NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3969 8.3001 120.3244 55.3494 33.9487 176.2604 2 A 4.1688 7.8892 118.2385 51.8941 18.7726 175.0645 3 L 4.5065 7.4594 116.8277 51.6446 46.8770 173.3997 4 D 4.3591 8.1603 115.0415 54.6543 38.8475 173.1562 5 A 4.9081 7.7137 118.2901 51.9105 22.4151 177.4022 6 N 4.3395 8.9913 118.5574 53.0072 37.7477 174.6910 7 D 4.8466 8.4395 117.7209 53.7984 39.5341 177.2703 8 L 4.2209 7.9044 120.0922 56.2313 42.0616 176.6470 9 L 4.7511 7.5873 118.9471 52.5268 42.7901 174.6363 10 P 4.4012 0.0000 0.0000 61.6963 32.0785 175.2771 11 P 3.0458 0.0000 0.0000 65.8375 30.5259 178.3085 12 E 3.8681 7.9955 115.8671 58.3309 29.0583 177.8624 13 K 4.3392 7.8121 117.6479 55.8862 33.6730 176.8518 14 A 3.6187 6.9896 120.0233 52.5795 18.1839 176.2356 15 F 5.3431 6.6164 115.9327 55.5358 42.0312 175.6864 16 V 4.2935 8.9163 124.7490 60.3578 32.3184 171.7459 17 P 4.9426 0.0000 0.0000 62.2443 31.7085 175.7545 18 E 4.4710 9.0416 126.6679 55.0821 30.9982 175.4969 19 L 4.6860 8.4884 125.5987 53.5459 43.5865 175.7500 20 A 4.7193 8.9576 126.9116 50.1342 20.8131 174.8129 21 V 4.3289 7.9942 122.0780 63.0100 32.3282 175.2635 22 A 4.9197 8.3921 132.4467 50.5867 21.5711 174.6321 23 D 4.6737 8.5539 114.5810 55.9282 40.6155 177.5832 24 D 4.4716 8.1348 118.5034 56.4925 41.9724 175.2677 25 G 3.3681 7.0959 103.1256 45.8032 0.0000 171.5234 26 V 4.8011 7.7022 119.6760 61.0709 33.9150 174.6861 27 N 5.1530 9.2003 127.1798 51.7245 41.4570 173.2206 28 V 4.4782 8.4177 127.1907 60.3888 33.7035 174.9211 29 R 5.4872 9.3445 127.3126 53.1388 31.2015 172.5963 30 F 5.2917 7.6351 119.3122 55.1405 39.5294 175.7763 31 R 4.1899 9.1993 124.5952 55.9067 30.9276 175.7455 32 I 4.8626 8.1331 124.2860 59.8640 39.1424 175.6157 33 A 4.1650 8.5483 128.4555 52.0674 19.9082 176.7076 34 D 4.7606 8.9606 121.1903 55.7800 40.4002 176.3738 35 G 4.5698 8.3112 124.9230 45.8108 0.0000 169.7232 36 Y 5.3415 7.8886 119.2622 56.6428 41.0398 174.4859 37 Y 5.4177 9.1911 119.6027 56.1139 41.8766 173.8086 38 M 4.8779 9.3209 121.7480 53.8452 35.6980 174.5302 39 Y 4.6180 8.2289 119.7903 56.7691 38.8637 176.7673 40 Q 3.5939 8.8979 126.7398 58.5104 29.2622 177.5127 41 A 4.2039 7.7974 118.3313 52.9310 18.8357 177.2017 42 K 4.4731 8.0695 115.1191 55.4791 33.4385 175.6185 43 I 4.2615 7.7736 119.2809 61.8918 37.8032 175.2534 44 V 4.3101 8.3127 128.5639 61.3442 33.1561 175.1774 45 G 4.5207 8.6124 115.0900 45.1665 0.0000 172.0598 46 K 4.0598 8.2207 123.5307 55.8781 36.3680 174.6672 47 T 5.5434 7.8446 117.0192 59.7488 70.0627 172.2797 48 N 4.1038 8.3047 123.3641 52.3051 39.5938 173.1088 49 P 4.3875 0.0000 0.0000 64.4410 32.4621 177.3425 50 A 4.6535 7.2712 119.7217 51.7078 19.5288 175.3791 51 D 4.5511 7.9855 115.1740 55.0379 40.1055 173.1909 52 L 4.8232 7.4459 113.4208 54.6034 42.4039 177.2284 53 L 4.6763 7.8711 119.7312 53.5269 43.9836 176.2234 54 G 3.9048 9.0060 113.6727 46.9984 0.0000 173.3668 55 Q 4.6011 7.3601 116.8283 53.6909 30.6988 172.0746 56 P 4.4832 0.0000 0.0000 62.9578 31.8626 176.7928 57 S 4.5222 8.8296 123.4476 57.5733 62.9484 174.2565 58 F 4.7078 8.7531 123.3392 57.0525 39.6085 176.2737 59 S 4.3202 8.5866 116.1560 58.6657 63.6273 170.8472 60 K 4.9233 7.9647 129.1251 56.0574 34.5321 174.5792 61 G 4.4907 8.3833 112.0640 46.6905 0.0000 174.9805 62 E 4.9921 9.0433 124.0337 54.0200 33.0846 173.7016 63 E 4.7139 8.6541 121.0886 55.8562 30.7759 175.9048 64 K 4.4966 9.0836 125.9040 54.2626 34.5773 175.0762 65 E 4.5425 8.7554 128.3614 56.6541 30.5397 174.6530 66 D 4.9312 9.1348 124.2532 53.3539 44.6365 174.4058 67 E 4.3332 8.8589 117.3733 56.4007 30.9600 176.6788 68 F 4.8569 9.1265 117.1082 58.7511 40.8186 176.4321 69 F 4.2330 8.8795 115.9072 57.2715 38.8995 175.2257 70 G 3.9735 8.5811 113.2276 43.6948 0.0000 172.7647 71 R 5.4509 7.0713 110.0936 55.5019 32.0875 173.4217 72 Q 4.7032 8.2430 121.5248 54.0465 34.2392 174.0793 73 T 4.5373 8.3527 117.5020 63.8327 69.1177 174.3723 74 V 4.8058 9.0241 119.1391 59.6742 36.4635 173.9212 75 Y 5.4614 8.7648 120.0936 56.8021 40.0300 176.2769 76 H 5.3550 9.0946 118.1851 54.7287 29.8200 172.7080 77 H 4.8795 8.0180 123.9620 56.9367 35.1934 173.2118 78 E 4.4787 8.2951 116.4706 55.0645 31.0245 176.3051 79 A 3.3533 7.8540 125.7993 50.5641 21.8835 174.7212 80 Q 4.4581 7.8795 123.7134 55.0895 32.6803 173.4794 81 V 4.3966 8.4838 126.1675 60.8824 34.5814 173.7461 82 A 4.4899 8.4895 130.2874 50.2761 21.4447 175.6439 83 F 5.1199 8.8435 121.9508 55.0296 40.9560 172.4846 84 P 4.4346 0.0000 0.0000 61.8727 32.7049 175.4486 85 Y 4.7749 7.0854 120.2777 58.1148 38.3200 175.6495 86 A 4.6009 9.1166 123.5261 52.0430 20.1105 177.0432 87 K 4.4568 7.8813 116.0577 54.4875 35.1448 176.8163 88 A 4.5313 8.7165 131.4062 50.5600 17.5686 175.7408 89 V 4.4772 7.5281 112.8456 59.1420 35.9146 176.7564 90 G 3.9527 8.5042 113.0151 45.1852 0.0000 173.0832 91 E 4.7068 7.5348 117.0359 53.4524 32.3962 174.8552 92 P 4.3790 0.0000 0.0000 63.0135 32.3068 175.0541 93 Y 4.9498 7.3628 119.2647 55.2307 41.9234 174.0603 94 K 4.8549 8.4792 121.9372 55.0982 35.0181 174.9008 95 L 5.0196 9.1706 127.6246 53.4049 44.7155 175.1853 96 V 4.4714 8.6799 127.9762 61.3291 33.2355 174.3874 97 L 5.1408 8.4046 127.5323 53.1516 45.4302 175.9486 98 T 4.6803 8.5843 119.2222 62.0417 72.4537 172.5815 99 Y 4.6618 8.6161 125.4857 56.6557 39.4891 174.5446 100 Q 4.7446 8.2995 125.9711 54.4847 32.6182 174.3554 101 G 3.9570 7.4410 111.4599 47.4710 0.0000 171.1308 102 S 4.6972 7.6185 116.5830 57.7124 68.4762 173.0109 103 A 5.0097 8.9836 122.1140 50.1279 21.1532 177.7950 104 E 4.1041 9.0361 120.0371 58.4455 29.6165 177.9904 105 A 4.2082 7.7765 120.4102 52.4690 18.9854 177.8011 106 G 3.9804 8.4399 104.4672 45.2625 0.0000 173.4301 107 V 4.2248 7.6542 118.7524 60.9254 33.0050 174.1074 108 C 5.0706 8.4909 127.0412 57.6025 32.7500 172.2822 109 Y 4.7702 7.9185 123.6032 55.4198 39.3895 173.6955 110 P 4.5606 0.0000 0.0000 62.1312 32.6332 175.3241 111 P 5.4136 0.0000 0.0000 61.4348 29.6300 173.7702 112 V 3.8104 8.3277 125.9484 64.3221 32.8082 173.5585 113 D 5.2814 8.6418 128.2311 52.1538 41.4335 175.9553 114 T 4.4242 8.8861 119.2799 61.6436 72.0585 172.4841 115 E 4.8520 8.4600 125.7702 54.7018 31.3487 175.3915 116 F 4.9637 9.2771 122.8968 55.6533 42.6648 173.9710 117 D 4.9667 8.7012 121.4417 52.7856 42.2655 176.1780 118 I 3.7440 8.3483 128.9481 60.4271 36.9760 176.4464 119 F 4.3110 8.1124 121.2923 55.6351 38.9897 176.7138 120 G 4.0562 8.3496 110.3840 46.8489 0.0000 172.6497 121 N 4.5897 8.2242 120.6762 52.5501 42.8396 174.1625 122 G 4.0115 7.8024 113.3498 44.1543 0.0000 172.4026 123 T 4.9109 6.8842 116.7462 60.4717 70.9516 174.1184 124 Y 4.7453 8.0638 120.8073 56.7341 41.8993 174.5582 125 H 4.8838 8.5234 118.6269 53.2048 33.0272 171.6988 126 P 4.7983 0.0000 0.0000 63.3905 32.1163 177.4629 127 Q 4.4231 8.5678 122.6156 54.9053 27.3790 175.9508 128 T 4.2166 7.6765 117.4026 63.5505 68.7389 175.1379 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 4.40 0.00 2.02 2.19 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 2.54 0.00 2 A 7.89 4.17 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 3 L 7.46 4.51 0.00 1.53 1.45 0.93 1.29 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 4 D 8.16 4.36 0.00 2.91 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 5 A 7.71 4.91 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 6 N 8.99 4.34 0.00 2.86 2.94 0.00 0.00 6.92 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 7 D 8.44 4.85 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 8 L 7.90 4.22 0.00 1.66 1.78 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 9 L 7.59 4.75 0.00 1.58 1.57 0.98 0.68 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 10 P 0.00 4.40 0.00 2.35 2.18 0.00 3.65 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 11 P 0.00 3.05 0.00 1.99 1.72 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 12 E 8.00 3.87 0.00 2.09 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 2.18 2.27 0.00 13 K 7.81 4.34 0.00 1.69 1.65 0.00 1.59 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.25 1.50 7.81 14 A 6.99 3.62 0.19 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 15 F 6.62 5.34 0.00 2.52 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.92 4.29 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 0.94 0.00 0.00 0.94 0.00 0.00 17 P 0.00 4.94 0.00 2.11 2.09 0.00 3.77 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 1.72 1.94 0.00 18 E 9.04 4.47 0.00 2.15 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 2.31 2.49 0.00 19 L 8.49 4.69 0.00 1.66 1.68 0.99 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.96 4.72 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 21 V 7.99 4.33 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 0.95 0.00 0.00 1.15 0.00 0.00 22 A 8.39 4.92 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 23 D 8.55 4.67 0.00 2.67 2.74 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 0.00 0.00 0.00 0.00 24 D 8.13 4.47 0.00 2.77 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 7.10 3.37 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 0.00 26 V 7.70 4.80 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 1.14 0.00 0.00 1.25 0.00 0.00 27 N 9.20 5.15 0.00 2.71 2.56 0.00 0.00 6.40 7.97 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 28 V 8.42 4.48 2.32 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 0.95 0.00 0.00 1.30 0.00 0.00 29 R 9.34 5.49 0.00 1.74 1.76 0.00 3.18 0.00 0.00 3.17 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.40 0.00 30 F 7.64 5.29 0.00 3.02 3.02 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 0.00 0.00 0.00 31 R 9.20 4.19 0.00 1.78 1.95 0.00 3.13 0.00 0.00 3.27 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 32 I 8.13 4.86 2.01 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.50 1.33 0.00 0.00 33 A 8.55 4.16 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 34 D 8.96 4.76 0.00 2.97 2.69 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 35 G 8.31 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.89 5.34 0.00 3.16 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 37 Y 9.19 5.42 0.00 3.07 3.04 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 0.00 0.00 0.00 38 M 9.32 4.88 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.66 0.00 39 Y 8.23 4.62 0.00 2.79 2.69 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 40 Q 8.90 3.59 0.00 1.48 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.73 0.00 0.00 0.00 0.00 0.00 1.46 1.53 0.00 41 A 7.80 4.20 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 42 K 8.07 4.47 0.00 1.64 1.80 0.00 1.94 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.31 1.45 7.81 43 I 7.77 4.26 2.15 0.00 0.00 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 1.45 0.99 1.34 0.00 0.00 44 V 8.31 4.31 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 1.00 0.00 0.00 0.99 0.00 0.00 45 G 8.61 4.52 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 46 K 8.22 4.06 0.00 1.66 1.72 0.00 1.21 0.00 0.00 1.52 0.00 0.00 2.73 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.21 1.24 7.81 47 T 7.84 5.54 4.08 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 1.25 0.00 0.00 48 N 8.30 4.10 0.00 2.86 2.82 0.00 0.00 6.26 7.88 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 49 P 0.00 4.39 0.00 2.08 2.26 0.00 3.59 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.17 0.00 50 A 7.27 4.65 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 51 D 7.99 4.55 0.00 2.78 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 52 L 7.45 4.82 0.00 1.57 1.62 0.93 0.51 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 53 L 7.87 4.68 0.00 1.62 1.53 1.06 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 54 G 9.01 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 55 Q 7.36 4.60 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 7.05 0.00 0.00 0.00 0.00 0.00 2.16 2.36 0.00 56 P 0.00 4.48 0.00 2.20 2.37 0.00 3.80 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 2.22 2.23 0.00 57 S 8.83 4.52 0.00 3.73 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 58 F 8.75 4.71 0.00 2.97 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 59 S 8.59 4.32 0.00 3.70 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 60 K 7.96 4.92 0.00 2.01 1.93 0.00 1.67 0.00 0.00 1.61 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.51 7.81 61 G 8.38 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.04 4.99 0.00 1.99 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 2.25 2.31 0.00 63 E 8.65 4.71 0.00 1.83 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 2.29 2.36 0.00 64 K 9.08 4.50 0.00 1.60 1.56 0.00 0.84 0.00 0.00 1.02 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.20 1.07 7.81 65 E 8.76 4.54 0.00 1.98 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 2.28 2.36 0.00 66 D 9.13 4.93 0.00 2.75 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 67 E 8.86 4.33 0.00 1.65 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 1.99 1.47 0.00 68 F 9.13 4.86 0.00 2.96 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 69 F 8.88 4.23 0.00 3.04 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 70 G 8.58 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 0.00 0.00 0.00 71 R 7.07 5.45 0.00 1.78 2.09 0.00 2.60 0.00 0.00 3.89 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.40 0.00 72 Q 8.24 4.70 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 7.33 0.00 0.00 0.00 0.00 0.00 2.40 2.49 0.00 73 T 8.35 4.54 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 1.26 0.00 0.00 74 V 9.02 4.81 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 0.91 0.00 0.00 0.88 0.00 0.00 75 Y 8.76 5.46 0.00 2.97 2.88 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 76 H 9.09 5.36 0.00 3.31 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.02 4.88 0.00 3.26 3.21 0.00 5.72 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.30 4.48 0.00 1.83 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 2.11 2.19 0.00 79 A 7.85 3.35 0.29 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 80 Q 7.88 4.46 0.00 1.86 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.71 0.00 0.00 0.00 0.00 0.00 2.13 2.35 0.00 81 V 8.48 4.40 1.61 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 -0.04 0.00 0.00 0.86 0.00 0.00 82 A 8.49 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.84 5.12 0.00 2.82 2.82 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 84 P 0.00 4.43 0.00 2.02 2.04 0.00 3.84 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 2.01 1.93 0.00 85 Y 7.09 4.77 0.00 2.84 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 86 A 9.12 4.60 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 87 K 7.88 4.46 0.00 1.71 1.64 0.00 1.66 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.30 1.48 7.81 88 A 8.72 4.53 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 89 V 7.53 4.48 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 0.76 0.00 0.00 0.90 0.00 0.00 90 G 8.50 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 0.00 0.00 0.00 91 E 7.53 4.71 0.00 1.98 1.88 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 2.23 2.21 0.00 92 P 0.00 4.38 0.00 2.03 2.00 0.00 3.71 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 1.98 1.95 0.00 93 Y 7.36 4.95 0.00 3.07 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 94 K 8.48 4.85 0.00 1.84 1.70 0.00 1.56 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.37 7.81 95 L 9.17 5.02 0.00 1.77 1.72 0.87 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.68 4.47 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 0.82 0.00 0.00 0.87 0.00 0.00 97 L 8.40 5.14 0.00 1.68 0.95 1.18 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.58 4.68 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 1.20 0.00 0.00 99 Y 8.62 4.66 0.00 2.82 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 0.00 100 Q 8.30 4.74 0.00 2.17 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.64 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 101 G 7.44 3.96 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 0.00 0.00 0.00 102 S 7.62 4.70 0.00 3.11 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 0.00 103 A 8.98 5.01 0.68 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 0.00 0.00 104 E 9.04 4.10 0.00 2.00 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 2.63 2.45 0.00 105 A 7.78 4.21 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 0.00 106 G 8.44 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 0.00 0.00 0.00 107 V 7.65 4.22 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 1.08 0.00 0.00 0.93 0.00 0.00 108 C 8.49 5.07 0.00 3.01 2.85 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 0.00 0.00 0.00 109 Y 7.92 4.77 0.00 3.30 3.19 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 0.00 110 P 0.00 4.56 0.00 2.18 2.17 0.00 3.99 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 2.12 2.06 0.00 111 P 0.00 5.41 0.00 2.12 2.30 0.00 3.42 0.00 0.00 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 112 V 8.33 3.81 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 1.07 0.00 0.00 1.15 0.00 0.00 113 D 8.64 5.28 0.00 2.71 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 0.00 114 T 8.89 4.42 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 0.92 0.00 0.00 115 E 8.46 4.85 0.00 1.69 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 2.12 2.19 0.00 116 F 9.28 4.96 0.00 2.76 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 0.00 117 D 8.70 4.97 0.00 2.72 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 0.00 118 I 8.35 3.74 1.33 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 1.26 1.05 0.61 0.00 0.00 119 F 8.11 4.31 0.00 3.09 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 0.00 120 G 8.35 4.06 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 0.00 0.00 0.00 121 N 8.22 4.59 0.00 1.91 1.54 0.00 0.00 7.11 7.75 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 0.00 122 G 7.80 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 0.00 0.00 0.00 123 T 6.88 4.91 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 1.20 0.00 0.00 124 Y 8.06 4.75 0.00 2.60 2.39 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 0.00 125 H 8.52 4.88 0.00 3.09 3.21 0.00 5.70 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.80 0.00 2.32 2.34 0.00 3.82 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 2.12 2.15 0.00 127 Q 8.57 4.42 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.99 0.00 0.00 0.00 0.00 0.00 2.42 2.53 0.00 128 T 7.68 4.22 4.27 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 1.23 0.00 0.00