NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 S 4.3856 8.3344 115.4118 58.0805 63.5571 171.8591 6 V 4.3475 7.4881 125.9108 61.0284 35.0832 169.2827 7 V 4.5524 9.0336 123.6062 61.3088 35.5183 173.2710 8 E 5.2791 8.7803 125.8312 55.4315 31.6816 174.6475 9 Y 4.9620 8.8533 122.5517 56.3525 43.0457 172.9461 10 E 4.9406 8.0662 125.9789 54.5838 31.6524 175.2737 11 V 4.4529 7.9080 119.4455 59.5440 35.6621 174.6418 12 V 4.5726 9.6938 123.1227 61.9358 33.5195 175.1003 13 S 4.9747 9.4178 122.9260 57.4112 65.2697 172.5782 14 K 4.8366 9.5530 126.1756 55.8397 36.4449 174.2010 15 N 5.1420 8.4957 123.7974 52.0657 41.0936 173.4397 16 L 4.8657 8.7821 126.9592 52.5432 44.2962 177.9893 17 T 3.8940 8.8790 110.7301 65.1745 68.5442 175.2571 18 S 4.5062 8.2160 115.8856 59.6904 64.5440 174.0152 19 K 4.8764 7.6307 119.7454 53.9675 36.3408 173.9300 20 M 5.2262 8.6886 122.3846 53.7838 35.5878 173.9890 21 S 5.0641 9.3352 122.1044 57.0233 66.4153 172.6188 22 H 5.0162 8.8784 123.9947 54.6440 32.1565 171.5214 23 E 5.4643 9.2249 125.4058 54.6987 32.4226 175.8837 24 L 5.0855 8.9730 121.3818 53.4405 47.0269 174.9474 25 L 4.8697 9.0568 122.4908 53.6270 43.5162 175.2432 26 F 4.7389 9.1978 126.8342 56.0533 41.9097 174.4161 27 S 4.7044 7.9571 121.8228 58.3366 62.5891 174.6682 28 V 3.6840 7.8178 127.3192 66.3440 31.2790 177.4717 29 K 4.0386 7.9506 119.9594 59.4291 32.1581 177.6901 30 K 4.1423 8.0982 116.2405 56.3426 32.3558 177.7076 31 R 4.0229 7.8822 116.8912 56.2859 28.3474 174.9691 32 W 4.8141 6.8113 124.5449 55.8061 34.7196 173.6376 33 F 4.3037 7.3458 121.2335 57.6288 39.0800 175.1948 34 V 4.0933 8.3442 121.4842 61.7721 32.5690 175.6832 35 K 3.8027 8.5761 128.6821 55.0886 32.4127 174.8936 36 P 4.2046 0.0000 0.0000 62.2677 31.8666 176.5788 37 F 4.7492 8.9273 117.2545 59.4544 38.9447 175.9922 38 R 4.2244 7.4580 120.2055 54.9232 33.1252 173.1138 39 H 4.8779 8.4460 122.6574 54.1758 30.3242 173.7731 40 D 4.5918 9.2618 124.4507 52.8327 42.0061 176.9500 41 R 4.0276 8.5299 126.0419 58.7619 30.8897 178.8810 42 Q 3.9592 8.1546 115.4246 58.5747 28.6663 177.6931 43 L 4.5790 7.6910 112.9152 53.3348 43.6998 176.2543 44 G 4.3624 7.9574 106.5215 46.5312 0.0000 173.6631 45 K 5.0199 8.4096 116.8672 54.5646 36.9043 177.3417 46 L 4.9269 8.4440 122.6399 53.5485 45.4197 175.2138 47 H 5.2559 8.3990 116.5723 54.8320 33.0296 172.5216 48 Y 5.2162 9.2723 120.8661 56.3319 41.2036 175.2908 49 K 4.5636 8.9010 121.4003 54.7853 33.7922 174.8061 50 L 4.5331 9.1131 125.6150 52.9255 43.6750 176.3831 51 L 4.4865 8.1491 122.5176 53.4964 42.7945 175.0920 52 P 4.0561 0.0000 0.0000 63.0395 31.7604 176.5761 53 G 3.7112 7.0123 110.2198 46.0639 0.0000 170.3738 54 N 4.9145 7.3330 116.0014 51.6975 42.2263 173.4661 55 Y 4.5158 7.5734 117.9070 56.5461 43.5355 173.8105 56 I 4.5256 8.7064 120.1459 59.4565 41.2682 175.0224 57 K 4.6037 8.2726 128.2611 55.0105 33.2410 175.3349 58 F 4.6251 8.5322 127.5327 56.8682 40.4942 175.3057 59 G 4.3180 8.7174 109.1095 44.3299 0.0000 171.5992 60 L 5.0484 8.5362 125.0508 53.6326 45.1152 174.1651 61 Y 5.1454 8.6312 124.8168 56.2468 40.6108 175.3636 62 V 4.6267 8.6979 123.2375 61.1847 35.2781 174.0688 63 L 4.6212 9.2018 128.8559 53.1563 42.2691 177.3528 64 K 3.8069 8.4868 122.6553 59.9659 32.3412 179.6086 65 N 4.6787 8.1014 115.0757 55.6035 38.7120 175.9209 66 Q 4.4786 8.1872 115.6520 54.6954 29.1671 174.5622 67 D 4.6819 8.4378 117.4079 55.5152 40.6511 171.7462 68 Y 5.0722 8.6685 117.6557 55.4834 41.4202 174.0170 69 A 4.9578 8.9575 128.0246 50.0638 22.5913 174.5229 70 R 4.9235 8.8941 123.1945 54.3683 33.2708 174.3652 71 F 5.5996 9.4408 127.4882 56.5712 42.5773 173.4659 72 E 5.0241 8.7209 124.5778 54.4947 33.7881 174.8971 73 I 4.8234 8.6790 122.0623 59.5845 40.8694 174.4614 74 A 5.2546 8.5043 128.0571 49.7695 22.5980 174.3176 75 W 4.8738 9.2525 130.4437 55.6126 33.2685 174.7434 76 V 4.1617 7.5755 127.3981 61.2890 33.1668 173.6001 77 H 4.8270 8.7424 127.8549 54.4501 32.4635 172.6443 78 V 4.5019 8.1065 126.3637 61.5565 33.4417 174.6646 79 D 4.7628 8.1392 128.7336 52.6584 43.7867 177.5175 80 K 4.0087 8.6340 117.5812 60.0718 32.0744 178.6661 81 D 4.5038 8.0057 114.9058 53.8623 39.3343 176.5927 82 G 3.8251 7.9430 107.4936 46.0826 0.0000 173.3850 83 K 4.4870 7.2848 117.5353 55.2526 33.9531 175.5400 84 I 5.0398 8.2126 125.4358 59.5454 40.7814 174.4584 85 E 4.7969 8.8270 126.5084 54.6126 33.1764 173.8137 86 E 5.3722 8.7672 124.4313 53.8310 33.5999 175.4552 87 R 4.7426 8.3141 120.2053 55.0435 34.8913 174.5547 88 T 4.5234 8.6990 120.6570 63.9360 68.9247 174.7195 89 V 4.4260 8.9239 118.0364 61.1824 33.3966 175.0105 90 Y 4.7338 7.6920 119.1305 57.1856 41.9504 172.5051 91 S 4.7978 7.5465 117.8228 57.3691 65.7063 173.4614 92 I 4.5350 8.7365 126.3098 59.6603 41.6311 173.0514 93 E 4.9489 8.3936 127.9056 55.2172 31.7384 174.8053 94 T 4.0374 8.2978 116.5701 61.4068 71.6627 172.0659 95 Y 5.4546 7.7855 121.1771 57.4820 38.7251 177.6136 96 W 4.6472 9.5993 133.6360 60.9287 30.6623 178.4127 97 H 3.8854 8.6698 113.7170 58.5340 27.9997 177.3777 98 I 3.7622 7.3267 122.1206 64.1263 37.1394 177.4241 99 F 4.0085 7.8219 121.1991 61.7584 39.3085 177.2455 100 I 3.0873 7.2538 117.9770 63.7400 37.4568 177.1507 101 D 4.3705 7.7594 118.4826 56.5888 40.9851 178.0651 102 I 3.6676 7.3954 120.6251 64.0975 36.7099 177.6848 103 E 3.7940 7.1509 117.6318 59.7291 29.2832 178.4025 104 N 4.3985 7.5465 112.5757 54.3263 38.7536 174.7916 105 D 4.3960 7.6890 118.8028 53.9757 41.0891 175.5746 106 L 4.0034 8.7591 127.3180 57.6184 41.6626 178.0885 107 N 4.7816 7.6005 120.4737 51.8705 38.3877 173.6288 108 C 4.2705 7.9549 114.7399 54.7889 32.0008 172.9893 109 P 4.1640 0.0000 0.0000 63.7101 32.1289 176.2330 110 Y 4.4134 8.8473 123.8371 60.6896 38.9225 178.3014 111 V 3.1731 8.0112 119.3964 65.0051 31.1053 178.0711 112 L 3.6452 7.6623 119.6976 57.7529 41.9767 178.3006 113 A 3.8512 7.9932 121.0926 55.1770 18.1986 179.4032 114 K 3.7220 8.7135 118.9645 59.6619 31.9848 178.2620 115 F 4.0818 8.3823 119.7729 61.6909 39.4844 176.5128 116 I 3.8059 7.6694 118.5818 64.7277 36.7067 178.0787 117 E 4.1165 7.5926 118.5559 59.1039 29.5326 177.8045 118 M 4.2434 7.8232 116.5611 54.2811 32.3898 176.4092 119 R 3.2562 6.7806 116.1319 55.3755 29.9675 174.5851 120 P 4.3697 0.0000 0.0000 62.3231 31.8142 176.1253 121 E 4.1914 8.5393 120.3534 55.7376 30.1813 176.0121 122 F 4.4136 8.8425 121.9004 60.7801 39.5033 174.5584 123 H 3.8016 8.3115 124.3209 56.1814 26.1110 174.3053 124 K 4.5595 7.4799 115.3645 55.3261 36.4023 175.8622 125 T 4.5262 8.1369 110.3382 60.4896 70.4788 173.7868 126 A 4.5710 8.0878 125.2463 51.3023 20.8593 176.1403 127 W 4.9031 8.1081 124.6935 56.6340 33.4331 173.9321 128 V 3.8874 6.3979 124.7922 60.8968 32.0549 175.6037 129 E 4.1644 8.4996 126.6092 56.3747 29.8832 177.2171 130 E 4.2260 8.6923 122.9614 55.9934 28.1934 175.7150 131 S 4.9165 8.3371 119.0778 56.2561 64.6022 173.4000 132 N 4.9479 8.3911 119.6286 52.4150 38.6079 174.3363 133 Y 4.0724 7.8382 120.5452 57.8390 39.3559 174.9177 134 S 4.5744 6.8516 119.6388 56.5477 67.1032 173.4366 135 I 4.2429 7.7664 115.5354 59.0740 39.2175 175.6450 136 A 4.1052 8.8961 126.2573 55.6088 18.1509 178.4580 137 E 4.3254 8.0645 112.8426 56.4161 30.3733 176.4842 138 D 4.9162 8.2252 121.0895 51.5671 43.0406 176.8947 139 D 4.4459 8.6514 119.0311 57.2628 38.8844 178.5687 140 I 3.6514 7.4553 120.2978 64.1034 37.0482 178.2372 141 Q 3.9829 8.8034 118.7660 59.2811 28.5872 179.1793 142 M 3.9712 8.1374 119.0227 58.6802 32.3135 178.3432 143 V 3.6120 7.8260 118.3134 66.1362 31.4016 177.5661 144 E 3.8907 8.3869 118.4875 59.3754 29.3817 179.1205 145 S 4.3112 8.3173 114.3138 61.9359 62.7916 176.6762 146 I 3.6985 7.7343 123.2200 63.8510 36.8858 178.0627 147 K 3.5017 8.1382 120.5451 59.6658 31.9680 178.6260 148 R 3.9001 9.0317 119.7514 59.4768 29.8334 177.9361 149 Y 4.1988 8.0390 119.3070 60.6817 38.7222 177.5213 150 L 3.7401 7.9212 118.4905 57.5821 41.9981 178.6755 151 E 4.0749 8.3463 118.5831 59.9353 29.2378 179.5710 152 R 3.8785 7.3848 115.5561 59.3009 30.4150 178.9152 153 K 3.8778 7.5227 117.1376 58.3128 32.0786 176.4962 154 I 4.2046 7.4726 124.0193 61.9425 38.0731 174.8551 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 5 S 8.33 4.39 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 6 V 7.49 4.35 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 0.75 0.00 0.00 0.92 0.00 0.00 7 V 9.03 4.55 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 1.01 0.00 0.00 0.93 0.00 0.00 8 E 8.78 5.28 0.00 1.92 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 2.21 2.17 0.00 9 Y 8.85 4.96 0.00 3.04 2.79 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 10 E 8.07 4.94 0.00 1.86 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.18 0.00 11 V 7.91 4.45 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 0.85 0.00 0.00 1.10 0.00 0.00 12 V 9.69 4.57 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 1.10 0.00 0.00 0.95 0.00 0.00 13 S 9.42 4.97 0.00 3.88 3.68 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 14 K 9.55 4.84 0.00 1.76 1.83 0.00 1.29 0.00 0.00 1.56 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.37 7.81 15 N 8.50 5.14 0.00 3.09 2.93 0.00 0.00 6.78 6.54 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 16 L 8.78 4.87 0.00 1.89 1.58 0.93 0.52 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 17 T 8.88 3.89 4.28 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 1.42 0.00 0.00 18 S 8.22 4.51 0.00 3.93 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 19 K 7.63 4.88 0.00 1.85 1.64 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.26 1.56 7.81 20 M 8.69 5.23 0.00 1.82 1.71 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.33 0.00 21 S 9.34 5.06 0.00 3.79 3.86 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 22 H 8.88 5.02 0.00 3.11 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 E 9.22 5.46 0.00 1.93 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 2.24 2.21 0.00 24 L 8.97 5.09 0.00 2.05 1.87 0.71 0.69 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 25 L 9.06 4.87 0.00 0.39 0.93 0.15 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 26 F 9.20 4.74 0.00 2.92 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 27 S 7.96 4.70 0.00 4.00 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 28 V 7.82 3.68 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 0.81 0.00 0.00 0.67 0.00 0.00 29 K 7.95 4.04 0.00 1.63 1.72 0.00 1.78 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.39 1.43 7.81 30 K 8.10 4.14 0.00 1.83 1.81 0.00 1.90 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.42 7.81 31 R 7.88 4.02 0.00 2.07 2.13 0.00 3.52 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.74 0.00 32 W 6.81 4.81 0.00 3.35 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 33 F 7.35 4.30 0.00 2.72 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 34 V 8.34 4.09 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 0.70 0.00 0.00 0.68 0.00 0.00 35 K 8.58 3.80 0.00 1.75 1.75 0.00 1.97 0.00 0.00 1.83 0.00 0.00 3.38 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.48 1.34 7.81 36 P 0.00 4.20 0.00 2.07 1.46 0.00 2.24 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.25 0.00 37 F 8.93 4.75 0.00 3.15 3.22 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 38 R 7.46 4.22 0.00 0.67 0.72 0.00 2.89 0.00 0.00 2.99 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.23 0.00 39 H 8.45 4.88 0.00 3.21 3.45 0.00 5.55 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 D 9.26 4.59 0.00 2.67 2.76 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 41 R 8.53 4.03 0.00 1.85 1.88 0.00 3.17 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.63 0.00 42 Q 8.15 3.96 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.99 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 43 L 7.69 4.58 0.00 1.58 1.60 0.96 0.74 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 44 G 7.96 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 0.00 0.00 0.00 0.00 45 K 8.41 5.02 0.00 1.54 1.45 0.00 1.60 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.36 7.81 46 L 8.44 4.93 0.00 1.49 1.26 0.93 1.24 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 47 H 8.40 5.26 0.00 2.88 3.59 0.00 5.57 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 9.27 5.22 0.00 3.20 2.79 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 49 K 8.90 4.56 0.00 1.55 1.63 0.00 1.18 0.00 0.00 1.46 0.00 0.00 2.53 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.83 0.52 7.81 50 L 9.11 4.53 0.00 1.43 1.39 0.40 -0.37 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 51 L 8.15 4.49 0.00 1.67 1.64 0.96 1.02 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 52 P 0.00 4.06 0.00 1.91 2.02 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 53 G 7.01 3.71 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 0.00 0.00 0.00 54 N 7.33 4.91 0.00 2.39 1.61 0.00 0.00 6.61 7.48 0.00 0.00 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 Y 7.57 4.52 0.00 2.50 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 56 I 8.71 4.53 1.42 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 1.13 0.51 0.16 0.00 0.00 57 K 8.27 4.60 0.00 1.83 1.65 0.00 1.78 0.00 0.00 1.88 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.41 1.49 7.81 58 F 8.53 4.63 0.00 2.12 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 0.00 0.00 0.00 59 G 8.72 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 60 L 8.54 5.05 0.00 2.15 1.55 -0.07 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.63 5.15 0.00 2.98 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 62 V 8.70 4.63 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.00 -0.03 0.00 0.00 63 L 9.20 4.62 0.00 1.75 1.66 0.79 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.49 3.81 0.00 2.01 1.90 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.29 7.81 65 N 8.10 4.68 0.00 2.74 2.92 0.00 0.00 6.83 7.69 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 66 Q 8.19 4.48 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 67 D 8.44 4.68 0.00 2.95 2.99 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 0.00 0.00 0.00 68 Y 8.67 5.07 0.00 3.26 2.81 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 69 A 8.96 4.96 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 70 R 8.89 4.92 0.00 1.86 1.97 0.00 3.09 0.00 0.00 3.18 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 71 F 9.44 5.60 0.00 3.17 3.01 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 72 E 8.72 5.02 0.00 2.00 1.78 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 2.21 2.41 0.00 73 I 8.68 4.82 1.98 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.81 0.85 0.00 0.00 74 A 8.50 5.25 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 75 W 9.25 4.87 0.00 3.38 2.92 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 76 V 7.58 4.16 1.74 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 0.46 0.00 0.00 0.67 0.00 0.00 77 H 8.74 4.83 0.00 3.50 3.34 0.00 5.78 0.00 0.00 0.00 0.00 6.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.11 4.50 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 0.94 0.00 0.00 0.85 0.00 0.00 79 D 8.14 4.76 0.00 2.60 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.63 4.01 0.00 1.81 1.85 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.42 7.81 81 D 8.01 4.50 0.00 2.76 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 82 G 7.94 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 83 K 7.28 4.49 0.00 2.27 1.76 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.43 7.81 84 I 8.21 5.04 1.92 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.79 0.91 0.00 0.00 85 E 8.83 4.80 0.00 2.00 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 2.26 2.32 0.00 86 E 8.77 5.37 0.00 1.90 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 2.21 2.19 0.00 87 R 8.31 4.74 0.00 1.77 1.79 0.00 3.12 0.00 0.00 3.35 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 88 T 8.70 4.52 4.25 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 1.27 0.00 0.00 89 V 8.92 4.43 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 0.67 0.00 0.00 1.10 0.00 0.00 90 Y 7.69 4.73 0.00 3.05 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 91 S 7.55 4.80 0.00 3.78 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 92 I 8.74 4.54 1.63 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.09 1.18 0.00 0.00 93 E 8.39 4.95 0.00 1.86 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 0.00 2.31 2.29 0.00 94 T 8.30 4.04 4.22 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 1.33 0.00 0.00 95 Y 7.79 5.45 0.00 2.95 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 96 W 9.60 4.65 0.00 3.39 3.41 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 97 H 8.67 3.89 0.00 3.28 3.44 0.00 5.58 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 7.33 3.76 2.10 0.00 0.00 1.00 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 0.51 0.96 0.00 0.00 99 F 7.82 4.01 0.00 3.25 3.32 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 0.00 100 I 7.25 3.09 0.80 0.00 0.00 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 1.11 0.56 0.63 0.00 0.00 101 D 7.76 4.37 0.00 2.83 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 0.00 102 I 7.40 3.67 1.62 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 1.56 0.49 0.88 0.00 0.00 103 E 7.15 3.79 0.00 2.04 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 2.23 2.10 0.00 104 N 7.55 4.40 0.00 2.78 2.83 0.00 0.00 7.08 7.95 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 0.00 105 D 7.69 4.40 0.00 2.78 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.76 4.00 0.00 1.67 1.72 0.91 1.11 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 0.00 107 N 7.60 4.78 0.00 2.70 2.78 0.00 0.00 6.73 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 0.00 108 C 7.95 4.27 0.00 1.75 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.16 0.00 2.01 1.98 0.00 2.58 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 110 Y 8.85 4.41 0.00 3.09 3.13 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 0.00 111 V 8.01 3.17 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 0.55 0.00 0.00 0.53 0.00 0.00 112 L 7.66 3.65 0.00 1.56 1.64 0.45 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 113 A 7.99 3.85 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 0.00 114 K 8.71 3.72 0.00 1.40 1.85 0.00 1.54 0.00 0.00 1.63 0.00 0.00 3.28 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.38 7.81 115 F 8.38 4.08 0.00 3.03 3.20 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 0.00 116 I 7.67 3.81 1.59 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 1.17 0.33 0.00 0.00 117 E 7.59 4.12 0.00 1.87 2.16 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 2.29 2.32 0.00 118 M 7.82 4.24 0.00 1.83 1.81 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.40 0.00 119 R 6.78 3.26 0.00 1.76 1.97 0.00 3.38 0.00 0.00 3.67 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 120 P 0.00 4.37 0.00 2.35 2.08 0.00 3.56 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 121 E 8.54 4.19 0.00 2.08 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 2.43 2.32 0.00 122 F 8.84 4.41 0.00 2.91 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 0.00 123 H 8.31 3.80 0.00 2.50 2.99 0.00 5.70 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.48 4.56 0.00 1.98 1.63 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.50 7.81 125 T 8.14 4.53 4.30 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 1.35 0.00 0.00 126 A 8.09 4.57 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 0.00 127 W 8.11 4.90 0.00 3.22 2.90 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 0.00 128 V 6.40 3.89 1.64 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 0.83 0.00 0.00 0.74 0.00 0.00 129 E 8.50 4.16 0.00 2.11 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 2.42 2.49 0.00 130 E 8.69 4.23 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 2.37 2.38 0.00 131 S 8.34 4.92 0.00 4.13 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 0.00 132 N 8.39 4.95 0.00 2.81 2.89 0.00 0.00 6.02 7.55 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 0.00 133 Y 7.84 4.07 0.00 2.65 2.31 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 0.00 134 S 6.85 4.57 0.00 3.59 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 I 7.77 4.24 2.24 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.80 1.50 0.00 0.00 136 A 8.90 4.11 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 0.00 137 E 8.06 4.33 0.00 2.01 1.93 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 2.35 2.53 0.00 138 D 8.23 4.92 0.00 2.98 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 0.00 139 D 8.65 4.45 0.00 3.13 3.16 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 0.00 140 I 7.46 3.65 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.77 0.88 0.00 0.00 141 Q 8.80 3.98 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 142 M 8.14 3.97 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 143 V 7.83 3.61 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 1.04 0.00 0.00 1.06 0.00 0.00 144 E 8.39 3.89 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 2.49 2.45 0.00 145 S 8.32 4.31 0.00 4.04 4.17 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 0.00 146 I 7.73 3.70 2.03 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.12 0.99 0.00 0.00 147 K 8.14 3.50 0.00 1.45 1.85 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.96 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.06 7.81 148 R 9.03 3.90 0.00 1.84 2.12 0.00 3.16 0.00 0.00 3.12 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 149 Y 8.04 4.20 0.00 3.18 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 0.00 150 L 7.92 3.74 0.00 1.83 1.83 1.19 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 151 E 8.35 4.07 0.00 2.11 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 2.73 2.57 0.00 152 R 7.38 3.88 0.00 1.85 1.92 0.00 3.18 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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