NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2309 8.1744 110.9379 61.4727 70.0250 172.9477 2 D 4.4940 8.5336 122.8818 52.0560 43.0790 173.7300 3 L 5.3221 8.5148 127.6850 54.0691 43.2866 178.0064 4 S 4.1115 8.4212 117.9756 61.2949 62.7368 176.4311 5 A 3.9849 7.9385 124.0297 55.2954 18.4497 179.3833 6 Q 4.0619 8.1962 116.0857 59.0746 28.7538 179.1296 7 K 3.9943 8.5166 119.8437 59.5046 31.8054 179.3198 8 R 3.9220 7.8508 118.4435 59.3999 29.9661 178.6303 9 L 4.0310 8.1115 118.7078 57.6769 41.6405 179.2722 10 A 4.0989 8.5963 120.9963 55.1933 18.3249 179.5673 11 A 4.1330 8.1712 119.3101 55.1143 18.2437 179.4292 12 D 4.3019 7.8269 116.8401 57.3584 41.1843 178.9332 13 V 3.6716 8.0966 118.4180 64.2253 31.6438 176.8969 14 L 4.2278 8.4299 118.4238 54.1004 42.1893 175.6051 15 D 4.3568 7.5883 117.6620 54.7624 39.8226 172.3918 16 V 4.5187 8.1779 116.2602 60.8368 35.5300 174.1806 17 G 3.7839 8.4173 111.7370 45.0813 0.0000 174.7142 18 K 3.7903 8.8715 121.8129 59.6047 32.1463 178.8254 19 N 4.4859 8.1294 113.6661 55.2461 38.5012 175.3795 20 R 4.5598 8.1905 116.8607 56.0062 31.7845 176.3742 21 V 4.3419 7.6381 113.3191 60.4799 32.8057 175.3524 22 W 4.7291 9.8433 135.0000 55.5820 33.3321 173.9908 23 F 5.2816 7.9639 125.4008 55.2234 40.7102 174.8742 24 N 3.1400 8.2891 123.5542 52.9669 39.0136 173.8371 25 P 4.1321 0.0000 0.0000 65.7962 31.5620 176.9956 26 E 4.3656 8.8338 115.0940 57.0286 29.5306 176.8317 27 R 4.6941 7.9489 118.7870 55.3539 31.6241 177.7899 28 Q 3.9913 8.3866 119.8238 58.9521 28.4308 178.4657 29 G 3.5579 7.8697 105.4590 47.8611 0.0000 175.1162 30 D 4.4562 7.8923 121.0257 57.1681 40.9812 178.7592 31 I 3.5106 7.8821 120.2972 64.2158 36.7744 178.3727 32 A 4.0255 8.0916 121.0354 54.7894 18.2264 178.7682 33 D 4.6148 7.7094 115.7537 54.7812 41.1590 176.5324 34 A 4.0008 7.3491 122.8703 52.6707 18.5036 176.4493 35 I 4.1788 8.7210 123.0605 63.5757 39.0170 177.3895 36 T 4.4132 8.1156 110.7315 60.6474 71.3364 175.8471 37 R 3.9599 8.3539 120.2416 59.2985 30.0399 178.8985 38 E 3.9499 8.1470 118.7916 59.3744 29.6704 178.4254 39 D 4.3611 8.0663 119.0213 57.2858 40.8172 179.0076 40 V 3.5851 7.6158 118.3823 65.9701 31.5686 178.3256 41 R 3.9516 8.3821 118.3215 59.0535 29.8492 178.6109 42 E 3.8890 8.1741 119.1027 59.4826 29.7234 179.0611 43 L 4.0710 7.7607 118.1986 57.2771 41.5708 179.7783 44 V 3.8897 7.6045 120.0886 65.6136 31.2876 177.7881 45 D 4.3922 7.8449 117.3592 57.4625 40.7913 178.4463 46 E 4.1489 7.9766 117.7050 57.6267 29.4481 178.3136 47 G 3.9898 8.0119 106.3428 45.1300 0.0000 174.2378 48 A 4.3295 8.1629 122.8407 53.8637 19.2276 177.9338 49 I 5.2944 7.8621 115.9367 59.9238 40.8040 174.9879 50 Q 4.7282 9.7491 123.9836 54.5231 34.0522 173.2950 51 A 5.1861 8.4191 122.1622 50.0504 20.5690 176.8973 52 K 4.1580 9.6157 125.8532 56.2191 33.0999 176.6843 53 D 4.5709 8.5565 125.1531 53.9462 41.5914 176.2535 54 K 4.3876 8.1984 121.1615 55.5693 34.1952 176.5252 55 K 4.2904 8.3319 121.7355 55.9945 33.0974 176.3639 56 G 4.1585 8.1394 110.8876 43.5016 0.0000 172.4002 57 N 4.4617 8.7214 122.1374 53.0776 39.2359 175.3293 58 S 4.3403 8.5049 118.7357 58.9205 63.7215 174.2448 59 R 4.6128 8.4059 120.8571 55.8024 31.3953 177.9734 60 G 3.5954 8.1919 107.0487 48.2260 0.0000 176.4670 61 R 3.9877 8.0118 120.3707 58.4641 29.9529 179.0286 62 A 4.0126 7.8000 120.3639 55.0981 18.5819 179.5355 63 R 3.8695 8.3398 117.0434 59.5553 30.1877 179.0723 64 E 3.9664 8.0889 118.0467 59.5032 29.4686 179.4378 65 R 3.9315 7.7087 117.8355 59.5303 30.0902 178.5404 66 Q 4.0273 8.3710 118.2364 58.8085 28.6834 179.0489 67 K 3.9885 8.0847 119.4226 59.3716 32.1705 179.4095 68 K 4.0009 8.0912 118.6906 59.8839 32.0723 179.6954 69 R 4.9590 8.5195 119.1568 58.6609 29.7050 178.9959 70 A 4.1060 7.9866 120.1617 54.7912 18.4494 178.0685 71 Y 4.3798 7.8678 115.6663 57.7825 38.9316 176.0607 72 G 3.8013 7.9816 106.5443 46.3707 0.0000 173.2206 73 H 4.8801 8.5777 117.4789 54.7196 30.6298 174.3918 74 Q 3.5286 8.6435 115.9906 57.2695 25.7076 174.4837 75 K 4.6502 7.9558 112.5379 56.0633 33.9732 177.3076 76 G 3.8248 8.1891 107.4967 44.5897 0.0000 175.1681 77 A 3.8895 8.8690 122.3138 55.4015 18.1320 180.0765 78 G 3.8404 8.0923 101.2679 47.3082 0.0000 173.9093 79 S 4.6364 8.5835 115.3569 58.1880 64.0628 174.2694 80 R 4.4787 7.6324 119.8085 54.8982 31.0385 176.0361 81 K 4.3722 8.6534 121.6055 56.9018 34.4949 176.5559 82 G 3.9901 7.7457 105.8569 43.6624 0.0000 173.1576 83 K 4.0717 8.2910 120.9391 55.7550 33.3006 177.6327 84 A 4.1159 8.8635 125.1514 55.5148 18.0500 180.4662 85 G 3.6605 8.0776 101.3808 46.5593 0.0000 174.9513 86 A 4.2846 7.7521 122.2193 54.6363 18.8862 179.4641 87 R 4.2341 7.8047 115.6419 57.6488 30.6496 176.8071 88 Q 4.2666 7.9936 120.0473 53.1433 31.7271 173.1503 89 N 4.4533 8.8433 124.6971 53.4846 39.8132 175.1295 90 S 4.1517 8.7063 123.9248 61.6254 63.2712 176.2781 91 K 3.9978 8.0706 123.1268 59.0482 32.0526 178.1407 92 E 4.2667 7.8923 120.7202 58.8092 29.4642 178.3565 93 D 4.3537 8.2446 118.2193 57.0109 41.2469 178.0237 94 W 4.1856 8.5728 129.1489 60.4631 30.5567 177.8931 95 E 3.6895 8.3559 118.7368 59.0045 28.9083 179.2959 96 S 4.0651 7.8104 113.0113 61.3950 62.5633 176.2856 97 R 3.7740 7.9796 120.8108 59.4030 29.9096 178.9437 98 I 3.2013 7.2617 118.5147 63.9899 37.6987 178.1484 99 R 3.8602 7.5437 118.4911 58.8600 29.9033 178.7892 100 A 4.0005 7.6551 120.3117 55.0305 18.3714 179.6738 101 Q 3.9620 8.0997 116.6942 58.8170 28.6849 178.9269 102 R 4.0498 7.8981 119.2902 59.3282 30.1877 178.9731 103 T 3.8856 8.0198 115.6121 66.4548 68.4250 176.2312 104 K 3.8307 7.9483 121.2763 59.8634 32.1130 178.7970 105 L 4.1482 8.1247 118.9111 57.8089 41.4815 179.6032 106 R 4.0877 8.4875 119.1162 59.0898 29.9710 178.4698 107 E 3.9744 8.1881 118.7262 59.3571 29.4085 179.0245 108 L 4.0227 7.9598 119.0462 57.7690 41.5935 179.6903 109 R 4.0669 7.8540 118.5686 59.6894 29.9483 178.4039 110 D 4.5268 7.6418 116.8888 56.7966 40.8753 177.6234 111 E 4.1939 7.9630 117.9169 56.5591 29.8660 176.8238 112 G 4.0903 8.4552 107.1033 46.6257 0.0000 174.9821 113 T 3.9936 7.8861 115.1851 65.7358 68.6235 174.1736 114 L 4.8716 7.4463 119.6425 52.3841 44.9260 176.8080 115 S 4.5952 8.4151 117.2894 57.3546 65.7198 175.2777 116 S 4.1494 8.7276 119.2872 62.2930 62.5162 177.2251 117 S 4.1969 8.0783 117.0034 61.1498 62.9163 176.3438 118 Q 4.0873 7.9796 121.6392 58.6266 28.4199 177.7440 119 Y 4.0751 8.6570 121.0341 60.7141 38.8113 177.9608 120 R 3.8083 8.4828 119.9089 59.7129 30.0499 177.8631 121 D 4.3764 8.0600 117.2193 57.3325 41.0992 178.2932 122 L 4.2004 8.0782 119.5600 57.8737 41.7165 178.5759 123 Y 3.9035 8.4505 119.8836 61.0275 38.1290 178.1798 124 D 4.4837 8.6128 119.8919 57.1873 40.8754 178.9561 125 K 3.9265 7.8749 119.2241 59.0203 32.0313 179.2372 126 A 4.1048 8.4570 121.6575 55.1906 18.1749 179.9549 127 G 4.0327 7.9261 102.6699 46.9616 0.0000 174.9907 128 G 3.9671 7.3470 105.3312 43.5463 0.0000 173.5412 129 G 3.9916 8.5239 108.2557 46.6857 0.0000 175.5279 130 E 3.7517 7.9054 120.5981 57.3141 29.8603 177.6091 131 F 5.1726 7.2660 116.9123 55.4236 41.0390 175.4078 132 D 4.5407 9.0713 126.3670 57.2905 41.2404 175.9398 133 S 4.5352 7.4532 111.2633 56.5253 65.5619 175.0292 134 V 3.4684 8.4844 118.2536 66.3863 31.2294 177.8793 135 A 4.4919 7.9281 121.3586 54.8146 17.9138 178.8900 136 D 4.4719 7.9757 115.9126 57.2408 41.1161 178.4188 137 L 3.2107 7.6116 120.5000 57.7617 42.1131 178.6061 138 E 3.8802 8.3596 118.8986 59.6501 29.2286 179.4125 139 R 3.9501 8.1842 116.9226 59.5490 30.1675 178.2683 140 Y 4.2279 7.6901 118.7324 60.9214 38.6948 177.8678 141 I 3.6463 7.7919 119.4640 64.1348 37.4429 176.8815 142 D 4.5473 8.0167 119.2939 54.9112 41.3699 176.2620 143 A 3.8974 7.2949 127.6248 52.7462 19.3287 177.7054 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 T 8.17 4.23 4.23 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 1.19 0.00 0.00 2 D 8.53 4.49 0.00 2.68 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 3 L 8.51 5.32 0.00 1.92 1.85 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.42 4.11 0.00 4.07 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 5 A 7.94 3.98 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 6 Q 8.20 4.06 0.00 2.43 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 7 K 8.52 3.99 0.00 1.96 1.74 0.00 1.17 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.39 1.38 7.81 8 R 7.85 3.92 0.00 1.92 2.14 0.00 3.10 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 1.64 1.68 0.00 9 L 8.11 4.03 0.00 1.93 1.73 0.94 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.60 4.10 1.63 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 0.00 0.00 0.00 0.00 0.00 0.00 11 A 8.17 4.13 1.49 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 12 D 7.83 4.30 0.00 2.73 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 13 V 8.10 3.67 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 0.86 0.00 0.00 0.96 0.00 0.00 14 L 8.43 4.23 0.00 1.76 1.79 1.03 1.13 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 15 D 7.59 4.36 0.00 2.74 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 16 V 8.18 4.52 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 0.81 0.00 0.00 1.03 0.00 0.00 17 G 8.42 3.78 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 0.00 0.00 0.00 18 K 8.87 3.79 0.00 1.80 1.84 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.48 7.81 19 N 8.13 4.49 0.00 2.70 2.87 0.00 0.00 6.79 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 20 R 8.19 4.56 0.00 1.88 1.95 0.00 3.12 0.00 0.00 3.17 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 21 V 7.64 4.34 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 0.67 0.00 0.00 0.58 0.00 0.00 22 W 9.84 4.73 0.00 3.30 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 23 F 7.96 5.28 0.00 2.61 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 24 N 8.29 3.14 0.00 2.75 2.56 0.00 0.00 6.76 7.99 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 25 P 0.00 4.13 0.00 2.07 2.08 0.00 3.70 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 26 E 8.83 4.37 0.00 2.03 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 2.35 2.30 0.00 27 R 7.95 4.69 0.00 1.72 1.77 0.00 3.14 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 28 Q 8.39 3.99 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.41 2.57 0.00 29 G 7.87 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 0.00 0.00 0.00 30 D 7.89 4.46 0.00 2.74 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 31 I 7.88 3.51 1.60 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.54 0.19 0.00 0.00 32 A 8.09 4.03 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 33 D 7.71 4.61 0.00 2.79 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 34 A 7.35 4.00 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 35 I 8.72 4.18 1.86 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 1.63 0.93 0.91 0.00 0.00 36 T 8.12 4.41 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 37 R 8.35 3.96 0.00 1.88 2.03 0.00 3.14 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 38 E 8.15 3.95 0.00 2.07 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 2.37 2.46 0.00 39 D 8.07 4.36 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 40 V 7.62 3.59 2.25 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 1.07 0.00 0.00 1.00 0.00 0.00 41 R 8.38 3.95 0.00 2.01 1.97 0.00 3.19 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.89 0.00 42 E 8.17 3.89 0.00 2.25 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 2.30 2.35 0.00 43 L 7.76 4.07 0.00 1.80 1.63 0.78 1.04 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 44 V 7.60 3.89 2.33 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 1.27 0.00 0.00 1.02 0.00 0.00 45 D 7.84 4.39 0.00 2.87 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 46 E 7.98 4.15 0.00 2.13 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 2.35 2.51 0.00 47 G 8.01 3.99 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 0.00 0.00 0.00 48 A 8.16 4.33 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 49 I 7.86 5.29 1.96 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.08 1.23 0.00 0.00 50 Q 9.75 4.73 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.78 0.00 0.00 0.00 0.00 0.00 2.38 2.69 0.00 51 A 8.42 5.19 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 52 K 9.62 4.16 0.00 1.81 1.73 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.43 7.81 53 D 8.56 4.57 0.00 2.69 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 54 K 8.20 4.39 0.00 1.86 1.80 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.41 7.81 55 K 8.33 4.29 0.00 1.73 1.74 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.22 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.43 7.81 56 G 8.14 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 57 N 8.72 4.46 0.00 2.71 2.77 0.00 0.00 7.12 7.57 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 58 S 8.50 4.34 0.00 3.86 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 59 R 8.41 4.61 0.00 1.82 1.87 0.00 3.13 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 60 G 8.19 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 0.00 0.00 0.00 61 R 8.01 3.99 0.00 1.87 2.00 0.00 3.13 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 62 A 7.80 4.01 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 63 R 8.34 3.87 0.00 2.00 2.00 0.00 3.22 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 64 E 8.09 3.97 0.00 2.04 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 2.32 2.32 0.00 65 R 7.71 3.93 0.00 1.91 2.14 0.00 3.11 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 1.64 1.89 0.00 66 Q 8.37 4.03 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 67 K 8.08 3.99 0.00 2.00 1.85 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.69 7.81 68 K 8.09 4.00 0.00 1.98 1.96 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.67 1.67 7.81 69 R 8.52 4.96 0.00 1.96 2.00 0.00 3.15 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.61 0.00 70 A 7.99 4.11 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 71 Y 7.87 4.38 0.00 2.97 3.06 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 72 G 7.98 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 73 H 8.58 4.88 0.00 3.30 3.25 0.00 5.77 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.64 3.53 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.52 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 75 K 7.96 4.65 0.00 1.69 1.74 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.67 7.81 76 G 8.19 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 77 A 8.87 3.89 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 78 G 8.09 3.84 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 0.00 0.00 0.00 79 S 8.58 4.64 0.00 3.94 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 80 R 7.63 4.48 0.00 1.81 1.85 0.00 3.10 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 81 K 8.65 4.37 0.00 1.65 1.77 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.45 7.81 82 G 7.75 3.99 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 0.00 0.00 0.00 83 K 8.29 4.07 0.00 1.84 1.69 0.00 1.63 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.50 7.81 84 A 8.86 4.12 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 85 G 8.08 3.66 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 0.00 0.00 0.00 86 A 7.75 4.28 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 87 R 7.80 4.23 0.00 1.94 2.01 0.00 3.29 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 88 Q 7.99 4.27 0.00 2.04 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 89 N 8.84 4.45 0.00 2.84 2.72 0.00 0.00 6.91 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 90 S 8.71 4.15 0.00 4.11 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 0.00 91 K 8.07 4.00 0.00 1.87 1.90 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.64 1.57 7.81 92 E 7.89 4.27 0.00 2.19 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 2.32 2.20 0.00 93 D 8.24 4.35 0.00 2.99 2.87 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 0.00 0.00 0.00 94 W 8.57 4.19 0.00 3.46 3.30 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 95 E 8.36 3.69 0.00 2.20 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 2.73 0.00 96 S 7.81 4.07 0.00 4.00 3.99 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 97 R 7.98 3.77 0.00 1.87 1.84 0.00 3.29 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 98 I 7.26 3.20 0.56 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.42 0.77 0.31 0.00 0.00 99 R 7.54 3.86 0.00 1.84 1.89 0.00 3.19 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 100 A 7.66 4.00 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 0.00 101 Q 8.10 3.96 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 102 R 7.90 4.05 0.00 1.87 2.11 0.00 3.00 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.53 0.00 103 T 8.02 3.89 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 1.22 0.00 0.00 104 K 7.95 3.83 0.00 2.00 2.01 0.00 1.52 0.00 0.00 1.63 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.52 7.81 105 L 8.12 4.15 0.00 2.06 1.89 0.88 0.61 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 0.00 106 R 8.49 4.09 0.00 2.21 2.07 0.00 3.11 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.68 0.00 107 E 8.19 3.97 0.00 2.22 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 2.33 2.65 0.00 108 L 7.96 4.02 0.00 1.78 1.77 0.93 0.89 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 0.00 109 R 7.85 4.07 0.00 1.80 1.83 0.00 2.62 0.00 0.00 2.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.48 0.00 110 D 7.64 4.53 0.00 2.64 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 0.00 111 E 7.96 4.19 0.00 1.99 2.29 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 2.31 2.31 0.00 112 G 8.46 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 0.00 113 T 7.89 3.99 4.39 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 1.22 0.00 0.00 114 L 7.45 4.87 0.00 1.65 1.64 1.05 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 115 S 8.42 4.60 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.73 4.15 0.00 4.06 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 0.00 117 S 8.08 4.20 0.00 4.11 4.20 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 0.00 118 Q 7.98 4.09 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.41 0.00 119 Y 8.66 4.08 0.00 3.04 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 0.00 120 R 8.48 3.81 0.00 2.21 2.13 0.00 3.26 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 121 D 8.06 4.38 0.00 2.96 2.87 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 0.00 0.00 0.00 122 L 8.08 4.20 0.00 1.93 1.75 0.98 1.11 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 0.00 123 Y 8.45 3.90 0.00 2.39 2.80 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 0.00 124 D 8.61 4.48 0.00 2.91 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 0.00 125 K 7.87 3.93 0.00 1.95 1.45 0.00 1.78 0.00 0.00 1.53 0.00 0.00 2.97 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.37 1.66 7.81 126 A 8.46 4.10 1.45 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 0.00 127 G 7.93 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 0.00 128 G 7.35 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 0.00 129 G 8.52 3.99 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 0.00 0.00 0.00 130 E 7.91 3.75 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 2.11 1.97 0.00 131 F 7.27 5.17 0.00 3.17 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 0.00 132 D 9.07 4.54 0.00 2.74 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 0.00 133 S 7.45 4.54 0.00 3.96 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 0.00 134 V 8.48 3.47 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 1.07 0.00 0.00 0.89 0.00 0.00 135 A 7.93 4.49 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 0.00 136 D 7.98 4.47 0.00 2.88 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 0.00 137 L 7.61 3.21 0.00 1.46 1.59 -0.23 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.36 3.88 0.00 2.13 1.96 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 2.29 2.53 0.00 139 R 8.18 3.95 0.00 1.93 2.06 0.00 3.20 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 140 Y 7.69 4.23 0.00 3.24 3.06 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 0.00 141 I 7.79 3.65 1.98 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 1.55 0.83 0.89 0.00 0.00 142 D 8.02 4.55 0.00 2.79 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 0.00 143 A 7.29 3.90 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