NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 F 4.8224 8.2829 115.7911 56.2321 39.8569 177.2020 4 K 4.0327 8.1162 128.9144 59.8831 31.3156 182.1695 5 K 4.2981 8.0659 123.2981 58.9861 32.3715 180.5982 6 V 4.3658 7.6157 116.2427 63.4640 32.4524 177.8296 7 A 4.0568 8.1482 123.9414 55.5375 18.1960 179.9722 8 K 3.9263 7.8324 121.9829 60.5221 31.7232 180.7256 9 E 4.2407 8.1607 119.2420 59.2165 29.3672 179.4737 10 T 3.8272 7.8143 115.3702 66.4896 68.4646 176.3174 11 A 3.9913 8.6560 122.9367 55.3874 18.4921 179.2390 12 I 3.6469 7.6971 118.1237 65.2852 37.1932 178.4706 13 T 3.8930 7.9700 115.8440 66.7782 68.3685 176.5386 14 L 4.0558 8.2600 121.0599 57.8901 41.7495 179.2098 15 Q 4.0016 8.4429 119.7171 59.6293 28.8961 178.9140 16 S 4.1844 8.1084 115.8326 61.5698 62.7415 176.0134 17 Y 4.1838 8.2650 122.4503 60.9070 38.5224 178.2819 18 L 3.9304 8.7125 120.0493 57.7660 41.5710 179.6287 19 T 3.8614 7.8024 115.9772 66.6147 68.3730 176.0136 20 Y 4.0222 8.1496 121.6296 60.6850 38.6977 178.1435 21 Q 3.1595 7.7749 118.8708 58.5122 28.7090 178.5195 22 A 3.8613 7.9724 121.9482 55.1762 18.3505 179.5766 23 V 3.5708 7.8912 117.1015 66.4200 31.6634 178.5011 24 R 3.8983 7.8310 115.3636 58.6454 29.2864 178.5393 25 L 3.8005 7.9793 121.5829 58.2771 42.0634 178.7938 26 I 3.6969 8.0199 120.1308 64.4027 36.7560 178.2495 27 S 4.1525 8.1259 113.3363 62.0074 62.4671 175.7832 28 Q 4.0346 8.1727 120.4909 58.9382 28.2410 179.1320 29 Q 3.3915 8.4738 120.7862 58.2188 29.3017 178.3871 30 L 4.6791 7.6951 120.0171 54.5942 43.5976 179.0676 31 S 4.0846 8.8161 119.5788 61.5281 62.3339 181.3780 32 E 4.4736 8.1536 117.2281 58.1603 30.9609 179.8439 33 T 4.0973 8.0750 110.4457 63.3577 68.8207 176.8624 34 N 4.9839 7.9615 124.1804 49.1557 39.5419 173.0570 35 P 4.4757 0.0000 0.0000 65.7469 31.2852 178.3049 36 G 3.8140 8.1790 104.8973 47.9520 0.0000 175.4547 37 Q 4.0595 8.0588 120.1256 58.3062 28.6209 178.3064 38 A 4.0625 7.6737 120.2642 55.2913 18.7868 179.4289 39 I 3.8325 7.9608 118.1451 64.3064 37.1646 178.1357 40 W 4.1873 8.2154 129.1419 60.7980 29.9733 177.4677 41 L 4.0996 9.1745 120.6153 58.4337 41.1473 179.2848 42 G 3.6876 7.9523 104.6768 47.5445 0.0000 175.3981 43 E 4.0409 7.8856 120.4435 59.1907 29.4148 179.0280 44 F 3.7480 7.8608 120.8974 61.2045 39.1090 177.2734 45 S 4.4451 7.6588 112.4175 60.9002 62.6503 176.2993 46 K 4.1132 7.3947 121.2077 59.0892 31.9860 178.9897 47 R 4.1162 7.6073 116.2322 56.9529 30.2306 176.2509 48 H 4.5590 7.2228 115.8760 53.0356 31.9850 171.2642 49 P 4.2817 0.0000 0.0000 62.5366 31.0060 176.8192 50 I 3.4441 8.1055 123.1996 61.9663 38.0122 176.6314 51 Q 4.0483 7.8701 118.3449 59.1303 28.9980 176.6819 52 E 4.4021 7.7128 120.1994 54.4184 27.8817 176.4415 53 S 4.1151 8.1256 119.2086 61.1452 63.5177 175.7803 54 D 4.4405 8.2486 122.9589 56.9911 40.6433 178.9266 55 L 4.0266 8.0270 118.5538 57.9423 41.6382 178.6023 56 Y 4.1972 8.6198 119.7846 61.0743 38.8442 178.3502 57 L 4.0481 8.8759 119.9818 57.8972 41.4910 179.5581 58 E 4.0190 8.4050 117.8954 59.1132 29.7746 178.7613 59 A 4.1733 8.1606 120.9647 55.5090 18.4451 179.4341 60 M 3.7438 8.1704 116.6252 58.6823 31.9628 178.1168 61 M 4.0776 7.7441 118.1857 58.1656 32.1626 177.9658 62 L 4.2938 7.7668 116.9895 55.8175 42.0777 177.1467 63 E 4.4587 7.8319 116.7884 57.3553 31.3762 175.6580 64 N 4.4301 8.5689 119.3706 51.3033 40.1466 174.6583 65 K 4.0646 8.4557 127.0586 59.0379 32.2555 179.0445 66 E 3.9471 8.0268 117.6952 59.3228 29.7414 178.9265 67 L 4.0479 8.0068 119.9100 57.4168 41.5960 179.7340 68 V 3.5506 7.2709 116.8868 66.0878 31.3951 178.2112 69 L 4.0256 7.8653 118.7268 57.4897 41.4102 179.2217 70 R 3.8848 8.4576 119.1887 59.5640 30.0174 178.2426 71 I 3.7135 8.2095 119.7408 64.8342 37.0600 178.4119 72 L 4.0339 7.9848 119.2621 57.8646 41.3330 179.9222 73 T 3.8578 7.6816 115.9619 66.6311 68.4663 177.1258 74 V 3.6051 7.8222 120.3867 65.9599 31.5138 178.1951 75 R 3.8825 8.1991 115.9787 59.2610 29.1684 178.5385 76 E 3.9607 7.8220 119.6490 59.0060 29.7025 178.5278 77 N 4.3335 8.0343 116.2686 56.2192 38.6408 177.3512 78 L 3.9345 8.2818 120.5676 57.5420 41.5747 179.3779 79 A 3.9454 8.1276 120.6494 55.4005 18.1525 178.9706 80 E 3.9781 8.0730 115.5888 60.7304 29.9645 179.6356 81 G 3.4473 8.2249 105.4202 46.8655 0.0000 175.2113 82 V 3.4712 7.9462 119.4125 65.3335 31.6503 178.0281 83 L 4.3235 7.9419 116.5711 56.2586 41.9604 178.0085 84 E 4.3291 7.8296 117.3363 60.1647 30.2803 178.2974 85 F 4.4307 8.2339 114.9013 58.8274 38.9767 177.5450 86 L 4.0243 7.8707 120.8033 57.5344 42.1266 176.3731 87 P 4.2939 0.0000 0.0000 66.4267 31.3004 178.5130 88 E 3.9484 8.3069 116.5219 61.7847 29.4934 180.7556 89 M 4.4069 8.2449 117.4402 57.4407 31.6955 178.8269 90 V 3.5680 8.2014 120.4132 65.6600 31.6255 177.7249 91 L 3.9127 7.7283 119.9500 58.3123 42.0726 179.2182 92 S 4.1199 8.1269 114.0071 61.3721 62.9133 176.3470 93 Q 4.0263 7.9668 121.5656 58.6773 28.2900 178.6321 94 I 3.7999 7.5735 120.7490 64.0811 37.1701 178.3773 95 K 3.8862 8.2429 119.5940 59.4472 31.8078 179.1179 96 Q 3.9029 8.1742 119.6244 59.1870 29.0403 178.0826 97 S 4.0455 8.0452 113.9920 61.6661 62.4732 175.5292 98 N 4.3876 8.9123 119.6728 56.5512 38.2100 177.6032 99 G 3.5157 8.2075 106.6680 47.9787 0.0000 175.3612 100 N 4.2834 8.3922 120.0864 56.3203 38.5560 177.3208 101 H 4.1982 8.3171 117.3372 58.8209 28.8572 178.0072 102 R 3.9319 7.9717 119.8646 59.3174 29.9161 179.0529 103 R 3.8954 8.2264 118.0127 59.6483 30.0680 178.9937 104 S 4.1278 7.9071 114.3504 61.6493 62.9557 176.5889 105 L 3.9377 7.9438 122.6442 58.4544 41.5277 179.2545 106 L 4.0946 7.9201 118.3996 57.4579 41.2287 179.4162 107 E 4.0720 8.4941 121.2560 59.9716 29.5429 179.8056 108 R 4.0946 8.2693 119.9441 60.5965 29.5316 179.8598 109 L 4.6285 7.4408 115.0799 54.5426 42.5652 176.7190 110 T 4.0606 7.0658 114.4811 61.0427 67.9269 173.8813 111 Q 4.0140 8.8099 132.3374 57.1451 29.6348 177.0484 112 V 4.0758 8.1865 121.1215 60.9876 32.7748 172.2501 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 F 8.28 4.82 0.00 3.20 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 4 K 8.12 4.03 0.00 1.87 1.86 0.00 1.80 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.13 7.81 5 K 8.07 4.30 0.00 1.85 1.77 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.36 1.07 7.81 6 V 7.62 4.37 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 0.86 0.00 0.00 0.96 0.00 0.00 7 A 8.15 4.06 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 8 K 7.83 3.93 0.00 1.74 1.88 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.40 7.81 9 E 8.16 4.24 0.00 2.01 2.03 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 2.41 2.55 0.00 10 T 7.81 3.83 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 1.20 0.00 0.00 11 A 8.66 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 12 I 7.70 3.65 2.02 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 1.76 1.26 0.93 0.00 0.00 13 T 7.97 3.89 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 1.20 0.00 0.00 14 L 8.26 4.06 0.00 1.95 1.78 0.94 0.86 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 15 Q 8.44 4.00 0.00 2.29 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 16 S 8.11 4.18 0.00 4.11 3.92 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 17 Y 8.26 4.18 0.00 3.20 3.21 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 18 L 8.71 3.93 0.00 1.71 1.70 0.96 0.81 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 19 T 7.80 3.86 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 1.27 0.00 0.00 20 Y 8.15 4.02 0.00 2.88 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 21 Q 7.77 3.16 0.00 1.95 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 1.67 2.24 0.00 22 A 7.97 3.86 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.89 3.57 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 1.27 0.00 0.00 1.19 0.00 0.00 24 R 7.83 3.90 0.00 2.03 2.01 0.00 2.82 0.00 0.00 2.75 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.49 0.00 25 L 7.98 3.80 0.00 1.66 1.84 0.88 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 26 I 8.02 3.70 2.02 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 1.39 0.70 0.92 0.00 0.00 27 S 8.13 4.15 0.00 4.10 3.94 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 28 Q 8.17 4.03 0.00 2.33 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.35 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 29 Q 8.47 3.39 0.00 2.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.70 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 30 L 7.70 4.68 0.00 1.63 1.64 0.95 0.73 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 31 S 8.82 4.08 0.00 3.56 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 32 E 8.15 4.47 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 2.15 1.85 0.00 33 T 8.07 4.10 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 34 N 7.96 4.98 0.00 2.71 2.71 0.00 0.00 6.85 8.04 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 35 P 0.00 4.48 0.00 2.28 2.34 0.00 3.72 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 2.09 2.06 0.00 36 G 8.18 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 37 Q 8.06 4.06 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 38 A 7.67 4.06 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 39 I 7.96 3.83 1.96 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 1.45 0.99 1.01 0.00 0.00 40 W 8.22 4.19 0.00 3.57 3.46 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 41 L 9.17 4.10 0.00 2.19 1.79 1.16 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 42 G 7.95 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 43 E 7.89 4.04 0.00 1.98 1.83 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 2.36 2.49 0.00 44 F 7.86 3.75 0.00 1.65 2.38 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 45 S 7.66 4.45 0.00 4.14 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 46 K 7.39 4.11 0.00 1.78 1.80 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.44 1.61 7.81 47 R 7.61 4.12 0.00 1.48 1.62 0.00 3.05 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.72 0.00 48 H 7.22 4.56 0.00 2.49 3.10 0.00 5.85 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 49 P 0.00 4.28 0.00 2.20 2.19 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.94 0.00 50 I 8.11 3.44 1.00 0.00 0.00 0.50 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 0.38 0.73 0.00 0.00 51 Q 7.87 4.05 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.06 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 52 E 7.71 4.40 0.00 2.08 1.90 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 2.29 2.38 0.00 53 S 8.13 4.12 0.00 4.14 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 54 D 8.25 4.44 0.00 2.76 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 55 L 8.03 4.03 0.00 1.94 1.80 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.62 4.20 0.00 3.17 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 57 L 8.88 4.05 0.00 1.77 1.76 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 58 E 8.40 4.02 0.00 2.19 2.04 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 2.37 2.46 0.00 59 A 8.16 4.17 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 60 M 8.17 3.74 0.00 1.83 1.31 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.33 0.00 61 M 7.74 4.08 0.00 2.05 2.33 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 2.85 2.58 0.00 62 L 7.77 4.29 0.00 1.89 1.76 1.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 63 E 7.83 4.46 0.00 2.20 2.28 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 2.37 2.65 0.00 64 N 8.57 4.43 0.00 1.73 2.14 0.00 0.00 7.24 7.07 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 65 K 8.46 4.06 0.00 1.77 1.78 0.00 1.67 0.00 0.00 1.84 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.54 7.81 66 E 8.03 3.95 0.00 2.13 2.13 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 2.28 2.35 0.00 67 L 8.01 4.05 0.00 1.79 1.75 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.27 3.55 2.20 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 1.02 0.00 0.00 0.95 0.00 0.00 69 L 7.87 4.03 0.00 1.86 1.68 0.89 0.82 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 70 R 8.46 3.88 0.00 1.99 2.11 0.00 3.15 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 71 I 8.21 3.71 2.06 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 0.99 0.00 0.00 72 L 7.98 4.03 0.00 1.71 1.73 0.93 0.81 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 73 T 7.68 3.86 4.36 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 1.20 0.00 0.00 74 V 7.82 3.61 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 1.10 0.00 0.00 0.91 0.00 0.00 75 R 8.20 3.88 0.00 2.08 2.17 0.00 2.85 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.65 0.00 76 E 7.82 3.96 0.00 2.17 2.11 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 2.30 2.35 0.00 77 N 8.03 4.33 0.00 2.89 2.82 0.00 0.00 7.00 7.60 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 78 L 8.28 3.93 0.00 1.92 1.68 0.86 0.95 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 79 A 8.13 3.95 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 80 E 8.07 3.98 0.00 2.04 2.04 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 2.67 2.50 0.00 81 G 8.22 3.45 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 0.00 82 V 7.95 3.47 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 1.01 0.00 0.00 0.91 0.00 0.00 83 L 7.94 4.32 0.00 1.92 1.69 0.95 1.25 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 84 E 7.83 4.33 0.00 2.47 2.37 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 2.55 2.63 0.00 85 F 8.23 4.43 0.00 3.09 3.10 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 0.00 0.00 0.00 86 L 7.87 4.02 0.00 2.01 1.69 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.29 0.00 2.20 2.10 0.00 3.94 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 88 E 8.31 3.95 0.00 1.97 1.98 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 2.32 1.96 0.00 89 M 8.24 4.41 0.00 2.30 2.38 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.81 0.00 90 V 8.20 3.57 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 0.96 0.00 0.00 0.92 0.00 0.00 91 L 7.73 3.91 0.00 2.03 1.62 0.88 1.27 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 92 S 8.13 4.12 0.00 4.10 4.10 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 0.00 0.00 0.00 93 Q 7.97 4.03 0.00 2.44 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 94 I 7.57 3.80 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 1.50 0.89 0.89 0.00 0.00 95 K 8.24 3.89 0.00 1.94 1.86 0.00 1.66 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.44 7.81 96 Q 8.17 3.90 0.00 2.12 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 97 S 8.05 4.05 0.00 3.96 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 98 N 8.91 4.39 0.00 3.09 2.89 0.00 0.00 7.00 8.21 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 99 G 8.21 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 0.00 0.00 0.00 100 N 8.39 4.28 0.00 2.81 2.79 0.00 0.00 7.13 7.87 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 0.00 101 H 8.32 4.20 0.00 3.18 3.33 0.00 5.63 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 0.00 102 R 7.97 3.93 0.00 2.02 1.99 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 103 R 8.23 3.90 0.00 2.08 1.98 0.00 3.14 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 104 S 7.91 4.13 0.00 4.13 3.94 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 0.00 105 L 7.94 3.94 0.00 1.78 1.89 0.92 0.56 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 0.00 106 L 7.92 4.09 0.00 1.89 1.70 0.92 0.88 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 0.00 107 E 8.49 4.07 0.00 2.01 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 2.34 2.50 0.00 108 R 8.27 4.09 0.00 1.89 1.85 0.00 3.25 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 109 L 7.44 4.63 0.00 1.64 1.73 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.07 4.06 4.42 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 1.27 0.00 0.00 111 Q 8.81 4.01 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.61 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 112 V 8.19 4.08 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