NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4108 8.3044 120.3244 54.5825 33.4247 174.6354 2 K 3.9120 8.3444 122.3837 56.0185 32.9032 175.5235 3 K 3.9786 9.5507 127.5886 59.3607 33.1576 176.0195 4 H 4.8381 7.8143 112.2918 54.3112 31.6672 173.6885 5 G 3.8872 8.5531 107.7806 44.5748 0.0000 172.8640 6 I 3.8003 7.8935 118.1967 60.8434 38.4444 175.7491 7 L 4.0606 8.4497 128.4322 57.7129 42.4576 177.6353 8 N 4.4140 8.0729 117.9673 53.2576 40.0411 175.3299 9 S 4.0873 8.6209 123.4791 61.9914 63.0687 176.2714 10 H 4.2669 7.9870 119.4381 58.5200 28.4576 177.6868 11 L 4.0162 8.7537 121.0064 57.5756 41.4293 179.1207 12 A 4.0094 8.3164 121.1524 55.4621 18.0660 179.9048 13 K 3.9622 7.7454 115.0171 59.4861 32.1815 179.5291 14 I 3.8921 7.4702 120.2658 64.4739 37.2416 178.4747 15 L 3.9931 8.3224 119.9592 57.6847 41.1639 179.2942 16 A 4.0426 7.9943 120.0727 55.0814 18.3757 178.6700 17 D 4.6096 7.6537 114.8984 53.9539 41.5678 177.1664 18 L 4.0424 7.1360 119.7334 55.3068 42.2643 176.7891 19 G 4.1640 9.3198 111.6994 43.0210 0.0000 171.6618 20 H 4.4578 8.5398 119.1942 58.1726 29.7856 175.2749 21 T 3.5450 8.8753 117.4655 61.1513 68.4447 171.9323 22 D 4.6096 7.9719 122.4478 54.5753 42.2934 175.4339 23 K 5.2360 8.5856 119.8023 54.6236 36.0842 175.1364 24 I 4.9932 8.5147 116.1371 59.1033 41.5091 174.1884 25 V 4.9476 8.4550 121.5686 61.1811 35.1826 174.0764 26 I 5.0391 8.8841 126.7364 59.5858 39.9583 174.5219 27 A 5.2922 9.4832 128.5778 49.8588 22.6962 175.1893 28 D 4.9633 8.1361 119.2993 52.5069 41.3762 176.7617 29 A 4.3215 9.2058 119.6458 53.3840 18.0160 178.5015 30 G 3.8200 8.9151 103.3052 44.4858 0.0000 173.6522 31 L 4.0544 7.4882 122.0091 54.1126 42.5469 174.7971 32 P 4.3969 0.0000 0.0000 62.4783 32.1730 175.5504 33 V 4.2108 8.0415 120.8303 60.3881 32.8641 173.9298 34 P 4.4187 0.0000 0.0000 62.3239 31.9232 175.4934 35 D 4.5142 8.3505 121.0394 55.9168 41.1615 177.2549 36 G 3.9046 9.0036 111.9818 45.0624 0.0000 173.1734 37 V 4.0554 7.0788 119.4468 60.8921 32.4501 175.2122 38 L 4.0598 8.4818 129.5697 55.3828 43.2071 175.1680 39 K 4.9087 8.6522 126.9755 54.8824 34.2810 175.3048 40 I 4.2535 8.6437 129.4740 59.6959 38.6398 174.1580 41 D 4.8078 8.5402 127.5651 53.4343 40.9682 175.7444 42 L 4.5699 8.8539 126.9748 55.2980 42.6584 177.7156 43 S 4.3077 7.9354 113.3782 58.7652 63.2918 173.8885 44 L 4.5300 8.5850 123.5322 56.1556 44.0896 176.1665 45 K 4.2850 7.4757 114.4098 55.1027 34.6159 172.2432 46 P 3.6431 0.0000 0.0000 64.2648 31.2938 176.4455 47 G 4.0695 9.5134 112.1028 44.5630 0.0000 173.3110 48 L 4.9166 7.8505 119.7439 52.1083 44.7813 174.8385 49 P 4.8738 0.0000 0.0000 62.1208 33.3555 175.4148 50 A 4.5853 8.4178 122.4013 51.7588 19.4977 178.3268 51 F 4.1275 9.8185 123.2896 61.6604 39.4508 178.0352 52 Q 3.1708 7.9286 116.7925 58.7787 28.5640 178.1993 53 D 4.3479 7.9065 119.2440 57.8333 40.9054 179.0007 54 T 3.8431 8.0895 115.9360 66.6429 68.5907 176.6205 55 A 4.0071 8.1689 122.7495 54.8944 18.0666 179.6786 56 A 3.9378 8.0139 118.7411 55.2525 18.8603 179.5453 57 V 3.6958 7.6516 116.6262 66.4278 31.6123 178.2062 58 L 4.0341 7.9651 118.2344 57.8463 41.1914 179.4869 59 A 4.1104 7.7039 119.5623 54.9015 18.3367 178.8647 60 E 4.0698 7.9782 116.6688 57.9670 29.8665 176.9261 61 E 4.6052 7.9840 115.1923 56.0389 31.3401 175.2316 62 M 4.5960 8.0949 118.1980 53.2766 34.8324 174.7551 63 A 4.3097 8.4933 127.5621 51.5671 19.0948 175.7373 64 V 4.7145 8.3358 121.4802 62.7052 32.5009 175.3909 65 E 4.6504 9.2182 124.9918 56.5173 31.7874 175.2851 66 K 4.7772 7.5207 119.7690 55.4784 35.8896 173.9574 67 V 4.6866 8.7356 125.3288 61.0606 34.8874 174.1775 68 I 5.0382 8.5575 127.2145 59.6238 40.6406 174.4173 69 A 4.8652 8.5945 126.1937 50.2852 23.6573 174.8009 70 A 4.6777 7.9735 121.5313 51.2301 19.8650 178.5626 71 A 4.1680 9.3517 125.7376 55.5327 18.3935 179.7906 72 E 3.6427 7.9631 115.8019 58.7103 29.3390 179.0037 73 I 3.7653 8.0478 119.4883 63.5766 37.7480 177.9746 74 K 3.9468 7.8927 118.8800 59.2152 31.9814 178.8786 75 A 4.1179 7.7369 119.4444 54.6065 18.6066 178.2340 76 S 4.5562 7.5201 110.0687 58.3503 63.4758 174.5605 77 N 4.7288 7.6983 115.2470 51.6700 40.7522 174.5907 78 Q 4.0181 8.1595 121.8127 59.3176 29.9199 176.5811 79 E 4.0836 8.1607 119.8853 59.4181 29.7336 178.2993 80 N 4.5683 8.3255 115.7914 56.2073 38.4993 177.0729 81 A 4.2495 7.8782 121.6567 54.8591 18.4591 179.8283 82 K 4.0390 8.3305 117.2724 59.3387 32.1885 179.0802 83 F 4.1551 8.4846 120.5853 61.5658 39.1581 177.0757 84 L 4.1559 8.0591 118.3050 57.9211 41.2466 179.2648 85 E 4.0516 7.8875 117.1517 59.5746 29.4975 179.0743 86 N 4.4216 8.2403 115.4981 56.2288 38.7525 176.9244 87 L 3.6433 7.7860 120.5199 56.9394 43.6933 178.2791 88 F 5.0983 7.9852 119.3839 55.0592 35.9332 176.2887 89 S 4.1030 7.7294 118.1580 62.1620 63.3104 176.3745 90 E 4.3191 8.1050 115.5276 56.9787 29.6075 176.3721 91 Q 4.7577 7.6798 118.6227 53.9200 31.9024 174.4952 92 E 4.3505 8.2822 122.8766 56.2188 31.0116 175.5107 93 I 4.7575 8.4105 127.3024 59.7009 39.5382 174.1980 94 E 4.6936 8.8166 128.9147 54.5419 31.8802 174.0822 95 Y 5.3194 8.6441 123.2232 56.3700 40.6857 174.7160 96 L 5.1294 8.9724 122.4201 52.5446 46.9438 176.2145 97 S 4.5712 9.4132 115.1008 58.2656 63.8227 174.8196 98 H 4.2337 9.0924 121.4217 59.7283 29.4394 177.4930 99 E 3.9601 8.2461 119.6316 59.5999 29.2023 178.9185 100 E 3.9703 7.9853 116.9845 59.3409 29.8320 178.7938 101 F 4.2044 8.5810 120.8937 61.5507 39.3118 177.2789 102 K 3.8967 8.5697 118.1891 59.6038 31.3195 179.3473 103 L 3.9860 7.9631 119.0591 57.6466 41.4464 179.5695 104 L 4.0019 7.7748 119.4319 57.5509 41.6243 179.1749 105 T 3.8302 7.2843 109.3513 63.9024 68.2769 176.4530 106 K 4.0126 7.4466 120.1557 58.9512 32.1114 177.8510 107 D 4.5639 7.8015 116.8052 53.7406 41.5216 176.7967 108 A 4.2992 6.9268 122.7841 52.1556 18.8951 177.9124 109 K 4.2651 8.9916 120.1686 58.3856 32.8649 177.0537 110 A 4.5146 7.1416 119.9737 51.4880 22.4911 175.0941 111 V 4.6266 8.3736 119.7256 61.2129 34.5122 174.5817 112 I 4.7094 9.0872 130.0458 60.0918 38.5142 174.8573 113 R 4.6436 8.7377 129.6470 55.8735 31.1816 176.2637 114 T 4.8539 8.9864 118.2022 60.4256 71.5040 174.6546 115 G 4.1384 8.9129 106.9645 46.0904 0.0000 173.1739 116 E 4.3626 8.2027 123.1129 55.9542 30.5146 177.9263 117 F 4.9361 8.7354 128.5583 57.6663 39.7515 175.9435 118 T 4.5829 7.4385 116.4362 60.6721 71.6540 172.3345 119 P 3.9950 0.0000 0.0000 64.5999 31.6283 175.3672 120 Y 3.2884 7.9009 118.2809 58.8500 35.6411 171.5760 121 A 3.8094 7.2973 123.5550 51.2877 16.3895 176.8851 122 N 5.7495 6.9805 117.7840 51.3195 43.6031 174.4473 123 C 5.1670 9.2271 114.3249 57.6760 33.9117 172.5412 124 I 4.9792 9.0206 121.2863 59.6567 39.7731 174.5316 125 L 4.6723 8.8114 127.7075 53.2991 43.6352 175.3467 126 Q 4.7841 8.7749 126.2015 54.0170 30.4852 174.4734 127 A 4.3583 8.8069 129.5320 53.1873 19.2880 176.8075 128 G 4.3232 9.3935 111.8426 45.2706 0.0000 173.0811 129 V 4.3179 7.9645 119.9326 61.1073 34.5242 176.2475 130 L 4.4915 8.0780 123.6696 54.6093 41.9972 176.9066 131 F 4.4473 6.9988 119.6207 57.3707 37.2783 173.8409 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 8.30 4.41 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 K 8.34 3.91 0.00 1.78 1.70 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.62 1.51 7.81 3 K 9.55 3.98 0.00 1.51 1.38 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.38 7.81 4 H 7.81 4.84 0.00 3.12 3.19 0.00 5.72 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 5 G 8.55 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 6 I 7.89 3.80 1.89 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 1.31 0.87 0.97 0.00 0.00 7 L 8.45 4.06 0.00 1.63 1.68 0.92 0.97 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 8 N 8.07 4.41 0.00 2.80 2.70 0.00 0.00 6.97 7.63 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 9 S 8.62 4.09 0.00 4.03 4.05 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 0.00 0.00 0.00 10 H 7.99 4.27 0.00 3.35 3.37 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.75 4.02 0.00 1.68 1.74 0.95 0.85 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 12 A 8.32 4.01 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 13 K 7.75 3.96 0.00 1.97 1.91 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.68 7.81 14 I 7.47 3.89 2.04 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 1.77 0.96 0.92 0.00 0.00 15 L 8.32 3.99 0.00 1.68 1.74 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 16 A 7.99 4.04 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 17 D 7.65 4.61 0.00 2.64 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 18 L 7.14 4.04 0.00 1.80 1.65 0.94 0.61 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 19 G 9.32 4.16 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 0.00 20 H 8.54 4.46 0.00 3.00 3.19 0.00 5.75 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.88 3.54 4.18 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 1.00 0.00 0.00 22 D 7.97 4.61 0.00 2.72 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 23 K 8.59 5.24 0.00 1.61 1.60 0.00 1.54 0.00 0.00 1.80 0.00 0.00 2.82 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.36 1.50 7.81 24 I 8.51 4.99 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.76 0.92 0.00 0.00 25 V 8.46 4.95 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 1.15 0.00 0.00 0.87 0.00 0.00 26 I 8.88 5.04 2.04 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 1.21 0.61 1.00 0.00 0.00 27 A 9.48 5.29 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 28 D 8.14 4.96 0.00 2.89 2.84 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 0.00 0.00 0.00 29 A 9.21 4.32 1.26 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 30 G 8.92 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 0.00 0.00 0.00 31 L 7.49 4.05 0.00 1.68 1.64 1.12 1.16 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 32 P 0.00 4.40 0.00 2.22 2.03 0.00 3.84 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 2.00 1.96 0.00 33 V 8.04 4.21 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 0.86 0.00 0.00 0.94 0.00 0.00 34 P 0.00 4.42 0.00 2.19 1.93 0.00 3.63 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 35 D 8.35 4.51 0.00 2.65 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 36 G 9.00 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.08 4.06 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 0.76 0.00 0.00 0.96 0.00 0.00 38 L 8.48 4.06 0.00 1.81 1.53 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 39 K 8.65 4.91 0.00 1.78 1.66 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.44 7.81 40 I 8.64 4.25 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.54 0.96 0.00 0.00 41 D 8.54 4.81 0.00 2.70 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 42 L 8.85 4.57 0.00 1.60 1.73 0.95 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 43 S 7.94 4.31 0.00 4.06 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 44 L 8.59 4.53 0.00 1.52 1.82 0.92 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 45 K 7.48 4.29 0.00 1.84 1.81 0.00 1.55 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.27 1.29 7.81 46 P 0.00 3.64 0.00 1.55 0.49 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 1.70 1.60 0.00 47 G 9.51 4.07 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 0.00 0.00 0.00 48 L 7.85 4.92 0.00 1.55 1.53 0.90 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 49 P 0.00 4.87 0.00 2.13 2.18 0.00 3.73 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 50 A 8.42 4.59 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 51 F 9.82 4.13 0.00 3.07 3.14 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 52 Q 7.93 3.17 0.00 1.76 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.65 0.00 0.00 0.00 0.00 0.00 1.16 2.14 0.00 53 D 7.91 4.35 0.00 2.79 2.71 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 54 T 8.09 3.84 4.32 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 1.23 0.00 0.00 55 A 8.17 4.01 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 56 A 8.01 3.94 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.65 3.70 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 1.00 0.00 0.00 58 L 7.97 4.03 0.00 1.78 1.78 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.70 4.11 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 60 E 7.98 4.07 0.00 1.96 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 2.31 2.38 0.00 61 E 7.98 4.61 0.00 1.98 1.95 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 2.41 2.21 0.00 62 M 8.09 4.60 0.00 2.11 1.91 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 63 A 8.49 4.31 1.26 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 64 V 8.34 4.71 2.34 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 0.77 0.00 0.00 1.16 0.00 0.00 65 E 9.22 4.65 0.00 2.03 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 2.55 2.22 0.00 66 K 7.52 4.78 0.00 1.79 1.58 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.52 7.81 67 V 8.74 4.69 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 0.60 0.00 0.00 -0.06 0.00 0.00 68 I 8.56 5.04 1.92 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.64 1.01 0.00 0.00 69 A 8.59 4.87 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 70 A 7.97 4.68 1.21 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 0.00 0.00 0.00 71 A 9.35 4.17 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 72 E 7.96 3.64 0.00 1.16 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 1.63 2.00 0.00 73 I 8.05 3.77 1.93 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 1.54 1.38 1.09 0.00 0.00 74 K 7.89 3.95 0.00 1.63 1.73 0.00 1.39 0.00 0.00 1.41 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.27 1.20 7.81 75 A 7.74 4.12 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 76 S 7.52 4.56 0.00 4.11 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 77 N 7.70 4.73 0.00 2.86 2.82 0.00 0.00 6.80 7.15 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 78 Q 8.16 4.02 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 79 E 8.16 4.08 0.00 2.11 1.94 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 2.44 2.46 0.00 80 N 8.33 4.57 0.00 2.99 3.03 0.00 0.00 6.85 7.54 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 81 A 7.88 4.25 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 K 8.33 4.04 0.00 2.04 1.94 0.00 1.75 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.77 7.81 83 F 8.48 4.16 0.00 3.23 3.42 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 84 L 8.06 4.16 0.00 2.06 1.88 1.17 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 85 E 7.89 4.05 0.00 2.15 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 2.75 2.61 0.00 86 N 8.24 4.42 0.00 2.69 2.77 0.00 0.00 7.03 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 7.79 3.64 0.00 0.64 1.14 0.48 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 88 F 7.99 5.10 0.00 3.10 3.05 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 0.00 0.00 0.00 89 S 7.73 4.10 0.00 3.83 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 90 E 8.11 4.32 0.00 1.97 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 2.31 2.32 0.00 91 Q 7.68 4.76 0.00 2.37 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.01 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 92 E 8.28 4.35 0.00 2.17 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 0.00 2.28 2.29 0.00 93 I 8.41 4.76 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.98 0.63 0.00 0.00 94 E 8.82 4.69 0.00 2.01 1.72 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 2.22 2.29 0.00 95 Y 8.64 5.32 0.00 2.86 2.84 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 0.00 0.00 0.00 96 L 8.97 5.13 0.00 1.68 1.60 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 97 S 9.41 4.57 0.00 4.00 4.07 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 98 H 9.09 4.23 0.00 3.52 3.52 0.00 5.79 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 99 E 8.25 3.96 0.00 2.05 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 2.46 2.39 0.00 100 E 7.99 3.97 0.00 2.14 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 2.37 2.37 0.00 101 F 8.58 4.20 0.00 3.24 3.28 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 0.00 102 K 8.57 3.90 0.00 1.94 1.84 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.55 1.54 7.81 103 L 7.96 3.99 0.00 1.88 1.69 0.92 0.66 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 L 7.77 4.00 0.00 1.77 1.43 0.86 0.44 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 0.00 105 T 7.28 3.83 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 0.83 0.00 0.00 106 K 7.45 4.01 0.00 1.83 1.88 0.00 1.66 0.00 0.00 1.81 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.43 7.81 107 D 7.80 4.56 0.00 2.60 2.66 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 0.00 0.00 0.00 0.00 108 A 6.93 4.30 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 0.00 109 K 8.99 4.27 0.00 1.60 1.88 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.54 7.81 110 A 7.14 4.51 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 8.37 4.63 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 1.02 0.00 0.00 0.93 0.00 0.00 112 I 9.09 4.71 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.73 1.00 0.00 0.00 113 R 8.74 4.64 0.00 1.95 1.95 0.00 3.10 0.00 0.00 3.57 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 114 T 8.99 4.85 4.55 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 1.33 0.00 0.00 115 G 8.91 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 0.00 0.00 0.00 116 E 8.20 4.36 0.00 2.22 1.94 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 2.31 2.35 0.00 117 F 8.74 4.94 0.00 2.87 3.03 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 T 7.44 4.58 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 1.28 0.00 0.00 119 P 0.00 3.99 0.00 2.11 2.03 0.00 3.82 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 2.04 2.06 0.00 120 Y 7.90 3.29 0.00 2.99 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 0.00 121 A 7.30 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 6.98 5.75 0.00 2.19 2.86 0.00 0.00 7.04 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 0.00 123 C 9.23 5.17 0.00 3.18 3.26 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 0.00 124 I 9.02 4.98 1.89 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.88 0.85 0.00 0.00 125 L 8.81 4.67 0.00 1.58 1.55 1.00 0.45 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 0.00 126 Q 8.77 4.78 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.91 0.00 0.00 0.00 0.00 0.00 2.25 2.43 0.00 127 A 8.81 4.36 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 0.00 128 G 9.39 4.32 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 0.00 129 V 7.96 4.32 1.77 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 0.09 0.00 0.00 0.29 0.00 0.00 130 L 8.08 4.49 0.00 1.85 1.77 0.98 0.78 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 0.00 131 F 7.00 4.45 0.00 3.12 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