 0.83 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 22 E 8.54 3.97 0.00 1.97 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 2.30 2.29 0.00 23 G 8.70 3.79 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 0.00 0.00 0.00 24 V 7.86 4.34 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 1.00 0.00 0.00 0.81 0.00 0.00 25 A 7.83 3.87 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 W 8.52 4.70 0.00 3.47 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 27 V 8.67 4.07 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 0.74 0.00 0.00 1.08 0.00 0.00 28 N 7.97 4.72 0.00 2.76 2.71 0.00 0.00 7.15 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 29 K 8.60 4.01 0.00 1.74 1.80 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.36 7.81 30 S 8.31 4.04 0.00 3.86 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 31 R 7.37 3.63 0.00 1.10 0.66 0.00 2.21 0.00 0.00 2.44 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 32 T 7.84 4.60 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 1.27 0.00 0.00 33 R 8.16 5.39 0.00 1.84 1.76 0.00 3.46 0.00 0.00 3.35 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.58 0.00 34 F 8.13 5.43 0.00 2.92 3.23 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 35 R 8.42 5.68 0.00 1.71 1.93 0.00 3.07 0.00 0.00 3.08 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.52 0.00 36 I 8.36 4.73 2.47 0.00 0.00 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 1.62 1.71 0.97 0.00 0.00 37 P 0.00 4.43 0.00 1.74 1.97 0.00 3.44 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.10 0.00 38 W 9.93 4.26 0.00 3.71 3.08 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 39 K 7.77 4.68 0.00 1.71 1.02 0.00 1.84 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.44 7.81 40 H 8.77 5.00 0.00 3.18 3.13 0.00 5.77 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.88 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 0.00 0.00 0.00 42 L 8.18 4.57 0.00 1.65 1.71 0.97 0.93 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 43 R 7.39 4.79 0.00 1.87 1.25 0.00 3.17 0.00 0.00 3.29 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 44 Q 8.29 4.48 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.78 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 45 D 8.19 4.65 0.00 2.81 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 46 A 8.04 4.53 1.55 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 47 Q 8.50 4.33 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 48 Q 8.82 4.49 0.00 2.67 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.99 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 49 E 8.14 4.26 0.00 1.99 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 2.27 2.34 0.00 50 D 8.25 4.75 0.00 2.97 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 51 F 7.90 4.77 0.00 3.20 3.40 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 52 G 8.20 3.55 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 0.00 53 I 7.01 3.66 0.89 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.19 0.64 0.00 0.00 54 F 6.89 4.18 0.00 3.35 3.07 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 0.00 55 Q 8.58 2.95 0.00 2.28 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.13 1.60 0.00 56 A 8.33 4.05 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 0.00 0.00 0.00 0.00 0.00 57 W 8.68 3.48 0.00 3.50 3.36 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 58 A 7.58 3.58 0.53 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 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.44 4.59 0.00 2.04 1.85 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 2.11 2.35 0.00 60 A 7.73 3.83 0.73 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 0.00 0.00 61 T 7.18 3.77 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 -0.65 0.00 0.00 62 G 7.49 3.80 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 0.00 0.00 0.00 63 A 7.29 4.08 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 64 Y 8.04 4.96 0.00 3.29 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 65 V 7.28 4.10 1.85 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 0.77 0.00 0.00 0.74 0.00 0.00 66 P 0.00 5.22 0.00 2.23 2.31 0.00 3.04 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.07 0.00 67 G 8.67 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 68 R 7.29 4.26 0.00 1.69 1.75 0.00 3.44 0.00 0.00 3.25 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.48 0.00 69 D 8.24 4.42 0.00 3.28 2.96 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 0.00 0.00 0.00 70 K 8.86 4.23 0.00 1.84 1.89 0.00 1.58 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.40 7.81 71 P 0.00 3.22 0.00 1.87 1.87 0.00 3.64 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.97 0.00 72 D 6.71 4.16 0.00 2.30 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 0.00 0.00 0.00 73 L 7.20 3.46 0.00 1.11 0.91 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.21 0.00 2.11 2.01 0.00 3.45 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.00 0.00 75 T 8.81 3.98 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 1.26 0.00 0.00 76 W 7.78 4.55 0.00 3.58 3.36 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 77 K 7.95 3.24 0.00 1.53 1.75 0.00 1.18 0.00 0.00 1.50 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.02 0.21 7.81 78 R 7.61 3.98 0.00 2.09 2.01 0.00 3.37 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.83 0.00 79 N 8.32 4.49 0.00 3.11 3.12 0.00 0.00 6.69 8.12 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 80 F 8.41 4.01 0.00 3.48 3.07 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 0.00 81 R 8.30 4.39 0.00 2.40 2.23 0.00 3.26 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.99 0.00 82 S 8.05 4.18 0.00 3.93 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 83 A 7.32 3.94 1.03 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 84 L 7.30 3.85 0.00 1.77 1.43 0.91 -0.11 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 85 N 7.62 4.44 0.00 2.92 3.08 0.00 0.00 7.28 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 86 R 7.43 4.08 0.00 1.95 1.96 0.00 3.39 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.74 0.00 87 K 7.46 4.04 0.00 1.73 1.71 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.39 7.81 88 E 9.11 4.05 0.00 2.08 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 2.28 2.33 0.00 89 G 7.64 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 90 L 7.34 4.48 0.00 1.50 1.63 0.92 0.76 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 91 R 8.26 4.78 0.00 2.04 1.98 0.00 2.81 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.51 0.00 92 L 8.40 3.58 0.00 1.26 1.39 -0.31 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.66 3.98 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 94 E 8.06 4.49 0.00 1.83 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 2.21 2.24 0.00 95 D 7.93 4.67 0.00 2.50 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 96 R 7.43 4.06 0.00 1.39 1.82 0.00 3.17 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.51 0.00 97 S 8.03 4.55 0.00 3.96 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 98 K 7.72 4.48 0.00 1.76 1.80 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.38 7.81 99 D 7.82 5.06 0.00 2.83 2.53 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 0.00 0.00 0.00 0.00 100 P 0.00 4.32 0.00 2.31 1.89 0.00 3.65 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.16 0.00 101 H 9.67 4.21 0.00 3.11 3.41 0.00 5.86 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 7.31 4.89 0.00 2.74 2.64 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 0.00 103 P 0.00 5.02 0.00 2.41 2.24 0.00 3.91 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 104 H 8.23 5.11 0.00 3.41 3.48 0.00 5.30 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.33 4.52 0.00 1.84 1.56 0.00 0.61 0.00 0.00 0.91 0.00 0.00 2.14 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.03 1.04 7.81 106 I 8.08 5.19 1.76 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 1.43 1.06 0.83 0.00 0.00 107 Y 7.86 4.46 0.00 2.07 2.65 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 0.00 108 E 9.08 4.92 0.00 2.00 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 2.20 2.41 0.00 109 F 8.54 4.94 0.00 3.34 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 0.00 110 V 8.00 3.95 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 0.76 0.00 0.00 0.97 0.00 0.00 111 N 8.17 4.51 0.00 2.84 2.66 0.00 0.00 6.73 7.21 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 0.00 112 S 8.51 4.25 0.00 3.60 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00